#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1oac n HIS 6 N 0.00 0.00 -2.04 0.00 -0.00 -1.26 -5.18 115.22 106.73 1oac n HIS 6 Ca 0.00 0.00 -0.29 0.00 -0.00 0.00 0.00 57.72 57.43 1oac n HIS 6 Cb 0.00 0.00 0.03 0.00 -0.00 0.00 0.00 29.99 30.02 1oac n HIS 6 CO 0.00 0.00 0.00 -1.64 -0.00 0.00 0.00 176.34 174.70 1oac s MET 7 N -0.59 3.10 0.15 1.57 1.00 -1.26 -4.20 119.30 119.06 1oac s MET 7 Ca 0.00 0.41 0.05 0.00 0.00 0.00 0.00 55.69 56.16 1oac s MET 7 Cb 0.00 -2.11 -0.04 0.00 0.00 0.00 0.00 34.83 32.67 1oac s MET 7 CO 0.00 -0.80 -0.12 0.54 0.00 0.00 0.00 175.02 174.65 1oac s VAL 8 N -3.20 1.31 -0.22 -6.03 0.11 0.13 -4.93 120.40 107.57 1oac s VAL 8 Ca 0.56 -1.98 -0.29 0.00 -2.93 0.00 0.00 61.98 57.33 1oac s VAL 8 Cb -0.11 -1.78 -0.00 0.00 -1.53 0.00 0.00 36.38 32.96 1oac s VAL 8 CO 0.50 -0.63 1.18 -2.16 -3.33 0.00 0.00 175.10 170.66 1oac s PRO 9 N -3.41 4.18 0.06 1.54 0.05 -1.26 0.59 135.00 136.74 1oac s PRO 9 Ca 0.15 1.45 -0.16 0.00 0.05 0.00 0.00 61.00 62.49 1oac s PRO 9 Cb -0.00 -3.74 -0.06 0.00 0.05 0.00 0.00 34.50 30.75 1oac s PRO 9 CO 0.02 -0.76 1.26 1.98 0.05 0.00 0.00 177.00 179.55 1oac h MET 10 N 8.10 -0.26 -0.46 4.56 4.05 -1.76 -2.46 114.93 126.70 1oac h MET 10 Ca -0.23 0.02 0.09 0.00 -0.28 0.00 0.00 59.70 59.30 1oac h MET 10 Cb 1.08 0.06 -0.09 0.00 -0.80 0.00 0.00 31.60 31.85 1oac h MET 10 CO 0.99 -0.17 -0.16 -0.44 0.23 0.00 0.00 176.91 177.35 1oac h ASP 11 N -0.27 -0.58 0.46 1.39 3.32 -1.94 0.23 116.42 119.04 1oac h ASP 11 Ca 0.02 0.15 -0.01 0.00 0.02 0.00 0.00 57.03 57.21 1oac h ASP 11 Cb 0.32 0.34 -0.02 0.00 0.22 0.00 0.00 39.33 40.19 1oac h ASP 11 CO -0.21 -0.20 -0.42 0.50 -1.72 0.00 0.00 179.24 177.19 1oac h LYS 12 N -0.06 -0.85 -0.47 3.56 3.64 -1.94 0.35 116.57 120.81 1oac h LYS 12 Ca 0.22 0.06 0.07 0.00 -1.27 0.00 0.00 60.65 59.73 1oac h LYS 12 Cb 0.40 0.19 -0.06 0.00 -0.41 0.00 0.00 32.23 32.35 1oac h LYS 12 CO -0.51 -0.57 0.12 1.15 -2.27 0.00 0.00 179.45 177.38 1oac h THR 13 N -0.88 0.79 -0.11 1.00 2.02 -1.05 -0.28 112.91 114.39 1oac h THR 13 Ca -0.05 -0.09 -0.05 0.00 0.77 0.00 0.00 66.41 66.99 1oac h THR 13 Cb 0.77 0.49 -0.00 0.00 -1.74 0.00 0.00 68.15 67.67 1oac h THR 13 CO -0.04 0.05 -0.14 -0.07 0.37 0.00 0.00 175.52 175.70 1oac h LEU 14 N 0.27 0.31 -1.13 2.58 -0.00 -0.53 -2.54 115.31 114.28 1oac h LEU 14 Ca 0.23 -0.50 -0.02 0.00 -0.00 0.00 0.00 57.88 57.58 1oac h LEU 14 Cb 0.27 -0.09 -0.03 0.00 -0.00 0.00 0.00 40.66 40.81 1oac h LEU 14 CO -0.27 0.76 0.32 0.11 -0.00 0.00 0.00 178.44 179.36 1oac h LYS 15 N -0.12 0.93 0.00 1.13 1.57 -0.80 -1.76 116.57 117.53 1oac h LYS 15 Ca 0.01 -0.12 -0.04 0.00 -1.87 0.00 0.00 60.65 58.64 1oac h LYS 15 Cb 0.68 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.80 1oac h LYS 15 CO 0.03 0.72 -0.17 0.93 -0.57 0.00 0.00 179.45 180.38 1oac h GLU 16 N 0.93 0.00 -0.00 3.15 5.08 -0.92 -2.44 114.58 120.38 1oac h GLU 16 Ca 0.23 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.59 1oac h GLU 16 Cb 0.09 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.34 1oac h GLU 16 CO -0.03 0.17 -0.28 0.34 -1.00 0.00 0.00 179.01 178.21 1oac n PHE 17 N -4.23 0.00 -0.48 4.33 7.35 -0.71 -4.95 117.46 118.77 1oac n PHE 17 Ca -0.02 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.67 1oac n PHE 17 Cb 0.24 -0.30 0.00 0.00 0.35 0.00 0.00 39.48 39.77 1oac n PHE 17 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1oac n GLY 18 N 1.46 0.73 3.85 7.13 0.00 -0.92 -5.08 105.19 112.36 1oac n GLY 18 Ca 0.08 -0.31 -0.34 0.00 0.00 0.00 0.00 46.02 45.45 1oac n GLY 18 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1oac s ALA 19 N -2.00 3.55 -0.17 4.61 0.00 -0.92 -4.84 121.76 121.99 1oac s ALA 19 Ca 0.00 -0.15 -0.22 0.00 0.00 0.00 0.00 51.96 51.59 1oac s ALA 19 Cb 0.00 -2.53 -0.02 0.00 0.00 0.00 0.00 23.12 20.57 1oac s ALA 19 CO 0.00 0.46 0.68 0.34 0.00 0.00 0.00 175.76 177.24 1oac s ASP 20 N -1.97 6.79 -0.19 0.00 2.15 0.69 -4.30 116.67 119.85 1oac s ASP 20 Ca 0.42 0.96 -0.04 0.00 0.43 0.00 0.00 52.55 54.33 1oac s ASP 20 Cb -0.13 -2.38 -0.02 0.00 -0.30 0.00 0.00 42.92 40.09 1oac s ASP 20 CO 0.20 -0.27 -0.04 -0.69 -0.17 0.00 0.00 175.17 174.20 1oac s VAL 21 N 1.77 3.58 -0.08 1.11 1.01 -1.26 -0.40 120.40 126.13 1oac s VAL 21 Ca 0.32 -0.44 0.04 0.00 0.00 0.00 0.00 61.98 61.90 1oac s VAL 21 Cb -0.16 -2.61 0.00 0.00 0.00 0.00 0.00 36.38 33.61 1oac s VAL 21 CO 0.12 0.45 -0.21 -1.10 0.00 0.00 0.00 175.10 174.36 1oac s GLN 22 N 1.04 2.51 -0.17 2.72 -0.21 -0.05 -4.99 119.66 120.52 1oac s GLN 22 Ca 0.01 -0.74 -0.05 0.00 0.02 0.00 0.00 55.36 54.60 1oac s GLN 22 Cb -0.15 -1.98 -0.03 0.00 1.00 0.00 0.00 33.01 31.85 1oac s GLN 22 CO 0.00 0.18 -0.01 -0.46 -2.12 0.00 0.00 175.29 172.89 1oac s TRP 23 N 0.31 3.08 -0.33 0.91 -0.11 -1.26 -0.56 118.94 120.98 1oac s TRP 23 Ca -0.14 -0.25 -0.03 0.00 1.22 0.00 0.00 56.10 56.90 1oac s TRP 23 Cb -0.16 -2.01 0.05 0.00 -1.50 0.00 0.00 33.47 29.85 1oac s TRP 23 CO 0.06 -0.04 0.06 0.34 -4.62 0.00 0.00 176.95 172.75 1oac s ASP 24 N 0.51 5.07 0.33 5.86 -1.08 0.25 -4.97 116.67 122.64 1oac s ASP 24 Ca -0.01 -1.32 0.13 0.00 -0.52 0.00 0.00 52.55 50.82 1oac s ASP 24 Cb -0.14 -1.77 0.59 0.00 -1.46 0.00 0.00 42.92 40.13 1oac s ASP 24 CO 0.02 -0.31 1.74 -0.78 0.52 0.00 0.00 175.17 176.35 1oac h ASP 25 N 8.07 0.00 -0.15 -0.34 3.58 -1.96 0.98 116.42 126.60 1oac h ASP 25 Ca -0.21 0.00 -0.06 0.00 0.42 0.00 0.00 57.03 57.18 1oac h ASP 25 Cb 1.07 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 42.11 1oac h ASP 25 CO 0.57 0.47 -0.14 0.22 -2.88 0.00 0.00 179.24 177.48 1oac h TYR 26 N 0.00 0.44 0.00 0.28 3.20 -1.97 -3.19 116.97 115.73 1oac h TYR 26 Ca -0.00 -0.13 0.00 0.00 3.14 0.00 0.00 58.73 61.74 1oac h TYR 26 Cb 0.85 -0.09 0.00 0.00 1.54 0.00 0.00 36.73 39.03 1oac h TYR 26 CO 0.00 0.75 -0.63 0.00 -1.64 0.00 0.00 178.16 176.64 1oac n ALA 27 N -2.42 3.00 -3.44 1.82 0.00 -1.16 -4.97 120.51 113.34 1oac n ALA 27 Ca -0.06 -0.27 -0.19 0.00 0.00 0.00 0.00 53.44 52.93 1oac n ALA 27 Cb 0.36 -1.16 0.07 0.00 0.00 0.00 0.00 19.45 18.72 1oac n ALA 27 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1oac n GLN 28 N -2.03 -3.91 -3.94 0.00 1.13 0.33 -4.99 117.38 103.98 1oac n GLN 28 Ca 0.03 0.76 -0.11 0.00 -1.94 0.00 0.00 57.00 55.75 1oac n GLN 28 Cb 0.43 -5.50 -0.13 0.00 0.11 0.00 0.00 30.24 25.15 1oac n GLN 28 CO 0.00 0.00 0.00 -1.17 -1.44 0.00 0.00 177.06 174.45 1oac s LEU 29 N -6.06 2.11 -0.10 1.08 0.20 -0.71 -4.49 118.68 110.72 1oac s LEU 29 Ca 0.24 -0.23 -0.03 0.00 0.69 0.00 0.00 54.13 54.79 1oac s LEU 29 Cb -0.04 0.03 -0.03 0.00 -0.43 0.00 0.00 46.19 45.71 1oac s LEU 29 CO 0.77 -0.13 0.03 -0.36 -0.29 0.00 0.00 176.35 176.37 1oac s PHE 30 N -0.67 3.25 -0.16 5.38 0.08 -0.37 -0.58 117.98 124.91 1oac s PHE 30 Ca -0.07 0.24 0.01 0.00 0.12 0.00 0.00 56.93 57.23 1oac s PHE 30 Cb -0.05 -1.84 0.01 0.00 -0.57 0.00 0.00 43.02 40.57 1oac s PHE 30 CO -0.00 0.49 -0.17 0.99 -0.10 0.00 0.00 175.22 176.43 1oac s THR 31 N -0.82 2.41 -0.14 0.64 2.01 0.28 -1.44 115.64 118.59 1oac s THR 31 Ca 0.13 -0.84 0.02 0.00 0.31 0.00 0.00 61.69 61.30 1oac s THR 31 Cb -0.12 -2.01 0.00 0.00 0.01 0.00 0.00 72.50 70.38 1oac s THR 31 CO 0.03 0.52 -0.20 -0.76 -0.69 0.00 0.00 174.62 173.52 1oac s LEU 32 N 1.01 2.24 -0.06 4.42 1.02 0.16 -0.87 118.68 126.61 1oac s LEU 32 Ca -0.02 -0.54 0.04 0.00 0.02 0.00 0.00 54.13 53.63 1oac s LEU 32 Cb -0.15 -1.48 0.00 0.00 0.02 0.00 0.00 46.19 44.58 1oac s LEU 32 CO -0.04 0.10 -0.19 -0.63 0.02 0.00 0.00 176.35 175.61 1oac s ILE 33 N 0.72 1.59 -0.24 -0.59 1.01 0.46 -0.23 121.20 123.92 1oac s ILE 33 Ca -0.09 -0.78 -0.03 0.00 0.00 0.00 0.00 60.65 59.76 1oac s ILE 33 Cb -0.16 -1.38 0.13 0.00 0.01 0.00 0.00 42.46 41.06 1oac s ILE 33 CO 0.01 0.45 0.35 -0.75 0.00 0.00 0.00 174.94 175.00 1oac s LYS 34 N 0.25 0.33 4.08 2.79 2.20 -0.21 -0.22 119.74 128.96 1oac s LYS 34 Ca -0.10 0.43 0.00 0.00 -0.36 0.00 0.00 55.97 55.93 1oac s LYS 34 Cb -0.14 -0.59 0.00 0.00 -1.51 0.00 0.00 37.83 35.58 1oac s LYS 34 CO 0.04 -0.69 0.00 -0.25 -0.36 0.00 0.00 175.35 174.10 1oac n ASP 35 N 5.35 0.00 0.00 1.43 8.00 -1.26 -0.97 116.55 129.10 1oac n ASP 35 Ca -0.04 0.00 0.13 0.00 0.71 0.00 0.00 54.79 55.59 1oac n ASP 35 Cb 0.50 0.00 0.61 0.00 -0.02 0.00 0.00 41.12 42.21 1oac n ASP 35 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1oac n GLY 36 N 0.00 -1.25 3.63 0.44 0.00 -1.26 -4.81 105.19 101.94 1oac n GLY 36 Ca 0.00 -0.11 -0.35 0.00 0.00 0.00 0.00 46.02 45.56 1oac n GLY 36 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1oac s ALA 37 N -2.75 3.44 -0.29 4.61 0.00 -0.14 -4.54 121.76 122.09 1oac s ALA 37 Ca 0.20 -0.81 0.03 0.00 0.00 0.00 0.00 51.96 51.37 1oac s ALA 37 Cb 0.17 -2.04 0.08 0.00 0.00 0.00 0.00 23.12 21.32 1oac s ALA 37 CO 0.43 0.02 -0.04 -0.47 0.00 0.00 0.00 175.76 175.70 1oac s TYR 38 N 0.65 3.30 -0.05 0.00 6.14 -1.26 -1.04 117.35 125.09 1oac s TYR 38 Ca 0.05 -2.49 0.05 0.00 0.64 0.00 0.00 57.07 55.31 1oac s TYR 38 Cb -0.13 -2.25 -0.02 0.00 0.42 0.00 0.00 41.96 39.99 1oac s TYR 38 CO 0.01 -0.89 -0.19 0.08 0.64 0.00 0.00 175.55 175.20 1oac s VAL 39 N 1.08 2.66 -0.08 3.14 1.01 0.67 -1.45 120.40 127.43 1oac s VAL 39 Ca -0.01 -0.86 0.04 0.00 0.00 0.00 0.00 61.98 61.15 1oac s VAL 39 Cb -0.19 -2.01 0.00 0.00 0.00 0.00 0.00 36.38 34.17 1oac s VAL 39 CO -0.07 0.58 -0.21 -0.54 0.00 0.00 0.00 175.10 174.85 1oac s LYS 40 N -0.48 2.60 -0.10 2.72 1.02 -0.59 0.37 119.74 125.28 1oac s LYS 40 Ca 0.06 -0.77 -0.08 0.00 0.02 0.00 0.00 55.97 55.19 1oac s LYS 40 Cb -0.12 -2.04 0.03 0.00 -0.52 0.00 0.00 37.83 35.18 1oac s LYS 40 CO 0.01 0.19 0.25 0.54 -0.92 0.00 0.00 175.35 175.43 1oac s VAL 41 N 0.28 -0.01 -0.07 3.17 0.11 -0.52 -1.13 120.40 122.24 1oac s VAL 41 Ca -0.14 0.02 -0.03 0.00 -2.93 0.00 0.00 61.98 58.90 1oac s VAL 41 Cb -0.16 -0.37 -0.04 0.00 -1.53 0.00 0.00 36.38 34.28 1oac s VAL 41 CO 0.06 0.01 0.09 -0.54 -3.33 0.00 0.00 175.10 171.40 1oac s LYS 42 N 0.33 3.23 0.25 1.54 1.02 -1.26 -1.23 119.74 123.61 1oac s LYS 42 Ca -0.02 -0.32 -0.31 0.00 0.02 0.00 0.00 55.97 55.35 1oac s LYS 42 Cb -0.03 -2.99 -0.11 0.00 -0.52 0.00 0.00 37.83 34.17 1oac s LYS 42 CO -0.01 0.71 1.64 -2.14 -0.92 0.00 0.00 175.35 174.63 1oac s PRO 43 N -1.29 4.14 0.00 -1.68 0.02 -1.26 -1.80 135.00 133.12 1oac s PRO 43 Ca 0.18 2.56 0.00 0.00 0.02 0.00 0.00 61.00 63.76 1oac s PRO 43 Cb -0.12 -3.06 0.00 0.00 0.02 0.00 0.00 34.50 31.34 1oac s PRO 43 CO 0.08 -0.67 0.00 0.41 -0.33 0.00 0.00 177.00 176.49 1oac n GLY 44 N 3.02 0.60 3.88 0.52 0.00 0.52 -4.95 105.19 108.78 1oac n GLY 44 Ca 0.12 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.82 1oac n GLY 44 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1oac s ALA 45 N -2.52 3.56 -0.73 4.61 0.00 -0.75 -4.95 121.76 120.99 1oac s ALA 45 Ca 0.00 -0.29 0.26 0.00 0.00 0.00 0.00 51.96 51.93 1oac s ALA 45 Cb 0.00 -2.44 0.70 0.00 0.00 0.00 0.00 23.12 21.38 1oac s ALA 45 CO 0.00 0.47 1.65 1.04 0.00 0.00 0.00 175.76 178.92 1oac n GLN 46 N -0.23 0.25 -4.18 0.00 6.02 -1.26 -4.43 117.38 113.54 1oac n GLN 46 Ca 0.00 0.16 -0.11 0.00 -0.01 0.00 0.00 57.00 57.04 1oac n GLN 46 Cb 0.53 -1.74 -0.10 0.00 1.02 0.00 0.00 30.24 29.94 1oac n GLN 46 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.06 177.00 1oac s THR 47 N -3.11 0.69 0.20 5.09 -4.23 -1.26 -1.14 115.64 111.88 1oac s THR 47 Ca 0.10 -1.95 0.02 0.00 -1.18 0.00 0.00 61.69 58.68 1oac s THR 47 Cb 0.13 -1.76 -0.05 0.00 1.34 0.00 0.00 72.50 72.16 1oac s THR 47 CO 0.63 -0.80 0.03 0.00 -0.54 0.00 0.00 174.62 173.94 1oac s ALA 48 N -3.63 1.46 -0.15 3.99 0.00 0.09 -4.60 121.76 118.92 1oac s ALA 48 Ca 0.14 -1.67 -0.01 0.00 0.00 0.00 0.00 51.96 50.42 1oac s ALA 48 Cb 0.05 0.68 -0.01 0.00 0.00 0.00 0.00 23.12 23.84 1oac s ALA 48 CO -0.03 -0.35 -0.11 0.42 0.00 0.00 0.00 175.76 175.68 1oac s ILE 49 N -3.68 3.12 -0.25 0.00 -1.09 -0.29 -0.39 121.20 118.62 1oac s ILE 49 Ca 0.28 -0.63 0.02 0.00 -2.23 0.00 0.00 60.65 58.09 1oac s ILE 49 Cb 0.06 -2.33 0.06 0.00 -1.58 0.00 0.00 42.46 38.68 1oac s ILE 49 CO 0.07 0.51 -0.09 -0.69 -1.23 0.00 0.00 174.94 173.51 1oac s VAL 50 N 0.55 1.99 -1.34 2.92 1.01 0.17 -1.55 120.40 124.15 1oac s VAL 50 Ca -0.07 -1.54 -0.02 0.00 0.00 0.00 0.00 61.98 60.35 1oac s VAL 50 Cb -0.15 -2.15 0.01 0.00 0.00 0.00 0.00 36.38 34.09 1oac s VAL 50 CO 0.03 -0.07 0.72 0.59 0.00 0.00 0.00 175.10 176.38 1oac n ASN 51 N 4.50 -1.55 0.00 3.32 5.03 -0.53 -1.14 115.26 124.88 1oac n ASN 51 Ca -0.13 -0.82 0.00 0.00 0.87 0.00 0.00 54.58 54.50 1oac n ASN 51 Cb 0.43 -3.98 0.00 0.00 -1.02 0.00 0.00 39.78 35.20 1oac n ASN 51 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1oac n GLY 52 N -1.61 0.72 3.40 7.41 0.00 -1.22 -4.64 105.19 109.26 1oac n GLY 52 Ca -0.26 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.46 1oac n GLY 52 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1oac s GLN 53 N -0.18 1.83 0.34 1.61 -0.21 -0.30 -5.08 119.66 117.66 1oac s GLN 53 Ca 0.00 -1.11 -0.26 0.00 0.02 0.00 0.00 55.36 54.01 1oac s GLN 53 Cb 0.00 -2.05 -0.10 0.00 1.00 0.00 0.00 33.01 31.86 1oac s GLN 53 CO 0.00 0.51 0.95 -1.25 -2.12 0.00 0.00 175.29 173.38 1oac s PRO 54 N -1.51 4.54 -0.03 2.91 0.04 -1.26 0.45 135.00 140.14 1oac s PRO 54 Ca 0.14 1.31 0.01 0.00 0.04 0.00 0.00 61.00 62.49 1oac s PRO 54 Cb -0.10 -2.73 0.03 0.00 0.04 0.00 0.00 34.50 31.73 1oac s PRO 54 CO 0.04 0.24 -0.01 -1.17 0.04 0.00 0.00 177.00 176.14 1oac s LEU 55 N -2.18 1.20 -0.01 -3.56 2.96 0.48 -4.90 118.68 112.67 1oac s LEU 55 Ca 0.51 -0.06 -0.30 0.00 -0.22 0.00 0.00 54.13 54.07 1oac s LEU 55 Cb -0.18 -0.29 -0.04 0.00 0.50 0.00 0.00 46.19 46.18 1oac s LEU 55 CO 0.23 -0.09 1.17 0.00 -1.32 0.00 0.00 176.35 176.34 1oac s ALA 56 N 1.01 3.42 0.02 5.97 0.00 -1.26 -0.74 121.76 130.18 1oac s ALA 56 Ca -0.10 0.68 -0.16 0.00 0.00 0.00 0.00 51.96 52.38 1oac s ALA 56 Cb -0.14 -3.47 -0.06 0.00 0.00 0.00 0.00 23.12 19.45 1oac s ALA 56 CO -0.01 -0.59 0.45 -0.51 0.00 0.00 0.00 175.76 175.10 1oac s LEU 57 N 1.70 4.49 -0.01 0.00 1.43 -0.29 -4.95 118.68 121.05 1oac s LEU 57 Ca 0.56 1.04 -0.24 0.00 -1.03 0.00 0.00 54.13 54.46 1oac s LEU 57 Cb -0.26 -2.68 -0.18 0.00 0.03 0.00 0.00 46.19 43.11 1oac s LEU 57 CO 0.25 0.31 1.19 1.56 0.23 0.00 0.00 176.35 179.88 1oac h GLN 58 N 4.64 -0.20 -4.79 1.70 4.20 -1.96 -3.44 115.11 115.26 1oac h GLN 58 Ca -0.51 0.01 -0.60 0.00 0.06 0.00 0.00 58.65 57.62 1oac h GLN 58 Cb 1.22 0.05 -0.35 0.00 0.30 0.00 0.00 27.48 28.70 1oac h GLN 58 CO 0.62 0.19 -0.84 0.08 -0.67 0.00 0.00 178.83 178.21 1oac s VAL 59 N -4.31 1.56 0.92 -0.54 1.01 -1.26 -5.15 120.40 112.64 1oac s VAL 59 Ca -0.14 -0.68 -0.11 0.00 0.00 0.00 0.00 61.98 61.05 1oac s VAL 59 Cb 0.02 -1.42 0.15 0.00 0.00 0.00 0.00 36.38 35.12 1oac s VAL 59 CO 0.58 0.45 1.11 -2.84 0.00 0.00 0.00 175.10 174.40 1oac s PRO 60 N 1.00 1.01 0.14 2.72 0.02 -1.26 -4.73 135.00 133.90 1oac s PRO 60 Ca -0.06 1.27 -0.30 0.00 0.02 0.00 0.00 61.00 61.94 1oac s PRO 60 Cb -0.15 -1.75 -0.07 0.00 0.02 0.00 0.00 34.50 32.56 1oac s PRO 60 CO -0.02 -2.55 1.05 0.08 -0.33 0.00 0.00 177.00 175.23 1oac s VAL 61 N -2.71 4.14 -0.05 3.83 1.01 -1.26 -4.71 120.40 120.66 1oac s VAL 61 Ca 0.65 1.80 0.06 0.00 0.00 0.00 0.00 61.98 64.49 1oac s VAL 61 Cb -0.21 -4.15 -0.02 0.00 0.00 0.00 0.00 36.38 32.00 1oac s VAL 61 CO 0.58 0.29 -0.22 0.68 0.00 0.00 0.00 175.10 176.43 1oac s VAL 62 N -0.07 2.34 -0.31 2.92 -7.23 -0.06 -0.35 120.40 117.64 1oac s VAL 62 Ca 0.49 -0.98 -0.14 0.00 -1.81 0.00 0.00 61.98 59.54 1oac s VAL 62 Cb -0.27 -1.86 -0.03 0.00 0.56 0.00 0.00 36.38 34.78 1oac s VAL 62 CO 0.32 0.57 0.31 -0.04 -0.31 0.00 0.00 175.10 175.95 1oac s MET 63 N -0.39 3.78 0.00 4.82 -1.94 -1.26 0.14 119.30 124.45 1oac s MET 63 Ca 0.04 -0.29 0.00 0.00 -1.71 0.00 0.00 55.69 53.72 1oac s MET 63 Cb -0.12 -3.73 0.00 0.00 2.01 0.00 0.00 34.83 32.99 1oac s MET 63 CO 0.02 -0.36 0.00 1.63 -0.01 0.00 0.00 175.02 176.30 1oac n LYS 64 N 5.25 0.00 -1.81 2.03 4.76 0.64 -4.81 118.16 124.22 1oac n LYS 64 Ca -0.11 0.00 -0.34 0.00 -2.87 0.00 0.00 58.31 54.99 1oac n LYS 64 Cb 0.50 0.00 -0.02 0.00 -1.84 0.00 0.00 35.03 33.68 1oac n LYS 64 CO 0.00 0.00 0.00 -3.47 -1.37 0.00 0.00 177.40 172.56 1oac n ASP 65 N 0.00 7.12 -3.51 4.39 2.03 -1.26 -4.47 116.55 120.85 1oac n ASP 65 Ca 0.00 -3.39 -0.19 0.00 0.52 0.00 0.00 54.79 51.74 1oac n ASP 65 Cb 0.00 -1.21 0.07 0.00 -0.72 0.00 0.00 41.12 39.25 1oac n ASP 65 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 1oac n ASN 66 N 0.62 -2.14 -3.63 1.67 4.13 -1.26 -4.99 115.26 109.66 1oac n ASN 66 Ca 0.53 -0.70 -0.21 0.00 1.68 0.00 0.00 54.58 55.88 1oac n ASN 66 Cb 0.39 -4.76 -0.17 0.00 -1.54 0.00 0.00 39.78 33.70 1oac n ASN 66 CO 0.00 0.00 0.00 -0.54 0.28 0.00 0.00 177.26 177.00 1oac s LYS 67 N -5.50 0.02 0.18 3.52 1.02 -1.26 -5.15 119.74 112.56 1oac s LYS 67 Ca 0.04 0.28 -0.10 0.00 0.02 0.00 0.00 55.97 56.21 1oac s LYS 67 Cb -0.01 -0.89 -0.07 0.00 -0.52 0.00 0.00 37.83 36.34 1oac s LYS 67 CO 0.76 -0.45 0.50 0.00 -0.92 0.00 0.00 175.35 175.24 1oac s ALA 68 N 2.21 3.63 -0.03 5.17 0.00 -1.26 0.23 121.76 131.71 1oac s ALA 68 Ca 0.04 -0.31 0.06 0.00 0.00 0.00 0.00 51.96 51.76 1oac s ALA 68 Cb -0.14 -2.38 -0.01 0.00 0.00 0.00 0.00 23.12 20.59 1oac s ALA 68 CO -0.06 0.53 -0.22 -1.58 0.00 0.00 0.00 175.76 174.43 1oac s TRP 69 N -1.66 2.04 0.15 0.00 0.52 0.38 -2.20 118.94 118.17 1oac s TRP 69 Ca 0.42 -0.46 0.08 0.00 0.02 0.00 0.00 56.10 56.17 1oac s TRP 69 Cb -0.12 -1.33 -0.04 0.00 -1.15 0.00 0.00 33.47 30.83 1oac s TRP 69 CO 0.21 -0.09 -0.19 0.14 0.02 0.00 0.00 176.95 177.05 1oac s VAL 70 N -0.38 1.80 1.13 4.03 -7.23 0.20 -0.89 120.40 119.06 1oac s VAL 70 Ca 0.05 -1.85 -0.12 0.00 -1.81 0.00 0.00 61.98 58.24 1oac s VAL 70 Cb -0.10 -1.79 0.27 0.00 0.56 0.00 0.00 36.38 35.31 1oac s VAL 70 CO 0.00 -0.27 1.05 -0.55 -0.31 0.00 0.00 175.10 175.02 1oac s SER 71 N -2.53 1.20 0.35 4.85 0.15 -1.26 0.19 113.70 116.64 1oac s SER 71 Ca 0.14 1.71 0.19 0.00 0.70 0.00 0.00 55.95 58.68 1oac s SER 71 Cb -0.06 -2.40 0.18 0.00 -1.71 0.00 0.00 66.02 62.02 1oac s SER 71 CO 0.06 -4.10 1.50 -2.24 1.20 0.00 0.00 173.24 169.66 1oac h ASP 72 N -2.55 0.00 0.05 5.45 2.03 -1.93 -3.13 116.42 116.34 1oac h ASP 72 Ca -0.58 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 55.72 1oac h ASP 72 Cb 1.32 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.82 1oac h ASP 72 CO 0.47 0.27 -0.06 1.07 -1.03 0.00 0.00 179.24 179.96 1oac n THR 73 N -3.15 0.00 0.16 1.15 5.66 -1.26 -4.66 114.28 112.17 1oac n THR 73 Ca 0.03 -0.22 -0.14 0.00 -3.05 0.00 0.00 64.05 60.67 1oac n THR 73 Cb 0.64 0.47 -0.06 0.00 -1.55 0.00 0.00 70.33 69.83 1oac n THR 73 CO 0.00 0.00 0.00 0.15 -3.05 0.00 0.00 175.07 172.17 1oac h PHE 74 N 2.08 -0.73 -0.23 1.09 3.57 -1.90 -1.47 116.94 119.34 1oac h PHE 74 Ca 0.00 0.01 0.05 0.00 3.53 0.00 0.00 57.97 61.55 1oac h PHE 74 Cb 0.50 0.29 -0.04 0.00 2.79 0.00 0.00 35.95 39.49 1oac h PHE 74 CO 0.00 -0.39 -0.05 0.82 -2.23 0.00 0.00 178.31 176.46 1oac h ILE 75 N -0.55 0.78 -0.45 1.41 2.04 -1.85 0.62 117.51 119.51 1oac h ILE 75 Ca 0.00 -0.00 -0.05 0.00 1.00 0.00 0.00 64.86 65.81 1oac h ILE 75 Cb 0.53 0.77 -0.02 0.00 -0.74 0.00 0.00 36.82 37.35 1oac h ILE 75 CO -0.09 0.00 0.09 -1.13 0.00 0.00 0.00 178.15 177.02 1oac h ASN 76 N 0.01 0.70 -0.69 1.72 -0.73 -1.89 0.58 115.58 115.27 1oac h ASN 76 Ca 0.11 -0.25 -0.06 0.00 1.87 0.00 0.00 56.30 57.97 1oac h ASN 76 Cb 0.17 -0.19 -0.03 0.00 0.27 0.00 0.00 38.32 38.54 1oac h ASN 76 CO -0.23 0.77 0.21 0.44 -0.37 0.00 0.00 177.43 178.25 1oac h ASP 77 N 0.60 1.03 0.00 1.15 3.32 -0.97 -1.50 116.42 120.05 1oac h ASP 77 Ca 0.14 -0.19 0.00 0.00 0.02 0.00 0.00 57.03 57.00 1oac h ASP 77 Cb 0.36 -0.27 0.00 0.00 0.22 0.00 0.00 39.33 39.64 1oac h ASP 77 CO 0.01 0.96 -0.23 0.58 -1.72 0.00 0.00 179.24 178.83 1oac h VAL 78 N 1.05 0.00 -0.02 -1.35 2.07 -0.65 -3.28 116.25 114.07 1oac h VAL 78 Ca 0.23 -0.98 -0.16 0.00 0.82 0.00 0.00 66.70 66.61 1oac h VAL 78 Cb 0.31 0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 30.06 1oac h VAL 78 CO -0.01 0.00 -0.71 -0.26 0.02 0.00 0.00 177.57 176.62 1oac h PHE 79 N -0.98 0.17 -0.75 1.57 0.04 0.01 -3.06 116.94 113.93 1oac h PHE 79 Ca 0.00 -0.08 -0.36 0.00 2.80 0.00 0.00 57.97 60.33 1oac h PHE 79 Cb 0.23 -0.02 -0.22 0.00 2.20 0.00 0.00 35.95 38.14 1oac h PHE 79 CO -0.10 0.79 0.37 1.04 -0.60 0.00 0.00 178.31 179.81 1oac n GLN 80 N -3.75 2.35 0.17 1.51 3.00 -0.57 -4.59 117.38 115.49 1oac n GLN 80 Ca -0.02 -3.07 0.03 0.00 -0.01 0.00 0.00 57.00 53.93 1oac n GLN 80 Cb 0.69 -2.07 0.27 0.00 0.00 0.00 0.00 30.24 29.13 1oac n GLN 80 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.06 177.72 1oac h SER 81 N 1.25 0.00 0.00 1.08 4.64 -1.58 -3.46 113.55 115.48 1oac h SER 81 Ca 0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.77 1oac h SER 81 Cb 2.41 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.50 1oac h SER 81 CO 0.82 0.47 0.00 0.61 -0.87 0.00 0.00 176.83 177.87 1oac n GLY 82 N 0.24 0.66 0.14 -0.77 0.00 -1.26 -4.94 105.19 99.26 1oac n GLY 82 Ca -0.01 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.11 1oac n GLY 82 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1oac h LEU 83 N 0.00 0.00 -8.52 0.99 3.38 -1.91 -3.41 115.31 105.85 1oac h LEU 83 Ca 0.00 0.00 -0.64 0.00 0.09 0.00 0.00 57.88 57.33 1oac h LEU 83 Cb 0.00 0.00 -0.14 0.00 0.09 0.00 0.00 40.66 40.61 1oac h LEU 83 CO 0.00 0.08 0.34 -0.62 0.09 0.00 0.00 178.44 178.33 1oac s ASP 84 N -5.69 6.34 -0.07 -0.43 2.15 -1.26 -4.79 116.67 112.91 1oac s ASP 84 Ca 0.02 -0.39 0.16 0.00 0.43 0.00 0.00 52.55 52.77 1oac s ASP 84 Cb 0.08 -2.38 0.60 0.00 -0.30 0.00 0.00 42.92 40.92 1oac s ASP 84 CO 0.76 -1.01 1.49 0.00 -0.17 0.00 0.00 175.17 176.23 1oac n GLN 85 N 6.83 3.09 0.04 4.34 6.02 -1.26 -4.57 117.38 131.87 1oac n GLN 85 Ca -0.00 -2.38 -0.11 0.00 -0.01 0.00 0.00 57.00 54.51 1oac n GLN 85 Cb 0.47 -1.72 -0.04 0.00 1.02 0.00 0.00 30.24 29.97 1oac n GLN 85 CO 0.00 0.00 0.00 1.15 -1.01 0.00 0.00 177.06 177.20 1oac h THR 86 N 3.53 0.59 -3.21 5.09 2.02 -1.90 -3.42 112.91 115.61 1oac h THR 86 Ca 0.00 0.00 -0.61 0.00 0.77 0.00 0.00 66.41 66.57 1oac h THR 86 Cb 1.15 0.59 -0.13 0.00 -1.74 0.00 0.00 68.15 68.02 1oac h THR 86 CO 0.15 0.00 -0.51 -0.36 0.37 0.00 0.00 175.52 175.17 1oac s PHE 87 N -6.13 3.38 0.25 3.16 0.08 -1.26 -0.56 117.98 116.91 1oac s PHE 87 Ca -0.15 0.28 0.10 0.00 0.12 0.00 0.00 56.93 57.29 1oac s PHE 87 Cb 0.09 -2.11 -0.05 0.00 -0.57 0.00 0.00 43.02 40.38 1oac s PHE 87 CO 0.67 0.30 -0.18 -0.65 -0.10 0.00 0.00 175.22 175.26 1oac s GLN 88 N 0.21 1.53 0.11 0.44 -1.52 -0.15 -4.94 119.66 115.34 1oac s GLN 88 Ca 0.07 -1.69 -0.14 0.00 -1.95 0.00 0.00 55.36 51.66 1oac s GLN 88 Cb -0.11 -1.51 -0.07 0.00 -0.22 0.00 0.00 33.01 31.10 1oac s GLN 88 CO -0.01 0.27 0.50 0.14 -0.25 0.00 0.00 175.29 175.95 1oac s VAL 89 N -2.67 4.92 -0.45 1.09 -7.23 -1.26 -3.30 120.40 111.49 1oac s VAL 89 Ca 0.27 0.78 -0.20 0.00 -1.81 0.00 0.00 61.98 61.02 1oac s VAL 89 Cb -0.03 -3.73 0.03 0.00 0.56 0.00 0.00 36.38 33.21 1oac s VAL 89 CO 0.12 0.32 0.61 -0.70 -0.31 0.00 0.00 175.10 175.13 1oac s GLU 90 N -1.77 3.22 0.02 4.82 2.12 -1.26 -4.83 118.70 121.01 1oac s GLU 90 Ca 0.34 -0.52 0.05 0.00 0.36 0.00 0.00 54.97 55.21 1oac s GLU 90 Cb -0.15 -3.98 -0.24 0.00 0.26 0.00 0.00 34.13 30.02 1oac s GLU 90 CO 0.18 -1.03 0.91 0.87 -0.54 0.00 0.00 175.26 175.65 1oac h LYS 91 N 8.88 0.09 -4.70 4.30 1.57 -1.97 -3.42 116.57 121.31 1oac h LYS 91 Ca -0.26 -0.15 -0.66 0.00 -1.87 0.00 0.00 60.65 57.72 1oac h LYS 91 Cb 1.10 0.05 -0.38 0.00 0.08 0.00 0.00 32.23 33.08 1oac h LYS 91 CO 0.89 0.86 -0.76 1.03 -0.57 0.00 0.00 179.45 180.90 1oac s ARG 92 N -2.64 1.80 0.28 3.15 0.52 -1.26 -5.10 118.95 115.70 1oac s ARG 92 Ca -0.05 -1.53 -0.29 0.00 -0.52 0.00 0.00 55.73 53.34 1oac s ARG 92 Cb 0.08 -2.96 -0.10 0.00 0.52 0.00 0.00 34.95 32.49 1oac s ARG 92 CO 0.83 -0.75 1.39 -1.25 0.02 0.00 0.00 175.30 175.55 1oac s PRO 93 N 1.06 4.29 0.26 3.54 0.04 -1.26 -4.96 135.00 137.97 1oac s PRO 93 Ca 0.00 2.27 -0.30 0.00 0.04 0.00 0.00 61.00 63.02 1oac s PRO 93 Cb -0.19 -3.09 -0.10 0.00 0.04 0.00 0.00 34.50 31.15 1oac s PRO 93 CO -0.07 -0.34 1.35 -1.58 0.04 0.00 0.00 177.00 176.39 1oac s HIS 94 N -0.41 3.12 -0.43 0.56 2.46 -1.26 -4.90 115.29 114.42 1oac s HIS 94 Ca 0.56 1.24 0.16 0.00 0.47 0.00 0.00 55.06 57.49 1oac s HIS 94 Cb -0.41 -3.69 0.87 0.00 -0.13 0.00 0.00 32.58 29.21 1oac s HIS 94 CO 0.47 -2.09 1.50 -0.35 -2.47 0.00 0.00 174.74 171.80 1oac n PRO 95 N 1.87 0.11 -0.35 2.88 -0.04 -1.26 -1.36 135.00 136.84 1oac n PRO 95 Ca 0.04 0.58 0.12 0.00 -0.04 0.00 0.00 63.50 64.19 1oac n PRO 95 Cb 0.42 -1.83 0.31 0.00 -0.04 0.00 0.00 33.50 32.35 1oac n PRO 95 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1oac