#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 2.51 -0.23 3.17 0.00 -1.26 0.09 119.74 124.02 2ayq s LYS 2 Ca 0.00 -0.88 -0.05 0.00 0.00 0.00 0.00 55.97 55.04 2ayq s LYS 2 Cb 0.00 -2.51 0.12 0.00 0.00 0.00 0.00 37.83 35.44 2ayq s LYS 2 CO 0.00 0.53 0.44 0.00 0.00 0.00 0.00 175.35 176.32 2ayq s MET 3 N -2.38 0.37 -0.09 1.78 0.00 -0.34 -4.93 119.30 113.71 2ayq s MET 3 Ca 0.26 0.89 -0.24 0.00 0.00 0.00 0.00 55.69 56.59 2ayq s MET 3 Cb -0.11 0.11 -0.03 0.00 0.00 0.00 0.00 34.83 34.79 2ayq s MET 3 CO 0.18 -0.42 0.75 0.15 0.00 0.00 0.00 175.02 175.68 2ayq s LYS 4 N 2.63 4.40 -0.07 3.16 3.01 -1.26 -1.44 119.74 130.18 2ayq s LYS 4 Ca 0.05 0.94 0.02 0.00 -1.01 0.00 0.00 55.97 55.97 2ayq s LYS 4 Cb -0.13 -3.49 0.01 0.00 -1.01 0.00 0.00 37.83 33.21 2ayq s LYS 4 CO -0.15 -0.06 -0.14 -0.51 0.51 0.00 0.00 175.35 175.01 2ayq s LEU 5 N 1.22 1.70 0.02 3.17 1.43 0.10 0.44 118.68 126.76 2ayq s LEU 5 Ca 0.38 -0.33 -0.27 0.00 -1.03 0.00 0.00 54.13 52.88 2ayq s LEU 5 Cb -0.18 -0.89 -0.04 0.00 0.03 0.00 0.00 46.19 45.11 2ayq s LEU 5 CO 0.17 0.05 0.87 0.00 0.23 0.00 0.00 176.35 177.67 2ayq s ALA 6 N 0.61 3.26 -0.29 4.21 0.00 -0.88 -1.48 121.76 127.19 2ayq s ALA 6 Ca -0.15 0.40 0.01 0.00 0.00 0.00 0.00 51.96 52.23 2ayq s ALA 6 Cb -0.16 -3.17 0.07 0.00 0.00 0.00 0.00 23.12 19.86 2ayq s ALA 6 CO 0.04 -0.10 -0.03 0.08 0.00 0.00 0.00 175.76 175.75 2ayq s VAL 7 N 0.53 2.49 -0.81 0.00 1.01 -0.15 -0.78 120.40 122.69 2ayq s VAL 7 Ca 0.45 -1.72 -0.01 0.00 0.00 0.00 0.00 61.98 60.70 2ayq s VAL 7 Cb -0.21 -2.54 0.20 0.00 0.00 0.00 0.00 36.38 33.84 2ayq s VAL 7 CO 0.25 -0.20 0.67 -0.76 0.00 0.00 0.00 175.10 175.06 2ayq s LEU 8 N 1.11 5.36 0.61 3.92 1.02 -0.49 -1.44 118.68 128.77 2ayq s LEU 8 Ca -0.03 -3.59 0.30 0.00 0.02 0.00 0.00 54.13 50.83 2ayq s LEU 8 Cb -0.20 -1.85 1.63 0.00 0.02 0.00 0.00 46.19 45.79 2ayq s LEU 8 CO -0.04 -0.20 2.00 1.55 0.02 0.00 0.00 176.35 179.68 2ayq h PRO 9 N 6.09 0.00 0.00 1.29 0.13 -1.84 -0.93 132.00 136.74 2ayq h PRO 9 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 2ayq h PRO 9 Cb 0.83 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.96 2ayq h PRO 9 CO 0.80 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 178.98 2ayq n GLY 10 N -1.37 1.35 3.42 1.56 0.00 -1.26 -2.99 105.19 105.90 2ayq n GLY 10 Ca 0.03 -0.69 -0.22 0.00 0.00 0.00 0.00 46.02 45.14 2ayq n GLY 10 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2ayq s ASP 11 N -4.00 2.16 0.36 1.61 1.47 -0.18 -4.57 116.67 113.51 2ayq s ASP 11 Ca 0.00 -1.57 0.00 0.00 1.18 0.00 0.00 52.55 52.16 2ayq s ASP 11 Cb 0.00 0.36 0.00 0.00 -0.34 0.00 0.00 42.92 42.94 2ayq s ASP 11 CO 0.00 -0.86 0.00 0.61 0.68 0.00 0.00 175.17 175.60 2ayq n GLY 12 N -0.73 1.23 0.00 2.12 0.00 -1.26 -2.13 105.19 104.42 2ayq n GLY 12 Ca -0.02 -0.74 0.07 0.00 0.00 0.00 0.00 46.02 45.33 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 0.61 -0.31 -0.61 -5.35 0.13 -3.91 119.36 109.91 2ayq n ILE 13 Ca 0.00 0.15 -0.11 0.00 -0.27 0.00 0.00 62.75 62.53 2ayq n ILE 13 Cb 0.00 -0.91 -0.08 0.00 -1.74 0.00 0.00 39.64 36.91 2ayq n ILE 13 CO 0.00 0.00 0.00 1.23 -1.76 0.00 0.00 176.55 176.02 2ayq h GLY 14 N 2.47 -0.77 2.00 3.28 0.00 -1.61 0.85 103.07 109.29 2ayq h GLY 14 Ca 0.00 0.73 -0.02 0.00 0.00 0.00 0.00 47.33 48.03 2ayq h GLY 14 CO 0.00 -0.04 -0.11 -0.56 0.00 0.00 0.00 176.54 175.83 2ayq h PRO 15 N -0.14 0.00 0.14 4.80 0.13 -1.65 -1.30 132.00 133.98 2ayq h PRO 15 Ca 0.15 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.28 2ayq h PRO 15 Cb 0.50 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.63 2ayq h PRO 15 CO -0.82 0.11 -0.07 0.93 -0.23 0.00 0.00 178.00 177.92 2ayq h GLU 16 N 0.00 -0.18 -0.27 0.86 5.08 -1.11 -2.89 114.58 116.06 2ayq h GLU 16 Ca -0.00 0.01 -0.14 0.00 -1.00 0.00 0.00 59.36 58.23 2ayq h GLU 16 Cb 0.27 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.55 2ayq h GLU 16 CO 0.01 0.21 -0.41 -0.39 -1.00 0.00 0.00 179.01 177.44 2ayq h VAL 17 N -0.64 1.29 -0.23 3.13 -1.51 -1.26 -3.04 116.25 113.99 2ayq h VAL 17 Ca -0.02 -1.59 0.03 0.00 -1.23 0.00 0.00 66.70 63.89 2ayq h VAL 17 Cb 0.48 1.52 -0.01 0.00 -2.13 0.00 0.00 31.29 31.15 2ayq h VAL 17 CO 0.03 0.51 0.16 -0.03 -1.23 0.00 0.00 177.57 177.01 2ayq h MET 18 N 0.54 0.20 0.72 5.19 -1.53 -1.29 -2.46 114.93 116.30 2ayq h MET 18 Ca 0.04 -0.01 -0.04 0.00 -3.44 0.00 0.00 59.70 56.26 2ayq h MET 18 Cb 0.94 -0.04 0.01 0.00 -0.55 0.00 0.00 31.60 31.95 2ayq h MET 18 CO 0.08 0.13 -0.35 0.22 0.14 0.00 0.00 176.91 177.14 2ayq h ASP 19 N 0.20 -0.82 -0.70 1.39 3.58 -1.38 -2.32 116.42 116.36 2ayq h ASP 19 Ca 0.10 0.02 0.15 0.00 0.42 0.00 0.00 57.03 57.72 2ayq h ASP 19 Cb 0.13 0.21 -0.11 0.00 1.72 0.00 0.00 39.33 41.29 2ayq h ASP 19 CO -0.02 -0.57 0.15 0.00 -2.88 0.00 0.00 179.24 175.92 2ayq h ALA 20 N -0.73 0.87 -0.64 -0.78 0.00 -1.53 0.13 119.26 116.59 2ayq h ALA 20 Ca -0.10 0.17 0.05 0.00 0.00 0.00 0.00 54.91 55.03 2ayq h ALA 20 Cb 0.75 0.24 -0.05 0.00 0.00 0.00 0.00 17.79 18.73 2ayq h ALA 20 CO 0.16 -0.34 0.36 0.00 0.00 0.00 0.00 179.25 179.44 2ayq h ALA 21 N 1.59 0.84 -0.18 0.00 0.00 -1.37 -0.56 119.26 119.58 2ayq h ALA 21 Ca 0.39 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.29 2ayq h ALA 21 Cb 0.65 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 2ayq h ALA 21 CO -0.50 0.06 0.05 0.82 0.00 0.00 0.00 179.25 179.69 2ayq h ILE 22 N 0.69 1.19 0.67 0.00 2.04 -0.26 0.79 117.51 122.62 2ayq h ILE 22 Ca 0.28 -0.58 -0.03 0.00 1.00 0.00 0.00 64.86 65.52 2ayq h ILE 22 Cb 0.13 1.24 -0.00 0.00 -0.74 0.00 0.00 36.82 37.45 2ayq h ILE 22 CO -0.15 0.18 -0.39 0.03 0.00 0.00 0.00 178.15 177.81 2ayq h ARG 23 N 0.11 -0.96 -0.20 2.37 3.08 -0.69 -0.76 114.38 117.33 2ayq h ARG 23 Ca 0.06 0.07 0.06 0.00 0.07 0.00 0.00 59.98 60.23 2ayq h ARG 23 Cb 0.23 0.22 -0.07 0.00 0.08 0.00 0.00 29.97 30.43 2ayq h ARG 23 CO -0.00 -0.64 -0.24 0.28 -1.07 0.00 0.00 179.97 178.29 2ayq h VAL 24 N -1.00 0.40 -0.78 2.04 2.07 -1.12 -0.04 116.25 117.82 2ayq h VAL 24 Ca -0.09 0.00 0.18 0.00 0.82 0.00 0.00 66.70 67.61 2ayq h VAL 24 Cb 0.80 0.40 -0.12 0.00 -1.52 0.00 0.00 31.29 30.84 2ayq h VAL 24 CO 0.10 0.00 0.17 -0.07 0.02 0.00 0.00 177.57 177.79 2ayq h LEU 25 N -0.27 -0.04 -0.34 2.57 3.38 -0.64 0.73 115.31 120.69 2ayq h LEU 25 Ca 0.12 0.17 -0.08 0.00 0.09 0.00 0.00 57.88 58.18 2ayq h LEU 25 Cb 0.46 0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.44 2ayq h LEU 25 CO -0.36 -0.09 -0.09 0.50 0.09 0.00 0.00 178.44 178.50 2ayq h LYS 26 N 0.23 0.67 -0.82 1.13 1.63 -0.07 0.26 116.57 119.60 2ayq h LYS 26 Ca 0.45 -0.26 0.08 0.00 -0.85 0.00 0.00 60.65 60.08 2ayq h LYS 26 Cb 0.81 -0.04 -0.07 0.00 -0.60 0.00 0.00 32.23 32.34 2ayq h LYS 26 CO -0.57 0.83 0.48 1.15 -3.45 0.00 0.00 179.45 177.89 2ayq h THR 27 N 0.45 0.95 0.04 1.00 2.02 0.88 -1.39 112.91 116.86 2ayq h THR 27 Ca 0.09 -0.28 -0.00 0.00 0.77 0.00 0.00 66.41 66.98 2ayq h THR 27 Cb 0.59 0.05 0.00 0.00 -1.74 0.00 0.00 68.15 67.05 2ayq h THR 27 CO 0.03 0.15 -0.02 0.58 0.37 0.00 0.00 175.52 176.64 2ayq h VAL 28 N 0.83 1.38 -0.36 3.16 2.07 -0.80 -3.33 116.25 119.20 2ayq h VAL 28 Ca 0.38 -1.57 0.07 0.00 0.82 0.00 0.00 66.70 66.40 2ayq h VAL 28 Cb 0.30 2.39 -0.02 0.00 -1.52 0.00 0.00 31.29 32.44 2ayq h VAL 28 CO -0.22 0.39 0.25 -0.07 0.02 0.00 0.00 177.57 177.93 2ayq h LEU 29 N -0.77 0.15 -1.93 2.57 3.38 -0.72 -2.16 115.31 115.84 2ayq h LEU 29 Ca -0.00 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.94 2ayq h LEU 29 Cb 0.67 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 41.37 2ayq h LEU 29 CO 0.01 0.09 0.04 0.47 0.09 0.00 0.00 178.44 179.14 2ayq n ASP 30 N -4.47 2.66 -0.00 -0.43 8.00 -0.54 -2.63 116.55 119.13 2ayq n ASP 30 Ca 0.05 -2.11 -0.20 0.00 0.71 0.00 0.00 54.79 53.24 2ayq n ASP 30 Cb 0.32 -0.52 -0.14 0.00 -0.02 0.00 0.00 41.12 40.76 2ayq n ASP 30 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 2ayq n ASN 31 N 0.30 1.98 -3.18 -2.24 5.03 -0.81 -4.66 115.26 111.68 2ayq n ASN 31 Ca 0.04 0.22 -0.21 0.00 0.87 0.00 0.00 54.58 55.50 2ayq n ASN 31 Cb 0.53 -0.76 -0.05 0.00 -1.02 0.00 0.00 39.78 38.48 2ayq n ASN 31 CO 0.00 0.00 0.00 -0.90 -1.83 0.00 0.00 177.26 174.53 2ayq n ASP 32 N -3.43 0.36 -3.52 6.41 3.85 -1.24 -5.02 116.55 113.96 2ayq n ASP 32 Ca -0.31 -2.85 -0.19 0.00 -0.71 0.00 0.00 54.79 50.73 2ayq n ASP 32 Cb 1.05 -0.55 0.01 0.00 -1.35 0.00 0.00 41.12 40.28 2ayq n ASP 32 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 2ayq n GLY 33 N 0.92 -1.12 3.04 6.12 0.00 -1.26 -4.36 105.19 108.53 2ayq n GLY 33 Ca 0.22 0.67 -0.32 0.00 0.00 0.00 0.00 46.02 46.60 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 -2.79 2.91 -0.60 1.61 0.09 -1.08 0.33 115.29 115.76 2ayq s HIS 34 Ca 0.06 -2.02 -0.27 0.00 -0.00 0.00 0.00 55.06 52.83 2ayq s HIS 34 Cb -0.01 -1.82 0.03 0.00 -0.00 0.00 0.00 32.58 30.79 2ayq s HIS 34 CO 0.85 -0.83 1.16 -1.83 -0.00 0.00 0.00 174.74 174.09 2ayq s GLU 35 N 1.23 3.44 -0.49 1.40 4.04 0.11 -4.54 118.70 123.89 2ayq s GLU 35 Ca -0.05 0.09 -0.19 0.00 0.04 0.00 0.00 54.97 54.86 2ayq s GLU 35 Cb -0.18 -4.04 0.05 0.00 0.02 0.00 0.00 34.13 29.98 2ayq s GLU 35 CO -0.07 -1.71 0.59 0.00 -1.84 0.00 0.00 175.26 172.23 2ayq s ALA 36 N 4.88 3.40 -0.44 -0.84 0.00 -1.26 -1.20 121.76 126.29 2ayq s ALA 36 Ca 0.40 -1.71 -0.16 0.00 0.00 0.00 0.00 51.96 50.49 2ayq s ALA 36 Cb -0.08 -3.29 0.05 0.00 0.00 0.00 0.00 23.12 19.79 2ayq s ALA 36 CO 0.23 -1.92 0.37 0.08 0.00 0.00 0.00 175.76 174.52 2ayq s VAL 37 N 2.50 5.21 -0.08 0.00 1.01 -0.52 -5.00 120.40 123.52 2ayq s VAL 37 Ca 0.14 -0.80 -0.07 0.00 0.00 0.00 0.00 61.98 61.25 2ayq s VAL 37 Cb -0.19 -4.05 -0.04 0.00 0.00 0.00 0.00 36.38 32.10 2ayq s VAL 37 CO 0.12 -0.47 0.19 -0.36 0.00 0.00 0.00 175.10 174.58 2ayq s PHE 38 N 1.76 3.60 -0.17 5.22 0.08 -1.26 0.00 117.98 127.22 2ayq s PHE 38 Ca 0.06 0.56 -0.04 0.00 0.12 0.00 0.00 56.93 57.63 2ayq s PHE 38 Cb -0.21 -1.97 0.06 0.00 -0.57 0.00 0.00 43.02 40.33 2ayq s PHE 38 CO 0.09 0.70 0.06 -2.00 -0.10 0.00 0.00 175.22 173.98 2ayq s GLU 39 N -1.23 0.33 0.63 0.44 2.12 -0.55 -4.94 118.70 115.49 2ayq s GLU 39 Ca 0.19 -0.20 -0.15 0.00 0.36 0.00 0.00 54.97 55.17 2ayq s GLU 39 Cb -0.13 -1.88 -0.02 0.00 0.26 0.00 0.00 34.13 32.37 2ayq s GLU 39 CO 0.08 -0.63 1.07 1.21 -0.54 0.00 0.00 175.26 176.45 2ayq s ASN 40 N 2.02 5.52 0.28 -1.70 2.47 -1.26 -0.98 114.94 121.29 2ayq s ASN 40 Ca 0.01 1.85 -0.14 0.00 0.42 0.00 0.00 52.86 55.00 2ayq s ASN 40 Cb -0.16 -2.53 0.01 0.00 -1.45 0.00 0.00 41.25 37.11 2ayq s ASN 40 CO -0.08 -1.34 0.56 0.00 -3.72 0.00 0.00 177.10 172.52 2ayq s ALA 41 N -2.49 -0.41 0.15 1.71 0.00 -0.52 -4.84 121.76 115.37 2ayq s ALA 41 Ca 0.64 -0.80 0.06 0.00 0.00 0.00 0.00 51.96 51.85 2ayq s ALA 41 Cb -0.17 0.99 -0.04 0.00 0.00 0.00 0.00 23.12 23.90 2ayq s ALA 41 CO 0.40 -0.90 0.04 -0.51 0.00 0.00 0.00 175.76 174.79 2ayq s LEU 42 N -3.02 3.52 0.08 0.00 1.02 -1.26 -4.42 118.68 114.59 2ayq s LEU 42 Ca 0.20 -0.25 -0.26 0.00 0.02 0.00 0.00 54.13 53.83 2ayq s LEU 42 Cb -0.02 -2.17 0.08 0.00 0.02 0.00 0.00 46.19 44.10 2ayq s LEU 42 CO 0.10 0.10 0.83 -0.51 0.02 0.00 0.00 176.35 176.89 2ayq s ILE 43 N -1.64 0.00 0.00 -0.59 2.07 -1.26 -4.60 121.20 115.18 2ayq s ILE 43 Ca 0.28 -0.17 0.00 0.00 -1.41 0.00 0.00 60.65 59.35 2ayq s ILE 43 Cb -0.10 -1.23 0.00 0.00 0.13 0.00 0.00 42.46 41.25 2ayq s ILE 43 CO 0.20 0.00 0.00 0.61 -1.91 0.00 0.00 174.94 173.84 2ayq n GLY 44 N -0.33 1.01 0.30 1.50 0.00 -0.04 -3.15 105.19 104.48 2ayq n GLY 44 Ca -0.10 -0.66 0.12 0.00 0.00 0.00 0.00 46.02 45.37 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 1.30 0.27 -0.02 0.00 -1.87 -0.77 103.07 101.98 2ayq h GLY 45 Ca 0.00 -0.03 0.06 0.00 0.00 0.00 0.00 47.33 47.36 2ayq h GLY 45 CO 0.00 -0.33 -0.15 0.00 0.00 0.00 0.00 176.54 176.06 2ayq h ALA 46 N 1.75 0.06 -0.43 3.60 0.00 -1.86 -1.59 119.26 120.78 2ayq h ALA 46 Ca 0.53 0.10 0.01 0.00 0.00 0.00 0.00 54.91 55.55 2ayq h ALA 46 Cb 1.03 0.36 -0.02 0.00 0.00 0.00 0.00 