#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 -1.85 -4.40 0.00 -0.00 -1.26 -5.05 115.22 102.67 1oac n HIS 6 Ca 0.00 0.13 -0.20 0.00 -0.00 0.00 0.00 57.72 57.65 1oac n HIS 6 Cb 0.00 -1.06 -0.10 0.00 -0.00 0.00 0.00 29.99 28.82 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 -2.64 1.49 0.06 -0.41 -1.94 -1.26 -4.16 119.30 110.43 1oac s MET 7 Ca 0.18 -1.76 0.03 0.00 -1.71 0.00 0.00 55.69 52.44 1oac s MET 7 Cb -0.03 -0.93 -0.03 0.00 2.01 0.00 0.00 34.83 35.85 1oac s MET 7 CO 0.15 -0.04 -0.11 0.54 -0.01 0.00 0.00 175.02 175.56 1oac s VAL 8 N -3.19 0.80 0.01 -6.03 0.11 0.17 -4.88 120.40 107.39 1oac s VAL 8 Ca 0.30 -1.21 -0.30 0.00 -2.93 0.00 0.00 61.98 57.83 1oac s VAL 8 Cb 0.05 -0.85 -0.07 0.00 -1.53 0.00 0.00 36.38 33.98 1oac s VAL 8 CO 0.11 -0.33 1.68 -2.16 -3.33 0.00 0.00 175.10 171.07 1oac s PRO 9 N -1.73 4.19 0.09 1.54 0.04 -1.26 -0.84 135.00 137.02 1oac s PRO 9 Ca -0.06 2.29 -0.35 0.00 0.04 0.00 0.00 61.00 62.92 1oac s PRO 9 Cb -0.09 -3.83 -0.15 0.00 0.04 0.00 0.00 34.50 30.47 1oac s PRO 9 CO 0.01 -0.80 1.57 1.98 0.04 0.00 0.00 177.00 179.80 1oac h MET 10 N 9.07 -0.86 -0.25 4.56 4.05 -1.66 -2.35 114.93 127.51 1oac h MET 10 Ca -0.42 0.06 -0.01 0.00 -0.28 0.00 0.00 59.70 59.05 1oac h MET 10 Cb 1.19 0.19 -0.01 0.00 -0.80 0.00 0.00 31.60 32.18 1oac h MET 10 CO 0.94 -0.57 0.09 -0.44 0.23 0.00 0.00 176.91 177.16 1oac h ASP 11 N -0.89 0.31 0.63 1.39 5.19 -1.92 -1.48 116.42 119.65 1oac h ASP 11 Ca -0.04 -0.02 -0.03 0.00 -0.62 0.00 0.00 57.03 56.32 1oac h ASP 11 Cb 0.81 -0.08 0.01 0.00 0.18 0.00 0.00 39.33 40.25 1oac h ASP 11 CO -0.15 0.30 -0.30 0.50 -3.12 0.00 0.00 179.24 176.47 1oac h LYS 12 N 0.35 -0.81 -0.24 3.56 3.64 -1.93 -2.48 116.57 118.67 1oac h LYS 12 Ca 0.09 0.06 0.06 0.00 -1.27 0.00 0.00 60.65 59.58 1oac h LYS 12 Cb 0.09 0.18 -0.07 0.00 -0.41 0.00 0.00 32.23 32.02 1oac h LYS 12 CO -0.01 -0.50 -0.31 1.15 -2.27 0.00 0.00 179.45 177.51 1oac h THR 13 N -1.10 0.28 -0.19 1.00 2.02 -1.07 -2.13 112.91 111.72 1oac h THR 13 Ca -0.09 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.08 1oac h THR 13 Cb 0.69 0.28 -0.01 0.00 -1.74 0.00 0.00 68.15 67.37 1oac h THR 13 CO 0.14 0.00 0.09 -0.07 0.37 0.00 0.00 175.52 176.05 1oac h LEU 14 N -0.33 0.26 -0.79 2.58 3.38 -1.37 -0.47 115.31 118.57 1oac h LEU 14 Ca 0.13 -0.14 0.08 0.00 0.09 0.00 0.00 57.88 58.04 1oac h LEU 14 Cb 0.53 -0.07 -0.07 0.00 0.09 0.00 0.00 40.66 41.15 1oac h LEU 14 CO -0.42 0.33 0.45 0.11 0.09 0.00 0.00 178.44 178.99 1oac h LYS 15 N 0.17 0.75 -0.09 1.13 6.56 -1.35 0.27 116.57 124.02 1oac h LYS 15 Ca 0.07 -0.05 -0.06 0.00 -1.06 0.00 0.00 60.65 59.55 1oac h LYS 15 Cb 0.14 -0.17 -0.01 0.00 -0.57 0.00 0.00 32.23 31.62 1oac h LYS 15 CO -0.01 0.50 -0.23 0.93 -2.06 0.00 0.00 179.45 178.57 1oac h GLU 16 N 0.77 0.15 0.00 3.15 4.39 -1.03 -2.22 114.58 119.80 1oac h GLU 16 Ca 0.37 -0.04 -0.01 0.00 0.34 0.00 0.00 59.36 60.01 1oac h GLU 16 Cb 0.30 -0.02 -0.00 0.00 -0.10 0.00 0.00 28.75 28.94 1oac h GLU 16 CO -0.23 0.39 -0.37 0.35 -1.16 0.00 0.00 179.01 177.99 1oac h PHE 17 N 0.14 0.00 0.00 4.33 3.57 0.45 -3.48 116.94 121.96 1oac h PHE 17 Ca 0.02 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.52 1oac h PHE 17 Cb 0.50 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.24 1oac h PHE 17 CO 0.01 0.04 0.00 0.41 -2.23 0.00 0.00 178.31 176.54 1oac n GLY 18 N 1.14 1.20 3.86 2.40 0.00 0.80 -5.07 105.19 109.52 1oac n GLY 18 Ca 0.02 -0.27 -0.35 0.00 0.00 0.00 0.00 46.02 45.43 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 3.70 0.12 4.61 0.00 -0.59 -4.84 121.76 122.77 1oac s ALA 19 Ca 0.00 -0.34 -0.26 0.00 0.00 0.00 0.00 51.96 51.37 1oac s ALA 19 Cb 0.00 -2.32 -0.07 0.00 0.00 0.00 0.00 23.12 20.74 1oac s ALA 19 CO 0.00 0.55 0.79 0.34 0.00 0.00 0.00 175.76 177.44 1oac s ASP 20 N -1.76 7.34 -0.17 0.00 2.15 0.16 -4.29 116.67 120.10 1oac s ASP 20 Ca 0.34 1.60 0.00 0.00 0.43 0.00 0.00 52.55 54.92 1oac s ASP 20 Cb -0.14 -2.50 0.03 0.00 -0.30 0.00 0.00 42.92 40.01 1oac s ASP 20 CO 0.18 0.12 -0.11 -0.69 -0.17 0.00 0.00 175.17 174.50 1oac s VAL 21 N -0.67 1.53 -0.09 1.11 1.01 -1.26 -1.81 120.40 120.22 1oac s VAL 21 Ca 0.38 -0.80 0.02 0.00 0.00 0.00 0.00 61.98 61.58 1oac s VAL 21 Cb -0.22 -1.55 -0.02 0.00 0.00 0.00 0.00 36.38 34.59 1oac s VAL 21 CO 0.26 0.28 -0.15 -1.10 0.00 0.00 0.00 175.10 174.38 1oac s GLN 22 N 1.47 3.00 -0.17 2.72 -0.21 0.03 -4.98 119.66 121.51 1oac s GLN 22 Ca 0.01 -0.71 -0.01 0.00 0.02 0.00 0.00 55.36 54.67 1oac s GLN 22 Cb -0.15 -2.49 -0.00 0.00 1.00 0.00 0.00 33.01 31.37 1oac s GLN 22 CO -0.09 0.37 -0.12 -0.46 -2.12 0.00 0.00 175.29 172.87 1oac s TRP 23 N -0.07 2.85 -0.40 0.91 -0.11 -1.26 -0.55 118.94 120.30 1oac s TRP 23 Ca -0.03 -1.01 -0.08 0.00 1.22 0.00 0.00 56.10 56.20 1oac s TRP 23 Cb -0.14 -1.96 0.07 0.00 -1.50 0.00 0.00 33.47 29.95 1oac s TRP 23 CO 0.04 -0.49 0.23 0.34 -4.62 0.00 0.00 176.95 172.44 1oac s ASP 24 N 1.00 5.56 0.18 5.86 -1.08 -0.00 -4.96 116.67 123.23 1oac s ASP 24 Ca -0.01 -1.45 -0.12 0.00 -0.52 0.00 0.00 52.55 50.45 1oac s ASP 24 Cb -0.15 -1.96 0.09 0.00 -1.46 0.00 0.00 42.92 39.45 1oac s ASP 24 CO -0.02 -0.49 1.77 -0.78 0.52 0.00 0.00 175.17 176.17 1oac h ASP 25 N 8.35 0.81 0.14 -0.34 3.58 -1.96 1.27 116.42 128.27 1oac h ASP 25 Ca -0.22 -0.13 -0.01 0.00 0.42 0.00 0.00 57.03 57.09 1oac h ASP 25 Cb 1.08 -0.21 0.00 0.00 1.72 0.00 0.00 39.33 41.92 1oac h ASP 25 CO 0.72 0.71 -0.07 0.22 -2.88 0.00 0.00 179.24 177.94 1oac h TYR 26 N 0.85 -0.18 0.00 0.28 3.20 -1.97 -3.24 116.97 115.92 1oac h TYR 26 Ca 0.21 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.08 1oac h TYR 26 Cb 0.11 0.06 0.00 0.00 1.54 0.00 0.00 36.73 38.44 1oac h TYR 26 CO -0.00 0.24 -0.00 0.00 -1.64 0.00 0.00 178.16 176.76 1oac n ALA 27 N -2.45 2.31 -3.36 1.82 0.00 -1.19 -4.94 120.51 112.70 1oac n ALA 27 Ca -0.09 -0.06 -0.17 0.00 0.00 0.00 0.00 53.44 53.12 1oac n ALA 27 Cb 0.26 -1.47 0.05 0.00 0.00 0.00 0.00 19.45 18.28 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 -1.90 -1.75 -3.77 0.00 1.13 0.43 -5.00 117.38 106.53 1oac n GLN 28 Ca 0.06 0.87 -0.13 0.00 -1.94 0.00 0.00 57.00 55.87 1oac n GLN 28 Cb 0.39 -5.19 -0.11 0.00 0.11 0.00 0.00 30.24 25.44 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 -5.39 0.81 -0.15 1.08 2.96 -0.77 -4.40 118.68 112.82 1oac s LEU 29 Ca 0.35 0.57 -0.08 0.00 -0.22 0.00 0.00 54.13 54.76 1oac s LEU 29 Cb -0.08 1.09 -0.04 0.00 0.50 0.00 0.00 46.19 47.67 1oac s LEU 29 CO 0.78 -0.14 0.12 -0.36 -1.32 0.00 0.00 176.35 175.43 1oac s PHE 30 N 0.01 3.49 -0.20 5.38 0.08 0.13 -0.82 117.98 126.05 1oac s PHE 30 Ca -0.01 0.42 -0.01 0.00 0.12 0.00 0.00 56.93 57.45 1oac s PHE 30 Cb -0.03 -2.01 0.01 0.00 -0.57 0.00 0.00 43.02 40.43 1oac s PHE 30 CO 0.01 0.55 -0.14 0.99 -0.10 0.00 0.00 175.22 176.52 1oac s THR 31 N -0.50 2.51 -0.15 0.64 2.01 0.28 -0.63 115.64 119.80 1oac s THR 31 Ca 0.12 -0.81 0.01 0.00 0.31 0.00 0.00 61.69 61.32 1oac s THR 31 Cb -0.12 -2.10 0.00 0.00 0.01 0.00 0.00 72.50 70.29 1oac s THR 31 CO 0.02 0.48 -0.17 -0.76 -0.69 0.00 0.00 174.62 173.50 1oac s LEU 32 N 1.35 2.37 -0.13 4.42 1.43 0.11 -0.79 118.68 127.44 1oac s LEU 32 Ca 0.05 -0.51 0.02 0.00 -1.03 0.00 0.00 54.13 52.67 1oac s LEU 32 Cb -0.14 -1.53 0.01 0.00 0.03 0.00 0.00 46.19 44.57 1oac s LEU 32 CO -0.10 0.09 -0.20 -0.63 0.23 0.00 0.00 176.35 175.74 1oac s ILE 33 N 0.80 1.86 -0.25 -0.59 1.01 -0.75 -0.60 121.20 122.68 1oac s ILE 33 Ca -0.06 -0.87 -0.02 0.00 0.00 0.00 0.00 60.65 59.70 1oac s ILE 33 Cb -0.15 -1.66 0.13 0.00 0.01 0.00 0.00 42.46 40.78 1oac s ILE 33 CO -0.00 0.51 0.31 -0.75 0.00 0.00 0.00 174.94 175.01 1oac s LYS 