n LEU 96 N -2.06 3.89 -4.66 1.53 4.77 -1.26 -4.79 117.00 114.42 1oac n LEU 96 Ca -0.01 -1.97 -0.46 0.00 -0.03 0.00 0.00 56.01 53.55 1oac n LEU 96 Cb 0.05 -0.47 -0.03 0.00 -2.33 0.00 0.00 43.42 40.64 1oac n LEU 96 CO 0.08 0.96 1.05 0.59 -1.33 0.00 0.00 177.39 178.75 1oac n ASN 97 N 1.60 2.73 -4.71 -1.43 5.03 -0.46 -4.92 115.26 113.10 1oac n ASN 97 Ca 0.24 1.12 -0.31 0.00 0.87 0.00 0.00 54.58 56.50 1oac n ASN 97 Cb 0.61 -1.41 0.14 0.00 -1.02 0.00 0.00 39.78 38.11 1oac n ASN 97 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1oac s ALA 98 N 0.25 1.78 0.33 5.41 0.00 -1.26 -4.91 121.76 123.36 1oac s ALA 98 Ca 0.72 0.53 -0.29 0.00 0.00 0.00 0.00 51.96 52.92 1oac s ALA 98 Cb -0.68 -3.40 -0.12 0.00 0.00 0.00 0.00 23.12 18.92 1oac s ALA 98 CO 0.46 -2.37 1.50 1.28 0.00 0.00 0.00 175.76 176.63 1oac n LEU 99 N -3.86 4.32 -4.92 0.00 4.77 -1.26 -5.00 117.00 111.06 1oac n LEU 99 Ca 0.11 1.19 -0.28 0.00 -0.03 0.00 0.00 56.01 57.00 1oac n LEU 99 Cb 0.52 -1.58 0.11 0.00 -2.33 0.00 0.00 43.42 40.15 1oac n LEU 99 CO 0.50 0.02 0.76 0.42 -1.33 0.00 0.00 177.39 177.76 1oac s THR 100 N -0.60 2.07 0.21 -5.08 -4.23 -1.26 -4.84 115.64 101.92 1oac s THR 100 Ca 0.59 -0.09 -0.09 0.00 -1.18 0.00 0.00 61.69 60.92 1oac s THR 100 Cb -0.51 -2.98 0.15 0.00 1.34 0.00 0.00 72.50 70.51 1oac s THR 100 CO 0.57 0.00 1.82 0.00 -0.54 0.00 0.00 174.62 176.46 1oac h ALA 101 N -1.08 0.93 -0.32 3.99 0.00 -1.94 0.86 119.26 121.71 1oac h ALA 101 Ca -0.45 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.47 1oac h ALA 101 Cb 1.30 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.92 1oac h ALA 101 CO 0.56 0.09 0.20 -0.44 0.00 0.00 0.00 179.25 179.66 1oac h ASP 102 N 0.74 0.37 -0.01 0.00 3.32 -1.99 -1.34 116.42 117.50 1oac h ASP 102 Ca 0.31 -0.03 -0.08 0.00 0.02 0.00 0.00 57.03 57.25 1oac h ASP 102 Cb 0.17 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 39.61 1oac h ASP 102 CO -0.17 0.30 -0.20 -0.33 -1.72 0.00 0.00 179.24 177.11 1oac h GLU 103 N 0.42 0.37 -0.31 3.56 5.08 -1.73 -1.08 114.58 120.89 1oac h GLU 103 Ca 0.11 -0.12 -0.02 0.00 -1.00 0.00 0.00 59.36 58.33 1oac h GLU 103 Cb -0.01 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.19 1oac h GLU 103 CO -0.02 0.56 0.11 0.82 -1.00 0.00 0.00 179.01 179.48 1oac h ILE 104 N 0.34 1.19 -0.60 3.13 2.04 -0.28 -1.68 117.51 121.66 1oac h ILE 104 Ca 0.06 -0.62 -0.03 0.00 1.00 0.00 0.00 64.86 65.27 1oac h ILE 104 Cb 0.55 1.01 -0.03 0.00 -0.74 0.00 0.00 36.82 37.62 1oac h ILE 104 CO 0.04 0.21 0.24 0.11 0.00 0.00 0.00 178.15 178.75 1oac h LYS 105 N 0.35 0.89 -0.64 2.37 1.57 -1.01 -2.04 116.57 118.06 1oac h LYS 105 Ca 0.10 -0.16 -0.01 0.00 -1.87 0.00 0.00 60.65 58.72 1oac h LYS 105 Cb 0.22 -0.15 -0.03 0.00 0.08 0.00 0.00 32.23 32.35 1oac h LYS 105 CO -0.01 0.76 0.37 0.37 -0.57 0.00 0.00 179.45 180.37 1oac h GLN 106 N 0.83 0.88 -0.09 3.15 4.15 -1.13 -1.26 115.11 121.64 1oac h GLN 106 Ca 0.20 -0.09 -0.00 0.00 0.77 0.00 0.00 58.65 59.53 1oac h GLN 106 Cb 0.20 -0.18 -0.00 0.00 0.21 0.00 0.00 27.48 27.70 1oac h GLN 106 CO -0.02 0.65 0.05 0.00 -1.93 0.00 0.00 178.83 177.59 1oac h ALA 107 N 1.18 0.12 -0.81 3.38 0.00 -1.10 -0.66 119.26 121.38 1oac h ALA 107 Ca 0.23 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 55.09 1oac h ALA 107 Cb 0.01 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 17.72 1oac h ALA 107 CO -0.04 -0.35 0.49 0.28 0.00 0.00 0.00 179.25 179.63 1oac h VAL 108 N 0.07 1.22 0.03 0.00 2.07 -1.20 -2.52 116.25 115.92 1oac h VAL 108 Ca 0.03 -0.48 -0.00 0.00 0.82 0.00 0.00 66.70 67.07 1oac h VAL 108 Cb 0.06 0.08 0.00 0.00 -1.52 0.00 0.00 31.29 29.91 1oac h VAL 108 CO -0.01 0.23 -0.01 -0.33 0.02 0.00 0.00 177.57 177.47 1oac h GLU 109 N 1.11 -0.04 -0.77 1.57 5.08 -0.88 -0.84 114.58 119.81 1oac h GLU 109 Ca 0.29 0.00 0.04 0.00 -1.00 0.00 0.00 59.36 58.69 1oac h GLU 109 Cb -0.05 0.01 -0.05 0.00 0.50 0.00 0.00 28.75 29.16 1oac h GLU 109 CO -0.06 0.11 0.48 0.82 -1.00 0.00 0.00 179.01 179.36 1oac h ILE 110 N -0.17 1.08 0.00 3.13 2.04 -0.80 -2.37 117.51 120.42 1oac h ILE 110 Ca -0.00 -0.32 -0.17 0.00 1.00 0.00 0.00 64.86 65.36 1oac h ILE 110 Cb 0.16 0.08 -0.02 0.00 -0.74 0.00 0.00 36.82 36.29 1oac h ILE 110 CO 0.01 0.17 -0.83 -0.37 0.00 0.00 0.00 178.15 177.13 1oac h VAL 111 N 0.93 1.58 0.00 1.67 -1.51 -1.34 -3.13 116.25 114.44 1oac h VAL 111 Ca 0.32 -2.86 -0.02 0.00 -1.23 0.00 0.00 66.70 62.91 1oac h VAL 111 Cb 0.06 2.55 -0.00 0.00 -2.13 0.00 0.00 31.29 31.77 1oac h VAL 111 CO -0.13 0.81 -0.10 0.11 -1.23 0.00 0.00 177.57 177.03 1oac h LYS 112 N 0.00 0.00 0.00 5.19 1.57 -0.78 -2.75 116.57 119.80 1oac h LYS 112 Ca -0.01 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 1oac h LYS 112 Cb 1.48 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.79 1oac h LYS 112 CO 0.11 0.10 0.00 0.00 -0.57 0.00 0.00 179.45 179.09 1oac n ALA 113 N -2.17 2.06 -1.78 3.86 0.00 -0.93 -4.84 120.51 116.71 1oac n ALA 113 Ca -0.00 -0.05 -0.37 0.00 0.00 0.00 0.00 53.44 53.03 1oac n ALA 113 Cb 0.31 -1.40 -0.06 0.00 0.00 0.00 0.00 19.45 18.30 1oac n ALA 113 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1oac s SER 114 N -3.49 7.21 0.44 0.00 0.15 -1.04 -4.95 113.70 112.02 1oac s SER 114 Ca 0.10 1.86 0.22 0.00 0.70 0.00 0.00 55.95 58.83 1oac s SER 114 Cb 0.14 -2.58 0.98 0.00 -1.71 0.00 0.00 66.02 62.85 1oac s SER 114 CO 0.46 -0.16 1.87 0.00 1.20 0.00 0.00 173.24 176.60 1oac h ALA 115 N 2.95 1.11 0.00 5.45 0.00 -1.89 -2.80 119.26 124.09 1oac h ALA 115 Ca -0.47 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.21 1oac h ALA 115 Cb 1.19 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.94 1oac h ALA 115 CO 0.64 0.32 0.00 -0.44 0.00 0.00 0.00 179.25 179.77 1oac h ASP 116 N 0.00 0.00 -2.34 0.00 3.32 -1.92 -3.44 116.42 112.04 1oac h ASP 116 Ca -0.00 0.00 -0.58 0.00 0.02 0.00 0.00 57.03 56.46 1oac h ASP 116 Cb 0.67 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.21 1oac h ASP 116 CO 0.03 0.00 1.38 0.12 -1.72 0.00 0.00 179.24 179.05 1oac s PHE 117 N -3.35 1.50 0.34 4.55 2.19 -1.06 -4.97 117.98 117.18 1oac s PHE 117 Ca 0.05 0.59 -0.22 0.00 0.33 0.00 0.00 56.93 57.68 1oac s PHE 117 Cb 0.09 -4.03 -0.10 0.00 -1.31 0.00 0.00 43.02 37.67 1oac s PHE 117 CO 0.56 -3.49 0.89 0.15 1.83 0.00 0.00 175.22 175.16 1oac s LYS 118 N 6.00 4.35 0.47 10.12 -0.14 -1.26 -4.97 119.74 134.31 1oac s LYS 118 Ca 0.90 1.12 0.18 0.00 -1.36 0.00 0.00 55.97 56.80 1oac s LYS 118 Cb -0.27 -2.56 1.16 0.00 -1.68 0.00 0.00 37.83 34.47 1oac s LYS 118 CO 0.34 0.18 1.98 -1.00 -0.76 0.00 0.00 175.35 176.10 1oac h PRO 119 N 2.69 0.25 -0.49 -1.68 0.13 -1.99 -2.84 132.00 128.07 1oac h PRO 119 Ca -0.48 -0.02 -0.03 0.00 -0.87 0.00 0.00 66.00 64.60 1oac h PRO 119 Cb 1.19 -0.06 -0.02 0.00 0.13 0.00 0.00 31.00 32.24 1oac h PRO 119 CO 0.64 0.17 0.03 0.09 -0.23 0.00 0.00 178.00 178.70 1oac n ASN 120 N -4.45 4.92 -4.70 1.44 5.03 -1.26 -4.99 115.26 111.25 1oac n ASN 120 Ca 0.10 -3.03 -0.43 0.00 0.87 0.00 0.00 54.58 52.09 1oac n ASN 120 Cb 0.46 -0.65 -0.02 0.00 -1.02 0.00 0.00 39.78 38.55 1oac n ASN 120 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.26 175.84 1oac n THR 121 N 0.08 0.81 -4.35 3.41 -1.04 -1.08 -4.84 114.28 107.28 1oac n THR 121 Ca 0.28 -0.20 -0.24 0.00 -2.04 0.00 0.00 64.05 61.85 1oac n THR 121 Cb 1.12 -1.71 -0.08 0.00 -1.82 0.00 0.00 70.33 67.83 1oac n THR 121 CO 0.00 0.00 0.00 -0.13 -0.64 0.00 0.00 175.07 174.30 1oac s ARG 122 N -0.20 2.08 -0.25 -2.82 0.52 -0.75 -4.98 118.95 112.55 1oac s ARG 122 Ca 0.68 -1.51 -0.07 0.00 -0.52 0.00 0.00 55.73 54.31 1oac s ARG 122 Cb -0.58 -2.04 -0.03 0.00 0.52 0.00 0.00 34.95 32.82 1oac s ARG 122 CO 0.47 0.36 0.06 -0.06 0.02 0.00 0.00 175.30 176.15 1oac s PHE 123 N -2.31 3.07 0.04 -0.53 0.40 0.18 -0.99 117.98 117.84 1oac s PHE 123 Ca 0.30 -0.49 0.01 0.00 -0.60 0.00 0.00 56.93 56.15 1oac s PHE 123 Cb -0.06 -2.23 -0.26 0.00 0.51 0.00 0.00 43.02 40.99 1oac s PHE 123 CO 0.18 -0.39 1.00 1.79 0.70 0.00 0.00 175.22 178.51 1oac h THR 124 N 5.57 1.34 -1.99 0.64 1.35 -0.67 -3.38 112.91 115.77 1oac h THR 124 Ca -0.39 -3.00 -0.03 0.00 -0.55 0.00 0.00 66.41 62.44 1oac h THR 124 Cb 1.17 2.78 -0.21 0.00 -1.73 0.00 0.00 68.15 70.16 1oac h THR 124 CO 0.58 0.84 0.13 -0.70 -0.25 0.00 0.00 175.52 176.12 1oac s GLU 125 N -2.65 0.81 -0.22 4.72 2.12 -1.10 -4.96 118.70 117.43 1oac s GLU 125 Ca -0.05 1.01 -0.01 0.00 0.36 0.00 0.00 54.97 56.29 1oac s GLU 125 Cb 0.08 0.37 0.06 0.00 0.26 0.00 0.00 34.13 34.90 1oac s GLU 125 CO 0.85 -0.10 -0.02 0.42 -0.54 0.00 0.00 175.26 175.86 1oac s ILE 126 N 0.52 1.15 0.04 -3.70 1.01 -1.26 -0.68 121.20 118.28 1oac s ILE 126 Ca -0.01 -0.98 -0.06 0.00 0.00 0.00 0.00 60.65 59.61 1oac s ILE 126 Cb -0.05 -1.51 -0.01 0.00 0.01 0.00 0.00 42.46 40.90 1oac s ILE 126 CO -0.02 -0.15 0.10 -0.44 0.00 0.00 0.00 174.94 174.44 1oac s SER 127 N 1.57 0.18 0.43 3.58 0.01 -0.39 -4.68 113.70 114.39 1oac s SER 127 Ca -0.04 -0.54 -0.26 0.00 1.31 0.00 0.00 55.95 56.42 1oac s SER 127 Cb -0.18 0.23 -0.09 0.00 0.21 0.00 0.00 66.02 66.19 1oac s SER 127 CO -0.07 -0.52 1.43 -0.11 0.41 0.00 0.00 173.24 174.38 1oac n LEU 128 N 0.73 4.91 -4.22 2.44 7.94 -1.26 -0.11 117.00 127.42 1oac n LEU 128 Ca -0.19 1.15 -0.42 0.00 -1.11 0.00 0.00 56.01 55.44 1oac n LEU 128 Cb 0.59 -1.60 -0.07 0.00 0.53 0.00 0.00 43.42 42.87 1oac n LEU 128 CO 0.23 -0.13 0.05 -0.22 -1.11 0.00 0.00 177.39 176.21 1oac s LEU 129 N -2.40 5.83 0.65 -1.96 2.96 -0.30 -4.66 118.68 118.79 1oac s LEU 129 Ca 0.59 -2.06 -0.14 0.00 -0.22 0.00 0.00 54.13 52.30 1oac s LEU 129 Cb -0.46 -2.04 -0.01 0.00 0.50 0.00 0.00 46.19 44.18 1oac s LEU 129 CO 0.59 -0.68 1.08 -2.16 -1.32 0.00 0.00 176.35 173.87 1oac s PRO 130 N 1.15 2.98 1.24 0.98 0.04 -1.26 -4.16 135.00 135.96 1oac s PRO 130 Ca 0.08 1.25 -0.20 0.00 0.04 0.00 0.00 61.00 62.17 1oac s PRO 130 Cb -0.25 -1.98 0.30 0.00 0.04 0.00 0.00 34.50 32.61 1oac s PRO 130 CO -0.01 -1.09 1.08 -1.25 0.04 0.00 0.00 177.00 175.77 1oac s PRO 131 N -4.25 -1.51 0.47 0.56 0.05 -1.26 -4.97 135.00 124.09 1oac s PRO 131 Ca 0.64 -0.03 -0.22 0.00 0.05 0.00 0.00 61.00 61.44 1oac s PRO 131 Cb -0.18 -1.56 -0.08 0.00 0.05 0.00 0.00 34.50 32.73 1oac s PRO 131 CO 0.42 -3.90 1.08 -0.51 0.05 0.00 0.00 177.00 174.13 1oac s ASP 132 N -3.77 6.31 0.28 6.66 1.11 -1.26 -4.86 116.67 121.14 1oac s ASP 132 Ca 0.71 2.06 0.01 0.00 0.18 0.00 0.00 52.55 55.51 1oac s ASP 132 Cb -0.10 -2.58 0.63 0.00 1.07 0.00 0.00 42.92 41.94 1oac s ASP 132 CO 0.56 -0.81 1.72 0.50 1.18 0.00 0.00 175.17 178.33 1oac h LYS 133 N 1.82 0.47 -0.35 8.23 3.64 -1.99 0.78 116.57 129.17 1oac h LYS 133 Ca -0.49 -0.03 0.03 0.00 -1.27 0.00 0.00 60.65 58.89 1oac h LYS 133 Cb 1.23 -0.11 -0.03 0.00 -0.41 0.00 0.00 32.23 32.92 1oac h LYS 133 CO 0.60 0.31 0.17 1.49 -2.27 0.00 0.00 179.45 179.75 1oac h GLU 134 N 0.48 0.34 -0.57 1.90 4.81 -1.99 0.37 114.58 119.92 1oac h GLU 134 Ca 0.51 -0.02 -0.06 0.00 -0.13 0.00 0.00 59.36 59.66 1oac h GLU 134 Cb 0.86 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 30.14 1oac h GLU 134 CO -0.46 0.23 0.12 0.00 -0.73 0.00 0.00 179.01 178.17 1oac h ALA 135 N 1.19 0.76 -0.32 2.92 0.00 -1.27 -2.04 119.26 120.49 1oac h ALA 135 Ca 0.15 -0.23 -0.09 0.00 0.00 0.00 0.00 54.91 54.74 1oac h ALA 135 Cb 0.07 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 1oac h ALA 135 CO -0.11 0.48 -0.13 0.28 0.00 0.00 0.00 179.25 179.77 1oac h VAL 136 N 0.83 1.29 -0.53 0.00 2.07 -0.43 -2.34 116.25 117.14 1oac h VAL 136 Ca 0.18 -1.22 -0.07 0.00 0.82 0.00 0.00 66.70 66.40 1oac h VAL 136 Cb 0.37 1.40 -0.02 0.00 -1.52 0.00 0.00 31.29 31.52 1oac h VAL 136 CO 0.01 0.40 0.03 -0.50 0.02 0.00 0.00 177.57 177.52 1oac h TRP 137 N 0.43 0.93 -0.18 1.57 -0.00 -0.25 -2.58 115.95 115.88 1oac h TRP 137 Ca 0.08 -0.13 -0.01 0.00 -0.00 0.00 0.00 58.89 58.82 1oac h TRP 137 Cb 0.65 -0.26 -0.01 0.00 -0.00 0.00 0.00 29.16 29.54 1oac h TRP 137 CO 0.06 0.83 0.05 0.00 -0.00 0.00 0.00 178.44 179.38 1oac h ALA 138 N 1.21 1.77 0.55 1.49 0.00 -1.25 0.12 119.26 123.14 1oac h ALA 138 Ca 0.16 -0.07 -0.03 0.00 0.00 0.00 0.00 54.91 54.98 1oac h ALA 138 Cb 0.45 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 18.16 1oac h ALA 138 CO 0.02 0.19 -0.26 0.35 0.00 0.00 0.00 179.25 179.54 1oac h PHE 139 N 0.25 -0.68 -0.93 0.00 3.04 -1.10 0.34 116.94 117.86 1oac h PHE 139 Ca 0.06 -0.02 -0.01 0.00 3.98 0.00 0.00 57.97 61.99 1oac h PHE 139 Cb 0.08 0.23 -0.04 0.00 2.56 0.00 0.00 35.95 38.77 1oac h PHE 139 CO 0.00 -0.37 0.55 0.00 -2.02 0.00 0.00 178.31 176.47 1oac h ALA 140 N -0.96 1.22 0.00 2.41 0.00 -1.25 0.22 119.26 120.90 1oac h ALA 140 Ca -0.08 -0.11 -0.30 0.00 0.00 0.00 0.00 54.91 54.43 1oac h ALA 140 Cb 0.62 -0.37 -0.05 0.00 0.00 0.00 0.00 17.79 17.98 1oac h ALA 140 CO 0.12 0.66 -1.87 1.28 0.00 0.00 0.00 179.25 179.44 1oac n LEU 141 N -4.35 0.62 -0.07 0.00 4.77 0.39 -4.58 117.00 113.78 1oac n LEU 141 Ca 0.10 0.30 0.02 0.00 -0.03 0.00 0.00 56.01 56.40 1oac n LEU 141 Cb 0.07 0.25 0.02 0.00 -2.33 0.00 0.00 43.42 41.43 1oac n LEU 141 CO 0.38 0.39 0.41 -0.62 -1.33 0.00 0.00 177.39 176.62 1oac n GLU 142 N -2.94 1.45 -2.93 3.23 1.02 0.12 -5.00 120.64 115.59 1oac n GLU 142 Ca -0.20 -1.32 -0.19 0.00 -0.02 0.00 0.00 57.16 55.42 1oac n GLU 142 Cb 1.06 -0.87 0.00 0.00 -0.02 0.00 0.00 31.44 31.61 1oac n GLU 142 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1oac n ASN 143 N -0.45 -4.22 -4.65 1.62 3.02 0.75 -4.91 115.26 106.42 1oac n ASN 143 Ca 0.03 -0.13 -0.41 0.00 -0.03 0.00 0.00 54.58 54.03 1oac n ASN 143 Cb 0.45 -3.51 -0.04 0.00 -0.61 0.00 0.00 39.78 36.07 1oac n ASN 143 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 1oac s LYS 144 N -5.56 4.23 0.35 3.52 2.20 -1.07 -4.95 119.74 118.47 1oac s LYS 144 Ca 0.22 0.93 -0.28 0.00 -0.36 0.00 0.00 55.97 56.48 1oac s LYS 144 Cb -0.11 -3.61 -0.09 0.00 -1.51 0.00 0.00 37.83 32.50 1oac s LYS 144 CO 0.27 -0.41 1.22 -1.25 -0.36 0.00 0.00 175.35 174.82 1oac s PRO 145 N 2.47 4.29 -0.40 4.03 0.04 -1.26 -3.47 135.00 140.70 1oac s PRO 145 Ca 0.35 2.02 -0.21 0.00 0.04 0.00 0.00 61.00 63.21 1oac s PRO 145 Cb -0.16 -2.95 0.01 0.00 0.04 0.00 0.00 34.50 31.44 1oac s PRO 145 CO 0.10 -0.17 0.64 0.08 0.04 0.00 0.00 177.00 177.69 1oac s VAL 146 N -1.23 4.85 -0.92 -0.36 1.01 -1.26 -4.98 120.40 117.51 1oac s VAL 146 Ca 0.51 0.34 -0.01 0.00 0.00 0.00 0.00 61.98 62.82 1oac s VAL 146 Cb -0.35 -4.15 0.27 0.00 0.00 0.00 0.00 36.38 32.15 1oac s VAL 146 CO 0.46 -0.47 1.08 -0.90 0.00 0.00 0.00 175.10 175.27 1oac n ASP 147 N 6.18 5.07 -3.88 3.32 5.68 -1.26 -4.93 116.55 126.73 1oac n ASP 147 Ca -0.01 -3.33 -0.15 0.00 -0.50 0.00 0.00 54.79 50.80 1oac n ASP 147 Cb 0.48 -1.06 -0.15 0.00 -1.14 0.00 0.00 41.12 39.26 1oac n ASP 147 CO 0.00 0.00 0.00 -1.10 -1.33 0.00 0.00 177.20 174.77 1oac s GLN 148 N -2.26 0.27 0.71 0.11 -0.21 -1.26 -5.15 119.66 111.87 1oac s GLN 148 Ca 0.33 -0.04 -0.14 0.00 0.02 0.00 0.00 55.36 55.53 1oac s GLN 148 Cb 0.04 -0.33 0.03 0.00 1.00 0.00 0.00 33.01 33.75 1oac s GLN 148 CO 0.00 -0.01 1.15 -1.25 -2.12 0.00 0.00 175.29 173.06 1oac s PRO 149 N 0.35 2.37 0.07 2.91 0.04 -1.26 -4.96 135.00 134.52 1oac s PRO 149 Ca -0.03 1.55 -0.30 0.00 0.04 0.00 0.00 61.00 62.26 1oac s PRO 149 Cb -0.06 -1.88 -0.06 0.00 0.04 0.00 0.00 34.50 32.54 1oac s PRO 149 CO -0.01 -1.61 1.18 1.03 0.04 0.00 0.00 177.00 177.63 1oac s ARG 150 N -4.08 4.45 0.17 4.56 1.81 -1.26 -4.95 118.95 119.64 1oac s ARG 150 Ca 0.70 1.75 0.10 0.00 -1.72 0.00 0.00 55.73 56.56 1oac s ARG 150 Cb -0.24 -3.35 -0.04 0.00 -0.45 0.00 0.00 34.95 30.87 1oac s ARG 150 CO 0.45 -0.22 -0.22 0.15 -0.68 0.00 0.00 175.30 174.78 1oac s LYS 151 N 0.94 1.36 0.08 3.54 1.02 -1.26 -1.34 119.74 124.08 1oac s LYS 151 Ca 0.58 -1.42 0.07 0.00 0.02 0.00 0.00 55.97 55.22 1oac s LYS 151 Cb -0.29 -1.59 -0.03 0.00 -0.52 0.00 0.00 37.83 35.40 1oac s LYS 151 CO 0.30 0.34 -0.19 0.00 -0.92 0.00 0.00 175.35 174.88 1oac s ALA 152 N -1.71 1.62 -0.24 5.17 0.00 -0.80 -1.16 121.76 124.65 1oac s ALA 152 Ca 0.16 -1.13 -0.12 0.00 0.00 0.00 0.00 51.96 50.88 1oac s ALA 152 Cb -0.07 -0.23 -0.05 0.00 0.00 0.00 0.00 23.12 22.77 1oac s ALA 152 CO 0.08 0.32 0.24 -0.51 0.00 0.00 0.00 175.76 175.88 1oac s ASP 153 N -1.67 6.19 -0.23 0.00 1.01 0.85 -1.71 116.67 121.11 1oac s ASP 153 Ca 0.05 0.20 0.02 0.00 0.71 0.00 0.00 52.55 53.53 1oac s ASP 153 Cb -0.10 -2.15 0.05 0.00 1.01 0.00 0.00 42.92 41.73 1oac s ASP 153 CO 0.03 -0.01 -0.14 -0.69 0.21 0.00 0.00 175.17 174.58 1oac s VAL 154 N 1.30 2.07 -0.19 -1.27 1.01 -0.22 -1.26 120.40 121.84 1oac s VAL 154 Ca 0.11 -1.34 -0.02 0.00 0.00 0.00 0.00 61.98 60.72 1oac s VAL 154 Cb -0.14 -2.08 -0.01 0.00 0.00 0.00 0.00 36.38 34.15 1oac s VAL 154 CO 0.07 0.17 -0.09 -0.63 0.00 0.00 0.00 175.10 174.61 1oac s ILE 155 N 1.20 3.06 0.15 2.22 1.01 0.14 -0.37 121.20 128.60 1oac s ILE 155 Ca -0.04 -0.62 0.10 0.00 0.00 0.00 0.00 60.65 60.09 1oac s ILE 155 Cb -0.17 -2.35 -0.04 0.00 0.01 0.00 0.00 42.46 39.91 1oac s ILE 155 CO -0.08 0.47 -0.22 0.00 0.00 0.00 0.00 174.94 175.11 1oac s MET 156 N 1.13 1.34 -0.31 2.79 0.23 0.07 0.08 119.30 124.63 1oac s MET 156 Ca 0.01 -1.37 -0.04 0.00 -1.03 0.00 0.00 55.69 53.26 1oac s MET 156 Cb -0.14 -1.61 0.04 0.00 -1.53 0.00 0.00 34.83 31.59 1oac s MET 156 CO -0.02 0.35 0.03 -1.17 -2.03 0.00 0.00 175.02 172.18 1oac s LEU 157 N -2.37 3.94 -0.53 0.18 2.96 -0.16 -0.66 118.68 122.03 1oac s LEU 157 Ca 0.15 -1.12 -0.05 0.00 -0.22 0.00 0.00 54.13 52.88 1oac s LEU 157 Cb -0.08 -1.77 0.14 0.00 0.50 0.00 0.00 46.19 44.97 1oac s LEU 157 CO 0.07 -0.26 0.36 -0.62 -1.32 0.00 0.00 176.35 174.58 1oac s ASP 158 N 1.33 5.48 0.19 3.68 2.15 0.31 -1.82 116.67 127.99 1oac s ASP 158 Ca -0.03 -2.33 0.00 0.00 0.43 0.00 0.00 52.55 50.62 1oac s ASP 158 Cb -0.19 -1.91 0.00 0.00 -0.30 0.00 0.00 42.92 40.52 1oac s ASP 158 CO 0.00 -0.53 0.00 0.61 -0.17 0.00 0.00 175.17 175.09 1oac n GLY 159 N 4.25 1.71 0.04 2.66 0.00 -1.26 -0.40 105.19 112.18 1oac n GLY 159 Ca 0.01 0.08 0.00 0.00 0.00 0.00 0.00 46.02 46.12 1oac n GLY 159 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1oac n LYS 160 N 0.00 1.00 -3.57 1.61 2.85 -1.26 -4.93 118.16 113.86 1oac n LYS 160 Ca 0.00 -0.93 -0.37 0.00 -1.05 0.00 0.00 58.31 55.96 1oac n LYS 160 Cb 0.00 -0.70 -0.06 0.00 -0.65 0.00 0.00 35.03 33.62 1oac n LYS 160 CO 0.00 0.00 0.00 -1.01 -0.05 0.00 0.00 177.40 176.34 1oac s HIS 161 N -0.42 3.59 -0.10 5.58 0.09 0.46 -4.55 115.29 119.94 1oac s HIS 161 Ca 0.01 0.76 -0.12 0.00 -0.00 0.00 0.00 55.06 55.71 1oac s HIS 161 Cb 0.01 -2.26 -0.05 0.00 -0.00 0.00 0.00 32.58 30.28 1oac s HIS 161 CO 0.00 0.48 0.27 0.42 -0.00 0.00 0.00 174.74 175.91 1oac s ILE 162 N -0.39 5.29 -0.03 0.60 -1.09 -1.26 0.11 121.20 124.44 1oac s ILE 162 Ca 0.20 0.52 0.03 0.00 -2.23 0.00 0.00 60.65 59.16 1oac s ILE 162 Cb -0.14 -3.58 0.00 0.00 -1.58 0.00 0.00 42.46 37.16 1oac s ILE 162 CO 0.08 0.51 -0.11 -0.63 -1.23 0.00 0.00 174.94 173.56 1oac s ILE 163 N -0.41 0.92 -0.16 2.92 1.09 0.16 -0.99 121.20 124.73 1oac s ILE 163 Ca 0.18 -0.44 -0.02 0.00 -1.10 0.00 0.00 60.65 59.27 1oac s ILE 163 Cb -0.14 -0.82 -0.01 0.00 -1.06 0.00 0.00 42.46 40.43 1oac s ILE 163 CO 0.06 0.28 -0.09 -1.61 -0.10 0.00 0.00 174.94 173.48 1oac s GLU 164 N 0.17 3.42 0.15 2.79 2.02 0.11 -0.75 118.70 126.61 1oac s GLU 164 Ca -0.03 -0.64 0.09 0.00 0.02 0.00 0.00 54.97 54.40 1oac s GLU 164 Cb -0.09 -2.78 -0.04 0.00 0.10 0.00 0.00 34.13 31.32 1oac s GLU 164 CO 0.01 0.10 -0.21 0.00 0.02 0.00 0.00 175.26 175.18 1oac s ALA 165 N 0.67 2.05 -0.07 5.21 0.00 0.50 -0.45 121.76 129.67 1oac s ALA 165 Ca -0.05 -1.44 0.05 0.00 0.00 0.00 0.00 51.96 50.52 1oac s ALA 165 Cb -0.15 -0.24 -0.00 0.00 0.00 0.00 0.00 23.12 22.73 1oac s ALA 165 CO 0.02 0.32 -0.22 0.08 0.00 0.00 0.00 175.76 175.97 1oac s VAL 166 N -1.65 1.83 0.03 0.00 1.01 -0.64 -1.06 120.40 119.93 1oac s VAL 166 Ca 0.14 -0.92 0.08 0.00 0.00 0.00 0.00 61.98 61.27 1oac s VAL 166 Cb -0.08 -1.57 -0.02 0.00 0.00 0.00 0.00 36.38 34.71 1oac s VAL 166 CO 0.06 0.51 -0.23 0.68 0.00 0.00 0.00 175.10 176.12 1oac s VAL 167 N 0.10 1.89 -0.40 2.92 -7.23 -0.70 -0.52 120.40 116.47 1oac s VAL 167 Ca -0.09 -1.23 -0.16 0.00 -1.81 0.00 0.00 61.98 58.69 1oac s VAL 167 Cb -0.15 -1.61 0.01 0.00 0.56 0.00 0.00 36.38 35.19 1oac s VAL 167 CO 0.05 0.34 0.36 -0.62 -0.31 0.00 0.00 175.10 174.91 1oac s ASP 168 N -1.07 6.15 0.22 4.85 -1.08 0.12 -1.91 116.67 123.96 1oac s ASP 168 Ca 0.09 -0.64 0.08 0.00 -0.52 0.00 0.00 52.55 51.57 1oac s ASP 168 Cb -0.09 -2.19 0.17 0.00 -1.46 0.00 0.00 42.92 39.34 1oac s ASP 168 CO 0.01 -0.46 1.50 -0.07 0.52 0.00 0.00 175.17 176.67 1oac h LEU 169 N 8.81 0.04 -0.06 -1.34 3.38 -1.50 0.61 115.31 125.25 1oac h LEU 169 Ca -0.28 -0.03 -0.11 0.00 0.09 0.00 0.00 57.88 57.55 1oac h LEU 169 Cb 1.12 -0.01 0.01 0.00 0.09 0.00 0.00 40.66 41.87 1oac h LEU 169 CO 0.74 0.77 -0.39 -0.61 0.09 0.00 0.00 178.44 179.04 1oac h GLN 170 N 0.02 0.36 -0.00 1.13 4.15 -1.93 -3.29 115.11 115.54 1oac h GLN 170 Ca -0.01 -0.31 0.00 0.00 0.77 0.00 0.00 58.65 59.10 1oac h GLN 170 Cb 1.31 0.07 0.00 0.00 0.21 0.00 0.00 27.48 29.07 1oac h GLN 170 CO 0.10 0.96 -0.20 0.09 -1.93 0.00 0.00 178.83 177.85 1oac n ASN 171 N -4.37 0.62 -3.64 -0.69 3.02 -1.23 -4.97 115.26 104.00 1oac n ASN 171 Ca -0.09 -0.56 -0.28 0.00 -0.03 0.00 0.00 54.58 53.62 1oac n ASN 171 Cb 0.54 0.01 0.04 0.00 -0.61 0.00 0.00 39.78 39.76 1oac n ASN 171 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 1oac n ASN 172 N -0.96 -4.95 -3.88 6.41 5.15 0.12 -5.00 115.26 112.15 1oac n ASN 172 Ca 0.12 -0.96 -0.11 0.00 -0.60 0.00 0.00 54.58 53.03 1oac n ASN 172 Cb 0.31 -3.65 -0.09 0.00 -0.53 0.00 0.00 39.78 35.82 1oac n ASN 172 CO 0.00 0.00 0.00 -1.59 1.40 0.00 0.00 177.26 177.07 1oac s LYS 173 N -5.80 0.54 -0.27 1.20 -2.85 -0.68 -4.98 119.74 106.90 1oac s LYS 173 Ca 0.42 -0.53 -0.25 0.00 -1.00 0.00 0.00 55.97 54.60 1oac s LYS 173 Cb -0.13 0.22 0.00 0.00 -2.06 0.00 0.00 37.83 35.86 1oac s LYS 173 CO 0.84 -0.13 0.88 -1.17 0.10 0.00 0.00 175.35 175.86 1oac s LEU 174 N -1.69 4.06 -0.07 2.77 2.96 -1.26 0.14 118.68 125.60 1oac s LEU 174 Ca -0.11 0.97 0.03 0.00 -0.22 0.00 0.00 54.13 54.80 1oac s LEU 174 Cb -0.05 -3.24 -0.25 0.00 0.50 0.00 0.00 46.19 43.15 1oac s LEU 174 CO -0.01 -0.61 0.56 -0.07 -1.32 0.00 0.00 176.35 174.90 1oac h LEU 175 N 9.41 0.22 -7.00 -0.68 3.38 -1.15 -3.48 115.31 116.01 1oac h LEU 175 Ca -0.23 -0.47 -0.02 0.00 0.09 0.00 0.00 57.88 57.25 1oac h LEU 175 Cb 1.09 -0.07 -0.17 0.00 0.09 0.00 0.00 40.66 41.59 1oac h LEU 175 CO 0.91 1.42 0.26 -0.94 0.09 0.00 0.00 178.44 180.18 1oac s SER 176 N -6.60 -0.58 -0.14 -0.43 1.04 -1.01 -4.92 113.70 101.06 1oac s SER 176 Ca -0.13 0.40 -0.04 0.00 0.48 0.00 0.00 55.95 56.66 1oac s SER 176 Cb 0.07 0.52 0.06 0.00 0.10 0.00 0.00 66.02 66.78 1oac s SER 176 CO 0.80 -0.70 0.14 0.86 0.98 0.00 0.00 173.24 175.32 1oac s TRP 177 N -2.16 -0.03 -0.28 5.02 -0.11 -1.26 -1.61 118.94 118.51 1oac s TRP 177 Ca -0.05 0.10 -0.03 0.00 1.22 0.00 0.00 56.10 57.34 1oac s TRP 177 Cb -0.00 -0.49 0.09 0.00 -1.50 0.00 0.00 33.47 31.57 1oac s TRP 177 CO 0.00 -0.44 0.10 -0.65 -4.62 0.00 0.00 176.95 171.34 1oac s GLN 178 N 2.23 0.44 0.30 5.86 -1.52 0.40 -4.99 119.66 122.38 1oac s GLN 178 Ca 0.04 -0.71 -0.29 0.00 -1.95 0.00 0.00 55.36 52.45 1oac s GLN 178 Cb -0.15 -1.62 -0.10 0.00 -0.22 0.00 0.00 33.01 30.92 1oac s GLN 178 CO -0.08 -0.95 1.33 -2.14 -0.25 0.00 0.00 175.29 173.20 1oac s PRO 179 N 1.89 4.34 -0.37 2.91 0.02 -1.26 0.04 135.00 142.57 1oac s PRO 179 Ca 0.08 2.21 -0.03 0.00 0.02 0.00 0.00 61.00 63.28 1oac s PRO 179 Cb -0.17 -3.09 0.08 0.00 0.02 0.00 0.00 34.50 31.34 1oac s PRO 179 CO -0.28 -0.24 0.14 0.42 -0.33 0.00 0.00 177.00 176.71 1oac s ILE 180 N -0.76 3.30 0.07 2.83 -1.09 -0.17 -4.89 121.20 120.49 1oac s ILE 180 Ca 0.52 -1.73 -0.32 0.00 -2.23 0.00 0.00 60.65 56.89 1oac s ILE 180 Cb -0.40 -3.11 -0.11 0.00 -1.58 0.00 0.00 42.46 37.27 1oac s ILE 180 CO 0.49 -0.46 1.85 1.17 -1.23 0.00 0.00 174.94 176.76 1oac n LYS 181 N 4.64 2.65 0.00 2.79 4.81 -1.26 -3.45 118.16 128.34 1oac n LYS 181 Ca -0.07 0.97 0.00 0.00 -0.87 0.00 0.00 58.31 58.34 1oac n LYS 181 Cb 0.42 -2.86 0.00 0.00 0.02 0.00 0.00 35.03 32.62 1oac n LYS 181 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 1oac n ASP 182 N 6.02 0.00 -4.77 3.14 8.00 -1.26 -5.00 116.55 122.68 1oac n ASP 182 Ca 0.19 0.00 -0.38 0.00 0.71 0.00 0.00 54.79 55.31 1oac n ASP 182 Cb 0.36 -0.00 -0.01 0.00 -0.02 0.00 0.00 41.12 41.45 1oac n ASP 182 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1oac s ALA 183 N -0.60 3.09 0.06 2.24 0.00 -1.22 -5.04 121.76 120.29 1oac s ALA 183 Ca 0.00 1.05 0.03 0.00 0.00 0.00 0.00 51.96 53.04 1oac s ALA 183 Cb 0.00 -3.42 -0.04 0.00 0.00 0.00 0.00 23.12 19.66 1oac s ALA 183 CO 0.00 -0.71 0.05 -1.01 0.00 0.00 0.00 175.76 174.08 1oac s HIS 184 N -1.41 3.13 0.38 0.00 3.76 -1.26 -4.46 115.29 115.44 1oac s HIS 184 Ca 0.60 0.07 0.00 0.00 -0.15 0.00 0.00 55.06 55.58 1oac s HIS 184 Cb -0.33 -1.62 -0.03 0.00 1.11 0.00 0.00 32.58 31.72 1oac s HIS 184 CO 0.41 0.51 0.59 0.20 -0.85 0.00 0.00 174.74 175.60 1oac s GLY 185 N -2.17 1.40 1.18 -2.22 0.00 -1.26 -4.52 107.32 99.73 1oac s GLY 185 Ca 0.26 -0.91 -0.14 0.00 0.00 0.00 0.00 44.72 43.93 1oac s GLY 185 CO 0.18 -0.82 1.03 -3.16 0.00 0.00 0.00 173.10 170.33 1oac s MET 186 N -4.40 -1.06 0.14 2.90 0.23 -1.26 -4.88 119.30 110.97 1oac s MET 186 Ca 0.42 0.62 -0.30 0.00 -1.03 0.00 0.00 55.69 55.40 1oac s MET 186 Cb -0.10 -1.55 -0.07 0.00 -1.53 0.00 0.00 34.83 31.58 1oac s MET 186 CO 0.37 -3.76 1.17 0.08 -2.03 0.00 0.00 175.02 170.85 1oac s VAL 187 N -2.55 3.81 0.32 5.16 1.01 0.10 -5.03 120.40 123.23 1oac s VAL 187 Ca 0.68 1.45 0.08 0.00 0.00 0.00 0.00 61.98 64.19 1oac s VAL 187 Cb -0.22 -3.93 -0.03 0.00 0.00 0.00 0.00 36.38 32.20 1oac s VAL 187 CO 0.62 0.20 0.24 -0.76 0.00 0.00 0.00 175.10 175.40 1oac s LEU 188 N 0.16 3.56 0.40 3.92 1.43 -1.26 -4.62 118.68 122.27 1oac s LEU 188 Ca 0.54 -0.51 0.07 0.00 -1.03 0.00 0.00 54.13 53.19 1oac s LEU 188 Cb -0.31 -2.13 0.84 0.00 0.03 0.00 0.00 46.19 44.62 1oac s LEU 188 CO 0.34 -0.28 2.04 -0.07 0.23 0.00 0.00 176.35 178.61 1oac h LEU 189 N 1.36 0.47 -1.29 1.79 3.38 -1.97 -0.89 115.31 118.17 1oac h LEU 189 Ca -0.45 -0.02 -0.07 0.00 0.09 0.00 0.00 57.88 57.43 1oac h LEU 189 Cb 1.25 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.87 1oac h LEU 189 CO 0.60 0.36 -0.32 -2.24 0.09 0.00 0.00 178.44 176.93 1oac h ASP 190 N 0.55 0.00 -0.75 -0.43 2.03 -2.01 -2.20 116.42 113.61 1oac h ASP 190 Ca 0.15 0.00 0.10 0.00 -0.73 0.00 0.00 57.03 56.55 1oac h ASP 190 Cb -0.03 0.00 -0.05 0.00 -0.83 0.00 0.00 39.33 38.42 1oac h ASP 190 CO -0.03 0.32 0.49 0.44 -1.03 0.00 0.00 179.24 179.43 1oac h ASP 191 N 0.00 0.57 -0.44 4.15 3.32 -1.55 -1.26 116.42 121.20 1oac h ASP 191 Ca -0.00 0.02 0.01 0.00 0.02 0.00 0.00 57.03 57.08 1oac h ASP 191 Cb 0.67 -0.10 -0.03 0.00 0.22 0.00 0.00 39.33 40.09 1oac h ASP 191 CO 0.04 0.34 0.28 -0.26 -1.72 0.00 0.00 179.24 177.92 1oac h PHE 192 N 0.63 0.52 -0.34 4.55 -1.00 -1.48 -2.66 116.94 117.17 1oac h PHE 192 Ca 0.35 0.01 -0.14 0.00 2.81 0.00 0.00 57.97 61.01 1oac h PHE 192 Cb 0.51 -0.17 -0.01 0.00 3.61 0.00 0.00 35.95 39.89 1oac h PHE 192 CO -0.00 0.32 -0.32 0.00 -1.61 0.00 0.00 178.31 176.69 1oac h ALA 193 N 1.18 0.49 0.02 2.45 0.00 -1.42 -2.84 119.26 119.15 1oac h ALA 193 Ca 0.17 -0.42 0.03 0.00 0.00 0.00 0.00 54.91 54.69 1oac h ALA 193 Cb -0.03 -0.11 -0.05 0.00 0.00 0.00 0.00 17.79 17.61 1oac h ALA 193 CO -0.06 0.54 -0.35 0.77 0.00 0.00 0.00 179.25 180.15 1oac h SER 194 N 0.60 -1.05 -0.59 0.00 0.02 -1.17 -1.24 113.55 110.10 1oac h SER 194 Ca 0.06 0.13 0.12 0.00 -0.84 0.00 0.00 61.79 61.26 1oac h SER 194 Cb 0.90 0.41 -0.10 0.00 0.14 0.00 0.00 62.40 63.76 1oac h SER 194 CO 0.08 -0.41 0.01 0.58 -1.14 0.00 0.00 176.83 175.95 1oac h VAL 195 N -0.52 0.52 -0.49 2.27 2.07 -1.52 0.75 116.25 119.34 1oac h VAL 195 Ca 0.05 -0.04 -0.03 0.00 0.82 0.00 0.00 66.70 67.50 1oac h VAL 195 Cb 0.59 0.39 -0.02 0.00 -1.52 0.00 0.00 31.29 30.73 1oac h VAL 195 CO -0.27 0.02 0.19 -0.61 0.02 0.00 0.00 177.57 176.92 1oac h GLN 196 N 0.13 0.73 0.16 1.57 5.75 -1.20 -1.91 115.11 120.33 1oac h GLN 196 Ca 0.31 -0.14 -0.01 0.00 -0.15 0.00 0.00 58.65 58.67 1oac h GLN 196 Cb 0.49 -0.12 0.00 0.00 1.07 0.00 0.00 27.48 28.93 1oac h GLN 196 CO -0.50 0.66 -0.08 -0.97 -2.65 0.00 0.00 178.83 175.29 1oac h ASN 197 N 0.64 -0.18 -0.39 -0.69 -0.73 -0.06 -1.77 115.58 112.40 1oac h ASN 197 Ca 0.16 -0.12 0.05 0.00 1.87 0.00 0.00 56.30 58.27 1oac h ASN 197 Cb 0.21 0.05 -0.05 0.00 0.27 0.00 0.00 38.32 38.79 1oac h ASN 197 CO -0.01 0.01 0.11 0.40 -0.37 0.00 0.00 177.43 177.57 1oac h ILE 198 N -0.36 0.85 -0.82 2.57 2.04 0.51 -2.04 117.51 120.25 1oac h ILE 198 Ca -0.02 -0.09 -0.02 0.00 1.00 0.00 0.00 64.86 65.73 1oac h ILE 198 Cb 0.29 0.57 -0.04 0.00 -0.74 0.00 0.00 36.82 36.90 1oac h ILE 198 CO 0.04 0.05 0.45 0.40 0.00 0.00 0.00 178.15 179.08 1oac h ILE 199 N 0.26 1.24 -0.01 -0.67 5.03 -1.25 -2.83 117.51 119.28 1oac h ILE 199 Ca 0.18 -0.60 -0.09 0.00 -0.12 0.00 0.00 64.86 64.23 1oac h ILE 199 Cb 0.19 0.15 -0.01 0.00 -3.03 0.00 0.00 36.82 34.12 1oac h ILE 199 CO -0.21 0.27 -0.43 0.78 -0.68 0.00 0.00 178.15 177.88 1oac h ASN 200 N 1.13 0.03 -0.10 1.72 -0.26 -1.03 -2.86 115.58 114.23 1oac h ASN 200 Ca 0.29 -0.01 0.00 0.00 -0.56 0.00 0.00 56.30 56.01 1oac h ASN 200 Cb 0.03 -0.01 0.00 0.00 -1.06 0.00 0.00 38.32 37.28 1oac h ASN 200 CO -0.05 0.46 0.00 0.59 -1.06 0.00 0.00 177.43 177.38 1oac n ASN 201 N -4.02 1.79 -4.52 5.81 5.03 -0.79 -4.85 115.26 113.70 1oac n ASN 201 Ca -0.02 -1.65 -0.37 0.00 0.87 0.00 0.00 54.58 53.42 1oac n ASN 201 Cb 0.46 -0.05 -0.12 0.00 -1.02 0.00 0.00 39.78 39.05 1oac n ASN 201 CO 0.00 0.00 0.00 -0.55 -1.83 0.00 0.00 177.26 174.88 1oac s SER 202 N -1.81 5.51 0.08 6.41 0.15 -1.08 -4.98 113.70 117.98 1oac s SER 202 Ca 0.35 -0.10 -0.28 0.00 0.70 0.00 0.00 55.95 56.62 1oac s SER 202 Cb 0.20 -2.00 -0.17 0.00 -1.71 0.00 0.00 66.02 62.34 1oac s SER 202 CO 0.30 -0.01 1.68 1.05 1.20 0.00 0.00 173.24 177.46 1oac h GLU 203 N 8.07 -0.44 -0.55 5.44 9.09 -1.89 -1.94 114.58 132.36 1oac h GLU 203 Ca -0.37 0.03 -0.04 0.00 0.05 0.00 0.00 59.36 59.03 1oac h GLU 203 Cb 1.18 0.10 -0.02 0.00 -1.65 0.00 0.00 28.75 28.36 1oac h GLU 203 CO 0.59 -0.30 0.19 0.93 0.05 0.00 0.00 179.01 180.47 1oac h GLU 204 N -0.46 0.85 -0.10 1.06 5.08 -1.96 -2.13 114.58 116.92 1oac h GLU 204 Ca -0.04 -0.17 0.01 0.00 -1.00 0.00 0.00 59.36 58.15 1oac h GLU 204 Cb 0.36 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.47 1oac h GLU 204 CO 0.07 0.76 0.05 0.35 -1.00 0.00 0.00 179.01 179.24 1oac h PHE 205 N 0.76 0.09 -0.35 4.33 3.57 -1.85 -1.85 116.94 121.65 1oac h PHE 205 Ca 0.18 0.00 0.02 0.00 3.53 0.00 0.00 57.97 61.70 1oac h PHE 205 Cb 0.26 -0.03 -0.02 0.00 2.79 0.00 0.00 35.95 38.95 1oac h PHE 205 CO 0.01 0.05 0.23 0.00 -2.23 0.00 0.00 178.31 176.38 1oac h ALA 206 N 1.05 1.82 -0.09 2.41 0.00 -1.14 -0.19 119.26 123.13 1oac h ALA 206 Ca 0.04 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 1oac h ALA 206 Cb 0.01 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 17.68 1oac h ALA 206 CO -0.03 0.15 -0.06 0.00 0.00 0.00 0.00 179.25 179.31 1oac h ALA 207 N 1.79 0.12 -0.92 0.00 0.00 -1.18 -1.57 119.26 117.49 1oac h ALA 207 Ca 0.14 -0.26 -0.01 0.00 0.00 0.00 0.00 54.91 54.77 1oac h ALA 207 Cb 0.04 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 17.76 1oac h ALA 207 CO -0.03 -0.09 0.53 0.00 0.00 0.00 0.00 179.25 179.66 1oac h ALA 208 N 0.60 1.19 -0.07 0.00 0.00 -0.47 -2.56 119.26 117.95 1oac h ALA 208 Ca 0.02 -0.12 -0.18 0.00 0.00 0.00 0.00 54.91 54.62 1oac h ALA 208 Cb 0.54 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 1oac h ALA 208 CO 0.02 0.67 -0.73 0.28 0.00 0.00 0.00 179.25 179.49 1oac h VAL 209 N 1.29 1.38 -0.90 0.00 2.07 -1.07 -3.11 116.25 115.91 1oac h VAL 209 Ca 0.33 -2.15 0.04 0.00 0.82 0.00 0.00 66.70 65.74 1oac h VAL 209 Cb -0.00 2.12 -0.05 0.00 -1.52 0.00 0.00 31.29 31.83 1oac h VAL 209 CO -0.06 0.65 0.59 0.50 0.02 0.00 0.00 177.57 179.27 1oac h LYS 210 N 0.26 1.05 -0.63 1.57 1.63 -0.94 -1.91 116.57 117.60 1oac h LYS 210 Ca -0.03 -0.06 0.07 0.00 -0.85 0.00 0.00 60.65 59.77 1oac h LYS 210 Cb 1.30 -0.24 -0.06 0.00 -0.60 0.00 0.00 32.23 32.64 1oac h LYS 210 CO 0.12 0.70 0.32 -0.22 -3.45 0.00 0.00 179.45 176.92 1oac h LYS 211 N 1.09 0.56 0.00 1.90 3.64 -1.40 -2.72 116.57 119.63 1oac h LYS 211 Ca 0.37 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.71 1oac h LYS 211 Cb 0.08 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 31.77 1oac h LYS 211 CO -0.12 0.37 0.00 0.54 -2.27 0.00 0.00 179.45 177.97 1oac n ARG 212 N -4.86 0.92 0.00 1.90 1.74 -0.75 -4.86 116.66 110.75 1oac n ARG 212 Ca 0.08 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.16 1oac n ARG 212 Cb 0.20 -1.34 0.00 0.00 -1.02 0.00 0.00 32.46 30.30 1oac n ARG 212 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1oac n GLY 213 N 0.71 0.75 3.55 -0.13 0.00 -1.03 -4.60 105.19 104.43 1oac n GLY 213 Ca 0.15 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.76 1oac n GLY 213 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1oac s ILE 214 N -2.00 5.11 -0.10 -0.61 1.09 -1.02 -4.94 121.20 118.73 1oac s ILE 214 Ca 0.00 0.14 -0.22 0.00 -1.10 0.00 0.00 60.65 59.46 1oac s ILE 214 Cb 0.00 -3.89 -0.19 0.00 -1.06 0.00 0.00 42.46 37.32 1oac s ILE 214 CO 0.00 -0.16 0.74 0.71 -0.10 0.00 0.00 174.94 176.13 1oac h THR 215 N 5.58 1.26 -3.41 2.92 1.35 -1.87 -3.24 112.91 115.49 1oac h THR 215 Ca -0.29 -1.72 -0.71 0.00 -0.55 0.00 0.00 66.41 63.14 1oac h THR 215 Cb 1.13 2.28 -0.30 0.00 -1.73 0.00 0.00 68.15 69.53 1oac h THR 215 CO 0.73 0.39 -0.46 -0.62 -0.25 0.00 0.00 175.52 175.30 1oac s ASP 216 N -5.88 5.54 0.00 5.36 -1.08 -1.26 -4.94 116.67 114.41 1oac s ASP 216 Ca -0.14 -1.80 0.14 0.00 -0.52 0.00 0.00 52.55 50.23 1oac s ASP 216 Cb -0.01 -1.95 0.86 0.00 -1.46 0.00 0.00 42.92 40.36 1oac s ASP 216 CO 0.53 -0.59 1.50 0.00 0.52 0.00 0.00 175.17 177.13 1oac n ALA 217 N 4.82 2.52 0.12 3.66 0.00 -1.26 -2.59 120.51 127.78 1oac n ALA 217 Ca -0.07 -0.09 0.03 0.00 0.00 0.00 0.00 53.44 53.31 1oac n ALA 217 Cb 0.42 -1.23 0.01 0.00 0.00 0.00 0.00 19.45 18.65 1oac n ALA 217 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1oac h LYS 218 N 0.00 0.00 -0.17 0.00 1.57 -1.96 -3.24 116.57 112.76 1oac h LYS 218 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1oac h LYS 218 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 1oac h LYS 218 CO 0.00 0.38 0.00 1.63 -0.57 0.00 0.00 179.45 180.89 1oac n LYS 219 N -3.11 1.23 -3.32 3.15 5.02 -1.07 -4.85 118.16 115.23 1oac n LYS 219 Ca -0.00 -0.33 -0.39 0.00 -2.02 0.00 0.00 58.31 55.57 1oac n LYS 219 Cb 0.73 -1.12 -0.07 0.00 -0.02 0.00 0.00 35.03 34.54 1oac n LYS 219 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1oac s VAL 220 N -1.81 5.15 -0.14 -0.18 1.01 -1.23 -0.47 120.40 122.73 1oac s VAL 220 Ca 0.06 0.83 -0.03 0.00 0.00 0.00 0.00 61.98 62.83 1oac s VAL 220 Cb 0.03 -3.78 -0.03 0.00 0.00 0.00 0.00 36.38 32.60 1oac s VAL 220 CO 0.04 0.22 -0.03 -0.63 0.00 0.00 0.00 175.10 174.70 1oac s ILE 221 N 1.47 3.99 0.37 2.22 -1.09 0.41 -4.95 121.20 123.62 1oac s ILE 221 Ca 0.21 -0.33 0.07 0.00 -2.23 0.00 0.00 60.65 58.38 1oac s ILE 221 Cb -0.15 -2.74 -0.01 0.00 -1.58 0.00 0.00 42.46 37.98 1oac s ILE 221 CO 0.09 0.51 0.42 0.42 -1.23 0.00 0.00 174.94 175.16 1oac s THR 222 N 0.11 3.41 -0.17 2.92 -4.23 -1.26 -0.81 115.64 115.61 1oac s THR 222 Ca -0.00 -1.17 -0.09 0.00 -1.18 0.00 0.00 61.69 59.25 1oac s THR 222 Cb -0.13 -3.17 0.06 0.00 1.34 0.00 0.00 72.50 70.59 1oac s THR 222 CO 0.03 -0.10 0.41 0.28 -0.54 0.00 0.00 174.62 174.70 1oac s THR 223 N -2.31 -0.08 0.04 3.99 -1.32 -0.87 -4.99 115.64 110.10 1oac s THR 223 Ca 0.47 0.10 -0.24 0.00 -1.21 0.00 0.00 61.69 60.81 1oac s THR 223 Cb -0.07 -0.61 -0.05 0.00 -1.51 0.00 0.00 72.50 70.25 1oac s THR 223 CO 0.30 0.04 0.73 -2.16 -2.21 0.00 0.00 174.62 171.32 1oac s PRO 224 N 1.51 4.46 0.01 7.08 0.04 -1.26 -2.61 135.00 144.24 1oac s PRO 224 Ca -0.09 1.01 0.04 0.00 0.04 0.00 0.00 61.00 62.00 1oac s PRO 224 Cb -0.09 -3.36 -0.01 0.00 0.04 0.00 0.00 34.50 31.08 1oac s PRO 224 CO -0.13 0.30 -0.13 -0.51 0.04 0.00 0.00 177.00 176.58 1oac s LEU 225 N -0.10 2.09 0.53 -3.56 1.43 -0.42 -5.00 118.68 113.65 1oac s LEU 225 Ca 0.37 -0.33 -0.17 0.00 -1.03 0.00 0.00 54.13 52.97 1oac s LEU 225 Cb -0.20 -0.60 -0.07 0.00 0.03 0.00 0.00 46.19 45.35 1oac s LEU 225 CO 0.22 0.09 1.02 0.42 0.23 0.00 0.00 176.35 178.33 1oac s THR 226 N -0.55 4.13 -0.79 5.49 -4.23 -1.26 -0.88 115.64 117.54 1oac s THR 226 Ca 0.03 1.10 0.23 0.00 -1.18 0.00 0.00 61.69 61.87 1oac s THR 226 Cb -0.06 -3.54 -0.12 0.00 1.34 0.00 0.00 72.50 70.12 1oac s THR 226 CO 0.00 -0.50 1.07 1.33 -0.54 0.00 0.00 174.62 175.98 1oac n VAL 227 N -1.52 0.08 -4.09 2.29 0.24 -1.26 -4.76 118.33 109.31 1oac n VAL 227 Ca 0.08 -0.13 0.00 0.00 -2.04 0.00 0.00 64.34 62.25 1oac n VAL 227 Cb 0.53 0.42 0.00 0.00 -1.47 0.00 0.00 33.84 33.32 1oac n VAL 227 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1oac n GLY 228 N 1.43 -0.70 2.98 7.63 0.00 -1.26 -4.85 105.19 110.42 1oac n GLY 228 Ca 0.03 -1.15 -0.14 0.00 0.00 0.00 0.00 46.02 44.76 1oac n GLY 228 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1oac s TYR 229 N 0.00 -0.34 -0.10 1.61 5.04 -1.26 -4.24 117.35 118.06 1oac s TYR 229 Ca 0.00 0.84 0.14 0.00 -2.44 0.00 0.00 57.07 55.61 1oac s TYR 229 Cb 0.00 -0.06 0.23 0.00 0.35 0.00 0.00 41.96 42.47 1oac s TYR 229 CO 0.00 -0.30 1.12 1.19 -1.34 0.00 0.00 175.55 176.22 1oac n PHE 230 N 5.04 0.00 -3.88 4.97 3.72 -1.26 -4.73 117.46 121.32 1oac n PHE 230 Ca -0.11 -0.78 -0.29 0.00 -0.05 0.00 0.00 57.45 56.22 1oac n PHE 230 Cb 0.51 -0.13 0.03 0.00 -0.94 0.00 0.00 39.48 38.95 1oac n PHE 230 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 1oac n ASP 231 N -1.06 -4.95 0.00 4.37 2.03 -1.26 -1.09 116.55 114.59 1oac n ASP 231 Ca 0.12 -0.75 0.00 0.00 0.52 0.00 0.00 54.79 54.68 1oac n ASP 231 Cb 0.66 -4.03 0.00 0.00 -0.72 0.00 0.00 41.12 37.04 1oac n ASP 231 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1oac n GLY 232 N -1.73 1.90 0.21 0.27 0.00 -1.26 -4.89 105.19 99.68 1oac n GLY 232 Ca 0.03 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.20 1oac n GLY 232 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1oac h LYS 233 N 2.35 0.00 -0.00 1.61 1.79 -1.47 -2.15 116.57 118.70 1oac h LYS 233 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1oac h LYS 233 Cb 0.00 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.65 1oac h LYS 233 CO 0.00 0.00 -0.33 -0.40 -1.08 0.00 0.00 179.45 177.64 1oac n ASP 234 N -2.66 0.61 -0.10 0.86 5.75 -1.26 -4.93 116.55 114.81 1oac n ASP 234 Ca 0.01 -0.42 -0.01 0.00 -0.01 0.00 0.00 54.79 54.36 1oac n ASP 234 Cb 0.23 0.10 -0.00 0.00 -1.03 0.00 0.00 41.12 40.42 1oac n ASP 234 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1oac n GLY 235 N 1.42 0.36 3.56 6.12 0.00 -0.81 -5.04 105.19 110.81 1oac n GLY 235 Ca 0.09 -0.90 -0.33 0.00 0.00 0.00 0.00 46.02 44.87 1oac n GLY 235 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1oac s LEU 236 N -0.27 3.09 0.10 0.99 1.43 -1.26 -5.10 118.68 117.66 1oac s LEU 236 Ca 0.00 -0.07 -0.28 0.00 -1.03 0.00 0.00 54.13 52.75 1oac s LEU 236 Cb 0.00 -1.68 -0.06 0.00 0.03 0.00 0.00 46.19 44.48 1oac s LEU 236 CO 0.00 0.35 0.89 -0.75 0.23 0.00 0.00 176.35 177.06 1oac s LYS 237 N -0.87 4.63 0.29 1.70 2.20 -1.26 -4.51 119.74 121.91 1oac s LYS 237 Ca 0.13 1.31 0.08 0.00 -0.36 0.00 0.00 55.97 57.12 1oac s LYS 237 Cb -0.11 -3.36 0.42 0.00 -1.51 0.00 0.00 37.83 33.27 1oac s LYS 237 CO 0.02 0.26 1.66 0.37 -0.36 0.00 0.00 175.35 177.31 1oac h GLN 238 N 5.50 0.15 -0.20 4.03 5.75 -2.00 -3.29 115.11 125.04 1oac h GLN 238 Ca -0.43 -0.08 0.02 0.00 -0.15 0.00 0.00 58.65 58.00 1oac h GLN 238 Cb 1.21 0.01 -0.02 0.00 1.07 0.00 0.00 27.48 29.74 1oac h GLN 238 CO 0.71 0.62 0.08 0.22 -2.65 0.00 0.00 178.83 177.81 1oac h ASP 239 N 0.12 0.11 -4.01 -0.69 1.82 -2.00 -3.46 116.42 108.31 1oac h ASP 239 Ca 0.00 0.02 -0.53 0.00 -0.39 0.00 0.00 57.03 56.13 1oac h ASP 239 Cb 0.93 -0.00 0.10 0.00 0.68 0.00 0.00 39.33 41.03 1oac h ASP 239 CO 0.07 0.09 0.56 0.00 -1.61 0.00 0.00 179.24 178.35 1oac s ALA 240 N -6.18 2.97 -0.99 -0.78 0.00 -1.24 -5.00 121.76 110.55 1oac s ALA 240 Ca -0.13 1.16 -0.19 0.00 0.00 0.00 0.00 51.96 52.80 1oac s ALA 240 Cb 0.09 -3.48 0.12 0.00 0.00 0.00 0.00 23.12 19.85 1oac s ALA 240 CO 0.69 -0.98 1.23 0.50 0.00 0.00 0.00 175.76 177.19 1oac s ARG 241 N -2.69 3.67 0.25 0.00 3.52 -1.26 -5.00 118.95 117.44 1oac s ARG 241 Ca 0.65 -1.77 0.07 0.00 -0.13 0.00 0.00 55.73 54.55 1oac s ARG 241 Cb -0.35 -5.02 -0.04 0.00 -1.56 0.00 0.00 34.95 27.99 1oac s ARG 241 CO 0.43 -1.85 0.19 -0.51 -0.81 0.00 0.00 175.30 172.75 1oac s LEU 242 N 2.93 3.80 -0.04 -0.88 1.43 -1.26 -1.52 118.68 123.13 1oac s LEU 242 Ca 0.36 -0.26 -0.13 0.00 -1.03 0.00 0.00 54.13 53.08 1oac s LEU 242 Cb -0.04 -2.33 0.02 0.00 0.03 0.00 0.00 46.19 43.88 1oac s LEU 242 CO -0.08 -0.03 0.29 -0.76 0.23 0.00 0.00 176.35 176.00 1oac s LEU 243 N -3.81 0.92 0.03 1.79 1.43 -0.78 -4.69 118.68 113.58 1oac s LEU 243 Ca 0.33 0.19 -0.00 0.00 -1.03 0.00 0.00 54.13 53.62 1oac s LEU 243 Cb -0.08 1.15 -0.04 0.00 0.03 0.00 0.00 46.19 47.25 1oac s LEU 243 CO 0.25 -0.35 0.16 -0.54 0.23 0.00 0.00 176.35 176.10 1oac s LYS 244 N -0.94 3.29 -0.09 1.70 1.02 -0.06 -1.00 119.74 123.66 1oac s LYS 244 Ca -0.10 -0.45 0.01 0.00 0.02 0.00 0.00 55.97 55.45 1oac s LYS 244 Cb -0.05 -2.98 0.02 0.00 -0.52 0.00 0.00 37.83 34.30 1oac s LYS 244 CO 0.03 0.63 -0.11 0.08 -0.92 0.00 0.00 175.35 175.06 1oac s VAL 245 N -1.39 1.11 0.04 3.17 1.01 0.24 -1.30 120.40 123.29 1oac s VAL 245 Ca 0.30 -0.42 0.01 0.00 0.00 0.00 0.00 61.98 61.87 1oac s VAL 245 Cb -0.13 -1.06 -0.04 0.00 0.00 0.00 0.00 36.38 35.16 1oac s VAL 245 CO 0.22 0.36 0.11 -0.63 0.00 0.00 0.00 175.10 175.16 1oac s ILE 246 N 1.06 4.80 0.07 2.22 -1.09 -1.07 -2.39 121.20 124.80 1oac s ILE 246 Ca -0.07 -0.54 0.06 0.00 -2.23 0.00 0.00 60.65 57.86 1oac s ILE 246 Cb -0.15 -3.27 -0.03 0.00 -1.58 0.00 0.00 42.46 37.43 1oac s ILE 246 CO -0.01 0.22 -0.15 -0.44 -1.23 0.00 0.00 174.94 173.32 1oac s SER 247 N -2.16 1.80 0.09 3.58 0.01 -1.26 -2.06 113.70 113.70 1oac s SER 247 Ca 0.28 -0.59 0.04 0.00 1.31 0.00 0.00 55.95 56.99 1oac s SER 247 Cb -0.12 -0.07 -0.03 0.00 0.21 0.00 0.00 66.02 66.00 1oac s SER 247 CO 0.20 -0.03 -0.12 -0.31 0.41 0.00 0.00 173.24 173.39 1oac s TYR 248 N -1.17 1.11 -0.16 2.43 2.02 0.01 -1.57 117.35 120.02 1oac s TYR 248 Ca -0.00 -0.57 -0.13 0.00 -0.37 0.00 0.00 57.07 56.00 1oac s TYR 248 Cb -0.10 -0.61 -0.05 0.00 -0.40 0.00 0.00 41.96 40.80 1oac s TYR 248 CO 0.02 0.03 0.27 -1.17 -1.57 0.00 0.00 175.55 173.13 1oac s LEU 249 N -2.15 4.25 -0.41 -1.29 2.96 0.94 -0.44 118.68 122.53 1oac s LEU 249 Ca 0.02 0.48 -0.28 0.00 -0.22 0.00 0.00 54.13 54.13 1oac s LEU 249 Cb -0.06 -2.33 0.02 0.00 0.50 0.00 0.00 46.19 44.32 1oac s LEU 249 CO 0.01 0.12 1.07 -0.62 -1.32 0.00 0.00 176.35 175.61 1oac s ASP 250 N 0.38 6.73 0.00 3.68 2.15 0.38 -4.65 116.67 125.35 1oac s ASP 250 Ca 0.15 0.66 0.11 0.00 0.43 0.00 0.00 52.55 53.91 1oac s ASP 250 Cb -0.13 -2.53 0.32 0.00 -0.30 0.00 0.00 42.92 40.28 1oac s ASP 250 CO 0.03 -1.05 1.26 1.33 -0.17 0.00 0.00 175.17 176.57 1oac n VAL 251 N 6.35 0.99 -2.00 1.11 0.24 -1.26 -4.92 118.33 118.83 1oac n VAL 251 Ca 0.11 -0.99 -0.03 0.00 -2.04 0.00 0.00 64.34 61.39 1oac n VAL 251 Cb 0.48 0.51 -0.00 0.00 -1.47 0.00 0.00 33.84 33.36 1oac n VAL 251 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1oac n GLY 252 N 0.56 0.28 0.82 7.63 0.00 -1.26 -4.93 105.19 108.28 1oac n GLY 252 Ca 0.12 -0.79 0.09 0.00 0.00 0.00 0.00 46.02 45.45 1oac n GLY 252 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1oac n ASP 253 N 1.49 2.77 -0.16 1.61 5.75 -1.26 -4.94 116.55 121.81 1oac n ASP 253 Ca -0.03 -1.82 -0.02 0.00 -0.01 0.00 0.00 54.79 52.90 1oac n ASP 253 Cb 0.50 -0.09 -0.01 0.00 -1.03 0.00 0.00 41.12 40.50 1oac n ASP 253 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1oac n GLY 254 N 1.08 0.49 2.40 6.12 0.00 -1.26 -4.02 105.19 110.00 1oac n GLY 254 Ca 0.13 -0.18 -0.26 0.00 0.00 0.00 0.00 46.02 45.71 1oac n GLY 254 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1oac n ASN 255 N -0.10 1.06 0.26 1.61 5.15 -1.26 -4.87 115.26 117.11 1oac n ASN 255 Ca -0.02 -2.81 0.10 0.00 -0.60 0.00 0.00 54.58 51.25 1oac n ASN 255 Cb 0.21 -0.64 0.68 0.00 -0.53 0.00 0.00 39.78 39.51 1oac n ASN 255 CO 0.00 0.00 0.00 0.10 1.40 0.00 0.00 177.26 178.76 1oac h TYR 256 N 4.73 0.00 -0.12 1.20 -0.00 -1.93 -2.38 116.97 118.48 1oac h TYR 256 Ca 0.17 0.00 0.03 0.00 0.00 0.00 0.00 58.73 58.93 1oac h TYR 256 Cb 0.83 0.00 -0.00 0.00 0.00 0.00 0.00 36.73 37.55 1oac h TYR 256 CO 0.45 0.11 0.11 -1.49 -0.00 0.00 0.00 178.16 177.34 1oac h TRP 257 N 0.00 0.00 -0.05 0.10 4.06 -1.92 -1.75 115.95 116.38 1oac h TRP 257 Ca -0.00 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.95 1oac h TRP 257 Cb 0.23 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.39 1oac h TRP 257 CO 0.00 0.00 0.00 0.00 -3.56 0.00 0.00 178.44 174.88 1oac n ALA 258 N -2.39 2.58 -3.17 1.49 0.00 -0.89 -4.39 120.51 113.73 1oac n ALA 258 Ca -0.00 -0.25 -0.23 0.00 0.00 0.00 0.00 53.44 52.96 1oac n ALA 258 Cb 0.22 -1.23 -0.05 0.00 0.00 0.00 0.00 19.45 18.39 1oac n ALA 258 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1oac n HIS 259 N -0.43 1.35 -2.24 0.00 8.25 -0.66 -4.75 115.22 116.75 1oac n HIS 259 Ca 0.15 -3.84 -0.37 0.00 -0.26 0.00 0.00 57.72 53.40 1oac n HIS 259 Cb 0.15 -0.44 -0.01 0.00 1.12 0.00 0.00 29.99 30.82 1oac n HIS 259 CO 0.00 0.00 0.00 -1.25 0.64 0.00 0.00 176.34 175.73 1oac s PRO 260 N -2.31 3.81 -0.77 -0.41 0.04 -1.26 -0.04 135.00 134.05 1oac s PRO 260 Ca 0.40 1.82 -0.09 0.00 0.04 0.00 0.00 61.00 63.18 1oac s PRO 260 Cb 0.26 -2.48 0.20 0.00 0.04 0.00 0.00 34.50 32.52 1oac s PRO 260 CO -0.09 -0.52 0.66 0.42 0.04 0.00 0.00 177.00 177.51 1oac s ILE 261 N -1.49 4.81 0.40 0.56 1.01 -0.61 -4.39 121.20 121.49 1oac s ILE 261 Ca 0.62 -2.82 -0.25 0.00 0.00 0.00 0.00 60.65 58.20 1oac s ILE 261 Cb -0.30 -4.02 -0.08 0.00 0.01 0.00 0.00 42.46 38.07 1oac s ILE 261 CO 0.37 -0.98 1.14 -0.70 0.00 0.00 0.00 174.94 174.76 1oac s GLU 262 N -0.13 4.08 -0.74 2.79 2.56 -1.26 -4.02 118.70 121.98 1oac s GLU 262 Ca 0.19 1.76 -0.04 0.00 0.00 0.00 0.00 54.97 56.88 1oac s GLU 262 Cb -0.14 -2.65 0.00 0.00 2.00 0.00 0.00 34.13 33.34 1oac s GLU 262 CO -0.07 -0.27 0.51 0.09 -0.56 0.00 0.00 175.26 174.96 1oac n ASN 263 N 0.06 -4.16 -3.61 -1.70 5.03 -1.26 -4.52 115.26 105.10 1oac n ASN 263 Ca 0.04 -0.23 -0.23 0.00 0.87 0.00 0.00 54.58 55.03 1oac n ASN 263 Cb 0.47 -2.84 -0.16 0.00 -1.02 0.00 0.00 39.78 36.23 1oac n ASN 263 CO 0.00 0.00 0.00 -0.22 -1.83 0.00 0.00 177.26 175.21 1oac s LEU 264 N -4.07 0.22 -0.05 3.41 2.96 -1.26 -0.03 118.68 119.86 1oac s LEU 264 Ca 0.25 -0.39 0.04 0.00 -0.22 0.00 0.00 54.13 53.81 1oac s LEU 264 Cb -0.11 -0.10 0.00 0.00 0.50 0.00 0.00 46.19 46.47 1oac s LEU 264 CO 0.31 -0.32 -0.16 -0.69 -1.32 0.00 0.00 176.35 174.17 1oac s VAL 265 N 2.18 1.34 -0.12 1.68 1.01 0.47 -4.53 120.40 122.43 1oac s VAL 265 Ca 0.03 -0.65 0.02 0.00 0.00 0.00 0.00 61.98 61.39 1oac s VAL 265 Cb -0.15 -1.16 -0.00 0.00 0.00 0.00 0.00 36.38 35.06 1oac s VAL 265 CO -0.08 0.39 -0.20 0.00 0.00 0.00 0.00 175.10 175.21 1oac s ALA 266 N 0.18 2.33 -0.25 5.51 0.00 -1.01 0.14 121.76 128.66 1oac s ALA 266 Ca -0.06 -0.96 -0.12 0.00 0.00 0.00 0.00 51.96 50.81 1oac s ALA 266 Cb -0.12 -0.97 -0.05 0.00 0.00 0.00 0.00 23.12 21.98 1oac s ALA 266 CO 0.03 0.23 0.23 0.08 0.00 0.00 0.00 175.76 176.33 1oac s VAL 267 N 0.42 5.30 -0.10 0.00 1.01 0.57 -0.59 120.40 127.00 1oac s VAL 267 Ca -0.15 0.31 0.01 0.00 0.00 0.00 0.00 61.98 62.16 1oac s VAL 267 Cb -0.17 -3.57 -0.02 0.00 0.00 0.00 0.00 36.38 32.62 1oac s VAL 267 CO 0.06 0.28 -0.15 -0.69 0.00 0.00 0.00 175.10 174.61 1oac s VAL 268 N 1.42 2.94 -0.30 2.92 1.01 -0.18 0.67 120.40 128.88 1oac s VAL 268 Ca 0.10 -0.72 -0.15 0.00 0.00 0.00 0.00 61.98 61.21 1oac s VAL 268 Cb -0.15 -2.20 -0.03 0.00 0.00 0.00 0.00 36.38 34.01 1oac s VAL 268 CO 0.07 0.55 0.38 -0.62 0.00 0.00 0.00 175.10 175.48 1oac s ASP 269 N 0.06 6.23 0.33 3.32 -1.08 0.18 -1.86 116.67 123.86 1oac s ASP 269 Ca -0.06 0.08 0.23 0.00 -0.52 0.00 0.00 52.55 52.29 1oac s ASP 269 Cb -0.15 -2.21 0.26 0.00 -1.46 0.00 0.00 42.92 39.36 1oac s ASP 269 CO 0.05 -0.26 1.42 -0.07 0.52 0.00 0.00 175.17 176.83 1oac h LEU 270 N 8.70 0.00 0.02 -1.34 3.38 -1.57 0.71 115.31 125.21 1oac h LEU 270 Ca -0.31 -0.01 -0.17 0.00 0.09 0.00 0.00 57.88 57.48 1oac h LEU 270 Cb 1.15 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.92 1oac h LEU 270 CO 0.67 0.01 -0.69 -0.33 0.09 0.00 0.00 178.44 178.19 1oac h GLU 271 N 0.00 0.43 0.00 1.13 5.08 -1.92 -3.22 114.58 116.08 1oac h GLU 271 Ca 0.00 -0.49 0.00 0.00 -1.00 0.00 0.00 59.36 57.87 1oac h GLU 271 Cb 0.97 0.15 0.00 0.00 0.50 0.00 0.00 28.75 30.37 1oac h GLU 271 CO 0.00 1.15 -0.38 1.04 -1.00 0.00 0.00 179.01 179.82 1oac n GLN 272 N -4.16 0.13 -3.70 2.33 6.02 -1.24 -4.96 117.38 111.79 1oac n GLN 272 Ca -0.11 0.05 -0.30 0.00 -0.01 0.00 0.00 57.00 56.64 1oac n GLN 272 Cb 0.72 -1.60 0.04 0.00 1.02 0.00 0.00 30.24 30.42 1oac n GLN 272 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 1oac n LYS 273 N -1.79 -1.69 -3.69 -1.09 5.02 