17.79 19.15 2ayq h ALA 46 CO -0.63 -0.55 0.27 0.00 0.00 0.00 0.00 179.25 178.34 2ayq h ALA 47 N 1.09 0.55 -0.90 0.00 0.00 -1.12 -2.35 119.26 116.51 2ayq h ALA 47 Ca 0.15 -0.02 0.23 0.00 0.00 0.00 0.00 54.91 55.27 2ayq h ALA 47 Cb 0.34 -0.15 -0.13 0.00 0.00 0.00 0.00 17.79 17.85 2ayq h ALA 47 CO -0.35 -0.03 0.39 0.82 0.00 0.00 0.00 179.25 180.08 2ayq h ILE 48 N 0.56 0.45 0.00 0.00 2.04 -0.42 -0.46 117.51 119.68 2ayq h ILE 48 Ca 0.16 -0.13 0.00 0.00 1.00 0.00 0.00 64.86 65.89 2ayq h ILE 48 Cb -0.04 0.04 0.00 0.00 -0.74 0.00 0.00 36.82 36.08 2ayq h ILE 48 CO -0.05 0.07 0.00 0.47 0.00 0.00 0.00 178.15 178.64 2ayq n ASP 49 N -5.06 0.00 -1.12 1.72 8.00 -0.90 -0.42 116.55 118.77 2ayq n ASP 49 Ca 0.23 0.81 0.00 0.00 0.71 0.00 0.00 54.79 56.54 2ayq n ASP 49 Cb 0.68 -0.48 0.00 0.00 -0.02 0.00 0.00 41.12 41.30 2ayq n ASP 49 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2ayq n GLU 50 N -1.95 0.88 0.00 -1.24 4.71 -1.03 -3.50 120.64 118.52 2ayq n GLU 50 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.15 2ayq n GLU 50 Cb 0.00 -1.06 0.00 0.00 -1.01 0.00 0.00 31.44 29.37 2ayq n GLU 50 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2ayq n ALA 51 N 0.78 0.00 0.00 0.62 0.00 -0.21 -4.99 120.51 116.71 2ayq n ALA 51 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2ayq n ALA 51 Cb 0.44 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.89 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 2.86 3.24 0.00 0.00 0.44 -4.97 105.19 106.77 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 -0.51 0.00 0.00 0.00 173.32 172.81 2ayq s THR 53 N -1.95 1.59 0.45 2.61 -4.23 -1.26 -4.83 115.64 108.02 2ayq s THR 53 Ca 0.00 -1.28 0.11 0.00 -1.18 0.00 0.00 61.69 59.35 2ayq s THR 53 Cb 0.00 -1.41 0.24 0.00 1.34 0.00 0.00 72.50 72.67 2ayq s THR 53 CO 0.00 0.09 2.06 1.55 -0.54 0.00 0.00 174.62 177.78 2ayq h PRO 54 N 4.63 0.26 -3.66 3.99 0.13 -1.85 -2.83 132.00 132.68 2ayq h PRO 54 Ca -0.43 -0.03 -0.61 0.00 -0.87 0.00 0.00 66.00 64.07 2ayq h PRO 54 Cb 1.17 -0.05 -0.40 0.00 0.13 0.00 0.00 31.00 31.84 2ayq h PRO 54 CO 0.42 0.22 -0.74 -1.17 -0.23 0.00 0.00 178.00 176.51 2ayq s LEU 55 N -9.17 2.93 0.22 1.56 2.96 -1.26 -0.86 118.68 115.07 2ayq s LEU 55 Ca -0.06 -2.02 -0.30 0.00 -0.22 0.00 0.00 54.13 51.53 2ayq s LEU 55 Cb 0.17 -1.09 -0.09 0.00 0.50 0.00 0.00 46.19 45.68 2ayq s LEU 55 CO 0.71 -0.37 1.29 -2.84 -1.32 0.00 0.00 176.35 173.82 2ayq s PRO 56 N 1.12 4.41 0.49 0.98 0.02 -1.26 -4.90 135.00 135.86 2ayq s PRO 56 Ca 0.12 2.05 0.22 0.00 0.02 0.00 0.00 61.00 63.41 2ayq s PRO 56 Cb -0.20 -3.18 1.27 0.00 0.02 0.00 0.00 34.50 32.42 2ayq s PRO 56 CO -0.15 -0.20 1.96 1.05 -0.33 0.00 0.00 177.00 179.33 2ayq h GLU 57 N 4.94 0.16 -0.45 5.54 9.09 -1.98 0.22 114.58 132.10 2ayq h GLU 57 Ca -0.45 -0.01 0.04 0.00 0.05 0.00 0.00 59.36 58.98 2ayq h GLU 57 Cb 1.22 -0.04 -0.04 0.00 -1.65 0.00 0.00 28.75 28.24 2ayq h GLU 57 CO 0.74 0.11 0.22 1.05 0.05 0.00 0.00 179.01 181.18 2ayq h GLU 58 N 0.16 0.43 -0.89 1.06 -0.00 -1.99 -1.66 114.58 111.70 2ayq h GLU 58 Ca 0.32 -0.03 0.05 0.00 -0.00 0.00 0.00 59.36 59.70 2ayq h GLU 58 Cb 1.01 -0.10 -0.06 0.00 -0.00 0.00 0.00 28.75 29.61 2ayq h GLU 58 CO -0.05 0.28 0.57 1.15 -0.00 0.00 0.00 179.01 180.96 2ayq h THR 59 N 0.44 1.09 -0.47 -1.06 2.02 -0.87 -0.94 112.91 113.12 2ayq h THR 59 Ca 0.20 -0.36 0.00 0.00 0.77 0.00 0.00 66.41 67.01 2ayq h THR 59 Cb 0.11 -0.06 -0.02 0.00 -1.74 0.00 0.00 68.15 66.43 2ayq h THR 59 CO -0.14 0.19 0.30 -0.07 0.37 0.00 0.00 175.52 176.17 2ayq h LEU 60 N 1.06 0.55 -0.62 2.58 3.38 -1.11 0.43 115.31 121.58 2ayq h LEU 60 Ca 0.38 -0.03 -0.01 0.00 0.09 0.00 0.00 57.88 58.30 2ayq h LEU 60 Cb 0.11 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 40.69 2ayq h LEU 60 CO -0.15 0.42 0.35 0.44 0.09 0.00 0.00 178.44 179.59 2ayq h ASP 61 N 0.63 0.77 -0.07 -0.43 3.32 -0.63 0.29 116.42 120.31 2ayq h ASP 61 Ca 0.17 -0.09 0.04 0.00 0.02 0.00 0.00 57.03 57.17 2ayq h ASP 61 Cb -0.04 -0.20 -0.05 0.00 0.22 0.00 0.00 39.33 39.26 2ayq h ASP 61 CO -0.03 0.64 -0.20 0.40 -1.72 0.00 0.00 179.24 178.32 2ayq h ILE 62 N 0.85 0.51 0.15 0.35 1.08 -0.65 -2.37 117.51 117.43 2ayq h ILE 62 Ca 0.22 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.69 2ayq h ILE 62 Cb 0.03 0.51 -0.01 0.00 -3.07 0.00 0.00 36.82 34.28 2ayq h ILE 62 CO -0.04 0.00 -0.14 0.00 -0.69 0.00 0.00 178.15 177.28 2ayq h ARG 64 N -0.31 0.00 -0.51 0.00 3.08 -0.09 0.30 114.38 116.85 2ayq h ARG 64 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2ayq h ARG 64 Cb 0.29 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.34 2ayq h ARG 64 CO -0.03 0.00 0.00 0.54 -1.07 0.00 0.00 179.97 179.41 2ayq n ARG 65 N -3.32 3.27 -4.10 0.04 1.74 -0.92 -4.98 116.66 108.39 2ayq n ARG 65 Ca 0.01 -2.64 -0.30 0.00 -0.77 0.00 0.00 57.85 54.15 2ayq n ARG 65 Cb 0.42 -1.69 -0.07 0.00 -1.02 0.00 0.00 32.46 30.11 2ayq n ARG 65 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 2ayq s SER 66 N -1.12 5.23 0.30 0.55 0.01 0.09 -4.93 113.70 113.84 2ayq s SER 66 Ca 0.42 -0.11 0.09 0.00 1.31 0.00 0.00 55.95 57.66 2ayq s SER 66 Cb 0.27 -1.31 0.46 0.00 0.21 0.00 0.00 66.02 65.64 2ayq s SER 66 CO 0.21 0.17 1.68 0.44 0.41 0.00 0.00 173.24 176.15 2ayq h ASP 67 N 3.36 0.12 -4.80 2.44 5.19 -0.31 -3.46 116.42 118.97 2ayq h ASP 67 Ca -0.47 -0.06 0.04 0.00 -0.62 0.00 0.00 57.03 55.92 2ayq h ASP 67 Cb 1.16 -0.03 -0.15 0.00 0.18 0.00 0.00 39.33 40.49 2ayq h ASP 67 CO 0.62 0.60 0.35 0.00 -3.12 0.00 0.00 179.24 177.68 2ayq s ALA 68 N -3.94 -1.73 -0.17 3.45 0.00 -1.23 -4.30 121.76 113.84 2ayq s ALA 68 Ca -0.03 0.86 0.01 0.00 0.00 0.00 0.00 51.96 52.80 2ayq s ALA 68 Cb 0.13 0.51 0.02 0.00 0.00 0.00 0.00 23.12 23.78 2ayq s ALA 68 CO 0.76 -0.67 -0.18 -1.50 0.00 0.00 0.00 175.76 174.17 2ayq s ILE 69 N -3.07 1.91 0.15 0.00 2.07 -0.24 -2.07 121.20 119.95 2ayq s ILE 69 Ca 0.01 -0.85 -0.14 0.00 -1.41 0.00 0.00 60.65 58.26 2ayq s ILE 69 Cb -0.01 -1.74 -0.07 0.00 0.13 0.00 0.00 42.46 40.77 2ayq s ILE 69 CO -0.08 0.52 0.56 -0.76 -1.91 0.00 0.00 174.94 173.26 2ayq s LEU 70 N 1.31 4.33 0.01 8.50 1.43 0.04 -1.13 118.68 133.17 2ayq s LEU 70 Ca 0.04 1.08 -0.00 0.00 -1.03 0.00 0.00 54.13 54.22 2ayq s LEU 70 Cb -0.13 -3.30 -0.02 0.00 0.03 0.00 0.00 46.19 42.77 2ayq s LEU 70 CO -0.11 0.09 -0.02 -0.22 0.23 0.00 0.00 176.35 176.32 2ayq s LEU 71 N -2.00 2.16 0.00 1.79 2.96 -0.36 -1.40 118.68 121.84 2ayq s LEU 71 Ca 0.38 -0.39 0.00 0.00 -0.22 0.00 0.00 54.13 53.90 2ayq s LEU 71 Cb -0.15 0.11 0.00 0.00 0.50 0.00 0.00 46.19 46.65 2ayq s LEU 71 CO 0.19 -0.25 0.00 0.61 -1.32 0.00 0.00 176.35 175.59 2ayq n GLY 72 N 1.88 0.83 3.29 7.98 0.00 -0.35 -4.22 105.19 114.58 2ayq n GLY 72 Ca -0.22 0.00 -0.10 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 -0.75 0.15 4.61 0.00 -1.23 -4.41 121.76 116.12 2ayq s ALA 73 Ca 0.00 -0.16 0.08 0.00 0.00 0.00 0.00 51.96 51.88 2ayq s ALA 73 Cb 0.00 0.60 -0.04 0.00 0.00 0.00 0.00 23.12 23.68 2ayq s ALA 73 CO 0.00 -0.59 -0.18 0.14 0.00 0.00 0.00 175.76 175.14 2ayq s VAL 74 N -3.66 1.71 0.00 0.00 -7.23 -1.26 -1.01 120.40 108.95 2ayq s VAL 74 Ca 0.02 -1.83 0.00 0.00 -1.81 0.00 0.00 61.98 58.36 2ayq s VAL 74 Cb 0.02 -1.75 0.00 0.00 0.56 0.00 0.00 36.38 35.21 2ayq s VAL 74 CO -0.11 -0.30 0.00 0.61 -0.31 0.00 0.00 175.10 174.99 2ayq n GLY 75 N 0.44 3.92 0.00 2.32 0.00 -1.26 -4.37 105.19 106.23 2ayq n GLY 75 Ca -0.14 -1.62 0.00 0.00 0.00 0.00 0.00 46.02 44.26 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 -1.48 1.55 0.28 -0.02 0.00 -1.26 -4.60 105.19 99.65 2ayq n GLY 76 Ca 0.00 -0.57 -0.07 0.00 0.00 0.00 0.00 46.02 45.38 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 0.93 -0.62 1.61 0.11 -2.02 -2.94 132.00 129.08 2ayq h PRO 77 Ca 0.00 -0.17 0.11 0.00 0.11 0.00 0.00 66.00 66.05 2ayq h PRO 77 Cb 0.00 -0.15 -0.12 0.00 0.11 0.00 0.00 31.00 30.84 2ayq h PRO 77 CO 0.00 0.79 -0.30 -0.22 -0.21 0.00 0.00 178.00 178.06 2ayq h LYS 78 N 0.87 -0.12 0.00 1.05 3.64 -2.04 -2.52 116.57 117.45 2ayq h LYS 78 Ca 0.21 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.60 2ayq h LYS 78 Cb 0.21 0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.06 2ayq h LYS 78 CO -0.02 -0.08 -0.51 0.91 -2.27 0.00 0.00 179.45 177.48 2ayq n TRP 79 N -5.44 0.03 0.30 1.91 8.01 -1.21 -4.19 117.44 116.84 2ayq n TRP 79 Ca 0.05 0.01 0.16 0.00 -1.31 0.00 0.00 57.50 56.41 2ayq n TRP 79 Cb 0.36 -0.27 0.77 0.00 -2.01 0.00 0.00 31.31 30.16 2ayq n TRP 79 CO 0.00 0.00 0.00 -0.44 -1.01 0.00 0.00 177.69 176.24 2ayq h ASP 80 N 0.00 0.00 -0.66 -0.99 5.19 -1.26 -2.71 116.42 116.00 2ayq h ASP 80 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 2ayq h ASP 80 Cb 0.52 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.03 2ayq h ASP 80 CO 0.00 0.00 0.00 1.41 -3.12 0.00 0.00 179.24 177.53 2ayq n HIS 81 N -2.71 0.96 -2.90 4.55 -0.00 -1.26 -4.96 115.22 108.91 2ayq n HIS 81 Ca -0.01 -0.52 -0.18 0.00 -0.00 0.00 0.00 57.72 57.01 2ayq n HIS 81 Cb 0.16 -0.04 0.07 0.00 -0.00 0.00 0.00 29.99 30.18 2ayq n HIS 81 CO 0.00 0.00 0.00 0.27 -0.00 0.00 0.00 176.34 176.61 2ayq n ASN 82 N 1.37 1.67 -4.74 0.41 0.23 -1.02 -5.07 115.26 108.11 2ayq n ASN 82 Ca 0.23 -2.26 -0.34 0.00 -0.53 0.00 0.00 54.58 51.68 2ayq n ASN 82 Cb 0.63 -0.44 0.07 0.00 -2.08 0.00 0.00 39.78 37.96 2ayq n ASN 82 CO 0.00 0.00 0.00 -2.16 -0.93 0.00 0.00 177.26 174.17 2ayq s PRO 83 N -4.48 2.44 0.44 -0.53 0.04 -1.26 -4.87 135.00 126.78 2ayq s PRO 83 Ca 0.56 1.65 0.23 0.00 0.04 0.00 0.00 61.00 63.47 2ayq s PRO 83 Cb -0.04 -1.88 1.22 0.00 0.04 0.00 0.00 34.50 33.84 2ayq s PRO 83 CO 0.36 -1.58 1.80 0.00 0.04 0.00 0.00 177.00 177.62 2ayq h ALA 84 N -0.05 2.45 0.00 8.56 0.00 -1.97 0.16 119.26 128.41 2ayq h ALA 84 Ca -0.48 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.46 2ayq h ALA 84 Cb 1.28 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 19.10 2ayq h ALA 84 CO 0.52 -0.81 -0.02 0.66 0.00 0.00 0.00 179.25 179.60 2ayq h SER 85 N 0.28 0.00 -0.39 0.00 4.64 -2.01 -3.00 113.55 113.08 2ayq h SER 85 Ca 0.55 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.84 2ayq h SER 85 Cb 1.61 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.68 2ayq h SER 85 CO -0.19 0.02 0.02 0.18 -0.87 0.00 0.00 176.83 175.99 2ayq n LEU 86 N -3.11 4.57 -4.74 5.97 4.32 0.54 -4.75 117.00 119.81 2ayq n LEU 86 Ca 0.02 -3.07 -0.38 0.00 -0.02 0.00 0.00 56.01 52.55 2ayq n LEU 86 Cb 0.39 -0.61 -0.06 0.00 -1.62 0.00 0.00 43.42 41.53 2ayq n LEU 86 CO 0.30 0.72 0.23 -0.60 -1.22 0.00 0.00 177.39 176.82 2ayq s ARG 87 N -2.87 4.32 0.45 3.23 6.06 -1.12 -4.86 118.95 124.16 2ayq s ARG 87 Ca 0.47 0.59 0.25 0.00 -2.50 0.00 0.00 55.73 54.54 2ayq s ARG 87 Cb 0.37 -3.39 1.28 0.00 0.06 0.00 0.00 34.95 33.27 2ayq s ARG 87 CO 0.10 0.24 1.77 -1.35 -2.50 0.00 0.00 175.30 173.57 2ayq h PRO 88 N 6.27 0.23 -0.43 5.12 0.11 -1.88 -2.60 132.00 138.81 2ayq h PRO 88 Ca -0.43 -0.01 0.03 0.00 0.11 0.00 0.00 66.00 65.70 2ayq h PRO 88 Cb 1.19 -0.05 -0.04 0.00 0.11 0.00 0.00 31.00 32.21 2ayq h PRO 88 CO 0.73 0.15 0.22 0.93 -0.21 0.00 0.00 178.00 179.82 2ayq h GLU 89 N 0.24 0.42 -0.24 1.05 3.07 -1.93 -2.26 114.58 114.93 2ayq h GLU 89 Ca 0.61 -0.03 0.07 0.00 -0.50 0.00 0.00 59.36 59.51 2ayq h GLU 89 Cb 1.85 -0.10 -0.01 0.00 -0.84 0.00 0.00 28.75 29.65 2ayq h GLU 89 CO -0.22 0.28 0.26 0.87 -1.40 0.00 0.00 179.01 178.80 2ayq h LYS 90 N 0.44 0.00 -0.38 2.33 6.56 -1.78 0.14 116.57 123.86 2ayq h LYS 90 Ca 0.18 0.00 -0.03 0.00 -1.06 0.00 0.00 60.65 59.74 2ayq h LYS 90 Cb 0.09 0.00 -0.02 0.00 -0.57 0.00 0.00 32.23 31.73 2ayq h LYS 90 CO -0.13 0.00 0.12 0.78 -2.06 0.00 0.00 179.45 178.16 2ayq h GLY 91 N 0.00 0.65 0.89 3.86 0.00 -1.57 0.44 103.07 107.34 2ayq h GLY 91 Ca 0.11 -0.39 -0.03 0.00 0.00 0.00 0.00 47.33 47.03 2ayq h GLY 91 CO -0.00 0.36 -0.30 -2.00 0.00 0.00 0.00 176.54 174.60 2ayq h LEU 92 N 0.47 -0.71 -0.45 3.11 5.85 -0.83 0.24 115.31 123.00 2ayq h LEU 92 Ca 0.12 -0.01 0.09 0.00 0.84 0.00 0.00 57.88 58.92 