34 N 0.84 0.30 6.00 2.79 2.47 -0.53 -0.66 119.74 130.96 1oac s LYS 34 Ca -0.08 0.23 0.00 0.00 -1.56 0.00 0.00 55.97 54.56 1oac s LYS 34 Cb -0.15 -0.72 0.00 0.00 -1.46 0.00 0.00 37.83 35.49 1oac s LYS 34 CO -0.01 -0.78 0.00 -0.25 0.16 0.00 0.00 175.35 174.47 1oac n ASP 35 N 5.34 0.00 0.00 1.43 8.00 -1.26 -1.49 116.55 128.57 1oac n ASP 35 Ca -0.03 0.00 0.14 0.00 0.71 0.00 0.00 54.79 55.61 1oac n ASP 35 Cb 0.49 0.00 0.80 0.00 -0.02 0.00 0.00 41.12 42.39 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 -1.02 3.56 0.44 0.00 -1.26 -4.76 105.19 102.15 1oac n GLY 36 Ca 0.00 -0.16 -0.37 0.00 0.00 0.00 0.00 46.02 45.49 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 -2.21 3.40 -0.30 4.61 0.00 -0.55 -4.61 121.76 122.09 1oac s ALA 37 Ca 0.37 -1.02 0.01 0.00 0.00 0.00 0.00 51.96 51.32 1oac s ALA 37 Cb 0.19 -2.24 0.07 0.00 0.00 0.00 0.00 23.12 21.14 1oac s ALA 37 CO 0.37 -0.37 -0.01 -0.47 0.00 0.00 0.00 175.76 175.27 1oac s TYR 38 N 1.41 3.40 -0.05 0.00 6.14 -1.26 -1.45 117.35 125.55 1oac s TYR 38 Ca 0.06 -2.35 0.04 0.00 0.64 0.00 0.00 57.07 55.47 1oac s TYR 38 Cb -0.15 -2.32 -0.02 0.00 0.42 0.00 0.00 41.96 39.89 1oac s TYR 38 CO 0.06 -0.88 -0.17 0.08 0.64 0.00 0.00 175.55 175.28 1oac s VAL 39 N 1.11 2.84 -0.09 3.14 1.01 0.23 -0.93 120.40 127.71 1oac s VAL 39 Ca -0.02 -0.80 0.04 0.00 0.00 0.00 0.00 61.98 61.20 1oac s VAL 39 Cb -0.20 -2.10 -0.00 0.00 0.00 0.00 0.00 36.38 34.08 1oac s VAL 39 CO -0.04 0.58 -0.23 -0.54 0.00 0.00 0.00 175.10 174.87 1oac s LYS 40 N -0.60 2.75 -0.08 2.72 1.02 0.33 -0.72 119.74 125.16 1oac s LYS 40 Ca 0.09 -0.83 -0.06 0.00 0.02 0.00 0.00 55.97 55.19 1oac s LYS 40 Cb -0.11 -2.15 0.03 0.00 -0.52 0.00 0.00 37.83 35.08 1oac s LYS 40 CO 0.01 0.21 0.21 0.54 -0.92 0.00 0.00 175.35 175.40 1oac s VAL 41 N 0.26 -0.02 -0.12 3.17 0.11 0.20 -0.34 120.40 123.66 1oac s VAL 41 Ca -0.15 0.06 -0.04 0.00 -2.93 0.00 0.00 61.98 58.92 1oac s VAL 41 Cb -0.17 -0.31 -0.03 0.00 -1.53 0.00 0.00 36.38 34.34 1oac s VAL 41 CO 0.07 0.02 0.02 -0.54 -3.33 0.00 0.00 175.10 171.34 1oac s LYS 42 N 0.51 3.34 0.33 1.54 1.02 -1.26 0.21 119.74 125.43 1oac s LYS 42 Ca -0.03 -0.40 -0.29 0.00 0.02 0.00 0.00 55.97 55.27 1oac s LYS 42 Cb -0.05 -2.93 -0.12 0.00 -0.52 0.00 0.00 37.83 34.22 1oac s LYS 42 CO -0.03 0.54 1.46 -2.30 -0.92 0.00 0.00 175.35 174.10 1oac n PRO 43 N 2.67 2.46 0.00 -1.68 -0.02 -1.26 -1.73 135.00 135.44 1oac n PRO 43 Ca -0.18 0.87 0.00 0.00 -2.02 0.00 0.00 63.50 62.17 1oac n PRO 43 Cb 0.53 -2.57 0.00 0.00 -0.02 0.00 0.00 33.50 31.45 