#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ayq s LYS 2 N 0.00 3.62 -0.22 0.03 3.01 -1.26 -1.97 119.74 122.95 2ayq s LYS 2 Ca 0.00 -0.00 -0.14 0.00 -1.01 0.00 0.00 55.97 54.82 2ayq s LYS 2 Cb 0.00 -3.10 0.07 0.00 -1.01 0.00 0.00 37.83 33.78 2ayq s LYS 2 CO 0.00 0.66 0.55 0.00 0.51 0.00 0.00 175.35 177.07 2ayq s MET 3 N -1.59 0.57 -0.35 1.68 0.00 -0.84 -5.00 119.30 113.77 2ayq s MET 3 Ca 0.26 0.96 -0.11 0.00 0.00 0.00 0.00 55.69 56.80 2ayq s MET 3 Cb -0.13 0.11 0.01 0.00 0.00 0.00 0.00 34.83 34.82 2ayq s MET 3 CO 0.14 -0.14 0.20 0.15 0.00 0.00 0.00 175.02 175.37 2ayq s LYS 4 N 1.28 3.03 -0.21 3.16 1.02 -1.26 -0.34 119.74 126.41 2ayq s LYS 4 Ca -0.08 -0.94 -0.08 0.00 0.02 0.00 0.00 55.97 54.89 2ayq s LYS 4 Cb -0.06 -3.69 -0.04 0.00 -0.52 0.00 0.00 37.83 33.52 2ayq s LYS 4 CO -0.13 -0.60 0.08 -0.51 -0.92 0.00 0.00 175.35 173.28 2ayq s LEU 5 N 1.59 3.75 -0.25 3.17 1.43 0.12 -0.05 118.68 128.44 2ayq s LEU 5 Ca 0.03 -0.00 -0.27 0.00 -1.03 0.00 0.00 54.13 52.86 2ayq s LEU 5 Cb -0.18 -1.98 0.00 0.00 0.03 0.00 0.00 46.19 44.06 2ayq s LEU 5 CO 0.07 0.09 0.93 0.00 0.23 0.00 0.00 176.35 177.66 2ayq s ALA 6 N 0.89 3.64 -0.21 4.21 0.00 -0.60 -2.54 121.76 127.14 2ayq s ALA 6 Ca 0.04 -0.04 -0.05 0.00 0.00 0.00 0.00 51.96 51.91 2ayq s ALA 6 Cb -0.14 -3.42 -0.02 0.00 0.00 0.00 0.00 23.12 19.54 2ayq s ALA 6 CO 0.03 -1.06 0.01 0.08 0.00 0.00 0.00 175.76 174.81 2ayq s VAL 7 N 3.07 3.93 -0.44 0.00 1.01 -0.51 -0.25 120.40 127.22 2ayq s VAL 7 Ca 0.39 -0.31 0.02 0.00 0.00 0.00 0.00 61.98 62.08 2ayq s VAL 7 Cb -0.15 -2.79 0.13 0.00 0.00 0.00 0.00 36.38 33.57 2ayq s VAL 7 CO 0.08 0.41 0.22 -0.76 0.00 0.00 0.00 175.10 175.05 2ayq s LEU 8 N 1.18 3.18 0.04 3.92 1.02 0.27 -1.46 118.68 126.83 2ayq s LEU 8 Ca 0.03 -2.58 -0.18 0.00 0.02 0.00 0.00 54.13 51.42 2ayq s LEU 8 Cb -0.14 -1.20 -0.09 0.00 0.02 0.00 0.00 46.19 44.78 2ayq s LEU 8 CO 0.01 -0.28 1.27 1.55 0.02 0.00 0.00 176.35 178.92 2ayq h PRO 9 N 6.87 -0.49 0.00 1.29 0.13 -1.81 -1.00 132.00 136.99 2ayq h PRO 9 Ca -0.04 0.03 0.00 0.00 -0.87 0.00 0.00 66.00 65.12 2ayq h PRO 9 Cb 0.93 0.11 0.00 0.00 0.13 0.00 0.00 31.00 32.18 2ayq h PRO 9 CO 0.53 -0.33 0.00 0.41 -0.23 0.00 0.00 178.00 178.38 2ayq n GLY 10 N -1.28 0.75 3.63 1.56 0.00 -1.26 -2.09 105.19 106.50 2ayq n GLY 10 Ca -0.06 -1.61 -0.28 0.00 0.00 0.00 0.00 46.02 44.07 2ayq n GLY 10 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2ayq s ASP 11 N -4.00 3.69 1.58 1.61 1.01 0.11 -4.70 116.67 115.97 2ayq s ASP 11 Ca 0.00 -1.47 0.00 0.00 0.71 0.00 0.00 52.55 51.79 2ayq s ASP 11 Cb 0.00 -0.04 0.00 0.00 1.01 0.00 0.00 42.92 43.89 2ayq s ASP 11 CO 0.00 -0.62 0.00 0.61 0.21 0.00 0.00 175.17 175.37 2ayq n GLY 12 N -1.01 3.35 0.00 0.21 0.00 -1.26 -1.06 105.19 105.42 2ayq n GLY 12 Ca -0.09 -0.14 0.08 0.00 0.00 0.00 0.00 46.02 45.87 2ayq n GLY 12 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2ayq n ILE 13 N 0.00 0.68 -0.23 -0.61 -5.35 0.38 -4.09 119.36 110.13 2ayq n ILE 13 Ca 0.00 0.17 -0.06 0.00 -0.27 0.00 0.00 62.75 62.59 2ayq n ILE 13 Cb 0.00 -0.89 -0.05 0.00 -1.74 0.00 0.00 39.64 36.95 2ayq n ILE 13 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2ayq n GLY 14 N 0.15 -2.60 0.18 3.28 0.00 -0.23 -1.46 105.19 104.51 2ayq n GLY 14 Ca 0.06 0.87 -0.05 0.00 0.00 0.00 0.00 46.02 46.91 2ayq n GLY 14 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2ayq h PRO 15 N 0.00 0.32 0.02 1.61 0.13 -1.75 -1.31 132.00 131.01 2ayq h PRO 15 Ca 0.09 -0.02 0.01 0.00 -0.87 0.00 0.00 66.00 65.21 2ayq h PRO 15 Cb 0.23 -0.07 -0.03 0.00 0.13 0.00 0.00 31.00 31.25 2ayq h PRO 15 CO -0.52 0.21 -0.34 0.93 -0.23 0.00 0.00 178.00 178.05 2ayq h GLU 16 N 0.33 -0.43 0.00 0.86 5.08 -1.55 0.31 114.58 119.17 2ayq h GLU 16 Ca 0.20 0.03 -0.00 0.00 -1.00 0.00 0.00 59.36 58.58 2ayq h GLU 16 Cb 0.18 0.10 -0.00 0.00 0.50 0.00 0.00 28.75 29.52 2ayq h GLU 16 CO -0.19 -0.28 -0.02 -0.39 -1.00 0.00 0.00 179.01 177.12 2ayq h VAL 17 N -0.44 0.67 -0.14 3.13 -1.51 -1.19 -2.19 116.25 114.58 2ayq h VAL 17 Ca 0.00 -0.07 -0.07 0.00 -1.23 0.00 0.00 66.70 65.34 2ayq h VAL 17 Cb 0.47 1.04 -0.00 0.00 -2.13 0.00 0.00 31.29 30.67 2ayq h VAL 17 CO -0.22 0.02 -0.18 -0.03 -1.23 0.00 0.00 177.57 175.93 2ayq h MET 18 N 0.00 0.36 -0.21 5.19 -1.53 -0.06 -1.62 114.93 117.07 2ayq h MET 18 Ca -0.00 -0.21 0.03 0.00 -3.44 0.00 0.00 59.70 56.08 2ayq h MET 18 Cb 0.04 0.01 -0.03 0.00 -0.55 0.00 0.00 31.60 31.08 2ayq h MET 18 CO 0.00 0.78 0.03 -0.44 0.14 0.00 0.00 176.91 177.42 2ayq h ASP 19 N -0.02 -0.01 -0.45 1.39 3.32 -0.38 0.17 116.42 120.43 2ayq h ASP 19 Ca 0.02 0.04 0.09 0.00 0.02 0.00 0.00 57.03 57.19 2ayq h ASP 19 Cb 0.73 0.05 -0.08 0.00 0.22 0.00 0.00 39.33 40.25 2ayq h ASP 19 CO 0.04 0.02 -0.07 0.00 -1.72 0.00 0.00 179.24 177.52 2ayq h ALA 20 N 1.16 0.35 0.08 3.45 0.00 -1.41 -0.51 119.26 122.38 2ayq h ALA 20 Ca 0.10 0.16 -0.00 0.00 0.00 0.00 0.00 54.91 55.16 2ayq h ALA 20 Cb 0.10 0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.19 2ayq h ALA 20 CO -0.14 -0.43 -0.04 0.00 0.00 0.00 0.00 179.25 178.65 2ayq h ALA 21 N 1.43 -0.11 -0.60 0.00 0.00 -0.49 -2.49 119.26 117.01 2ayq h ALA 21 Ca 0.22 -0.07 0.09 0.00 0.00 0.00 0.00 54.91 55.15 2ayq h ALA 21 Cb 0.34 0.04 -0.07 0.00 0.00 0.00 0.00 17.79 18.10 2ayq h ALA 21 CO -0.43 -0.51 0.22 0.82 0.00 0.00 0.00 179.25 179.35 2ayq h ILE 22 N -0.21 0.77 0.16 0.00 2.04 -0.12 0.25 117.51 120.40 2ayq h ILE 22 Ca -0.01 -0.14 0.01 0.00 1.00 0.00 0.00 64.86 65.73 2ayq h ILE 22 Cb 0.17 0.34 -0.04 0.00 -0.74 0.00 0.00 36.82 36.55 2ayq h ILE 22 CO 0.02 0.07 -0.44 0.03 0.00 0.00 0.00 178.15 177.83 2ayq h ARG 23 N 0.39 -0.67 -0.59 2.37 3.08 -0.90 0.56 114.38 118.61 2ayq h ARG 23 Ca 0.30 0.05 0.08 0.00 0.07 0.00 0.00 59.98 60.48 2ayq h ARG 23 Cb 0.37 0.15 -0.06 0.00 0.08 0.00 0.00 29.97 30.51 2ayq h ARG 23 CO -0.31 -0.45 0.25 0.28 -1.07 0.00 0.00 179.97 178.68 2ayq h VAL 24 N -0.70 0.83 -0.04 2.04 2.07 -0.94 -1.80 116.25 117.71 2ayq h VAL 24 Ca 0.01 -0.16 0.02 0.00 0.82 0.00 0.00 66.70 67.40 2ayq h VAL 24 Cb 0.71 0.33 -0.03 0.00 -1.52 0.00 0.00 31.29 30.78 2ayq h VAL 24 CO -0.23 0.08 -0.09 0.25 0.02 0.00 0.00 177.57 177.60 2ayq h LEU 25 N 0.46 -0.28 0.09 2.57 5.85 0.48 -2.60 115.31 121.88 2ayq h LEU 25 Ca 0.29 0.05 0.02 0.00 0.84 0.00 0.00 57.88 59.08 2ayq h LEU 25 Cb 0.31 0.13 -0.04 0.00 0.37 0.00 0.00 40.66 41.43 2ayq h LEU 25 CO -0.26 -0.13 -0.30 0.11 -0.34 0.00 0.00 178.44 177.51 2ayq h LYS 26 N -0.14 -0.49 -0.11 1.25 1.57 0.88 -2.22 116.57 117.31 2ayq h LYS 26 Ca 0.05 0.03 0.05 0.00 -1.87 0.00 0.00 60.65 58.91 2ayq h LYS 26 Cb 0.21 0.11 -0.06 0.00 0.08 0.00 0.00 32.23 32.57 2ayq h LYS 26 CO -0.13 -0.33 -0.31 1.79 -0.57 0.00 0.00 179.45 179.91 2ayq h THR 27 N -0.51 0.30 -0.64 -0.16 1.35 -1.25 -0.22 112.91 111.77 2ayq h THR 27 Ca 0.04 0.00 0.13 0.00 -0.55 0.00 0.00 66.41 66.03 2ayq h THR 27 Cb 0.55 0.30 -0.10 0.00 -1.73 0.00 0.00 68.15 67.17 2ayq h THR 27 CO -0.19 0.00 0.11 0.58 -0.25 0.00 0.00 175.52 175.77 2ayq h VAL 28 N -0.40 0.57 -0.39 6.82 2.07 -1.25 -0.44 116.25 123.23 2ayq h VAL 28 Ca 0.09 -0.08 -0.06 0.00 0.82 0.00 0.00 66.70 67.47 2ayq h VAL 28 Cb 0.54 0.32 -0.01 0.00 -1.52 0.00 0.00 31.29 30.62 2ayq h VAL 28 CO -0.34 0.04 0.00 -0.07 0.02 0.00 0.00 177.57 177.23 2ayq h LEU 29 N 0.23 0.67 -0.61 2.57 3.38 -0.84 -3.04 115.31 117.67 2ayq h LEU 29 Ca 0.35 -0.31 0.10 0.00 0.09 0.00 0.00 57.88 58.11 2ayq h LEU 29 Cb 0.55 -0.18 -0.07 0.00 0.09 0.00 0.00 40.66 41.05 2ayq h LEU 29 CO -0.46 0.81 0.22 -0.78 0.09 0.00 0.00 178.44 178.32 2ayq h ASP 30 N 0.51 0.20 0.01 -0.43 3.58 0.51 -1.11 116.42 119.69 2ayq h ASP 30 Ca 0.11 0.08 0.00 0.00 0.42 0.00 0.00 57.03 57.64 2ayq h ASP 30 Cb 0.47 0.07 0.00 0.00 1.72 0.00 0.00 39.33 41.59 2ayq h ASP 30 CO 0.02 0.12 0.00 0.59 -2.88 0.00 0.00 179.24 177.09 2ayq n ASN 31 N -5.01 0.00 -0.36 2.28 4.13 -0.52 -1.95 115.26 113.82 2ayq n ASN 31 Ca 0.09 0.28 0.03 0.00 1.68 0.00 0.00 54.58 56.65 2ayq n ASN 31 Cb 0.29 -0.28 0.04 0.00 -1.54 0.00 0.00 39.78 38.28 2ayq n ASN 31 CO 0.00 0.00 0.00 0.47 0.28 0.00 0.00 177.26 178.01 2ayq n ASP 32 N -1.28 0.63 -0.12 6.41 8.00 -0.47 -5.02 116.55 124.71 2ayq n ASP 32 Ca 0.00 -2.25 -0.02 0.00 0.71 0.00 0.00 54.79 53.24 2ayq n ASP 32 Cb 0.00 -0.25 -0.01 0.00 -0.02 0.00 0.00 41.12 40.85 2ayq n ASP 32 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2ayq n GLY 33 N -0.38 0.36 3.77 0.44 0.00 -0.82 -5.00 105.19 103.56 2ayq n GLY 33 Ca 0.04 -0.06 -0.38 0.00 0.00 0.00 0.00 46.02 45.62 2ayq n GLY 33 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2ayq s HIS 34 N -1.57 3.23 -0.19 1.61 3.76 -0.91 -5.01 115.29 116.21 2ayq s HIS 34 Ca 0.00 1.62 -0.01 0.00 -0.15 0.00 0.00 55.06 56.52 2ayq s HIS 34 Cb 0.00 -3.24 0.01 0.00 1.11 0.00 0.00 32.58 30.46 2ayq s HIS 34 CO 0.00 -0.86 -0.13 -2.00 -0.85 0.00 0.00 174.74 170.90 2ayq s GLU 35 N -2.30 3.18 0.10 1.40 2.12 -0.83 -4.47 118.70 117.89 2ayq s GLU 35 Ca 0.56 -0.74 0.08 0.00 0.36 0.00 0.00 54.97 55.23 2ayq s GLU 35 Cb -0.26 -2.74 -0.03 0.00 0.26 0.00 0.00 34.13 31.35 2ayq s GLU 35 CO 0.33 -0.16 -0.21 0.00 -0.54 0.00 0.00 175.26 174.69 2ayq s ALA 36 N 1.26 1.78 -0.09 6.30 0.00 -1.26 -1.98 121.76 127.76 2ayq s ALA 36 Ca 0.03 -1.23 0.04 0.00 0.00 0.00 0.00 51.96 50.81 2ayq s ALA 36 Cb -0.14 -0.24 -0.00 0.00 0.00 0.00 0.00 23.12 22.73 2ayq s ALA 36 CO -0.07 0.35 -0.24 0.08 0.00 0.00 0.00 175.76 175.89 2ayq s VAL 37 N -1.15 2.13 -0.27 0.00 1.01 0.53 -4.96 120.40 117.68 2ayq s VAL 37 Ca 0.06 -1.01 0.02 0.00 0.00 0.00 0.00 61.98 61.05 2ayq s VAL 37 Cb -0.10 -1.80 0.06 0.00 0.00 0.00 0.00 36.38 34.54 2ayq s VAL 37 CO 0.04 0.56 -0.07 -0.36 0.00 0.00 0.00 175.10 175.27 2ayq s PHE 38 N 0.19 3.30 -0.26 5.22 0.40 -1.26 0.15 117.98 125.72 2ayq s PHE 38 Ca -0.14 -2.26 -0.09 0.00 -0.60 0.00 0.00 56.93 53.84 2ayq s PHE 38 Cb -0.17 -2.04 -0.04 0.00 0.51 0.00 0.00 43.02 41.29 2ayq s PHE 38 CO 0.07 -0.87 0.12 -1.21 0.70 0.00 0.00 175.22 174.03 2ayq s GLU 39 N 1.13 3.80 -0.09 0.44 2.02 -1.05 -4.95 118.70 120.00 2ayq s GLU 39 Ca -0.07 -0.40 -0.21 0.00 0.02 0.00 0.00 54.97 54.31 2ayq s GLU 39 Cb -0.20 -3.45 -0.04 0.00 0.10 0.00 0.00 34.13 30.54 2ayq s GLU 39 CO -0.04 -0.15 0.60 -0.80 0.02 0.00 0.00 175.26 174.89 2ayq s ASN 40 N 1.57 6.85 0.24 -0.19 -0.87 -1.26 -1.42 114.94 119.86 2ayq s ASN 40 Ca 0.06 1.02 0.08 0.00 -1.57 0.00 0.00 52.86 52.46 2ayq s ASN 40 Cb -0.15 -2.35 -0.05 0.00 -0.02 0.00 0.00 41.25 38.67 2ayq s ASN 40 CO 0.06 -0.05 -0.12 0.00 -2.57 0.00 0.00 177.10 174.42 2ayq s ALA 41 N 0.67 2.19 0.24 0.60 0.00 -0.53 -4.97 121.76 119.96 2ayq s ALA 41 Ca 0.32 -1.76 -0.03 0.00 0.00 0.00 0.00 51.96 50.49 2ayq s ALA 41 Cb -0.17 -0.01 -0.05 0.00 0.00 0.00 0.00 23.12 22.90 2ayq s ALA 41 CO 0.15 0.04 0.46 -0.51 0.00 0.00 0.00 175.76 175.90 2ayq s LEU 42 N -3.38 4.15 0.02 0.00 1.02 -1.26 -4.42 118.68 114.81 2ayq s LEU 42 Ca 0.26 0.55 -0.28 0.00 0.02 0.00 0.00 54.13 54.68 2ayq s LEU 42 Cb 0.00 -3.34 0.09 0.00 0.02 0.00 0.00 46.19 42.97 2ayq s LEU 42 CO 0.09 -0.11 0.81 -0.51 0.02 0.00 0.00 176.35 176.65 2ayq s ILE 43 N -1.96 0.00 0.00 -0.59 2.07 -1.26 -4.58 121.20 114.88 2ayq s ILE 43 Ca 0.41 0.00 0.00 0.00 -1.41 0.00 0.00 60.65 59.65 2ayq s ILE 43 Cb -0.11 -1.00 0.00 0.00 0.13 0.00 0.00 42.46 41.48 2ayq s ILE 43 CO 0.29 0.00 0.00 0.61 -1.91 0.00 0.00 174.94 173.93 2ayq n GLY 44 N -0.10 -0.13 0.38 1.50 0.00 -0.07 -3.55 105.19 103.21 2ayq n GLY 44 Ca -0.12 -1.03 0.23 0.00 0.00 0.00 0.00 46.02 45.10 2ayq n GLY 44 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2ayq h GLY 45 N 0.00 1.62 0.91 -0.02 0.00 -1.89 -1.28 103.07 102.42 2ayq h GLY 45 Ca 0.00 -0.24 -0.03 0.00 0.00 0.00 0.00 47.33 47.06 2ayq h GLY 45 CO 0.00 -0.27 -0.37 0.00 0.00 0.00 0.00 176.54 175.90 2ayq h ALA 46 N 1.70 -0.97 -0.90 3.60 0.00 -1.84 0.30 119.26 121.14 2ayq h ALA 46 Ca 0.66 -0.20 0.13 0.00 0.00 0.00 0.00 54.91 55.50 2ayq h ALA 46 Cb 1.56 0.44 -0.09 0.00 0.00 0.00 0.00 17.79 19.70 2ayq h ALA 46 CO -0.43 -1.06 0.52 0.00 0.00 0.00 0.00 179.25 178.28 2ayq h ALA 47 N -0.67 1.35 -0.12 0.00 0.00 -1.32 0.22 119.26 118.71 2ayq h ALA 47 Ca -0.09 0.05 0.01 0.00 0.00 0.00 0.00 54.91 54.89 