2ayq h LEU 92 Cb 0.26 0.18 -0.09 0.00 0.37 0.00 0.00 40.66 41.39 2ayq h LEU 92 CO -0.00 -0.42 -0.12 -0.07 -0.34 0.00 0.00 178.44 177.48 2ayq h LEU 93 N -0.96 -0.44 0.25 2.25 3.38 -1.15 -0.63 115.31 118.01 2ayq h LEU 93 Ca -0.09 0.14 0.01 0.00 0.09 0.00 0.00 57.88 58.03 2ayq h LEU 93 Cb 0.68 0.29 -0.02 0.00 0.09 0.00 0.00 40.66 41.69 2ayq h LEU 93 CO 0.14 -0.15 -0.29 1.23 0.09 0.00 0.00 178.44 179.46 2ayq h GLY 94 N -0.01 -0.62 0.22 0.83 0.00 -0.01 0.22 103.07 103.69 2ayq h GLY 94 Ca 0.22 0.33 0.15 0.00 0.00 0.00 0.00 47.33 48.03 2ayq h GLY 94 CO -0.47 -0.25 0.45 -2.00 0.00 0.00 0.00 176.54 174.27 2ayq h LEU 95 N -0.58 0.55 -0.70 3.11 5.85 -0.03 0.46 115.31 123.96 2ayq h LEU 95 Ca -0.00 0.09 -0.06 0.00 0.84 0.00 0.00 57.88 58.75 2ayq h LEU 95 Cb 0.55 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.55 2ayq h LEU 95 CO -0.08 0.23 0.22 -0.09 -0.34 0.00 0.00 178.44 178.37 2ayq h ARG 96 N 0.63 1.09 -0.33 1.25 2.43 -0.61 -0.54 114.38 118.30 2ayq h ARG 96 Ca 0.47 -0.23 -0.08 0.00 -0.81 0.00 0.00 59.98 59.33 2ayq h ARG 96 Cb 0.67 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 30.05 2ayq h ARG 96 CO -0.36 0.93 -0.10 -0.22 -1.51 0.00 0.00 179.97 178.71 2ayq h LYS 97 N 1.03 0.66 -0.49 0.20 3.64 0.12 -1.98 116.57 119.74 2ayq h LYS 97 Ca 0.23 -0.26 -0.04 0.00 -1.27 0.00 0.00 60.65 59.30 2ayq h LYS 97 Cb 0.30 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 32.07 2ayq h LYS 97 CO -0.01 0.84 0.14 1.49 -2.27 0.00 0.00 179.45 179.64 2ayq h GLU 98 N 0.43 0.74 0.00 1.90 4.57 0.16 -1.74 114.58 120.64 2ayq h GLU 98 Ca 0.08 -0.13 0.00 0.00 -1.18 0.00 0.00 59.36 58.13 2ayq h GLU 98 Cb 0.61 -0.12 0.00 0.00 -0.16 0.00 0.00 28.75 29.08 2ayq h GLU 98 CO 0.04 0.66 -0.18 -1.33 -1.18 0.00 0.00 179.01 177.02 2ayq n MET 99 N -4.30 0.02 -3.17 1.92 2.81 -0.24 -4.96 117.12 109.19 2ayq n MET 99 Ca 0.04 0.01 -0.14 0.00 -1.81 0.00 0.00 57.70 55.80 2ayq n MET 99 Cb 0.20 -1.52 0.07 0.00 -0.71 0.00 0.00 33.22 31.27 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 1.49 -0.26 3.59 3.03 0.00 -0.66 -4.98 105.19 107.39 2ayq n GLY 100 Ca 0.06 0.03 -0.40 0.00 0.00 0.00 0.00 46.02 45.71 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 -5.57 4.18 -0.15 0.99 1.43 -1.00 -4.63 118.68 113.93 2ayq s LEU 101 Ca 0.02 0.17 0.11 0.00 -1.03 0.00 0.00 54.13 53.40 2ayq s LEU 101 Cb -0.00 -2.50 -0.17 0.00 0.03 0.00 0.00 46.19 43.55 2ayq s LEU 101 CO 0.61 -0.30 0.01 2.22 0.23 0.00 0.00 176.35 179.11 2ayq n PHE 102 N 5.49 0.00 -3.58 0.29 1.16 -0.65 -4.75 117.46 115.42 2ayq n PHE 102 Ca -0.07 0.00 -0.36 0.00 -1.87 0.00 0.00 57.45 55.15 2ayq n PHE 102 Cb 0.50 -0.71 -0.07 0.00 -1.61 0.00 0.00 39.48 37.59 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 -2.35 3.62 -0.39 1.98 0.00 -0.76 0.82 121.76 124.67 2ayq s ALA 103 Ca -0.10 -0.49 -0.07 0.00 0.00 0.00 0.00 51.96 51.29 2ayq s ALA 103 Cb 0.05 -2.34 0.07 0.00 0.00 0.00 0.00 23.12 20.89 2ayq s ALA 103 CO 0.56 0.12 0.19 1.21 0.00 0.00 0.00 175.76 177.84 2ayq s ASN 104 N 0.39 5.44 -0.36 0.00 2.47 0.96 -0.61 114.94 123.24 2ayq s ASN 104 Ca 0.15 -1.46 -0.18 0.00 0.42 0.00 0.00 52.86 51.80 2ayq s ASN 104 Cb -0.13 -1.91 -0.00 0.00 -1.45 0.00 0.00 41.25 37.76 2ayq s ASN 104 CO 0.03 -0.46 0.49 -0.22 -3.72 0.00 0.00 177.10 173.22 2ayq s LEU 105 N 1.37 4.42 -0.34 3.21 0.20 0.82 -0.85 118.68 127.50 2ayq s LEU 105 Ca 0.02 -0.14 0.01 0.00 0.69 0.00 0.00 54.13 54.70 2ayq s LEU 105 Cb -0.22 -2.53 0.11 0.00 -0.43 0.00 0.00 46.19 43.12 2ayq s LEU 105 CO 0.01 -0.48 0.11 -0.60 -0.29 0.00 0.00 176.35 175.10 2ayq s ARG 106 N 2.32 0.99 0.33 1.98 3.52 -0.65 -1.33 118.95 126.11 2ayq s ARG 106 Ca 0.17 -1.43 -0.27 0.00 -0.13 0.00 0.00 55.73 54.07 2ayq s ARG 106 Cb -0.16 -2.33 -0.09 0.00 -1.56 0.00 0.00 34.95 30.81 2ayq s ARG 106 CO 0.13 -1.01 1.05 -1.25 -0.81 0.00 0.00 175.30 173.41 2ayq s PRO 107 N 1.22 4.47 -0.06 5.12 0.04 -1.26 -2.73 135.00 141.80 2ayq s PRO 107 Ca 0.12 1.61 -0.01 0.00 0.04 0.00 0.00 61.00 62.75 2ayq s PRO 107 Cb -0.19 -2.90 0.03 0.00 0.04 0.00 0.00 34.50 31.47 2ayq s PRO 107 CO -0.17 0.11 0.00 0.08 0.04 0.00 0.00 177.00 177.07 2ayq s VAL 108 N -1.41 0.33 0.05 -0.36 1.01 0.04 -4.66 120.40 115.40 2ayq s VAL 108 Ca 0.50 0.12 -0.00 0.00 0.00 0.00 0.00 61.98 62.60 2ayq s VAL 108 Cb -0.26 -0.48 -0.03 0.00 0.00 0.00 0.00 36.38 35.61 2ayq s VAL 108 CO 0.33 0.24 -0.04 -1.59 0.00 0.00 0.00 175.10 174.04 2ayq s LYS 109 N 1.80 0.54 0.28 2.72 -2.85 -1.26 -0.78 119.74 120.18 2ayq s LYS 109 Ca 0.02 -1.03 -0.25 0.00 -1.00 0.00 0.00 55.97 53.71 2ayq s LYS 109 Cb -0.13 0.11 -0.09 0.00 -2.06 0.00 0.00 37.83 35.67 2ayq s LYS 109 CO -0.04 -0.08 0.87 0.00 0.10 0.00 0.00 175.35 176.20 2ayq s ALA 110 N -3.05 3.29 -0.21 0.59 0.00 -0.31 -4.92 121.76 117.16 2ayq s ALA 110 Ca -0.00 0.42 -0.00 0.00 0.00 0.00 0.00 51.96 52.38 2ayq s ALA 110 Cb 0.02 -3.07 0.05 0.00 0.00 0.00 0.00 23.12 20.12 2ayq s ALA 110 CO -0.06 0.23 -0.04 0.71 0.00 0.00 0.00 175.76 176.59 2ayq s TYR 111 N -1.53 1.99 0.27 0.00 2.02 -1.26 -4.89 117.35 113.95 2ayq s TYR 111 Ca 0.47 -1.42 -0.01 0.00 -0.37 0.00 0.00 57.07 55.74 2ayq s TYR 111 Cb -0.19 -1.42 0.62 0.00 -0.40 0.00 0.00 41.96 40.57 2ayq s TYR 111 CO 0.24 -0.70 1.41 0.00 -1.57 0.00 0.00 175.55 174.92 2ayq n ALA 112 N 4.79 0.40 0.30 3.71 0.00 -1.26 -0.15 120.51 128.29 2ayq n ALA 112 Ca -0.12 0.97 0.18 0.00 0.00 0.00 0.00 53.44 54.47 2ayq n ALA 112 Cb 0.46 -0.68 0.93 0.00 0.00 0.00 0.00 19.45 20.16 2ayq n ALA 112 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 2ayq h THR 113 N 0.00 0.25 -0.01 0.00 2.02 -1.96 -1.77 112.91 111.44 2ayq h THR 113 Ca 0.52 -0.26 0.00 0.00 0.77 0.00 0.00 66.41 67.44 2ayq h THR 113 Cb 1.00 1.20 0.00 0.00 -1.74 0.00 0.00 68.15 68.62 2ayq h THR 113 CO -0.87 0.04 -0.48 0.18 0.37 0.00 0.00 175.52 174.77 2ayq n LEU 114 N -3.36 1.79 -0.25 2.58 4.77 0.79 -2.26 117.00 121.05 2ayq n LEU 114 Ca -0.02 -0.65 0.16 0.00 -0.03 0.00 0.00 56.01 55.46 2ayq n LEU 114 Cb 0.17 -0.02 0.45 0.00 -2.33 0.00 0.00 43.42 41.68 2ayq n LEU 114 CO 0.25 0.34 1.22 -0.07 -1.33 0.00 0.00 177.39 177.80 2ayq h LEU 115 N 2.06 0.53 -1.52 2.23 3.38 -1.08 0.17 115.31 121.08 2ayq h LEU 115 Ca 0.00 0.04 -0.04 0.00 0.09 0.00 0.00 57.88 57.98 2ayq h LEU 115 Cb 0.70 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.38 2ayq h LEU 115 CO 0.00 0.23 -0.10 0.78 0.09 0.00 0.00 178.44 179.44 2ayq h ASN 116 N 0.54 0.17 1.39 -0.43 4.21 -1.79 -2.95 115.58 116.73 2ayq h ASN 116 Ca 0.46 -0.03 -0.08 0.00 1.21 0.00 0.00 56.30 57.86 2ayq h ASN 116 Cb 0.96 -0.05 -0.01 0.00 -1.12 0.00 0.00 38.32 38.10 2ayq h ASN 116 CO -0.20 0.30 -0.63 0.00 -1.29 0.00 0.00 177.43 175.61 2ayq h ALA 117 N 1.72 0.72 -2.62 -0.83 0.00 -1.25 -3.47 119.26 113.53 2ayq h ALA 117 Ca 0.04 -0.36 -0.58 0.00 0.00 0.00 0.00 54.91 54.01 2ayq h ALA 117 Cb 0.30 0.02 0.16 0.00 0.00 0.00 0.00 17.79 18.26 2ayq h ALA 117 CO 0.02 0.45 -0.04 0.45 0.00 0.00 0.00 179.25 180.13 2ayq n SER 118 N -3.06 0.28 0.21 0.00 2.88 -1.05 -4.80 113.62 108.08 2ayq n SER 118 Ca -0.00 0.84 0.09 0.00 -1.33 0.00 0.00 58.87 58.47 2ayq n SER 118 Cb 0.68 -1.31 0.30 0.00 -0.75 0.00 0.00 64.21 63.13 2ayq n SER 118 CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 2ayq h PRO 119 N 0.65 0.00 -6.68 -1.46 0.11 -1.77 -3.45 132.00 119.40 2ayq h PRO 119 Ca -0.46 0.00 -0.50 0.00 0.11 0.00 0.00 66.00 65.14 2ayq h PRO 119 Cb 1.37 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.46 2ayq h PRO 119 CO 0.51 0.22 0.05 -0.51 -0.21 0.00 0.00 178.00 178.07 2ayq s LEU 120 N -6.49 4.04 0.22 2.35 1.43 -1.26 -5.02 118.68 113.95 2ayq s LEU 120 Ca 0.03 1.16 -0.30 0.00 -1.03 0.00 0.00 54.13 53.99 2ayq s LEU 120 Cb 0.08 -3.97 -0.10 0.00 0.03 0.00 0.00 46.19 42.23 2ayq s LEU 120 CO 0.66 -0.22 1.47 -0.54 0.23 0.00 0.00 176.35 177.95 2ayq s LYS 121 N -3.13 4.26 0.11 1.70 1.02 -1.26 -4.73 119.74 117.70 2ayq s LYS 121 Ca 0.52 2.30 -0.04 0.00 0.02 0.00 0.00 55.97 58.77 2ayq s LYS 121 Cb -0.10 -3.13 0.16 0.00 -0.52 0.00 0.00 37.83 34.24 2ayq s LYS 121 CO 0.21 -0.47 0.63 -2.13 -0.92 0.00 0.00 175.35 172.67 2ayq n ARG 122 N 2.81 -0.05 0.14 1.68 0.63 -1.26 0.05 116.66 120.65 2ayq n ARG 122 Ca 0.09 0.62 0.12 0.00 -0.92 0.00 0.00 57.85 57.76 2ayq n ARG 122 Cb 0.40 -0.93 0.64 0.00 0.45 0.00 0.00 32.46 33.02 2ayq n ARG 122 CO 0.00 0.00 0.00 0.93 -2.51 0.00 0.00 177.63 176.05 2ayq h GLU 123 N 0.00 0.05 0.00 -0.14 3.07 -1.94 -0.78 114.58 114.83 2ayq h GLU 123 Ca 0.18 -0.00 -0.08 0.00 -0.50 0.00 0.00 59.36 58.95 2ayq h GLU 123 Cb 0.28 -0.01 -0.01 0.00 -0.84 0.00 0.00 28.75 28.17 2ayq h GLU 123 CO -0.41 0.03 -0.49 0.00 -1.40 0.00 0.00 179.01 176.74 2ayq h ARG 124 N 0.05 0.00 0.00 2.33 3.08 -0.73 -3.38 114.38 115.72 2ayq h ARG 124 Ca 0.11 0.00 -0.07 0.00 0.07 0.00 0.00 59.98 60.09 2ayq h ARG 124 Cb 0.38 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.42 2ayq h ARG 124 CO -0.01 0.84 -0.31 -0.24 -1.07 0.00 0.00 179.97 179.18 2ayq h VAL 125 N -1.00 0.71 -4.11 2.04 3.04 -1.48 -3.41 116.25 112.05 2ayq h VAL 125 Ca -0.13 -1.39 -0.56 0.00 -1.01 0.00 0.00 66.70 63.62 2ayq h VAL 125 Cb 0.98 1.90 0.15 0.00 -2.01 0.00 0.00 31.29 32.32 2ayq h VAL 125 CO -0.08 0.30 0.52 -0.70 -1.01 0.00 0.00 177.57 176.61 2ayq s GLU 126 N -3.56 2.61 0.00 4.17 2.12 -0.31 -2.64 118.70 121.09 2ayq s GLU 126 Ca 0.01 2.06 0.00 0.00 0.36 0.00 0.00 54.97 57.40 2ayq s GLU 126 Cb 0.10 -1.87 0.00 0.00 0.26 0.00 0.00 34.13 32.62 2ayq s GLU 126 CO 0.67 -1.55 0.00 0.09 -0.54 0.00 0.00 175.26 173.93 2ayq n ASN 127 N -1.84 0.00 -4.76 -1.70 3.02 -1.26 -4.87 115.26 103.84 2ayq n ASN 127 Ca 0.15 0.00 -0.41 0.00 -0.03 0.00 0.00 54.58 54.29 2ayq n ASN 127 Cb 0.48 -1.22 0.00 0.00 -0.61 0.00 0.00 39.78 38.43 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 2.06 -2.72 2.41 0.31 -1.08 -4.85 118.33 112.45 2ayq n VAL 128 Ca 0.00 -0.50 -0.05 0.00 -0.01 0.00 0.00 64.34 63.78 2ayq n VAL 128 Cb 0.00 -1.91 0.04 0.00 -0.91 0.00 0.00 33.84 31.06 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 0.45 -2.44 -4.66 4.52 2.03 -1.25 -1.16 116.55 114.04 2ayq n ASP 129 Ca 0.02 -2.29 -0.29 0.00 0.52 0.00 0.00 54.79 52.75 2ayq n ASP 129 Cb 0.39 1.33 -0.10 0.00 -0.72 0.00 0.00 41.12 42.01 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 0.39 2.72 -0.06 -2.67 0.05 0.03 -4.62 118.68 114.51 2ayq s LEU 130 Ca 0.28 -1.45 -0.03 0.00 0.05 0.00 0.00 54.13 52.99 2ayq s LEU 130 Cb 0.12 -0.85 0.04 0.00 -2.05 0.00 0.00 46.19 43.45 2ayq s LEU 130 CO -0.12 -0.56 0.13 -0.69 -0.55 0.00 0.00 176.35 174.57 2ayq s VAL 131 N -2.76 -0.11 -0.23 1.48 1.01 -0.08 -0.78 120.40 118.93 2ayq s VAL 131 Ca 0.27 0.24 -0.09 0.00 0.00 0.00 0.00 61.98 62.40 2ayq s VAL 131 Cb 0.08 -0.23 -0.04 0.00 0.00 0.00 0.00 36.38 36.18 2ayq s VAL 131 CO 0.14 0.10 0.12 -0.63 0.00 0.00 0.00 175.10 174.82 2ayq s ILE 132 N 1.50 4.94 -0.28 2.22 1.01 -1.11 -0.64 121.20 128.84 2ayq s ILE 132 Ca -0.05 0.03 -0.09 0.00 0.00 0.00 0.00 60.65 60.54 2ayq s ILE 132 Cb -0.12 -3.29 -0.02 0.00 0.01 0.00 0.00 42.46 39.04 2ayq s ILE 132 CO -0.05 0.36 0.13 -0.69 0.00 0.00 0.00 174.94 174.68 2ayq s VAL 133 N 1.13 4.60 -0.05 2.92 1.01 0.12 -1.64 120.40 128.49 2ayq s VAL 133 Ca 0.06 -0.24 0.03 0.00 0.00 0.00 0.00 61.98 61.83 2ayq s VAL 133 Cb -0.14 -3.25 -0.03 0.00 0.00 0.00 0.00 36.38 32.96 2ayq s VAL 133 CO 0.04 0.19 -0.12 -0.60 0.00 0.00 0.00 175.10 174.62 2ayq s ARG 134 N 1.64 2.57 0.06 2.72 3.52 -0.03 -2.06 118.95 127.36 2ayq s ARG 134 Ca 0.06 -0.66 -0.30 0.00 -0.13 0.00 0.00 55.73 54.70 2ayq s ARG 134 Cb -0.16 -2.44 -0.05 0.00 -1.56 0.00 0.00 34.95 30.75 2ayq s ARG 134 CO 0.06 0.64 0.99 -2.00 -0.81 0.00 0.00 175.30 174.18 2ayq s GLU 135 N -0.76 4.61 -0.18 5.12 -6.30 -0.78 -0.03 118.70 120.38 2ayq s GLU 135 Ca 0.12 1.47 0.09 0.00 -2.50 0.00 0.00 54.97 54.15 2ayq s GLU 135 Cb -0.11 -3.41 -0.17 0.00 0.00 0.00 0.00 34.13 30.44 2ayq s GLU 135 CO 0.01 0.06 -0.04 1.28 0.02 0.00 0.00 175.26 176.58 2ayq n LEU 136 N 3.34 1.22 -0.07 2.70 4.77 