0.23 -4.99 118.16 110.17 1oac n LYS 273 Ca 0.05 0.47 -0.14 0.00 -2.02 0.00 0.00 58.31 56.67 1oac n LYS 273 Cb 0.38 -4.28 -0.08 0.00 -0.02 0.00 0.00 35.03 31.03 1oac n LYS 273 CO 0.00 0.00 0.00 -1.59 -0.52 0.00 0.00 177.40 175.29 1oac s LYS 274 N -6.00 0.74 -0.06 1.97 -2.85 -0.11 -4.97 119.74 108.46 1oac s LYS 274 Ca 0.40 0.12 -0.30 0.00 -1.00 0.00 0.00 55.97 55.19 1oac s LYS 274 Cb -0.14 0.34 -0.05 0.00 -2.06 0.00 0.00 37.83 35.92 1oac s LYS 274 CO 0.86 -0.19 1.56 0.42 0.10 0.00 0.00 175.35 178.09 1oac s ILE 275 N -0.92 3.69 -1.59 3.79 1.01 -1.26 -0.64 121.20 125.27 1oac s ILE 275 Ca -0.10 0.88 0.22 0.00 0.00 0.00 0.00 60.65 61.66 1oac s ILE 275 Cb -0.03 -3.57 -0.08 0.00 0.01 0.00 0.00 42.46 38.78 1oac s ILE 275 CO 0.05 -0.06 1.04 1.33 0.00 0.00 0.00 174.94 177.30 1oac n VAL 276 N 5.32 0.00 -3.65 2.92 0.24 0.21 -4.93 118.33 118.45 1oac n VAL 276 Ca 0.16 -0.14 -0.03 0.00 -2.04 0.00 0.00 64.34 62.29 1oac n VAL 276 Cb 0.43 1.09 -0.06 0.00 -1.47 0.00 0.00 33.84 33.83 1oac n VAL 276 CO 0.00 0.00 0.00 -0.75 -2.14 0.00 0.00 176.83 173.94 1oac s LYS 277 N -2.70 0.09 -0.18 7.34 2.20 -1.18 -4.98 119.74 120.33 1oac s LYS 277 Ca 0.14 0.08 0.01 0.00 -0.36 0.00 0.00 55.97 55.84 1oac s LYS 277 Cb 0.17 0.04 0.02 0.00 -1.51 0.00 0.00 37.83 36.56 1oac s LYS 277 CO 0.69 -0.02 -0.20 0.42 -0.36 0.00 0.00 175.35 175.89 1oac s ILE 278 N -0.25 2.03 -0.21 5.43 1.01 -1.26 -0.32 121.20 127.64 1oac s ILE 278 Ca 0.07 -0.92 -0.08 0.00 0.00 0.00 0.00 60.65 59.72 1oac s ILE 278 Cb -0.04 -1.84 -0.04 0.00 0.01 0.00 0.00 42.46 40.56 1oac s ILE 278 CO -0.13 0.54 0.07 -1.61 0.00 0.00 0.00 174.94 173.81 1oac s GLU 279 N 1.29 3.89 0.04 2.79 2.02 0.37 -4.97 118.70 124.12 1oac s GLU 279 Ca 0.05 -0.38 0.07 0.00 0.02 0.00 0.00 54.97 54.73 1oac s GLU 279 Cb -0.13 -3.27 -0.02 0.00 0.10 0.00 0.00 34.13 30.80 1oac s GLU 279 CO -0.13 0.12 -0.20 -1.21 0.02 0.00 0.00 175.26 173.87 1oac s GLU 280 N 0.79 1.38 0.00 1.61 2.02 -1.26 -0.40 118.70 122.84 1oac s GLU 280 Ca 0.04 -0.90 0.00 0.00 0.02 0.00 0.00 54.97 54.13 1oac s GLU 280 Cb -0.13 -1.47 0.00 0.00 0.10 0.00 0.00 34.13 32.63 1oac s GLU 280 CO 0.02 0.38 0.00 0.41 0.02 0.00 0.00 175.26 176.09 1oac n GLY 281 N 1.94 5.44 3.71 -1.39 0.00 0.95 -4.99 105.19 110.86 1oac n GLY 281 Ca -0.17 -2.06 -0.38 0.00 0.00 0.00 0.00 46.02 43.41 1oac n GLY 281 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1oac n PRO 282 N 0.00 1.28 -2.60 1.61 -0.02 -1.26 -4.92 135.00 129.10 1oac n PRO 282 Ca 0.00 0.49 -0.43 0.00 -2.02 0.00 0.00 63.50 61.54 1oac n PRO 282 Cb 0.00 -2.48 -0.02 0.00 -0.02 0.00 0.00 33.50 30.98 1oac n PRO 282 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1oac s VAL 283 N -1.37 4.58 -0.10 -1.45 1.01 -1.26 -4.67 120.40 117.14 1oac s VAL 283 Ca 0.77 1.87 0.03 0.00 0.00 0.00 0.00 61.98 64.65 1oac s VAL 283 Cb -0.40 -4.20 0.01 0.00 0.00 0.00 0.00 36.38 31.78 1oac s VAL 283 CO 0.45 -0.03 -0.18 -0.69 0.00 0.00 0.00 175.10 174.65 1oac s VAL 284 N 2.29 1.65 0.36 2.92 1.01 -1.26 -5.09 120.40 122.27 1oac s VAL 284 Ca 0.51 -0.76 -0.28 0.00 0.00 0.00 0.00 61.98 61.44 1oac s VAL 284 Cb -0.20 -1.47 -0.11 0.00 0.00 0.00 0.00 36.38 34.61 1oac s VAL 284 CO 0.18 0.47 1.41 -2.84 0.00 0.00 0.00 175.10 174.32 1oac s PRO 285 N 0.68 4.21 0.06 2.72 0.02 -1.26 -4.59 135.00 136.84 1oac s PRO 285 Ca -0.13 2.43 -0.31 0.00 0.02 0.00 0.00 61.00 63.01 1oac s PRO 285 Cb -0.16 -3.01 -0.06 0.00 0.02 0.00 0.00 34.50 31.29 1oac s PRO 285 CO 0.03 -0.39 1.21 0.08 -0.33 0.00 0.00 177.00 177.60 1oac s VAL 286 N -1.12 3.99 -0.03 3.83 1.01 -1.26 -4.79 120.40 122.03 1oac s VAL 286 Ca 0.51 1.43 -0.30 0.00 0.00 0.00 0.00 61.98 63.62 1oac s VAL 286 Cb -0.44 -3.91 -0.07 0.00 0.00 0.00 0.00 36.38 31.96 1oac s VAL 286 CO 0.59 0.11 1.92 -2.84 0.00 0.00 0.00 175.10 174.87 1oac s PRO 287 N 1.08 3.99 -0.02 2.72 0.02 -1.26 -4.88 135.00 136.64 1oac s PRO 287 Ca 0.59 2.39 0.19 0.00 0.02 0.00 0.00 61.00 64.19 1oac s PRO 287 Cb -0.30 -4.15 -0.29 0.00 0.02 0.00 0.00 34.50 29.79 1oac s PRO 287 CO 0.29 -1.11 0.48 -1.33 -0.33 0.00 0.00 177.00 175.00 1oac n MET 288 N 7.63 0.62 -1.68 5.54 2.81 -1.26 -4.47 117.12 126.30 1oac n MET 288 Ca 0.21 -0.15 -0.45 0.00 -1.81 0.00 0.00 57.70 55.50 1oac n MET 288 Cb 0.42 -1.45 -0.04 0.00 -0.71 0.00 0.00 33.22 31.45 1oac n MET 288 CO 0.00 0.00 0.00 2.41 1.51 0.00 0.00 175.97 179.89 1oac n THR 289 N -2.07 0.20 -1.94 2.03 -1.04 -1.26 -4.91 114.28 105.30 1oac n THR 289 Ca -0.03 -0.05 -0.42 0.00 -2.04 0.00 0.00 64.05 61.51 1oac n THR 289 Cb 0.47 -1.65 -0.03 0.00 -1.82 0.00 0.00 70.33 67.31 1oac n THR 289 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1oac s ALA 290 N 0.76 3.77 -0.41 2.41 0.00 -1.26 -4.96 121.76 122.06 1oac s ALA 290 Ca 0.75 1.35 0.09 0.00 0.00 0.00 0.00 51.96 54.16 1oac s ALA 290 Cb -0.63 -3.63 0.29 0.00 0.00 0.00 0.00 23.12 19.16 1oac s ALA 290 CO 0.39 -0.80 0.63 0.54 0.00 0.00 0.00 175.76 176.52 1oac n ARG 291 N 4.12 1.05 -1.89 0.00 5.12 -1.26 -5.13 116.66 118.67 1oac n ARG 291 Ca 0.14 -3.46 -0.35 0.00 -1.93 0.00 0.00 57.85 52.26 1oac n ARG 291 Cb 0.39 -1.51 0.04 0.00 -1.16 0.00 0.00 32.46 30.21 1oac n ARG 291 CO 0.00 0.00 0.00 -1.25 -1.93 0.00 0.00 177.63 174.45 1oac s PRO 292 N -1.84 2.87 0.00 5.56 0.04 -1.26 -4.71 135.00 135.66 1oac s PRO 292 Ca 0.38 1.63 0.03 0.00 0.04 0.00 0.00 61.00 63.08 1oac s PRO 292 Cb 0.24 -1.94 0.00 0.00 0.04 0.00 0.00 34.50 32.85 1oac s PRO 292 CO -0.09 -1.24 0.42 1.97 0.04 0.00 0.00 177.00 178.09 1oac n PHE 293 N -1.96 0.00 1.72 0.56 1.16 -1.26 -4.73 117.46 112.94 1oac n PHE 293 Ca 0.12 0.00 0.15 0.00 -1.87 0.00 0.00 57.45 55.85 1oac n PHE 293 Cb 0.51 0.00 0.71 0.00 -1.61 0.00 0.00 39.48 39.09 1oac n PHE 293 CO 0.00 0.00 0.00 -0.40 -1.87 0.00 0.00 176.76 174.49 1oac n ASP 294 N -0.29 0.83 0.00 5.98 5.75 -1.26 -4.94 116.55 122.62 1oac n ASP 294 Ca 0.01 -1.27 0.00 0.00 -0.01 0.00 0.00 54.79 53.53 1oac n ASP 294 Cb 0.06 -0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.15 1oac n ASP 294 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1oac n GLY 295 N 1.10 0.78 0.36 6.12 0.00 -1.26 -4.94 105.19 107.34 1oac n GLY 295 Ca 0.21 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.38 1oac n GLY 295 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 1oac h ARG 296 N 4.01 0.20 -0.57 1.61 0.11 -1.94 -0.60 114.38 117.21 1oac h ARG 296 Ca 0.00 -0.01 0.00 0.00 0.10 0.00 0.00 59.98 60.07 1oac h ARG 296 Cb 0.00 -0.04 0.00 0.00 1.11 0.00 0.00 29.97 31.04 1oac h ARG 296 CO 0.00 0.13 0.00 -0.40 0.10 0.00 0.00 179.97 179.80 1oac n ASP 297 N -4.44 3.67 -4.39 0.08 5.75 -1.26 -5.00 116.55 110.95 1oac n ASP 297 Ca 0.09 -2.09 -0.20 0.00 -0.01 0.00 0.00 54.79 52.58 1oac n ASP 297 Cb 0.45 -0.41 -0.10 0.00 -1.03 0.00 0.00 41.12 40.03 1oac n ASP 297 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 1oac s ARG 298 N -1.16 1.46 -0.11 0.11 1.81 -0.23 -5.13 118.95 115.70 1oac s ARG 298 Ca 0.40 -1.71 0.00 0.00 -1.72 0.00 0.00 55.73 52.70 1oac s ARG 298 Cb 0.22 -1.12 0.02 0.00 -0.45 0.00 0.00 34.95 33.62 1oac s ARG 298 CO 0.25 0.09 -0.09 0.08 -0.68 0.00 0.00 175.30 174.94 1oac s VAL 299 N -3.01 1.12 0.38 3.52 1.01 -1.26 -4.96 120.40 117.19 1oac s VAL 299 Ca 0.27 -0.37 -0.15 0.00 0.00 0.00 0.00 61.98 61.73 1oac s VAL 299 Cb 0.02 -1.10 -0.09 0.00 0.00 0.00 0.00 36.38 35.22 1oac s VAL 299 CO 0.10 0.38 0.81 0.00 0.00 0.00 0.00 175.10 176.39 1oac s ALA 300 N 1.47 3.25 0.52 5.51 0.00 -1.26 -5.04 121.76 126.21 1oac s ALA 300 Ca 0.01 0.06 -0.19 0.00 0.00 0.00 0.00 51.96 51.84 1oac s ALA 300 Cb -0.13 -2.86 -0.07 0.00 0.00 0.00 0.00 23.12 20.06 1oac s ALA 300 CO -0.06 0.15 1.04 -1.25 0.00 0.00 0.00 175.76 175.63 1oac s PRO 301 N -3.36 3.67 0.33 0.00 0.04 -1.26 -4.99 135.00 129.43 1oac s PRO 301 Ca 0.55 1.28 -0.28 0.00 0.04 0.00 0.00 61.00 62.59 1oac s PRO 301 Cb -0.10 -2.08 -0.10 0.00 0.04 0.00 0.00 34.50 32.26 1oac s PRO 301 CO 0.22 -0.53 1.24 0.00 0.04 0.00 0.00 177.00 177.97 1oac s ALA 302 N -2.17 3.42 -0.02 8.56 0.00 -1.26 -5.05 121.76 125.24 1oac s ALA 302 Ca 0.65 1.13 0.03 0.00 0.00 0.00 0.00 51.96 53.78 1oac s ALA 302 Cb -0.16 -3.43 -0.00 0.00 0.00 0.00 0.00 23.12 19.53 1oac s ALA 302 CO 0.26 -0.51 -0.11 0.08 0.00 0.00 0.00 175.76 175.47 1oac s VAL 303 N -1.19 0.94 0.54 0.00 1.01 -1.26 -5.14 120.40 115.30 1oac s VAL 303 Ca 0.49 -0.47 -0.19 0.00 0.00 0.00 0.00 61.98 61.81 1oac s VAL 303 Cb -0.37 -0.81 -0.06 0.00 0.00 0.00 0.00 36.38 35.15 1oac s VAL 303 CO 0.48 0.28 1.08 -0.54 0.00 0.00 0.00 175.10 176.39 1oac s LYS 304 N -0.02 3.47 0.60 2.72 3.01 -1.26 -5.01 119.74 123.25 1oac s LYS 304 Ca -0.00 1.42 -0.17 0.00 -1.01 0.00 0.00 55.97 56.20 1oac s LYS 304 Cb -0.07 -2.04 -0.03 0.00 -1.01 0.00 0.00 37.83 34.68 1oac s LYS 304 CO 0.00 -0.71 1.13 -1.25 0.51 0.00 0.00 175.35 175.03 1oac s PRO 305 N -3.49 3.06 -0.02 -1.68 0.04 -1.26 -5.06 135.00 126.59 1oac s PRO 305 Ca 0.68 1.54 0.00 0.00 0.04 0.00 0.00 61.00 63.27 1oac s PRO 305 Cb -0.19 -1.97 0.03 0.00 0.04 0.00 0.00 34.50 32.41 1oac s PRO 305 CO 0.27 -1.07 0.02 1.41 0.04 0.00 0.00 177.00 177.67 1oac s MET 306 N -3.64 0.07 0.01 4.56 1.75 -1.26 -5.16 119.30 115.62 1oac s MET 306 Ca 0.71 0.14 0.04 0.00 -1.25 0.00 0.00 55.69 55.33 1oac s MET 306 Cb -0.23 -0.31 -0.01 0.00 2.84 0.00 0.00 34.83 37.11 1oac s MET 306 CO 0.34 -0.15 -0.12 -0.65 -0.65 0.00 0.00 175.02 173.79 1oac s GLN 307 N 1.01 0.93 -0.22 4.11 -0.21 -1.26 -5.03 119.66 118.99 1oac s GLN 307 Ca -0.09 -0.52 -0.03 0.00 0.02 0.00 0.00 55.36 54.75 1oac s GLN 307 Cb -0.13 -0.91 0.00 0.00 1.00 0.00 0.00 33.01 32.98 1oac s GLN 307 CO -0.02 0.24 -0.07 0.42 -2.12 0.00 0.00 175.29 173.73 1oac s ILE 308 N -0.46 3.04 0.12 1.08 1.01 -1.26 -5.11 121.20 119.61 1oac s ILE 308 Ca 0.03 -0.69 0.08 0.00 0.00 0.00 0.00 60.65 60.07 1oac s ILE 308 Cb -0.06 -2.40 -0.04 0.00 0.01 0.00 0.00 42.46 39.97 1oac s ILE 308 CO 0.00 0.39 -0.18 0.27 0.00 0.00 0.00 174.94 175.42 1oac s ILE 309 N 1.41 1.61 -0.47 2.92 -4.36 -1.26 -3.83 121.20 117.22 1oac s ILE 309 Ca 0.04 -1.63 0.03 0.00 -0.26 0.00 0.00 60.65 58.84 1oac s ILE 309 Cb -0.15 -1.56 0.15 0.00 1.25 0.00 0.00 42.46 42.16 1oac s ILE 309 CO -0.05 -0.19 0.32 -1.61 0.24 0.00 0.00 174.94 173.65 1oac s GLU 310 N -2.20 1.30 0.45 0.37 2.02 -1.26 -5.01 118.70 114.37 1oac s GLU 310 Ca 0.08 -2.23 0.31 0.00 0.02 0.00 0.00 54.97 53.15 1oac s GLU 310 Cb -0.08 -2.11 1.40 0.00 0.10 0.00 0.00 34.13 33.44 1oac s GLU 310 CO 0.04 -1.27 1.92 -1.00 0.02 0.00 0.00 175.26 174.97 1oac h PRO 311 N 6.12 0.00 -0.40 0.39 0.13 -1.98 -2.63 132.00 133.63 1oac h PRO 311 Ca 0.13 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.26 1oac h PRO 311 Cb 0.89 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.02 1oac h PRO 311 CO 0.46 0.00 0.00 0.39 -0.23 0.00 0.00 178.00 178.62 1oac n GLU 312 N -2.70 3.22 0.00 0.86 1.02 -1.26 -3.39 120.64 118.39 1oac n GLU 312 Ca 0.00 -2.62 0.00 0.00 -0.02 0.00 0.00 57.16 54.52 1oac n GLU 312 Cb 0.20 -1.70 0.00 0.00 -0.02 0.00 0.00 31.44 29.93 1oac n GLU 312 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1oac n GLY 313 N 0.30 -3.13 3.97 0.62 0.00 -0.99 -4.80 105.19 101.15 1oac n GLY 313 Ca 0.20 -2.11 -0.21 0.00 0.00 0.00 0.00 46.02 43.90 1oac n GLY 313 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1oac s LYS 314 N -0.64 3.29 0.13 1.61 -0.14 -1.26 -4.84 119.74 117.90 1oac s LYS 314 Ca 0.00 -0.78 0.26 0.00 -1.36 0.00 0.00 55.97 54.09 1oac s LYS 314 Cb 0.00 -2.81 0.64 0.00 -1.68 0.00 0.00 37.83 33.98 1oac s LYS 314 CO 0.00 0.19 1.58 0.09 -0.76 0.00 0.00 175.35 176.45 1oac n ASN 315 N -1.60 0.66 -4.93 2.83 4.13 -1.26 -4.85 115.26 110.23 1oac n ASN 315 Ca -0.04 0.31 -0.28 0.00 1.68 0.00 0.00 54.58 56.25 1oac n ASN 315 Cb 0.57 -0.29 -0.03 0.00 -1.54 0.00 0.00 39.78 38.49 1oac n ASN 315 CO 0.00 0.00 0.00 -0.72 0.28 0.00 0.00 177.26 176.82 1oac s TYR 316 N -3.11 3.50 -0.05 3.10 1.13 -1.26 -4.44 117.35 116.22 1oac s TYR 316 Ca 0.09 0.17 0.06 0.00 -1.41 0.00 0.00 57.07 55.99 1oac s TYR 316 Cb 0.14 -1.71 -0.01 0.00 -1.10 0.00 0.00 41.96 39.28 1oac s TYR 316 CO 0.65 0.55 -0.25 0.99 -2.51 0.00 0.00 175.55 174.98 1oac s THR 317 N -1.65 2.03 -0.31 -3.49 2.01 -0.23 -4.74 115.64 109.26 1oac s THR 317 Ca 0.35 -1.06 -0.01 0.00 0.31 0.00 0.00 61.69 61.28 1oac s THR 317 Cb -0.12 -1.72 0.06 0.00 0.01 0.00 0.00 72.50 70.74 1oac s THR 317 CO 0.28 0.57 0.02 -0.63 -0.69 0.00 0.00 174.62 174.17 1oac s ILE 318 N -0.19 2.93 -0.43 1.82 1.01 0.28 -0.45 121.20 126.18 1oac s ILE 318 Ca -0.03 -1.54 -0.05 0.00 0.00 0.00 0.00 60.65 59.04 1oac s ILE 318 Cb -0.13 -2.76 0.11 0.00 0.01 0.00 0.00 42.46 39.69 1oac s ILE 318 CO 0.03 -0.20 0.25 -0.89 0.00 0.00 0.00 174.94 174.13 1oac s THR 319 N 1.21 3.57 0.00 2.92 2.01 -0.01 -0.98 115.64 124.36 1oac s THR 319 Ca -0.03 -1.98 0.00 0.00 0.31 0.00 0.00 61.69 59.99 1oac s THR 319 Cb -0.20 -3.41 0.00 0.00 0.01 0.00 0.00 72.50 68.89 1oac s THR 319 CO -0.02 -0.72 0.00 0.61 -0.69 0.00 0.00 174.62 173.80 1oac n GLY 320 N 4.69 3.07 0.67 4.40 0.00 -1.21 -1.85 105.19 114.95 1oac n GLY 320 Ca -0.04 -0.23 0.06 0.00 0.00 0.00 0.00 46.02 45.82 1oac n GLY 320 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1oac n ASP 321 N 8.96 2.78 -4.73 1.61 8.00 -1.26 -4.98 116.55 126.92 1oac n ASP 321 Ca 0.00 -1.87 -0.38 0.00 0.71 0.00 0.00 54.79 53.25 1oac n ASP 321 Cb 0.00 -0.19 -0.06 0.00 -0.02 0.00 0.00 41.12 40.85 1oac n ASP 321 CO 0.00 0.00 0.00 -0.04 -0.39 0.00 0.00 177.20 176.77 1oac s MET 322 N -1.02 4.34 -0.17 -1.24 -1.94 -0.77 -1.13 119.30 117.37 1oac s MET 322 Ca 0.23 0.55 -0.05 0.00 -1.71 0.00 0.00 55.69 54.70 1oac s MET 322 Cb 0.13 -3.42 -0.03 0.00 2.01 0.00 0.00 34.83 33.52 1oac s MET 322 CO 0.17 0.19 0.00 0.42 -0.01 0.00 0.00 175.02 175.80 1oac s ILE 323 N 0.49 4.21 -0.15 2.53 1.01 -0.31 -0.83 121.20 128.15 1oac s ILE 323 Ca 0.28 -0.24 0.01 0.00 0.00 0.00 0.00 60.65 60.70 1oac s ILE 323 Cb -0.16 -2.88 0.01 0.00 0.01 0.00 0.00 42.46 39.44 1oac s ILE 323 CO 0.12 0.47 -0.18 -2.28 0.00 0.00 0.00 174.94 173.07 1oac s HIS 324 N 0.51 2.75 -0.20 3.97 5.65 0.40 -1.70 115.29 126.67 1oac s HIS 324 Ca -0.01 -1.23 -0.04 0.00 0.25 0.00 0.00 55.06 54.03 1oac s HIS 324 Cb -0.14 -1.87 0.10 0.00 -1.18 0.00 0.00 32.58 29.49 1oac s HIS 324 CO 0.02 -0.57 0.33 -0.46 -0.65 0.00 0.00 174.74 173.41 1oac s TRP 325 N 0.90 -0.62 0.00 3.88 -0.00 -0.56 -1.07 118.94 121.47 1oac s TRP 325 Ca -0.04 0.92 0.00 0.00 -0.00 0.00 0.00 56.10 56.97 1oac s TRP 325 Cb -0.15 0.00 0.00 0.00 -0.00 0.00 0.00 33.47 33.32 1oac s TRP 325 CO -0.02 -0.55 0.00 0.54 -0.00 0.00 0.00 176.95 176.91 1oac n ARG 326 N 5.36 0.00 -0.02 5.86 5.12 -1.26 -0.81 116.66 130.91 1oac n ARG 326 Ca -0.06 0.00 0.13 0.00 -1.93 0.00 0.00 57.85 55.99 1oac n ARG 326 Cb 0.50 0.00 0.34 0.00 -1.16 0.00 0.00 32.46 32.14 1oac n ARG 326 CO 0.00 0.00 0.00 0.09 -1.93 0.00 0.00 177.63 175.79 1oac n ASN 327 N 7.46 2.16 -4.92 0.55 5.03 -1.26 -4.93 115.26 119.34 1oac n ASN 327 Ca 0.00 -1.72 -0.29 0.00 0.87 0.00 0.00 54.58 53.44 1oac n ASN 327 Cb 0.00 -0.03 -0.04 0.00 -1.02 0.00 0.00 39.78 38.70 1oac n ASN 327 CO 0.00 0.00 0.00 0.26 -1.83 0.00 0.00 177.26 175.69 1oac s TRP 328 N -1.94 3.49 -0.08 3.10 0.52 0.01 -0.34 118.94 123.69 1oac s TRP 328 Ca 0.34 0.32 -0.04 0.00 0.02 0.00 0.00 56.10 56.74 1oac s TRP 328 Cb 0.20 -1.82 0.04 0.00 -1.15 0.00 0.00 33.47 30.74 1oac s TRP 328 CO 0.31 0.46 0.18 -0.51 0.02 0.00 0.00 176.95 177.41 1oac s ASP 329 N -2.91 -0.00 0.18 2.95 1.01 -1.06 -1.50 116.67 115.33 1oac s ASP 329 Ca 0.37 0.37 -0.16 0.00 0.71 0.00 0.00 52.55 53.84 1oac s ASP 329 Cb -0.12 0.27 0.02 0.00 1.01 0.00 0.00 42.92 44.11 1oac s ASP 329 CO 0.28 -0.17 0.47 0.72 0.21 0.00 0.00 175.17 176.68 1oac s PHE 330 N 1.41 -0.06 -0.10 4.23 -0.71 -0.69 -1.84 117.98 120.22 1oac s PHE 330 Ca -0.07 -0.28 -0.01 0.00 -1.04 0.00 0.00 56.93 55.53 1oac s PHE 330 Cb -0.11 0.31 -0.03 0.00 -1.21 0.00 0.00 43.02 41.97 1oac s PHE 330 CO -0.07 -0.85 -0.04 -1.58 -1.34 0.00 0.00 175.22 171.34 1oac s HIS 331 N -3.87 3.01 -0.15 3.49 2.46 0.60 -1.16 115.29 119.66 1oac s HIS 331 Ca 0.09 -0.02 0.02 0.00 0.47 0.00 0.00 55.06 55.61 1oac s HIS 331 Cb 0.00 -1.80 0.01 0.00 -0.13 0.00 0.00 32.58 30.67 1oac s HIS 331 CO -0.04 0.27 -0.20 -1.17 -2.47 0.00 0.00 174.74 171.12 1oac s LEU 332 N -0.51 2.18 0.15 8.88 2.96 -0.28 -0.28 118.68 131.78 1oac s LEU 332 Ca 0.08 -0.59 -0.01 0.00 -0.22 0.00 0.00 54.13 53.39 1oac s LEU 332 Cb -0.12 -1.48 -0.04 0.00 0.50 0.00 0.00 46.19 45.05 1oac s LEU 332 CO 0.02 0.06 0.07 -0.94 -1.32 0.00 0.00 176.35 174.24 1oac s SER 333 N 0.95 0.31 0.01 3.68 1.04 -0.69 -4.78 113.70 114.22 1oac s SER 333 Ca -0.04 -1.25 0.07 0.00 0.48 0.00 0.00 55.95 55.21 1oac s SER 333 Cb -0.15 0.31 -0.03 0.00 0.10 0.00 0.00 66.02 66.25 1oac s SER 333 CO -0.04 -0.75 -0.22 -0.32 0.98 0.00 0.00 173.24 172.88 1oac s MET 334 N -4.07 2.07 -0.02 4.02 1.75 -1.26 -0.96 119.30 120.84 1oac s MET 334 Ca 0.28 -0.96 0.03 0.00 -1.25 0.00 0.00 55.69 53.79 1oac s MET 334 Cb 0.07 -2.12 -0.00 0.00 2.84 0.00 0.00 34.83 35.62 1oac s MET 334 CO 0.05 0.55 -0.11 1.21 -0.65 0.00 0.00 175.02 176.07 1oac s ASN 335 N -1.03 1.34 0.36 1.11 3.84 0.19 -4.94 114.94 115.80 1oac s ASN 335 Ca 0.12 -0.21 0.14 0.00 0.21 0.00 0.00 52.86 53.12 1oac s ASN 335 Cb -0.10 -0.23 0.68 0.00 -0.55 0.00 0.00 41.25 41.05 1oac s ASN 335 CO 0.02 0.12 1.78 0.77 -2.79 0.00 0.00 177.10 176.99 1oac h SER 336 N 6.04 0.00 0.00 -4.21 4.64 -1.91 0.12 113.55 118.23 1oac h SER 336 Ca -0.33 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 60.98 1oac h SER 336 Cb 1.17 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.26 1oac h SER 336 CO 0.49 0.41 -0.12 -0.09 -0.87 0.00 0.00 176.83 176.65 1oac h ARG 337 N 0.00 0.00 -0.02 4.77 2.43 -1.90 0.15 114.38 119.81 1oac h ARG 337 Ca -0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1oac h ARG 337 Cb 0.77 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.32 1oac h ARG 337 CO 0.05 0.36 -0.16 1.33 -1.51 0.00 0.00 179.97 180.04 1oac n VAL 338 N -4.69 0.00 -3.02 0.20 0.24 -1.25 -1.46 118.33 108.34 1oac n VAL 338 Ca -0.05 -0.42 0.00 0.00 -2.04 0.00 0.00 64.34 61.82 1oac n VAL 338 Cb 0.21 1.34 0.00 0.00 -1.47 0.00 0.00 33.84 33.92 1oac n VAL 338 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1oac n GLY 339 N 1.19 0.38 3.77 7.63 0.00 0.40 -4.48 105.19 114.08 1oac n GLY 339 Ca 0.10 -1.14 -0.41 0.00 0.00 0.00 0.00 46.02 44.58 1oac n GLY 339 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1oac s PRO 340 N 0.00 4.35 -0.14 1.61 0.04 -1.26 -0.64 135.00 138.96 1oac s PRO 340 Ca 0.00 2.22 0.02 0.00 0.04 0.00 0.00 61.00 63.28 1oac s PRO 340 Cb 0.00 -3.07 0.01 0.00 0.04 0.00 0.00 34.50 31.48 1oac s PRO 340 CO 0.00 -0.20 -0.19 -1.64 0.04 0.00 0.00 177.00 175.01 1oac s MET 341 N -1.78 2.74 -0.26 4.56 -1.94 -0.13 -4.33 119.30 118.16 1oac s MET 341 Ca 0.49 -0.75 -0.09 0.00 -1.71 0.00 0.00 55.69 53.63 1oac s MET 341 Cb -0.40 -2.28 -0.04 0.00 2.01 0.00 0.00 34.83 34.12 1oac s MET 341 CO 0.53 -0.07 0.12 0.42 -0.01 0.00 0.00 175.02 176.01 1oac s ILE 342 N 0.98 4.81 0.28 2.53 -1.09 0.06 -1.70 121.20 127.08 1oac s ILE 342 Ca -0.04 -0.00 0.03 0.00 -2.23 0.00 0.00 60.65 58.41 1oac s ILE 342 Cb -0.15 -3.27 -0.06 0.00 -1.58 0.00 0.00 42.46 37.41 1oac s ILE 342 CO -0.04 0.31 0.03 -0.44 -1.23 0.00 0.00 174.94 173.57 1oac s SER 343 N 1.57 2.01 -1.27 3.58 0.01 0.62 -0.79 113.70 119.42 1oac s SER 343 Ca 0.06 -1.31 -0.22 0.00 1.31 0.00 0.00 55.95 55.80 1oac s SER 343 Cb -0.15 -0.02 0.03 0.00 0.21 0.00 0.00 66.02 66.09 1oac s SER 343 CO 0.07 -0.57 0.42 0.35 0.41 0.00 0.00 173.24 173.91 1oac n THR 344 N -0.55 -1.93 -2.83 1.44 -2.24 0.23 -0.29 114.28 108.11 1oac n THR 344 Ca -0.03 -0.53 -0.42 0.00 -2.27 0.00 0.00 64.05 60.79 1oac n THR 344 Cb 0.65 -1.69 -0.04 0.00 -2.10 0.00 0.00 70.33 67.15 1oac n THR 344 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1oac s VAL 345 N -3.86 4.63 0.19 2.28 1.01 0.18 -4.31 120.40 120.52 1oac s VAL 345 Ca 0.31 1.20 0.09 0.00 0.00 0.00 0.00 61.98 63.58 1oac s VAL 345 Cb -0.17 -4.30 -0.04 0.00 0.00 0.00 0.00 36.38 31.87 1oac s VAL 345 CO 0.94 -0.48 -0.18 0.42 0.00 0.00 0.00 175.10 175.81 1oac s THR 346 N 3.36 1.89 -0.16 3.92 -4.23 -0.77 -1.41 115.64 118.25 1oac s THR 346 Ca 0.37 -2.03 0.02 0.00 -1.18 0.00 0.00 61.69 58.87 1oac s THR 346 Cb -0.12 -1.94 0.02 0.00 1.34 0.00 0.00 72.50 71.79 1oac s THR 346 CO 0.17 -0.37 -0.20 -0.47 -0.54 0.00 0.00 174.62 173.21 1oac s TYR 347 N -2.26 2.66 -0.69 3.99 6.14 -0.22 -2.58 117.35 124.39 1oac s TYR 347 Ca 0.19 -1.45 -0.25 0.00 0.64 0.00 0.00 57.07 56.20 1oac s TYR 347 Cb -0.05 -1.83 0.05 0.00 0.42 0.00 0.00 41.96 40.55 1oac s TYR 347 CO 0.08 -0.69 1.12 1.21 0.64 0.00 0.00 175.55 177.90 1oac s ASN 348 N 1.06 6.19 -0.51 4.32 3.04 0.53 0.34 114.94 129.91 1oac s ASN 348 Ca -0.01 -0.67 -0.17 0.00 0.04 0.00 0.00 52.86 52.05 1oac s ASN 348 Cb -0.14 -2.49 0.09 0.00 -1.54 0.00 0.00 41.25 37.16 1oac s ASN 348 CO -0.07 -1.62 0.49 -0.62 -3.04 0.00 0.00 177.10 172.25 1oac s ASP 349 N 3.64 6.17 -1.56 -4.21 2.15 0.23 -4.54 116.67 118.55 1oac s ASP 349 Ca 0.29 -1.35 -0.04 0.00 0.43 0.00 0.00 52.55 51.88 1oac s ASP 349 Cb -0.12 -2.22 0.04 0.00 -0.30 0.00 0.00 42.92 40.31 1oac s ASP 349 CO 0.13 -0.79 0.22 0.59 -0.17 0.00 0.00 175.17 175.16 1oac n ASN 350 N 5.51 0.05 0.00 -0.34 4.13 -1.26 -1.36 115.26 122.00 1oac n ASN 350 Ca -0.11 -1.19 0.00 0.00 1.68 0.00 0.00 54.58 54.96 1oac n ASN 350 Cb 0.43 -2.05 0.00 0.00 -1.54 0.00 0.00 39.78 36.62 1oac n ASN 350 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1oac n GLY 351 N -2.19 0.50 3.18 7.41 0.00 -1.26 -5.05 105.19 107.78 1oac n GLY 351 Ca -0.25 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.43 1oac n GLY 351 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1oac s THR 352 N -2.21 2.67 -0.12 2.61 2.01 -0.46 -5.08 115.64 115.06 1oac s THR 352 Ca 0.00 -0.98 -0.30 0.00 0.31 0.00 0.00 61.69 60.73 1oac s THR 352 Cb 0.00 -2.30 -0.02 0.00 0.01 0.00 0.00 72.50 70.19 1oac s THR 352 CO 0.00 0.30 1.20 -0.54 -0.69 0.00 0.00 174.62 174.89 1oac s LYS 353 N 1.32 4.30 -0.05 4.92 1.02 -1.26 0.74 119.74 130.73 1oac s LYS 353 Ca 0.01 1.62 0.04 0.00 0.02 0.00 0.00 55.97 57.66 1oac s LYS 353 Cb -0.16 -3.64 -0.03 0.00 -0.52 0.00 0.00 37.83 33.49 1oac s LYS 353 CO -0.07 -0.55 -0.14 1.03 -0.92 0.00 0.00 175.35 174.70 1oac s ARG 354 N 2.78 2.51 0.32 1.68 0.52 0.15 -4.90 118.95 122.01 1oac s ARG 354 Ca 0.54 -0.70 -0.29 0.00 -0.52 0.00 0.00 55.73 54.76 1oac s ARG 354 Cb -0.22 -2.38 -0.10 0.00 0.52 0.00 0.00 34.95 32.77 1oac s ARG 354 CO 0.17 0.62 1.39 0.15 0.02 0.00 0.00 175.30 177.65 1oac s LYS 355 N -0.71 4.27 0.06 3.54 1.02 -1.26 -1.05 119.74 125.61 1oac s LYS 355 Ca 0.11 2.34 0.00 0.00 0.02 0.00 0.00 55.97 58.44 1oac s LYS 355 Cb -0.11 -3.05 0.00 0.00 -0.52 0.00 0.00 37.83 34.15 1oac s LYS 355 CO 0.01 -0.34 0.00 0.28 -0.92 0.00 0.00 175.35 174.37 1oac n VAL 356 N 1.11 0.41 -3.69 3.17 0.31 -0.50 -0.55 118.33 118.60 1oac n VAL 356 Ca 0.02 0.14 -0.13 0.00 -0.01 0.00 0.00 64.34 64.36 1oac n VAL 356 Cb 0.41 -1.29 -0.13 0.00 -0.91 0.00 0.00 33.84 31.91 1oac n VAL 356 CO 0.00 0.00 0.00 -0.32 -1.32 0.00 0.00 176.83 175.19 1oac s MET 357 N -2.00 0.17 -0.03 5.55 -2.45 -0.90 -1.47 119.30 118.18 1oac s MET 357 Ca 0.00 0.68 -0.25 0.00 -1.25 0.00 0.00 55.69 54.87 1oac s MET 357 Cb 0.00 -0.06 -0.20 0.00 1.25 0.00 0.00 34.83 35.82 1oac s MET 357 CO 0.00 -0.24 1.20 -0.92 1.05 0.00 0.00 175.02 176.11 1oac h TYR 358 N 7.89 -0.06 -2.45 4.11 3.20 -1.27 0.55 116.97 128.94 1oac h TYR 358 Ca -0.24 -0.00 -0.09 0.00 3.14 0.00 0.00 58.73 61.55 1oac h TYR 358 Cb 1.13 0.02 -0.22 0.00 1.54 0.00 0.00 36.73 39.20 1oac h TYR 358 CO 0.36 0.42 -0.07 -1.21 -1.64 0.00 0.00 178.16 176.02 1oac s GLU 359 N -4.14 0.71 0.00 1.82 2.02 -1.21 -0.60 118.70 117.29 1oac s GLU 359 Ca -0.15 0.52 -0.02 0.00 0.02 0.00 0.00 54.97 55.34 1oac s GLU 359 Cb 0.01 0.34 -0.01 0.00 0.10 0.00 0.00 34.13 34.58 1oac s GLU 359 CO 0.64 -0.13 0.03 0.20 0.02 0.00 0.00 175.26 176.01 1oac s GLY 360 N -0.21 0.09 0.11 -1.39 0.00 0.03 0.69 107.32 106.64 1oac s GLY 360 Ca -0.04 -0.21 -0.26 0.00 0.00 0.00 0.00 44.72 44.21 1oac s GLY 360 CO 0.03 -0.26 1.05 -1.35 0.00 0.00 0.00 173.10 172.57 1oac s SER 361 N -0.79 -0.14 0.35 1.64 1.04 -0.83 -0.76 113.70 114.20 1oac s SER 361 Ca -0.09 -0.33 -0.29 0.00 0.48 0.00 0.00 55.95 55.72 1oac s SER 361 Cb -0.05 0.40 -0.11 0.00 0.10 0.00 0.00 66.02 66.35 1oac s SER 361 CO -0.00 -0.73 1.52 -0.11 0.98 0.00 0.00 173.24 174.89 1oac n LEU 362 N -0.48 4.58 -0.09 2.42 7.94 -1.26 -1.32 117.00 128.79 1oac n LEU 362 Ca -0.07 1.20 -0.11 0.00 -1.11 0.00 0.00 56.01 55.92 1oac n LEU 362 Cb 0.61 -1.61 -0.05 0.00 0.53 0.00 0.00 43.42 42.91 1oac n LEU 362 CO 