2ayq h ALA 47 Cb 0.76 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.43 2ayq h ALA 47 CO 0.11 0.06 0.04 0.82 0.00 0.00 0.00 179.25 180.28 2ayq h ILE 48 N 0.79 0.97 -0.43 0.00 2.04 -0.94 0.62 117.51 120.56 2ayq h ILE 48 Ca 0.46 -0.03 -0.03 0.00 1.00 0.00 0.00 64.86 66.26 2ayq h ILE 48 Cb 0.54 0.86 -0.02 0.00 -0.74 0.00 0.00 36.82 37.46 2ayq h ILE 48 CO -0.30 0.02 0.16 0.44 0.00 0.00 0.00 178.15 178.46 2ayq h ASP 49 N 0.10 0.56 0.17 1.72 3.32 0.94 0.47 116.42 123.71 2ayq h ASP 49 Ca 0.05 -0.07 0.00 0.00 0.02 0.00 0.00 57.03 57.04 2ayq h ASP 49 Cb 0.03 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 39.44 2ayq h ASP 49 CO -0.06 0.53 -1.05 -0.62 -1.72 0.00 0.00 179.24 176.32 2ayq n GLU 50 N -4.36 0.14 0.00 3.56 -0.58 -0.22 -4.59 120.64 114.60 2ayq n GLU 50 Ca 0.03 -0.02 0.00 0.00 -0.42 0.00 0.00 57.16 56.75 2ayq n GLU 50 Cb 0.16 -1.52 0.00 0.00 -0.57 0.00 0.00 31.44 29.51 2ayq n GLU 50 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2ayq n ALA 51 N -1.66 0.30 0.00 0.62 0.00 0.21 -5.02 120.51 114.96 2ayq n ALA 51 Ca 0.03 -0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.34 2ayq n ALA 51 Cb 0.38 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.83 2ayq n ALA 51 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2ayq n GLY 52 N 0.00 2.82 3.16 0.00 0.00 0.16 -4.94 105.19 106.39 2ayq n GLY 52 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.78 2ayq n GLY 52 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2ayq s THR 53 N -2.10 1.34 -0.13 2.61 -1.32 -1.25 -4.81 115.64 109.97 2ayq s THR 53 Ca 0.00 -0.72 0.26 0.00 -1.21 0.00 0.00 61.69 60.02 2ayq s THR 53 Cb 0.00 -1.12 0.27 0.00 -1.51 0.00 0.00 72.50 70.15 2ayq s THR 53 CO 0.00 0.38 1.80 1.55 -2.21 0.00 0.00 174.62 176.14 2ayq h PRO 54 N 5.73 0.00 -2.21 7.08 0.13 -1.84 -2.96 132.00 137.92 2ayq h PRO 54 Ca -0.36 0.00 -0.56 0.00 -0.87 0.00 0.00 66.00 64.21 2ayq h PRO 54 Cb 1.15 0.00 -0.37 0.00 0.13 0.00 0.00 31.00 31.91 2ayq h PRO 54 CO 0.48 0.00 -0.97 -0.11 -0.23 0.00 0.00 178.00 177.18 2ayq n LEU 55 N -2.44 -0.59 -4.72 1.56 7.94 -1.26 -0.89 117.00 116.60 2ayq n LEU 55 Ca -0.01 -4.33 -0.34 0.00 -1.11 0.00 0.00 56.01 50.23 2ayq n LEU 55 Cb 0.12 0.58 0.09 0.00 0.53 0.00 0.00 43.42 44.74 2ayq n LEU 55 CO 0.15 1.90 0.79 -2.16 -1.11 0.00 0.00 177.39 176.96 2ayq s PRO 56 N -0.07 2.11 0.26 1.96 0.04 -1.24 -4.89 135.00 133.16 2ayq s PRO 56 Ca 0.33 1.74 -0.02 0.00 0.04 0.00 0.00 61.00 63.09 2ayq s PRO 56 Cb 0.06 -1.83 0.46 0.00 0.04 0.00 0.00 34.50 33.22 2ayq s PRO 56 CO -0.18 -1.85 1.83 1.05 0.04 0.00 0.00 177.00 177.89 2ayq h GLU 57 N -0.35 0.89 -0.89 4.56 9.09 -1.98 -1.61 114.58 124.29 2ayq h GLU 57 Ca -0.47 -0.05 0.08 0.00 0.05 0.00 0.00 59.36 58.97 2ayq h GLU 57 Cb 1.29 -0.20 -0.07 0.00 -1.65 0.00 0.00 28.75 28.12 2ayq h GLU 57 CO 0.49 0.59 0.54 1.05 0.05 0.00 0.00 179.01 181.73 2ayq h GLU 58 N 0.92 0.91 -0.69 1.06 -0.00 -1.98 -1.14 114.58 113.66 2ayq h GLU 58 Ca 0.44 -0.05 -0.01 0.00 -0.00 0.00 0.00 59.36 59.74 2ayq h GLU 58 Cb 0.38 -0.21 -0.03 0.00 -0.00 0.00 0.00 28.75 28.90 2ayq h GLU 58 CO -0.24 0.60 0.40 1.15 -0.00 0.00 0.00 179.01 180.92 2ayq h THR 59 N 0.94 1.20 -0.37 -1.06 2.02 -1.60 -0.91 112.91 113.14 2ayq h THR 59 Ca 0.41 -0.47 -0.03 0.00 0.77 0.00 0.00 66.41 67.09 2ayq h THR 59 Cb 0.29 0.27 -0.02 0.00 -1.74 0.00 0.00 68.15 66.95 2ayq h THR 59 CO -0.21 0.22 0.11 -0.07 0.37 0.00 0.00 175.52 175.93 2ayq h LEU 60 N 0.94 0.54 -0.36 2.58 3.38 -1.18 -0.84 115.31 120.37 2ayq h LEU 60 Ca 0.25 -0.21 0.07 0.00 0.09 0.00 0.00 57.88 58.07 2ayq h LEU 60 Cb -0.01 -0.14 -0.06 0.00 0.09 0.00 0.00 40.66 40.54 2ayq h LEU 60 CO -0.04 0.61 -0.01 0.44 0.09 0.00 0.00 178.44 179.53 2ayq h ASP 61 N 0.45 -0.17 -0.02 -0.43 3.32 -0.72 0.22 116.42 119.06 2ayq h ASP 61 Ca 0.12 0.09 0.00 0.00 0.02 0.00 0.00 57.03 57.26 2ayq h ASP 61 Cb 0.27 0.16 -0.00 0.00 0.22 0.00 0.00 39.33 39.97 2ayq h ASP 61 CO -0.00 -0.05 -0.00 0.40 -1.72 0.00 0.00 179.24 177.87 2ayq h ILE 62 N 0.08 0.98 -0.32 0.35 2.04 -0.93 -2.29 117.51 117.43 2ayq h ILE 62 Ca 0.17 -0.00 0.06 0.00 1.00 0.00 0.00 64.86 66.09 2ayq h ILE 62 Cb 0.25 0.98 -0.05 0.00 -0.74 0.00 0.00 36.82 37.25 2ayq h ILE 62 CO -0.30 0.00 -0.02 0.00 0.00 0.00 0.00 178.15 177.83 2ayq h ARG 64 N 0.07 0.66 0.00 0.00 3.08 -0.80 -1.46 114.38 115.92 2ayq h ARG 64 Ca 0.15 -0.04 -0.16 0.00 0.07 0.00 0.00 59.98 60.00 2ayq h ARG 64 Cb 0.22 -0.15 -0.02 0.00 0.08 0.00 0.00 29.97 30.09 2ayq h ARG 64 CO -0.28 0.44 -0.76 0.00 -1.07 0.00 0.00 179.97 178.30 2ayq h ARG 65 N 0.68 0.00 -7.15 0.04 3.08 -0.76 -3.47 114.38 106.79 2ayq h ARG 65 Ca 0.26 0.00 -0.49 0.00 0.07 0.00 0.00 59.98 59.82 2ayq h ARG 65 Cb 0.18 0.00 0.07 0.00 0.08 0.00 0.00 29.97 30.29 2ayq h ARG 65 CO -0.08 0.76 0.39 -1.12 -1.07 0.00 0.00 179.97 178.85 2ayq s SER 66 N -6.69 5.72 0.32 7.04 0.01 -0.21 -4.96 113.70 114.92 2ayq s SER 66 Ca 0.01 1.95 0.16 0.00 1.31 0.00 0.00 55.95 59.37 2ayq s SER 66 Cb 0.11 -2.55 0.45 0.00 0.21 0.00 0.00 66.02 64.23 2ayq s SER 66 CO 0.78 -1.21 1.63 0.44 0.41 0.00 0.00 173.24 175.28 2ayq h ASP 67 N 0.70 0.00 -5.26 2.44 3.32 -0.75 -3.47 116.42 113.40 2ayq h ASP 67 Ca -0.48 0.00 0.12 0.00 0.02 0.00 0.00 57.03 56.69 2ayq h ASP 67 Cb 1.23 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 40.74 2ayq h ASP 67 CO 0.57 0.49 0.46 0.00 -1.72 0.00 0.00 179.24 179.03 2ayq s ALA 68 N -3.42 -1.39 -0.04 3.45 0.00 -1.24 -4.51 121.76 114.60 2ayq s ALA 68 Ca 0.01 -0.29 -0.02 0.00 0.00 0.00 0.00 51.96 51.66 2ayq s ALA 68 Cb 0.11 0.71 0.03 0.00 0.00 0.00 0.00 23.12 23.97 2ayq s ALA 68 CO 0.72 -1.04 0.05 -1.50 0.00 0.00 0.00 175.76 173.99 2ayq s ILE 69 N -2.69 -0.07 -0.22 0.00 2.07 -0.60 -1.56 121.20 118.13 2ayq s ILE 69 Ca 0.17 0.38 -0.13 0.00 -1.41 0.00 0.00 60.65 59.66 2ayq s ILE 69 Cb -0.03 -0.16 -0.05 0.00 0.13 0.00 0.00 42.46 42.35 2ayq s ILE 69 CO 0.06 0.17 0.26 -0.76 -1.91 0.00 0.00 174.94 172.76 2ayq s LEU 70 N 2.00 4.13 0.05 8.50 1.43 0.66 -1.09 118.68 134.36 2ayq s LEU 70 Ca 0.03 0.29 0.09 0.00 -1.03 0.00 0.00 54.13 53.50 2ayq s LEU 70 Cb -0.12 -2.28 -0.03 0.00 0.03 0.00 0.00 46.19 43.79 2ayq s LEU 70 CO -0.03 0.00 -0.24 -0.22 0.23 0.00 0.00 176.35 176.09 2ayq s LEU 71 N 1.17 2.17 0.00 1.79 2.96 0.24 -0.57 118.68 126.44 2ayq s LEU 71 Ca 0.12 -0.57 0.00 0.00 -0.22 0.00 0.00 54.13 53.46 2ayq s LEU 71 Cb -0.14 -1.18 0.00 0.00 0.50 0.00 0.00 46.19 45.37 2ayq s LEU 71 CO 0.06 0.22 0.00 0.61 -1.32 0.00 0.00 176.35 175.92 2ayq n GLY 72 N 1.78 0.80 3.47 7.98 0.00 -0.38 -4.04 105.19 114.81 2ayq n GLY 72 Ca -0.17 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.70 2ayq n GLY 72 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ayq s ALA 73 N -4.00 -1.70 0.10 4.61 0.00 -0.89 -4.13 121.76 115.76 2ayq s ALA 73 Ca 0.00 0.94 0.07 0.00 0.00 0.00 0.00 51.96 52.97 2ayq s ALA 73 Cb 0.00 0.40 -0.03 0.00 0.00 0.00 0.00 23.12 23.49 2ayq s ALA 73 CO 0.00 -0.55 -0.17 0.14 0.00 0.00 0.00 175.76 175.17 2ayq s VAL 74 N -2.37 1.46 0.00 0.00 -7.23 -1.26 0.08 120.40 111.07 2ayq s VAL 74 Ca -0.05 -1.52 0.00 0.00 -1.81 0.00 0.00 61.98 58.60 2ayq s VAL 74 Cb -0.00 -1.41 0.00 0.00 0.56 0.00 0.00 36.38 35.52 2ayq s VAL 74 CO -0.01 -0.19 0.00 0.61 -0.31 0.00 0.00 175.10 175.20 2ayq n GLY 75 N 1.00 4.43 0.00 2.32 0.00 -1.26 -4.37 105.19 107.31 2ayq n GLY 75 Ca -0.19 -1.41 0.00 0.00 0.00 0.00 0.00 46.02 44.42 2ayq n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ayq n GLY 76 N -1.88 2.74 0.30 -0.02 0.00 -1.26 -4.33 105.19 100.74 2ayq n GLY 76 Ca 0.00 -0.48 0.18 0.00 0.00 0.00 0.00 46.02 45.72 2ayq n GLY 76 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2ayq h PRO 77 N 0.00 0.00 -0.28 1.61 0.11 -2.00 -2.96 132.00 128.48 2ayq h PRO 77 Ca 0.00 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 66.09 2ayq h PRO 77 Cb 0.00 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.10 2ayq h PRO 77 CO 0.00 0.04 0.07 -0.22 -0.21 0.00 0.00 178.00 177.68 2ayq h LYS 78 N 0.00 0.39 -0.32 1.05 3.64 -2.04 -2.92 116.57 116.36 2ayq h LYS 78 Ca -0.00 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.33 2ayq h LYS 78 Cb 0.24 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 31.98 2ayq h LYS 78 CO 0.01 0.37 0.00 0.91 -2.27 0.00 0.00 179.45 178.46 2ayq n TRP 79 N -4.38 0.41 1.00 1.91 8.01 -1.12 -4.56 117.44 118.71 2ayq n TRP 79 Ca 0.01 -0.24 0.05 0.00 -1.31 0.00 0.00 57.50 56.01 2ayq n TRP 79 Cb 0.16 -0.00 0.31 0.00 -2.01 0.00 0.00 31.31 29.77 2ayq n TRP 79 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.69 176.43 2ayq n ASP 80 N 1.25 0.00 -0.49 -0.99 9.92 -1.11 -2.20 116.55 122.94 2ayq n ASP 80 Ca 0.16 -0.67 0.05 0.00 -0.53 0.00 0.00 54.79 53.80 2ayq n ASP 80 Cb 0.54 0.00 0.09 0.00 -0.64 0.00 0.00 41.12 41.11 2ayq n ASP 80 CO 0.00 0.00 0.00 1.41 0.13 0.00 0.00 177.20 178.74 2ayq n HIS 81 N -0.83 0.20 -3.37 1.24 8.25 -1.26 -5.01 115.22 114.44 2ayq n HIS 81 Ca 0.08 -0.23 -0.29 0.00 -0.26 0.00 0.00 57.72 57.02 2ayq n HIS 81 Cb 0.04 -0.01 -0.03 0.00 1.12 0.00 0.00 29.99 31.10 2ayq n HIS 81 CO 0.00 0.00 0.00 -0.80 0.64 0.00 0.00 176.34 176.18 2ayq s ASN 82 N -0.92 6.44 0.49 0.41 -0.87 -0.93 -5.06 114.94 114.49 2ayq s ASN 82 Ca 0.16 0.69 -0.22 0.00 -1.57 0.00 0.00 52.86 51.92 2ayq s ASN 82 Cb 0.10 -2.13 -0.07 0.00 -0.02 0.00 0.00 41.25 39.13 2ayq s ASN 82 CO 0.14 -0.18 1.20 -2.16 -2.57 0.00 0.00 177.10 173.52 2ayq s PRO 83 N -3.51 3.59 0.23 -0.60 0.04 -1.26 -4.86 135.00 128.62 2ayq s PRO 83 Ca 0.43 1.84 0.04 0.00 0.04 0.00 0.00 61.00 63.35 2ayq s PRO 83 Cb -0.11 -2.33 0.63 0.00 0.04 0.00 0.00 34.50 32.73 2ayq s PRO 83 CO 0.30 -0.71 1.14 0.00 0.04 0.00 0.00 177.00 177.76 2ayq n ALA 84 N -0.69 0.43 0.31 8.56 0.00 -1.26 0.80 120.51 128.66 2ayq n ALA 84 Ca 0.08 0.77 0.20 0.00 0.00 0.00 0.00 53.44 54.50 2ayq n ALA 84 Cb 0.48 -0.60 0.95 0.00 0.00 0.00 0.00 19.45 20.28 2ayq n ALA 84 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2ayq h SER 85 N 0.00 0.00 -1.40 0.00 4.64 -2.01 -3.02 113.55 111.77 2ayq h SER 85 Ca 0.47 0.00 -0.64 0.00 -0.47 0.00 0.00 61.79 61.15 2ayq h SER 85 Cb 1.03 0.00 -0.37 0.00 -0.31 0.00 0.00 62.40 62.75 2ayq h SER 85 CO -0.66 0.00 -0.06 0.18 -0.87 0.00 0.00 176.83 175.42 2ayq n LEU 86 N -3.04 5.92 -4.24 5.97 4.77 0.24 -4.78 117.00 121.84 2ayq n LEU 86 Ca -0.01 -4.88 -0.15 0.00 -0.03 0.00 0.00 56.01 50.93 2ayq n LEU 86 Cb 0.18 -0.66 -0.10 0.00 -2.33 0.00 0.00 43.42 40.50 2ayq n LEU 86 CO 0.23 1.98 -0.42 -0.13 -1.33 0.00 0.00 177.39 177.71 2ayq s ARG 87 N -3.73 1.03 0.11 3.23 0.52 -1.14 -4.66 118.95 114.31 2ayq s ARG 87 Ca 0.52 -1.35 -0.27 0.00 -0.52 0.00 0.00 55.73 54.12 2ayq s ARG 87 Cb 0.43 -0.71 -0.09 0.00 0.52 0.00 0.00 34.95 35.10 2ayq s ARG 87 CO -0.17 0.11 1.45 -1.35 0.02 0.00 0.00 175.30 175.35 2ayq h PRO 88 N 3.11 -0.28 -0.93 3.54 0.11 -1.90 -2.57 132.00 133.08 2ayq h PRO 88 Ca -0.38 0.02 0.26 0.00 0.11 0.00 0.00 66.00 66.01 2ayq h PRO 88 Cb 1.19 0.06 -0.16 0.00 0.11 0.00 0.00 31.00 32.20 2ayq h PRO 88 CO 0.58 -0.19 0.13 0.93 -0.21 0.00 0.00 178.00 179.24 2ayq h GLU 89 N -0.29 0.08 -0.74 1.05 3.07 -1.93 0.12 114.58 115.93 2ayq h GLU 89 Ca 0.07 -0.00 0.13 0.00 -0.50 0.00 0.00 59.36 59.05 2ayq h GLU 89 Cb 0.47 -0.02 -0.09 0.00 -0.84 0.00 0.00 28.75 28.28 2ayq h GLU 89 CO -0.51 0.05 0.32 -0.22 -1.40 0.00 0.00 179.01 177.25 2ayq h LYS 90 N 0.08 0.48 -0.34 2.33 3.11 -1.70 0.81 116.57 121.34 2ayq h LYS 90 Ca 0.58 -0.03 -0.02 0.00 -2.81 0.00 0.00 60.65 58.38 2ayq h LYS 90 Cb 1.22 -0.11 -0.02 0.00 -1.00 0.00 0.00 32.23 32.33 2ayq h LYS 90 CO -0.80 0.32 0.14 0.78 -2.81 0.00 0.00 179.45 177.08 2ayq h GLY 91 N 0.49 0.50 0.56 5.01 0.00 -0.82 0.13 103.07 108.95 2ayq h GLY 91 Ca 0.39 -0.23 -0.02 0.00 0.00 0.00 0.00 47.33 47.48 2ayq h GLY 91 CO -0.36 0.22 -0.18 -2.00 0.00 0.00 0.00 176.54 174.21 2ayq h LEU 92 N 0.47 -0.43 -1.22 3.11 5.85 -0.81 -1.24 115.31 121.04 2ayq h LEU 92 Ca 0.12 -0.13 0.04 0.00 0.84 0.00 0.00 57.88 58.75 2ayq h LEU 92 Cb 0.09 0.11 -0.05 0.00 0.37 0.00 0.00 40.66 41.18 2ayq h LEU 92 CO -0.01 -0.02 0.54 -0.07 -0.34 0.00 0.00 178.44 178.54 2ayq h LEU 93 N -0.96 0.87 0.45 2.25 3.38 -1.11 -0.95 115.31 119.24 2ayq h LEU 93 Ca -0.05 