0.24 -2.59 117.00 126.62 2ayq n LEU 136 Ca 0.04 -0.05 -0.12 0.00 -0.03 0.00 0.00 56.01 55.86 2ayq n LEU 136 Cb 0.50 -0.06 -0.06 0.00 -2.33 0.00 0.00 43.42 41.47 2ayq n LEU 136 CO 0.52 0.59 0.68 0.71 -1.33 0.00 0.00 177.39 178.55 2ayq h THR 137 N 0.00 1.30 -1.45 -5.08 1.35 -1.86 -3.48 112.91 103.70 2ayq h THR 137 Ca -0.45 -1.11 0.00 0.00 -0.55 0.00 0.00 66.41 64.30 2ayq h THR 137 Cb 1.89 1.63 0.00 0.00 -1.73 0.00 0.00 68.15 69.94 2ayq h THR 137 CO -0.02 0.33 0.00 0.61 -0.25 0.00 0.00 175.52 176.20 2ayq n GLY 138 N -0.05 4.06 1.84 5.82 0.00 -1.26 -4.75 105.19 110.85 2ayq n GLY 138 Ca -0.05 -1.89 0.00 0.00 0.00 0.00 0.00 46.02 44.08 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 -1.80 0.10 -0.02 0.00 -0.60 -4.31 105.19 103.57 2ayq n GLY 139 Ca 0.00 -1.86 0.10 0.00 0.00 0.00 0.00 46.02 44.26 2ayq n GLY 139 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2ayq n LEU 140 N 0.00 0.50 0.08 0.99 7.94 -1.26 -2.88 117.00 122.37 2ayq n LEU 140 Ca 0.00 0.63 -0.12 0.00 -1.11 0.00 0.00 56.01 55.42 2ayq n LEU 140 Cb 0.00 -0.58 -0.06 0.00 0.53 0.00 0.00 43.42 43.32 2ayq n LEU 140 CO 0.00 -0.53 0.15 1.88 -1.11 0.00 0.00 177.39 177.79 2ayq h TYR 141 N 0.00 0.44 -2.57 1.96 0.05 -1.83 -3.38 116.97 111.64 2ayq h TYR 141 Ca 0.00 -0.26 -0.60 0.00 0.05 0.00 0.00 58.73 57.92 2ayq h TYR 141 Cb 0.30 -0.04 -0.41 0.00 1.01 0.00 0.00 36.73 37.59 2ayq h TYR 141 CO 0.00 1.11 -0.71 1.19 -1.05 0.00 0.00 178.16 178.70 2ayq n PHE 142 N -3.65 2.23 -3.65 4.88 3.72 -1.14 -5.04 117.46 114.81 2ayq n PHE 142 Ca -0.06 -4.01 -0.03 0.00 -0.05 0.00 0.00 57.45 53.30 2ayq n PHE 142 Cb 0.87 -0.42 -0.05 0.00 -0.94 0.00 0.00 39.48 38.94 2ayq n PHE 142 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 2ayq s GLY 143 N -1.48 -0.68 0.31 1.37 0.00 -1.25 -4.59 107.32 101.00 2ayq s GLY 143 Ca 0.32 2.32 0.08 0.00 0.00 0.00 0.00 44.72 47.44 2ayq s GLY 143 CO -0.12 2.82 0.21 0.50 0.00 0.00 0.00 173.10 176.51 2ayq s ARG 144 N 2.48 2.69 0.56 2.90 3.00 -1.26 -3.34 118.95 125.98 2ayq s ARG 144 Ca -0.07 -1.28 -0.20 0.00 0.00 0.00 0.00 55.73 54.18 2ayq s ARG 144 Cb -0.10 -2.42 -0.04 0.00 0.00 0.00 0.00 34.95 32.38 2ayq s ARG 144 CO -0.19 0.21 1.25 -1.25 0.00 0.00 0.00 175.30 175.32 2ayq s PRO 145 N -3.90 3.13 -0.44 3.54 0.04 -1.26 -4.75 135.00 131.36 2ayq s PRO 145 Ca 0.37 1.96 0.08 0.00 0.04 0.00 0.00 61.00 63.44 2ayq s PRO 145 Cb -0.06 -2.10 0.27 0.00 0.04 0.00 0.00 34.50 32.65 2ayq s PRO 145 CO 0.25 -1.12 0.79 0.45 0.04 0.00 0.00 177.00 177.41 2ayq n SER 146 N -1.25 -1.29 -3.15 6.66 2.88 -1.26 -2.92 113.62 113.30 2ayq n SER 146 Ca 0.12 -3.14 -0.19 0.00 -1.33 0.00 0.00 58.87 54.33 2ayq n SER 146 Cb 0.48 0.71 -0.08 0.00 -0.75 0.00 0.00 64.21 64.57 2ayq n SER 146 CO 0.00 0.00 0.00 -1.84 -1.23 0.00 0.00 175.04 171.97 2ayq n GLU 147 N 1.15 0.39 -3.55 -1.46 0.00 -1.17 -4.96 120.64 111.05 2ayq n GLU 147 Ca 0.15 -3.21 -0.41 0.00 0.00 0.00 0.00 57.16 53.68 2ayq n GLU 147 Cb 0.62 2.64 -0.10 0.00 0.00 0.00 0.00 31.44 34.60 2ayq n GLU 147 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.13 178.16 2ayq s ARG 148 N -3.31 2.73 0.40 3.44 0.52 -1.26 -2.01 118.95 119.47 2ayq s ARG 148 Ca 0.38 -1.37 -0.23 0.00 -0.52 0.00 0.00 55.73 53.99 2ayq s ARG 148 Cb 0.02 -3.86 -0.10 0.00 0.52 0.00 0.00 34.95 31.53 2ayq s ARG 148 CO 0.27 -0.93 0.99 1.03 0.02 0.00 0.00 175.30 176.68 2ayq s ARG 149 N 1.50 4.25 1.20 3.54 0.52 0.14 -4.64 118.95 125.47 2ayq s ARG 149 Ca 0.03 1.32 -0.20 0.00 -0.52 0.00 0.00 55.73 56.36 2ayq s ARG 149 Cb -0.23 -2.43 0.29 0.00 0.52 0.00 0.00 34.95 33.10 2ayq s ARG 149 CO 0.04 -0.03 1.15 0.20 0.02 0.00 0.00 175.30 176.67 2ayq s GLY 150 N -1.83 1.62 0.44 -3.53 0.00 -1.26 -2.39 107.32 100.37 2ayq s GLY 150 Ca 0.58 -1.09 -0.23 0.00 0.00 0.00 0.00 44.72 43.98 2ayq s GLY 150 CO 0.21 -0.17 1.13 2.56 0.00 0.00 0.00 173.10 176.82 2ayq s PRO 151 N -5.56 3.89 -1.35 2.90 0.04 -1.26 -4.65 135.00 129.01 2ayq s PRO 151 Ca 0.73 1.69 0.00 0.00 0.04 0.00 0.00 61.00 63.46 2ayq s PRO 151 Cb -0.07 -2.45 0.00 0.00 0.04 0.00 0.00 34.50 32.02 2ayq s PRO 151 CO 0.55 -0.42 0.00 0.41 0.04 0.00 0.00 177.00 177.58 2ayq n GLY 152 N 0.40 0.67 2.48 0.56 0.00 -1.26 -0.93 105.19 107.11 2ayq n GLY 152 Ca 0.07 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.94 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 -2.23 -2.21 -0.27 1.61 1.02 -1.22 -4.83 120.64 112.50 2ayq n GLU 153 Ca -0.15 0.69 -0.03 0.00 -0.02 0.00 0.00 57.16 57.65 2ayq n GLU 153 Cb 0.51 -5.31 0.02 0.00 -0.02 0.00 0.00 31.44 26.64 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 -1.88 3.81 -3.69 1.62 3.02 -0.10 -4.55 115.26 113.48 2ayq n ASN 154 Ca -0.16 -2.29 -0.14 0.00 -0.03 0.00 0.00 54.58 51.96 2ayq n ASN 154 Cb 0.63 -0.70 -0.09 0.00 -0.61 0.00 0.00 39.78 39.00 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 -0.38 0.62 0.03 3.52 2.12 -1.01 -4.96 118.70 118.65 2ayq s GLU 155 Ca 0.07 0.65 0.00 0.00 0.36 0.00 0.00 54.97 56.04 2ayq s GLU 155 Cb 0.05 0.30 -0.03 0.00 0.26 0.00 0.00 34.13 34.72 2ayq s GLU 155 CO 0.01 -0.09 -0.04 0.54 -0.54 0.00 0.00 175.26 175.14 2ayq s VAL 156 N 0.12 0.23 0.07 3.70 0.11 -1.26 0.28 120.40 123.66 2ayq s VAL 156 Ca -0.01 -1.14 -0.11 0.00 -2.93 0.00 0.00 61.98 57.79 2ayq s VAL 156 Cb -0.03 -0.60 0.01 0.00 -1.53 0.00 0.00 36.38 34.23 2ayq s VAL 156 CO 0.01 -0.58 0.25 0.68 -3.33 0.00 0.00 175.10 172.14 2ayq s VAL 157 N -1.95 0.11 0.01 2.04 -7.23 -0.85 -4.94 120.40 107.59 2ayq s VAL 157 Ca -0.10 -0.90 -0.02 0.00 -1.81 0.00 0.00 61.98 59.16 2ayq s VAL 157 Cb -0.06 -1.11 -0.01 0.00 0.56 0.00 0.00 36.38 35.75 2ayq s VAL 157 CO -0.02 -0.50 0.02 -1.81 -0.31 0.00 0.00 175.10 172.48 2ayq s ASP 158 N -2.46 0.16 -0.07 4.85 1.01 -1.25 -3.03 116.67 115.88 2ayq s ASP 158 Ca -0.00 -0.37 0.05 0.00 0.71 0.00 0.00 52.55 52.94 2ayq s ASP 158 Cb 0.02 0.12 -0.01 0.00 1.01 0.00 0.00 42.92 44.06 2ayq s ASP 158 CO -0.07 -0.29 -0.25 -0.89 0.21 0.00 0.00 175.17 173.88 2ayq s THR 159 N -1.29 2.04 -0.44 -1.27 2.01 -1.15 -4.98 115.64 110.56 2ayq s THR 159 Ca -0.14 -1.04 -0.14 0.00 0.31 0.00 0.00 61.69 60.67 2ayq s THR 159 Cb -0.08 -1.74 0.06 0.00 0.01 0.00 0.00 72.50 70.75 2ayq s THR 159 CO -0.00 0.56 0.33 -0.22 -0.69 0.00 0.00 174.62 174.60 2ayq s LEU 160 N -0.01 5.34 -0.04 4.42 2.96 -1.26 -4.08 118.68 126.01 2ayq s LEU 160 Ca -0.08 -1.22 0.06 0.00 -0.22 0.00 0.00 54.13 52.67 2ayq s LEU 160 Cb -0.15 -2.13 -0.01 0.00 0.50 0.00 0.00 46.19 44.40 2ayq s LEU 160 CO 0.05 -0.56 -0.21 0.00 -1.32 0.00 0.00 176.35 174.31 2ayq s ALA 161 N 1.61 1.82 0.02 5.97 0.00 -1.23 -4.88 121.76 125.07 2ayq s ALA 161 Ca 0.04 -0.88 -0.03 0.00 0.00 0.00 0.00 51.96 51.09 2ayq s ALA 161 Cb -0.22 -0.55 -0.02 0.00 0.00 0.00 0.00 23.12 22.33 2ayq s ALA 161 CO 0.07 0.37 0.04 0.71 0.00 0.00 0.00 175.76 176.94 2ayq s TYR 162 N -0.17 0.23 0.10 0.00 2.02 -1.26 -1.56 117.35 116.71 2ayq s TYR 162 Ca -0.01 -0.50 0.07 0.00 -0.37 0.00 0.00 57.07 56.27 2ayq s TYR 162 Cb -0.12 -0.17 -0.04 0.00 -0.40 0.00 0.00 41.96 41.24 2ayq s TYR 162 CO 0.02 -0.27 -0.11 0.95 -1.57 0.00 0.00 175.55 174.57 2ayq s THR 163 N -1.98 3.33 0.32 -0.71 -4.23 -1.26 -5.01 115.64 106.11 2ayq s THR 163 Ca -0.11 -1.27 0.10 0.00 -1.18 0.00 0.00 61.69 59.23 2ayq s THR 163 Cb -0.05 -2.55 0.31 0.00 1.34 0.00 0.00 72.50 71.55 2ayq s THR 163 CO -0.02 0.12 1.71 -0.09 -0.54 0.00 0.00 174.62 175.81 2ayq h ARG 164 N 3.67 0.50 -0.33 3.99 2.43 -2.01 -0.30 114.38 122.33 2ayq h ARG 164 Ca -0.49 -0.03 -0.13 0.00 -0.81 0.00 0.00 59.98 58.52 2ayq h ARG 164 Cb 1.17 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 30.60 2ayq h ARG 164 CO 0.52 0.33 -0.30 1.49 -1.51 0.00 0.00 179.97 180.50 2ayq h GLU 165 N 0.51 0.79 -0.71 0.20 4.81 -1.99 -0.76 114.58 117.44 2ayq h GLU 165 Ca 0.65 -0.41 0.09 0.00 -0.13 0.00 0.00 59.36 59.56 2ayq h GLU 165 Cb 1.29 0.01 -0.05 0.00 0.63 0.00 0.00 28.75 30.63 2ayq h GLU 165 CO -0.51 1.03 0.47 0.93 -0.73 0.00 0.00 179.01 180.20 2ayq h GLU 166 N 0.56 0.61 0.02 1.92 5.08 -1.46 -1.84 114.58 119.47 2ayq h GLU 166 Ca 0.06 -0.04 -0.00 0.00 -1.00 0.00 0.00 59.36 58.38 2ayq h GLU 166 Cb 0.88 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.99 2ayq h GLU 166 CO 0.08 0.40 -0.01 0.82 -1.00 0.00 0.00 179.01 179.30 2ayq h ILE 167 N 0.63 1.27 -0.74 3.13 2.04 -1.27 -3.22 117.51 119.35 2ayq h ILE 167 Ca 0.32 -1.83 0.17 0.00 1.00 0.00 0.00 64.86 64.52 2ayq h ILE 167 Cb 0.43 2.35 -0.12 0.00 -0.74 0.00 0.00 36.82 38.74 2ayq h ILE 167 CO -0.11 0.41 0.06 -0.33 0.00 0.00 0.00 178.15 178.18 2ayq h GLU 168 N -0.95 0.14 -0.54 2.37 5.08 -0.82 -1.79 114.58 118.06 2ayq h GLU 168 Ca -0.00 -0.01 -0.09 0.00 -1.00 0.00 0.00 59.36 58.25 2ayq h GLU 168 Cb 0.70 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.90 2ayq h GLU 168 CO 0.00 0.09 -0.03 0.07 -1.00 0.00 0.00 179.01 178.15 2ayq h ARG 169 N 0.15 0.98 -0.60 2.33 0.11 -1.48 -1.40 114.38 114.46 2ayq h ARG 169 Ca 0.41 -0.33 -0.09 0.00 0.10 0.00 0.00 59.98 60.08 2ayq h ARG 169 Cb 0.73 -0.08 -0.02 0.00 1.11 0.00 0.00 29.97 31.71 2ayq h ARG 169 CO -0.62 1.00 0.01 0.97 0.10 0.00 0.00 179.97 181.43 2ayq h ILE 170 N 0.85 1.26 -0.25 0.08 6.09 -1.36 -1.81 117.51 122.38 2ayq h ILE 170 Ca 0.15 -1.12 -0.19 0.00 -1.37 0.00 0.00 64.86 62.32 2ayq h ILE 170 Cb 0.57 0.79 0.00 0.00 0.47 0.00 0.00 36.82 38.65 2ayq h ILE 170 CO 0.03 0.41 -0.60 0.40 -3.07 0.00 0.00 178.15 175.32 2ayq h ILE 171 N 0.95 1.28 -0.79 2.19 2.04 -1.32 -1.66 117.51 120.20 2ayq h ILE 171 Ca 0.17 -1.79 -0.05 0.00 1.00 0.00 0.00 64.86 64.20 2ayq h ILE 171 Cb 0.53 1.75 -0.03 0.00 -0.74 0.00 0.00 36.82 38.32 2ayq h ILE 171 CO 0.03 0.58 0.31 -0.33 0.00 0.00 0.00 178.15 178.74 2ayq h GLU 172 N 0.61 1.18 -0.11 2.37 5.08 -1.15 -0.08 114.58 122.49 2ayq h GLU 172 Ca -0.01 -0.22 -0.00 0.00 -1.00 0.00 0.00 59.36 58.14 2ayq h GLU 172 Cb 1.22 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 30.27 2ayq h GLU 172 CO 0.13 0.96 0.07 -0.22 -1.00 0.00 0.00 179.01 178.95 2ayq h LYS 173 N 1.15 0.16 -0.28 2.33 1.63 -1.24 -1.36 116.57 118.97 2ayq h LYS 173 Ca 0.26 -0.02 0.06 0.00 -0.85 0.00 0.00 60.65 60.11 2ayq h LYS 173 Cb 0.22 -0.03 -0.06 0.00 -0.60 0.00 0.00 32.23 31.76 2ayq h LYS 173 CO -0.02 0.16 -0.13 0.00 -3.45 0.00 0.00 179.45 176.01 2ayq h ALA 174 N 0.98 0.10 -0.17 5.00 0.00 -0.74 -0.50 119.26 123.94 2ayq h ALA 174 Ca 0.04 0.11 0.05 0.00 0.00 0.00 0.00 54.91 55.10 2ayq h ALA 174 Cb 0.05 0.31 -0.05 0.00 0.00 0.00 0.00 17.79 18.10 2ayq h ALA 174 CO -0.01 -0.53 -0.14 0.74 0.00 0.00 0.00 179.25 179.31 2ayq h PHE 175 N -0.09 -0.36 -0.84 0.00 0.04 -0.74 -0.93 116.94 114.03 2ayq h PHE 175 Ca 0.15 0.02 0.10 0.00 2.80 0.00 0.00 57.97 61.04 2ayq h PHE 175 Cb 0.31 0.19 -0.06 0.00 2.20 0.00 0.00 35.95 38.58 2ayq h PHE 175 CO -0.32 -0.21 0.54 1.96 -0.60 0.00 0.00 178.31 179.68 2ayq h GLN 176 N -0.16 0.74 -0.32 1.51 4.20 -0.44 -0.78 115.11 119.87 2ayq h GLN 176 Ca 0.11 -0.04 -0.17 0.00 0.06 0.00 0.00 58.65 58.60 2ayq h GLN 176 Cb 0.31 -0.17 -0.00 0.00 0.30 0.00 0.00 27.48 27.92 2ayq h GLN 176 CO -0.26 0.49 -0.46 -0.07 -0.67 0.00 0.00 178.83 177.86 2ayq h LEU 177 N 0.77 0.94 -1.04 1.46 3.38 -0.13 -2.97 115.31 117.71 2ayq h LEU 177 Ca 0.39 -0.46 -0.04 0.00 0.09 0.00 0.00 57.88 57.85 2ayq h LEU 177 Cb 0.48 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.93 2ayq h LEU 177 CO -0.16 1.25 0.18 0.00 0.09 0.00 0.00 178.44 179.80 2ayq h ALA 178 N 0.78 1.23 0.00 1.53 0.00 0.10 -2.33 119.26 120.57 2ayq h ALA 178 Ca 0.04 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.75 2ayq h ALA 178 Cb 1.05 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.61 2ayq h ALA 178 CO 0.11 0.55 -0.05 0.37 0.00 0.00 0.00 179.25 180.22 2ayq h GLN 179 N 0.85 0.00 -0.01 0.00 4.15 -1.04 0.15 115.11 119.21 2ayq h GLN 179 Ca 0.19 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.61 2ayq h GLN 179 Cb 0.24 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.93 2ayq h GLN 179 CO -0.01 0.05 -0.32 0.44 -1.93 0.00 