0.13 0.13 -0.47 0.61 -1.11 0.00 0.00 177.39 176.67 1oac n GLY 363 N 1.05 -0.87 3.72 -3.96 0.00 0.12 -4.61 105.19 100.64 1oac n GLY 363 Ca 0.04 -0.09 0.01 0.00 0.00 0.00 0.00 46.02 45.97 1oac n GLY 363 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1oac s GLY 364 N -4.53 -0.30 0.17 -0.02 0.00 -0.99 -4.39 107.32 97.26 1oac s GLY 364 Ca -0.21 0.41 -0.12 0.00 0.00 0.00 0.00 44.72 44.80 1oac s GLY 364 CO 0.36 1.20 0.38 -3.16 0.00 0.00 0.00 173.10 171.87 1oac s MET 365 N -2.46 1.23 -0.12 2.90 0.00 -1.26 -0.56 119.30 119.03 1oac s MET 365 Ca 0.17 -1.03 -0.15 0.00 0.00 0.00 0.00 55.69 54.68 1oac s MET 365 Cb 0.02 0.43 0.04 0.00 0.00 0.00 0.00 34.83 35.32 1oac s MET 365 CO -0.02 -0.48 0.39 -1.50 0.00 0.00 0.00 175.02 173.41 1oac s ILE 366 N -3.92 0.01 -0.51 3.16 2.07 -0.24 -3.82 121.20 117.95 1oac s ILE 366 Ca 0.13 -0.11 0.03 0.00 -1.41 0.00 0.00 60.65 59.30 1oac s ILE 366 Cb 0.02 -0.59 0.14 0.00 0.13 0.00 0.00 42.46 42.16 1oac s ILE 366 CO -0.02 -0.06 0.29 -0.69 -1.91 0.00 0.00 174.94 172.55 1oac s VAL 367 N -0.19 2.08 0.06 4.00 1.01 0.02 -0.92 120.40 126.47 1oac s VAL 367 Ca -0.03 -3.14 -0.12 0.00 0.00 0.00 0.00 61.98 58.68 1oac s VAL 367 Cb -0.03 -2.43 -0.06 0.00 0.00 0.00 0.00 36.38 33.86 1oac s VAL 367 CO 0.02 -0.89 0.43 -2.16 0.00 0.00 0.00 175.10 172.50 1oac s PRO 368 N -0.21 3.86 0.22 2.72 0.04 -1.24 -1.34 135.00 139.05 1oac s PRO 368 Ca 0.19 0.32 0.05 0.00 0.04 0.00 0.00 61.00 61.60 1oac s PRO 368 Cb -0.21 -3.07 -0.03 0.00 0.04 0.00 0.00 34.50 31.23 1oac s PRO 368 CO -0.03 0.59 0.32 0.71 0.04 0.00 0.00 177.00 178.63 1oac s TYR 369 N -1.29 3.41 -0.36 0.56 1.51 -0.97 -2.26 117.35 117.94 1oac s TYR 369 Ca 0.30 0.00 0.15 0.00 -1.01 0.00 0.00 57.07 56.52 1oac s TYR 369 Cb -0.15 -1.57 0.50 0.00 -0.11 0.00 0.00 41.96 40.63 1oac s TYR 369 CO 0.17 0.47 1.41 0.41 -1.11 0.00 0.00 175.55 176.89 1oac n GLY 370 N -1.15 3.70 3.68 0.71 0.00 -0.51 -4.97 105.19 106.66 1oac n GLY 370 Ca -0.08 -0.89 -0.35 0.00 0.00 0.00 0.00 46.02 44.69 1oac n GLY 370 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1oac s ASP 371 N -1.67 5.59 0.00 1.61 -1.08 -1.26 -4.97 116.67 114.89 1oac s ASP 371 Ca 0.39 0.16 0.27 0.00 -0.52 0.00 0.00 52.55 52.85 1oac s ASP 371 Cb 0.30 -1.82 0.98 0.00 -1.46 0.00 0.00 42.92 40.92 1oac s ASP 371 CO 0.11 0.28 1.71 -0.81 0.52 0.00 0.00 175.17 176.98 1oac n PRO 372 N 2.83 0.49 -0.72 4.34 -0.04 -1.26 -2.51 135.00 138.13 1oac n PRO 372 Ca -0.18 -0.21 -0.30 0.00 -0.04 0.00 0.00 63.50 62.77 1oac n PRO 372 Cb 0.53 -1.50 0.20 0.00 -0.04 0.00 0.00 33.50 32.70 1oac n PRO 372 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1oac s ASP 373 N -2.65 2.14 0.23 3.54 1.11 -1.26 -4.34 116.67 115.43 1oac s ASP 373 Ca 0.22 1.77 -0.06 0.00 0.18 0.00 0.00 52.55 54.66 1oac s ASP 373 Cb 0.19 -2.38 0.38 0.00 1.07 0.00 0.00 42.92 42.17 1oac s ASP 373 CO 0.54 -3.52 1.75 -0.29 1.18 0.00 0.00 175.17 174.83 1oac h ILE 374 N -2.16 0.76 -0.04 0.77 6.09 -1.98 0.03 117.51 120.99 1oac h ILE 374 Ca -0.53 -0.18 0.00 0.00 -1.37 0.00 0.00 64.86 62.79 1oac h ILE 374 Cb 1.30 0.20 0.00 0.00 0.47 0.00 0.00 36.82 38.79 1oac h ILE 374 CO 0.48 0.09 0.00 0.61 -3.07 0.00 0.00 178.15 176.26 1oac n GLY 375 N -1.31 -0.35 0.00 8.18 0.00 -1.26 -4.48 105.19 105.97 1oac n GLY 375 Ca 0.12 -0.33 0.00 0.00 0.00 0.00 0.00 46.02 45.81 1oac n GLY 375 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1oac n TRP 376 N -0.24 0.00 -0.16 1.61 7.02 -0.63 -4.83 117.44 120.21 1oac n TRP 376 Ca 0.19 0.00 0.24 0.00 -1.02 0.00 0.00 57.50 56.91 1oac n TRP 376 Cb 0.25 0.00 0.65 0.00 -2.42 0.00 0.00 31.31 29.78 1oac n TRP 376 CO 0.00 0.00 0.00 0.10 -2.02 0.00 0.00 177.69 175.77 1oac h TYR 377 N 0.00 0.18 -0.01 -5.99 -0.00 -0.72 0.18 116.97 110.61 1oac h TYR 377 Ca 0.00 0.01 0.00 0.00 0.00 0.00 0.00 58.73 58.74 1oac h TYR 377 Cb 0.55 -0.06 0.00 0.00 0.00 0.00 0.00 36.73 37.22 1oac h TYR 377 CO 0.00 0.05 -0.75 1.97 -0.00 0.00 0.00 178.16 179.43 1oac n PHE 378 N -4.37 0.00 -1.95 0.10 -1.74 -1.26 -4.97 117.46 103.26 1oac n PHE 378 Ca 0.17 0.00 -0.43 0.00 -0.56 0.00 0.00 57.45 56.63 1oac n PHE 378 Cb 0.80 -0.00 -0.03 0.00 1.52 0.00 0.00 39.48 41.77 1oac n PHE 378 CO 0.00 0.00 0.00 0.21 -0.56 0.00 0.00 176.76 176.41 1oac s LYS 379 N -2.75 3.56 -0.28 3.97 2.20 0.05 -4.70 119.74 121.79 1oac s LYS 379 Ca 0.13 1.73 -0.03 0.00 -0.36 0.00 0.00 55.97 57.44 1oac s LYS 379 Cb 0.17 -4.16 0.17 0.00 -1.51 0.00 0.00 37.83 32.50 1oac s LYS 379 CO 0.73 -1.59 0.55 0.00 -0.36 0.00 0.00 175.35 174.68 1oac s ALA 380 N 6.21 -1.93 -0.25 3.13 0.00 -1.26 -2.30 121.76 125.35 1oac s ALA 380 Ca 0.81 1.68 -0.22 0.00 0.00 0.00 0.00 51.96 54.23 1oac s ALA 380 Cb -0.27 -1.98 -0.01 0.00 0.00 0.00 0.00 23.12 20.85 1oac s ALA 380 CO 0.33 -1.25 0.70 0.71 0.00 0.00 0.00 175.76 176.25 1oac s TYR 381 N 2.78 3.28 -1.05 0.00 2.02 -0.45 -4.86 117.35 119.08 1oac s TYR 381 Ca 0.15 0.90 -0.05 0.00 -0.37 0.00 0.00 57.07 57.71 1oac s TYR 381 Cb -0.15 -2.92 0.29 0.00 -0.40 0.00 0.00 41.96 38.78 1oac s TYR 381 CO -0.19 -0.36 1.27 1.28 -1.57 0.00 0.00 175.55 175.98 1oac n LEU 382 N 5.83 5.81 -0.11 -1.29 4.77 -1.26 -0.80 117.00 129.95 1oac n LEU 382 Ca 0.01 -5.17 -0.07 0.00 -0.03 0.00 0.00 56.01 50.75 1oac n LEU 382 Cb 0.48 -1.28 -0.00 0.00 -2.33 0.00 0.00 43.42 40.29 1oac n LEU 382 CO 0.45 1.60 0.68 0.44 -1.33 0.00 0.00 177.39 179.23 1oac h ASP 383 N 5.76 -0.88 0.07 -1.43 3.32 -1.93 0.36 116.42 121.68 1oac h ASP 383 Ca 0.19 0.17 -0.00 0.00 0.02 0.00 0.00 57.03 57.41 1oac h ASP 383 Cb 0.71 0.43 0.00 0.00 0.22 0.00 0.00 39.33 40.69 1oac h ASP 383 CO 1.17 -0.28 -0.03 0.77 -1.72 0.00 0.00 179.24 179.14 1oac h SER 384 N -0.21 -0.07 0.06 6.45 4.64 -1.83 -2.28 113.55 120.30 1oac h SER 384 Ca 0.18 -0.46 -0.00 0.00 -0.47 0.00 0.00 61.79 61.03 1oac h SER 384 Cb 0.49 0.02 0.00 0.00 -0.31 0.00 0.00 62.40 62.60 1oac h SER 384 CO -0.49 0.45 -0.03 1.23 -0.87 0.00 0.00 176.83 177.12 1oac h GLY 385 N -0.63 -0.09 1.33 -0.77 0.00 -1.80 0.13 103.07 101.24 1oac h GLY 385 Ca -0.01 0.03 -0.11 0.00 0.00 0.00 0.00 47.33 47.24 1oac h GLY 385 CO 0.01 -0.03 -1.01 -0.55 0.00 0.00 0.00 176.54 174.97 1oac h ASP 386 N -0.11 0.00 0.00 0.19 3.32 -0.43 -3.42 116.42 115.97 1oac h ASP 386 Ca -0.01 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.04 1oac h ASP 386 Cb 0.09 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.64 1oac h ASP 386 CO 0.01 0.42 -0.80 -1.22 -1.72 0.00 0.00 179.24 175.94 1oac n TYR 387 N -2.96 0.00 -1.79 4.55 4.02 -0.90 0.03 117.16 120.11 1oac n TYR 387 Ca -0.04 0.00 -0.01 0.00 -0.01 0.00 0.00 57.90 57.84 1oac n TYR 387 Cb 0.74 0.00 -0.01 0.00 -0.02 0.00 0.00 39.34 40.05 1oac n TYR 387 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1oac n GLY 388 N 2.13 -3.43 0.15 2.72 0.00 0.03 -4.81 105.19 101.97 1oac n GLY 388 Ca 0.00 0.10 -0.02 0.00 0.00 0.00 0.00 46.02 46.10 1oac n GLY 388 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 1oac h MET 389 N 0.96 0.06 -0.19 1.61 2.86 -1.26 -2.48 114.93 116.48 1oac h MET 389 Ca -0.10 -0.04 -0.01 0.00 -2.06 0.00 0.00 59.70 57.49 1oac h MET 389 Cb 0.22 0.01 -0.01 0.00 0.06 0.00 0.00 31.60 31.88 1oac h MET 389 CO 0.01 0.63 0.08 0.78 1.06 0.00 0.00 176.91 179.47 1oac h GLY 390 N 1.70 0.31 1.02 8.32 0.00 -1.05 -2.47 103.07 110.90 1oac h GLY 390 Ca -0.01 -0.17 0.05 0.00 0.00 0.00 0.00 47.33 47.21 1oac h GLY 390 CO 0.08 0.16 0.52 -0.84 0.00 0.00 0.00 176.54 176.46 1oac h THR 391 N 0.16 1.07 -0.69 4.70 2.02 -1.20 -2.05 112.91 116.93 1oac h THR 391 Ca 0.06 -0.31 -0.25 0.00 0.77 0.00 0.00 66.41 66.68 1oac h THR 391 Cb 0.17 0.08 -0.15 0.00 -1.74 0.00 0.00 68.15 66.51 1oac h THR 391 CO -0.01 0.17 0.32 0.18 0.37 0.00 0.00 175.52 176.55 1oac n LEU 392 N -4.47 5.69 -4.70 2.58 4.77 -0.94 -4.99 117.00 114.93 1oac n LEU 392 Ca 0.11 -2.98 -0.43 0.00 -0.03 0.00 0.00 56.01 52.69 1oac n LEU 392 Cb 0.18 -0.73 -0.01 0.00 -2.33 0.00 0.00 43.42 40.52 1oac n LEU 392 CO 0.34 0.80 0.93 0.41 -1.33 0.00 0.00 177.39 178.53 1oac n THR 393 N -0.29 1.92 -3.73 -5.08 -1.04 -0.77 -2.35 114.28 102.93 1oac n THR 393 Ca 0.39 -0.48 -0.37 0.00 -2.04 0.00 0.00 64.05 61.56 1oac n THR 393 Cb 1.31 -1.59 -0.11 0.00 -1.82 0.00 0.00 70.33 68.12 1oac n THR 393 CO 0.00 0.00 0.00 -0.44 -0.64 0.00 0.00 175.07 173.99 1oac s SER 394 N -0.25 5.66 0.19 8.00 0.01 0.12 -4.86 113.70 122.57 1oac s SER 394 Ca 0.56 -0.04 -0.33 0.00 1.31 0.00 0.00 55.95 57.45 1oac s SER 394 Cb -0.57 -2.02 -0.14 0.00 0.21 0.00 0.00 66.02 63.50 1oac s SER 394 CO 0.61 0.01 1.49 -2.65 0.41 0.00 0.00 173.24 173.11 1oac n PRO 395 N 4.62 2.04 -2.08 12.44 -0.02 -1.26 -4.57 135.00 146.16 1oac n PRO 395 Ca -0.15 0.73 -0.42 0.00 -2.02 0.00 0.00 63.50 61.64 1oac n PRO 395 Cb 0.52 -2.44 -0.03 0.00 -0.02 0.00 0.00 33.50 31.53 1oac n PRO 395 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1oac s ILE 396 N 0.45 2.98 -0.65 4.25 1.01 0.33 -4.95 121.20 124.62 1oac s ILE 396 Ca 0.74 0.73 -0.27 0.00 0.00 0.00 0.00 60.65 61.86 1oac s ILE 396 Cb -0.68 -3.47 0.04 0.00 0.01 0.00 0.00 42.46 38.35 1oac s ILE 396 CO 0.44 0.07 1.17 0.00 0.00 0.00 0.00 174.94 176.62 1oac s ALA 397 N 0.82 2.93 0.07 9.38 0.00 -1.26 -4.96 121.76 128.75 1oac s ALA 397 Ca 0.64 -1.19 -0.37 0.00 0.00 0.00 0.00 51.96 51.05 1oac s ALA 397 Cb -0.40 -4.07 -0.18 0.00 0.00 0.00 0.00 23.12 18.47 1oac s ALA 397 CO 0.33 -2.89 1.11 -2.13 0.00 0.00 0.00 175.76 172.18 1oac n ARG 398 N 8.62 0.52 0.00 0.00 0.63 -1.26 -1.64 116.66 123.52 1oac n ARG 398 Ca 0.04 0.19 0.00 0.00 -0.92 0.00 0.00 57.85 57.16 1oac n ARG 398 Cb 0.48 -1.67 0.00 0.00 0.45 0.00 0.00 32.46 31.72 1oac n ARG 398 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1oac n GLY 399 N 1.92 2.82 0.98 5.14 0.00 -0.82 -4.72 105.19 110.51 1oac n GLY 399 Ca 0.18 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.20 1oac n GLY 399 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1oac n LYS 400 N -2.00 0.04 0.23 1.61 5.02 -0.83 -4.68 118.16 117.56 1oac n LYS 400 Ca 0.00 0.01 0.13 0.00 -2.02 0.00 0.00 58.31 56.44 1oac n LYS 400 Cb 0.00 -0.57 0.28 0.00 -0.02 0.00 0.00 35.03 34.72 1oac n LYS 400 CO 0.00 0.00 0.00 -0.44 -0.52 0.00 0.00 177.40 176.44 1oac h ASP 401 N -0.07 0.00 -5.04 4.39 3.32 -1.60 -3.45 116.42 113.97 1oac h ASP 401 Ca -0.00 0.00 -0.11 0.00 0.02 0.00 0.00 57.03 56.94 1oac h ASP 401 Cb 0.07 0.00 -0.18 0.00 0.22 0.00 0.00 39.33 39.44 1oac h ASP 401 CO -0.00 0.00 -0.36 0.00 -1.72 0.00 0.00 179.24 177.16 1oac s ALA 402 N -3.31 -0.49 0.80 3.45 0.00 -1.26 -4.97 121.76 115.99 1oac s ALA 402 Ca 0.06 -0.11 -0.10 0.00 0.00 0.00 0.00 51.96 51.81 1oac s ALA 402 Cb 0.06 0.23 0.08 0.00 0.00 0.00 0.00 23.12 23.49 1oac s ALA 402 CO 0.64 -0.33 1.10 -1.25 0.00 0.00 0.00 175.76 175.92 1oac s PRO 403 N -2.20 1.99 0.57 0.00 0.04 -1.26 -1.94 135.00 132.19 1oac s PRO 403 Ca -0.08 1.21 0.38 0.00 0.04 0.00 0.00 61.00 62.56 1oac s PRO 403 Cb -0.03 -1.86 2.03 0.00 0.04 0.00 0.00 34.50 34.68 1oac s PRO 403 CO -0.02 -1.85 2.17 0.66 0.04 0.00 0.00 177.00 178.00 1oac h SER 404 N -1.28 0.00 -0.42 6.66 4.64 -1.88 -1.49 113.55 119.78 1oac h SER 404 Ca -0.44 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.88 1oac h SER 404 Cb 1.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.33 1oac h SER 404 CO 0.50 0.00 0.00 -0.46 -0.87 0.00 0.00 176.83 176.00 1oac n ASN 405 N -2.88 3.03 -4.86 4.97 6.94 -1.25 -4.91 115.26 116.30 1oac n ASN 405 Ca -0.02 -2.22 -0.31 0.00 -0.02 0.00 0.00 54.58 52.01 1oac n ASN 405 Cb 0.09 -0.43 0.03 0.00 -2.36 0.00 0.00 39.78 37.11 1oac n ASN 405 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1oac s ALA 406 N -1.66 2.97 -0.19 -2.53 0.00 -0.56 -4.76 121.76 115.03 1oac s ALA 406 Ca 0.32 -0.10 -0.06 0.00 0.00 0.00 0.00 51.96 52.11 1oac s ALA 406 Cb 0.20 -3.09 -0.03 0.00 0.00 0.00 0.00 23.12 20.20 1oac s ALA 406 CO 0.17 -0.89 0.03 0.08 0.00 0.00 0.00 175.76 175.15 1oac s VAL 407 N -3.18 4.39 -0.18 0.00 1.01 -0.14 -4.52 120.40 117.78 1oac s VAL 407 Ca 0.56 -0.17 -0.05 0.00 0.00 0.00 0.00 61.98 62.32 1oac s VAL 407 Cb -0.12 -2.98 -0.03 0.00 0.00 0.00 0.00 36.38 33.25 1oac s VAL 407 CO 0.54 0.44 0.01 -0.76 0.00 0.00 0.00 175.10 175.33 1oac s LEU 408 N 0.67 3.40 0.03 3.92 1.43 -1.26 -1.30 118.68 125.56 1oac s LEU 408 Ca 0.02 -0.11 0.00 0.00 -1.03 0.00 0.00 54.13 53.01 1oac s LEU 408 Cb -0.14 -1.85 -0.04 0.00 0.03 0.00 0.00 46.19 44.20 1oac s LEU 408 CO 0.02 0.12 0.12 -0.76 0.23 0.00 0.00 176.35 176.08 1oac s LEU 409 N 0.66 4.03 0.04 1.79 1.43 0.78 -4.81 118.68 122.60 1oac s LEU 409 Ca 0.00 0.16 -0.03 0.00 -1.03 0.00 0.00 54.13 53.23 1oac s LEU 409 Cb -0.14 -2.49 -0.04 0.00 0.03 0.00 0.00 46.19 43.54 1oac s LEU 409 CO 0.02 0.23 0.25 0.20 0.23 0.00 0.00 176.35 177.28 1oac s ASN 410 N -2.05 6.42 0.02 2.29 -0.87 -1.26 0.13 114.94 119.62 1oac s ASN 410 Ca 0.27 0.42 0.01 0.00 -1.57 0.00 0.00 52.86 51.99 1oac s ASN 410 Cb -0.12 -2.03 -0.02 0.00 -0.02 0.00 0.00 41.25 39.06 1oac s ASN 410 CO 0.19 0.19 -0.05 -1.61 -2.57 0.00 0.00 177.10 173.26 1oac s GLU 411 N -2.20 0.37 -0.11 -0.60 0.41 0.81 -4.90 118.70 112.48 1oac s GLU 411 Ca 0.32 -0.57 -0.00 0.00 -0.41 0.00 0.00 54.97 54.31 1oac s GLU 411 Cb -0.13 -0.10 -0.02 0.00 -1.78 0.00 0.00 34.13 32.10 1oac s GLU 411 CO 0.22 0.01 -0.10 0.99 -0.49 0.00 0.00 175.26 175.89 1oac s THR 412 N -1.17 3.36 0.24 3.63 2.01 -1.26 0.13 115.64 122.58 1oac s THR 412 Ca -0.11 -0.57 0.01 0.00 0.31 0.00 0.00 61.69 61.33 1oac s THR 412 Cb -0.08 -2.40 -0.05 0.00 0.01 0.00 0.00 72.50 69.98 1oac s THR 412 CO -0.00 0.54 0.09 0.27 -0.69 0.00 0.00 174.62 174.83 1oac s ILE 413 N -0.08 0.49 0.25 1.82 -4.36 -0.64 -4.93 121.20 113.75 1oac s ILE 413 Ca -0.01 -2.00 -0.25 0.00 -0.26 0.00 0.00 60.65 58.14 1oac s ILE 413 Cb -0.14 -2.56 -0.09 0.00 1.25 0.00 0.00 42.46 40.93 1oac s ILE 413 CO 0.03 -0.05 0.85 0.00 0.24 0.00 0.00 174.94 176.01 1oac s ALA 414 N -3.81 3.33 0.72 2.27 0.00 -1.26 0.50 121.76 123.51 1oac s ALA 414 Ca 0.36 0.41 -0.03 0.00 0.00 0.00 0.00 51.96 52.71 1oac s ALA 414 Cb 0.08 -3.05 0.07 0.00 0.00 0.00 0.00 23.12 20.22 1oac s ALA 414 CO 0.12 0.24 0.45 -0.40 0.00 0.00 0.00 175.76 176.18 1oac n ASP 415 N 0.96 0.34 0.00 0.00 5.68 0.34 -4.83 116.55 119.04 1oac n ASP 415 Ca -0.01 -1.35 0.11 0.00 -0.50 0.00 0.00 54.79 53.04 1oac n ASP 415 Cb 0.50 -0.32 0.62 0.00 -1.14 0.00 0.00 41.12 40.78 1oac n ASP 415 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1oac n TYR 416 N -2.28 0.00 0.87 2.11 4.11 -1.26 -1.90 117.16 118.81 1oac n TYR 416 Ca 0.07 0.00 0.10 0.00 -0.00 0.00 0.00 57.90 58.07 1oac n TYR 416 Cb 0.23 -0.14 0.06 0.00 -0.00 0.00 0.00 39.34 39.49 1oac n TYR 416 CO 0.00 0.00 0.00 0.25 -0.00 0.00 0.00 176.86 177.11 1oac n THR 417 N -1.14 0.00 -0.48 -3.48 -2.24 -1.26 -0.65 114.28 105.03 1oac n THR 417 Ca 0.14 -0.45 0.00 0.00 -2.27 0.00 0.00 64.05 61.47 1oac n THR 417 Cb 0.13 1.38 0.00 0.00 -2.10 0.00 0.00 70.33 69.74 1oac n THR 417 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1oac n GLY 418 N 1.20 0.74 3.75 3.38 0.00 -0.80 -4.90 105.19 108.57 1oac n GLY 418 Ca 0.11 -0.17 -0.36 0.00 0.00 0.00 0.00 46.02 45.60 1oac n GLY 418 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1oac s VAL 419 N -2.00 4.99 0.31 1.61 1.01 -1.26 -4.65 120.40 120.40 1oac s VAL 419 Ca 0.00 0.02 -0.30 0.00 0.00 0.00 0.00 61.98 61.70 1oac s VAL 419 Cb 0.00 -3.18 -0.12 0.00 0.00 0.00 0.00 36.38 33.08 1oac s VAL 419 CO 0.00 0.57 1.47 -2.65 0.00 0.00 0.00 175.10 174.49 1oac n PRO 420 N 2.50 2.42 -4.07 2.72 -0.02 -1.26 -0.50 135.00 136.79 1oac n PRO 420 Ca -0.18 0.86 -0.31 0.00 -2.02 0.00 0.00 63.50 61.84 1oac n PRO 420 Cb 0.54 -2.56 -0.16 0.00 -0.02 0.00 0.00 33.50 31.30 1oac n PRO 420 CO 0.00 0.00 0.00 1.41 1.98 0.00 0.00 175.50 178.89 1oac s MET 421 N -1.05 2.61 -0.16 -0.52 1.75 0.18 -4.80 119.30 117.32 1oac s MET 421 Ca 0.61 -0.70 -0.18 0.00 -1.25 0.00 0.00 55.69 54.17 1oac s MET 421 Cb -0.54 -2.34 -0.04 0.00 2.84 0.00 0.00 34.83 34.75 1oac s MET 421 CO 0.54 -0.23 0.50 -2.00 -0.65 0.00 0.00 175.02 173.18 1oac s GLU 422 N 1.39 4.26 -0.28 4.11 2.12 -1.26 -1.62 118.70 127.42 1oac s GLU 422 Ca 0.05 0.43 -0.10 0.00 0.36 0.00 0.00 54.97 55.70 1oac s GLU 422 Cb -0.13 -3.50 -0.04 0.00 0.26 0.00 0.00 34.13 30.72 1oac s GLU 422 CO -0.12 0.00 0.17 0.42 -0.54 0.00 0.00 175.26 175.19 1oac s ILE 423 N 1.14 5.02 0.24 -3.70 1.01 0.34 -4.93 121.20 120.32 1oac s ILE 423 Ca 0.25 -0.02 -0.30 0.00 0.00 0.00 0.00 60.65 60.58 1oac s ILE 423 Cb -0.15 -3.43 -0.09 0.00 0.01 0.00 0.00 42.46 38.80 1oac s ILE 423 CO 0.10 0.21 0.98 -2.16 0.00 0.00 0.00 174.94 174.08 1oac s PRO 424 N 1.71 4.79 -1.46 2.79 0.04 -1.26 -0.14 135.00 141.47 1oac s PRO 424 Ca 0.06 1.57 -0.08 0.00 0.04 0.00 0.00 61.00 62.60 1oac s PRO 424 Cb -0.16 -3.26 0.05 0.00 0.04 0.00 0.00 34.50 31.17 1oac s PRO 424 CO 0.09 0.42 0.78 0.54 0.04 0.00 0.00 177.00 178.87 1oac n ARG 425 N 1.51 -4.71 0.02 4.56 1.74 -1.15 -4.46 116.66 114.15 1oac n ARG 425 Ca -0.01 0.55 -0.11 0.00 -0.77 0.00 0.00 57.85 57.50 1oac n ARG 425 Cb 0.47 -5.19 0.02 0.00 -1.02 0.00 0.00 32.46 26.74 1oac n ARG 425 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1oac h ALA 426 N 0.91 0.59 -3.72 7.54 0.00 -0.42 0.95 119.26 125.11 1oac h ALA 426 Ca -0.60 -0.56 -0.35 0.00 0.00 0.00 0.00 54.91 53.39 1oac h ALA 426 Cb 1.37 -0.06 -0.26 0.00 0.00 0.00 0.00 17.79 18.84 1oac h ALA 426 CO 0.64 0.72 -0.76 0.42 0.00 0.00 0.00 179.25 180.27 1oac s ILE 427 N -3.82 0.67 -0.07 0.00 1.01 -1.11 -4.42 121.20 113.47 1oac s ILE 427 Ca -0.07 -0.65 0.05 0.00 0.00 0.00 0.00 60.65 59.98 1oac s ILE 427 Cb 0.11 -0.62 -0.01 0.00 0.01 0.00 0.00 42.46 41.94 1oac s ILE 427 CO 0.85 -0.01 -0.21 0.00 0.00 0.00 0.00 174.94 175.56 1oac s ALA 428 N -0.62 2.32 -0.14 9.38 0.00 -0.46 -0.16 121.76 132.08 1oac s ALA 428 Ca -0.01 -1.02 0.01 0.00 0.00 0.00 0.00 51.96 50.95 1oac s ALA 428 Cb -0.06 -0.80 0.00 0.00 0.00 0.00 0.00 23.12 22.27 1oac s ALA 428 CO 0.00 0.42 -0.18 0.08 0.00 0.00 0.00 175.76 176.09 1oac s VAL 429 N -0.21 2.45 -0.02 0.00 1.01 -0.42 -0.09 120.40 123.13 1oac s VAL 429 Ca -0.01 -0.85 -0.21 0.00 0.00 0.00 0.00 61.98 60.91 1oac s VAL 429 Cb -0.13 -2.01 0.04 0.00 0.00 0.00 0.00 36.38 34.27 1oac s VAL 429 CO 0.03 0.53 0.45 0.72 0.00 0.00 0.00 175.10 176.83 1oac s PHE 430 N 0.75 -0.36 -0.03 5.22 -0.71 -0.38 -0.97 117.98 121.50 1oac s PHE 430 Ca -0.07 0.55 -0.03 0.00 -1.04 0.00 0.00 56.93 56.34 1oac s PHE 430 Cb -0.16 0.22 -0.04 0.00 -1.21 0.00 0.00 43.02 41.84 1oac s PHE 430 CO 0.00 -0.49 0.16 -2.00 -1.34 0.00 0.00 175.22 171.56 1oac s GLU 431 N -1.44 3.39 0.03 1.99 2.12 -1.26 0.12 118.70 123.65 1oac s GLU 431 Ca -0.12 -0.30 -0.06 0.00 0.36 0.00 0.00 54.97 54.85 1oac s GLU 431 Cb -0.03 -3.09 -0.01 0.00 0.26 0.00 0.00 34.13 31.27 1oac s GLU 431 CO 0.05 0.69 0.12 -0.98 -0.54 0.00 0.00 175.26 174.60 1oac s ARG 432 N -1.73 0.56 0.13 4.30 1.70 0.40 -4.96 118.95 119.35 1oac s ARG 432 Ca 0.24 -0.64 -0.30 0.00 -0.47 0.00 0.00 55.73 54.56 1oac s ARG 432 Cb -0.12 0.23 -0.07 0.00 -0.57 0.00 0.00 34.95 34.41 1oac s ARG 432 CO 0.15 -0.14 1.12 -0.47 -1.08 0.00 0.00 175.30 174.88 1oac s TYR 433 N -2.23 3.55 -0.28 5.89 5.04 -1.26 -0.80 117.35 127.25 1oac s TYR 433 Ca -0.08 1.51 0.16 0.00 -2.44 0.00 0.00 57.07 56.22 1oac s TYR 433 Cb -0.03 -3.31 0.49 0.00 0.35 0.00 0.00 41.96 39.45 1oac s TYR 433 CO -0.03 -0.78 1.13 0.00 -1.34 0.00 0.00 175.55 174.53 1oac n ALA 434 N 2.96 3.62 0.00 3.97 0.00 0.10 -4.89 120.51 126.27 1oac n ALA 434 Ca 0.05 -3.21 0.00 0.00 0.00 0.00 0.00 53.44 50.27 1oac n ALA 434 Cb 0.47 -0.67 0.00 0.00 0.00 0.00 0.00 19.45 19.25 1oac n ALA 434 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1oac n GLY 435 N -0.60 -2.05 3.76 0.00 0.00 -1.26 -4.74 105.19 100.29 1oac n GLY 435 Ca 0.22 -1.51 -0.40 0.00 0.00 0.00 0.00 46.02 44.32 1oac n GLY 435 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1oac s PRO 436 N 0.00 4.60 0.15 1.61 0.04 -1.26 -0.62 135.00 139.51 1oac s PRO 436 Ca 0.00 1.84 -0.11 0.00 0.04 0.00 0.00 61.00 62.76 1oac s PRO 436 Cb 0.00 -3.19 -0.01 0.00 0.04 0.00 0.00 34.50 31.34 1oac s PRO 436 CO 0.00 0.14 1.53 1.49 0.04 0.00 0.00 177.00 180.20 1oac h GLU 437 N 4.01 0.93 -2.90 4.56 4.57 -0.10 -3.42 114.58 122.22 1oac h GLU 437 Ca -0.46 -0.41 0.02 0.00 -1.18 0.00 0.00 59.36 57.33 1oac h GLU 437 Cb 1.21 -0.03 -0.10 0.00 -0.16 0.00 0.00 28.75 29.67 1oac h GLU 437 CO 0.68 1.07 0.25 1.52 -1.18 0.00 0.00 179.01 181.35 1oac s TYR 438 N -4.64 -0.42 -0.12 0.92 -0.85 -1.24 -4.98 117.35 106.02 1oac s TYR 438 Ca -0.12 0.15 -0.25 0.00 -0.52 0.00 0.00 57.07 56.34 1oac s TYR 438 Cb 0.11 0.60 0.06 0.00 0.38 0.00 0.00 41.96 43.11 1oac s TYR 438 CO 0.86 -0.91 0.61 0.21 -1.52 0.00 0.00 175.55 174.79 1oac s LYS 439 N -3.71 0.88 -0.23 -3.49 2.20 -1.26 -2.01 119.74 112.12 1oac s LYS 439 Ca 0.04 0.43 -0.05 0.00 -0.36 0.00 0.00 55.97 56.03 1oac s LYS 439 Cb -0.02 0.42 0.11 0.00 -1.51 0.00 0.00 37.83 36.83 1oac s LYS 439 CO -0.07 -0.22 0.43 -1.58 -0.36 0.00 0.00 175.35 173.56 1oac s HIS 440 N -0.63 -0.90 -0.85 4.03 2.46 0.13 -5.02 115.29 114.51 1oac s HIS 440 Ca -0.07 1.37 -0.10 0.00 0.47 0.00 0.00 55.06 56.72 1oac s HIS 440 Cb -0.02 0.27 0.22 0.00 -0.13 0.00 0.00 32.58 32.91 1oac s HIS 440 CO 0.06 -0.60 0.78 -1.14 -2.47 0.00 0.00 174.74 171.36 1oac s GLN 441 N 2.63 3.52 0.04 2.88 2.00 -1.26 -1.23 119.66 128.24 1oac s GLN 441 Ca 0.04 -2.68 -0.31 0.00 -2.00 0.00 0.00 55.36 50.42 1oac s GLN 441 Cb -0.13 -4.30 -0.06 0.00 0.80 0.00 0.00 33.01 29.31 1oac s GLN 441 CO -0.15 -1.26 1.39 -2.00 -0.50 0.00 0.00 175.29 172.78 1oac s GLU 442 N -0.26 4.30 0.13 1.67 2.56 -1.26 -4.92 118.70 120.91 1oac s GLU 442 Ca 0.21 2.00 -0.35 0.00 0.00 0.00 0.00 54.97 56.83 1oac s GLU 442 Cb -0.12 -3.46 -0.16 0.00 2.00 0.00 0.00 34.13 32.40 1oac s GLU 442 CO -0.08 -0.52 1.39 -0.12 -0.56 0.00 0.00 175.26 175.37 1oac n MET 443 N 4.85 1.47 -1.07 4.30 1.56 -1.26 -1.53 117.12 125.44 1oac n MET 443 Ca 0.12 0.53 -0.02 0.00 -0.27 0.00 0.00 57.70 58.06 1oac n MET 443 Cb 0.43 -2.19 -0.01 0.00 2.15 0.00 0.00 33.22 33.61 1oac n MET 443 CO 0.00 0.00 0.00 0.41 -0.73 0.00 0.00 175.97 175.65 1oac n GLY 444 N 2.67 0.43 3.55 -5.12 0.00 -1.26 -4.99 105.19 100.46 1oac n GLY 444 Ca 0.17 -0.09 -0.26 0.00 0.00 0.00 0.00 46.02 45.84 1oac n GLY 444 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1oac s GLN 445 N -1.51 1.83 0.37 1.61 1.11 -0.58 -5.12 119.66 117.37 1oac s GLN 445 Ca 0.00 -1.97 -0.26 0.00 0.01 0.00 0.00 55.36 53.14 1oac s GLN 445 Cb 0.00 -1.62 -0.09 0.00 -1.01 0.00 0.00 33.01 30.30 1oac s GLN 445 CO 0.00 0.07 1.17 -2.14 0.01 0.00 0.00 175.29 174.41 1oac s PRO 446 N -3.65 4.20 0.58 2.91 0.02 -1.26 -4.63 135.00 133.17 1oac s PRO 446 Ca 0.33 1.88 -0.20 0.00 0.02 0.00 0.00 61.00 63.03 1oac s PRO 446 Cb 0.05 -2.82 -0.04 0.00 0.02 0.00 0.00 34.50 31.71 1oac s PRO 446 CO 0.16 -0.20 1.24 1.21 -0.33 0.00 0.00 177.00 179.08 1oac s ASN 447 N -1.01 5.21 -0.19 2.53 3.84 -1.26 -4.59 114.94 119.47 1oac s ASN 447 Ca 0.54 2.47 0.01 0.00 0.21 0.00 0.00 52.86 56.09 1oac s ASN 447 Cb -0.32 -2.61 0.04 0.00 -0.55 0.00 0.00 41.25 37.81 1oac s ASN 447 CO 0.41 -1.58 -0.13 -0.69 -2.79 0.00 0.00 177.10 172.32 1oac s VAL 448 N -1.51 1.78 0.01 -5.21 1.01 -0.36 -5.01 120.40 111.10 1oac s VAL 448 Ca 0.76 -1.01 -0.01 0.00 0.00 0.00 0.00 61.98 61.71 1oac s VAL 448 Cb -0.33 -1.78 -0.01 0.00 0.00 0.00 0.00 36.38 34.27 1oac s VAL 448 CO 0.36 0.26 0.01 -0.44 0.00 0.00 0.00 175.10 175.30 1oac s SER 449 N 1.35 0.12 0.03 3.32 0.01 -1.26 -0.69 113.70 116.58 1oac s SER 449 Ca 0.00 -0.28 0.02 0.00 1.31 0.00 0.00 55.95 57.00 1oac s SER 449 Cb -0.15 0.11 -0.02 0.00 0.21 0.00 0.00 66.02 66.16 1oac s SER 449 CO -0.09 -0.22 -0.07 0.42 0.41 0.00 0.00 173.24 173.69 1oac s THR 450 N -0.99 0.48 0.26 1.44 -4.23 -0.85 -5.02 115.64 106.74 1oac s THR 450 Ca -0.11 -0.82 -0.29 0.00 -1.18 0.00 0.00 61.69 59.29 1oac s THR 450 Cb -0.07 -0.51 -0.09 0.00 1.34 0.00 0.00 72.50 73.17 1oac s THR 450 CO -0.00 -0.25 0.95 -0.70 -0.54 0.00 0.00 174.62 174.08 1oac s GLU 451 N -1.15 4.78 -0.19 3.99 2.12 -1.26 0.52 118.70 127.51 1oac s GLU 451 Ca -0.07 1.47 -0.12 0.00 0.36 0.00 0.00 54.97 56.62 1oac s GLU 451 Cb -0.08 -3.16 -0.05 0.00 0.26 0.00 0.00 34.13 31.11 1oac s GLU 451 CO 0.00 0.44 0.20 0.50 -0.54 0.00 0.00 175.26 175.86 1oac s ARG 452 N -1.41 4.21 -0.03 4.30 3.52 0.20 -4.26 118.95 125.49 1oac s ARG 452 Ca 0.43 -0.09 0.06 0.00 -0.13 0.00 0.00 55.73 56.00 1oac s ARG 452 Cb -0.25 -3.43 -0.02 0.00 -1.56 0.00 0.00 34.95 29.69 1oac s ARG 452 CO 0.31 0.25 -0.22 1.03 -0.81 0.00 0.00 175.30 175.87 1oac s ARG 453 N 0.47 2.25 -0.03 5.12 1.81 -1.26 0.03 118.95 127.34 1oac s ARG 453 Ca 0.11 -0.85 0.07 0.00 -1.72 0.00 0.00 55.73 53.35 1oac s ARG 453 Cb -0.12 -2.17 -0.02 0.00 -0.45 0.00 