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.89 2ayq h LEU 93 Cb 0.54 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 41.09 2ayq h LEU 93 CO 0.09 0.59 -0.26 1.23 0.09 0.00 0.00 178.44 180.18 2ayq h GLY 94 N 1.00 -0.70 0.34 0.83 0.00 -0.74 -1.75 103.07 102.06 2ayq h GLY 94 Ca 0.33 0.28 0.14 0.00 0.00 0.00 0.00 47.33 48.08 2ayq h GLY 94 CO -0.10 -0.26 0.53 -2.00 0.00 0.00 0.00 176.54 174.70 2ayq h LEU 95 N -0.66 0.71 -0.62 3.11 5.85 -0.34 -0.62 115.31 122.73 2ayq h LEU 95 Ca -0.05 0.07 -0.02 0.00 0.84 0.00 0.00 57.88 58.72 2ayq h LEU 95 Cb 0.53 -0.06 -0.03 0.00 0.37 0.00 0.00 40.66 41.48 2ayq h LEU 95 CO 0.07 0.34 0.32 -0.09 -0.34 0.00 0.00 178.44 178.74 2ayq h ARG 96 N 0.78 0.88 -0.12 1.25 2.43 -0.84 -1.97 114.38 116.79 2ayq h ARG 96 Ca 0.48 -0.11 -0.05 0.00 -0.81 0.00 0.00 59.98 59.49 2ayq h ARG 96 Cb 0.59 -0.17 -0.00 0.00 -0.42 0.00 0.00 29.97 29.97 2ayq h ARG 96 CO -0.31 0.68 -0.10 0.87 -1.51 0.00 0.00 179.97 179.60 2ayq h LYS 97 N 0.85 0.28 -0.93 0.20 1.57 -0.37 -2.46 116.57 115.71 2ayq h LYS 97 Ca 0.22 -0.14 0.08 0.00 -1.87 0.00 0.00 60.65 58.93 2ayq h LYS 97 Cb 0.07 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 32.32 2ayq h LYS 97 CO -0.03 0.67 0.60 1.49 -0.57 0.00 0.00 179.45 181.61 2ayq h GLU 98 N -0.10 0.99 0.00 3.15 4.57 -1.05 0.18 114.58 122.32 2ayq h GLU 98 Ca 0.02 -0.06 0.00 0.00 -1.18 0.00 0.00 59.36 58.14 2ayq h GLU 98 Cb 0.61 -0.22 0.00 0.00 -0.16 0.00 0.00 28.75 28.98 2ayq h GLU 98 CO 0.03 0.66 0.00 -1.33 -1.18 0.00 0.00 179.01 177.18 2ayq n MET 99 N -4.51 0.07 -3.02 1.92 2.81 -0.75 -4.93 117.12 108.71 2ayq n MET 99 Ca 0.15 0.05 -0.13 0.00 -1.81 0.00 0.00 57.70 55.97 2ayq n MET 99 Cb 0.23 -1.50 0.06 0.00 -0.71 0.00 0.00 33.22 31.31 2ayq n MET 99 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2ayq n GLY 100 N 1.11 -0.40 3.67 3.03 0.00 0.62 -4.99 105.19 108.22 2ayq n GLY 100 Ca 0.07 0.15 -0.37 0.00 0.00 0.00 0.00 46.02 45.87 2ayq n GLY 100 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2ayq s LEU 101 N -5.19 4.13 -0.03 0.99 1.43 -0.95 -4.69 118.68 114.37 2ayq s LEU 101 Ca 0.15 0.21 0.06 0.00 -1.03 0.00 0.00 54.13 53.51 2ayq s LEU 101 Cb -0.02 -2.20 -0.08 0.00 0.03 0.00 0.00 46.19 43.92 2ayq s LEU 101 CO 0.57 0.04 0.09 2.22 0.23 0.00 0.00 176.35 179.50 2ayq n PHE 102 N 4.30 0.00 -3.87 0.29 1.16 -0.91 -4.74 117.46 113.68 2ayq n PHE 102 Ca -0.13 0.00 -0.36 0.00 -1.87 0.00 0.00 57.45 55.08 2ayq n PHE 102 Cb 0.52 -0.19 -0.07 0.00 -1.61 0.00 0.00 39.48 38.13 2ayq n PHE 102 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 2ayq s ALA 103 N -2.31 3.80 -0.14 1.98 0.00 -0.66 0.15 121.76 124.58 2ayq s ALA 103 Ca -0.02 -0.66 0.00 0.00 0.00 0.00 0.00 51.96 51.28 2ayq s ALA 103 Cb 0.03 -1.99 0.02 0.00 0.00 0.00 0.00 23.12 21.18 2ayq s ALA 103 CO 0.24 0.50 -0.13 1.21 0.00 0.00 0.00 175.76 177.59 2ayq s ASN 104 N -0.67 2.57 -0.18 0.00 2.47 -0.90 -0.23 114.94 117.99 2ayq s ASN 104 Ca 0.13 -0.44 -0.08 0.00 0.42 0.00 0.00 52.86 52.89 2ayq s ASN 104 Cb -0.12 -1.10 -0.04 0.00 -1.45 0.00 0.00 41.25 38.54 2ayq s ASN 104 CO 0.02 -0.07 0.08 -0.76 -3.72 0.00 0.00 177.10 172.66 2ayq s LEU 105 N 1.53 3.94 -0.43 3.21 1.43 0.14 -1.37 118.68 127.14 2ayq s LEU 105 Ca 0.05 0.15 0.02 0.00 -1.03 0.00 0.00 54.13 53.32 2ayq s LEU 105 Cb -0.13 -2.00 0.13 0.00 0.03 0.00 0.00 46.19 44.23 2ayq s LEU 105 CO -0.10 0.20 0.23 -0.60 0.23 0.00 0.00 176.35 176.31 2ayq s ARG 106 N 0.21 1.22 0.67 1.70 6.06 -0.35 -1.80 118.95 126.65 2ayq s ARG 106 Ca 0.05 -1.92 -0.12 0.00 -2.50 0.00 0.00 55.73 51.25 2ayq s ARG 106 Cb -0.12 -2.27 -0.00 0.00 0.06 0.00 0.00 34.95 32.62 2ayq s ARG 106 CO -0.00 -1.15 1.06 -2.14 -2.50 0.00 0.00 175.30 170.56 2ayq s PRO 107 N 0.47 3.03 -0.23 5.12 0.02 -1.26 -1.69 135.00 140.46 2ayq s PRO 107 Ca 0.17 1.02 -0.03 0.00 0.02 0.00 0.00 61.00 62.18 2ayq s PRO 107 Cb -0.24 -2.00 0.12 0.00 0.02 0.00 0.00 34.50 32.40 2ayq s PRO 107 CO -0.01 -1.03 0.34 0.08 -0.33 0.00 0.00 177.00 176.05 2ayq s VAL 108 N -2.90 -0.53 0.05 3.83 1.01 0.37 -4.78 120.40 117.46 2ayq s VAL 108 Ca 0.59 -0.07 0.09 0.00 0.00 0.00 0.00 61.98 62.60 2ayq s VAL 108 Cb -0.14 -0.77 -0.03 0.00 0.00 0.00 0.00 36.38 35.44 2ayq s VAL 108 CO 0.50 -0.13 -0.25 -0.75 0.00 0.00 0.00 175.10 174.47 2ayq s LYS 109 N 2.49 1.79 -0.17 2.72 2.20 -1.26 -1.85 119.74 125.66 2ayq s LYS 109 Ca 0.11 -1.12 -0.22 0.00 -0.36 0.00 0.00 55.97 54.37 2ayq s LYS 109 Cb -0.15 -2.00 -0.02 0.00 -1.51 0.00 0.00 37.83 34.15 2ayq s LYS 109 CO -0.15 0.51 0.69 0.00 -0.36 0.00 0.00 175.35 176.04 2ayq s ALA 110 N -0.84 3.50 -0.31 3.13 0.00 0.25 -4.84 121.76 122.66 2ayq s ALA 110 Ca 0.12 -0.13 -0.07 0.00 0.00 0.00 0.00 51.96 51.88 2ayq s ALA 110 Cb -0.10 -3.03 0.01 0.00 0.00 0.00 0.00 23.12 20.00 2ayq s ALA 110 CO 0.03 -0.49 0.10 0.71 0.00 0.00 0.00 175.76 176.10 2ayq s TYR 111 N 1.76 3.17 0.26 0.00 2.02 -1.26 -4.83 117.35 118.48 2ayq s TYR 111 Ca 0.32 -0.95 -0.06 0.00 -0.37 0.00 0.00 57.07 56.01 2ayq s TYR 111 Cb -0.16 -2.28 0.48 0.00 -0.40 0.00 0.00 41.96 39.59 2ayq s TYR 111 CO 0.12 -0.57 1.45 0.00 -1.57 0.00 0.00 175.55 174.97 2ayq n ALA 112 N 4.89 0.27 1.67 3.71 0.00 -1.26 0.42 120.51 130.20 2ayq n ALA 112 Ca -0.14 1.02 0.02 0.00 0.00 0.00 0.00 53.44 54.34 2ayq n ALA 112 Cb 0.48 -0.63 0.14 0.00 0.00 0.00 0.00 19.45 19.44 2ayq n ALA 112 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2ayq n THR 113 N -5.49 0.00 0.08 0.00 -2.24 -1.26 -2.85 114.28 102.52 2ayq n THR 113 Ca 0.16 0.00 0.01 0.00 -2.27 0.00 0.00 64.05 61.95 2ayq n THR 113 Cb 0.51 -0.17 -0.01 0.00 -2.10 0.00 0.00 70.33 68.55 2ayq n THR 113 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2ayq n LEU 114 N -0.59 0.13 0.15 3.22 4.77 0.17 -1.73 117.00 123.12 2ayq n LEU 114 Ca 0.04 -0.52 0.17 0.00 -0.03 0.00 0.00 56.01 55.67 2ayq n LEU 114 Cb 0.02 0.00 0.76 0.00 -2.33 0.00 0.00 43.42 41.87 2ayq n LEU 114 CO 0.03 0.03 1.15 -0.07 -1.33 0.00 0.00 177.39 177.20 2ayq h LEU 115 N 0.02 0.00 -2.04 2.23 3.38 -1.35 0.60 115.31 118.15 2ayq h LEU 115 Ca 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 2ayq h LEU 115 Cb 0.04 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.79 2ayq h LEU 115 CO 0.00 0.00 -0.06 -0.55 0.09 0.00 0.00 178.44 177.92 2ayq h ASN 116 N 0.00 0.00 0.97 -0.43 -1.07 -1.85 -1.88 115.58 111.33 2ayq h ASN 116 Ca 0.13 0.00 0.00 0.00 0.07 0.00 0.00 56.30 56.50 2ayq h ASN 116 Cb 0.63 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 36.88 2ayq h ASN 116 CO -0.00 0.06 -0.76 0.00 0.07 0.00 0.00 177.43 176.80 2ayq h ALA 117 N 1.94 0.56 -2.69 4.14 0.00 -1.15 -3.47 119.26 118.60 2ayq h ALA 117 Ca -0.00 0.00 -0.53 0.00 0.00 0.00 0.00 54.91 54.38 2ayq h ALA 117 Cb 0.31 0.00 0.05 0.00 0.00 0.00 0.00 17.79 18.15 2ayq h ALA 117 CO 0.01 0.00 0.80 0.45 0.00 0.00 0.00 179.25 180.51 2ayq s SER 118 N -4.79 6.63 0.48 0.00 0.15 -0.71 -4.63 113.70 110.83 2ayq s SER 118 Ca 0.03 2.64 0.32 0.00 0.70 0.00 0.00 55.95 59.64 2ayq s SER 118 Cb 0.11 -2.61 1.49 0.00 -1.71 0.00 0.00 66.02 63.30 2ayq s SER 118 CO 0.75 -0.75 1.97 -0.65 1.20 0.00 0.00 173.24 175.76 2ayq h PRO 119 N 5.74 0.00 -6.51 5.44 0.11 -1.75 -3.43 132.00 131.59 2ayq h PRO 119 Ca -0.45 0.00 -0.45 0.00 0.11 0.00 0.00 66.00 65.22 2ayq h PRO 119 Cb 1.21 0.00 0.02 0.00 0.11 0.00 0.00 31.00 32.34 2ayq h PRO 119 CO 0.83 0.00 -0.22 -0.51 -0.21 0.00 0.00 178.00 177.89 2ayq s LEU 120 N -5.55 3.80 0.45 2.35 1.43 -1.26 -5.07 118.68 114.83 2ayq s LEU 120 Ca 0.00 0.04 -0.23 0.00 -1.03 0.00 0.00 54.13 52.92 2ayq s LEU 120 Cb 0.10 -2.95 -0.07 0.00 0.03 0.00 0.00 46.19 43.29 2ayq s LEU 120 CO 0.43 -0.58 1.16 -0.54 0.23 0.00 0.00 176.35 177.06 2ayq s LYS 121 N -4.37 3.78 0.19 1.70 1.02 -1.26 -4.88 119.74 115.93 2ayq s LYS 121 Ca 0.47 1.77 -0.18 0.00 0.02 0.00 0.00 55.97 58.05 2ayq s LYS 121 Cb -0.10 -2.42 0.16 0.00 -0.52 0.00 0.00 37.83 34.95 2ayq s LYS 121 CO 0.34 -0.53 1.60 -0.09 -0.92 0.00 0.00 175.35 175.75 2ayq h ARG 122 N 2.09 -0.11 -0.75 1.68 2.43 -1.92 -2.18 114.38 115.61 2ayq h ARG 122 Ca -0.49 0.01 0.22 0.00 -0.81 0.00 0.00 59.98 58.90 2ayq h ARG 122 Cb 1.25 0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 30.79 2ayq h ARG 122 CO 0.60 -0.08 0.90 1.05 -1.51 0.00 0.00 179.97 180.94 2ayq h GLU 123 N -0.12 0.00 0.00 0.20 4.11 -1.95 -0.06 114.58 116.77 2ayq h GLU 123 Ca 0.25 0.00 -0.24 0.00 0.07 0.00 0.00 59.36 59.44 2ayq h GLU 123 Cb 0.52 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.74 2ayq h GLU 123 CO -0.65 0.00 -1.64 0.54 0.07 0.00 0.00 179.01 177.33 2ayq n ARG 124 N -3.38 0.55 0.25 1.06 1.74 -0.83 -4.43 116.66 111.62 2ayq n ARG 124 Ca 0.16 0.35 0.16 0.00 -0.77 0.00 0.00 57.85 57.75 2ayq n ARG 124 Cb 1.14 -1.56 0.70 0.00 -1.02 0.00 0.00 32.46 31.73 2ayq n ARG 124 CO 0.00 0.00 0.00 -0.24 -1.52 0.00 0.00 177.63 175.87 2ayq h VAL 125 N -1.00 0.00 -3.68 1.55 3.04 -1.42 -3.40 116.25 111.34 2ayq h VAL 125 Ca -0.37 -0.37 -0.53 0.00 -1.01 0.00 0.00 66.70 64.42 2ayq h VAL 125 Cb 1.26 1.28 0.09 0.00 -2.01 0.00 0.00 31.29 31.92 2ayq h VAL 125 CO -0.22 0.00 0.81 -0.70 -1.01 0.00 0.00 177.57 176.44 2ayq s GLU 126 N -3.63 4.14 0.00 4.17 2.12 -0.06 -2.39 118.70 123.04 2ayq s GLU 126 Ca 0.01 2.54 0.00 0.00 0.36 0.00 0.00 54.97 57.88 2ayq s GLU 126 Cb 0.09 -3.00 0.00 0.00 0.26 0.00 0.00 34.13 31.48 2ayq s GLU 126 CO 0.48 -0.54 0.00 0.09 -0.54 0.00 0.00 175.26 174.75 2ayq n ASN 127 N 1.21 0.00 -4.68 -1.70 3.02 -1.26 -4.80 115.26 107.05 2ayq n ASN 127 Ca 0.04 0.00 -0.47 0.00 -0.03 0.00 0.00 54.58 54.12 2ayq n ASN 127 Cb 0.39 -0.00 -0.04 0.00 -0.61 0.00 0.00 39.78 39.51 2ayq n ASN 127 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 2ayq n VAL 128 N -2.00 0.35 -2.88 2.41 0.31 -1.00 -4.86 118.33 110.66 2ayq n VAL 128 Ca 0.00 -0.06 -0.13 0.00 -0.01 0.00 0.00 64.34 64.14 2ayq n VAL 128 Cb 0.00 -1.78 0.02 0.00 -0.91 0.00 0.00 33.84 31.17 2ayq n VAL 128 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 2ayq n ASP 129 N 5.39 -1.90 -4.73 4.52 2.03 -1.24 -0.58 116.55 120.04 2ayq n ASP 129 Ca 0.20 -3.18 -0.26 0.00 0.52 0.00 0.00 54.79 52.07 2ayq n ASP 129 Cb 0.30 1.11 -0.08 0.00 -0.72 0.00 0.00 41.12 41.74 2ayq n ASP 129 CO 0.00 0.00 0.00 -1.48 -1.92 0.00 0.00 177.20 173.80 2ayq s LEU 130 N -1.06 3.03 -0.04 -2.67 0.05 -0.77 -4.66 118.68 112.55 2ayq s LEU 130 Ca 0.32 -1.16 -0.02 0.00 0.05 0.00 0.00 54.13 53.33 2ayq s LEU 130 Cb 0.23 -1.31 0.03 0.00 -2.05 0.00 0.00 46.19 43.09 2ayq s LEU 130 CO -0.19 -0.56 0.08 -0.69 -0.55 0.00 0.00 176.35 174.44 2ayq s VAL 131 N -2.64 -0.09 -0.20 1.48 1.01 -0.62 -0.48 120.40 118.86 2ayq s VAL 131 Ca 0.38 0.27 -0.09 0.00 0.00 0.00 0.00 61.98 62.54 2ayq s VAL 131 Cb 0.05 -0.17 -0.05 0.00 0.00 0.00 0.00 36.38 36.21 2ayq s VAL 131 CO 0.21 0.11 0.11 -0.63 0.00 0.00 0.00 175.10 174.90 2ayq s ILE 132 N 1.49 5.16 -0.19 2.22 1.01 -0.68 -1.71 121.20 128.49 2ayq s ILE 132 Ca -0.05 0.10 -0.06 0.00 0.00 0.00 0.00 60.65 60.65 2ayq s ILE 132 Cb -0.12 -3.35 -0.03 0.00 0.01 0.00 0.00 42.46 38.96 2ayq s ILE 132 CO -0.04 0.43 0.02 -0.69 0.00 0.00 0.00 174.94 174.65 2ayq s VAL 133 N 0.53 4.26 0.00 2.92 1.01 0.98 -1.22 120.40 128.88 2ayq s VAL 133 Ca 0.06 -0.22 0.08 0.00 0.00 0.00 0.00 61.98 61.90 2ayq s VAL 133 Cb -0.12 -2.92 -0.02 0.00 0.00 0.00 0.00 36.38 33.32 2ayq s VAL 133 CO 0.00 0.44 -0.24 -0.60 0.00 0.00 0.00 175.10 174.70 2ayq s ARG 134 N 0.69 1.85 -0.37 2.72 3.52 -0.47 -1.79 118.95 125.10 2ayq s ARG 134 Ca 0.01 -0.92 -0.29 0.00 -0.13 0.00 0.00 55.73 54.40 2ayq s ARG 134 Cb -0.14 -1.86 0.02 0.00 -1.56 0.00 0.00 34.95 31.41 2ayq s ARG 134 CO 0.02 0.50 1.16 -2.00 -0.81 0.00 0.00 175.30 174.17 2ayq s GLU 135 N -0.77 3.89 0.02 5.12 -6.30 -0.85 -2.12 118.70 117.70 2ayq s GLU 135 Ca 0.10 0.94 0.08 0.00 -2.50 0.00 0.00 54.97 53.58 2ayq s GLU 135 Cb -0.09 -3.84 -0.23 0.00 0.00 0.00 0.00 34.13 29.97 2ayq s GLU 135 CO 0.00 -1.14 0.92 -0.07 0.02 0.00 0.00 175.26 174.98 2ayq h LEU 136 N 10.75 0.07 0.00 2.70 3.38 -0.63 -3.16 115.31 128.41 2ayq h LEU 136 Ca -0.23 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.64 2ayq h LEU 136 Cb 1.07 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.80 2ayq h LEU 136 CO 1.07 1.08 