0.00 178.83 177.06 2ayq n ILE 180 N -4.25 0.00 0.00 2.39 -5.35 -0.91 -4.76 119.36 106.48 2ayq n ILE 180 Ca -0.03 -0.19 0.00 0.00 -0.27 0.00 0.00 62.75 62.26 2ayq n ILE 180 Cb 0.13 0.75 0.00 0.00 -1.74 0.00 0.00 39.64 38.78 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 -0.31 1.14 -0.15 6.28 1.74 -0.01 -4.98 116.66 120.36 2ayq n ARG 181 Ca 0.12 0.00 0.04 0.00 -0.77 0.00 0.00 57.85 57.24 2ayq n ARG 181 Cb 0.40 0.00 0.12 0.00 -1.02 0.00 0.00 32.46 31.96 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 1.69 -3.62 5.56 1.74 -1.23 -4.92 116.66 115.87 2ayq n ARG 182 Ca 0.00 -0.99 -0.22 0.00 -0.77 0.00 0.00 57.85 55.86 2ayq n ARG 182 Cb 0.00 -1.25 0.06 0.00 -1.02 0.00 0.00 32.46 30.25 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 0.30 -6.57 -3.65 5.56 5.02 0.31 -4.97 118.16 114.16 2ayq n LYS 183 Ca 0.09 0.76 -0.26 0.00 -2.02 0.00 0.00 58.31 56.87 2ayq n LYS 183 Cb 0.25 -5.68 -0.17 0.00 -0.02 0.00 0.00 35.03 29.42 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 -6.01 0.24 -0.15 1.97 1.02 -1.26 -1.57 119.74 113.96 2ayq s LYS 184 Ca 0.31 -0.17 -0.02 0.00 0.02 0.00 0.00 55.97 56.12 2ayq s LYS 184 Cb -0.14 -1.87 -0.02 0.00 -0.52 0.00 0.00 37.83 35.28 2ayq s LYS 184 CO 0.76 -0.65 -0.09 -1.17 -0.92 0.00 0.00 175.35 173.28 2ayq s LEU 185 N 2.06 2.89 -0.37 3.17 2.96 -0.07 -1.84 118.68 127.48 2ayq s LEU 185 Ca 0.01 -0.29 -0.06 0.00 -0.22 0.00 0.00 54.13 53.57 2ayq s LEU 185 Cb -0.16 -1.68 0.06 0.00 0.50 0.00 0.00 46.19 44.91 2ayq s LEU 185 CO -0.08 0.13 0.15 0.00 -1.32 0.00 0.00 176.35 175.23 2ayq s ALA 186 N 0.57 3.11 -0.17 5.97 0.00 0.61 -1.48 121.76 130.35 2ayq s ALA 186 Ca -0.06 -1.99 -0.27 0.00 0.00 0.00 0.00 51.96 49.64 2ayq s ALA 186 Cb -0.15 -2.36 -0.01 0.00 0.00 0.00 0.00 23.12 20.60 2ayq s ALA 186 CO 0.03 -1.49 0.92 0.45 0.00 0.00 0.00 175.76 175.66 2ayq s SER 187 N 1.66 7.04 -0.11 0.00 0.15 0.66 -1.35 113.70 121.75 2ayq s SER 187 Ca 0.01 1.29 -0.01 0.00 0.70 0.00 0.00 55.95 57.94 2ayq s SER 187 Cb -0.21 -2.49 -0.03 0.00 -1.71 0.00 0.00 66.02 61.58 2ayq s SER 187 CO 0.01 -0.48 -0.08 -0.69 1.20 0.00 0.00 173.24 173.20 2ayq s VAL 188 N 2.41 3.56 0.00 4.45 1.01 -0.55 -1.05 120.40 130.23 2ayq s VAL 188 Ca 0.41 -0.50 0.00 0.00 0.00 0.00 0.00 61.98 61.89 2ayq s VAL 188 Cb -0.16 -2.50 0.00 0.00 0.00 0.00 0.00 36.38 33.72 2ayq s VAL 188 CO 0.12 0.55 0.00 -0.90 0.00 0.00 0.00 175.10 174.86 2ayq n ASP 189 N 2.96 0.00 -2.57 3.32 5.68 -0.29 -4.55 116.55 121.10 2ayq n ASP 189 Ca -0.18 -0.96 -0.15 0.00 -0.50 0.00 0.00 54.79 53.00 2ayq n ASP 189 Cb 0.53 0.00 0.02 0.00 -1.14 0.00 0.00 41.12 40.53 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 2.18 0.00 0.11 3.00 -1.26 -0.65 118.16 121.54 2ayq n LYS 190 Ca 0.00 -3.77 0.01 0.00 -0.00 0.00 0.00 58.31 54.54 2ayq n LYS 190 Cb 0.00 -1.71 0.04 0.00 0.00 0.00 0.00 35.03 33.36 2ayq n LYS 190 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2ayq n ALA 191 N -0.32 1.65 0.89 3.14 0.00 -1.26 -1.28 120.51 123.32 2ayq n ALA 191 Ca 0.22 -0.01 0.09 0.00 0.00 0.00 0.00 53.44 53.74 2ayq n ALA 191 Cb 0.78 -1.02 -0.09 0.00 0.00 0.00 0.00 19.45 19.12 2ayq n ALA 191 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 2ayq n ASN 192 N -0.64 1.08 0.07 0.00 2.04 -1.26 -4.50 115.26 112.04 2ayq n ASN 192 Ca 0.01 -1.04 0.00 0.00 -0.44 0.00 0.00 54.58 53.11 2ayq n ASN 192 Cb 0.00 0.90 0.00 0.00 -2.53 0.00 0.00 39.78 38.16 2ayq n ASN 192 CO 0.00 0.00 0.00 0.52 -0.44 0.00 0.00 177.26 177.34 2ayq n VAL 193 N -1.18 0.29 -2.29 3.53 0.31 -0.40 -5.06 118.33 113.52 2ayq n VAL 193 Ca 0.04 0.10 -0.42 0.00 -0.01 0.00 0.00 64.34 64.05 2ayq n VAL 193 Cb 0.32 -0.89 -0.03 0.00 -0.91 0.00 0.00 33.84 32.34 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 -6.41 4.28 0.42 7.52 1.43 -0.53 -4.90 118.68 120.50 2ayq s LEU 194 Ca 0.00 1.99 0.15 0.00 -1.03 0.00 0.00 54.13 55.24 2ayq s LEU 194 Cb 0.00 -3.55 0.92 0.00 0.03 0.00 0.00 46.19 43.59 2ayq s LEU 194 CO 0.00 -0.72 1.92 -0.08 0.23 0.00 0.00 176.35 177.70 2ayq h GLU 195 N 8.00 0.00 -0.51 1.70 4.57 -1.94 0.52 114.58 126.93 2ayq h GLU 195 Ca -0.35 0.00 -0.12 0.00 -1.18 0.00 0.00 59.36 57.71 2ayq h GLU 195 Cb 1.16 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 29.74 2ayq h GLU 195 CO 0.92 0.26 -0.14 0.66 -1.18 0.00 0.00 179.01 179.52 2ayq h SER 196 N 0.00 1.00 -0.50 1.04 4.64 -1.94 -1.40 113.55 116.40 2ayq h SER 196 Ca -0.00 -0.37 -0.11 0.00 -0.47 0.00 0.00 61.79 60.83 2ayq h SER 196 Cb 0.48 -0.27 -0.02 0.00 -0.31 0.00 0.00 62.40 62.28 2ayq h SER 196 CO 0.03 1.14 -0.13 0.28 -0.87 0.00 0.00 176.83 177.29 2ayq h SER 197 N 0.86 1.00 -0.73 4.97 0.02 -1.61 0.16 113.55 118.20 2ayq h SER 197 Ca 0.13 -0.33 0.03 0.00 -0.84 0.00 0.00 61.79 60.77 2ayq h SER 197 Cb 0.71 -0.27 -0.05 0.00 0.14 0.00 0.00 62.40 62.94 2ayq h SER 197 CO 0.05 1.12 0.46 -0.09 -1.14 0.00 0.00 176.83 177.23 2ayq h ARG 198 N 0.88 0.87 -0.25 3.45 1.12 -0.66 0.60 114.38 120.39 2ayq h ARG 198 Ca 0.13 -0.05 -0.16 0.00 -1.11 0.00 0.00 59.98 58.80 2ayq h ARG 198 Cb 0.69 -0.20 -0.01 0.00 -0.01 0.00 0.00 29.97 30.44 2ayq h ARG 198 CO 0.05 0.58 -0.48 1.98 -3.11 0.00 0.00 179.97 178.99 2ayq h MET 199 N 0.90 0.66 0.25 0.20 4.05 -0.92 -2.59 114.93 117.48 2ayq h MET 199 Ca 0.29 -0.38 -0.00 0.00 -0.28 0.00 0.00 59.70 59.33 2ayq h MET 199 Cb 0.02 0.03 -0.01 0.00 -0.80 0.00 0.00 31.60 30.84 2ayq h MET 199 CO -0.11 1.00 -0.18 2.35 0.23 0.00 0.00 176.91 180.19 2ayq h TRP 200 N 0.53 -0.48 -0.85 1.39 2.91 0.36 -1.40 115.95 118.42 2ayq h TRP 200 Ca 0.03 -0.00 0.04 0.00 1.13 0.00 0.00 58.89 60.09 2ayq h TRP 200 Cb 1.03 0.18 -0.05 0.00 -0.51 0.00 0.00 29.16 29.80 2ayq h TRP 200 CO 0.05 -0.28 0.54 -0.09 -1.03 0.00 0.00 178.44 177.63 2ayq h ARG 201 N -0.43 1.00 -0.11 2.65 2.43 -0.89 0.19 114.38 119.21 2ayq h ARG 201 Ca -0.02 -0.06 0.04 0.00 -0.81 0.00 0.00 59.98 59.13 2ayq h ARG 201 Cb 0.38 -0.23 -0.04 0.00 -0.42 0.00 0.00 29.97 29.66 2ayq h ARG 201 CO 0.00 0.66 -0.14 0.93 -1.51 0.00 0.00 179.97 179.91 2ayq h GLU 202 N 1.03 -0.18 -0.72 0.20 5.08 -1.11 0.62 114.58 119.51 2ayq h GLU 202 Ca 0.35 0.01 -0.05 0.00 -1.00 0.00 0.00 59.36 58.67 2ayq h GLU 202 Cb 0.05 0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.31 2ayq h GLU 202 CO -0.13 -0.12 0.27 0.82 -1.00 0.00 0.00 179.01 178.85 2ayq h ILE 203 N -0.18 1.25 -0.69 3.13 2.04 -0.34 -1.68 117.51 121.04 2ayq h ILE 203 Ca 0.09 -0.81 0.03 0.00 1.00 0.00 0.00 64.86 65.17 2ayq h ILE 203 Cb 0.31 0.44 -0.04 0.00 -0.74 0.00 0.00 36.82 36.78 2ayq h ILE 203 CO -0.22 0.32 0.43 0.00 0.00 0.00 0.00 178.15 178.68 2ayq h ALA 204 N 1.13 0.90 -0.48 1.87 0.00 -0.09 0.00 119.26 122.59 2ayq h ALA 204 Ca 0.24 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.10 2ayq h ALA 204 Cb 0.24 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 2ayq h ALA 204 CO -0.02 0.20 0.21 1.49 0.00 0.00 0.00 179.25 181.13 2ayq h GLU 205 N 0.84 0.70 -0.54 0.00 4.57 -0.40 -2.17 114.58 117.58 2ayq h GLU 205 Ca 0.28 -0.11 -0.07 0.00 -1.18 0.00 0.00 59.36 58.27 2ayq h GLU 205 Cb 0.02 -0.12 -0.02 0.00 -0.16 0.00 0.00 28.75 28.47 2ayq h GLU 205 CO -0.11 0.61 0.06 0.93 -1.18 0.00 0.00 179.01 179.32 2ayq h GLU 206 N 0.63 0.92 -0.20 1.92 3.07 -0.62 -2.83 114.58 117.47 2ayq h GLU 206 Ca 0.16 -0.26 -0.07 0.00 -0.50 0.00 0.00 59.36 58.69 2ayq h GLU 206 Cb 0.15 -0.10 -0.01 0.00 -0.84 0.00 0.00 28.75 27.95 2ayq h GLU 206 CO -0.02 0.91 -0.17 1.15 -1.40 0.00 0.00 179.01 179.48 2ayq h THR 207 N 0.81 1.22 -0.92 1.13 2.02 -0.87 -2.68 112.91 113.62 2ayq h THR 207 Ca 0.16 -1.00 0.19 0.00 0.77 0.00 0.00 66.41 66.53 2ayq h THR 207 Cb 0.45 1.26 -0.07 0.00 -1.74 0.00 0.00 68.15 68.05 2ayq h THR 207 CO 0.02 0.31 0.59 0.00 0.37 0.00 0.00 175.52 176.82 2ayq h ALA 208 N 1.51 2.03 -0.82 6.16 0.00 -1.13 -0.45 119.26 126.58 2ayq h ALA 208 Ca 0.06 0.03 0.03 0.00 0.00 0.00 0.00 54.91 55.03 2ayq h ALA 208 Cb 0.49 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 18.18 2ayq h ALA 208 CO 0.03 -0.32 0.54 1.57 0.00 0.00 0.00 179.25 181.07 2ayq h LYS 209 N 0.53 0.98 0.00 0.00 -0.00 -1.55 -1.09 116.57 115.45 2ayq h LYS 209 Ca 0.48 -0.06 -0.00 0.00 -0.00 0.00 0.00 60.65 61.07 2ayq h LYS 209 Cb 1.02 -0.22 -0.00 0.00 -0.00 0.00 0.00 32.23 33.03 2ayq h LYS 209 CO -0.22 0.65 -0.01 1.57 -0.00 0.00 0.00 179.45 181.44 2ayq h LYS 210 N 1.01 0.00 -2.25 0.07 -0.00 -1.22 -3.30 116.57 110.89 2ayq h LYS 210 Ca 0.32 0.00 -0.59 0.00 -0.00 0.00 0.00 60.65 60.38 2ayq h LYS 210 Cb 0.03 0.00 -0.41 0.00 -0.00 0.00 0.00 32.23 31.85 2ayq h LYS 210 CO -0.09 0.01 -0.73 0.66 -0.00 0.00 0.00 179.45 179.30 2ayq n TYR 211 N -3.11 2.44 0.27 0.07 4.02 -0.42 -4.93 117.16 115.50 2ayq n TYR 211 Ca 0.01 -3.99 0.16 0.00 -0.01 0.00 0.00 57.90 54.07 2ayq n TYR 211 Cb 0.36 -0.48 0.77 0.00 -0.02 0.00 0.00 39.34 39.98 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 4.33 0.00 -0.47 -0.72 0.13 -1.62 -2.55 132.00 131.10 2ayq h PRO 212 Ca 0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.30 2ayq h PRO 212 Cb 0.73 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.86 2ayq h PRO 212 CO 0.71 0.00 0.00 -0.40 -0.23 0.00 0.00 178.00 178.08 2ayq n ASP 213 N -2.61 2.41 -4.17 1.44 5.75 -1.26 -4.84 116.55 113.26 2ayq n ASP 213 Ca -0.01 -2.08 -0.31 0.00 -0.01 0.00 0.00 54.79 52.38 2ayq n ASP 213 Cb 0.12 -0.32 -0.17 0.00 -1.03 0.00 0.00 41.12 39.72 2ayq n ASP 213 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 2ayq s VAL 214 N -1.53 1.89 -0.40 2.12 1.01 -0.96 -4.87 120.40 117.66 2ayq s VAL 214 Ca 0.28 -0.91 -0.29 0.00 0.00 0.00 0.00 61.98 61.06 2ayq s VAL 214 Cb 0.16 -1.65 0.02 0.00 0.00 0.00 0.00 36.38 34.91 2ayq s VAL 214 CO 0.17 0.52 1.10 -0.70 0.00 0.00 0.00 175.10 176.20 2ayq s GLU 215 N 0.52 3.90 -0.09 2.72 2.12 -0.61 -4.91 118.70 122.35 2ayq s GLU 215 Ca -0.15 0.82 -0.08 0.00 0.36 0.00 0.00 54.97 55.92 2ayq s GLU 215 Cb -0.17 -3.82 -0.04 0.00 0.26 0.00 0.00 34.13 30.36 2ayq s GLU 215 CO 0.06 -1.13 0.19 -1.17 -0.54 0.00 0.00 175.26 172.67 2ayq s LEU 216 N 4.03 4.40 0.02 2.70 2.96 -1.26 -0.89 118.68 130.65 2ayq s LEU 216 Ca 0.47 0.56 0.01 0.00 -0.22 0.00 0.00 54.13 54.94 2ayq s LEU 216 Cb -0.10 -2.20 -0.01 0.00 0.50 0.00 0.00 46.19 44.38 2ayq s LEU 216 CO 0.23 0.39 -0.04 -0.44 -1.32 0.00 0.00 176.35 175.16 2ayq s SER 217 N -1.09 0.44 -0.20 3.68 0.01 -0.55 -4.99 113.70 111.00 2ayq s SER 217 Ca 0.17 -0.34 -0.02 0.00 1.31 0.00 0.00 55.95 57.07 2ayq s SER 217 Cb -0.13 0.03 0.00 0.00 0.21 0.00 0.00 66.02 66.13 2ayq s SER 217 CO 0.07 -0.15 -0.10 -1.00 0.41 0.00 0.00 173.24 172.47 2ayq s HIS 218 N -0.91 2.88 0.09 2.43 0.09 -1.26 -0.24 115.29 118.38 2ayq s HIS 218 Ca -0.08 -1.15 0.09 0.00 -0.00 0.00 0.00 55.06 53.92 2ayq s HIS 218 Cb -0.07 -2.02 -0.03 0.00 -0.00 0.00 0.00 32.58 30.46 2ayq s HIS 218 CO -0.00 -0.61 -0.22 -1.64 -0.00 0.00 0.00 174.74 172.27 2ayq s MET 219 N 1.32 1.27 0.27 1.40 -1.94 -0.21 -4.98 119.30 116.43 2ayq s MET 219 Ca 0.04 -1.16 -0.26 0.00 -1.71 0.00 0.00 55.69 52.60 2ayq s MET 219 Cb -0.14 -1.55 -0.09 0.00 2.01 0.00 0.00 34.83 35.06 2ayq s MET 219 CO -0.06 0.37 0.90 -0.51 -0.01 0.00 0.00 175.02 175.71 2ayq s LEU 220 N -1.78 4.44 0.25 -0.03 1.43 -1.26 -1.13 118.68 120.61 2ayq s LEU 220 Ca 0.09 1.79 -0.08 0.00 -1.03 0.00 0.00 54.13 54.90 2ayq s LEU 220 Cb -0.10 -3.79 0.42 0.00 0.03 0.00 0.00 46.19 42.76 2ayq s LEU 220 CO 0.04 0.03 1.61 1.62 0.23 0.00 0.00 176.35 179.88 2ayq h VAL 221 N 2.83 0.26 -0.87 -1.59 3.04 -1.21 -0.83 116.25 117.88 2ayq h VAL 221 Ca -0.46 -0.02 0.00 0.00 -1.01 0.00 0.00 66.70 65.21 2ayq h VAL 221 Cb 1.20 0.20 -0.04 0.00 -2.01 0.00 0.00 31.29 30.64 2ayq h VAL 221 CO 0.66 0.01 0.55 -2.24 -1.01 0.00 0.00 177.57 175.54 2ayq h ASP 222 N 0.05 1.02 -0.08 3.17 2.03 -1.92 0.03 116.42 120.72 2ayq h ASP 222 Ca 0.42 -0.05 -0.01 0.00 -0.73 0.00 0.00 57.03 56.66 2ayq h ASP 222 Cb 0.71 -0.26 -0.00 0.00 -0.83 0.00 0.00 39.33 38.95 2ayq h ASP 222 CO -0.75 0.76 0.00 0.28 -1.03 0.00 0.00 179.24 178.51 2ayq h SER 223 