0.00 34.95 32.20 1oac s ARG 453 CO 0.01 0.58 -0.25 -1.21 -0.68 0.00 0.00 175.30 173.75 1oac s GLU 454 N -0.68 2.13 -0.33 3.54 2.02 0.02 -3.87 118.70 121.52 1oac s GLU 454 Ca 0.11 -0.89 -0.14 0.00 0.02 0.00 0.00 54.97 54.06 1oac s GLU 454 Cb -0.10 -2.00 -0.02 0.00 0.10 0.00 0.00 34.13 32.11 1oac s GLU 454 CO -0.00 0.51 0.29 -1.17 0.02 0.00 0.00 175.26 174.90 1oac s LEU 455 N -0.50 4.43 -0.07 1.80 2.96 -0.75 -0.46 118.68 126.09 1oac s LEU 455 Ca 0.07 -0.28 -0.01 0.00 -0.22 0.00 0.00 54.13 53.68 1oac s LEU 455 Cb -0.10 -2.23 -0.03 0.00 0.50 0.00 0.00 46.19 44.32 1oac s LEU 455 CO -0.00 -0.26 -0.00 -0.69 -1.32 0.00 0.00 176.35 174.08 1oac s VAL 456 N 1.86 4.28 -0.33 1.68 1.01 0.12 -0.83 120.40 128.19 1oac s VAL 456 Ca 0.09 -0.29 -0.01 0.00 0.00 0.00 0.00 61.98 61.77 1oac s VAL 456 Cb -0.17 -2.81 0.07 0.00 0.00 0.00 0.00 36.38 33.47 1oac s VAL 456 CO 0.11 0.58 0.04 -0.69 0.00 0.00 0.00 175.10 175.14 1oac s VAL 457 N -0.91 2.89 -0.10 2.92 1.01 -0.19 -1.25 120.40 124.77 1oac s VAL 457 Ca 0.14 -1.69 -0.00 0.00 0.00 0.00 0.00 61.98 60.43 1oac s VAL 457 Cb -0.11 -2.80 -0.03 0.00 0.00 0.00 0.00 36.38 33.44 1oac s VAL 457 CO 0.03 -0.30 -0.07 -0.60 0.00 0.00 0.00 175.10 174.16 1oac s ARG 458 N 1.17 3.07 -0.01 2.72 3.52 0.87 -1.28 118.95 129.01 1oac s ARG 458 Ca -0.00 -0.57 0.01 0.00 -0.13 0.00 0.00 55.73 55.04 1oac s ARG 458 Cb -0.20 -2.67 0.00 0.00 -1.56 0.00 0.00 34.95 30.52 1oac s ARG 458 CO -0.03 0.49 -0.05 -0.46 -0.81 0.00 0.00 175.30 174.44 1oac s TRP 459 N -0.33 0.50 -0.06 5.12 -0.00 -0.05 -1.35 118.94 122.76 1oac s TRP 459 Ca 0.05 -0.10 0.05 0.00 -0.00 0.00 0.00 56.10 56.09 1oac s TRP 459 Cb -0.13 -0.38 -0.00 0.00 -0.00 0.00 0.00 33.47 32.96 1oac s TRP 459 CO 0.02 -0.05 -0.20 0.42 -0.00 0.00 0.00 176.95 177.14 1oac s ILE 460 N 0.19 1.68 -0.02 5.86 1.01 -1.26 -0.01 121.20 128.65 1oac s ILE 460 Ca -0.02 -0.84 0.02 0.00 0.00 0.00 0.00 60.65 59.81 1oac s ILE 460 Cb -0.06 -1.45 0.01 0.00 0.01 0.00 0.00 42.46 40.97 1oac s ILE 460 CO -0.00 0.48 -0.07 -0.55 0.00 0.00 0.00 174.94 174.79 1oac s SER 461 N 0.08 0.98 -0.13 3.58 0.15 -0.77 0.12 113.70 117.72 1oac s SER 461 Ca -0.07 -0.15 0.02 0.00 0.70 0.00 0.00 55.95 56.45 1oac s SER 461 Cb -0.14 -0.29 0.01 0.00 -1.71 0.00 0.00 66.02 63.90 1oac s SER 461 CO 0.04 0.04 -0.19 -0.89 1.20 0.00 0.00 173.24 173.43 1oac s THR 462 N 0.29 1.85 -0.29 6.45 2.01 -0.99 -0.72 115.64 124.24 1oac s THR 462 Ca -0.04 -0.85 0.02 0.00 0.31 0.00 0.00 61.69 61.13 1oac s THR 462 Cb -0.08 -1.65 0.08 0.00 0.01 0.00 0.00 72.50 70.86 1oac s THR 462 CO 0.00 0.51 0.00 -0.69 -0.69 0.00 0.00 174.62 173.75 1oac s VAL 463 N 0.90 1.77 0.00 3.82 1.01 -1.26 -4.85 120.40 121.79 1oac s VAL 463 Ca -0.06 -1.71 0.00 0.00 0.00 0.00 0.00 61.98 60.21 1oac s VAL 463 Cb -0.15 -2.16 0.00 0.00 0.00 0.00 0.00 36.38 34.07 1oac s VAL 463 CO -0.02 -0.37 0.00 0.61 0.00 0.00 0.00 175.10 175.32 1oac n GLY 464 N 4.52 2.53 0.87 4.51 0.00 -1.26 -4.83 105.19 111.53 1oac n GLY 464 Ca -0.05 -0.30 0.00 0.00 0.00 0.00 0.00 46.02 45.67 1oac n GLY 464 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1oac n ASN 465 N 7.62 2.28 -3.64 1.61 0.23 -1.26 -5.03 115.26 117.06 1oac n ASN 465 Ca 0.00 -1.85 -0.03 0.00 -0.53 0.00 0.00 54.58 52.17 1oac n ASN 465 Cb 0.00 -0.46 -0.07 0.00 -2.08 0.00 0.00 39.78 37.17 1oac n ASN 465 CO 0.00 0.00 0.00 -1.81 -0.93 0.00 0.00 177.26 174.52 1oac s ASP 467 N 0.71 -0.51 -0.07 0.53 1.11 -0.56 -1.07 116.67 116.80 1oac s ASP 467 Ca 0.00 0.83 0.04 0.00 0.18 0.00 0.00 52.55 53.60 1oac s ASP 467 Cb 0.00 1.17 -0.02 0.00 1.07 0.00 0.00 42.92 45.15 1oac s ASP 467 CO 0.00 -0.13 -0.18 -0.31 1.18 0.00 0.00 175.17 175.72 1oac s TYR 468 N 1.24 2.62 -0.14 4.23 2.02 0.10 -1.24 117.35 126.18 1oac s TYR 468 Ca -0.08 -0.50 -0.00 0.00 -0.37 0.00 0.00 57.07 56.12 1oac s TYR 468 Cb -0.04 -1.67 -0.01 0.00 -0.40 0.00 0.00 41.96 39.84 1oac s TYR 468 CO -0.14 -0.07 -0.14 0.42 -1.57 0.00 0.00 175.55 174.05 1oac s ILE 469 N -0.25 2.92 -0.12 2.71 1.01 -0.10 -1.85 121.20 125.53 1oac s ILE 469 Ca 0.00 -0.70 0.02 0.00 0.00 0.00 0.00 60.65 59.97 1oac s ILE 469 Cb -0.13 -2.23 -0.00 0.00 0.01 0.00 0.00 42.46 40.10 1oac s ILE 469 CO 0.03 0.52 -0.19 -0.36 0.00 0.00 0.00 174.94 174.94 1oac s PHE 470 N 0.53 2.69 -0.14 3.97 0.40 0.99 -0.12 117.98 126.31 1oac s PHE 470 Ca -0.09 -0.94 0.02 0.00 -0.60 0.00 0.00 56.93 55.32 1oac s PHE 470 Cb -0.16 -1.79 0.00 0.00 0.51 0.00 0.00 43.02 41.58 1oac s PHE 470 CO 0.04 -0.38 -0.20 -0.51 0.70 0.00 0.00 175.22 174.87 1oac s ASP 471 N 0.46 3.26 -0.33 1.36 1.01 -0.28 -0.87 116.67 121.28 1oac s ASP 471 Ca -0.13 -0.56 -0.09 0.00 0.71 0.00 0.00 52.55 52.48 1oac s ASP 471 Cb -0.17 -1.47 0.01 0.00 1.01 0.00 0.00 42.92 42.31 1oac s ASP 471 CO 0.06 0.10 0.15 0.26 0.21 0.00 0.00 175.17 175.95 1oac s TRP 472 N 0.71 3.20 -0.22 4.23 0.52 -0.40 -1.50 118.94 125.47 1oac s TRP 472 Ca -0.09 -0.88 -0.04 0.00 0.02 0.00 0.00 56.10 55.11 1oac s TRP 472 Cb -0.16 -2.36 -0.01 0.00 -1.15 0.00 0.00 33.47 29.79 1oac s TRP 472 CO 0.01 -0.58 -0.03 0.42 0.02 0.00 0.00 176.95 176.79 1oac s ILE 473 N 1.55 3.51 -0.22 2.03 1.01 0.89 -1.02 121.20 128.95 1oac s ILE 473 Ca 0.03 -0.45 -0.10 0.00 0.00 0.00 0.00 60.65 60.13 1oac s ILE 473 Cb -0.18 -2.60 -0.05 0.00 0.01 0.00 0.00 42.46 39.64 1oac s ILE 473 CO 0.05 0.41 0.15 -0.36 0.00 0.00 0.00 174.94 175.20 1oac s PHE 474 N 1.48 3.36 0.04 3.97 0.40 -0.01 -0.24 117.98 126.98 1oac s PHE 474 Ca 0.06 0.29 -0.00 0.00 -0.60 0.00 0.00 56.93 56.67 1oac s PHE 474 Cb -0.14 -2.22 -0.04 0.00 0.51 0.00 0.00 43.02 41.13 1oac s PHE 474 CO -0.02 0.18 0.19 -1.01 0.70 0.00 0.00 175.22 175.25 1oac s HIS 475 N 0.72 3.50 0.41 0.36 3.76 0.02 -1.81 115.29 122.25 1oac s HIS 475 Ca 0.08 0.26 0.08 0.00 -0.15 0.00 0.00 55.06 55.33 1oac s HIS 475 Cb -0.12 -1.77 0.87 0.00 1.11 0.00 0.00 32.58 32.67 1oac s HIS 475 CO 0.01 0.60 2.04 0.93 -0.85 0.00 0.00 174.74 177.47 1oac h GLU 476 N 3.32 0.45 -0.18 1.40 5.08 -1.87 -2.02 114.58 120.76 1oac h GLU 476 Ca -0.46 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 57.86 1oac h GLU 476 Cb 1.17 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 30.32 1oac h GLU 476 CO 0.73 0.34 0.00 0.27 -1.00 0.00 0.00 179.01 179.35 1oac n ASN 477 N -4.45 0.18 0.00 1.42 2.04 -1.26 -4.84 115.26 108.35 1oac n ASN 477 Ca 0.02 -1.88 0.00 0.00 -0.44 0.00 0.00 54.58 52.28 1oac n ASN 477 Cb 0.10 -0.09 0.00 0.00 -2.53 0.00 0.00 39.78 37.26 1oac n ASN 477 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 1oac n GLY 478 N 0.36 0.43 3.78 4.83 0.00 -0.76 -4.83 105.19 109.01 1oac n GLY 478 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 1oac n GLY 478 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1oac s THR 479 N -2.14 3.85 -0.09 2.61 2.01 -1.26 -4.36 115.64 116.25 1oac s THR 479 Ca 0.00 1.47 0.03 0.00 0.31 0.00 0.00 61.69 63.50 1oac s THR 479 Cb 0.00 -3.79 0.01 0.00 0.01 0.00 0.00 72.50 68.73 1oac s THR 479 CO 0.00 0.06 -0.19 -0.63 -0.69 0.00 0.00 174.62 173.17 1oac s ILE 480 N -1.62 1.72 0.15 1.82 1.01 -0.32 -0.79 121.20 123.16 1oac s ILE 480 Ca 0.55 -0.81 0.08 0.00 0.00 0.00 0.00 60.65 60.47 1oac s ILE 480 Cb -0.21 -1.51 -0.04 0.00 0.01 0.00 0.00 42.46 40.70 1oac s ILE 480 CO 0.27 0.48 -0.08 -0.83 0.00 0.00 0.00 174.94 174.79 1oac s GLY 481 N 0.54 1.75 -0.16 6.18 0.00 0.66 -1.27 107.32 115.02 1oac s GLY 481 Ca -0.15 -1.38 -0.02 0.00 0.00 0.00 0.00 44.72 43.17 1oac s GLY 481 CO 0.05 -1.38 0.00 -0.42 0.00 0.00 0.00 173.10 171.35 1oac s ILE 482 N -1.55 0.70 -0.00 0.90 1.01 -1.10 -0.08 121.20 121.08 1oac s ILE 482 Ca 0.24 -0.48 0.04 0.00 0.00 0.00 0.00 60.65 60.45 1oac s ILE 482 Cb -0.10 -1.04 -0.03 0.00 0.01 0.00 0.00 42.46 41.30 1oac s ILE 482 CO 0.15 -0.02 -0.11 -1.81 0.00 0.00 0.00 174.94 173.15 1oac s ASP 483 N 1.80 4.33 -0.11 3.58 1.01 -0.56 -1.42 116.67 125.29 1oac s ASP 483 Ca 0.00 -0.21 0.01 0.00 0.71 0.00 0.00 52.55 53.06 1oac s ASP 483 Cb -0.16 -0.93 0.02 0.00 1.01 0.00 0.00 42.92 42.86 1oac s ASP 483 CO -0.07 0.29 -0.12 0.00 0.21 0.00 0.00 175.17 175.48 1oac s ALA 484 N -0.92 1.50 0.17 5.23 0.00 -0.46 -1.12 121.76 126.16 1oac s ALA 484 Ca 0.15 -0.63 0.09 0.00 0.00 0.00 0.00 51.96 51.57 1oac s ALA 484 Cb -0.11 -0.85 -0.04 0.00 0.00 0.00 0.00 23.12 22.12 1oac s ALA 484 CO 0.05 -0.21 -0.11 0.20 0.00 0.00 0.00 175.76 175.69 1oac s GLY 485 N 1.27 1.73 -0.02 0.00 0.00 0.83 -1.17 107.32 109.97 1oac s GLY 485 Ca -0.02 -1.45 0.02 0.00 0.00 0.00 0.00 44.72 43.27 1oac s GLY 485 CO -0.05 -1.47 -0.08 0.00 0.00 0.00 0.00 173.10 171.51 1oac s ALA 486 N -1.62 0.74 0.21 3.20 0.00 -0.08 -0.92 121.76 123.29 1oac s ALA 486 Ca 0.24 -0.29 -0.04 0.00 0.00 0.00 0.00 51.96 51.87 1oac s ALA 486 Cb -0.09 -0.27 0.02 0.00 0.00 0.00 0.00 23.12 22.78 1oac s ALA 486 CO 0.14 0.13 0.36 -2.37 0.00 0.00 0.00 175.76 174.02 1oac n THR 487 N 3.23 0.00 0.00 0.00 5.66 -0.37 -0.73 114.28 122.07 1oac n THR 487 Ca -0.17 -0.83 0.00 0.00 -3.05 0.00 0.00 64.05 60.00 1oac n THR 487 Cb 0.55 0.61 0.00 0.00 -1.55 0.00 0.00 70.33 69.94 1oac n THR 487 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1oac n GLY 488 N -0.32 0.02 3.46 1.09 0.00 -1.24 -1.50 105.19 106.69 1oac n GLY 488 Ca -0.02 -2.10 -0.34 0.00 0.00 0.00 0.00 46.02 43.56 1oac n GLY 488 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1oac s ILE 489 N 0.00 3.66 0.47 -0.61 -1.09 -0.24 -0.60 121.20 122.79 1oac s ILE 489 Ca 0.00 -0.44 -0.20 0.00 -2.23 0.00 0.00 60.65 57.78 1oac s ILE 489 Cb 0.00 -2.59 -0.09 0.00 -1.58 0.00 0.00 42.46 38.19 1oac s ILE 489 CO 0.00 0.50 1.00 -1.61 -1.23 0.00 0.00 174.94 173.59 1oac s GLU 490 N 0.43 3.97 -0.29 2.79 2.02 -1.26 -4.75 118.70 121.61 1oac s GLU 490 Ca -0.05 1.21 -0.29 0.00 0.02 0.00 0.00 54.97 55.86 1oac s GLU 490 Cb -0.15 -2.13 0.00 0.00 0.10 0.00 0.00 34.13 31.95 1oac s GLU 490 CO 0.03 -0.27 1.28 0.00 0.02 0.00 0.00 175.26 176.32 1oac s ALA 491 N -2.16 3.40 0.22 5.21 0.00 -1.26 -4.94 121.76 122.23 1oac s ALA 491 Ca 0.64 0.12 0.10 0.00 0.00 0.00 0.00 51.96 52.81 1oac s ALA 491 Cb -0.13 -3.75 -0.04 0.00 0.00 0.00 0.00 23.12 19.20 1oac s ALA 491 CO 0.19 -1.70 -0.08 0.14 0.00 0.00 0.00 175.76 174.31 1oac s VAL 492 N 4.24 3.18 -0.11 0.00 -7.23 -1.26 -3.80 120.40 115.41 1oac s VAL 492 Ca 0.55 -1.84 -0.01 0.00 -1.81 0.00 0.00 61.98 58.87 1oac s VAL 492 Cb -0.17 -2.63 -0.03 0.00 0.56 0.00 0.00 36.38 34.12 1oac s VAL 492 CO 0.22 -0.23 -0.06 -0.75 -0.31 0.00 0.00 175.10 173.96 1oac s LYS 493 N -3.19 3.22 0.14 4.82 2.20 -0.14 -4.87 119.74 121.93 1oac s LYS 493 Ca 0.28 -0.54 -0.29 0.00 -0.36 0.00 0.00 55.97 55.05 1oac s LYS 493 Cb -0.07 -2.74 -0.07 0.00 -1.51 0.00 0.00 37.83 33.44 1oac s LYS 493 CO 0.17 0.44 0.94 0.20 -0.36 0.00 0.00 175.35 176.73 1oac s GLY 494 N -0.19 3.02 0.14 5.54 0.00 -1.26 -1.78 107.32 112.79 1oac s GLY 494 Ca 0.03 0.56 -0.00 0.00 0.00 0.00 0.00 44.72 45.31 1oac s GLY 494 CO 0.03 1.34 0.03 -1.34 0.00 0.00 0.00 173.10 173.16 1oac s VAL 495 N -0.37 0.31 0.12 1.40 -7.23 -0.47 -4.85 120.40 109.31 1oac s VAL 495 Ca 0.44 -1.93 0.04 0.00 -1.81 0.00 0.00 61.98 58.73 1oac s VAL 495 Cb -0.24 -2.05 -0.21 0.00 0.56 0.00 0.00 36.38 34.44 1oac s VAL 495 CO 0.30 -0.49 1.28 0.11 -0.31 0.00 0.00 175.10 175.99 1oac h LYS 496 N 2.81 0.07 -6.80 4.82 1.57 -1.93 -3.40 116.57 113.72 1oac h LYS 496 Ca -0.36 -0.11 -0.53 0.00 -1.87 0.00 0.00 60.65 57.78 1oac h LYS 496 Cb 1.20 0.04 0.07 0.00 0.08 0.00 0.00 32.23 33.62 1oac h LYS 496 CO 0.61 1.02 0.80 0.00 -0.57 0.00 0.00 179.45 181.31 1oac s ALA 497 N -2.79 3.66 -0.20 3.86 0.00 -1.26 -4.77 121.76 120.27 1oac s ALA 497 Ca -0.00 1.45 -0.10 0.00 0.00 0.00 0.00 51.96 53.30 1oac s ALA 497 Cb 0.10 -3.59 -0.20 0.00 0.00 0.00 0.00 23.12 19.42 1oac s ALA 497 CO 0.83 -0.87 0.08 1.63 0.00 0.00 0.00 175.76 177.44 1oac n LYS 498 N 1.97 0.66 -4.40 0.00 5.02 -1.26 -0.68 118.16 119.46 1oac n LYS 498 Ca 0.06 0.32 -0.21 0.00 -2.02 0.00 0.00 58.31 56.47 1oac n LYS 498 Cb 0.39 -1.64 -0.09 0.00 -0.02 0.00 0.00 35.03 33.66 1oac n LYS 498 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 1oac s THR 499 N -2.49 0.62 -1.11 -0.18 -4.23 -1.26 -4.12 115.64 102.86 1oac s THR 499 Ca -0.29 -2.00 0.21 0.00 -1.18 0.00 0.00 61.69 58.42 1oac s THR 499 Cb 0.08 -2.56 0.22 0.00 1.34 0.00 0.00 72.50 71.59 1oac s THR 499 CO 0.64 0.00 1.66 0.23 -0.54 0.00 0.00 174.62 176.61 1oac n MET 500 N -0.66 0.08 -0.04 3.99 2.81 -1.26 -2.94 117.12 119.10 1oac n MET 500 Ca -0.02 0.13 0.12 0.00 -1.81 0.00 0.00 57.70 56.13 1oac n MET 500 Cb 0.66 -1.50 0.46 0.00 -0.71 0.00 0.00 33.22 32.13 1oac n MET 500 CO 0.00 0.00 0.00 0.72 1.51 0.00 0.00 175.97 178.20 1oac n HIS 501 N -1.44 0.10 -2.98 2.03 8.25 -1.26 -4.79 115.22 115.13 1oac n HIS 501 Ca 0.06 -0.05 -0.34 0.00 -0.26 0.00 0.00 57.72 57.13 1oac n HIS 501 Cb 0.22 0.00 -0.06 0.00 1.12 0.00 0.00 29.99 31.27 1oac n HIS 501 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1oac s ASP 502 N -1.79 7.00 0.31 0.41 1.01 -1.15 -4.98 116.67 117.47 1oac s ASP 502 Ca 0.35 1.53 0.07 0.00 0.71 0.00 0.00 52.55 55.21 1oac s ASP 502 Cb 0.19 -2.47 0.78 0.00 1.01 0.00 0.00 42.92 42.44 1oac s ASP 502 CO 0.30 -0.15 1.77 -0.33 0.21 0.00 0.00 175.17 176.97 1oac h GLU 503 N 2.65 0.70 0.00 8.23 5.08 -1.90 -1.43 114.58 127.90 1oac h GLU 503 Ca -0.48 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 57.84 1oac h GLU 503 Cb 1.18 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 30.28 1oac h GLU 503 CO 0.64 0.46 -0.27 0.25 -1.00 0.00 0.00 179.01 179.09 1oac n THR 504 N -4.77 0.27 -0.32 1.13 -2.24 -1.26 -4.44 114.28 102.65 1oac n THR 504 Ca 0.24 -0.16 0.00 0.00 -2.27 0.00 0.00 64.05 61.86 1oac n THR 504 Cb 0.61 -0.28 0.07 0.00 -2.10 0.00 0.00 70.33 68.63 1oac n THR 504 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1oac h ALA 505 N 2.73 0.31 -0.61 6.98 0.00 -1.54 1.02 119.26 128.15 1oac h ALA 505 Ca 0.00 0.29 -0.01 0.00 0.00 0.00 0.00 54.91 55.18 1oac h ALA 505 Cb 0.64 0.82 -0.03 0.00 0.00 0.00 0.00 17.79 19.22 1oac h ALA 505 CO 0.00 -0.53 0.33 -0.22 0.00 0.00 0.00 179.25 178.83 1oac h LYS 506 N -0.03 0.86 -0.03 0.00 3.64 -1.79 -0.26 116.57 118.96 1oac h LYS 506 Ca 0.36 -0.10 -0.26 0.00 -1.27 0.00 0.00 60.65 59.38 1oac h LYS 506 Cb 0.62 -0.17 0.02 0.00 -0.41 0.00 0.00 32.23 32.29 1oac h LYS 506 CO -0.90 0.66 -0.99 -0.44 -2.27 0.00 0.00 179.45 175.51 1oac h ASP 507 N 0.83 0.91 -0.44 4.20 3.32 -1.42 -3.17 116.42 120.66 1oac h ASP 507 Ca 0.21 -0.70 0.02 0.00 0.02 0.00 0.00 57.03 56.59 1oac h ASP 507 Cb 0.06 -0.28 -0.02 0.00 0.22 0.00 0.00 39.33 39.30 1oac h ASP 507 CO -0.03 1.50 0.29 0.44 -1.72 0.00 0.00 179.24 179.72 1oac h ASP 508 N 0.42 0.44 -0.60 6.45 3.32 0.16 -2.82 116.42 123.78 1oac h ASP 508 Ca -0.11 -0.01 -0.22 0.00 0.02 0.00 0.00 57.03 56.71 1oac h ASP 508 Cb 1.64 -0.10 -0.13 0.00 0.22 0.00 0.00 39.33 40.95 1oac h ASP 508 CO 0.20 0.31 0.20 0.35 -1.72 0.00 0.00 179.24 178.57 1oac n THR 509 N -4.48 2.78 0.09 0.35 -2.24 -0.16 -4.55 114.28 106.07 1oac n THR 509 Ca 0.04 -2.03 0.01 0.00 -2.27 0.00 0.00 64.05 59.80 1oac n THR 509 Cb 0.13 -0.35 0.32 0.00 -2.10 0.00 0.00 70.33 68.33 1oac n THR 509 CO 0.00 0.00 0.00 -0.09 -0.57 0.00 0.00 175.07 174.41 1oac h ARG 510 N 1.78 0.29 -0.20 -0.78 2.43 -1.47 -3.17 114.38 113.25 1oac h ARG 510 Ca 0.28 -0.08 0.00 0.00 -0.81 0.00 0.00 59.98 59.36 1oac h ARG 510 Cb 2.10 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 31.63 1oac h ARG 510 CO 0.63 0.48 0.00 0.66 -1.51 0.00 0.00 179.97 180.22 1oac n TYR 511 N -4.20 0.45 0.00 2.20 4.01 -1.26 -5.06 117.16 113.30 1oac n TYR 511 Ca -0.01 -0.68 0.00 0.00 -0.16 0.00 0.00 57.90 57.05 1oac n TYR 511 Cb 0.33 -0.13 0.00 0.00 -0.31 0.00 0.00 39.34 39.22 1oac n TYR 511 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1oac n GLY 512 N -0.27 1.11 3.79 2.72 0.00 -1.20 -0.85 105.19 110.49 1oac n GLY 512 Ca 0.13 -0.75 -0.36 0.00 0.00 0.00 0.00 46.02 45.04 1oac n GLY 512 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1oac s THR 513 N -2.00 4.03 -0.43 2.61 2.01 -1.23 -4.38 115.64 116.26 1oac s THR 513 Ca 0.00 1.57 -0.29 0.00 0.31 0.00 0.00 61.69 63.28 1oac s THR 513 Cb 0.00 -3.81 0.02 0.00 0.01 0.00 0.00 72.50 68.72 1oac s THR 513 CO 0.00 0.02 1.18 -0.22 -0.69 0.00 0.00 174.62 174.91 1oac s LEU 514 N -2.46 3.69 0.00 4.42 2.96 -1.26 -0.73 118.68 125.30 1oac s LEU 514 Ca 0.55 0.66 0.16 0.00 -0.22 0.00 0.00 54.13 55.28 1oac s LEU 514 Cb -0.19 -3.55 0.01 0.00 0.50 0.00 0.00 46.19 42.96 1oac s LEU 514 CO 0.24 -1.21 0.88 2.30 -1.32 0.00 0.00 176.35 177.23 1oac n ILE 515 N 6.69 0.00 -3.81 6.68 -5.35 -0.44 -4.79 119.36 118.34 1oac n ILE 515 Ca 0.13 -0.34 -0.07 0.00 -0.27 0.00 0.00 62.75 62.19 1oac n ILE 515 Cb 0.48 1.21 -0.02 0.00 -1.74 0.00 0.00 39.64 39.57 1oac n ILE 515 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 1oac s ASP 516 N -1.87 -0.28 0.25 7.28 -1.08 -1.12 -4.65 116.67 115.19 1oac s ASP 516 Ca 0.14 -0.54 -0.31 0.00 -0.52 0.00 0.00 52.55 51.33 1oac s ASP 516 Cb 0.13 0.70 -0.11 0.00 -1.46 0.00 0.00 42.92 42.18 1oac s ASP 516 CO 0.39 -1.28 1.62 -1.00 0.52 0.00 0.00 175.17 175.42 1oac s HIS 517 N -3.86 2.84 -1.68 -5.34 3.76 -1.26 -2.41 115.29 107.34 1oac s HIS 517 Ca 0.10 0.65 0.00 0.00 -0.15 0.00 0.00 55.06 55.66 1oac s HIS 517 Cb -0.05 -4.06 0.00 0.00 1.11 0.00 0.00 32.58 29.58 1oac s HIS 517 CO 0.05 -3.74 0.00 0.09 -0.85 0.00 0.00 174.74 170.29 1oac n ASN 518 N 2.89 -5.58 -3.92 1.40 4.13 0.14 -4.96 115.26 109.36 1oac n ASN 518 Ca 0.11 0.39 -0.24 0.00 1.68 0.00 0.00 54.58 56.52 1oac n ASN 518 Cb 0.37 -4.48 -0.17 0.00 -1.54 0.00 0.00 39.78 33.97 1oac n ASN 518 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 1oac s ILE 519 N -2.36 0.83 -0.11 2.41 1.01 -1.01 -1.37 121.20 120.60 1oac s ILE 519 Ca 0.00 -0.24 0.03 0.00 0.00 0.00 0.00 60.65 60.43 1oac s ILE 519 Cb 0.00 -0.83 -0.01 0.00 0.01 0.00 0.00 42.46 41.63 1oac s ILE 519 CO 0.00 0.31 -0.19 -0.69 0.00 0.00 0.00 174.94 174.36 1oac s VAL 520 N 1.19 2.49 -0.62 2.92 1.01 -0.73 -1.33 120.40 125.33 1oac s VAL 520 Ca -0.06 -0.87 -0.22 0.00 0.00 0.00 0.00 61.98 60.84 1oac s VAL 520 Cb -0.14 -1.99 0.07 0.00 0.00 0.00 0.00 36.38 34.32 1oac s VAL 520 CO -0.02 0.55 0.87 -0.83 0.00 0.00 0.00 175.10 175.67 1oac s GLY 521 N 0.26 1.50 0.21 4.51 0.00 0.09 -0.96 107.32 112.94 1oac s GLY 521 Ca -0.14 -1.86 -0.32 0.00 0.00 0.00 0.00 44.72 42.41 1oac s GLY 521 CO 0.07 1.90 1.34 2.41 0.00 0.00 0.00 173.10 178.82 1oac n THR 522 N 5.84 0.82 -1.99 0.90 -1.04 -1.25 -3.46 114.28 114.10 1oac n THR 522 Ca -0.05 -0.21 -0.39 0.00 -2.04 0.00 0.00 64.05 61.37 1oac n THR 522 Cb 0.45 -1.26 0.01 0.00 -1.82 0.00 0.00 70.33 67.71 1oac n THR 522 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 1oac s THR 523 N -0.01 2.49 0.34 12.58 2.01 -0.03 -4.90 115.64 128.12 1oac s THR 523 Ca 0.71 0.41 -0.17 0.00 0.31 0.00 0.00 61.69 62.95 1oac s THR 523 Cb -0.73 -3.22 0.04 0.00 0.01 0.00 0.00 72.50 68.59 1oac s THR 523 CO 0.49 0.03 0.73 -1.38 -0.69 0.00 0.00 174.62 173.80 1oac s HIS 524 N -1.32 0.09 0.23 4.92 -3.43 -1.15 -1.43 115.29 113.19 1oac s HIS 524 Ca 0.63 -0.64 0.11 0.00 -0.80 0.00 0.00 55.06 54.36 1oac s HIS 524 Cb -0.38 0.70 -0.05 0.00 -1.43 0.00 0.00 32.58 31.42 1oac s HIS 524 CO 0.47 -1.39 -0.22 -0.65 -2.00 0.00 0.00 174.74 170.95 1oac s GLN 525 N -3.03 1.56 -0.23 -0.38 -0.21 -0.96 -0.75 119.66 115.67 1oac s GLN 525 Ca 0.15 -1.62 -0.01 0.00 0.02 0.00 0.00 55.36 53.90 1oac s GLN 525 Cb -0.05 -1.75 0.02 0.00 1.00 0.00 0.00 33.01 32.23 1oac s GLN 525 CO 0.10 0.35 -0.09 -1.01 -2.12 0.00 0.00 175.29 172.53 1oac s HIS 526 N -2.08 3.00 -0.18 0.91 3.76 0.08 -3.64 115.29 117.13 1oac s HIS 526 Ca 0.24 -1.51 0.01 0.00 -0.15 0.00 0.00 55.06 53.65 1oac s HIS 526 Cb -0.06 -2.03 0.03 0.00 1.11 0.00 0.00 32.58 31.63 1oac s HIS 526 CO 0.12 -0.72 -0.15 0.42 -0.85 0.00 0.00 174.74 173.55 1oac s ILE 527 N 1.33 1.81 -0.03 0.60 1.01 -0.09 -0.77 121.20 125.06 1oac s ILE 527 Ca 0.02 -0.91 0.00 0.00 0.00 0.00 0.00 60.65 59.76 1oac s ILE 527 Cb -0.16 -1.73 -0.04 0.00 0.01 0.00 0.00 42.46 40.55 1oac s ILE 527 CO -0.06 0.38 0.01 -0.31 0.00 0.00 0.00 174.94 174.96 1oac s TYR 528 N 1.36 3.14 -0.07 3.97 2.02 0.18 -1.08 117.35 126.88 1oac s TYR 528 Ca 0.02 0.14 0.03 0.00 -0.37 0.00 0.00 57.07 56.89 1oac s TYR 528 Cb -0.14 -1.72 0.01 0.00 -0.40 0.00 0.00 41.96 39.71 1oac s TYR 528 CO -0.10 0.48 -0.14 1.21 -1.57 0.00 0.00 175.55 175.43 1oac s ASN 529 N -1.36 1.93 -0.16 2.29 2.47 0.28 -0.24 114.94 120.15 1oac s ASN 529 Ca 0.18 -0.33 -0.03 0.00 0.42 0.00 0.00 52.86 53.10 1oac s ASN 529 Cb -0.12 -0.87 -0.02 0.00 -1.45 0.00 0.00 41.25 38.79 1oac s ASN 529 CO 0.08 0.06 -0.06 -0.36 -3.72 0.00 0.00 177.10 173.09 1oac s PHE 530 N 0.58 2.95 -0.36 0.43 0.08 0.01 0.16 117.98 121.84 1oac s PHE 530 Ca -0.14 -0.49 -0.17 0.00 0.12 0.00 0.00 56.93 56.25 1oac s PHE 530 Cb -0.16 -1.95 -0.00 0.00 -0.57 0.00 0.00 43.02 40.34 1oac s PHE 530 CO 0.04 -0.16 0.45 0.50 -0.10 0.00 0.00 175.22 175.95 1oac s ARG 531 N 0.53 3.51 -0.30 0.44 3.52 -0.44 -1.41 118.95 124.80 1oac s ARG 531 Ca -0.05 -0.35 0.03 0.00 -0.13 0.00 0.00 55.73 55.23 1oac s ARG 531 Cb -0.15 -3.83 0.08 0.00 -1.56 0.00 0.00 34.95 29.49 1oac s ARG 531 CO 0.03 -0.64 0.01 -0.51 -0.81 0.00 0.00 175.30 173.37 1oac s LEU 532 N 2.24 3.77 -1.21 -0.88 1.43 0.13 -1.97 118.68 122.19 1oac s LEU 532 Ca 0.15 -1.76 -0.17 0.00 -1.03 0.00 0.00 54.13 51.32 1oac s LEU 532 Cb -0.16 -1.43 0.11 0.00 0.03 0.00 0.00 46.19 44.74 1oac s LEU 532 CO 0.13 -0.32 1.56 -0.62 0.23 0.00 0.00 176.35 177.33 1oac s ASP 533 N 1.12 6.87 0.33 2.29 2.15 0.22 -1.30 116.67 128.35 1oac s ASP 533 Ca 0.04 -2.50 -0.26 0.00 0.43 0.00 0.00 52.55 50.25 1oac s ASP 533 Cb -0.19 -2.50 -0.09 0.00 -0.30 0.00 0.00 42.92 39.83 1oac s ASP 533 CO -0.09 -1.05 1.02 -0.76 -0.17 0.00 0.00 175.17 174.11 1oac s LEU 534 N 3.28 4.35 -0.59 -1.34 1.43 -1.26 -0.82 118.68 123.72 1oac s LEU 534 Ca 0.48 2.03 0.05 0.00 -1.03 0.00 0.00 54.13 55.65 1oac s LEU 534 Cb 0.01 -3.94 0.17 0.00 0.03 0.00 0.00 46.19 42.45 1oac s LEU 534 CO 0.02 -0.22 0.43 -1.81 0.23 0.00 0.00 176.35 175.00 1oac s ASP 535 N -1.38 3.56 -0.59 2.29 1.01 -0.54 -4.68 116.67 116.34 1oac s ASP 535 Ca 0.51 -3.55 -0.26 0.00 0.71 0.00 0.00 52.55 49.95 1oac s ASP 535 Cb -0.24 -1.19 -0.04 0.00 1.01 0.00 0.00 42.92 42.47 1oac s ASP 535 CO 0.30 -0.12 2.06 -0.69 0.21 0.00 0.00 175.17 176.93 1oac s VAL 536 N -0.88 3.23 -1.33 -1.27 1.01 -1.26 -2.93 120.40 116.98 1oac s VAL 536 Ca 0.28 0.11 -0.05 0.00 0.00 0.00 0.00 61.98 62.32 1oac s VAL 536 Cb -0.02 -3.62 0.03 0.00 0.00 0.00 0.00 36.38 32.78 1oac s VAL 536 CO -0.18 -0.60 0.35 -0.67 0.00 0.00 0.00 175.10 174.01 1oac n ASP 537 N 14.00 -4.55 0.00 3.32 -0.08 0.28 -4.54 116.55 124.98 1oac n ASP 537 Ca 0.27 -0.18 0.00 0.00 -1.51 0.00 0.00 54.79 53.38 1oac n ASP 537 Cb 0.53 -3.76 0.00 0.00 2.34 0.00 0.00 41.12 40.23 1oac n ASP 537 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1oac n GLY 538 N -1.15 3.42 0.16 0.27 0.00 -1.15 -4.83 105.19 101.91 1oac n GLY 538 Ca -0.09 -1.70 -0.15 0.00 0.00 0.00 0.00 46.02 44.08 1oac n GLY 538 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1oac h GLU 539 N 0.00 0.45 -6.54 1.61 3.07 -1.86 -3.41 114.58 107.90 1oac h GLU 539 Ca 0.00 -0.50 -0.55 0.00 -0.50 0.00 0.00 59.36 57.81 1oac h GLU 539 Cb 0.00 0.15 -0.07 0.00 -0.84 0.00 0.00 28.75 27.99 1oac h GLU 539 CO 0.00 1.16 1.00 -0.80 -1.40 0.00 0.00 179.01 178.97 1oac s ASN 540 N -7.13 6.39 0.35 1.42 0.01 -1.26 -3.30 114.94 111.42 1oac s ASN 540 Ca -0.06 0.06 0.04 0.00 -0.71 0.00 0.00 52.86 52.19 1oac s ASN 540 Cb 0.08 -2.55 -0.05 0.00 0.41 0.00 0.00 41.25 39.13 1oac s ASN 540 CO 0.88 -1.54 0.07 0.20 -1.51 0.00 0.00 177.10 175.20 1oac s ASN 541 N 3.15 2.60 0.03 -1.22 0.01 -0.34 -4.45 114.94 114.73 1oac s ASN 541 Ca 0.43 -1.44 -0.02 0.00 -0.71 0.00 0.00 52.86 51.11 1oac s ASN 541 Cb -0.08 0.04 -0.02 0.00 0.41 0.00 0.00 41.25 41.60 1oac s ASN 541 CO 0.24 -0.67 0.01 -0.44 -1.51 0.00 0.00 177.10 174.73 1oac s SER 542 N -3.54 0.28 -0.26 -1.22 0.01 0.60 -0.83 113.70 108.74 1oac s SER 542 Ca 0.33 -0.63 -0.12 0.00 1.31 0.00 0.00 55.95 56.84 1oac s SER 542 Cb 0.07 0.16 -0.05 0.00 0.21 0.00 0.00 66.02 66.42 1oac s SER 542 CO 0.15 -0.43 0.23 -0.22 0.41 0.00 0.00 173.24 173.38 1oac s LEU 543 N -1.99 4.06 -0.08 2.44 2.96 -1.26 -0.51 118.68 124.30 1oac s LEU 543 Ca -0.07 0.12 0.04 0.00 -0.22 0.00 0.00 54.13 53.99 1oac s LEU 543 Cb -0.03 -2.20 -0.01 0.00 0.50 0.00 0.00 46.19 44.45 1oac s LEU 543 CO -0.04 -0.04 -0.21 -0.69 -1.32 0.00 0.00 176.35 174.05 1oac s VAL 544 N 1.58 2.39 -0.10 1.68 1.01 -0.23 -1.04 120.40 125.68 1oac s VAL 544 Ca 0.09 -0.93 -0.06 0.00 0.00 0.00 0.00 61.98 61.09 1oac s VAL 544 Cb -0.15 -1.91 -0.04 0.00 0.00 0.00 0.00 36.38 34.28 1oac s VAL 544 CO 0.09 