0.00 0.35 0.09 0.00 0.00 178.44 181.03 2ayq n THR 137 N -3.23 0.00 -1.25 0.22 -2.24 -1.26 -5.00 114.28 101.53 2ayq n THR 137 Ca -0.11 0.61 0.00 0.00 -2.27 0.00 0.00 64.05 62.28 2ayq n THR 137 Cb 1.01 -1.37 0.00 0.00 -2.10 0.00 0.00 70.33 67.87 2ayq n THR 137 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2ayq n GLY 138 N 1.34 0.25 0.00 3.38 0.00 -1.26 -4.76 105.19 104.14 2ayq n GLY 138 Ca 0.00 -1.82 0.00 0.00 0.00 0.00 0.00 46.02 44.20 2ayq n GLY 138 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ayq n GLY 139 N 5.00 0.68 0.27 -0.02 0.00 -1.21 -4.54 105.19 105.37 2ayq n GLY 139 Ca 0.00 -2.27 0.18 0.00 0.00 0.00 0.00 46.02 43.93 2ayq n GLY 139 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2ayq h LEU 140 N 0.00 0.00 -0.08 0.99 5.85 -1.88 -2.44 115.31 117.74 2ayq h LEU 140 Ca 0.00 0.00 -0.07 0.00 0.84 0.00 0.00 57.88 58.65 2ayq h LEU 140 Cb 0.00 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.03 2ayq h LEU 140 CO 0.00 0.00 -0.24 1.88 -0.34 0.00 0.00 178.44 179.74 2ayq h TYR 141 N 0.00 0.40 -0.00 1.25 0.05 -1.84 -3.34 116.97 113.49 2ayq h TYR 141 Ca 0.00 -0.16 0.00 0.00 0.05 0.00 0.00 58.73 58.62 2ayq h TYR 141 Cb 0.17 -0.07 0.00 0.00 1.01 0.00 0.00 36.73 37.84 2ayq h TYR 141 CO 0.00 0.85 -0.76 1.19 -1.05 0.00 0.00 178.16 178.39 2ayq n PHE 142 N -4.50 0.00 -2.17 4.88 3.01 -1.17 -4.96 117.46 112.55 2ayq n PHE 142 Ca -0.08 0.00 -0.42 0.00 1.01 0.00 0.00 57.45 57.96 2ayq n PHE 142 Cb 0.44 -0.04 -0.03 0.00 -0.01 0.00 0.00 39.48 39.84 2ayq n PHE 142 CO 0.00 0.00 0.00 0.20 1.01 0.00 0.00 176.76 177.97 2ayq s GLY 143 N -2.85 2.07 0.14 1.37 0.00 -0.93 -5.00 107.32 102.12 2ayq s GLY 143 Ca 0.12 1.12 0.05 0.00 0.00 0.00 0.00 44.72 46.01 2ayq s GLY 143 CO 0.75 2.29 0.09 -1.60 0.00 0.00 0.00 173.10 174.64 2ayq s ARG 144 N 0.85 2.79 0.41 2.90 6.06 -1.26 -3.64 118.95 127.06 2ayq s ARG 144 Ca 0.63 -0.85 -0.22 0.00 -2.50 0.00 0.00 55.73 52.78 2ayq s ARG 144 Cb -0.37 -2.62 -0.10 0.00 0.06 0.00 0.00 34.95 31.92 2ayq s ARG 144 CO 0.32 0.51 0.96 -1.25 -2.50 0.00 0.00 175.30 173.34 2ayq s PRO 145 N -2.83 4.27 -0.25 5.12 0.04 -1.26 -4.73 135.00 135.36 2ayq s PRO 145 Ca 0.30 1.21 -0.03 0.00 0.04 0.00 0.00 61.00 62.51 2ayq s PRO 145 Cb -0.11 -2.34 0.08 0.00 0.04 0.00 0.00 34.50 32.18 2ayq s PRO 145 CO 0.22 0.00 0.09 0.45 0.04 0.00 0.00 177.00 177.80 2ayq s SER 146 N -2.00 3.26 0.13 6.66 0.15 -1.25 -2.64 113.70 118.01 2ayq s SER 146 Ca 0.59 -1.12 -0.24 0.00 0.70 0.00 0.00 55.95 55.88 2ayq s SER 146 Cb -0.13 -0.49 0.08 0.00 -1.71 0.00 0.00 66.02 63.78 2ayq s SER 146 CO 0.17 -0.39 1.09 -1.83 1.20 0.00 0.00 173.24 173.48 2ayq s GLU 147 N 1.96 1.05 0.23 5.44 -1.05 -0.46 -5.00 118.70 120.87 2ayq s GLU 147 Ca 0.06 -0.65 0.10 0.00 -0.15 0.00 0.00 54.97 54.32 2ayq s GLU 147 Cb -0.16 0.31 -0.04 0.00 -0.44 0.00 0.00 34.13 33.79 2ayq s GLU 147 CO -0.23 -0.49 -0.08 1.03 0.95 0.00 0.00 175.26 176.44 2ayq s ARG 148 N -2.37 2.07 0.00 -4.83 0.52 -1.26 -0.76 118.95 112.33 2ayq s ARG 148 Ca 0.20 -1.42 0.00 0.00 -0.52 0.00 0.00 55.73 53.99 2ayq s ARG 148 Cb -0.01 -2.08 0.00 0.00 0.52 0.00 0.00 34.95 33.37 2ayq s ARG 148 CO 0.03 0.39 0.00 0.54 0.02 0.00 0.00 175.30 176.27 2ayq n ARG 149 N -0.45 0.00 0.00 3.54 1.74 0.27 -4.96 116.66 116.80 2ayq n ARG 149 Ca -0.08 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.00 2ayq n ARG 149 Cb 0.58 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 32.02 2ayq n ARG 149 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2ayq n GLY 150 N 0.00 -1.19 0.00 -0.13 0.00 -1.26 0.18 105.19 102.78 2ayq n GLY 150 Ca 0.00 0.41 0.00 0.00 0.00 0.00 0.00 46.02 46.43 2ayq n GLY 150 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2ayq n PRO 151 N 0.00 -0.51 -1.18 1.61 -0.02 -1.26 -4.85 135.00 128.78 2ayq n PRO 151 Ca 0.00 0.00 -0.06 0.00 -2.02 0.00 0.00 63.50 61.42 2ayq n PRO 151 Cb 0.00 0.00 -0.03 0.00 -0.02 0.00 0.00 33.50 33.45 2ayq n PRO 151 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2ayq n GLY 152 N 2.81 0.86 3.81 -1.23 0.00 -1.26 -3.49 105.19 106.69 2ayq n GLY 152 Ca 0.00 -0.67 -0.27 0.00 0.00 0.00 0.00 46.02 45.08 2ayq n GLY 152 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2ayq n GLU 153 N -2.69 -2.74 0.05 1.61 1.02 -1.15 -4.89 120.64 111.85 2ayq n GLU 153 Ca -0.06 0.45 0.12 0.00 -0.02 0.00 0.00 57.16 57.65 2ayq n GLU 153 Cb 0.22 -4.46 0.23 0.00 -0.02 0.00 0.00 31.44 27.41 2ayq n GLU 153 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 2ayq n ASN 154 N -2.87 0.65 -3.86 1.62 3.02 0.13 -4.84 115.26 109.10 2ayq n ASN 154 Ca -0.23 0.14 -0.14 0.00 -0.03 0.00 0.00 54.58 54.32 2ayq n ASN 154 Cb 0.65 0.04 -0.15 0.00 -0.61 0.00 0.00 39.78 39.71 2ayq n ASN 154 CO 0.00 0.00 0.00 -0.70 -2.62 0.00 0.00 177.26 173.94 2ayq s GLU 155 N -3.13 0.12 0.05 3.52 2.12 -0.75 -4.95 118.70 115.67 2ayq s GLU 155 Ca 0.08 0.01 0.04 0.00 0.36 0.00 0.00 54.97 55.46 2ayq s GLU 155 Cb 0.14 -0.20 -0.02 0.00 0.26 0.00 0.00 34.13 34.31 2ayq s GLU 155 CO 0.70 -0.03 -0.12 0.54 -0.54 0.00 0.00 175.26 175.80 2ayq s VAL 156 N 0.35 0.96 0.03 3.70 0.11 -1.26 0.95 120.40 125.24 2ayq s VAL 156 Ca -0.03 -1.07 -0.10 0.00 -2.93 0.00 0.00 61.98 57.86 2ayq s VAL 156 Cb -0.05 -0.92 0.01 0.00 -1.53 0.00 0.00 36.38 33.89 2ayq s VAL 156 CO -0.01 -0.13 0.20 0.68 -3.33 0.00 0.00 175.10 172.51 2ayq s VAL 157 N -1.04 0.10 0.06 2.04 -7.23 0.06 -5.00 120.40 109.40 2ayq s VAL 157 Ca -0.02 -0.83 0.03 0.00 -1.81 0.00 0.00 61.98 59.35 2ayq s VAL 157 Cb -0.09 -0.82 -0.03 0.00 0.56 0.00 0.00 36.38 36.00 2ayq s VAL 157 CO 0.01 -0.46 -0.09 -1.81 -0.31 0.00 0.00 175.10 172.45 2ayq s ASP 158 N -1.93 1.09 -0.11 4.85 1.01 -1.25 -1.36 116.67 118.98 2ayq s ASP 158 Ca -0.07 -0.67 0.02 0.00 0.71 0.00 0.00 52.55 52.53 2ayq s ASP 158 Cb -0.02 0.03 0.01 0.00 1.01 0.00 0.00 42.92 43.95 2ayq s ASP 158 CO -0.02 -0.24 -0.15 -0.89 0.21 0.00 0.00 175.17 174.07 2ayq s THR 159 N -1.90 1.51 -0.54 -1.27 2.01 -1.08 -4.95 115.64 109.42 2ayq s THR 159 Ca -0.03 -0.65 -0.21 0.00 0.31 0.00 0.00 61.69 61.11 2ayq s THR 159 Cb -0.06 -1.38 0.06 0.00 0.01 0.00 0.00 72.50 71.12 2ayq s THR 159 CO -0.00 0.44 0.77 -0.22 -0.69 0.00 0.00 174.62 174.92 2ayq s LEU 160 N 1.00 4.64 -0.17 4.42 2.96 -1.26 -3.42 118.68 126.86 2ayq s LEU 160 Ca -0.06 -0.75 0.01 0.00 -0.22 0.00 0.00 54.13 53.10 2ayq s LEU 160 Cb -0.15 -2.57 0.03 0.00 0.50 0.00 0.00 46.19 44.00 2ayq s LEU 160 CO -0.02 -1.07 -0.13 0.00 -1.32 0.00 0.00 176.35 173.82 2ayq s ALA 161 N 3.21 1.92 0.02 5.97 0.00 -1.23 -4.88 121.76 126.77 2ayq s ALA 161 Ca 0.21 -1.01 0.05 0.00 0.00 0.00 0.00 51.96 51.21 2ayq s ALA 161 Cb -0.17 -1.13 -0.02 0.00 0.00 0.00 0.00 23.12 21.80 2ayq s ALA 161 CO 0.14 -0.52 -0.15 0.71 0.00 0.00 0.00 175.76 175.94 2ayq s TYR 162 N 1.45 1.35 0.08 0.00 2.02 -1.26 -3.35 117.35 117.64 2ayq s TYR 162 Ca 0.03 -0.32 -0.01 0.00 -0.37 0.00 0.00 57.07 56.40 2ayq s TYR 162 Cb -0.14 -0.82 -0.04 0.00 -0.40 0.00 0.00 41.96 40.56 2ayq s TYR 162 CO -0.10 0.03 0.26 0.95 -1.57 0.00 0.00 175.55 175.11 2ayq s THR 163 N -0.67 5.33 0.31 -0.71 -4.23 -1.26 -4.98 115.64 109.43 2ayq s THR 163 Ca 0.04 -0.27 0.07 0.00 -1.18 0.00 0.00 61.69 60.34 2ayq s THR 163 Cb -0.07 -3.63 0.31 0.00 1.34 0.00 0.00 72.50 70.45 2ayq s THR 163 CO 0.01 0.11 1.79 -0.09 -0.54 0.00 0.00 174.62 175.90 2ayq h ARG 164 N 3.01 0.73 -0.06 3.99 2.43 -2.00 -1.39 114.38 121.08 2ayq h ARG 164 Ca -0.45 -0.04 -0.00 0.00 -0.81 0.00 0.00 59.98 58.67 2ayq h ARG 164 Cb 1.16 -0.17 -0.00 0.00 -0.42 0.00 0.00 29.97 30.54 2ayq h ARG 164 CO 0.75 0.48 0.03 1.49 -1.51 0.00 0.00 179.97 181.21 2ayq h GLU 165 N 0.75 0.09 -0.87 0.20 4.81 -1.99 -0.22 114.58 117.36 2ayq h GLU 165 Ca 0.56 -0.02 0.20 0.00 -0.13 0.00 0.00 59.36 59.98 2ayq h GLU 165 Cb 0.89 -0.02 -0.06 0.00 0.63 0.00 0.00 28.75 30.20 2ayq h GLU 165 CO -0.35 0.20 0.58 0.93 -0.73 0.00 0.00 179.01 179.64 2ayq h GLU 166 N -0.04 0.35 0.15 1.92 5.08 -1.66 0.53 114.58 120.92 2ayq h GLU 166 Ca 0.02 -0.02 -0.29 0.00 -1.00 0.00 0.00 59.36 58.07 2ayq h GLU 166 Cb 0.14 -0.08 0.01 0.00 0.50 0.00 0.00 28.75 29.32 2ayq h GLU 166 CO -0.00 0.23 -1.36 0.82 -1.00 0.00 0.00 179.01 177.70 2ayq h ILE 167 N 0.36 1.37 0.41 3.13 2.04 -1.18 -3.30 117.51 120.34 2ayq h ILE 167 Ca 0.45 -2.93 -0.02 0.00 1.00 0.00 0.00 64.86 63.36 2ayq h ILE 167 Cb 1.17 2.92 0.00 0.00 -0.74 0.00 0.00 36.82 40.17 2ayq h ILE 167 CO -0.15 0.86 -0.20 -0.33 0.00 0.00 0.00 178.15 178.34 2ayq h GLU 168 N 0.09 -0.53 -0.90 2.37 5.08 0.87 -2.57 114.58 119.00 2ayq h GLU 168 Ca -0.19 0.04 0.14 0.00 -1.00 0.00 0.00 59.36 58.35 2ayq h GLU 168 Cb 2.02 0.12 -0.09 0.00 0.50 0.00 0.00 28.75 31.30 2ayq h GLU 168 CO 0.21 -0.23 0.50 0.07 -1.00 0.00 0.00 179.01 178.55 2ayq h ARG 169 N -0.80 0.70 0.02 2.33 0.11 -1.23 -0.69 114.38 114.83 2ayq h ARG 169 Ca -0.06 -0.04 -0.00 0.00 0.10 0.00 0.00 59.98 59.98 2ayq h ARG 169 Cb 0.54 -0.16 0.00 0.00 1.11 0.00 0.00 29.97 31.46 2ayq h ARG 169 CO 0.09 0.47 -0.01 0.97 0.10 0.00 0.00 179.97 181.59 2ayq h ILE 170 N 0.72 1.37 0.00 0.08 2.10 -1.63 -2.38 117.51 117.77 2ayq h ILE 170 Ca 0.48 -1.21 -0.00 0.00 1.08 0.00 0.00 64.86 65.20 2ayq h ILE 170 Cb 0.63 2.19 -0.00 0.00 -1.09 0.00 0.00 36.82 38.55 2ayq h ILE 170 CO -0.34 0.31 -0.00 0.40 -1.08 0.00 0.00 178.15 177.44 2ayq h ILE 171 N -0.55 0.43 0.30 2.19 2.04 -1.02 0.20 117.51 121.09 2ayq h ILE 171 Ca -0.00 -0.01 -0.01 0.00 1.00 0.00 0.00 64.86 65.83 2ayq h ILE 171 Cb 0.53 1.01 0.00 0.00 -0.74 0.00 0.00 36.82 37.62 2ayq h ILE 171 CO 0.00 0.00 -0.14 -0.33 0.00 0.00 0.00 178.15 177.68 2ayq h GLU 172 N 0.00 -0.38 -0.96 2.37 4.39 -0.97 -2.55 114.58 116.48 2ayq h GLU 172 Ca -0.00 0.03 0.10 0.00 0.34 0.00 0.00 59.36 59.82 2ayq h GLU 172 Cb 0.01 0.09 -0.07 0.00 -0.10 0.00 0.00 28.75 28.67 2ayq h GLU 172 CO 0.00 -0.05 0.61 -0.22 -1.16 0.00 0.00 179.01 178.20 2ayq h LYS 173 N -0.91 0.97 -0.15 2.33 1.63 -0.76 -0.66 116.57 119.03 2ayq h LYS 173 Ca -0.04 -0.06 0.04 0.00 -0.85 0.00 0.00 60.65 59.74 2ayq h LYS 173 Cb 0.51 -0.22 -0.04 0.00 -0.60 0.00 0.00 32.23 31.88 2ayq h LYS 173 CO 0.07 0.64 -0.09 0.00 -3.45 0.00 0.00 179.45 176.62 2ayq h ALA 174 N 1.52 0.03 -0.17 5.00 0.00 -0.99 -0.17 119.26 124.48 2ayq h ALA 174 Ca 0.44 0.06 0.03 0.00 0.00 0.00 0.00 54.91 55.44 2ayq h ALA 174 Cb 0.36 0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.34 2ayq h ALA 174 CO -0.20 -0.54 0.01 0.74 0.00 0.00 0.00 179.25 179.26 2ayq h PHE 175 N -0.09 0.02 -0.34 0.00 0.04 -0.72 -0.72 116.94 115.12 2ayq h PHE 175 Ca 0.09 0.01 0.05 0.00 2.80 0.00 0.00 57.97 60.92 2ayq h PHE 175 Cb 0.22 0.02 -0.02 0.00 2.20 0.00 0.00 35.95 38.37 2ayq h PHE 175 CO -0.23 -0.01 0.23 1.96 -0.60 0.00 0.00 178.31 179.66 2ayq h GLN 176 N 0.07 0.25 0.23 1.51 4.20 -0.86 -0.31 115.11 120.21 2ayq h GLN 176 Ca 0.08 -0.02 -0.01 0.00 0.06 0.00 0.00 58.65 58.76 2ayq h GLN 176 Cb 0.09 -0.06 0.00 0.00 0.30 0.00 0.00 27.48 27.81 2ayq h GLN 176 CO -0.12 0.17 -0.11 -0.07 -0.67 0.00 0.00 178.83 178.02 2ayq h LEU 177 N 0.26 -0.27 -2.01 1.46 3.38 -0.08 -3.14 115.31 114.92 2ayq h LEU 177 Ca 0.15 -0.22 0.15 0.00 0.09 0.00 0.00 57.88 58.04 2ayq h LEU 177 Cb 0.26 0.07 -0.02 0.00 0.09 0.00 0.00 40.66 41.06 2ayq h LEU 177 CO -0.03 0.25 0.44 0.00 0.09 0.00 0.00 178.44 179.18 2ayq h ALA 178 N -0.59 2.38 -0.21 1.53 0.00 -0.84 0.12 119.26 121.65 2ayq h ALA 178 Ca -0.03 -0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.77 2ayq h ALA 178 Cb 0.47 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 2ayq h ALA 178 CO 0.05 -0.71 -0.25 0.37 0.00 0.00 0.00 179.25 178.72 2ayq h GLN 179 N 0.00 0.39 -0.14 0.00 4.15 -1.02 0.51 115.11 119.00 2ayq h GLN 179 Ca 0.25 -0.14 0.00 0.00 0.77 0.00 0.00 58.65 59.53 2ayq h GLN 179 Cb 1.12 -0.03 0.00 0.00 0.21 0.00 0.00 27.48 28.78 2ayq h GLN 179 CO -0.00 0.61 0.00 0.44 -1.93 0.00 0.00 178.83 177.95 2ayq n ILE 180 N -4.14 0.17 0.00 2.39 -5.35 0.38 -4.63 119.36 108.18 2ayq n ILE 180 Ca -0.01 -0.42 0.00 0.00 -0.27 0.00 0.00 62.75 62.05 2ayq n ILE 180 Cb 0.39 0.71 0.00 0.00 -1.74 0.00 0.00 39.64 38.99 2ayq n ILE 180 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 2ayq n ARG 181 N 0.67 0.59 -0.27 6.28 1.74 -0.96 -4.97 116.66 