N 1.18 0.13 -0.79 4.15 0.02 -1.62 -2.17 113.55 114.45 2ayq h SER 223 Ca 0.31 -0.30 0.21 0.00 -0.84 0.00 0.00 61.79 61.17 2ayq h SER 223 Cb -0.09 -0.03 -0.04 0.00 0.14 0.00 0.00 62.40 62.37 2ayq h SER 223 CO -0.06 0.40 0.55 0.74 -1.14 0.00 0.00 176.83 177.31 2ayq h THR 224 N -0.14 0.66 0.86 -2.27 2.02 -0.73 -0.15 112.91 113.15 2ayq h THR 224 Ca 0.02 -0.05 -0.04 0.00 0.77 0.00 0.00 66.41 67.11 2ayq h THR 224 Cb 0.33 0.50 0.00 0.00 -1.74 0.00 0.00 68.15 67.24 2ayq h THR 224 CO 0.00 0.03 -0.47 -1.28 0.37 0.00 0.00 175.52 174.17 2ayq h SER 225 N 0.14 -1.15 0.53 4.18 0.87 -0.34 -2.18 113.55 115.60 2ayq h SER 225 Ca 0.39 0.05 -0.05 0.00 -1.23 0.00 0.00 61.79 60.94 2ayq h SER 225 Cb 1.31 0.32 -0.01 0.00 -0.44 0.00 0.00 62.40 63.58 2ayq h SER 225 CO -0.06 -0.75 -0.25 0.00 -0.53 0.00 0.00 176.83 175.23 2ayq h MET 226 N -1.22 0.00 -0.17 2.24 -0.00 -1.02 -2.86 114.93 111.90 2ayq h MET 226 Ca -0.12 0.00 -0.08 0.00 -0.00 0.00 0.00 59.70 59.50 2ayq h MET 226 Cb 0.96 0.00 -0.01 0.00 -0.00 0.00 0.00 31.60 32.55 2ayq h MET 226 CO 0.16 0.25 -0.26 1.96 -0.00 0.00 0.00 176.91 179.02 2ayq h GLN 227 N 0.00 0.30 0.00 -0.10 1.08 -0.89 0.53 115.11 116.03 2ayq h GLN 227 Ca -0.00 -0.11 0.00 0.00 -1.45 0.00 0.00 58.65 57.09 2ayq h GLN 227 Cb 0.59 -0.02 0.00 0.00 -0.05 0.00 0.00 27.48 27.99 2ayq h GLN 227 CO 0.03 0.55 0.00 -0.07 -0.95 0.00 0.00 178.83 178.39 2ayq h LEU 228 N 0.27 0.00 0.00 1.46 3.38 -1.15 0.14 115.31 119.42 2ayq h LEU 228 Ca 0.04 0.00 -0.30 0.00 0.09 0.00 0.00 57.88 57.71 2ayq h LEU 228 Cb 0.60 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.31 2ayq h LEU 228 CO 0.04 0.00 -1.94 -0.38 0.09 0.00 0.00 178.44 176.25 2ayq n ILE 229 N -2.71 1.52 0.16 1.22 5.41 -0.80 -4.15 119.36 120.00 2ayq n ILE 229 Ca -0.00 -0.19 0.00 0.00 1.00 0.00 0.00 62.75 63.56 2ayq n ILE 229 Cb 0.17 -2.04 0.24 0.00 -0.71 0.00 0.00 39.64 37.29 2ayq n ILE 229 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2ayq h ALA 230 N -0.96 1.12 0.00 -1.39 0.00 -0.85 -3.41 119.26 113.77 2ayq h ALA 230 Ca -0.45 -0.48 -0.21 0.00 0.00 0.00 0.00 54.91 53.77 2ayq h ALA 230 Cb 1.38 -0.08 -0.14 0.00 0.00 0.00 0.00 17.79 18.94 2ayq h ALA 230 CO -0.28 0.66 -0.33 -1.71 0.00 0.00 0.00 179.25 177.59 2ayq n ASN 231 N -3.89 -2.10 0.31 0.00 5.15 0.44 -4.99 115.26 110.17 2ayq n ASN 231 Ca -0.01 -3.30 0.17 0.00 -0.60 0.00 0.00 54.58 50.84 2ayq n ASN 231 Cb 0.54 1.76 0.99 0.00 -0.53 0.00 0.00 39.78 42.54 2ayq n ASN 231 CO 0.00 0.00 0.00 1.55 1.40 0.00 0.00 177.26 180.21 2ayq h PRO 232 N 2.80 0.00 0.00 1.20 0.13 -1.56 -2.43 132.00 132.14 2ayq h PRO 232 Ca -0.15 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.98 2ayq h PRO 232 Cb 1.13 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.26 2ayq h PRO 232 CO 0.10 0.01 0.00 0.41 -0.23 0.00 0.00 178.00 178.28 2ayq n GLY 233 N -1.22 -1.07 0.21 1.56 0.00 -1.26 -2.48 105.19 100.93 2ayq n GLY 233 Ca -0.03 0.12 0.09 0.00 0.00 0.00 0.00 46.02 46.20 2ayq n GLY 233 CO 0.00 0.00 0.00 0.06 0.00 0.00 0.00 173.32 173.38 2ayq h GLN 234 N 0.00 0.00 -7.16 1.61 3.07 -1.81 -3.46 115.11 107.35 2ayq h GLN 234 Ca 0.00 0.00 -0.50 0.00 0.09 0.00 0.00 58.65 58.24 2ayq h GLN 234 Cb 0.20 0.00 0.04 0.00 0.08 0.00 0.00 27.48 27.80 2ayq h GLN 234 CO 0.00 0.25 0.29 -0.06 0.09 0.00 0.00 178.83 179.40 2ayq s PHE 235 N -3.56 3.57 0.00 0.06 0.08 -1.03 -5.01 117.98 112.09 2ayq s PHE 235 Ca 0.01 1.14 0.00 0.00 0.12 0.00 0.00 56.93 58.21 2ayq s PHE 235 Cb 0.10 -2.58 0.00 0.00 -0.57 0.00 0.00 43.02 39.97 2ayq s PHE 235 CO 0.65 -0.47 0.00 -3.47 -0.10 0.00 0.00 175.22 171.83 2ayq n ASP 236 N -2.31 0.00 -4.10 1.36 2.03 -1.26 -4.56 116.55 107.71 2ayq n ASP 236 Ca 0.04 0.00 -0.32 0.00 0.52 0.00 0.00 54.79 55.03 2ayq n ASP 236 Cb 0.54 0.00 -0.16 0.00 -0.72 0.00 0.00 41.12 40.78 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 -0.54 1.89 -0.04 5.18 1.01 -0.77 -0.90 120.40 126.23 2ayq s VAL 237 Ca 0.00 -0.84 0.01 0.00 0.00 0.00 0.00 61.98 61.15 2ayq s VAL 237 Cb 0.00 -1.72 -0.03 0.00 0.00 0.00 0.00 36.38 34.63 2ayq s VAL 237 CO 0.00 0.51 -0.05 -0.63 0.00 0.00 0.00 175.10 174.94 2ayq s ILE 238 N 1.23 3.85 -0.01 2.22 1.01 0.18 -0.29 121.20 129.41 2ayq s ILE 238 Ca 0.02 -0.53 0.01 0.00 0.00 0.00 0.00 60.65 60.15 2ayq s ILE 238 Cb -0.14 -2.63 -0.00 0.00 0.01 0.00 0.00 42.46 39.71 2ayq s ILE 238 CO -0.10 0.52 -0.03 0.54 0.00 0.00 0.00 174.94 175.87 2ayq s VAL 239 N -0.91 0.28 0.12 2.92 0.11 -0.46 0.15 120.40 122.62 2ayq s VAL 239 Ca 0.15 -0.14 -0.26 0.00 -2.93 0.00 0.00 61.98 58.80 2ayq s VAL 239 Cb -0.11 -0.25 0.07 0.00 -1.53 0.00 0.00 36.38 34.56 2ayq s VAL 239 CO 0.04 0.09 0.95 0.28 -3.33 0.00 0.00 175.10 173.13 2ayq s THR 240 N 0.01 0.00 0.83 5.04 -1.32 -0.88 -1.49 115.64 117.84 2ayq s THR 240 Ca 0.00 -0.51 -0.11 0.00 -1.21 0.00 0.00 61.69 59.87 2ayq s THR 240 Cb -0.03 -1.77 0.09 0.00 -1.51 0.00 0.00 72.50 69.28 2ayq s THR 240 CO -0.00 0.00 1.09 -1.83 -2.21 0.00 0.00 174.62 171.67 2ayq s GLU 241 N -3.23 1.77 0.00 7.08 4.04 -1.26 -1.87 118.70 125.22 2ayq s GLU 241 Ca 0.11 0.99 0.00 0.00 0.04 0.00 0.00 54.97 56.11 2ayq s GLU 241 Cb -0.01 -1.85 0.00 0.00 0.02 0.00 0.00 34.13 32.28 2ayq s GLU 241 CO -0.00 -1.93 0.34 -1.71 -1.84 0.00 0.00 175.26 170.12 2ayq n ASN 242 N -3.70 0.00 -0.31 0.83 2.85 -1.07 -0.79 115.26 113.08 2ayq n ASN 242 Ca 0.08 0.34 -0.01 0.00 -0.11 0.00 0.00 54.58 54.88 2ayq n ASN 242 Cb 0.54 -0.01 0.05 0.00 1.24 0.00 0.00 39.78 41.60 2ayq n ASN 242 CO 0.00 0.00 0.00 -0.03 -2.11 0.00 0.00 177.26 175.12 2ayq h MET 243 N 0.00 -0.05 0.02 1.20 4.05 -1.89 0.20 114.93 118.47 2ayq h MET 243 Ca 0.00 0.00 -0.00 0.00 -0.28 0.00 0.00 59.70 59.42 2ayq h MET 243 Cb 0.00 0.01 0.00 0.00 -0.80 0.00 0.00 31.60 30.81 2ayq h MET 243 CO 0.00 -0.03 -0.01 0.74 0.23 0.00 0.00 176.91 177.84 2ayq h PHE 244 N -0.05 -0.03 -0.02 1.39 0.04 -1.87 -2.77 116.94 113.62 2ayq h PHE 244 Ca 0.33 -0.00 -0.03 0.00 2.80 0.00 0.00 57.97 61.06 2ayq h PHE 244 Cb 0.59 0.01 -0.01 0.00 2.20 0.00 0.00 35.95 38.75 2ayq h PHE 244 CO -0.76 0.03 -0.15 0.78 -0.60 0.00 0.00 178.31 177.61 2ayq h GLY 245 N -0.08 0.04 0.90 -1.45 0.00 0.16 -0.64 103.07 102.00 2ayq h GLY 245 Ca -0.00 -0.02 -0.02 0.00 0.00 0.00 0.00 47.33 47.29 2ayq h GLY 245 CO 0.01 0.02 0.10 -1.80 0.00 0.00 0.00 176.54 174.86 2ayq h ASP 246 N 0.03 0.36 0.65 0.19 3.58 -0.39 -1.04 116.42 119.81 2ayq h ASP 246 Ca 0.01 -0.18 -0.03 0.00 0.42 0.00 0.00 57.03 57.25 2ayq h ASP 246 Cb 0.29 -0.09 0.01 0.00 1.72 0.00 0.00 39.33 41.25 2ayq h ASP 246 CO 0.02 0.44 -0.31 0.40 -2.88 0.00 0.00 179.24 176.91 2ayq h ILE 247 N 0.26 0.00 -0.93 2.25 2.04 -1.15 -2.83 117.51 117.16 2ayq h ILE 247 Ca 0.09 -0.30 0.20 0.00 1.00 0.00 0.00 64.86 65.85 2ayq h ILE 247 Cb 0.20 0.00 -0.11 0.00 -0.74 0.00 0.00 36.82 36.16 2ayq h ILE 247 CO -0.01 0.00 0.49 -0.07 0.00 0.00 0.00 178.15 178.56 2ayq h LEU 248 N -1.18 0.54 -0.08 1.44 3.38 -1.18 0.13 115.31 118.36 2ayq h LEU 248 Ca -0.09 0.12 0.03 0.00 0.09 0.00 0.00 57.88 58.03 2ayq h LEU 248 Cb 0.67 0.05 -0.03 0.00 0.09 0.00 0.00 40.66 41.44 2ayq h LEU 248 CO 0.15 0.13 -0.08 0.28 0.09 0.00 0.00 178.44 179.01 2ayq h SER 249 N 0.57 -0.25 -0.87 -0.43 0.02 -1.19 -0.27 113.55 111.13 2ayq h SER 249 Ca 0.55 0.05 -0.02 0.00 -0.84 0.00 0.00 61.79 61.54 2ayq h SER 249 Cb 0.95 0.12 -0.04 0.00 0.14 0.00 0.00 62.40 63.58 2ayq h SER 249 CO -0.45 -0.11 0.48 0.44 -1.14 0.00 0.00 176.83 176.05 2ayq h ASP 250 N -0.10 1.09 0.39 3.07 5.19 -0.57 -2.38 116.42 123.10 2ayq h ASP 250 Ca 0.06 -0.10 -0.02 0.00 -0.62 0.00 0.00 57.03 56.35 2ayq h ASP 250 Cb 0.19 -0.28 0.00 0.00 0.18 0.00 0.00 39.33 39.42 2ayq h ASP 250 CO -0.14 0.87 -0.21 -0.08 -3.12 0.00 0.00 179.24 176.56 2ayq h GLU 251 N 1.21 -0.53 0.00 3.56 4.81 -0.32 -2.40 114.58 120.91 2ayq h GLU 251 Ca 0.31 0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.57 2ayq h GLU 251 Cb 0.03 0.12 0.00 0.00 0.63 0.00 0.00 28.75 29.53 2ayq h GLU 251 CO -0.05 -0.35 0.00 0.00 -0.73 0.00 0.00 179.01 177.88 2ayq h ALA 252 N 0.05 1.00 -0.71 2.92 0.00 -0.84 -3.14 119.26 118.55 2ayq h ALA 252 Ca -0.05 0.00 0.01 0.00 0.00 0.00 0.00 54.91 54.87 2ayq h ALA 252 Cb 0.44 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.19 2ayq h ALA 252 CO 0.07 0.00 0.47 0.77 0.00 0.00 0.00 179.25 180.56 2ayq h SER 253 N 0.00 0.81 0.93 0.00 0.02 -0.91 -3.22 113.55 111.19 2ayq h SER 253 Ca 0.00 -0.02 -0.22 0.00 -0.84 0.00 0.00 61.79 60.71 2ayq h SER 253 Cb 0.06 -0.20 -0.03 0.00 0.14 0.00 0.00 62.40 62.36 2ayq h SER 253 CO 0.00 0.59 -1.11 -0.37 -1.14 0.00 0.00 176.83 174.80 2ayq h VAL 254 N 0.96 1.46 -1.27 2.27 -1.51 -1.69 -3.32 116.25 113.15 2ayq h VAL 254 Ca 0.26 -3.17 0.39 0.00 -1.23 0.00 0.00 66.70 62.95 2ayq h VAL 254 Cb -0.11 2.72 -0.11 0.00 -2.13 0.00 0.00 31.29 31.66 2ayq h VAL 254 CO -0.06 0.83 0.84 0.16 -1.23 0.00 0.00 177.57 178.12 2ayq h ILE 255 N 0.00 0.25 -0.01 7.19 3.07 -1.69 0.87 117.51 127.18 2ayq h ILE 255 Ca -0.07 -0.05 0.00 0.00 1.55 0.00 0.00 64.86 66.29 2ayq h ILE 255 Cb 1.78 0.08 0.00 0.00 -0.27 0.00 0.00 36.82 38.41 2ayq h ILE 255 CO 0.11 0.03 -0.54 0.35 -1.05 0.00 0.00 178.15 177.05 2ayq n THR 256 N -4.58 0.00 -2.06 0.16 -2.24 -1.26 -4.19 114.28 100.12 2ayq n THR 256 Ca 0.33 -0.20 -0.10 0.00 -2.27 0.00 0.00 64.05 61.81 2ayq n THR 256 Cb 1.30 1.11 -0.01 0.00 -2.10 0.00 0.00 70.33 70.63 2ayq n THR 256 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2ayq n GLY 257 N 1.43 0.14 0.23 3.38 0.00 0.30 -4.47 105.19 106.19 2ayq n GLY 257 Ca 0.09 -0.46 0.02 0.00 0.00 0.00 0.00 46.02 45.67 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 0.04 1.92 -4.54 1.61 3.41 -1.26 -4.83 113.62 109.96 2ayq n SER 258 Ca -0.12 -1.62 -0.46 0.00 -0.26 0.00 0.00 58.87 56.41 2ayq n SER 258 Cb 0.55 -0.05 -0.05 0.00 -0.26 0.00 0.00 64.21 64.41 2ayq n SER 258 CO 0.00 0.00 0.00 -0.11 -0.16 0.00 0.00 175.04 174.77 2ayq n LEU 259 N 0.09 2.84 0.00 1.04 7.94 -1.25 -0.79 117.00 126.87 2ayq n LEU 259 Ca 0.04 0.34 0.00 0.00 -1.11 0.00 0.00 56.01 55.28 2ayq n LEU 259 Cb 0.23 -1.43 0.00 0.00 0.53 0.00 0.00 43.42 42.75 2ayq n LEU 259 CO 0.03 -0.65 0.00 0.61 -1.11 0.00 0.00 177.39 176.27 2ayq n GLY 260 N 5.98 0.94 0.16 -3.96 0.00 -1.26 -4.88 105.19 102.16 2ayq n GLY 260 Ca 0.34 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.38 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 0.00 0.84 -2.84 1.61 0.00 0.03 -4.57 117.12 112.20 2ayq n MET 261 Ca 0.00 -1.22 -0.41 0.00 0.00 0.00 0.00 57.70 56.07 2ayq n MET 261 Cb 0.00 -0.78 -0.04 0.00 0.00 0.00 0.00 33.22 32.40 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 -0.71 4.34 0.22 3.17 1.43 -1.22 -3.87 118.68 122.04 2ayq s LEU 262 Ca 0.06 1.46 0.05 0.00 -1.03 0.00 0.00 54.13 54.66 2ayq s LEU 262 Cb 0.05 -3.37 -0.03 0.00 0.03 0.00 0.00 46.19 42.86 2ayq s LEU 262 CO 0.01 -0.22 0.34 -2.16 0.23 0.00 0.00 176.35 174.55 2ayq s PRO 263 N 1.03 3.44 0.32 1.29 0.04 -1.26 -1.14 135.00 138.72 2ayq s PRO 263 Ca 0.46 -0.73 0.03 0.00 0.04 0.00 0.00 61.00 60.80 2ayq s PRO 263 Cb -0.19 -2.90 -0.04 0.00 0.04 0.00 0.00 34.50 31.40 2ayq s PRO 263 CO 0.23 0.45 0.16 -1.54 0.04 0.00 0.00 177.00 176.34 2ayq s SER 264 N -3.84 1.70 -0.28 6.66 1.04 0.18 -4.12 113.70 115.05 2ayq s SER 264 Ca 0.34 -1.57 -0.22 0.00 0.48 0.00 0.00 55.95 54.98 2ayq s SER 264 Cb -0.09 0.38 0.11 0.00 0.10 0.00 0.00 66.02 66.52 2ayq s SER 264 CO 0.29 -0.89 0.88 0.00 0.98 0.00 0.00 173.24 174.51 2ayq s ALA 265 N -3.55 -1.96 -0.23 5.32 0.00 -0.44 -2.51 121.76 118.39 2ayq s ALA 265 Ca 0.35 2.07 -0.02 0.00 0.00 0.00 0.00 51.96 54.35 2ayq s ALA 265 Cb 0.05 -1.42 0.01 0.00 0.00 0.00 0.00 23.12 21.76 2ayq s ALA 265 CO 0.17 -0.31 -0.07 -1.12 0.00 0.00 0.00 175.76 174.44 2ayq s SER 266 N 0.70 4.15 0.50 0.00 0.01 0.41 -0.13 113.70 119.34 2ayq s SER 266 Ca -0.02 -0.61 0.04 0.00 1.31 0.00 0.00 55.95 56.67 2ayq s SER 266 Cb -0.05 -1.68 -0.01 0.00 0.21 0.00 0.00 66.02 64.49 2ayq s SER 266 CO -0.08 -0.06 0.14 -0.76 0.41 0.00 0.00 173.24 