0.56 0.12 0.00 0.00 0.00 0.00 175.10 175.87 1oac s ALA 545 N -0.05 3.78 -0.30 5.51 0.00 0.18 -1.44 121.76 129.44 1oac s ALA 545 Ca -0.06 -0.69 -0.02 0.00 0.00 0.00 0.00 51.96 51.19 1oac s ALA 545 Cb -0.15 -1.87 0.10 0.00 0.00 0.00 0.00 23.12 21.21 1oac s ALA 545 CO 0.05 0.63 0.12 -1.64 0.00 0.00 0.00 175.76 174.91 1oac s MET 546 N -1.11 0.47 -0.33 0.00 -1.94 -0.51 -0.81 119.30 115.07 1oac s MET 546 Ca 0.16 -0.85 -0.11 0.00 -1.71 0.00 0.00 55.69 53.18 1oac s MET 546 Cb -0.12 -1.59 -0.01 0.00 2.01 0.00 0.00 34.83 35.13 1oac s MET 546 CO 0.05 -1.01 0.20 -0.51 -0.01 0.00 0.00 175.02 173.74 1oac s ASP 547 N 1.80 5.79 0.12 3.03 1.01 0.51 -1.86 116.67 127.07 1oac s ASP 547 Ca 0.10 -0.54 -0.31 0.00 0.71 0.00 0.00 52.55 52.50 1oac s ASP 547 Cb -0.17 -2.06 -0.10 0.00 1.01 0.00 0.00 42.92 41.60 1oac s ASP 547 CO -0.29 -0.24 1.71 -2.84 0.21 0.00 0.00 175.17 173.71 1oac s PRO 548 N 1.65 4.17 0.06 8.23 0.02 -1.26 -0.11 135.00 147.77 1oac s PRO 548 Ca 0.05 2.46 0.03 0.00 0.02 0.00 0.00 61.00 63.56 1oac s PRO 548 Cb -0.17 -3.47 -0.03 0.00 0.02 0.00 0.00 34.50 30.84 1oac s PRO 548 CO 0.08 -0.75 -0.09 0.14 -0.33 0.00 0.00 177.00 176.04 1oac s VAL 549 N 2.28 0.75 -0.20 3.83 -7.23 0.16 -4.91 120.40 115.10 1oac s VAL 549 Ca 0.76 -1.31 -0.17 0.00 -1.81 0.00 0.00 61.98 59.45 1oac s VAL 549 Cb -0.44 -0.95 -0.04 0.00 0.56 0.00 0.00 36.38 35.52 1oac s VAL 549 CO 0.33 -0.43 0.44 -0.69 -0.31 0.00 0.00 175.10 174.44 1oac s VAL 550 N -1.76 5.17 0.07 1.32 1.01 -1.26 -0.19 120.40 124.76 1oac s VAL 550 Ca -0.03 0.79 0.06 0.00 0.00 0.00 0.00 61.98 62.80 1oac s VAL 550 Cb -0.07 -3.76 -0.03 0.00 0.00 0.00 0.00 36.38 32.51 1oac s VAL 550 CO 0.00 0.23 -0.17 -0.54 0.00 0.00 0.00 175.10 174.63 1oac s LYS 551 N 1.37 1.01 0.51 2.72 1.02 -0.11 -4.95 119.74 121.30 1oac s LYS 551 Ca 0.21 -0.98 -0.23 0.00 0.02 0.00 0.00 55.97 54.99 1oac s LYS 551 Cb -0.15 -1.11 -0.07 0.00 -0.52 0.00 0.00 37.83 35.98 1oac s LYS 551 CO 0.09 0.26 1.25 -2.30 -0.92 0.00 0.00 175.35 173.72 1oac n PRO 552 N 1.41 1.62 -2.66 -1.68 -0.02 -1.26 0.69 135.00 133.11 1oac n PRO 552 Ca -0.20 0.59 -0.42 0.00 -2.02 0.00 0.00 63.50 61.45 1oac n PRO 552 Cb 0.54 -2.42 -0.03 0.00 -0.02 0.00 0.00 33.50 31.57 1oac n PRO 552 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 1oac s ASN 553 N -0.83 7.25 0.00 2.55 3.04 0.12 -4.61 114.94 122.45 1oac s ASN 553 Ca 0.68 1.60 0.03 0.00 0.04 0.00 0.00 52.86 55.21 1oac s ASN 553 Cb -0.45 -2.56 0.04 0.00 -1.54 0.00 0.00 41.25 36.74 1oac s ASN 553 CO 0.52 -0.42 0.77 0.35 -3.04 0.00 0.00 177.10 175.27 1oac n THR 554 N 4.41 0.39 1.06 -5.21 -2.24 -1.26 -4.61 114.28 106.81 1oac n THR 554 Ca 0.08 -0.69 0.12 0.00 -2.27 0.00 0.00 64.05 61.29 1oac n THR 554 Cb 0.49 0.84 0.22 0.00 -2.10 0.00 0.00 70.33 69.77 1oac n THR 554 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1oac n ALA 555 N -0.01 3.61 0.00 6.98 0.00 -1.26 -5.08 120.51 124.75 1oac n ALA 555 Ca 0.02 -0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.05 1oac n ALA 555 Cb 0.15 -1.06 0.00 0.00 0.00 0.00 0.00 19.45 18.54 1oac n ALA 555 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1oac n GLY 556 N 1.46 -0.29 0.00 0.00 0.00 -1.26 -5.11 105.19 99.99 1oac n GLY 556 Ca 0.07 -1.82 0.00 0.00 0.00 0.00 0.00 46.02 44.27 1oac n GLY 556 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1oac n GLY 557 N -0.31 -0.64 0.26 -0.02 0.00 -1.26 -4.60 105.19 98.63 1oac n GLY 557 Ca 0.00 -1.74 0.17 0.00 0.00 0.00 0.00 46.02 44.45 1oac n GLY 557 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1oac h PRO 558 N 0.00 0.00 -6.85 1.61 0.11 -2.03 -3.46 132.00 121.39 1oac h PRO 558 Ca 0.00 0.00 -0.51 0.00 0.11 0.00 0.00 66.00 65.60 1oac h PRO 558 Cb 0.00 0.00 0.04 0.00 0.11 0.00 0.00 31.00 31.15 1oac h PRO 558 CO 0.00 0.00 0.55 1.03 -0.21 0.00 0.00 178.00 179.37 1oac s ARG 559 N -3.71 4.47 -0.02 1.05 1.81 -1.26 -4.95 118.95 116.34 1oac s ARG 559 Ca 0.00 2.00 0.14 0.00 -1.72 0.00 0.00 55.73 56.16 1oac s ARG 559 Cb 0.10 -3.10 -0.20 0.00 -0.45 0.00 0.00 34.95 31.30 1oac s ARG 559 CO 0.48 -0.01 0.69 0.25 -0.68 0.00 0.00 175.30 176.03 1oac n THR 560 N 0.93 1.46 -4.35 0.02 -2.24 -1.26 -4.59 114.28 104.25 1oac n THR 560 Ca -0.00 -0.76 -0.18 0.00 -2.27 0.00 0.00 64.05 60.84 1oac n THR 560 Cb 0.43 -0.92 -0.10 0.00 -2.10 0.00 0.00 70.33 67.64 1oac n THR 560 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1oac s SER 561 N -5.96 1.85 0.09 3.42 1.04 -1.26 0.14 113.70 113.02 1oac s SER 561 Ca -0.04 -1.26 0.01 0.00 0.48 0.00 0.00 55.95 55.14 1oac s SER 561 Cb 0.08 0.01 -0.04 0.00 0.10 0.00 0.00 66.02 66.17 1oac s SER 561 CO 0.82 -0.55 -0.05 0.42 0.98 0.00 0.00 173.24 174.86 1oac s THR 562 N -3.43 0.58 -0.38 2.02 -4.23 0.22 -4.62 115.64 105.80 1oac s THR 562 Ca 0.31 -1.91 -0.12 0.00 -1.18 0.00 0.00 61.69 58.79 1oac s THR 562 Cb 0.06 -1.68 0.03 0.00 1.34 0.00 0.00 72.50 72.25 1oac s THR 562 CO 0.10 -0.87 0.23 -0.04 -0.54 0.00 0.00 174.62 173.50 1oac s MET 563 N -3.86 2.86 0.43 3.99 -1.94 -1.26 -0.94 119.30 118.58 1oac s MET 563 Ca 0.12 -1.06 0.04 0.00 -1.71 0.00 0.00 55.69 53.07 1oac s MET 563 Cb 0.06 -3.79 -0.04 0.00 2.01 0.00 0.00 34.83 33.06 1oac s MET 563 CO -0.05 -0.71 0.04 -0.65 -0.01 0.00 0.00 175.02 173.64 1oac s GLN 564 N 1.58 1.97 -0.08 2.03 -0.21 0.74 -4.99 119.66 120.70 1oac s GLN 564 Ca 0.03 -2.18 0.03 0.00 0.02 0.00 0.00 55.36 53.26 1oac s GLN 564 Cb -0.19 -1.25 0.01 0.00 1.00 0.00 0.00 33.01 32.57 1oac s GLN 564 CO 0.07 -0.26 -0.18 0.08 -2.12 0.00 0.00 175.29 172.88 1oac s VAL 565 N -2.98 1.60 -0.50 1.09 1.01 -1.26 0.40 120.40 119.77 1oac s VAL 565 Ca 0.23 -0.75 -0.21 0.00 0.00 0.00 0.00 61.98 61.25 1oac s VAL 565 Cb 0.06 -1.41 0.04 0.00 0.00 0.00 0.00 36.38 35.07 1oac s VAL 565 CO 0.12 0.46 0.70 0.21 0.00 0.00 0.00 175.10 176.59 1oac s ASN 566 N 0.51 6.28 -0.19 3.32 3.84 0.84 -4.89 114.94 124.64 1oac s ASN 566 Ca -0.17 -0.63 -0.05 0.00 0.21 0.00 0.00 52.86 52.22 1oac s ASN 566 Cb -0.17 -2.33 -0.02 0.00 -0.55 0.00 0.00 41.25 38.18 1oac s ASN 566 CO 0.06 -0.93 -0.01 -1.58 -2.79 0.00 0.00 177.10 171.85 1oac s GLN 567 N 2.97 3.63 0.06 0.43 0.74 -1.26 -0.36 119.66 125.87 1oac s GLN 567 Ca 0.20 -0.52 -0.15 0.00 0.05 0.00 0.00 55.36 54.95 1oac s GLN 567 Cb -0.16 -3.05 0.03 0.00 1.10 0.00 0.00 33.01 30.92 1oac s GLN 567 CO 0.15 0.05 0.34 1.52 -0.55 0.00 0.00 175.29 176.81 1oac s TYR 568 N 0.89 -0.15 0.27 1.67 1.13 0.01 -4.99 117.35 116.18 1oac s TYR 568 Ca 0.01 -0.02 -0.20 0.00 -1.41 0.00 0.00 57.07 55.45 1oac s TYR 568 Cb -0.14 0.14 -0.09 0.00 -1.10 0.00 0.00 41.96 40.77 1oac s TYR 568 CO 0.02 -0.56 0.78 -0.80 -2.51 0.00 0.00 175.55 172.48 1oac s ASN 569 N -2.23 7.05 -0.31 -0.18 -0.87 -1.26 0.51 114.94 117.64 1oac s ASN 569 Ca -0.03 1.48 -0.00 0.00 -1.57 0.00 0.00 52.86 52.74 1oac s ASN 569 Cb 0.00 -2.45 0.06 0.00 -0.02 0.00 0.00 41.25 38.85 1oac s ASN 569 CO -0.05 -0.05 0.01 -0.63 -2.57 0.00 0.00 177.10 173.81 1oac s ILE 570 N -1.66 2.80 -0.90 0.60 1.01 -0.20 -4.89 121.20 117.96 1oac s ILE 570 Ca 0.47 -1.62 0.26 0.00 0.00 0.00 0.00 60.65 59.76 1oac s ILE 570 Cb -0.15 -2.70 0.07 0.00 0.01 0.00 0.00 42.46 39.69 1oac s ILE 570 CO 0.20 -0.22 1.51 0.61 0.00 0.00 0.00 174.94 177.04 1oac n GLY 571 N 4.55 -1.36 3.35 6.18 0.00 -1.26 -4.31 105.19 112.34 1oac n GLY 571 Ca -0.10 -0.26 -0.11 0.00 0.00 0.00 0.00 46.02 45.54 1oac n GLY 571 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1oac s ASN 572 N -3.37 0.15 0.33 1.61 4.22 -1.26 -0.57 114.94 116.05 1oac s ASN 572 Ca 0.10 -1.25 0.10 0.00 -2.14 0.00 0.00 52.86 49.67 1oac s ASN 572 Cb 0.17 0.47 0.58 0.00 1.28 0.00 0.00 41.25 43.75 1oac s ASN 572 CO 0.67 -0.97 1.76 -0.33 -2.04 0.00 0.00 177.10 176.19 1oac h GLU 573 N 2.46 0.12 -0.35 3.55 5.08 -1.17 -1.78 114.58 122.48 1oac h GLU 573 Ca -0.32 -0.05 -0.14 0.00 -1.00 0.00 0.00 59.36 57.85 1oac h GLU 573 Cb 1.25 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.48 1oac h GLU 573 CO 0.46 0.50 -0.33 1.96 -1.00 0.00 0.00 179.01 180.60 1oac h GLN 574 N 0.11 0.79 -0.06 2.33 1.08 -1.86 -2.59 115.11 114.91 1oac h GLN 574 Ca 0.01 -0.37 -0.17 0.00 -1.45 0.00 0.00 58.65 56.67 1oac h GLN 574 Cb 0.73 -0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 28.15 1oac h GLN 574 CO 0.06 1.00 -0.71 -0.44 -0.95 0.00 0.00 178.83 177.78 1oac h ASP 575 N 0.66 0.34 0.82 1.46 3.32 -1.94 -3.20 116.42 117.88 1oac h ASP 575 Ca 0.07 -0.22 -0.04 0.00 0.02 0.00 0.00 57.03 56.86 1oac h ASP 575 Cb 0.87 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 40.31 1oac h ASP 575 CO 0.08 0.94 -0.18 0.00 -1.72 0.00 0.00 179.24 178.36 1oac h ALA 576 N 1.05 1.06 -1.46 3.45 0.00 -1.07 -3.41 119.26 118.88 1oac h ALA 576 Ca -0.02 -0.16 -0.52 0.00 0.00 0.00 0.00 54.91 54.21 1oac h ALA 576 Cb 1.27 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 18.98 1oac h ALA 576 CO 0.11 0.22 1.24 0.00 0.00 0.00 0.00 179.25 180.82 1oac s ALA 577 N -3.76 2.42 0.21 0.00 0.00 -1.00 -4.24 121.76 115.40 1oac s ALA 577 Ca -0.00 -0.87 -0.07 0.00 0.00 0.00 0.00 51.96 51.02 1oac s ALA 577 Cb 0.11 -4.27 -0.02 0.00 0.00 0.00 0.00 23.12 18.94 1oac s ALA 577 CO 0.61 -3.60 0.29 1.14 0.00 0.00 0.00 175.76 174.21 1oac s GLN 578 N 6.47 1.33 0.42 0.00 -2.07 0.16 -5.00 119.66 120.97 1oac s GLN 578 Ca 0.56 -1.40 -0.23 0.00 -1.82 0.00 0.00 55.36 52.47 1oac s GLN 578 Cb -0.11 0.37 -0.09 0.00 -1.09 0.00 0.00 33.01 32.09 1oac s GLN 578 CO 0.19 -0.49 1.08 0.15 -1.32 0.00 0.00 175.29 174.90 1oac s LYS 579 N -4.07 4.03 -0.24 9.60 -0.14 -1.26 -1.67 119.74 125.98 1oac s LYS 579 Ca 0.28 1.56 -0.09 0.00 -1.36 0.00 0.00 55.97 56.36 1oac s LYS 579 Cb 0.03 -2.46 -0.04 0.00 -1.68 0.00 0.00 37.83 33.68 1oac s LYS 579 CO 0.09 -0.27 0.12 0.12 -0.76 0.00 0.00 175.35 174.64 1oac s PHE 580 N -1.67 3.22 -0.32 3.18 5.36 -1.26 -4.84 117.98 121.65 1oac s PHE 580 Ca 0.60 0.00 -0.12 0.00 -0.96 0.00 0.00 56.93 56.46 1oac s PHE 580 Cb -0.23 -2.24 -0.02 0.00 -0.34 0.00 0.00 43.02 40.18 1oac s PHE 580 CO 0.28 -0.07 0.21 0.34 -1.46 0.00 0.00 175.22 174.53 1oac s ASP 581 N 1.20 5.97 0.00 6.13 -1.08 -1.26 -4.97 116.67 122.66 1oac s ASP 581 Ca 0.06 -0.33 0.06 0.00 -0.52 0.00 0.00 52.55 51.82 1oac s ASP 581 Cb -0.14 -2.11 0.26 0.00 -1.46 0.00 0.00 42.92 39.47 1oac s ASP 581 CO 0.05 -0.18 1.18 -0.81 0.52 0.00 0.00 175.17 175.92 1oac n PRO 582 N 5.08 0.01 0.00 4.34 -0.04 -1.26 -0.28 135.00 142.84 1oac n PRO 582 Ca -0.13 0.38 0.13 0.00 -0.04 0.00 0.00 63.50 63.84 1oac n PRO 582 Cb 0.50 -1.50 0.44 0.00 -0.04 0.00 0.00 33.50 32.90 1oac n PRO 582 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1oac n GLY 583 N -0.87 -1.03 3.86 0.55 0.00 -1.26 -4.92 105.19 101.52 1oac n GLY 583 Ca 0.02 -0.31 -0.23 0.00 0.00 0.00 0.00 46.02 45.50 1oac n GLY 583 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1oac s THR 584 N -2.72 2.26 -0.09 2.61 -4.23 0.61 -4.53 115.64 109.55 1oac s THR 584 Ca 0.20 -1.46 0.04 0.00 -1.18 0.00 0.00 61.69 59.29 1oac s THR 584 Cb 0.19 -2.72 0.00 0.00 1.34 0.00 0.00 72.50 71.31 1oac s THR 584 CO 0.56 0.00 -0.22 -0.63 -0.54 0.00 0.00 174.62 173.79 1oac s ILE 585 N -2.60 1.93 -0.12 2.99 1.01 -0.78 -4.94 121.20 118.69 1oac s ILE 585 Ca 0.43 -0.95 0.00 0.00 0.00 0.00 0.00 60.65 60.13 1oac s ILE 585 Cb -0.01 -1.67 0.02 0.00 0.01 0.00 0.00 42.46 40.80 1oac s ILE 585 CO 0.25 0.53 -0.12 -0.13 0.00 0.00 0.00 174.94 175.48 1oac s ARG 586 N 0.33 1.94 0.12 2.79 1.81 -1.26 -1.42 118.95 123.26 1oac s ARG 586 Ca -0.17 -0.43 0.10 0.00 -1.72 0.00 0.00 55.73 53.52 1oac s ARG 586 Cb -0.17 -1.82 -0.04 0.00 -0.45 0.00 0.00 34.95 32.47 1oac s ARG 586 CO 0.08 -0.21 -0.23 -0.51 -0.68 0.00 0.00 175.30 173.75 1oac s LEU 587 N 1.45 2.47 -0.31 2.53 1.43 -0.52 -0.24 118.68 125.48 1oac s LEU 587 Ca 0.02 -0.66 -0.06 0.00 -1.03 0.00 0.00 54.13 52.39 1oac s LEU 587 Cb -0.13 -1.35 0.03 0.00 0.03 0.00 0.00 46.19 44.76 1oac s LEU 587 CO -0.07 0.18 0.08 -0.22 0.23 0.00 0.00 176.35 176.55 1oac s LEU 588 N -2.05 4.03 0.15 1.79 2.96 -0.07 -1.07 118.68 124.43 1oac s LEU 588 Ca 0.15 -0.94 0.08 0.00 -0.22 0.00 0.00 54.13 53.20 1oac s LEU 588 Cb -0.10 -1.86 -0.04 0.00 0.50 0.00 0.00 46.19 44.69 1oac s LEU 588 CO 0.07 -0.25 -0.06 -0.44 -1.32 0.00 0.00 176.35 174.35 1oac s SER 589 N 1.44 4.50 -0.46 3.68 0.01 0.33 -0.81 113.70 122.38 1oac s SER 589 Ca 0.00 -0.45 -0.11 0.00 1.31 0.00 0.00 55.95 56.70 1oac s SER 589 Cb -0.18 -0.87 0.10 0.00 0.21 0.00 0.00 66.02 65.28 1oac s SER 589 CO 0.02 0.12 0.34 0.21 0.41 0.00 0.00 173.24 174.34 1oac s ASN 590 N -2.69 5.81 0.55 2.44 3.84 0.04 -0.29 114.94 124.64 1oac s ASN 590 Ca 0.25 -1.66 0.36 0.00 0.21 0.00 0.00 52.86 52.02 1oac s ASN 590 Cb -0.10 -2.05 1.78 0.00 -0.55 0.00 0.00 41.25 40.33 1oac s ASN 590 CO 0.16 -0.65 2.09 1.55 -2.79 0.00 0.00 177.10 177.46 1oac h PRO 591 N 8.54 0.00 0.00 0.43 0.13 -1.87 -2.68 132.00 136.55 1oac h PRO 591 Ca -0.24 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.89 1oac h PRO 591 Cb 1.09 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.22 1oac h PRO 591 CO 0.85 0.00 -0.45 0.09 -0.23 0.00 0.00 178.00 178.25 1oac n ASN 592 N -2.91 0.74 -3.96 1.44 3.02 -1.26 -4.87 115.26 107.46 1oac n ASN 592 Ca -0.01 0.25 -0.16 0.00 -0.03 0.00 0.00 54.58 54.62 1oac n ASN 592 Cb 0.16 -0.11 -0.14 0.00 -0.61 0.00 0.00 39.78 39.08 1oac n ASN 592 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 1oac s LYS 593 N -3.15 0.47 0.18 3.52 1.02 -1.01 -5.10 119.74 115.66 1oac s LYS 593 Ca 0.07 -0.20 0.07 0.00 0.02 0.00 0.00 55.97 55.94 1oac s LYS 593 Cb 0.13 -0.45 -0.04 0.00 -0.52 0.00 0.00 37.83 36.94 1oac s LYS 593 CO 0.69 0.12 -0.15 -1.21 -0.92 0.00 0.00 175.35 173.88 1oac s GLU 594 N -0.11 1.25 0.37 1.68 2.02 -1.26 -0.46 118.70 122.19 1oac s GLU 594 Ca 0.02 -1.49 -0.05 0.00 0.02 0.00 0.00 54.97 53.47 1oac s GLU 594 Cb -0.02 -1.09 0.08 0.00 0.10 0.00 0.00 34.13 33.20 1oac s GLU 594 CO -0.00 0.19 0.51 0.27 0.02 0.00 0.00 175.26 176.25 1oac n ASN 595 N -0.09 0.17 -0.07 -0.19 2.04 0.23 -4.79 115.26 112.56 1oac n ASN 595 Ca -0.10 -1.26 0.13 0.00 -0.44 0.00 0.00 54.58 52.91 1oac n ASN 595 Cb 0.59 -0.37 0.53 0.00 -2.53 0.00 0.00 39.78 38.00 1oac n ASN 595 CO 0.00 0.00 0.00 -0.09 -0.44 0.00 0.00 177.26 176.73 1oac h ARG 596 N 0.00 0.34 -0.01 -3.83 2.43 -1.88 -1.39 114.38 110.03 1oac h ARG 596 Ca -0.16 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 58.99 1oac h ARG 596 Cb 0.48 -0.08 0.00 0.00 -0.42 0.00 0.00 29.97 29.96 1oac h ARG 596 CO 0.13 0.22 -0.09 -1.33 -1.51 0.00 0.00 179.97 177.39 1oac n MET 597 N -4.46 0.91 -0.60 0.20 2.81 -1.26 -4.94 117.12 109.78 1oac n MET 597 Ca 0.10 -0.35 0.00 0.00 -1.81 0.00 0.00 57.70 55.64 1oac n MET 597 Cb 0.42 -1.49 0.00 0.00 -0.71 0.00 0.00 33.22 31.43 1oac n MET 597 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1oac n GLY 598 N 1.23 0.64 3.85 3.03 0.00 -0.52 -5.07 105.19 108.34 1oac n GLY 598 Ca 0.16 -0.58 -0.36 0.00 0.00 0.00 0.00 46.02 45.25 1oac n GLY 598 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1oac s ASN 599 N -2.52 6.17 0.23 1.61 0.02 -1.26 -4.84 114.94 114.35 1oac s ASN 599 Ca 0.00 0.39 -0.32 0.00 -1.02 0.00 0.00 52.86 51.91 1oac s ASN 599 Cb 0.00 -1.95 -0.12 0.00 0.02 0.00 0.00 41.25 39.20 1oac s ASN 599 CO 0.00 0.38 1.67 -2.65 0.02 0.00 0.00 177.10 176.52 1oac n PRO 600 N 1.86 2.69 -1.97 -0.60 -0.02 -1.26 0.77 135.00 136.46 1oac n PRO 600 Ca -0.18 0.96 -0.42 0.00 -2.02 0.00 0.00 63.50 61.84 1oac n PRO 600 Cb 0.54 -2.78 -0.02 0.00 -0.02 0.00 0.00 33.50 31.22 1oac n PRO 600 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 1oac s VAL 601 N 0.80 2.60 0.22 -1.45 -7.23 0.39 -4.75 120.40 111.00 1oac s VAL 601 Ca 0.72 0.48 -0.04 0.00 -1.81 0.00 0.00 61.98 61.34 1oac s VAL 601 Cb -0.52 -3.31 -0.03 0.00 0.56 0.00 0.00 36.38 33.08 1oac s VAL 601 CO 0.37 0.07 0.24 -0.44 -0.31 0.00 0.00 175.10 175.03 1oac s SER 602 N 0.61 0.15 -0.06 4.85 0.01 -0.85 -0.78 113.70 117.62 1oac s SER 602 Ca 0.63 -1.27 0.04 0.00 1.31 0.00 0.00 55.95 56.65 1oac s SER 602 Cb -0.43 0.45 0.00 0.00 0.21 0.00 0.00 66.02 66.25 1oac s SER 602 CO 0.40 -0.94 -0.17 -0.31 0.41 0.00 0.00 173.24 172.62 1oac s TYR 603 N -4.07 1.83 -0.08 2.43 1.51 0.01 -0.44 117.35 118.54 1oac s TYR 603 Ca 0.34 -0.62 -0.24 0.00 -1.01 0.00 0.00 57.07 55.54 1oac s TYR 603 Cb 0.05 -1.26 -0.03 0.00 -0.11 0.00 0.00 41.96 40.61 1oac s TYR 603 CO 0.12 -0.25 0.73 -1.14 -1.11 0.00 0.00 175.55 173.90 1oac s GLN 604 N 0.27 4.42 -0.24 -0.62 0.74 0.10 -0.89 119.66 123.44 1oac s GLN 604 Ca -0.10 0.92 -0.07 0.00 0.05 0.00 0.00 55.36 56.15 1oac s GLN 604 Cb -0.14 -3.47 -0.03 0.00 1.10 0.00 0.00 33.01 30.47 1oac s GLN 604 CO 0.04 0.01 0.07 0.42 -0.55 0.00 0.00 175.29 175.28 1oac s ILE 605 N 0.98 4.41 -0.42 -2.34 1.01 0.67 -1.33 121.20 124.18 1oac s ILE 605 Ca 0.38 -0.14 0.03 0.00 0.00 0.00 0.00 60.65 60.92 1oac s ILE 605 Cb -0.18 -3.05 0.12 0.00 0.01 0.00 0.00 42.46 39.36 1oac s ILE 605 CO 0.18 0.36 0.17 -0.63 0.00 0.00 0.00 174.94 175.02 1oac s ILE 606 N 1.39 1.98 0.40 2.92 1.01 0.71 -4.49 121.20 125.13 1oac s ILE 606 Ca 0.05 -2.58 0.17 0.00 0.00 0.00 0.00 60.65 58.29 1oac s ILE 606 Cb -0.15 -2.42 0.17 0.00 0.01 0.00 0.00 42.46 40.08 1oac s ILE 606 CO 0.04 -0.74 1.94 -0.65 0.00 0.00 0.00 174.94 175.52 1oac h PRO 607 N 7.11 0.00 -3.97 2.79 0.11 -1.90 -1.30 132.00 134.84 1oac h PRO 607 Ca -0.06 0.00 -0.60 0.00 0.11 0.00 0.00 66.00 65.45 1oac h PRO 607 Cb 0.95 0.00 -0.40 0.00 0.11 0.00 0.00 31.00 31.67 1oac h PRO 607 CO 0.56 0.24 -0.76 -0.47 -0.21 0.00 0.00 178.00 177.37 1oac s TYR 608 N -4.33 2.22 -0.98 0.65 5.04 -1.26 -4.65 117.35 114.03 1oac s TYR 608 Ca -0.03 -1.92 0.10 0.00 -2.44 0.00 0.00 57.07 52.79 1oac s TYR 608 Cb 0.14 -1.86 0.24 0.00 0.35 0.00 0.00 41.96 40.83 1oac s TYR 608 CO 0.68 -0.84 1.15 0.00 -1.34 0.00 0.00 175.55 175.19 1oac n ALA 609 N 4.70 2.24 0.00 3.97 0.00 -0.17 -4.92 120.51 126.34 1oac n ALA 609 Ca -0.04 -1.01 0.00 0.00 0.00 0.00 0.00 53.44 52.40 1oac n ALA 609 Cb 0.43 -0.40 0.00 0.00 0.00 0.00 0.00 19.45 19.48 1oac n ALA 609 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1oac n GLY 610 N 0.49 2.60 3.62 0.00 0.00 -1.23 -4.79 105.19 105.89 1oac n GLY 610 Ca 0.10 -1.99 -0.01 0.00 0.00 0.00 0.00 46.02 44.12 1oac n GLY 610 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1oac s GLY 611 N 0.00 -0.29 0.00 -0.02 0.00 -1.26 -1.13 107.32 104.62 1oac s GLY 611 Ca 0.00 1.57 0.21 0.00 0.00 0.00 0.00 44.72 46.51 1oac s GLY 611 CO 0.00 0.49 1.03 -1.30 0.00 0.00 0.00 173.10 173.31 1oac n THR 612 N -0.16 0.00 -4.32 0.90 -2.24 -0.41 -4.90 114.28 103.15 1oac n THR 612 Ca 0.00 -0.25 -0.24 0.00 -2.27 0.00 0.00 64.05 61.29 1oac n THR 612 Cb 0.59 1.23 -0.08 0.00 -2.10 0.00 0.00 70.33 69.96 1oac n THR 612 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 1oac s HIS 613 N -2.42 2.56 0.42 4.78 4.02 -1.26 -4.95 115.29 118.45 1oac s HIS 613 Ca 0.17 -0.42 -0.25 0.00 1.02 0.00 0.00 55.06 55.57 1oac s HIS 613 Cb 0.17 -1.48 -0.10 0.00 -1.02 0.00 0.00 32.58 30.15 1oac s HIS 613 CO 0.57 0.48 1.19 -2.30 1.02 0.00 0.00 174.74 175.69 1oac n PRO 614 N -0.96 1.73 -2.14 8.40 -0.02 -1.26 -4.84 135.00 135.91 1oac n PRO 614 Ca -0.04 0.62 -0.34 0.00 -2.02 0.00 0.00 63.50 61.71 1oac n PRO 614 Cb 0.62 -2.27 0.01 0.00 -0.02 0.00 0.00 33.50 31.84 1oac n PRO 614 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1oac s VAL 615 N -1.22 3.21 -0.39 -1.45 1.01 -1.26 -0.74 120.40 119.56 1oac s VAL 615 Ca 0.62 0.70 -0.22 0.00 0.00 0.00 0.00 61.98 63.09 1oac s VAL 615 Cb -0.52 -3.25 0.01 0.00 0.00 0.00 0.00 36.38 32.62 1oac s VAL 615 CO 0.57 -0.21 0.70 0.00 0.00 0.00 0.00 175.10 176.16 1oac s ALA 616 N -1.93 3.39 -0.25 5.51 0.00 -0.69 -4.22 121.76 123.57 1oac s ALA 616 Ca 0.71 -0.90 0.18 0.00 0.00 0.00 0.00 51.96 51.95 1oac s ALA 616 Cb -0.23 -3.30 0.14 0.00 0.00 0.00 0.00 23.12 19.73 1oac s ALA 616 CO 0.30 -1.58 1.47 0.87 0.00 0.00 0.00 175.76 176.82 1oac h LYS 617 N 8.65 0.00 0.00 0.00 1.57 -1.95 -3.43 116.57 121.41 1oac h LYS 617 Ca -0.25 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.53 1oac h LYS 617 Cb 1.10 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.41 1oac h LYS 617 CO 0.89 0.33 0.00 0.41 -0.57 0.00 0.00 179.45 180.51 1oac n GLY 618 N 1.19 0.80 3.71 3.86 0.00 -1.26 -4.92 105.19 108.57 1oac n GLY 618 Ca 0.02 -0.45 -0.42 0.00 0.00 0.00 0.00 46.02 45.17 1oac n GLY 618 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1oac s ALA 619 N -1.00 3.21 -0.65 4.61 0.00 -1.24 -4.89 121.76 121.80 1oac s ALA 619 Ca 0.00 0.60 -0.05 0.00 0.00 0.00 0.00 51.96 52.51 1oac s ALA 619 Cb 0.00 -3.35 -0.02 0.00 0.00 0.00 0.00 23.12 19.75 1oac s ALA 619 CO 0.00 -0.24 2.92 1.04 0.00 0.00 0.00 175.76 179.48 1oac n GLN 620 N 3.76 2.91 -4.08 0.00 1.13 -1.26 -4.83 117.38 115.00 1oac n GLN 620 Ca 0.06 -2.24 -0.14 0.00 -1.94 0.00 0.00 57.00 52.74 1oac n GLN 620 Cb 0.50 -2.28 -0.12 0.00 0.11 0.00 0.00 30.24 28.45 1oac n GLN 620 CO 0.00 0.00 0.00 -0.06 -1.44 0.00 0.00 177.06 175.56 1oac s PHE 621 N -0.54 0.73 0.53 1.08 0.08 -1.26 -5.01 117.98 113.59 1oac s PHE 621 Ca 0.61 -0.48 -0.18 0.00 0.12 0.00 0.00 56.93 57.00 1oac s PHE 621 Cb 0.31 -0.43 -0.07 0.00 -0.57 0.00 0.00 43.02 42.25 1oac s PHE 621 CO -0.13 -0.06 1.04 0.00 -0.10 0.00 0.00 175.22 175.97 1oac s ALA 622 N -1.33 2.85 -1.43 5.36 0.00 -1.26 -4.93 121.76 121.01 1oac s ALA 622 Ca -0.09 0.47 0.17 0.00 0.00 0.00 0.00 51.96 52.51 1oac s ALA 622 Cb -0.10 -3.23 0.84 0.00 0.00 0.00 0.00 23.12 20.63 1oac s ALA 622 CO 0.01 -0.48 1.48 -0.35 0.00 0.00 0.00 175.76 176.42 1oac n PRO 623 N -1.43 0.24 0.00 0.00 -0.04 -1.26 -1.63 135.00 130.88 1oac n PRO 623 Ca 0.09 0.13 0.13 0.00 -0.04 0.00 0.00 63.50 63.81 1oac n PRO 623 Cb 0.53 -1.50 0.37 0.00 -0.04 0.00 0.00 33.50 32.86 1oac n PRO 623 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 1oac n ASP 624 N -1.29 2.01 -4.77 3.54 5.75 -1.26 -4.67 116.55 115.87 1oac n ASP 624 Ca 0.08 -1.66 -0.38 0.00 -0.01 0.00 0.00 54.79 52.82 1oac n ASP 624 Cb 0.13 0.01 -0.04 0.00 -1.03 0.00 0.00 41.12 40.19 1oac n ASP 624 CO 0.00 0.00 0.00 -1.61 -0.11 0.00 0.00 177.20 175.48 1oac s GLU 625 N -2.02 4.41 0.17 0.11 0.41 -0.64 -4.94 118.70 116.19 1oac s GLU 625 Ca 0.34 1.65 -0.12 0.00 -0.41 0.00 0.00 54.97 56.43 1oac s GLU 625 Cb 0.21 -2.87 0.07 0.00 -1.78 0.00 0.00 34.13 29.76 1oac s GLU 625 CO 0.33 0.05 1.72 -1.49 -0.49 0.00 0.00 175.26 175.38 1oac h TRP 626 N 3.17 0.91 -0.62 1.61 4.06 -1.89 -1.83 115.95 121.36 1oac h TRP 626 Ca -0.47 -0.07 -0.02 0.00 2.06 0.00 0.00 58.89 60.38 1oac h TRP 626 Cb 1.21 -0.27 -0.03 0.00 -1.00 0.00 0.00 29.16 29.07 1oac h TRP 626 CO 0.58 0.73 0.29 0.97 -3.56 0.00 0.00 178.44 177.45 1oac h ILE 627 N 0.82 1.21 -0.15 1.49 2.10 -1.92 0.93 117.51 121.99 1oac h ILE 627 Ca 0.20 -0.59 0.01 0.00 1.08 0.00 0.00 64.86 65.55 1oac h ILE 627 Cb 0.22 0.43 -0.01 0.00 -1.09 0.00 0.00 36.82 36.36 1oac h ILE 627 CO -0.01 0.25 0.05 0.22 -1.08 0.00 0.00 178.15 177.57 1oac h TYR 628 N 0.88 0.10 -0.41 2.19 5.03 -1.79 -0.15 116.97 122.81 1oac h TYR 628 Ca 0.22 0.01 -0.02 0.00 2.58 0.00 0.00 58.73 61.51 1oac h TYR 628 Cb 0.11 -0.02 -0.02 0.00 1.55 0.00 0.00 36.73 38.35 1oac h TYR 628 CO 0.01 0.05 0.18 1.25 -1.32 0.00 0.00 178.16 178.33 1oac h HIS 629 N 0.13 0.61 -0.05 -3.82 2.76 -0.95 -3.13 115.15 110.70 1oac h HIS 629 Ca 0.06 -0.04 -0.16 0.00 -2.20 0.00 0.00 60.37 58.03 1oac h HIS 629 Cb 0.03 -0.19 -0.01 0.00 1.55 0.00 0.00 27.41 28.80 1oac h HIS 629 CO -0.11 0.52 -0.69 0.00 -1.30 0.00 0.00 177.93 176.36 1oac h ARG 630 N 0.52 0.25 -3.09 5.26 3.08 -0.68 -3.37 114.38 116.35 1oac h ARG 630 Ca 0.14 -0.20 -0.62 0.00 0.07 0.00 0.00 59.98 59.37 1oac h ARG 630 Cb 0.16 0.04 -0.42 0.00 0.08 0.00 0.00 29.97 29.83 1oac h ARG 630 CO -0.01 0.84 -0.60 -0.51 -1.07 0.00 0.00 179.97 178.62 1oac s LEU 631 N -7.80 4.56 0.41 3.04 1.43 -0.08 -3.76 118.68 116.48 1oac s LEU 631 Ca -0.04 -3.68 0.09 0.00 -1.03 0.00 0.00 54.13 49.47 1oac s LEU 631 Cb 0.11 -1.57 0.87 0.00 0.03 0.00 0.00 46.19 45.63 1oac s LEU 631 CO 0.81 -0.11 2.01 0.28 0.23 0.00 0.00 176.35 179.57 1oac h SER 632 N 5.59 0.33 -0.51 2.29 0.02 -1.78 -3.16 113.55 116.32 1oac h SER 632 Ca 0.12 -0.03 0.15 0.00 -0.84 0.00 0.00 61.79 61.18 1oac h SER 632 Cb 0.78 -0.08 -0.02 0.00 0.14 0.00 0.00 62.40 63.22 1oac h SER 632 CO 0.69 0.33 0.38 2.19 -1.14 0.00 0.00 176.83 179.28 1oac h PHE 633 N 0.36 0.00 -0.23 3.45 -0.00 -1.91 -2.81 116.94 115.80 1oac h PHE 633 Ca 0.09 0.00 -0.02 0.00 -0.00 0.00 0.00 57.97 58.04 1oac h PHE 633 Cb 0.12 0.00 -0.01 0.00 -0.00 0.00 0.00 35.95 36.06 1oac h PHE 633 CO 0.00 0.00 0.06 0.52 -0.00 0.00 0.00 178.31 178.89 1oac h MET 634 N 0.00 0.32 0.00 6.09 2.86 -1.95 -3.31 114.93 118.94 1oac h MET 634 Ca 0.24 -0.04 0.00 0.00 -2.06 0.00 0.00 59.70 57.84 1oac h MET 634 Cb 0.99 -0.06 0.00 