119.75 2ayq n ARG 181 Ca 0.17 0.00 0.04 0.00 -0.77 0.00 0.00 57.85 57.29 2ayq n ARG 181 Cb 0.43 0.00 0.15 0.00 -1.02 0.00 0.00 32.46 32.02 2ayq n ARG 181 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 2ayq n ARG 182 N 0.00 2.17 -3.84 5.56 1.74 -1.24 -4.92 116.66 116.13 2ayq n ARG 182 Ca 0.00 -1.18 -0.32 0.00 -0.77 0.00 0.00 57.85 55.58 2ayq n ARG 182 Cb 0.00 -1.54 0.02 0.00 -1.02 0.00 0.00 32.46 29.91 2ayq n ARG 182 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 2ayq n LYS 183 N 0.31 -1.63 -3.68 5.56 5.02 0.18 -4.99 118.16 118.93 2ayq n LYS 183 Ca 0.11 0.37 -0.14 0.00 -2.02 0.00 0.00 58.31 56.63 2ayq n LYS 183 Cb 0.46 -3.95 -0.14 0.00 -0.02 0.00 0.00 35.03 31.38 2ayq n LYS 183 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 2ayq s LYS 184 N -6.42 0.14 -0.03 1.97 1.02 -1.26 -2.85 119.74 112.30 2ayq s LYS 184 Ca 0.33 0.68 0.05 0.00 0.02 0.00 0.00 55.97 57.06 2ayq s LYS 184 Cb -0.14 -0.08 -0.01 0.00 -0.52 0.00 0.00 37.83 37.08 2ayq s LYS 184 CO 0.89 -0.27 -0.19 -1.17 -0.92 0.00 0.00 175.35 173.70 2ayq s LEU 185 N 2.20 1.98 -0.30 3.17 2.96 -0.19 -2.09 118.68 126.41 2ayq s LEU 185 Ca -0.00 -0.37 0.01 0.00 -0.22 0.00 0.00 54.13 53.55 2ayq s LEU 185 Cb -0.12 -1.02 0.07 0.00 0.50 0.00 0.00 46.19 45.62 2ayq s LEU 185 CO -0.08 0.19 -0.02 0.00 -1.32 0.00 0.00 176.35 175.12 2ayq s ALA 186 N -0.17 2.76 -0.43 5.97 0.00 -0.02 -1.14 121.76 128.73 2ayq s ALA 186 Ca 0.00 -1.93 -0.25 0.00 0.00 0.00 0.00 51.96 49.78 2ayq s ALA 186 Cb -0.10 -1.84 0.02 0.00 0.00 0.00 0.00 23.12 21.20 2ayq s ALA 186 CO 0.01 -1.34 0.92 0.45 0.00 0.00 0.00 175.76 175.80 2ayq s SER 187 N 1.19 6.55 -0.17 0.00 0.15 0.33 -1.45 113.70 120.31 2ayq s SER 187 Ca -0.03 0.24 -0.08 0.00 0.70 0.00 0.00 55.95 56.78 2ayq s SER 187 Cb -0.20 -2.45 -0.04 0.00 -1.71 0.00 0.00 66.02 61.61 2ayq s SER 187 CO -0.04 -0.99 0.11 -0.69 1.20 0.00 0.00 173.24 172.84 2ayq s VAL 188 N 3.65 5.24 0.00 4.45 1.01 -0.82 -0.90 120.40 133.03 2ayq s VAL 188 Ca 0.37 0.12 0.00 0.00 0.00 0.00 0.00 61.98 62.47 2ayq s VAL 188 Cb -0.11 -3.34 0.00 0.00 0.00 0.00 0.00 36.38 32.93 2ayq s VAL 188 CO 0.24 0.51 0.00 -0.90 0.00 0.00 0.00 175.10 174.95 2ayq n ASP 189 N 2.99 0.00 -2.55 3.32 5.68 0.29 -4.54 116.55 121.74 2ayq n ASP 189 Ca -0.17 -0.88 -0.14 0.00 -0.50 0.00 0.00 54.79 53.10 2ayq n ASP 189 Cb 0.53 0.00 0.03 0.00 -1.14 0.00 0.00 41.12 40.54 2ayq n ASP 189 CO 0.00 0.00 0.00 1.17 -1.33 0.00 0.00 177.20 177.04 2ayq n LYS 190 N 0.00 2.27 0.32 0.11 3.00 -1.26 -0.00 118.16 122.60 2ayq n LYS 190 Ca 0.00 -3.78 0.15 0.00 -0.00 0.00 0.00 58.31 54.68 2ayq n LYS 190 Cb 0.00 -1.76 0.76 0.00 0.00 0.00 0.00 35.03 34.03 2ayq n LYS 190 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2ayq h ALA 191 N 2.66 1.42 0.00 3.14 0.00 -1.84 0.75 119.26 125.39 2ayq h ALA 191 Ca 0.07 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.98 2ayq h ALA 191 Cb 1.20 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.99 2ayq h ALA 191 CO 0.55 -0.40 0.00 -2.95 0.00 0.00 0.00 179.25 176.45 2ayq h ASN 192 N 0.00 0.00 0.00 0.00 -0.00 -1.97 -3.42 115.58 110.20 2ayq h ASN 192 Ca 0.01 0.00 0.00 0.00 -0.00 0.00 0.00 56.30 56.31 2ayq h ASN 192 Cb 0.79 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 39.11 2ayq h ASN 192 CO -0.00 0.00 -0.16 0.52 -0.00 0.00 0.00 177.43 177.79 2ayq n VAL 193 N -2.54 0.40 -2.22 6.14 0.31 0.16 -5.08 118.33 115.49 2ayq n VAL 193 Ca 0.03 0.13 -0.41 0.00 -0.01 0.00 0.00 64.34 64.08 2ayq n VAL 193 Cb 0.32 -1.01 -0.03 0.00 -0.91 0.00 0.00 33.84 32.21 2ayq n VAL 193 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 2ayq s LEU 194 N -6.50 4.45 0.13 7.52 1.43 -0.64 -4.93 118.68 120.14 2ayq s LEU 194 Ca 0.00 2.51 -0.06 0.00 -1.03 0.00 0.00 54.13 55.55 2ayq s LEU 194 Cb 0.00 -3.63 -0.09 0.00 0.03 0.00 0.00 46.19 42.49 2ayq s LEU 194 CO 0.00 -0.45 1.31 -0.08 0.23 0.00 0.00 176.35 177.36 2ayq h GLU 195 N 4.10 0.46 -0.96 1.70 4.57 -1.91 -2.53 114.58 120.01 2ayq h GLU 195 Ca -0.47 -0.48 0.05 0.00 -1.18 0.00 0.00 59.36 57.28 2ayq h GLU 195 Cb 1.22 0.13 -0.06 0.00 -0.16 0.00 0.00 28.75 29.88 2ayq h GLU 195 CO 0.69 1.12 0.63 0.66 -1.18 0.00 0.00 179.01 180.94 2ayq h SER 196 N 0.27 1.03 -0.23 1.04 4.64 -1.94 -0.58 113.55 117.77 2ayq h SER 196 Ca -0.08 -0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.23 2ayq h SER 196 Cb 1.55 -0.23 -0.01 0.00 -0.31 0.00 0.00 62.40 63.40 2ayq h SER 196 CO 0.16 0.69 0.11 0.28 -0.87 0.00 0.00 176.83 177.20 2ayq h SER 197 N 1.18 0.31 -0.92 4.97 0.02 -1.84 -0.10 113.55 117.17 2ayq h SER 197 Ca 0.39 -0.14 0.08 0.00 -0.84 0.00 0.00 61.79 61.29 2ayq h SER 197 Cb 0.06 -0.08 -0.07 0.00 0.14 0.00 0.00 62.40 62.45 2ayq h SER 197 CO -0.13 0.36 0.57 0.03 -1.14 0.00 0.00 176.83 176.52 2ayq h ARG 198 N 0.24 0.98 -0.52 3.45 3.08 -0.73 0.25 114.38 121.13 2ayq h ARG 198 Ca 0.08 -0.06 -0.07 0.00 0.07 0.00 0.00 59.98 60.00 2ayq h ARG 198 Cb 0.14 -0.22 -0.02 0.00 0.08 0.00 0.00 29.97 29.95 2ayq h ARG 198 CO -0.01 0.65 0.06 1.98 -1.07 0.00 0.00 179.97 181.58 2ayq h MET 199 N 1.01 0.87 0.35 0.04 4.05 -0.76 -1.74 114.93 118.74 2ayq h MET 199 Ca 0.42 -0.25 -0.01 0.00 -0.28 0.00 0.00 59.70 59.58 2ayq h MET 199 Cb 0.26 -0.10 -0.01 0.00 -0.80 0.00 0.00 31.60 30.96 2ayq h MET 199 CO -0.20 0.87 -0.26 2.35 0.23 0.00 0.00 176.91 179.90 2ayq h TRP 200 N 0.75 -0.68 -0.92 1.39 2.91 0.60 -1.67 115.95 118.34 2ayq h TRP 200 Ca 0.15 -0.00 0.09 0.00 1.13 0.00 0.00 58.89 60.26 2ayq h TRP 200 Cb 0.44 0.25 -0.07 0.00 -0.51 0.00 0.00 29.16 29.27 2ayq h TRP 200 CO 0.03 -0.39 0.59 -0.09 -1.03 0.00 0.00 178.44 177.56 2ayq h ARG 201 N -0.60 0.92 0.39 2.65 2.43 -0.44 0.84 114.38 120.56 2ayq h ARG 201 Ca -0.03 -0.06 -0.02 0.00 -0.81 0.00 0.00 59.98 59.07 2ayq h ARG 201 Cb 0.52 -0.21 0.00 0.00 -0.42 0.00 0.00 29.97 29.86 2ayq h ARG 201 CO 0.00 0.61 -0.19 0.93 -1.51 0.00 0.00 179.97 179.81 2ayq h GLU 202 N 0.95 -0.50 -0.42 0.20 5.08 -1.03 -1.60 114.58 117.25 2ayq h GLU 202 Ca 0.42 0.03 0.02 0.00 -1.00 0.00 0.00 59.36 58.83 2ayq h GLU 202 Cb 0.36 0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.70 2ayq h GLU 202 CO -0.18 -0.28 0.28 0.82 -1.00 0.00 0.00 179.01 178.65 2ayq h ILE 203 N -0.61 1.06 0.14 3.13 2.04 -0.49 -0.15 117.51 122.64 2ayq h ILE 203 Ca -0.05 -0.17 -0.01 0.00 1.00 0.00 0.00 64.86 65.63 2ayq h ILE 203 Cb 0.45 0.52 0.00 0.00 -0.74 0.00 0.00 36.82 37.05 2ayq h ILE 203 CO 0.09 0.09 -0.07 0.00 0.00 0.00 0.00 178.15 178.26 2ayq h ALA 204 N 1.75 -0.19 -0.70 1.87 0.00 -0.57 -0.75 119.26 120.67 2ayq h ALA 204 Ca 0.16 -0.06 0.06 0.00 0.00 0.00 0.00 54.91 55.07 2ayq h ALA 204 Cb 0.04 0.07 -0.06 0.00 0.00 0.00 0.00 17.79 17.85 2ayq h ALA 204 CO -0.04 -0.58 0.40 1.49 0.00 0.00 0.00 179.25 180.52 2ayq h GLU 205 N -0.24 0.71 0.55 0.00 4.57 -0.21 -1.64 114.58 118.33 2ayq h GLU 205 Ca -0.02 -0.04 -0.03 0.00 -1.18 0.00 0.00 59.36 58.09 2ayq h GLU 205 Cb 0.19 -0.16 0.01 0.00 -0.16 0.00 0.00 28.75 28.62 2ayq h GLU 205 CO 0.03 0.47 -0.26 0.93 -1.18 0.00 0.00 179.01 179.00 2ayq h GLU 206 N 0.73 -0.71 -0.28 1.92 3.07 -0.80 -2.86 114.58 115.64 2ayq h GLU 206 Ca 0.31 0.05 0.08 0.00 -0.50 0.00 0.00 59.36 59.30 2ayq h GLU 206 Cb 0.19 0.16 -0.01 0.00 -0.84 0.00 0.00 28.75 28.25 2ayq h GLU 206 CO -0.18 -0.43 0.22 1.15 -1.40 0.00 0.00 179.01 178.37 2ayq h THR 207 N -0.85 0.73 -0.78 1.13 2.02 -0.98 -2.06 112.91 112.13 2ayq h THR 207 Ca -0.08 0.00 0.07 0.00 0.77 0.00 0.00 66.41 67.17 2ayq h THR 207 Cb 0.61 0.84 -0.06 0.00 -1.74 0.00 0.00 68.15 67.80 2ayq h THR 207 CO 0.12 0.00 0.46 0.00 0.37 0.00 0.00 175.52 176.47 2ayq h ALA 208 N 1.82 1.07 -0.55 6.16 0.00 -1.05 -0.98 119.26 125.73 2ayq h ALA 208 Ca 0.14 0.01 0.14 0.00 0.00 0.00 0.00 54.91 55.19 2ayq h ALA 208 Cb 0.58 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.18 2ayq h ALA 208 CO -0.00 0.15 0.38 1.57 0.00 0.00 0.00 179.25 181.35 2ayq h LYS 209 N 0.82 0.13 0.00 0.00 -0.00 -1.40 0.17 116.57 116.28 2ayq h LYS 209 Ca 0.35 -0.01 -0.06 0.00 -0.00 0.00 0.00 60.65 60.94 2ayq h LYS 209 Cb 0.22 -0.03 -0.01 0.00 -0.00 0.00 0.00 32.23 32.42 2ayq h LYS 209 CO -0.19 0.08 -0.27 1.57 -0.00 0.00 0.00 179.45 180.64 2ayq h LYS 210 N 0.13 0.00 -2.22 0.07 -0.00 -1.31 -3.33 116.57 109.90 2ayq h LYS 210 Ca 0.26 0.00 -0.59 0.00 -0.00 0.00 0.00 60.65 60.32 2ayq h LYS 210 Cb 0.86 0.00 -0.41 0.00 -0.00 0.00 0.00 32.23 32.68 2ayq h LYS 210 CO -0.03 0.27 -0.76 0.66 -0.00 0.00 0.00 179.45 179.59 2ayq n TYR 211 N -3.27 2.26 0.27 0.07 4.02 0.58 -4.94 117.16 116.15 2ayq n TYR 211 Ca 0.01 -3.96 0.16 0.00 -0.01 0.00 0.00 57.90 54.10 2ayq n TYR 211 Cb 0.54 -0.47 0.81 0.00 -0.02 0.00 0.00 39.34 40.20 2ayq n TYR 211 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 176.86 174.85 2ayq h PRO 212 N 4.29 0.00 0.00 -0.72 0.13 -1.65 -2.31 132.00 131.73 2ayq h PRO 212 Ca 0.16 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.29 2ayq h PRO 212 Cb 0.74 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.87 2ayq h PRO 212 CO 0.70 0.00 -0.27 0.38 -0.23 0.00 0.00 178.00 178.58 2ayq h ASP 213 N 0.00 0.00 -3.41 1.44 3.04 -1.92 -3.45 116.42 112.13 2ayq h ASP 213 Ca 0.00 0.00 -0.59 0.00 -3.24 0.00 0.00 57.03 53.20 2ayq h ASP 213 Cb 0.12 0.00 -0.09 0.00 -1.04 0.00 0.00 39.33 38.32 2ayq h ASP 213 CO 0.00 0.02 -0.07 -0.69 -2.04 0.00 0.00 179.24 176.46 2ayq s VAL 214 N -3.24 5.13 -0.47 4.15 1.01 -0.87 -4.89 120.40 121.23 2ayq s VAL 214 Ca 0.05 0.97 -0.29 0.00 0.00 0.00 0.00 61.98 62.71 2ayq s VAL 214 Cb 0.06 -3.84 0.03 0.00 0.00 0.00 0.00 36.38 32.63 2ayq s VAL 214 CO 0.70 0.23 1.12 -0.70 0.00 0.00 0.00 175.10 176.45 2ayq s GLU 215 N 1.25 3.73 -0.08 2.72 2.12 -1.13 -4.91 118.70 122.40 2ayq s GLU 215 Ca 0.25 0.57 -0.20 0.00 0.36 0.00 0.00 54.97 55.95 2ayq s GLU 215 Cb -0.15 -3.90 -0.04 0.00 0.26 0.00 0.00 34.13 30.30 2ayq s GLU 215 CO 0.10 -1.34 0.56 -1.17 -0.54 0.00 0.00 175.26 172.87 2ayq s LEU 216 N 4.35 4.32 0.05 2.70 2.96 -1.26 -1.03 118.68 130.78 2ayq s LEU 216 Ca 0.47 0.99 0.05 0.00 -0.22 0.00 0.00 54.13 55.42 2ayq s LEU 216 Cb -0.08 -2.84 -0.02 0.00 0.50 0.00 0.00 46.19 43.74 2ayq s LEU 216 CO 0.30 -0.00 -0.14 -0.44 -1.32 0.00 0.00 176.35 174.74 2ayq s SER 217 N 0.47 1.70 -0.12 3.68 0.01 -0.30 -4.99 113.70 114.15 2ayq s SER 217 Ca 0.30 -0.51 0.01 0.00 1.31 0.00 0.00 55.95 57.06 2ayq s SER 217 Cb -0.16 -0.09 -0.01 0.00 0.21 0.00 0.00 66.02 65.97 2ayq s SER 217 CO 0.14 0.00 -0.17 -1.00 0.41 0.00 0.00 173.24 172.62 2ayq s HIS 218 N -0.99 2.73 0.03 2.43 3.76 -1.26 -0.51 115.29 121.48 2ayq s HIS 218 Ca 0.01 -0.80 0.03 0.00 -0.15 0.00 0.00 55.06 54.14 2ayq s HIS 218 Cb -0.09 -1.81 -0.02 0.00 1.11 0.00 0.00 32.58 31.78 2ayq s HIS 218 CO 0.02 -0.30 -0.09 -1.64 -0.85 0.00 0.00 174.74 171.88 2ayq s MET 219 N 0.39 0.62 0.02 1.40 -1.94 -0.08 -4.96 119.30 114.75 2ayq s MET 219 Ca -0.13 -0.63 -0.23 0.00 -1.71 0.00 0.00 55.69 52.99 2ayq s MET 219 Cb -0.17 -0.51 -0.05 0.00 2.01 0.00 0.00 34.83 36.11 2ayq s MET 219 CO 0.06 0.12 0.69 -0.51 -0.01 0.00 0.00 175.02 175.37 2ayq s LEU 220 N -1.14 4.43 0.24 -0.03 1.43 -1.25 -0.55 118.68 121.82 2ayq s LEU 220 Ca -0.04 1.32 -0.07 0.00 -1.03 0.00 0.00 54.13 54.31 2ayq s LEU 220 Cb -0.08 -3.10 0.39 0.00 0.03 0.00 0.00 46.19 43.43 2ayq s LEU 220 CO 0.01 0.05 1.35 0.55 0.23 0.00 0.00 176.35 178.53 2ayq n VAL 221 N 2.79 -0.37 0.17 -1.59 3.14 1.00 0.11 118.33 123.59 2ayq n VAL 221 Ca -0.04 1.98 0.06 0.00 -2.96 0.00 0.00 64.34 63.38 2ayq n VAL 221 Cb 0.51 -2.73 0.54 0.00 -1.06 0.00 0.00 33.84 31.10 2ayq n VAL 221 CO 0.00 0.00 0.00 -2.24 -6.46 0.00 0.00 176.83 168.13 2ayq h ASP 222 N 0.00 0.14 -0.04 6.55 2.03 -1.93 -1.67 116.42 121.51 2ayq h ASP 222 Ca 0.41 -0.01 -0.08 0.00 -0.73 0.00 0.00 57.03 56.62 2ayq h ASP 222 Cb 0.62 -0.04 0.00 0.00 -0.83 0.00 0.00 39.33 39.09 2ayq h ASP 222 CO -0.89 0.15 -0.29 0.28 -1.03 0.00 0.00 179.24 177.46 2ayq h SER 223 N 0.17 0.33 -0.80 4.15 0.02 -0.72 -3.10 113.55 113.60 2ayq h SER 223 Ca 0.04 -0.69 0.17 0.00 -0.84 0.00 0.00 61.79 60.47 2ayq h SER 223 Cb 0.06 -0.10 -0.05 0.00 0.14 0.00 0.00 62.40 62.45 2ayq h SER 223 CO -0.00 0.97 0.54 0.74 -1.14 0.00 0.00 176.83 177.93 2ayq h THR 224 N -0.29 0.75 0.10 -2.27 2.02 -0.95 