172.88 2ayq s LEU 267 N 1.40 2.58 0.00 2.44 1.43 0.22 -1.20 118.68 125.55 2ayq s LEU 267 Ca 0.04 -1.44 0.00 0.00 -1.03 0.00 0.00 54.13 51.70 2ayq s LEU 267 Cb -0.15 -0.97 0.00 0.00 0.03 0.00 0.00 46.19 45.10 2ayq s LEU 267 CO -0.05 -0.84 0.00 -2.11 0.23 0.00 0.00 176.35 173.58 2ayq n ARG 268 N -1.37 0.00 0.00 1.70 1.85 -1.26 -1.64 116.66 115.95 2ayq n ARG 268 Ca -0.11 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.74 2ayq n ARG 268 Cb 0.66 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 32.07 2ayq n ARG 268 CO 0.00 0.00 0.00 0.43 -0.01 0.00 0.00 177.63 178.05 2ayq n SER 269 N -2.61 0.00 -2.94 2.89 7.64 -1.26 -4.74 113.62 112.60 2ayq n SER 269 Ca 0.00 0.27 -0.16 0.00 1.01 0.00 0.00 58.87 59.99 2ayq n SER 269 Cb 0.00 -0.27 -0.05 0.00 -1.01 0.00 0.00 64.21 62.88 2ayq n SER 269 CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13 2ayq n ASP 270 N -1.24 0.89 0.25 6.43 5.68 -1.26 -5.03 116.55 122.27 2ayq n ASP 270 Ca 0.00 -2.41 0.17 0.00 -0.50 0.00 0.00 54.79 52.05 2ayq n ASP 270 Cb 0.07 0.73 0.92 0.00 -1.14 0.00 0.00 41.12 41.70 2ayq n ASP 270 CO 0.00 0.00 0.00 0.03 -1.33 0.00 0.00 177.20 175.90 2ayq h ARG 271 N 0.00 0.00 -6.85 0.11 2.47 -1.85 -3.43 114.38 104.84 2ayq h ARG 271 Ca -0.20 0.00 -0.51 0.00 -1.26 0.00 0.00 59.98 58.01 2ayq h ARG 271 Cb 0.78 0.00 0.03 0.00 -1.65 0.00 0.00 29.97 29.14 2ayq h ARG 271 CO 0.31 0.00 0.51 0.12 0.56 0.00 0.00 179.97 181.47 2ayq s PHE 272 N -3.86 3.39 0.17 3.04 5.36 -1.26 -4.10 117.98 120.72 2ayq s PHE 272 Ca -0.04 1.62 -0.24 0.00 -0.96 0.00 0.00 56.93 57.31 2ayq s PHE 272 Cb 0.10 -3.38 0.06 0.00 -0.34 0.00 0.00 43.02 39.46 2ayq s PHE 272 CO 0.31 -0.94 0.72 0.20 -1.46 0.00 0.00 175.22 174.05 2ayq s GLY 273 N -0.84 -0.40 -0.12 13.12 0.00 -1.26 -4.01 107.32 113.80 2ayq s GLY 273 Ca 0.47 0.30 0.01 0.00 0.00 0.00 0.00 44.72 45.50 2ayq s GLY 273 CO 0.43 0.10 -0.17 -0.29 0.00 0.00 0.00 173.10 173.17 2ayq s MET 274 N -3.65 3.26 -0.10 2.90 1.75 -0.34 -1.08 119.30 122.03 2ayq s MET 274 Ca 0.06 -0.76 0.03 0.00 -1.25 0.00 0.00 55.69 53.77 2ayq s MET 274 Cb -0.02 -2.52 0.01 0.00 2.84 0.00 0.00 34.83 35.13 2ayq s MET 274 CO -0.05 0.19 -0.21 0.71 -0.65 0.00 0.00 175.02 175.01 2ayq s TYR 275 N 0.38 2.38 0.01 4.11 1.51 -0.28 -0.45 117.35 125.02 2ayq s TYR 275 Ca -0.13 -1.03 -0.15 0.00 -1.01 0.00 0.00 57.07 54.75 2ayq s TYR 275 Cb -0.17 -1.62 0.02 0.00 -0.11 0.00 0.00 41.96 40.09 2ayq s TYR 275 CO 0.06 -0.45 0.31 -1.83 -1.11 0.00 0.00 175.55 172.54 2ayq s GLU 276 N 0.54 0.74 0.53 -0.62 -1.05 -1.04 -1.23 118.70 116.57 2ayq s GLU 276 Ca -0.15 -0.33 -0.19 0.00 -0.15 0.00 0.00 54.97 54.16 2ayq s GLU 276 Cb -0.17 0.33 -0.07 0.00 -0.44 0.00 0.00 34.13 33.78 2ayq s GLU 276 CO 0.05 -0.22 1.06 -1.25 0.95 0.00 0.00 175.26 175.84 2ayq s PRO 277 N -1.89 3.59 0.43 -4.83 0.04 -1.26 -0.64 135.00 130.44 2ayq s PRO 277 Ca -0.10 1.34 0.20 0.00 0.04 0.00 0.00 61.00 62.49 2ayq s PRO 277 Cb -0.03 -2.06 0.97 0.00 0.04 0.00 0.00 34.50 33.41 2ayq s PRO 277 CO 0.01 -0.60 1.88 0.28 0.04 0.00 0.00 177.00 178.61 2ayq h VAL 278 N 1.16 0.85 -4.23 -0.36 2.07 -1.42 -3.44 116.25 110.88 2ayq h VAL 278 Ca -0.49 -1.08 -0.52 0.00 0.82 0.00 0.00 66.70 65.43 2ayq h VAL 278 Cb 1.23 1.65 0.14 0.00 -1.52 0.00 0.00 31.29 32.79 2ayq h VAL 278 CO 0.58 0.27 0.35 -1.38 0.02 0.00 0.00 177.57 177.41 2ayq s HIS 279 N -3.97 2.28 0.00 1.57 -3.43 -1.26 -5.06 115.29 105.42 2ayq s HIS 279 Ca -0.02 1.61 0.00 0.00 -0.80 0.00 0.00 55.06 55.85 2ayq s HIS 279 Cb 0.13 -3.27 0.00 0.00 -1.43 0.00 0.00 32.58 28.01 2ayq s HIS 279 CO 0.66 -2.17 0.00 0.41 -2.00 0.00 0.00 174.74 171.64 2ayq n GLY 280 N -0.26 -1.28 0.11 -1.38 0.00 -1.26 -4.83 105.19 96.28 2ayq n GLY 280 Ca 0.11 -1.59 -0.10 0.00 0.00 0.00 0.00 46.02 44.45 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 -0.12 0.24 -6.36 1.61 4.64 -1.85 -3.46 113.55 108.24 2ayq h SER 281 Ca 0.00 -0.22 -0.38 0.00 -0.47 0.00 0.00 61.79 60.72 2ayq h SER 281 Cb 0.00 -0.07 0.01 0.00 -0.31 0.00 0.00 62.40 62.03 2ayq h SER 281 CO 0.00 1.09 -0.81 0.00 -0.87 0.00 0.00 176.83 176.24 2ayq n ALA 282 N -2.45 -2.68 0.00 5.18 0.00 -1.26 0.18 120.51 119.48 2ayq n ALA 282 Ca -0.04 -0.23 -0.11 0.00 0.00 0.00 0.00 53.44 53.05 2ayq n ALA 282 Cb 0.89 -1.69 -0.05 0.00 0.00 0.00 0.00 19.45 18.60 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 -0.63 0.12 -0.19 0.00 0.13 -1.93 -2.40 132.00 127.10 2ayq h PRO 283 Ca -0.50 -0.01 0.05 0.00 -0.87 0.00 0.00 66.00 64.67 2ayq h PRO 283 Cb 1.30 -0.03 -0.01 0.00 0.13 0.00 0.00 31.00 32.40 2ayq h PRO 283 CO 0.39 0.08 0.34 0.38 -0.23 0.00 0.00 178.00 178.96 2ayq h ASP 284 N 0.12 0.00 0.73 1.44 3.04 -2.01 0.38 116.42 120.11 2ayq h ASP 284 Ca 0.03 0.00 -0.06 0.00 -3.24 0.00 0.00 57.03 53.77 2ayq h ASP 284 Cb -0.01 0.00 -0.01 0.00 -1.04 0.00 0.00 39.33 38.27 2ayq h ASP 284 CO -0.01 0.00 -1.31 -0.38 -2.04 0.00 0.00 179.24 175.50 2ayq n ILE 285 N -3.35 0.70 -1.61 4.15 2.08 -0.94 -4.91 119.36 115.47 2ayq n ILE 285 Ca 0.02 -0.59 -0.45 0.00 0.56 0.00 0.00 62.75 62.29 2ayq n ILE 285 Cb 0.45 -0.39 -0.02 0.00 -0.75 0.00 0.00 39.64 38.93 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 -2.27 0.07 0.00 -1.39 0.00 0.13 -2.22 120.51 114.83 2ayq n ALA 286 Ca -0.04 0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.80 2ayq n ALA 286 Cb 0.65 -2.09 0.00 0.00 0.00 0.00 0.00 19.45 18.01 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 1.44 2.64 0.08 0.00 0.00 -1.26 -4.83 105.19 103.25 2ayq n GLY 287 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.12 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 -1.03 0.91 -2.23 1.61 6.02 -0.94 -4.88 117.38 116.83 2ayq n GLN 288 Ca 0.00 0.00 -0.16 0.00 -0.01 0.00 0.00 57.00 56.83 2ayq n GLN 288 Cb 0.00 -1.07 -0.02 0.00 1.02 0.00 0.00 30.24 30.17 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 0.35 -0.09 0.22 1.08 0.00 -1.26 -4.87 105.19 100.62 2ayq n GLY 289 Ca 0.00 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.11 2ayq n GLY 289 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2ayq n LYS 290 N -2.75 1.31 -3.14 1.61 2.85 -1.26 -1.46 118.16 115.32 2ayq n LYS 290 Ca -0.19 -2.70 -0.37 0.00 -1.05 0.00 0.00 58.31 53.99 2ayq n LYS 290 Cb 0.63 -1.49 -0.06 0.00 -0.65 0.00 0.00 35.03 33.46 2ayq n LYS 290 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2ayq s ALA 291 N -2.86 3.48 -0.45 0.58 0.00 -1.26 -4.89 121.76 116.36 2ayq s ALA 291 Ca 0.33 0.15 -0.24 0.00 0.00 0.00 0.00 51.96 52.19 2ayq s ALA 291 Cb 0.29 -2.78 0.03 0.00 0.00 0.00 0.00 23.12 20.66 2ayq s ALA 291 CO 0.00 0.35 0.86 1.21 0.00 0.00 0.00 175.76 178.18 2ayq s ASN 292 N -1.43 6.47 0.30 0.00 3.84 -1.26 -4.50 114.94 118.36 2ayq s ASN 292 Ca 0.38 0.06 0.25 0.00 0.21 0.00 0.00 52.86 53.76 2ayq s ASN 292 Cb -0.19 -2.42 0.71 0.00 -0.55 0.00 0.00 41.25 38.81 2ayq s ASN 292 CO 0.21 -0.97 1.73 1.55 -2.79 0.00 0.00 177.10 176.84 2ayq h PRO 293 N 8.98 0.00 -0.62 0.43 0.13 -1.91 -3.35 132.00 135.66 2ayq h PRO 293 Ca -0.24 0.00 0.10 0.00 -0.87 0.00 0.00 66.00 64.98 2ayq h PRO 293 Cb 1.08 0.00 -0.07 0.00 0.13 0.00 0.00 31.00 32.14 2ayq h PRO 293 CO 0.99 0.00 0.23 -0.07 -0.23 0.00 0.00 178.00 178.92 2ayq h LEU 294 N 0.00 0.22 -0.48 1.56 3.38 -1.92 0.95 115.31 119.02 2ayq h LEU 294 Ca 0.00 0.08 0.07 0.00 0.09 0.00 0.00 57.88 58.12 2ayq h LEU 294 Cb 0.77 0.06 -0.06 0.00 0.09 0.00 0.00 40.66 41.53 2ayq h LEU 294 CO 0.00 0.13 0.14 1.23 0.09 0.00 0.00 178.44 180.02 2ayq h GLY 295 N 0.40 0.61 1.33 0.83 0.00 -1.70 0.13 103.07 104.68 2ayq h GLY 295 Ca 0.31 -0.06 -0.18 0.00 0.00 0.00 0.00 47.33 47.40 2ayq h GLY 295 CO -0.32 -0.02 -0.58 -0.84 0.00 0.00 0.00 176.54 174.78 2ayq h THR 296 N 0.29 1.30 -0.76 4.70 2.02 -1.64 -2.25 112.91 116.56 2ayq h THR 296 Ca 0.23 -1.81 -0.01 0.00 0.77 0.00 0.00 66.41 65.59 2ayq h THR 296 Cb 0.28 1.76 -0.04 0.00 -1.74 0.00 0.00 68.15 68.41 2ayq h THR 296 CO -0.27 0.57 0.43 0.58 0.37 0.00 0.00 175.52 177.20 2ayq h VAL 297 N 0.52 1.22 -0.39 3.16 2.07 -0.02 -0.62 116.25 122.20 2ayq h VAL 297 Ca 0.00 -0.52 -0.12 0.00 0.82 0.00 0.00 66.70 66.88 2ayq h VAL 297 Cb 1.16 0.18 -0.01 0.00 -1.52 0.00 0.00 31.29 31.10 2ayq h VAL 297 CO 0.12 0.24 -0.24 -0.07 0.02 0.00 0.00 177.57 177.64 2ayq h LEU 298 N 1.06 0.89 -1.10 2.57 3.38 -0.65 -2.63 115.31 118.82 2ayq h LEU 298 Ca 0.27 -0.42 0.11 0.00 0.09 0.00 0.00 57.88 57.93 2ayq h LEU 298 Cb -0.00 -0.25 -0.07 0.00 0.09 0.00 0.00 40.66 40.43 2ayq h LEU 298 CO -0.05 1.12 0.61 0.28 0.09 0.00 0.00 178.44 180.49 2ayq h SER 299 N 0.66 0.88 -0.71 -0.43 0.02 -0.66 0.77 113.55 114.09 2ayq h SER 299 Ca 0.08 0.03 -0.00 0.00 -0.84 0.00 0.00 61.79 61.06 2ayq h SER 299 Cb 0.80 -0.15 -0.03 0.00 0.14 0.00 0.00 62.40 63.16 2ayq h SER 299 CO 0.07 0.50 0.44 0.00 -1.14 0.00 0.00 176.83 176.69 2ayq h ALA 300 N 1.54 0.90 -0.68 3.77 0.00 -0.81 -0.59 119.26 123.38 2ayq h ALA 300 Ca 0.46 -0.08 -0.08 0.00 0.00 0.00 0.00 54.91 55.21 2ayq h ALA 300 Cb 0.44 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 17.91 2ayq h ALA 300 CO -0.22 0.36 0.13 0.00 0.00 0.00 0.00 179.25 179.52 2ayq h ALA 301 N 1.23 0.90 -0.93 0.00 0.00 -0.59 -1.43 119.26 118.45 2ayq h ALA 301 Ca 0.26 -0.26 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 2ayq h ALA 301 Cb -0.05 -0.26 -0.04 0.00 0.00 0.00 0.00 17.79 17.44 2ayq h ALA 301 CO -0.05 0.66 0.55 -0.07 0.00 0.00 0.00 179.25 180.34 2ayq h LEU 302 N 1.04 1.13 -0.06 0.00 3.38 -0.60 -1.00 115.31 119.20 2ayq h LEU 302 Ca 0.21 -0.08 0.02 0.00 0.09 0.00 0.00 57.88 58.12 2ayq h LEU 302 Cb 0.42 -0.29 -0.02 0.00 0.09 0.00 0.00 40.66 40.87 2ayq h LEU 302 CO 0.01 0.88 -0.04 -0.03 0.09 0.00 0.00 178.44 179.35 2ayq h MET 303 N 1.29 -0.04 -0.54 1.13 4.05 -0.46 0.26 114.93 120.63 2ayq h MET 303 Ca 0.33 0.00 -0.01 0.00 -0.28 0.00 0.00 59.70 59.75 2ayq h MET 303 Cb -0.04 0.01 -0.03 0.00 -0.80 0.00 0.00 31.60 30.75 2ayq h MET 303 CO -0.06 -0.02 0.31 -0.07 0.23 0.00 0.00 176.91 177.29 2ayq h LEU 304 N -0.04 0.65 0.20 3.39 3.38 -0.76 0.28 115.31 122.41 2ayq h LEU 304 Ca 0.04 -0.04 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 2ayq h LEU 304 Cb 0.09 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.68 2ayq h LEU 304 CO -0.09 0.52 -0.10 -0.09 0.09 0.00 0.00 178.44 178.77 2ayq h ARG 305 N 0.75 -0.26 0.00 1.13 2.43 -0.53 0.15 114.38 118.04 2ayq h ARG 305 Ca 0.19 0.02 -0.14 0.00 -0.81 0.00 0.00 59.98 59.24 2ayq h ARG 305 Cb 0.00 0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 29.59 2ayq h ARG 305 CO -0.03 0.11 -0.75 1.88 -1.51 0.00 0.00 179.97 179.67 2ayq h TYR 306 N -0.92 0.00 0.01 2.20 0.05 -0.50 -2.71 116.97 115.10 2ayq h TYR 306 Ca -0.03 0.00 -0.40 0.00 0.05 0.00 0.00 58.73 58.35 2ayq h TYR 306 Cb 0.49 0.00 -0.06 0.00 1.01 0.00 0.00 36.73 38.17 2ayq h TYR 306 CO 0.07 0.66 -2.36 0.43 -1.05 0.00 0.00 178.16 175.91 2ayq n SER 307 N -3.23 1.98 -0.17 3.88 7.64 0.08 -4.68 113.62 119.13 2ayq n SER 307 Ca 0.00 0.11 0.08 0.00 1.01 0.00 0.00 58.87 60.07 2ayq n SER 307 Cb 0.81 -0.65 -0.06 0.00 -1.01 0.00 0.00 64.21 63.31 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 -3.72 0.00 -1.00 1.43 3.72 -1.15 -4.82 117.46 111.92 2ayq n PHE 308 Ca -0.47 0.00 -0.00 0.00 -0.05 0.00 0.00 57.45 56.93 2ayq n PHE 308 Cb 0.94 0.00 -0.00 0.00 -0.94 0.00 0.00 39.48 39.48 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 1.32 0.23 3.21 1.37 0.00 0.08 -4.90 105.19 106.50 2ayq n GLY 309 Ca 0.05 -0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.67 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 -0.01 5.04 -0.10 0.99 7.99 0.29 -4.76 117.00 126.44 2ayq n LEU 310 Ca -0.00 -3.65 -0.09 0.00 -0.01 0.00 0.00 56.01 52.26 2ayq n LEU 310 Cb 0.27 -1.59 -0.02 0.00 -0.11 0.00 0.00 43.42 41.98 2ayq n LEU 310 CO 0.00 -0.00 0.95 -0.33 -1.51 0.00 0.00 177.39 176.49 2ayq h GLU 311 N 7.52 0.46 -0.76 3.23 5.08 -1.88 -2.00 114.58 126.23 2ayq h GLU 311 Ca 0.44 -0.06 0.02 0.00 -1.00 0.00 0.00 59.36 58.76 2ayq h GLU 311 Cb 0.77 -0.09 -0.04 0.00 0.50 0.00 0.00 28.75 29.89 2ayq h GLU 311 CO 1.66 0.40 0.50 1.57 -1.00 0.00 0.00 179.01 182.14 2ayq h LYS 312 N 0.40 0.97 -0.34 2.33 2.10 -1.98 0.10 116.57 120.15 2ayq h LYS 312 Ca 0.11 -0.06 -0.09 0.00 -2.00 0.00 0.00 60.65 58.61 2ayq h LYS 312 Cb 0.08 -0.22 -0.01 0.00 -0.90 0.00 0.00 32.23 31.18 2ayq h LYS 312 CO -0.02 0.64 -0.16 0.93 -2.00 0.00 0.00 179.45 178.84 2ayq h GLU 313 N 0.99 0.70 -0.46 0.07 3.07 -1.91 -1.45 114.58 115.60 2ayq h GLU 313 Ca 0.28 -0.31 -0.05 0.00 -0.50 0.00 0.00 59.36 58.79 2ayq h GLU 313 Cb -0.07 -0.02 -0.02 0.00 -0.84 0.00 0.00 28.75 27.80 2ayq h GLU 313 CO -0.07 0.91 0.09 0.00 -1.40 0.00 0.00 179.01 178.54 2ayq h ALA 314 N 0.78 0.60 -0.40 3.43 0.00 -0.83 -2.72 119.26 120.12 2ayq h ALA 314 Ca 0.08 -0.21 0.07 0.00 0.00 0.00 0.00 54.91 54.84 2ayq h ALA 314 Cb 0.69 -0.17 -0.06 0.00 0.00 0.00 0.00 17.79 18.25 2ayq h ALA 314 CO 0.05 0.31 0.02 0.00 0.00 0.00 0.00 179.25 179.63 2ayq h ALA 315 N 0.96 0.38 -0.72 0.00 0.00 -0.61 -1.56 119.26 117.71 2ayq h ALA 315 Ca 0.14 0.11 0.07 0.00 0.00 0.00 0.00 54.91 55.22 2ayq h ALA 315 Cb 0.35 0.17 -0.06 0.00 0.00 0.00 0.00 17.79 18.26 2ayq h ALA 315 CO 0.01 -0.38 0.41 0.00 0.00 0.00 0.00 179.25 179.28 2ayq h ALA 316 N 1.34 0.98 0.00 0.00 0.00 -1.09 -0.24 119.26 120.25 2ayq h ALA 316 Ca 0.19 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.12 2ayq h ALA 316 Cb 0.27 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.92 2ayq h ALA 316 CO -0.31 0.08 -0.00 0.82 0.00 0.00 0.00 179.25 179.84 2ayq h ILE 317 N 0.73 1.10 -0.49 0.00 2.04 -1.01 -0.95 117.51 118.93 2ayq h ILE 317 Ca 0.33 -0.29 -0.01 0.00 1.00 0.00 0.00 64.86 65.89 2ayq h ILE 317 Cb 0.22 1.29 -0.02 0.00 -0.74 0.00 0.00 36.82 37.57 2ayq h ILE 317 CO -0.20 0.08 0.27 -0.33 0.00 0.00 0.00 178.15 177.97 2ayq h GLU 318 N -0.13 0.66 0.26 2.37 5.08 -0.92 -0.75 114.58 121.15 2ayq h GLU 318 Ca -0.00 -0.06 -0.01 0.00 -1.00 0.00 0.00 59.36 58.29 2ayq h GLU 318 Cb 0.13 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.24 2ayq h GLU 318 CO 0.00 0.48 -0.13 -0.22 -1.00 0.00 0.00 179.01 178.15 2ayq h LYS 319 N 0.67 -0.34 -0.77 2.33 1.63 -0.78 -2.08 116.57 117.24 2ayq h LYS 319 Ca 0.17 0.02 0.17 0.00 -0.85 0.00 0.00 60.65 60.17 2ayq h LYS 319 Cb 0.01 0.08 -0.11 0.00 -0.60 0.00 0.00 32.23 31.61 2ayq h LYS 319 CO -0.03 -0.06 0.23 0.00 -3.45 0.00 0.00 179.45 176.14 2ayq h ALA 320 N 0.07 1.05 -0.02 5.00 0.00 -0.51 0.09 119.26 124.94 2ayq h ALA 320 Ca -0.04 0.16 0.01 0.00 0.00 0.00 0.00 54.91 55.04 2ayq h ALA 320 Cb 0.43 0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 2ayq h ALA 320 CO 0.06 -0.32 -0.02 0.28 0.00 0.00 0.00 179.25 179.25 2ayq h VAL 321 N 0.31 0.95 0.15 0.00 2.07 -0.99 -1.37 116.25 117.38 2ayq h VAL 321 Ca 0.44 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.98 2ayq h VAL 321 Cb 0.76 0.95 -0.03 0.00 -1.52 0.00 0.00 31.29 31.45 2ayq h VAL 321 CO -0.50 0.00 -0.27 -0.78 0.02 0.00 0.00 177.57 176.03 2ayq h ASP 322 N -0.02 -0.76 -0.91 0.57 3.58 -0.37 -1.38 116.42 117.14 2ayq h ASP 322 Ca 0.01 0.08 0.15 0.00 0.42 0.00 0.00 57.03 57.69 2ayq h ASP 322 Cb 0.04 0.28 -0.09 0.00 1.72 0.00 0.00 39.33 41.28 2ayq h ASP 322 CO -0.03 -0.37 0.51 0.44 -2.88 0.00 0.00 179.24 176.91 2ayq h ASP 323 N -0.50 0.67 -0.16 2.28 3.32 -0.84 0.99 116.42 122.16 2ayq h ASP 323 Ca 0.02 0.08 -0.01 0.00 0.02 0.00 0.00 57.03 57.14 2ayq h ASP 323 Cb 0.51 -0.04 -0.01 0.00 0.22 0.00 0.00 39.33 40.02 2ayq h ASP 323 CO -0.13 0.29 0.05 0.58 -1.72 0.00 0.00 179.24 178.31 2ayq h VAL 324 N 0.73 1.18 -0.17 -1.35 2.07 -0.79 0.12 116.25 118.03 2ayq h VAL 324 Ca 0.49 -0.55 -0.02 0.00 0.82 0.00 0.00 66.70 67.44 2ayq h VAL 324 Cb 0.65 1.24 -0.01 0.00 -1.52 0.00 0.00 31.29 31.65 2ayq h VAL 324 CO -0.34 0.17 0.01 -0.07 0.02 0.00 0.00 177.57 177.36 2ayq h LEU 325 N 0.09 0.22 -0.74 2.57 3.38 0.10 -0.77 115.31 120.15 2ayq h LEU 325 Ca 0.05 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 57.99 2ayq h LEU 325 Cb 0.21 -0.06 -0.03 0.00 0.09 0.00 0.00 40.66 40.87 2ayq h LEU 325 CO -0.00 0.26 0.41 -0.61 0.09 0.00 0.00 178.44 178.59 2ayq h GLN 326 N 0.24 1.03 -0.10 1.13 5.75 0.20 -0.24 115.11 123.12 2ayq h GLN 326 Ca 0.06 -0.12 0.00 0.00 -0.15 0.00 0.00 58.65 58.44 2ayq h GLN 326 Cb 0.15 -0.20 0.00 0.00 1.07 0.00 0.00 27.48 28.50 2ayq h GLN 326 CO 0.00 0.77 0.00 -0.25 -2.65 0.00 0.00 178.83 176.70 2ayq n ASP 327 N -4.46 0.10 -2.00 -0.69 8.00 -0.08 -4.86 116.55 112.55 2ayq n ASP 327 Ca 0.07 -1.94 -0.13 0.00 0.71 0.00 0.00 54.79 53.49 2ayq n ASP 327 Cb 0.09 -0.05 0.03 0.00 -0.02 0.00 0.00 41.12 41.17 2ayq n ASP 327 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2ayq n GLY 328 N 0.42 0.00 3.62 0.44 0.00 -0.10 -4.89 105.19 104.69 2ayq n GLY 328 Ca 0.00 -0.21 -0.33 0.00 0.00 0.00 0.00 46.02 45.48 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 -2.99 2.98 0.08 1.61 2.02 -1.09 -0.40 117.35 119.56 2ayq s TYR 329 Ca 0.23 0.04 -0.09 0.00 -0.37 0.00 0.00 57.07 56.88 2ayq s TYR 329 Cb -0.10 -1.68 0.03 0.00 -0.40 0.00 0.00 41.96 39.81 2ayq s TYR 329 CO 0.28 0.39 0.42 0.00 -1.57 0.00 0.00 175.55 175.07 2ayq n THR 331 N -0.30 0.00 0.00 0.00 -2.24 -1.26 -1.61 114.28 108.87 2ayq n THR 331 Ca -0.01 -0.43 0.00 0.00 -2.27 0.00 0.00 64.05 61.34 2ayq n THR 331 Cb 0.24 1.32 0.00 0.00 -2.10 0.00 0.00 70.33 69.80 2ayq n THR 331 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2ayq n GLY 332 N 1.13 0.96 0.22 3.38 0.00 -1.26 -4.70 105.19 104.92 2ayq n GLY 332 Ca 0.10 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.96 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 1.52 0.86 -4.07 1.61 2.03 -1.93 -3.45 116.42 113.00 2ayq h ASP 333 Ca 0.00 -0.56 -0.50 0.00 -0.73 0.00 0.00 57.03 55.24 2ayq h ASP 333 Cb 0.00 -0.26 0.05 0.00 -0.83 0.00 0.00 39.33 38.29 2ayq h ASP 333 CO 0.00 1.35 0.30 -0.76 -1.03 0.00 0.00 179.24 179.10 2ayq s LEU 334 N -8.35 3.42 -0.71 0.15 1.43 -1.26 -5.03 118.68 108.33 2ayq s LEU 334 Ca -0.09 1.27 0.04 0.00 -1.03 0.00 0.00 54.13 54.32 2ayq s LEU 334 Cb 0.09 -4.27 0.22 0.00 0.03 0.00 0.00 46.19 42.26 2ayq s LEU 334 CO 0.89 -0.73 0.67 0.00 0.23 0.00 0.00 176.35 177.42 2ayq n GLN 335 N -2.41 2.33 -1.24 1.70 1.13 -1.26 -4.91 117.38 112.71 2ayq n GLN 335 Ca 0.04 -4.58 -0.31 0.00 -1.94 0.00 0.00 57.00 50.22 2ayq n GLN 335 Cb 0.54 -2.30 0.10 0.00 0.11 0.00 0.00 30.24 28.70 2ayq n GLN 335 CO 0.00 0.00 0.00 0.14 -1.44 0.00 0.00 177.06 175.76 2ayq s VAL 336 N -1.97 3.13 0.00 5.09 -7.23 -1.26 -4.59 120.40 113.57 2ayq s VAL 336 Ca 0.32 0.37 0.00 0.00 -1.81 0.00 0.00 61.98 60.86 2ayq s VAL 336 Cb 0.04 -2.85 0.00 0.00 0.56 0.00 0.00 36.38 34.13 2ayq s VAL 336 CO -0.09 -0.48 0.00 0.00 -0.31 0.00 0.00 175.10 174.22 2ayq n ALA 337 N -3.63 0.00 -2.90 1.32 0.00 -0.96 -3.22 120.51 111.12 2ayq n ALA 337 Ca 0.08 0.00 -0.44 0.00 0.00 0.00 0.00 53.44 53.09 2ayq n ALA 337 Cb 0.54 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.99 2ayq n ALA 337 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2ayq n ASN 338 N 0.00 5.36 -4.68 0.00 3.02 -1.26 -4.98 115.26 112.72 2ayq n ASN 338 Ca 0.00 -3.06 -0.44 0.00 -0.03 0.00 0.00 54.58 51.05 2ayq n ASN 338 Cb 0.00 -1.49 -0.02 0.00 -0.61 0.00 0.00 39.78 37.66 2ayq n ASN 338 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2ayq n GLY 339 N 3.29 0.70 2.65 7.41 0.00 -1.20 -4.53 105.19 113.52 2ayq n GLY 339 Ca 0.34 0.43 -0.22 0.00 0.00 0.00 0.00 46.02 46.57 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 -0.92 -0.02 -0.10 1.61 1.02 0.47 -5.02 119.74 116.77 2ayq s LYS 340 Ca 0.64 0.21 -0.20 0.00 0.02 0.00 0.00 55.97 56.63 2ayq s LYS 340 Cb -0.62 -1.02 -0.04 0.00 -0.52 0.00 0.00 37.83 35.63 2ayq s LYS 340 CO 0.54 -0.47 0.57 0.08 -0.92 0.00 0.00 175.35 175.15 2ayq s VAL 341 N 2.16 5.13 0.31 3.17 1.01 -1.26 -2.34 120.40 128.59 2ayq s VAL 341 Ca 0.04 1.15 0.04 0.00 0.00 0.00 0.00 61.98 63.20 2ayq s VAL 341 Cb -0.14 -3.91 -0.03 0.00 0.00 0.00 0.00 36.38 32.30 2ayq s VAL 341 CO -0.06 0.29 0.18 0.68 0.00 0.00 0.00 175.10 176.20 2ayq s VAL 342 N 0.73 0.24 0.69 2.92 -7.23 -0.64 -4.99 120.40 112.13 2ayq s VAL 342 Ca 0.30 -2.00 -0.11 0.00 -1.81 0.00 0.00 61.98 58.36 2ayq s VAL 342 Cb -0.16 -2.49 0.01 0.00 0.56 0.00 0.00 36.38 34.30 2ayq s VAL 342 CO 0.13 0.00 1.09 -0.94 -0.31 0.00 0.00 175.10 175.07 2ayq s SER 343 N -3.38 5.53 0.20 4.85 1.04 -1.26 -4.23 113.70 116.45 2ayq s SER 343 Ca 0.36 1.15 -0.10 0.00 0.48 0.00 0.00 55.95 57.83 2ayq s SER 343 Cb 0.04 -1.97 0.23 0.00 0.10 0.00 0.00 66.02 64.42 2ayq s SER 343 CO 0.19 -1.29 1.77 0.74 0.98 0.00 0.00 173.24 175.64 2ayq h THR 344 N -0.61 0.87 -0.29 2.02 2.02 -1.48 -0.33 112.91 115.12 2ayq h THR 344 Ca -0.45 -0.17 -0.02 0.00 0.77 0.00 0.00 66.41 66.54 2ayq h THR 344 Cb 1.25 0.33 -0.01 0.00 -1.74 0.00 0.00 68.15 67.97 2ayq h THR 344 CO 0.64 0.09 0.11 0.40 0.37 0.00 0.00 175.52 177.13 2ayq h ILE 345 N 0.50 1.18 0.28 3.11 5.03 -1.92 -2.45 117.51 123.24 2ayq h ILE 345 Ca 0.28 -0.56 0.00 0.00 -0.12 0.00 0.00 64.86 64.46 2ayq h ILE 345 Cb 0.27 1.02 -0.04 0.00 -3.03 0.00 0.00 36.82 35.04 2ayq h ILE 345 CO -0.23 0.19 -0.52 -0.08 -0.68 0.00 0.00 178.15 176.83 2ayq h GLU 346 N 0.31 -0.82 -0.81 2.37 4.57 -1.70 0.22 114.58 118.72 2ayq h GLU 346 Ca 0.09 0.06 0.16 0.00 -1.18 0.00 0.00 59.36 58.49 2ayq h GLU 346 Cb 0.19 0.19 -0.10 0.00 -0.16 0.00 0.00 28.75 28.87 2ayq h GLU 346 CO -0.01 -0.55 0.34 -0.07 -1.18 0.00 0.00 179.01 177.55 2ayq h LEU 347 N -0.85 0.32 -0.59 1.64 3.38 -1.09 0.20 115.31 118.32 2ayq h LEU 347 Ca -0.03 0.12 0.01 0.00 0.09 0.00 0.00 57.88 58.07 2ayq h LEU 347 Cb 0.80 0.09 -0.03 0.00 0.09 0.00 0.00 40.66 41.61 2ayq h LEU 347 CO -0.19 0.09 0.38 0.74 0.09 0.00 0.00 178.44 179.55 2ayq h THR 348 N 0.46 1.12 -0.51 0.22 2.02 -0.87 0.39 112.91 115.74 2ayq h THR 348 Ca 0.46 -0.26 0.03 0.00 0.77 0.00 0.00 66.41 67.40 2ayq h THR 348 Cb 0.74 0.29 -0.04 0.00 -1.74 0.00 0.00 68.15 67.40 2ayq h THR 348 CO -0.43 0.14 0.30 0.44 0.37 0.00 0.00 175.52 176.33 2ayq h ASP 349 N 0.76 0.48 -0.36 4.18 3.32 0.23 -0.36 116.42 124.66 2ayq h ASP 349 Ca 0.22 0.01 -0.02 0.00 0.02 0.00 0.00 57.03 57.26 2ayq h ASP 349 Cb -0.05 -0.09 -0.02 0.00 0.22 0.00 0.00 39.33 39.39 2ayq h ASP 349 CO -0.07 0.34 0.15 0.03 -1.72 0.00 0.00 179.24 177.97 2ayq h ARG 350 N 0.59 0.54 -0.54 3.56 3.08 -0.32 0.20 114.38 121.51 2ayq h ARG 350 Ca 0.21 -0.10 0.11 0.00 0.07 0.00 0.00 59.98 60.27 2ayq h ARG 350 Cb 0.03 -0.09 -0.10 0.00 0.08 0.00 0.00 29.97 29.90 2ayq h ARG 350 CO -0.10 0.52 -0.08 -0.07 -1.07 0.00 0.00 179.97 179.17 2ayq h LEU 351 N 0.44 -0.39 -0.33 3.04 3.38 0.86 0.55 115.31 122.87 2ayq h LEU 351 Ca 0.12 0.15 -0.05 0.00 0.09 0.00 0.00 57.88 58.20 2ayq h LEU 351 Cb 0.18 0.29 -0.01 0.00 0.09 0.00 0.00 40.66 41.21 2ayq h LEU 351 CO -0.01 -0.14 0.03 0.40 0.09 0.00 0.00 178.44 178.80 2ayq h ILE 352 N 0.04 1.25 -0.57 1.22 2.04 -0.79 0.21 117.51 120.91 2ayq h ILE 352 Ca 0.27 -0.89 0.08 0.00 1.00 0.00 0.00 64.86 65.32 2ayq h ILE 352 Cb 0.41 1.19 -0.03 0.00 -0.74 0.00 0.00 36.82 37.65 2ayq h ILE 352 CO -0.52 0.29 0.38 -0.08 0.00 0.00 0.00 178.15 178.23 2ayq h GLU 353 N 0.38 0.41 0.02 2.37 4.81 0.16 0.35 114.58 123.07 2ayq h GLU 353 Ca 0.10 -0.02 -0.23 0.00 -0.13 0.00 0.00 59.36 59.07 2ayq h GLU 353 Cb 0.40 -0.09 -0.03 0.00 0.63 0.00 0.00 28.75 29.66 2ayq h GLU 353 CO 0.01 0.27 -1.14 0.87 -0.73 0.00 0.00 179.01 178.29 2ayq h LYS 354 N 0.42 0.04 0.00 1.92 1.79 0.40 -3.27 116.57 117.87 2ayq h LYS 354 Ca 0.26 -0.07 0.00 0.00 -2.18 0.00 0.00 60.65 58.65 2ayq h LYS 354 Cb 0.46 0.03 0.00 0.00 -1.58 0.00 0.00 32.23 31.13 2ayq h LYS 354 CO -0.07 0.96 0.00 -0.11 -1.08 0.00 0.00 179.45 179.15 2ayq n LEU 355 N -3.34 0.00 0.00 2.94 7.94 0.12 -4.92 117.00 119.75 2ayq n LEU 355 Ca -0.04 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.86 2ayq n LEU 355 Cb 0.97 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.92 2ayq n LEU 355 CO 0.48 0.00 0.00 -0.46 -1.11 0.00 0.00 177.39 176.30