0.00 0.06 0.00 0.00 31.60 32.59 1oac h MET 634 CO -0.00 0.30 -1.01 -3.47 1.06 0.00 0.00 176.91 173.79 1oac n ASP 635 N -4.41 0.63 -4.40 1.22 2.03 -1.06 -3.61 116.55 106.95 1oac n ASP 635 Ca 0.00 -0.33 -0.30 0.00 0.52 0.00 0.00 54.79 54.68 1oac n ASP 635 Cb 0.15 0.82 -0.13 0.00 -0.72 0.00 0.00 41.12 41.24 1oac n ASP 635 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 1oac s LYS 636 N -3.16 1.74 0.15 -0.67 -0.14 -1.25 -4.66 119.74 111.76 1oac s LYS 636 Ca 0.05 -1.16 0.21 0.00 -1.36 0.00 0.00 55.97 53.70 1oac s LYS 636 Cb 0.15 -2.02 -0.05 0.00 -1.68 0.00 0.00 37.83 34.23 1oac s LYS 636 CO 0.81 0.50 0.96 1.04 -0.76 0.00 0.00 175.35 177.89 1oac n GLN 637 N 1.34 0.61 -4.16 1.68 3.00 -0.85 -4.47 117.38 114.53 1oac n GLN 637 Ca -0.17 0.14 -0.20 0.00 -0.01 0.00 0.00 57.00 56.75 1oac n GLN 637 Cb 0.52 -1.81 -0.16 0.00 0.00 0.00 0.00 30.24 28.79 1oac n GLN 637 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.06 175.89 1oac s LEU 638 N -5.44 1.31 -0.00 1.08 2.96 -0.67 -0.97 118.68 116.95 1oac s LEU 638 Ca -0.02 -0.13 0.04 0.00 -0.22 0.00 0.00 54.13 53.80 1oac s LEU 638 Cb 0.09 -0.47 -0.01 0.00 0.50 0.00 0.00 46.19 46.31 1oac s LEU 638 CO 0.80 -0.06 -0.12 0.26 -1.32 0.00 0.00 176.35 175.92 1oac s TRP 639 N 0.95 1.05 -0.06 5.38 0.52 -0.68 0.40 118.94 126.50 1oac s TRP 639 Ca -0.10 -0.21 -0.01 0.00 0.02 0.00 0.00 56.10 55.79 1oac s TRP 639 Cb -0.14 -0.67 0.03 0.00 -1.15 0.00 0.00 33.47 31.53 1oac s TRP 639 CO -0.00 -0.01 0.01 0.08 0.02 0.00 0.00 176.95 177.04 1oac s VAL 640 N -0.34 0.32 0.24 4.03 1.01 -1.26 -0.48 120.40 123.92 1oac s VAL 640 Ca 0.04 0.14 0.08 0.00 0.00 0.00 0.00 61.98 62.24 1oac s VAL 640 Cb -0.05 -0.47 -0.05 0.00 0.00 0.00 0.00 36.38 35.81 1oac s VAL 640 CO -0.00 0.24 -0.12 0.42 0.00 0.00 0.00 175.10 175.64 1oac s THR 641 N 1.85 1.79 0.15 3.92 -4.23 -0.01 -4.59 115.64 114.52 1oac s THR 641 Ca 0.03 -2.20 -0.30 0.00 -1.18 0.00 0.00 61.69 58.03 1oac s THR 641 Cb -0.12 -2.22 -0.07 0.00 1.34 0.00 0.00 72.50 71.43 1oac s THR 641 CO -0.04 -0.47 1.06 -0.60 -0.54 0.00 0.00 174.62 174.03 1oac s ARG 642 N -3.66 4.61 0.13 3.99 6.06 -1.26 -0.55 118.95 128.27 1oac s ARG 642 Ca 0.26 1.64 -0.31 0.00 -2.50 0.00 0.00 55.73 54.81 1oac s ARG 642 Cb 0.00 -3.32 -0.10 0.00 0.06 0.00 0.00 34.95 31.60 1oac s ARG 642 CO 0.10 0.09 1.74 -0.47 -2.50 0.00 0.00 175.30 174.25 1oac s TYR 643 N -0.04 2.44 -0.03 5.12 5.04 0.54 -4.82 117.35 125.61 1oac s TYR 643 Ca 0.49 0.19 -0.01 0.00 -2.44 0.00 0.00 57.07 55.31 1oac s TYR 643 Cb -0.27 -4.09 0.03 0.00 0.35 0.00 0.00 41.96 37.97 1oac s TYR 643 CO 0.33 -4.38 0.06 -1.01 -1.34 0.00 0.00 175.55 169.21 1oac s HIS 644 N 2.27 -0.00 0.30 4.97 3.76 -1.26 -5.03 115.29 120.29 1oac s HIS 644 Ca 0.77 0.23 0.05 0.00 -0.15 0.00 0.00 55.06 55.96 1oac s HIS 644 Cb -0.45 -0.26 0.81 0.00 1.11 0.00 0.00 32.58 33.78 1oac s HIS 644 CO 0.34 -0.13 1.65 -1.35 -0.85 0.00 0.00 174.74 174.40 1oac h PRO 645 N 7.55 0.24 -0.19 8.40 0.11 -2.04 -2.36 132.00 143.70 1oac h PRO 645 Ca -0.38 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.72 1oac h PRO 645 Cb 1.12 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.18 1oac h PRO 645 CO 0.40 0.16 0.00 0.41 -0.21 0.00 0.00 178.00 178.75 1oac n GLY 646 N -1.36 0.33 3.43 -0.55 0.00 -1.26 -4.76 105.19 101.03 1oac n GLY 646 Ca 0.24 -0.41 -0.44 0.00 0.00 0.00 0.00 46.02 45.41 1oac n GLY 646 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1oac s GLU 647 N -1.75 3.33 0.00 1.61 2.02 -0.89 -4.73 118.70 118.29 1oac s GLU 647 Ca 0.31 -1.41 0.00 0.00 0.02 0.00 0.00 54.97 53.89 1oac s GLU 647 Cb 0.17 -4.55 0.00 0.00 0.10 0.00 0.00 34.13 29.85 1oac s GLU 647 CO 0.25 -1.72 0.00 0.54 0.02 0.00 0.00 175.26 174.35 1oac n ARG 648 N 6.75 2.57 -4.43 1.61 1.74 -1.26 -4.88 116.66 118.76 1oac n ARG 648 Ca 0.08 0.00 -0.34 0.00 -0.77 0.00 0.00 57.85 56.82 1oac n ARG 648 Cb 0.46 -0.92 -0.14 0.00 -1.02 0.00 0.00 32.46 30.84 1oac n ARG 648 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 1oac s PHE 649 N -1.80 2.86 0.35 -1.55 0.08 -1.26 -4.80 117.98 111.85 1oac s PHE 649 Ca 0.00 -0.84 0.05 0.00 0.12 0.00 0.00 56.93 56.26 1oac s PHE 649 Cb 0.00 -1.94 0.71 0.00 -0.57 0.00 0.00 43.02 41.22 1oac s PHE 649 CO 0.00 -0.38 1.94 -1.00 -0.10 0.00 0.00 175.22 175.68 1oac h PRO 650 N 7.29 0.78 -0.17 0.24 0.13 -1.95 -1.36 132.00 136.96 1oac h PRO 650 Ca -0.33 -0.05 0.00 0.00 -0.87 0.00 0.00 66.00 64.75 1oac h PRO 650 Cb 1.19 -0.18 0.00 0.00 0.13 0.00 0.00 31.00 32.14 1oac h PRO 650 CO 0.58 0.52 0.00 -0.85 -0.23 0.00 0.00 178.00 178.02 1oac n GLU 651 N -4.49 1.97 0.00 0.86 0.00 -1.26 -1.61 120.64 116.11 1oac n GLU 651 Ca 0.12 -1.45 0.00 0.00 0.00 0.00 0.00 57.16 55.83 1oac n GLU 651 Cb 0.25 -1.45 0.00 0.00 0.00 0.00 0.00 31.44 30.25 1oac n GLU 651 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1oac n GLY 652 N 1.25 1.42 0.15 -1.84 0.00 -0.51 -4.31 105.19 101.35 1oac n GLY 652 Ca 0.17 -1.76 -0.10 0.00 0.00 0.00 0.00 46.02 44.33 1oac n GLY 652 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1oac h LYS 653 N 0.00 0.43 -3.04 1.61 3.64 -1.82 -3.37 116.57 114.01 1oac h LYS 653 Ca 0.00 -0.10 -0.64 0.00 -1.27 0.00 0.00 60.65 58.64 1oac h LYS 653 Cb 0.00 -0.06 -0.41 0.00 -0.41 0.00 0.00 32.23 31.36 1oac h LYS 653 CO 0.00 0.51 -0.46 0.66 -2.27 0.00 0.00 179.45 177.89 1oac n TYR 654 N -4.71 3.50 1.58 1.91 4.01 -1.26 -4.94 117.16 117.25 1oac n TYR 654 Ca -0.03 -4.25 0.14 0.00 -0.16 0.00 0.00 57.90 53.60 1oac n TYR 654 Cb 0.18 -0.73 0.78 0.00 -0.31 0.00 0.00 39.34 39.25 1oac n TYR 654 CO 0.00 0.00 0.00 -0.35 -0.46 0.00 0.00 176.86 176.05 1oac n PRO 655 N 1.90 0.70 -2.38 -0.72 -0.04 -1.26 -4.51 135.00 128.68 1oac n PRO 655 Ca 0.21 0.01 -0.43 0.00 -0.04 0.00 0.00 63.50 63.26 1oac n PRO 655 Cb 0.36 -1.50 -0.02 0.00 -0.04 0.00 0.00 33.50 32.30 1oac n PRO 655 CO 0.00 0.00 0.00 1.21 -0.04 0.00 0.00 175.50 176.67 1oac s ASN 656 N -2.21 6.78 -1.45 3.54 2.47 -1.26 -3.24 114.94 119.56 1oac s ASN 656 Ca 0.36 1.52 -0.10 0.00 0.42 0.00 0.00 52.86 55.07 1oac s ASN 656 Cb 0.19 -2.54 0.05 0.00 -1.45 0.00 0.00 41.25 37.50 1oac s ASN 656 CO 0.36 -0.93 0.76 0.54 -3.72 0.00 0.00 177.10 174.10 1oac n ARG 657 N 6.99 -4.96 -2.30 0.43 1.74 -1.26 -4.30 116.66 113.00 1oac n ARG 657 Ca 0.15 0.67 -0.35 0.00 -0.77 0.00 0.00 57.85 57.54 1oac n ARG 657 Cb 0.45 -5.51 -0.00 0.00 -1.02 0.00 0.00 32.46 26.38 1oac n ARG 657 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 1oac s SER 658 N -2.97 5.87 -0.02 0.55 1.04 -1.20 -4.86 113.70 112.10 1oac s SER 658 Ca 0.49 2.16 0.20 0.00 0.48 0.00 0.00 55.95 59.28 1oac s SER 658 Cb -0.24 -2.58 -0.29 0.00 0.10 0.00 0.00 66.02 63.01 1oac s SER 658 CO 0.60 -1.12 0.52 0.35 0.98 0.00 0.00 173.24 174.57 1oac n THR 659 N -1.14 0.00 -4.08 2.02 -2.24 -1.26 -4.60 114.28 102.99 1oac n THR 659 Ca 0.11 -0.37 -0.11 0.00 -2.27 0.00 0.00 64.05 61.41 1oac n THR 659 Cb 0.51 0.24 -0.07 0.00 -2.10 0.00 0.00 70.33 68.91 1oac n THR 659 CO 0.00 0.00 0.00 -1.38 -0.57 0.00 0.00 175.07 173.12 1oac s HIS 660 N -3.28 0.71 -0.41 4.78 -3.43 -1.26 -4.86 115.29 107.55 1oac s HIS 660 Ca -0.04 -1.01 -0.29 0.00 -0.80 0.00 0.00 55.06 52.92 1oac s HIS 660 Cb 0.13 -0.09 0.02 0.00 -1.43 0.00 0.00 32.58 31.22 1oac s HIS 660 CO 0.83 -0.90 1.19 0.34 -2.00 0.00 0.00 174.74 174.19 1oac s ASP 661 N -3.09 6.66 0.00 7.38 -1.08 -1.25 -4.82 116.67 120.47 1oac s ASP 661 Ca 0.29 0.75 0.12 0.00 -0.52 0.00 0.00 52.55 53.18 1oac s ASP 661 Cb 0.02 -2.55 0.28 0.00 -1.46 0.00 0.00 42.92 39.21 1oac s ASP 661 CO 0.12 -1.18 1.19 0.35 0.52 0.00 0.00 175.17 176.17 1oac n THR 662 N 6.58 0.78 0.00 1.71 -2.24 -1.26 -3.69 114.28 116.16 1oac n THR 662 Ca 0.13 -0.89 0.00 0.00 -2.27 0.00 0.00 64.05 61.02 1oac n THR 662 Cb 0.48 0.67 0.00 0.00 -2.10 0.00 0.00 70.33 69.38 1oac n THR 662 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1oac n GLY 663 N 0.62 0.61 0.34 3.38 0.00 -1.26 -4.26 105.19 104.62 1oac n GLY 663 Ca 0.11 -0.06 0.06 0.00 0.00 0.00 0.00 46.02 46.13 1oac n GLY 663 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1oac h LEU 664 N 0.00 0.56 -0.55 0.99 3.38 -1.48 -0.56 115.31 117.66 1oac h LEU 664 Ca 0.00 -0.00 0.06 0.00 0.09 0.00 0.00 57.88 58.03 1oac h LEU 664 Cb 0.00 -0.12 -0.05 0.00 0.09 0.00 0.00 40.66 40.57 1oac h LEU 664 CO 0.00 0.37 0.26 1.23 0.09 0.00 0.00 178.44 180.39 1oac h GLY 665 N 0.64 0.77 0.89 0.83 0.00 -1.85 -1.95 103.07 102.40 1oac h GLY 665 Ca 0.25 -0.17 -0.11 0.00 0.00 0.00 0.00 47.33 47.31 1oac h GLY 665 CO -0.07 0.08 -0.29 -1.61 0.00 0.00 0.00 176.54 174.65 1oac h GLN 666 N 0.49 0.57 -0.45 4.80 4.15 -1.32 -2.80 115.11 120.56 1oac h GLN 666 Ca 0.25 -0.33 0.03 0.00 0.77 0.00 0.00 58.65 59.37 1oac h GLN 666 Cb 0.20 0.03 -0.02 0.00 0.21 0.00 0.00 27.48 27.89 1oac h GLN 666 CO -0.19 0.93 0.30 1.88 -1.93 0.00 0.00 178.83 179.82 1oac h TYR 667 N 0.25 0.49 -0.02 3.99 0.05 -0.87 -2.24 116.97 118.64 1oac h TYR 667 Ca 0.02 0.01 0.00 0.00 0.05 0.00 0.00 58.73 58.81 1oac h TYR 667 Cb 0.87 -0.17 0.00 0.00 1.01 0.00 0.00 36.73 38.44 1oac h TYR 667 CO 0.08 0.29 -0.30 -1.13 -1.05 0.00 0.00 178.16 176.06 1oac n SER 668 N -4.48 1.85 -0.26 3.88 3.41 -0.76 -4.47 113.62 112.80 1oac n SER 668 Ca 0.05 -1.42 -0.05 0.00 -0.26 0.00 0.00 58.87 57.19 1oac n SER 668 Cb 0.14 0.26 0.06 0.00 -0.26 0.00 0.00 64.21 64.41 1oac n SER 668 CO 0.00 0.00 0.00 0.50 -0.16 0.00 0.00 175.04 175.38 1oac h LYS 669 N 2.43 0.98 0.00 4.33 3.64 -1.11 -2.38 116.57 124.46 1oac h LYS 669 Ca 0.00 -0.09 0.00 0.00 -1.27 0.00 0.00 60.65 59.29 1oac h LYS 669 Cb 0.70 -0.20 0.00 0.00 -0.41 0.00 0.00 32.23 32.31 1oac h LYS 669 CO 0.00 0.69 0.00 -0.40 -2.27 0.00 0.00 179.45 177.47 1oac n ASP 670 N -4.53 0.00 -3.85 4.20 5.75 -1.26 -4.92 116.55 111.94 1oac n ASP 670 Ca 0.06 0.03 -0.37 0.00 -0.01 0.00 0.00 54.79 54.51 1oac n ASP 670 Cb 0.06 -0.29 0.03 0.00 -1.03 0.00 0.00 41.12 39.88 1oac n ASP 670 CO 0.00 0.00 0.00 -3.20 -0.11 0.00 0.00 177.20 173.89 1oac n ASN 671 N -1.29 -4.84 -4.81 -1.12 4.05 -0.89 -4.93 115.26 101.42 1oac n ASN 671 Ca 0.09 -1.11 -0.31 0.00 0.45 0.00 0.00 54.58 53.70 1oac n ASN 671 Cb 0.15 -2.46 0.06 0.00 1.23 0.00 0.00 39.78 38.77 1oac n ASN 671 CO 0.00 0.00 0.00 -1.61 -3.05 0.00 0.00 177.26 172.60 1oac s GLU 672 N -6.40 2.77 0.26 1.20 2.02 -1.26 -4.52 118.70 112.77 1oac s GLU 672 Ca 0.41 1.01 -0.30 0.00 0.02 0.00 0.00 54.97 56.11 1oac s GLU 672 Cb -0.19 -1.97 -0.09 0.00 0.10 0.00 0.00 34.13 31.98 1oac s GLU 672 CO 0.91 -1.23 1.19 0.45 0.02 0.00 0.00 175.26 176.60 1oac s SER 673 N -3.70 7.08 -0.18 -0.19 0.15 -1.26 -0.75 113.70 114.85 1oac s SER 673 Ca 0.59 2.36 0.17 0.00 0.70 0.00 0.00 55.95 59.76 1oac s SER 673 Cb -0.15 -2.62 0.51 0.00 -1.71 0.00 0.00 66.02 62.05 1oac s SER 673 CO 0.55 -0.32 1.40 0.18 1.20 0.00 0.00 173.24 176.25 1oac n LEU 674 N 1.62 3.77 -4.54 3.45 4.77 0.27 -4.88 117.00 121.46 1oac n LEU 674 Ca 0.01 -3.05 -0.43 0.00 -0.03 0.00 0.00 56.01 52.51 1oac n LEU 674 Cb 0.44 -0.54 -0.06 0.00 -2.33 0.00 0.00 43.42 40.93 1oac n LEU 674 CO 0.56 0.70 0.54 -0.62 -1.33 0.00 0.00 177.39 177.24 1oac s ASP 675 N -2.04 6.40 -1.22 -1.43 2.15 -1.26 -4.28 116.67 114.99 1oac s ASP 675 Ca 0.42 -0.13 -0.08 0.00 0.43 0.00 0.00 52.55 53.18 1oac s ASP 675 Cb 0.34 -2.38 -0.01 0.00 -0.30 0.00 0.00 42.92 40.57 1oac s ASP 675 CO 0.08 -0.90 0.74 -3.20 -0.17 0.00 0.00 175.17 171.72 1oac n ASN 676 N 6.66 -3.28 -4.23 -0.34 4.05 -0.62 -4.99 115.26 112.52 1oac n ASN 676 Ca 0.02 -0.89 -0.15 0.00 0.45 0.00 0.00 54.58 54.01 1oac n ASN 676 Cb 0.48 -3.89 -0.10 0.00 1.23 0.00 0.00 39.78 37.50 1oac n ASN 676 CO 0.00 0.00 0.00 0.28 -3.05 0.00 0.00 177.26 174.49 1oac s THR 677 N -3.59 0.31 -0.50 -0.44 -1.32 -0.01 -4.54 115.64 105.56 1oac s THR 677 Ca 0.23 -2.00 -0.29 0.00 -1.21 0.00 0.00 61.69 58.42 1oac s THR 677 Cb -0.07 -2.57 0.02 0.00 -1.51 0.00 0.00 72.50 68.38 1oac s THR 677 CO 0.83 0.00 1.24 -0.62 -2.21 0.00 0.00 174.62 173.85 1oac s ASP 678 N -3.26 6.48 0.21 8.08 -1.08 -1.21 -1.20 116.67 124.69 1oac s ASP 678 Ca 0.38 0.44 0.06 0.00 -0.52 0.00 0.00 52.55 52.91 1oac s ASP 678 Cb 0.07 -2.55 -0.04 0.00 -1.46 0.00 0.00 42.92 38.95 1oac s ASP 678 CO 0.14 -1.39 0.17 0.00 0.52 0.00 0.00 175.17 174.60 1oac s ALA 679 N 4.94 3.58 -0.09 3.66 0.00 -1.26 -0.34 121.76 132.26 1oac s ALA 679 Ca 0.50 -1.32 0.02 0.00 0.00 0.00 0.00 51.96 51.16 1oac s ALA 679 Cb -0.09 -1.34 0.01 0.00 0.00 0.00 0.00 23.12 21.71 1oac s ALA 679 CO 0.30 0.37 -0.14 0.08 0.00 0.00 0.00 175.76 176.38 1oac s VAL 680 N -1.94 1.33 -0.12 0.00 1.01 0.28 -4.21 120.40 116.75 1oac s VAL 680 Ca 0.32 -0.56 -0.07 0.00 0.00 0.00 0.00 61.98 61.67 1oac s VAL 680 Cb -0.09 -1.22 -0.04 0.00 0.00 0.00 0.00 36.38 35.03 1oac s VAL 680 CO 0.24 0.40 0.14 -0.69 0.00 0.00 0.00 175.10 175.19 1oac s VAL 681 N 0.87 5.49 -0.09 2.92 1.01 -0.42 -0.83 120.40 129.36 1oac s VAL 681 Ca -0.10 0.20 0.03 0.00 0.00 0.00 0.00 61.98 62.11 1oac s VAL 681 Cb -0.15 -3.39 0.01 0.00 0.00 0.00 0.00 36.38 32.84 1oac s VAL 681 CO 0.01 0.62 -0.17 0.26 0.00 0.00 0.00 175.10 175.82 1oac s TRP 682 N -1.00 1.93 -0.18 5.22 0.52 0.36 0.22 118.94 126.01 1oac s TRP 682 Ca 0.15 -0.80 -0.01 0.00 0.02 0.00 0.00 56.10 55.46 1oac s TRP 682 Cb -0.12 -1.36 0.00 0.00 -1.15 0.00 0.00 33.47 30.84 1oac s TRP 682 CO 0.04 -0.38 -0.13 -1.64 0.02 0.00 0.00 176.95 174.86 1oac s MET 683 N 0.66 3.19 -0.17 4.98 -1.94 -0.50 -1.69 119.30 123.83 1oac s MET 683 Ca -0.14 -0.74 -0.07 0.00 -1.71 0.00 0.00 55.69 53.03 1oac s MET 683 Cb -0.16 -2.72 -0.04 0.00 2.01 0.00 0.00 34.83 33.92 1oac s MET 683 CO 0.04 -0.12 0.07 0.99 -0.01 0.00 0.00 175.02 175.99 1oac s THR 684 N 1.15 4.90 0.08 2.05 2.01 -0.14 -0.81 115.64 124.88 1oac s THR 684 Ca 0.01 -0.00 -0.07 0.00 0.31 0.00 0.00 61.69 61.94 1oac s THR 684 Cb -0.14 -3.19 -0.01 0.00 0.01 0.00 0.00 72.50 69.16 1oac s THR 684 CO -0.05 0.48 0.14 0.28 -0.69 0.00 0.00 174.62 174.78 1oac s THR 685 N 0.14 0.16 -0.84 -0.82 -1.32 0.67 -4.50 115.64 109.13 1oac s THR 685 Ca 0.05 -1.35 0.00 0.00 -1.21 0.00 0.00 61.69 59.19 1oac s THR 685 Cb -0.12 -1.40 0.00 0.00 -1.51 0.00 0.00 72.50 69.47 1oac s THR 685 CO 0.00 -0.73 0.00 0.61 -2.21 0.00 0.00 174.62 172.29 1oac n GLY 686 N -0.02 -1.33 3.30 6.08 0.00 -1.26 0.49 105.19 112.44 1oac n GLY 686 Ca -0.15 -0.97 -0.16 0.00 0.00 0.00 0.00 46.02 44.74 1oac n GLY 686 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1oac s THR 687 N -2.48 1.00 -0.26 2.61 -4.23 0.05 -1.71 115.64 110.63 1oac s THR 687 Ca 0.00 -2.03 -0.01 0.00 -1.18 0.00 0.00 61.69 58.47 1oac s THR 687 Cb 0.00 -2.22 0.04 0.00 1.34 0.00 0.00 72.50 71.65 1oac s THR 687 CO 0.00 -0.42 -0.06 -0.89 -0.54 0.00 0.00 174.62 172.71 1oac s THR 688 N -3.44 2.77 -0.47 3.99 2.01 0.08 -0.74 115.64 119.85 1oac s THR 688 Ca 0.26 -1.18 -0.17 0.00 0.31 0.00 0.00 61.69 60.91 1oac s THR 688 Cb 0.05 -2.47 0.06 0.00 0.01 0.00 0.00 72.50 70.15 1oac s THR 688 CO 0.07 0.12 0.45 -2.28 -0.69 0.00 0.00 174.62 172.28 1oac s HIS 689 N 1.28 3.19 -0.24 4.92 5.04 0.07 -3.99 115.29 125.56 1oac s HIS 689 Ca -0.02 -0.73 -0.07 0.00 -1.54 0.00 0.00 55.06 52.70 1oac s HIS 689 Cb -0.18 -3.18 -0.03 0.00 0.04 0.00 0.00 32.58 29.24 1oac s HIS 689 CO -0.04 -0.83 0.06 0.08 -2.34 0.00 0.00 174.74 171.67 1oac s VAL 690 N 1.96 4.32 0.68 0.89 1.01 -1.26 -2.95 120.40 125.05 1oac s VAL 690 Ca 0.08 -0.17 -0.11 0.00 0.00 0.00 0.00 61.98 61.77 1oac s VAL 690 Cb -0.22 -3.01 -0.00 0.00 0.00 0.00 0.00 36.38 33.16 1oac s VAL 690 CO 0.09 0.36 1.08 0.00 0.00 0.00 0.00 175.10 176.63 1oac s ALA 691 N 1.40 2.95 0.13 5.51 0.00 -1.26 -5.06 121.76 125.43 1oac s ALA 691 Ca 0.05 -0.27 -0.08 0.00 0.00 0.00 0.00 51.96 51.67 1oac s ALA 691 Cb -0.15 -3.04 -0.01 0.00 0.00 0.00 0.00 23.12 19.92 1oac s ALA 691 CO 0.03 -1.01 0.21 -0.98 0.00 0.00 0.00 175.76 174.02 1oac s ARG 692 N -5.31 1.00 0.55 0.00 1.70 -1.26 -4.63 118.95 111.00 1oac s ARG 692 Ca 0.57 -1.13 0.26 0.00 -0.47 0.00 0.00 55.73 54.96 1oac s ARG 692 Cb -0.11 0.34 1.56 0.00 -0.57 0.00 0.00 34.95 36.17 1oac s ARG 692 CO 0.52 -0.34 2.16 0.00 -1.08 0.00 0.00 175.30 176.57 1oac h ALA 693 N 2.67 1.52 0.00 7.88 0.00 -1.86 -2.42 119.26 127.05 1oac h ALA 693 Ca -0.33 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.53 1oac h ALA 693 Cb 1.21 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.99 1oac h ALA 693 CO 0.53 0.07 0.00 0.39 0.00 0.00 0.00 179.25 180.24 1oac n GLU 694 N -3.91 0.06 -0.58 0.00 4.71 -1.26 -2.50 120.64 117.15 1oac n GLU 694 Ca -0.03 0.37 0.09 0.00 -0.01 0.00 0.00 57.16 57.58 1oac n GLU 694 Cb 0.15 -1.63 0.33 0.00 -1.01 0.00 0.00 31.44 29.27 1oac n GLU 694 CO 0.00 0.00 0.00 0.39 0.09 0.00 0.00 177.13 177.61 1oac n GLU 695 N -1.75 3.69 -3.99 3.49 1.02 -0.91 -4.59 120.64 117.59 1oac n GLU 695 Ca 0.02 -2.84 -0.24 0.00 -0.02 0.00 0.00 57.16 54.09 1oac n GLU 695 Cb 0.14 -1.87 -0.17 0.00 -0.02 0.00 0.00 31.44 29.52 1oac n GLU 695 CO 0.00 0.00 0.00 -0.46 1.18 0.00 0.00 177.13 177.85 1oac s TRP 696 N -2.03 1.01 -1.45 -0.32 -0.11 -1.04 -3.10 118.94 111.90 1oac s TRP 696 Ca 0.47 -0.39 0.28 0.00 1.22 0.00 0.00 56.10 57.69 1oac s TRP 696 Cb 0.32 -0.92 1.12 0.00 -1.50 0.00 0.00 33.47 32.49 1oac s TRP 696 CO 0.20 -0.34 1.81 -0.35 -4.62 0.00 0.00 176.95 173.64 1oac n PRO 697 N 4.68 0.48 -4.04 5.86 -0.04 -1.26 -4.98 135.00 135.70 1oac n PRO 697 Ca -0.15 -0.17 -0.13 0.00 -0.04 0.00 0.00 63.50 63.02 1oac n PRO 697 Cb 0.50 -1.50 -0.13 0.00 -0.04 0.00 0.00 33.50 32.34 1oac n PRO 697 CO 0.00 0.00 0.00 -1.50 -0.04 0.00 0.00 175.50 173.96 1oac s ILE 698 N -2.63 0.29 -0.26 0.52 2.07 -1.25 -4.72 121.20 115.22 1oac s ILE 698 Ca 0.24 -0.49 -0.17 0.00 -1.41 0.00 0.00 60.65 58.82 1oac s ILE 698 Cb 0.19 -0.32 -0.03 0.00 0.13 0.00 0.00 42.46 42.44 1oac s ILE 698 CO 0.52 -0.13 0.50 -0.32 -1.91 0.00 0.00 174.94 173.59 1oac s MET 699 N -0.66 4.06 0.37 3.50 -2.45 0.23 -4.53 119.30 119.81 1oac s MET 699 Ca -0.04 0.28 -0.28 0.00 -1.25 0.00 0.00 55.69 54.39 1oac s MET 699 Cb -0.05 -3.65 -0.11 0.00 1.25 0.00 0.00 34.83 32.27 1oac s MET 699 CO -0.00 -0.35 1.49 -2.14 1.05 0.00 0.00 175.02 175.07 1oac s PRO 700 N 2.28 4.11 0.03 4.11 0.02 -1.26 -3.72 135.00 140.57 1oac s PRO 700 Ca 0.20 2.57 -0.36 0.00 0.02 0.00 0.00 61.00 63.43 1oac s PRO 700 Cb -0.16 -2.97 -0.15 0.00 0.02 0.00 0.00 34.50 31.24 1oac s PRO 700 CO 0.09 -0.53 1.55 2.41 -0.33 0.00 0.00 177.00 180.19 1oac n THR 701 N 0.52 0.13 -4.62 0.99 -1.04 -1.26 -4.80 114.28 104.20 1oac n THR 701 Ca 0.01 -0.02 -0.33 0.00 -2.04 0.00 0.00 64.05 61.67 1oac n THR 701 Cb 0.39 -1.23 -0.11 0.00 -1.82 0.00 0.00 70.33 67.55 1oac n THR 701 CO 0.00 0.00 0.00 -1.61 -0.64 0.00 0.00 175.07 172.82 1oac s GLU 702 N 1.57 2.54 0.13 -2.82 0.41 0.09 -4.91 118.70 115.72 1oac s GLU 702 Ca 0.86 -0.70 0.08 0.00 -0.41 0.00 0.00 54.97 54.81 1oac s GLU 702 Cb -0.86 -2.47 -0.04 0.00 -1.78 0.00 0.00 34.13 28.99 1oac s GLU 702 CO 0.48 0.62 -0.19 -1.58 -0.49 0.00 0.00 175.26 174.09 1oac s TRP 703 N -0.88 1.78 0.05 1.61 0.52 -1.26 -0.90 118.94 119.85 1oac s TRP 703 Ca 0.14 -0.45 0.07 0.00 0.02 0.00 0.00 56.10 55.88 1oac s TRP 703 Cb -0.11 -0.93 -0.03 0.00 -1.15 0.00 0.00 33.47 31.26 1oac s TRP 703 CO 0.04 0.26 -0.20 0.14 0.02 0.00 0.00 176.95 177.21 1oac s VAL 704 N -1.66 1.62 0.03 4.03 -7.23 -0.31 -1.29 120.40 115.58 1oac s VAL 704 Ca 0.11 -1.20 0.07 0.00 -1.81 0.00 0.00 61.98 59.15 1oac s VAL 704 Cb -0.08 -1.42 -0.02 0.00 0.56 0.00 0.00 36.38 35.43 1oac s VAL 704 CO 0.05 0.17 -0.20 -1.00 -0.31 0.00 0.00 175.10 173.81 1oac s HIS 705 N -0.83 1.79 0.15 2.82 0.09 -0.28 -1.36 115.29 117.67 1oac s HIS 705 Ca 0.07 -0.36 0.04 0.00 -0.00 0.00 0.00 55.06 54.80 1oac s HIS 705 Cb -0.09 -1.09 -0.05 0.00 -0.00 0.00 0.00 32.58 31.36 1oac s HIS 705 CO 0.02 0.06 -0.08 0.95 -0.00 0.00 0.00 174.74 175.69 1oac s THR 706 N -0.72 1.09 -0.05 1.30 -4.23 -0.51 -1.00 115.64 111.52 1oac s THR 706 Ca 0.07 -2.04 -0.18 0.00 -1.18 0.00 0.00 61.69 58.36 1oac s THR 706 Cb -0.08 -1.91 0.04 0.00 1.34 0.00 0.00 72.50 71.88 1oac s THR 706 CO 0.01 -0.69 0.41 -0.22 -0.54 0.00 0.00 174.62 173.59 1oac s LEU 707 N -3.17 0.45 -0.17 4.79 2.96 -0.49 -2.71 118.68 120.33 1oac s LEU 707 Ca 0.18 0.38 0.00 0.00 -0.22 0.00 0.00 54.13 54.47 1oac s LEU 707 Cb 0.03 1.57 0.04 0.00 0.50 0.00 0.00 46.19 48.32 1oac s LEU 707 CO 0.01 -0.42 -0.09 -0.76 -1.32 0.00 0.00 176.35 173.77 1oac s LEU 708 N -0.97 1.79 0.00 -0.68 1.43 -0.40 -0.20 118.68 119.65 1oac s LEU 708 Ca -0.10 -0.65 0.07 0.00 -1.03 0.00 0.00 54.13 52.41 1oac s LEU 708 Cb -0.04 -1.07 -0.02 0.00 0.03 0.00 0.00 46.19 45.10 1oac s LEU 708 CO 0.05 -0.13 -0.21 -0.54 0.23 0.00 0.00 176.35 175.74 1oac s LYS 709 N 1.53 1.60 0.36 1.70 1.02 -0.44 -1.17 119.74 124.34 1oac s LYS 709 Ca 0.02 -0.81 -0.28 0.00 0.02 0.00 0.00 55.97 54.91 1oac s LYS 709 Cb -0.15 -1.60 -0.11 0.00 -0.52 0.00 0.00 37.83 35.46 1oac s LYS 709 CO -0.09 0.43 1.42 -1.25 -0.92 0.00 0.00 175.35 174.94 1oac s PRO 710 N -0.72 4.17 -0.34 -1.68 0.04 -1.26 0.01 135.00 135.23 1oac s PRO 710 Ca 0.08 2.44 -0.01 0.00 0.04 0.00 0.00 61.00 63.55 1oac s PRO 710 Cb -0.08 -2.99 0.12 0.00 0.04 0.00 0.00 34.50 31.59 1oac s PRO 710 CO 0.00 -0.43 0.16 -0.46 0.04 0.00 0.00 177.00 176.32 1oac s TRP 711 N -1.13 1.04 -1.35 0.56 -0.11 0.41 -4.75 118.94 113.62 1oac s TRP 711 Ca 0.52 -1.55 0.00 0.00 1.22 0.00 0.00 56.10 56.29 1oac s TRP 711 Cb -0.44 -1.27 0.00 0.00 -1.50 0.00 0.00 33.47 30.27 1oac s TRP 711 CO 0.59 -0.84 0.00 0.09 -4.62 0.00 0.00 176.95 172.18 1oac n ASN 712 N 4.54 -4.49 0.01 5.86 3.02 -1.26 -2.01 115.26 120.92 1oac n ASN 712 Ca 0.02 0.20 -0.18 0.00 -0.03 0.00 0.00 54.58 54.60 1oac n ASN 712 Cb 0.39 -3.38 -0.10 0.00 -0.61 0.00 0.00 39.78 36.08 1oac n ASN 712 CO 0.00 0.00 0.00 0.15 -2.62 0.00 0.00 177.26 174.79 1oac h PHE 713 N 0.00 0.80 -1.09 3.10 3.57 -1.86 -3.37 116.94 118.09 1oac h PHE 713 Ca -0.30 -0.41 -0.47 0.00 3.53 0.00 0.00 57.97 60.32 1oac h PHE 713 Cb 1.03 -0.10 0.02 0.00 2.79 0.00 0.00 35.95 39.68 1oac h PHE 713 CO 0.38 1.23 -0.19 -0.06 -2.23 0.00 0.00 178.31 177.44 1oac s PHE 714 N -3.39 2.08 -1.18 0.41 0.08 -1.26 -4.87 117.98 109.85 1oac s PHE 714 Ca -0.12 -0.58 0.21 0.00 0.12 0.00 0.00 56.93 56.56 1oac s PHE 714 Cb 0.05 -2.26 -0.19 0.00 -0.57 0.00 0.00 43.02 40.05 1oac s PHE 714 CO 0.86 -0.76 0.93 -0.25 -0.10 0.00 0.00 175.22 175.90 1oac n ASP 715 N -2.01 1.18 -3.72 1.36 8.00 -1.26 -4.81 116.55 115.29 1oac n ASP 715 Ca 0.11 -1.09 0.01 0.00 0.71 0.00 0.00 54.79 54.53 1oac n ASP 715 Cb 0.61 0.90 0.02 0.00 -0.02 0.00 0.00 41.12 42.63 1oac n ASP 715 CO 0.00 0.00 0.00 -1.84 -0.39 0.00 0.00 177.20 174.97 1oac n GLU 716 N -1.22 0.30 -1.70 -1.24 0.28 -1.26 -4.93 120.64 110.88 1oac n GLU 716 Ca 0.05 -0.96 -0.58 0.00 -0.16 0.00 0.00 57.16 55.51 1oac n GLU 716 Cb 0.35 1.47 -0.07 0.00 1.43 0.00 0.00 31.44 34.62 1oac n GLU 716 CO 0.00 0.00 0.00 2.41 -0.16 0.00 0.00 177.13 179.38 1oac n THR 717 N -0.88 0.24 0.23 3.84 -1.04 -1.26 -4.82 114.28 110.59 1oac n THR 717 Ca 0.03 -0.04 0.11 0.00 -2.04 0.00 0.00 64.05 62.10 1oac n THR 717 Cb 0.58 -1.11 0.47 0.00 -1.82 0.00 0.00 70.33 68.46 1oac n THR 717 CO 0.00 0.00 0.00 -0.65 -0.64 0.00 0.00 175.07 173.78 1oac h PRO 718 N 6.67 0.00 -0.53 -2.82 0.11 -1.96 -3.13 132.00 130.34 1oac h PRO 718 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1oac h PRO 718 Cb 1.33 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.44 1oac h PRO 718 CO 0.93 0.19 0.00 0.25 -0.21 0.00 0.00 178.00 179.17 1oac n THR 719 N -3.33 0.84 -0.05 -1.15 -2.24 -1.26 -4.23 114.28 102.85 1oac n THR 719 Ca 0.00 -0.71 -0.16 0.00 -2.27 0.00 0.00 64.05 60.91 1oac n THR 719 Cb 0.42 0.24 -0.06 0.00 -2.10 0.00 0.00 70.33 68.83 1oac n THR 719 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 1oac h LEU 720 N 2.89 0.94 0.00 3.22 3.38 -1.93 -3.50 115.31 120.31 1oac h LEU 720 Ca 0.00 -0.59 0.00 0.00 0.09 0.00 0.00 57.88 57.38 1oac h LEU 720 Cb 0.79 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 41.26 1oac h LEU 720 CO 0.05 1.36 0.00 0.61 0.09 0.00 0.00 178.44 180.55 1oac n GLY 721 N 0.56 1.36 3.76 0.83 0.00 -1.26 -5.03 105.19 105.41 1oac n GLY 721 Ca -0.06 -2.24 -0.40 0.00 0.00 0.00 0.00 46.02 43.32 1oac n GLY 721 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1oac s ALA 722 N -1.35 3.37 0.06 4.61 0.00 -1.26 -4.99 121.76 122.19 1oac s ALA 722 Ca 0.00 0.84 -0.31 0.00 0.00 0.00 0.00 51.96 52.50 1oac s ALA 722 Cb 0.00 -3.31 -0.06 0.00 0.00 0.00 0.00 23.12 19.75 1oac s ALA 722 CO 0.00 -0.12 1.33 -0.51 0.00 0.00 0.00 175.76 176.46 1oac s LEU 723 N -1.54 4.35 0.00 0.00 1.43 -1.26 -5.26 118.68 116.39 1oac s LEU 723 Ca 0.45 2.15 0.00 0.00 -1.03 0.00 0.00 54.13 55.70 1oac s LEU 723 Cb -0.30 -3.58 0.00 0.00 0.03 0.00 0.00 46.19 42.34 1oac s LEU 723 CO 0.39 -0.62 0.47 0.29 0.23 0.00 0.00 176.35 177.11