0.59 112.91 112.86 2ayq h THR 224 Ca -0.03 -0.14 0.02 0.00 0.77 0.00 0.00 66.41 67.03 2ayq h THR 224 Cb 0.98 0.32 -0.03 0.00 -1.74 0.00 0.00 68.15 67.68 2ayq h THR 224 CO 0.06 0.07 -0.20 -1.28 0.37 0.00 0.00 175.52 174.54 2ayq h SER 225 N 0.40 -0.57 -0.44 4.18 0.87 -1.24 0.27 113.55 117.03 2ayq h SER 225 Ca 0.40 0.07 -0.06 0.00 -1.23 0.00 0.00 61.79 60.97 2ayq h SER 225 Cb 0.97 0.22 -0.02 0.00 -0.44 0.00 0.00 62.40 63.13 2ayq h SER 225 CO -0.13 -0.29 0.05 0.24 -0.53 0.00 0.00 176.83 176.17 2ayq h MET 226 N -0.39 0.73 0.00 2.24 2.86 -1.05 -3.01 114.93 116.32 2ayq h MET 226 Ca 0.03 -0.21 -0.03 0.00 -2.06 0.00 0.00 59.70 57.44 2ayq h MET 226 Cb 0.41 -0.08 -0.00 0.00 0.06 0.00 0.00 31.60 31.98 2ayq h MET 226 CO -0.12 0.77 -0.12 1.96 1.06 0.00 0.00 176.91 180.46 2ayq h GLN 227 N 0.59 0.00 0.00 1.72 1.08 -0.48 0.31 115.11 118.34 2ayq h GLN 227 Ca 0.13 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.33 2ayq h GLN 227 Cb 0.41 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.84 2ayq h GLN 227 CO 0.01 0.12 0.00 -0.07 -0.95 0.00 0.00 178.83 177.94 2ayq h LEU 228 N 0.00 0.00 0.00 1.46 3.38 -0.34 -0.00 115.31 119.81 2ayq h LEU 228 Ca -0.00 0.00 -0.44 0.00 0.09 0.00 0.00 57.88 57.53 2ayq h LEU 228 Cb 0.22 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 40.90 2ayq h LEU 228 CO 0.02 0.00 -2.43 -0.38 0.09 0.00 0.00 178.44 175.73 2ayq n ILE 229 N -2.46 1.53 1.33 1.22 5.41 -0.20 -4.16 119.36 122.03 2ayq n ILE 229 Ca 0.02 -0.38 0.13 0.00 1.00 0.00 0.00 62.75 63.52 2ayq n ILE 229 Cb 0.27 -1.84 0.40 0.00 -0.71 0.00 0.00 39.64 37.76 2ayq n ILE 229 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2ayq n ALA 230 N -4.06 2.83 -2.66 -1.39 0.00 -0.07 -4.61 120.51 110.55 2ayq n ALA 230 Ca -0.52 -0.46 -0.04 0.00 0.00 0.00 0.00 53.44 52.42 2ayq n ALA 230 Cb 0.88 -1.11 0.04 0.00 0.00 0.00 0.00 19.45 19.27 2ayq n ALA 230 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 2ayq n ASN 231 N -0.09 -1.28 0.08 0.00 2.85 -0.11 -4.98 115.26 111.72 2ayq n ASN 231 Ca 0.15 -1.87 0.07 0.00 -0.11 0.00 0.00 54.58 52.82 2ayq n ASN 231 Cb 0.38 0.88 0.33 0.00 1.24 0.00 0.00 39.78 42.61 2ayq n ASN 231 CO 0.00 0.00 0.00 -0.81 -2.11 0.00 0.00 177.26 174.34 2ayq n PRO 232 N -0.58 0.08 0.28 1.20 -0.04 -0.64 -2.29 135.00 133.01 2ayq n PRO 232 Ca -0.17 0.49 0.17 0.00 -0.04 0.00 0.00 63.50 63.94 2ayq n PRO 232 Cb 0.71 -1.71 0.75 0.00 -0.04 0.00 0.00 33.50 33.21 2ayq n PRO 232 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 2ayq h GLY 233 N 0.85 0.00 1.82 0.55 0.00 -1.87 -3.09 103.07 101.34 2ayq h GLY 233 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 47.33 47.21 2ayq h GLY 233 CO 0.00 0.00 -0.50 0.06 0.00 0.00 0.00 176.54 176.10 2ayq h GLN 234 N 0.00 0.20 -6.72 4.80 3.07 -1.83 -3.45 115.11 111.17 2ayq h GLN 234 Ca -0.00 -0.11 -0.51 0.00 0.09 0.00 0.00 58.65 58.12 2ayq h GLN 234 Cb 0.43 0.01 0.02 0.00 0.08 0.00 0.00 27.48 28.02 2ayq h GLN 234 CO 0.01 0.65 0.51 -0.06 0.09 0.00 0.00 178.83 180.03 2ayq s PHE 235 N -3.95 3.52 0.00 0.06 0.08 -1.17 -4.96 117.98 111.56 2ayq s PHE 235 Ca -0.04 1.57 0.00 0.00 0.12 0.00 0.00 56.93 58.58 2ayq s PHE 235 Cb 0.13 -3.34 0.00 0.00 -0.57 0.00 0.00 43.02 39.24 2ayq s PHE 235 CO 0.78 -0.83 0.00 -3.47 -0.10 0.00 0.00 175.22 171.60 2ayq n ASP 236 N 1.97 0.00 -4.26 1.36 2.03 -1.26 -4.19 116.55 112.20 2ayq n ASP 236 Ca 0.02 0.00 -0.31 0.00 0.52 0.00 0.00 54.79 55.02 2ayq n ASP 236 Cb 0.45 -0.11 -0.16 0.00 -0.72 0.00 0.00 41.12 40.58 2ayq n ASP 236 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 2ayq s VAL 237 N -0.44 1.97 -0.13 5.18 1.01 -0.89 -1.58 120.40 125.52 2ayq s VAL 237 Ca 0.00 -1.03 0.01 0.00 0.00 0.00 0.00 61.98 60.96 2ayq s VAL 237 Cb 0.00 -1.66 0.02 0.00 0.00 0.00 0.00 36.38 34.74 2ayq s VAL 237 CO 0.00 0.55 -0.15 -0.63 0.00 0.00 0.00 175.10 174.87 2ayq s ILE 238 N -0.25 1.56 -0.01 2.22 1.01 -0.70 -0.84 121.20 124.19 2ayq s ILE 238 Ca -0.00 -0.65 0.02 0.00 0.00 0.00 0.00 60.65 60.02 2ayq s ILE 238 Cb -0.12 -1.44 -0.03 0.00 0.01 0.00 0.00 42.46 40.87 2ayq s ILE 238 CO 0.02 0.45 -0.05 0.54 0.00 0.00 0.00 174.94 175.91 2ayq s VAL 239 N 1.22 3.78 0.09 2.92 0.11 -0.53 -0.01 120.40 127.98 2ayq s VAL 239 Ca -0.01 -0.68 -0.26 0.00 -2.93 0.00 0.00 61.98 58.10 2ayq s VAL 239 Cb -0.14 -2.64 0.08 0.00 -1.53 0.00 0.00 36.38 32.16 2ayq s VAL 239 CO -0.06 0.43 0.83 -0.89 -3.33 0.00 0.00 175.10 172.08 2ayq s THR 240 N -0.98 0.00 1.11 5.04 2.01 -0.74 -1.95 115.64 120.13 2ayq s THR 240 Ca 0.17 -0.22 -0.19 0.00 0.31 0.00 0.00 61.69 61.76 2ayq s THR 240 Cb -0.11 -1.30 0.28 0.00 0.01 0.00 0.00 72.50 71.38 2ayq s THR 240 CO 0.07 0.00 0.90 -1.84 -0.69 0.00 0.00 174.62 173.06 2ayq n GLU 241 N -0.34 -3.24 0.02 4.92 0.28 -1.26 -2.01 120.64 119.02 2ayq n GLU 241 Ca -0.10 -1.45 -0.01 0.00 -0.16 0.00 0.00 57.16 55.45 2ayq n GLU 241 Cb 0.62 -1.46 -0.00 0.00 1.43 0.00 0.00 31.44 32.02 2ayq n GLU 241 CO 0.00 0.00 0.00 -0.97 -0.16 0.00 0.00 177.13 176.00 2ayq h ASN 242 N -2.70 -0.05 -0.39 -1.84 -0.73 -1.78 -0.49 115.58 107.59 2ayq h ASN 242 Ca -0.35 0.00 0.08 0.00 1.87 0.00 0.00 56.30 57.90 2ayq h ASN 242 Cb 1.10 0.01 -0.07 0.00 0.27 0.00 0.00 38.32 39.63 2ayq h ASN 242 CO 0.23 -0.04 -0.04 -0.03 -0.37 0.00 0.00 177.43 177.18 2ayq h MET 243 N -0.06 0.05 -0.39 6.67 4.05 -1.88 0.09 114.93 123.45 2ayq h MET 243 Ca -0.01 -0.00 -0.07 0.00 -0.28 0.00 0.00 59.70 59.34 2ayq h MET 243 Cb 0.05 -0.01 -0.01 0.00 -0.80 0.00 0.00 31.60 30.82 2ayq h MET 243 CO 0.01 0.04 -0.02 0.74 0.23 0.00 0.00 176.91 177.91 2ayq h PHE 244 N 0.06 0.78 -0.31 1.39 0.04 -1.96 -3.02 116.94 113.91 2ayq h PHE 244 Ca 0.19 -0.14 0.04 0.00 2.80 0.00 0.00 57.97 60.86 2ayq h PHE 244 Cb 0.28 -0.20 -0.04 0.00 2.20 0.00 0.00 35.95 38.20 2ayq h PHE 244 CO -0.30 0.80 0.10 0.78 -0.60 0.00 0.00 178.31 179.09 2ayq h GLY 245 N 0.53 0.39 -0.17 -1.45 0.00 -0.54 -1.19 103.07 100.64 2ayq h GLY 245 Ca 0.11 -0.06 0.10 0.00 0.00 0.00 0.00 47.33 47.49 2ayq h GLY 245 CO 0.02 0.02 -0.21 -1.80 0.00 0.00 0.00 176.54 174.58 2ayq h ASP 246 N 0.23 -0.72 0.85 0.19 3.58 -0.93 0.12 116.42 119.74 2ayq h ASP 246 Ca 0.14 0.18 -0.04 0.00 0.42 0.00 0.00 57.03 57.73 2ayq h ASP 246 Cb 0.12 0.41 0.01 0.00 1.72 0.00 0.00 39.33 41.59 2ayq h ASP 246 CO -0.15 -0.23 -0.41 0.40 -2.88 0.00 0.00 179.24 175.96 2ayq h ILE 247 N -0.08 0.00 -0.84 2.25 2.04 -1.30 -3.04 117.51 116.54 2ayq h ILE 247 Ca 0.24 -0.11 0.15 0.00 1.00 0.00 0.00 64.86 66.15 2ayq h ILE 247 Cb 0.46 0.00 -0.09 0.00 -0.74 0.00 0.00 36.82 36.45 2ayq h ILE 247 CO -0.58 0.00 0.43 -0.07 0.00 0.00 0.00 178.15 177.92 2ayq h LEU 248 N -1.24 0.51 -0.27 1.44 3.38 -0.90 -1.61 115.31 116.61 2ayq h LEU 248 Ca -0.12 0.09 0.07 0.00 0.09 0.00 0.00 57.88 58.01 2ayq h LEU 248 Cb 0.87 0.02 -0.07 0.00 0.09 0.00 0.00 40.66 41.56 2ayq h LEU 248 CO 0.19 0.21 -0.23 0.28 0.09 0.00 0.00 178.44 178.98 2ayq h SER 249 N 0.61 -0.76 -0.66 -0.43 0.02 -0.74 -0.07 113.55 111.51 2ayq h SER 249 Ca 0.46 0.14 -0.02 0.00 -0.84 0.00 0.00 61.79 61.53 2ayq h SER 249 Cb 0.66 0.37 -0.03 0.00 0.14 0.00 0.00 62.40 63.53 2ayq h SER 249 CO -0.37 -0.27 0.32 0.44 -1.14 0.00 0.00 176.83 175.81 2ayq h ASP 250 N -0.22 0.87 0.20 3.07 5.19 -1.22 -2.50 116.42 121.80 2ayq h ASP 250 Ca 0.15 -0.13 0.01 0.00 -0.62 0.00 0.00 57.03 56.43 2ayq h ASP 250 Cb 0.45 -0.22 -0.02 0.00 0.18 0.00 0.00 39.33 39.71 2ayq h ASP 250 CO -0.40 0.75 -0.25 -0.08 -3.12 0.00 0.00 179.24 176.14 2ayq h GLU 251 N 0.92 -0.49 -0.09 3.56 4.81 -0.41 -2.30 114.58 120.58 2ayq h GLU 251 Ca 0.23 0.03 0.03 0.00 -0.13 0.00 0.00 59.36 59.52 2ayq h GLU 251 Cb 0.12 0.11 -0.00 0.00 0.63 0.00 0.00 28.75 29.61 2ayq h GLU 251 CO -0.03 -0.33 0.13 0.00 -0.73 0.00 0.00 179.01 178.05 2ayq h ALA 252 N 0.18 1.57 -0.00 2.92 0.00 -0.85 -2.96 119.26 120.11 2ayq h ALA 252 Ca 0.01 -0.00 0.01 0.00 0.00 0.00 0.00 54.91 54.93 2ayq h ALA 252 Cb 0.49 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.27 2ayq h ALA 252 CO -0.09 -0.18 -0.08 0.77 0.00 0.00 0.00 179.25 179.68 2ayq h SER 253 N 0.00 -0.23 0.47 0.00 0.02 -0.96 -3.10 113.55 109.75 2ayq h SER 253 Ca 0.04 0.04 -0.07 0.00 -0.84 0.00 0.00 61.79 60.95 2ayq h SER 253 Cb 0.30 0.10 -0.01 0.00 0.14 0.00 0.00 62.40 62.93 2ayq h SER 253 CO -0.00 -0.11 -0.35 -0.37 -1.14 0.00 0.00 176.83 174.85 2ayq h VAL 254 N -0.13 1.11 -0.96 2.27 -1.51 -1.62 -3.35 116.25 112.06 2ayq h VAL 254 Ca 0.03 -1.27 0.20 0.00 -1.23 0.00 0.00 66.70 64.44 2ayq h VAL 254 Cb 0.18 1.71 -0.11 0.00 -2.13 0.00 0.00 31.29 30.93 2ayq h VAL 254 CO -0.08 0.34 0.54 0.16 -1.23 0.00 0.00 177.57 177.30 2ayq h ILE 255 N 0.00 0.62 0.00 7.19 3.07 -1.66 -2.74 117.51 124.00 2ayq h ILE 255 Ca -0.00 -0.21 -0.10 0.00 1.55 0.00 0.00 64.86 66.09 2ayq h ILE 255 Cb 0.68 -0.06 -0.02 0.00 -0.27 0.00 0.00 36.82 37.16 2ayq h ILE 255 CO 0.05 0.11 -1.10 0.71 -1.05 0.00 0.00 178.15 176.87 2ayq h THR 256 N 0.63 0.36 0.00 0.16 1.35 -1.76 -3.39 112.91 110.25 2ayq h THR 256 Ca 0.57 -1.65 0.00 0.00 -0.55 0.00 0.00 66.41 64.78 2ayq h THR 256 Cb 0.97 1.91 0.00 0.00 -1.73 0.00 0.00 68.15 69.30 2ayq h THR 256 CO -0.43 0.20 0.00 0.61 -0.25 0.00 0.00 175.52 175.65 2ayq n GLY 257 N 1.29 0.76 0.52 5.82 0.00 -1.03 -4.12 105.19 108.44 2ayq n GLY 257 Ca -0.04 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.06 2ayq n GLY 257 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2ayq n SER 258 N 0.00 1.55 -4.74 1.61 3.41 -1.26 -4.87 113.62 109.32 2ayq n SER 258 Ca 0.00 -1.80 -0.42 0.00 -0.26 0.00 0.00 58.87 56.39 2ayq n SER 258 Cb 0.00 -0.14 -0.02 0.00 -0.26 0.00 0.00 64.21 63.79 2ayq n SER 258 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 2ayq s LEU 259 N -1.34 4.35 0.00 1.04 2.96 -1.26 -1.39 118.68 123.04 2ayq s LEU 259 Ca 0.27 2.94 0.00 0.00 -0.22 0.00 0.00 54.13 57.12 2ayq s LEU 259 Cb 0.14 -3.62 0.00 0.00 0.50 0.00 0.00 46.19 43.21 2ayq s LEU 259 CO 0.21 -0.94 0.00 0.61 -1.32 0.00 0.00 176.35 174.91 2ayq n GLY 260 N 2.70 1.58 1.05 7.98 0.00 -1.26 -4.82 105.19 112.41 2ayq n GLY 260 Ca 0.10 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.16 2ayq n GLY 260 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 2ayq n MET 261 N -0.16 1.09 -3.36 1.61 0.00 -0.49 -4.55 117.12 111.27 2ayq n MET 261 Ca 0.00 -2.87 -0.38 0.00 0.00 0.00 0.00 57.70 54.45 2ayq n MET 261 Cb 0.00 -1.05 -0.06 0.00 0.00 0.00 0.00 33.22 32.10 2ayq n MET 261 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 175.97 175.46 2ayq s LEU 262 N -2.08 4.25 0.52 3.17 1.43 -1.22 -4.22 118.68 120.52 2ayq s LEU 262 Ca 0.37 0.71 0.05 0.00 -1.03 0.00 0.00 54.13 54.23 2ayq s LEU 262 Cb 0.38 -2.61 0.04 0.00 0.03 0.00 0.00 46.19 44.03 2ayq s LEU 262 CO -0.10 -0.00 0.71 -2.16 0.23 0.00 0.00 176.35 175.03 2ayq s PRO 263 N 0.75 2.54 0.19 1.29 0.04 -1.26 -1.24 135.00 137.30 2ayq s PRO 263 Ca 0.23 -1.16 -0.18 0.00 0.04 0.00 0.00 61.00 59.93 2ayq s PRO 263 Cb -0.15 -2.62 0.03 0.00 0.04 0.00 0.00 34.50 31.81 2ayq s PRO 263 CO 0.09 -0.63 0.52 -1.54 0.04 0.00 0.00 177.00 175.48 2ayq s SER 264 N -4.47 -0.28 -0.02 6.66 1.04 -0.78 -4.32 113.70 111.53 2ayq s SER 264 Ca 0.58 -0.44 -0.08 0.00 0.48 0.00 0.00 55.95 56.49 2ayq s SER 264 Cb -0.09 0.57 0.01 0.00 0.10 0.00 0.00 66.02 66.61 2ayq s SER 264 CO 0.37 -1.03 0.17 0.00 0.98 0.00 0.00 173.24 173.73 2ayq s ALA 265 N -3.86 -0.42 -0.36 5.32 0.00 -0.74 -2.68 121.76 119.01 2ayq s ALA 265 Ca 0.08 0.12 0.01 0.00 0.00 0.00 0.00 51.96 52.17 2ayq s ALA 265 Cb -0.01 -0.02 0.11 0.00 0.00 0.00 0.00 23.12 23.20 2ayq s ALA 265 CO -0.04 -0.18 0.13 -1.12 0.00 0.00 0.00 175.76 174.55 2ayq s SER 266 N -0.93 4.16 0.59 0.00 0.01 -0.11 0.28 113.70 117.70 2ayq s SER 266 Ca -0.10 -2.10 0.06 0.00 1.31 0.00 0.00 55.95 55.12 2ayq s SER 266 Cb -0.05 -1.16 0.08 0.00 0.21 0.00 0.00 66.02 65.10 2ayq s SER 266 CO 0.01 -0.36 0.81 -0.76 0.41 0.00 0.00 173.24 173.35 2ayq s LEU 267 N 1.01 3.17 0.00 2.44 1.43 0.68 -2.04 118.68 125.36 2ayq s LEU 267 Ca 0.12 -0.58 0.00 0.00 -1.03 0.00 0.00 54.13 52.64 2ayq s LEU 267 Cb -0.20 -1.99 0.00 0.00 0.03 0.00 0.00 46.19 44.03 2ayq s LEU 267 CO -0.13 -1.37 0.00 -2.11 0.23 0.00 0.00 176.35 172.97 2ayq n ARG 268 N -2.35 0.29 -0.20 1.70 1.85 -1.24 -1.65 116.66 115.06 2ayq n ARG 268 Ca 0.14 0.00 -0.08 0.00 -1.00 0.00 0.00 57.85 56.91 2ayq n ARG 268 Cb 0.61 0.00 0.02 0.00 -1.05 0.00 0.00 32.46 32.04 2ayq n ARG 268 CO 0.00 0.00 0.00 0.77 -0.01 0.00 0.00 177.63 178.39 2ayq h SER 269 N 0.00 0.85 -3.19 2.89 0.02 -1.90 -3.46 113.55 108.75 2ayq h SER 269 Ca 0.00 -0.21 0.00 0.00 -0.84 0.00 0.00 61.79 60.74 2ayq h SER 269 Cb 0.00 -0.22 0.00 0.00 0.14 0.00 0.00 62.40 62.32 2ayq h SER 269 CO 0.00 0.84 0.00 -0.90 -1.14 0.00 0.00 176.83 175.63 2ayq n ASP 270 N -4.41 0.00 -0.55 3.07 5.75 -1.26 -4.99 116.55 114.16 2ayq n ASP 270 Ca 0.03 -0.67 0.00 0.00 -0.01 0.00 0.00 54.79 54.14 2ayq n ASP 270 Cb 0.21 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.30 2ayq n ASP 270 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 2ayq n ARG 271 N -0.67 0.80 -3.99 0.11 1.74 -1.26 -4.81 116.66 108.57 2ayq n ARG 271 Ca 0.00 0.00 -0.28 0.00 -0.77 0.00 0.00 57.85 56.80 2ayq n ARG 271 Cb 0.00 -1.37 -0.04 0.00 -1.02 0.00 0.00 32.46 30.03 2ayq n ARG 271 CO 0.00 0.00 0.00 0.12 -1.52 0.00 0.00 177.63 176.23 2ayq s PHE 272 N -0.87 3.37 -0.12 -1.55 2.19 -1.26 -4.38 117.98 115.36 2ayq s PHE 272 Ca 0.00 0.12 -0.33 0.00 0.33 0.00 0.00 56.93 57.05 2ayq s PHE 272 Cb 0.00 -1.65 0.13 0.00 -1.31 0.00 0.00 43.02 40.19 2ayq s PHE 272 CO 0.00 0.54 1.14 0.20 1.83 0.00 0.00 175.22 178.93 2ayq s GLY 273 N -2.86 -0.34 -0.17 13.12 0.00 -1.26 -3.67 107.32 112.14 2ayq s GLY 273 Ca 0.33 1.32 -0.00 0.00 0.00 0.00 0.00 44.72 46.37 2ayq s GLY 273 CO 0.26 0.43 -0.14 -0.29 0.00 0.00 0.00 173.10 173.35 2ayq s MET 274 N -2.60 3.20 -0.09 2.90 1.75 -0.87 -1.56 119.30 122.03 2ayq s MET 274 Ca 0.09 -0.75 0.03 0.00 -1.25 0.00 0.00 55.69 53.81 2ayq s MET 274 Cb -0.00 -2.68 -0.01 0.00 2.84 0.00 0.00 34.83 34.98 2ayq s MET 274 CO -0.05 -0.06 -0.17 0.71 -0.65 0.00 0.00 175.02 174.79 2ayq s TYR 275 N 1.02 2.68 0.12 4.11 1.51 -0.25 -0.93 117.35 125.60 2ayq s TYR 275 Ca -0.01 -0.59 -0.19 0.00 -1.01 0.00 0.00 57.07 55.27 2ayq s TYR 275 Cb -0.15 -1.72 0.04 0.00 -0.11 0.00 0.00 41.96 40.03 2ayq s TYR 275 CO -0.03 -0.14 0.46 -1.83 -1.11 0.00 0.00 175.55 172.90 2ayq s GLU 276 N -0.03 1.10 0.51 -0.62 1.03 -1.09 -0.59 118.70 119.00 2ayq s GLU 276 Ca -0.05 -0.57 -0.19 0.00 0.03 0.00 0.00 54.97 54.20 2ayq s GLU 276 Cb -0.14 0.49 -0.08 0.00 -0.80 0.00 0.00 34.13 33.60 2ayq s GLU 276 CO 0.04 -0.43 1.02 -1.25 -1.33 0.00 0.00 175.26 173.31 2ayq s PRO 277 N -3.51 3.79 0.14 -4.83 0.04 -1.26 -1.88 135.00 127.49 2ayq s PRO 277 Ca 0.01 1.20 -0.13 0.00 0.04 0.00 0.00 61.00 62.12 2ayq s PRO 277 Cb 0.01 -2.10 -0.02 0.00 0.04 0.00 0.00 34.50 32.43 2ayq s PRO 277 CO -0.10 -0.42 1.54 0.28 0.04 0.00 0.00 177.00 178.34 2ayq h VAL 278 N 1.24 1.27 -3.39 -0.36 2.07 -1.45 -3.46 116.25 112.17 2ayq h VAL 278 Ca -0.48 -1.23 -0.54 0.00 0.82 0.00 0.00 66.70 65.27 2ayq h VAL 278 Cb 1.21 1.18 0.20 0.00 -1.52 0.00 0.00 31.29 32.35 2ayq h VAL 278 CO 0.59 0.42 -0.42 0.00 0.02 0.00 0.00 177.57 178.18 2ayq n HIS 279 N -4.28 -0.93 -0.54 1.57 1.44 -1.26 -5.02 115.22 106.19 2ayq n HIS 279 Ca -0.01 0.30 0.00 0.00 -2.01 0.00 0.00 57.72 56.00 2ayq n HIS 279 Cb 0.38 -1.87 0.00 0.00 0.12 0.00 0.00 29.99 28.62 2ayq n HIS 279 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 2ayq n GLY 280 N 1.49 -0.52 0.09 -1.39 0.00 -1.26 -4.88 105.19 98.72 2ayq n GLY 280 Ca 0.09 -1.69 -0.04 0.00 0.00 0.00 0.00 46.02 44.38 2ayq n GLY 280 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2ayq h SER 281 N 0.00 0.00 -6.60 1.61 4.64 -1.85 -3.46 113.55 107.89 2ayq h SER 281 Ca 0.00 0.00 -0.48 0.00 -0.47 0.00 0.00 61.79 60.84 2ayq h SER 281 Cb 0.00 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.10 2ayq h SER 281 CO 0.00 0.80 -0.95 0.00 -0.87 0.00 0.00 176.83 175.81 2ayq n ALA 282 N -2.37 -2.67 0.19 5.18 0.00 -1.26 -0.47 120.51 119.11 2ayq n ALA 282 Ca -0.05 -0.35 0.10 0.00 0.00 0.00 0.00 53.44 53.14 2ayq n ALA 282 Cb 0.90 -2.13 0.55 0.00 0.00 0.00 0.00 19.45 18.77 2ayq n ALA 282 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 2ayq h PRO 283 N -1.37 0.00 -0.37 0.00 0.13 -1.93 -2.00 132.00 126.46 2ayq h PRO 283 Ca -0.62 0.00 -0.16 0.00 -0.87 0.00 0.00 66.00 64.35 2ayq h PRO 283 Cb 1.36 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.49 2ayq h PRO 283 CO 0.44 0.00 -0.41 -0.44 -0.23 0.00 0.00 178.00 177.36 2ayq h ASP 284 N 0.00 0.99 -0.08 1.44 5.19 -2.00 -2.88 116.42 119.08 2ayq h ASP 284 Ca 0.00 -0.46 0.00 0.00 -0.62 0.00 0.00 57.03 55.95 2ayq h ASP 284 Cb 0.32 -0.28 0.00 0.00 0.18 0.00 0.00 39.33 39.55 2ayq h ASP 284 CO 0.00 1.26 0.00 -0.38 -3.12 0.00 0.00 179.24 177.00 2ayq n ILE 285 N -4.05 0.10 -1.67 0.35 2.08 -0.75 -4.88 119.36 110.53 2ayq n ILE 285 Ca -0.02 -0.20 -0.47 0.00 0.56 0.00 0.00 62.75 62.62 2ayq n ILE 285 Cb 0.56 0.12 -0.04 0.00 -0.75 0.00 0.00 39.64 39.53 2ayq n ILE 285 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 2ayq n ALA 286 N -0.14 1.17 0.00 -1.39 0.00 -1.09 -2.20 120.51 116.86 2ayq n ALA 286 Ca 0.17 0.39 0.00 0.00 0.00 0.00 0.00 53.44 54.00 2ayq n ALA 286 Cb 0.24 -2.40 0.00 0.00 0.00 0.00 0.00 19.45 17.29 2ayq n ALA 286 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2ayq n GLY 287 N 3.75 2.01 0.00 0.00 0.00 -1.26 -4.81 105.19 104.88 2ayq n GLY 287 Ca 0.19 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.20 2ayq n GLY 287 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2ayq n GLN 288 N 0.00 0.00 -1.26 1.61 6.02 -0.94 -4.82 117.38 117.99 2ayq n GLN 288 Ca 0.00 0.27 -0.09 0.00 -0.01 0.00 0.00 57.00 57.17 2ayq n GLN 288 Cb 0.00 -1.51 -0.04 0.00 1.02 0.00 0.00 30.24 29.71 2ayq n GLN 288 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2ayq n GLY 289 N -1.26 1.06 0.49 1.08 0.00 -1.26 -4.88 105.19 100.42 2ayq n GLY 289 Ca 0.00 -0.57 0.10 0.00 0.00 0.00 0.00 46.02 45.55 2ayq n GLY 289 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2ayq n LYS 290 N -2.63 1.46 -1.66 1.61 5.02 -1.26 -1.05 118.16 119.64 2ayq n LYS 290 Ca -0.09 -1.01 -0.47 0.00 -2.02 0.00 0.00 58.31 54.71 2ayq n LYS 290 Cb 0.31 -1.40 -0.05 0.00 -0.02 0.00 0.00 35.03 33.87 2ayq n LYS 290 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2ayq n ALA 291 N 0.07 1.00 -2.61 7.82 0.00 -1.26 -4.78 120.51 120.75 2ayq n ALA 291 Ca 0.09 0.42 -0.43 0.00 0.00 0.00 0.00 53.44 53.52 2ayq n ALA 291 Cb 0.43 -2.35 -0.05 0.00 0.00 0.00 0.00 19.45 17.48 2ayq n ALA 291 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 2ayq s ASN 292 N 1.52 6.36 0.00 0.00 3.84 -1.26 -4.33 114.94 121.07 2ayq s ASN 292 Ca 0.82 -0.30 0.29 0.00 0.21 0.00 0.00 52.86 53.89 2ayq s ASN 292 Cb -0.72 -2.40 1.31 0.00 -0.55 0.00 0.00 41.25 38.89 2ayq s ASN 292 CO 0.42 -1.05 1.95 -0.81 -2.79 0.00 0.00 177.10 174.83 2ayq n PRO 293 N 6.98 0.12 -0.24 0.43 -0.04 -1.26 -4.20 135.00 136.79 2ayq n PRO 293 Ca 0.01 0.01 0.01 0.00 -0.04 0.00 0.00 63.50 63.49 2ayq n PRO 293 Cb 0.48 -1.50 0.13 0.00 -0.04 0.00 0.00 33.50 32.57 2ayq n PRO 293 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 2ayq h LEU 294 N 0.00 0.43 0.51 1.53 3.38 -1.92 -0.97 115.31 118.27 2ayq h LEU 294 Ca 0.00 0.06 -0.02 0.00 0.09 0.00 0.00 57.88 58.01 2ayq h LEU 294 Cb 0.43 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.17 2ayq h LEU 294 CO 0.00 0.25 -0.34 1.23 0.09 0.00 0.00 178.44 179.66 2ayq h GLY 295 N 0.57 -0.89 1.04 0.83 0.00 -1.73 -0.50 103.07 102.38 2ayq h GLY 295 Ca 0.34 0.38 0.05 0.00 0.00 0.00 0.00 47.33 48.11 2ayq h GLY 295 CO -0.27 -0.32 0.50 -0.84 0.00 0.00 0.00 176.54 175.61 2ayq h THR 296 N -0.83 1.06 -0.10 4.70 2.02 -1.78 -0.15 112.91 117.83 2ayq h THR 296 Ca -0.06 -0.29 -0.01 0.00 0.77 0.00 0.00 66.41 66.81 2ayq h THR 296 Cb 0.68 0.13 -0.00 0.00 -1.74 0.00 0.00 68.15 67.22 2ayq h THR 296 CO 0.04 0.16 0.01 0.58 0.37 0.00 0.00 175.52 176.68 2ayq h VAL 297 N 0.86 1.23 0.00 3.16 2.07 -0.92 -1.25 116.25 121.41 2ayq h VAL 297 Ca 0.32 -0.74 -0.01 0.00 0.82 0.00 0.00 66.70 67.10 2ayq h VAL 297 Cb 0.18 1.53 -0.00 0.00 -1.52 0.00 0.00 31.29 31.48 2ayq h VAL 297 CO -0.11 0.21 -0.03 -0.07 0.02 0.00 0.00 177.57 177.59 2ayq h LEU 298 N -0.08 0.00 0.11 2.57 3.38 -0.24 -0.09 115.31 120.96 2ayq h LEU 298 Ca 0.03 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 2ayq h LEU 298 Cb 0.32 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.07 2ayq h LEU 298 CO 0.00 0.03 -0.05 0.28 0.09 0.00 0.00 178.44 178.79 2ayq h SER 299 N 0.00 -0.13 -0.68 -0.43 0.02 -0.41 -1.79 113.55 110.13 2ayq h SER 299 Ca -0.00 -0.29 0.17 0.00 -0.84 0.00 0.00 61.79 60.82 2ayq h SER 299 Cb 0.08 0.03 -0.04 0.00 0.14 0.00 0.00 62.40 62.61 2ayq h SER 299 CO 0.00 0.24 0.47 0.00 -1.14 0.00 0.00 176.83 176.41 2ayq h ALA 300 N 0.32 2.38 -0.14 3.77 0.00 0.09 0.20 119.26 125.88 2ayq h ALA 300 Ca -0.02 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 2ayq h ALA 300 Cb 0.41 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 2ayq h ALA 300 CO 0.03 -0.57 0.01 0.00 0.00 0.00 0.00 179.25 178.72 2ayq h ALA 301 N 1.67 0.19 -0.82 0.00 0.00 -0.82 -2.34 119.26 117.15 2ayq h ALA 301 Ca 0.33 -0.18 0.03 0.00 0.00 0.00 0.00 54.91 55.09 2ayq h ALA 301 Cb 1.04 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 18.73 2ayq h ALA 301 CO -0.06 -0.13 0.53 -0.07 0.00 0.00 0.00 179.25 179.52 2ayq h LEU 302 N -0.00 0.88 0.27 0.00 3.38 0.19 -2.55 115.31 117.47 2ayq h LEU 302 Ca 0.04 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.00 2ayq h LEU 302 Cb 0.34 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.86 2ayq h LEU 302 CO 0.01 0.61 -0.49 -0.03 0.09 0.00 0.00 178.44 178.63 2ayq h MET 303 N 1.03 -0.78 -0.98 1.13 4.05 -0.93 0.12 114.93 118.57 2ayq h MET 303 Ca 0.32 0.05 0.23 0.00 -0.28 0.00 0.00 59.70 60.03 2ayq h MET 303 Cb -0.01 0.18 -0.12 0.00 -0.80 0.00 0.00 31.60 30.85 2ayq h MET 303 CO -0.11 -0.52 0.56 -0.07 0.23 0.00 0.00 176.91 177.00 2ayq h LEU 304 N -0.81 0.64 0.23 3.39 3.38 -1.14 0.15 115.31 121.14 2ayq h LEU 304 Ca -0.03 0.13 -0.01 0.00 0.09 0.00 0.00 57.88 58.06 2ayq h LEU 304 Cb 0.76 0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.55 2ayq h LEU 304 CO -0.18 0.12 -0.11 -0.09 0.09 0.00 0.00 178.44 178.27 2ayq h ARG 305 N 0.58 -0.29 0.00 1.13 2.43 -1.05 0.18 114.38 117.36 2ayq h ARG 305 Ca 0.62 0.02 -0.11 0.00 -0.81 0.00 0.00 59.98 59.70 2ayq h ARG 305 Cb 1.13 0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 30.73 2ayq h ARG 305 CO -0.47 -0.15 -0.51 1.88 -1.51 0.00 0.00 179.97 179.21 2ayq h TYR 306 N -1.07 0.00 0.00 2.20 0.05 -0.60 -1.30 116.97 116.25 2ayq h TYR 306 Ca -0.03 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.75 2ayq h TYR 306 Cb 0.28 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.02 2ayq h TYR 306 CO 0.01 0.51 -0.76 0.43 -1.05 0.00 0.00 178.16 177.30 2ayq n SER 307 N -3.63 0.76 0.00 3.88 7.64 0.51 -4.68 113.62 118.09 2ayq n SER 307 Ca -0.01 -0.86 0.00 0.00 1.01 0.00 0.00 58.87 59.02 2ayq n SER 307 Cb 0.58 1.01 0.00 0.00 -1.01 0.00 0.00 64.21 64.80 2ayq n SER 307 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 2ayq n PHE 308 N -1.39 0.00 -1.47 1.43 3.72 -1.09 -4.82 117.46 113.85 2ayq n PHE 308 Ca 0.03 0.00 -0.16 0.00 -0.05 0.00 0.00 57.45 57.27 2ayq n PHE 308 Cb 0.25 0.00 -0.07 0.00 -0.94 0.00 0.00 39.48 38.72 2ayq n PHE 308 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2ayq n GLY 309 N 0.01 1.58 2.73 1.37 0.00 -0.49 -4.88 105.19 105.51 2ayq n GLY 309 Ca 0.00 -0.12 -0.42 0.00 0.00 0.00 0.00 46.02 45.48 2ayq n GLY 309 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2ayq n LEU 310 N -1.82 7.06 0.32 0.99 4.77 0.55 -4.77 117.00 124.11 2ayq n LEU 310 Ca -0.16 -4.49 -0.18 0.00 -0.03 0.00 0.00 56.01 51.15 2ayq n LEU 310 Cb 0.58 -1.53 -0.09 0.00 -2.33 0.00 0.00 43.42 40.05 2ayq n LEU 310 CO 0.24 1.43 0.57 -0.08 -1.33 0.00 0.00 177.39 178.23 2ayq h GLU 311 N 5.63 -0.95 -0.61 3.23 4.57 -1.88 0.31 114.58 124.87 2ayq h GLU 311 Ca 0.53 0.06 0.12 0.00 -1.18 0.00 0.00 59.36 58.89 2ayq h GLU 311 Cb 0.57 0.22 -0.12 0.00 -0.16 0.00 0.00 28.75 29.25 2ayq h GLU 311 CO 1.71 -0.63 -0.21 -0.22 -1.18 0.00 0.00 179.01 178.48 2ayq h LYS 312 N -0.99 -0.05 -0.60 1.92 3.64 -1.98 0.23 116.57 118.73 2ayq h LYS 312 Ca -0.07 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.31 2ayq h LYS 312 Cb 0.83 0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 32.63 2ayq h LYS 312 CO 0.01 -0.03 0.36 0.93 -2.27 0.00 0.00 179.45 178.45 2ayq h GLU 313 N -0.05 0.82 -0.38 1.90 3.07 -1.91 -2.67 114.58 115.35 2ayq h GLU 313 Ca 0.29 -0.08 -0.01 0.00 -0.50 0.00 0.00 59.36 59.06 2ayq h GLU 313 Cb 0.49 -0.17 -0.02 0.00 -0.84 0.00 0.00 28.75 28.21 2ayq h GLU 313 CO -0.66 0.59 0.19 0.00 -1.40 0.00 0.00 179.01 177.73 2ayq h ALA 314 N 1.18 0.49 -0.05 3.43 0.00 0.13 -2.74 119.26 121.70 2ayq h ALA 314 Ca 0.22 -0.10 0.01 0.00 0.00 0.00 0.00 54.91 55.03 2ayq h ALA 314 Cb -0.02 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.62 2ayq h ALA 314 CO -0.04 0.04 0.03 0.00 0.00 0.00 0.00 179.25 179.29 2ayq h ALA 315 N 1.04 2.00 0.05 0.00 0.00 -0.44 -2.31 119.26 119.59 2ayq h ALA 315 Ca 0.13 -0.00 0.01 0.00 0.00 0.00 0.00 54.91 55.04 2ayq h ALA 315 Cb 0.11 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 2ayq h ALA 315 CO -0.02 -0.01 -0.07 0.00 0.00 0.00 0.00 179.25 179.15 2ayq h ALA 316 N 1.97 -0.12 -0.54 0.00 0.00 -1.16 0.14 119.26 119.55 2ayq h ALA 316 Ca 0.02 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 2ayq h ALA 316 Cb 0.04 0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 2ayq h ALA 316 CO -0.00 -0.58 0.22 0.82 0.00 0.00 0.00 179.25 179.71 2ayq h ILE 317 N -0.15 1.22 -0.99 0.00 2.04 -1.47 -1.00 117.51 117.15 2ayq h ILE 317 Ca 0.01 -0.67 0.01 0.00 1.00 0.00 0.00 64.86 65.21 2ayq h ILE 317 Cb 0.16 0.64 -0.05 0.00 -0.74 0.00 0.00 36.82 36.84 2ayq h ILE 317 CO -0.04 0.26 0.66 -0.33 0.00 0.00 0.00 178.15 178.69 2ayq h GLU 318 N 0.74 1.31 0.17 2.37 5.08 -1.09 -0.99 114.58 122.17 2ayq h GLU 318 Ca 0.18 -0.08 -0.01 0.00 -1.00 0.00 0.00 59.36 58.45 2ayq h GLU 318 Cb 0.19 -0.29 0.00 0.00 0.50 0.00 0.00 28.75 29.15 2ayq h GLU 318 CO -0.02 0.87 -0.08 -0.22 -1.00 0.00 0.00 179.01 178.56 2ayq h LYS 319 N 1.35 -0.22 -0.48 2.33 3.64 -0.70 -1.78 116.57 120.71 2ayq h LYS 319 Ca 0.36 0.02 0.08 0.00 -1.27 0.00 0.00 60.65 59.84 2ayq h LYS 319 Cb -0.16 0.05 -0.10 0.00 -0.41 0.00 0.00 32.23 31.62 2ayq h LYS 319 CO -0.08 0.12 -0.43 0.00 -2.27 0.00 0.00 179.45 176.79 2ayq h ALA 320 N 0.14 -0.39 -0.43 5.00 0.00 -0.85 0.35 119.26 123.07 2ayq h ALA 320 Ca -0.02 0.08 0.09 0.00 0.00 0.00 0.00 54.91 55.06 2ayq h ALA 320 Cb 0.45 0.92 -0.08 0.00 0.00 0.00 0.00 17.79 19.08 2ayq h ALA 320 CO 0.04 -0.85 -0.10 0.28 0.00 0.00 0.00 179.25 178.62 2ayq h VAL 321 N -0.28 0.57 0.20 0.00 2.07 -1.17 0.16 116.25 117.80 2ayq h VAL 321 Ca 0.15 -0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.67 2ayq h VAL 321 Cb 0.57 0.57 -0.01 0.00 -1.52 0.00 0.00 31.29 30.90 2ayq h VAL 321 CO -0.62 0.00 -0.18 -0.78 0.02 0.00 0.00 177.57 176.01 2ayq h ASP 322 N 0.00 -0.48 -0.12 0.57 3.58 0.04 -2.04 116.42 117.97 2ayq h ASP 322 Ca 0.21 0.04 0.03 0.00 0.42 0.00 0.00 57.03 57.73 2ayq h ASP 322 Cb 0.32 0.16 -0.03 0.00 1.72 0.00 0.00 39.33 41.50 2ayq h ASP 322 CO -0.44 -0.27 -0.04 0.44 -2.88 0.00 0.00 179.24 176.04 2ayq h ASP 323 N -0.40 -0.15 -0.88 2.28 3.32 0.28 0.35 116.42 121.22 2ayq h ASP 323 Ca -0.00 0.04 0.10 0.00 0.02 0.00 0.00 57.03 57.19 2ayq h ASP 323 Cb 0.37 0.09 -0.07 0.00 0.22 0.00 0.00 39.33 39.94 2ayq h ASP 323 CO -0.03 -0.06 0.52 0.58 -1.72 0.00 0.00 179.24 178.53 2ayq h VAL 324 N -0.02 0.93 -0.12 -1.35 2.07 -0.88 0.39 116.25 117.27 2ayq h VAL 324 Ca 0.06 -0.30 -0.13 0.00 0.82 0.00 0.00 66.70 67.15 2ayq h VAL 324 Cb 0.11 -0.02 -0.01 0.00 -1.52 0.00 0.00 31.29 29.86 2ayq h VAL 324 CO -0.14 0.16 -0.51 -0.07 0.02 0.00 0.00 177.57 177.04 2ayq h LEU 325 N 0.87 0.34 -1.48 2.57 3.38 -0.78 -1.81 115.31 118.41 2ayq h LEU 325 Ca 0.42 -0.17 -0.04 0.00 0.09 0.00 0.00 57.88 58.18 2ayq h LEU 325 Cb 0.37 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.01 2ayq h LEU 325 CO -0.24 0.79 -0.08 -0.61 0.09 0.00 0.00 178.44 178.39 2ayq h GLN 326 N 0.25 0.24 -0.00 1.13 5.75 0.26 0.58 115.11 123.32 2ayq h GLN 326 Ca 0.01 -0.05 0.00 0.00 -0.15 0.00 0.00 58.65 58.46 2ayq h GLN 326 Cb 0.98 -0.04 0.00 0.00 1.07 0.00 0.00 27.48 29.49 2ayq h GLN 326 CO 0.08 0.34 -0.04 -0.25 -2.65 0.00 0.00 178.83 176.31 2ayq n ASP 327 N -4.32 0.09 0.00 -0.69 9.92 0.11 -4.92 116.55 116.73 2ayq n ASP 327 Ca -0.01 -0.02 0.00 0.00 -0.53 0.00 0.00 54.79 54.23 2ayq n ASP 327 Cb 0.23 -0.29 0.00 0.00 -0.64 0.00 0.00 41.12 40.42 2ayq n ASP 327 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2ayq n GLY 328 N 1.36 0.77 3.82 0.44 0.00 0.19 -4.88 105.19 106.89 2ayq n GLY 328 Ca 0.12 -0.01 -0.36 0.00 0.00 0.00 0.00 46.02 45.77 2ayq n GLY 328 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2ayq s TYR 329 N -2.00 3.63 0.17 1.61 2.02 -0.85 -1.40 117.35 120.53 2ayq s TYR 329 Ca 0.00 1.29 -0.24 0.00 -0.37 0.00 0.00 57.07 57.75 2ayq s TYR 329 Cb 0.00 -2.55 0.06 0.00 -0.40 0.00 0.00 41.96 39.07 2ayq s TYR 329 CO 0.00 0.35 0.82 0.00 -1.57 0.00 0.00 175.55 175.16 2ayq n THR 331 N -0.42 0.11 0.00 0.00 -1.04 -1.26 -1.76 114.28 109.91 2ayq n THR 331 Ca -0.07 -0.28 0.00 0.00 -2.04 0.00 0.00 64.05 61.65 2ayq n THR 331 Cb 0.61 0.37 0.00 0.00 -1.82 0.00 0.00 70.33 69.49 2ayq n THR 331 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2ayq n GLY 332 N 1.13 2.37 0.10 3.41 0.00 -1.26 -4.81 105.19 106.12 2ayq n GLY 332 Ca 0.18 -0.72 -0.15 0.00 0.00 0.00 0.00 46.02 45.32 2ayq n GLY 332 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 2ayq h ASP 333 N 2.00 0.24 -3.96 1.61 2.03 -1.91 -3.45 116.42 112.98 2ayq h ASP 333 Ca 0.00 -0.71 -0.52 0.00 -0.73 0.00 0.00 57.03 55.07 2ayq h ASP 333 Cb 0.00 -0.07 0.08 0.00 -0.83 0.00 0.00 39.33 38.51 2ayq h ASP 333 CO 0.00 0.92 0.59 -0.76 -1.03 0.00 0.00 179.24 178.96 2ayq s LEU 334 N -8.65 4.17 -1.14 0.15 1.43 -1.26 -4.93 118.68 108.45 2ayq s LEU 334 Ca -0.15 2.60 -0.05 0.00 -1.03 0.00 0.00 54.13 55.50 2ayq s LEU 334 Cb 0.02 -3.96 0.27 0.00 0.03 0.00 0.00 46.19 42.54 2ayq s LEU 334 CO 0.74 -0.89 1.63 0.00 0.23 0.00 0.00 176.35 178.06 2ayq n GLN 335 N -0.00 4.29 -2.43 1.70 1.13 -1.26 -4.94 117.38 115.87 2ayq n GLN 335 Ca 0.04 -4.26 -0.39 0.00 -1.94 0.00 0.00 57.00 50.46 2ayq n GLN 335 Cb 0.44 -2.63 -0.04 0.00 0.11 0.00 0.00 30.24 28.13 2ayq n GLN 335 CO 0.00 0.00 0.00 0.08 -1.44 0.00 0.00 177.06 175.70 2ayq s VAL 336 N -1.96 3.42 0.00 5.09 1.01 -1.26 -4.69 120.40 122.01 2ayq s VAL 336 Ca 0.34 1.31 0.00 0.00 0.00 0.00 0.00 61.98 63.64 2ayq s VAL 336 Cb 0.07 -3.79 0.00 0.00 0.00 0.00 0.00 36.38 32.66 2ayq s VAL 336 CO 0.07 0.22 0.09 0.00 0.00 0.00 0.00 175.10 175.48 2ayq n ALA 337 N 0.69 0.00 -3.61 5.51 0.00 -0.70 -2.88 120.51 119.52 2ayq n ALA 337 Ca 0.01 0.00 -0.37 0.00 0.00 0.00 0.00 53.44 53.08 2ayq n ALA 337 Cb 0.46 0.04 -0.06 0.00 0.00 0.00 0.00 19.45 19.89 2ayq n ALA 337 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 2ayq s ASN 338 N -0.76 6.09 -0.42 0.00 0.01 -1.26 -5.04 114.94 113.56 2ayq s ASN 338 Ca 0.00 -3.66 -0.24 0.00 -0.71 0.00 0.00 52.86 48.25 2ayq s ASN 338 Cb 0.00 -1.93 -0.12 0.00 0.41 0.00 0.00 41.25 39.60 2ayq s ASN 338 CO 0.00 -0.20 1.44 0.61 -1.51 0.00 0.00 177.10 177.44 2ayq n GLY 339 N 2.43 -0.17 2.91 0.66 0.00 -1.14 -4.74 105.19 105.14 2ayq n GLY 339 Ca 0.21 0.70 -0.30 0.00 0.00 0.00 0.00 46.02 46.63 2ayq n GLY 339 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ayq s LYS 340 N 4.37 1.91 -0.02 1.61 1.02 -0.49 -5.05 119.74 123.09 2ayq s LYS 340 Ca 0.77 -2.59 -0.30 0.00 0.02 0.00 0.00 55.97 53.88 2ayq s LYS 340 Cb -0.87 -3.18 -0.03 0.00 -0.52 0.00 0.00 37.83 33.23 2ayq s LYS 340 CO 0.37 -1.13 1.03 0.08 -0.92 0.00 0.00 175.35 174.77 2ayq s VAL 341 N -0.28 4.71 0.00 3.17 1.01 -1.26 -2.59 120.40 125.15 2ayq s VAL 341 Ca 0.18 1.95 0.00 0.00 0.00 0.00 0.00 61.98 64.11 2ayq s VAL 341 Cb -0.24 -4.25 0.00 0.00 0.00 0.00 0.00 36.38 31.89 2ayq s VAL 341 CO -0.01 0.11 0.00 1.33 0.00 0.00 0.00 175.10 176.53 2ayq n VAL 342 N 4.07 0.00 -3.55 2.92 0.24 -0.72 -4.96 118.33 116.32 2ayq n VAL 342 Ca 0.07 0.00 -0.23 0.00 -2.04 0.00 0.00 64.34 62.15 2ayq n VAL 342 Cb 0.50 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.87 2ayq n VAL 342 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 2ayq s SER 343 N -0.63 4.91 0.14 -1.34 1.04 -1.26 -4.43 113.70 112.12 2ayq s SER 343 Ca 0.00 -0.97 -0.23 0.00 0.48 0.00 0.00 55.95 55.23 2ayq s SER 343 Cb 0.00 0.07 -0.00 0.00 0.10 0.00 0.00 66.02 66.18 2ayq s SER 343 CO 0.00 -1.02 1.64 0.74 0.98 0.00 0.00 173.24 175.58 2ayq h THR 344 N 0.68 0.46 -0.25 2.02 2.02 -1.28 -1.20 112.91 115.35 2ayq h THR 344 Ca -0.36 0.00 0.03 0.00 0.77 0.00 0.00 66.41 66.85 2ayq h THR 344 Cb 1.29 0.46 -0.03 0.00 -1.74 0.00 0.00 68.15 68.12 2ayq h THR 344 CO 0.53 0.00 0.06 0.40 0.37 0.00 0.00 175.52 176.87 2ayq h ILE 345 N -0.27 0.89 0.11 3.11 5.03 -1.90 -2.55 117.51 121.93 2ayq h ILE 345 Ca 0.11 -0.05 -0.01 0.00 -0.12 0.00 0.00 64.86 64.79 2ayq h ILE 345 Cb 0.43 0.72 0.00 0.00 -3.03 0.00 0.00 36.82 34.94 2ayq h ILE 345 CO -0.30 0.03 -0.05 -0.08 -0.68 0.00 0.00 178.15 177.06 2ayq h GLU 346 N 0.16 -0.14 -0.94 2.37 4.81 -1.84 0.21 114.58 119.21 2ayq h GLU 346 Ca 0.12 0.01 0.23 0.00 -0.13 0.00 0.00 59.36 59.59 2ayq h GLU 346 Cb 0.11 0.03 -0.07 0.00 0.63 0.00 0.00 28.75 29.45 2ayq h GLU 346 CO -0.15 0.09 0.63 1.25 -0.73 0.00 0.00 179.01 180.11 2ayq h LEU 347 N -0.35 0.34 0.14 1.64 5.85 -1.17 0.37 115.31 122.13 2ayq h LEU 347 Ca -0.01 0.04 -0.01 0.00 0.84 0.00 0.00 57.88 58.74 2ayq h LEU 347 Cb 0.29 -0.02 0.00 0.00 0.37 0.00 0.00 40.66 41.30 2ayq h LEU 347 CO 0.02 0.12 -0.07 0.74 -0.34 0.00 0.00 178.44 178.91 2ayq h THR 348 N 0.33 1.02 -0.92 1.05 2.02 -1.01 -2.07 112.91 113.34 2ayq h THR 348 Ca 0.49 -0.90 0.18 0.00 0.77 0.00 0.00 66.41 66.95 2ayq h THR 348 Cb 1.36 1.56 -0.08 0.00 -1.74 0.00 0.00 68.15 69.26 2ayq h THR 348 CO -0.17 0.21 0.59 0.44 0.37 0.00 0.00 175.52 176.95 2ayq h ASP 349 N -0.63 0.58 0.01 4.18 3.32 0.13 -0.08 116.42 123.93 2ayq h ASP 349 Ca -0.02 0.05 -0.00 0.00 0.02 0.00 0.00 57.03 57.08 2ayq h ASP 349 Cb 0.48 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 39.97 2ayq h ASP 349 CO 0.03 0.25 -0.01 0.03 -1.72 0.00 0.00 179.24 177.83 2ayq h ARG 350 N 0.59 -0.02 -0.78 3.56 2.47 -0.26 -1.34 114.38 118.61 2ayq h ARG 350 Ca 0.48 0.00 0.12 0.00 -1.26 0.00 0.00 59.98 59.32 2ayq h ARG 350 Cb 0.94 0.00 -0.08 0.00 -1.65 0.00 0.00 29.97 29.18 2ayq h ARG 350 CO -0.23 0.17 0.38 -0.07 0.56 0.00 0.00 179.97 180.79 2ayq h LEU 351 N -0.20 0.47 -0.29 3.04 3.38 -0.32 -0.33 115.31 121.06 2ayq h LEU 351 Ca -0.00 0.08 -0.03 0.00 0.09 0.00 0.00 57.88 58.01 2ayq h LEU 351 Cb 0.19 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.93 2ayq h LEU 351 CO 0.00 0.24 0.05 0.40 0.09 0.00 0.00 178.44 179.22 2ayq h ILE 352 N 0.60 1.23 -0.21 1.22 2.04 -1.14 -2.35 117.51 118.90 2ayq h ILE 352 Ca 0.40 -0.77 0.05 0.00 1.00 0.00 0.00 64.86 65.54 2ayq h ILE 352 Cb 0.50 1.19 -0.06 0.00 -0.74 0.00 0.00 36.82 37.71 2ayq h ILE 352 CO -0.32 0.25 -0.16 -0.08 0.00 0.00 0.00 178.15 177.85 2ayq h GLU 353 N 0.29 -0.15 -0.05 2.37 4.81 -0.06 0.21 114.58 122.01 2ayq h GLU 353 Ca 0.09 0.01 0.01 0.00 -0.13 0.00 0.00 59.36 59.34 2ayq h GLU 353 Cb 0.33 0.03 -0.00 0.00 0.63 0.00 0.00 28.75 29.74 2ayq h GLU 353 CO 0.00 -0.10 0.05 0.87 -0.73 0.00 0.00 179.01 179.10 2ayq h LYS 354 N -0.16 0.00 -0.02 1.92 1.79 -0.98 -1.30 116.57 117.83 2ayq h LYS 354 Ca 0.12 0.00 -0.22 0.00 -2.18 0.00 0.00 60.65 58.37 2ayq h LYS 354 Cb 0.34 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.99 2ayq h LYS 354 CO -0.30 0.00 -0.90 -0.07 -1.08 0.00 0.00 179.45 177.09 2ayq h LEU 355 N 0.00 0.59 -4.66 2.94 3.38 -0.08 -3.23 115.31 114.25 2ayq h LEU 355 Ca 0.02 -0.45 -0.64 0.00 0.09 0.00 0.00 57.88 56.90 2ayq h LEU 355 Cb 0.12 -0.18 -0.23 0.00 0.09 0.00 0.00 40.66 40.46 2ayq h LEU 355 CO -0.00 1.24 0.77 0.59 0.09 0.00 0.00 178.44 181.13 2ayq n ASN 356 N -3.78 7.12 0.00 -0.43 5.03 -0.49 -5.09 115.26 117.61 2ayq n ASN 356 Ca -0.07 -3.57 0.00 0.00 0.87 0.00 0.00 54.58 51.82 2ayq n ASN 356 Cb 0.81 -1.12 0.00 0.00 -1.02 0.00 0.00 39.78 38.45 2ayq n ASN 356 CO 0.00 0.00 0.00 -3.20 -1.83 0.00 0.00 177.26 172.23