1oac n PRO 43 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1oac n GLY 44 N 1.20 2.86 3.74 -1.23 0.00 0.72 -4.93 105.19 107.56 1oac n GLY 44 Ca 0.05 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.72 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 -0.94 2.37 -0.90 4.61 0.00 -0.70 -4.82 121.76 121.37 1oac s ALA 45 Ca 0.00 1.03 0.23 0.00 0.00 0.00 0.00 51.96 53.22 1oac s ALA 45 Cb 0.00 -3.49 0.10 0.00 0.00 0.00 0.00 23.12 19.74 1oac s ALA 45 CO 0.00 -1.51 1.11 1.04 0.00 0.00 0.00 175.76 176.40 1oac n GLN 46 N -2.03 0.07 -4.38 0.00 1.13 -1.26 -4.36 117.38 106.56 1oac n GLN 46 Ca 0.14 -0.00 -0.22 0.00 -1.94 0.00 0.00 57.00 54.98 1oac n GLN 46 Cb 0.49 -1.52 -0.11 0.00 0.11 0.00 0.00 30.24 29.22 1oac n GLN 46 CO 0.00 0.00 0.00 0.95 -1.44 0.00 0.00 177.06 176.57 1oac s THR 47 N -3.05 2.02 0.17 5.09 -4.23 -1.26 -0.44 115.64 113.92 1oac s THR 47 Ca 0.08 -2.14 0.07 0.00 -1.18 0.00 0.00 61.69 58.52 1oac s THR 47 Cb 0.16 -2.05 -0.04 0.00 1.34 0.00 0.00 72.50 71.91 1oac s THR 47 CO 0.79 -0.40 -0.14 0.00 -0.54 0.00 0.00 174.62 174.33 1oac s ALA 48 N -2.39 1.79 -0.21 3.99 0.00 0.64 -4.67 121.76 120.91 1oac s ALA 48 Ca 0.22 -1.50 -0.04 0.00 0.00 0.00 0.00 51.96 50.64 1oac s ALA 48 Cb -0.04 -0.08 -0.01 0.00 0.00 0.00 0.00 23.12 22.98 1oac s ALA 48 CO 0.09 0.08 -0.03 0.42 0.00 0.00 0.00 175.76 176.32 1oac s ILE 49 N -2.62 3.54 -0.28 0.00 -1.09 0.54 -0.24 121.20 121.05 1oac s ILE 49 Ca 0.17 -0.44 0.01 0.00 -2.23 0.00 0.00 60.65 58.15 1oac s ILE 49 Cb -0.02 -2.60 0.06 0.00 -1.58 0.00 0.00 42.46 38.31 1oac s ILE 49 CO 0.05 0.43 -0.06 -0.69 -1.23 0.00 0.00 174.94 173.43 1oac s VAL 50 N 1.30 2.51 -1.47 2.92 1.01 0.54 -0.51 120.40 126.70 1oac s VAL 50 Ca 0.04 -1.54 -0.07 0.00 0.00 0.00 0.00 61.98 60.40 1oac s VAL 50 Cb -0.14 -2.47 0.05 0.00 0.00 0.00 0.00 36.38 33.82 1oac s VAL 50 CO -0.01 -0.07 0.73 0.59 0.00 0.00 0.00 175.10 176.35 1oac n ASN 51 N 4.51 -2.45 0.00 3.32 5.03 -0.10 -1.38 115.26 124.18 1oac n ASN 51 Ca -0.13 -0.88 0.00 0.00 0.87 0.00 0.00 54.58 54.43 1oac n ASN 51 Cb 0.43 -3.55 0.00 0.00 -1.02 0.00 0.00 39.78 35.64 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 -1.69 1.36 3.59 7.41 0.00 -1.23 -4.64 105.19 109.98 1oac n GLY 52 Ca -0.13 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.55 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 -0.02 2.68 0.20 1.61 -1.52 -0.48 -5.10 119.66 117.03 1oac s GLN 53 Ca 0.00 -0.62 -0.28 0.00 -1.95 0.00 0.00 55.36 52.51 1oac s GLN 53 Cb 0.00 -2.56 -0.08 0.00 -0.22 0.00 0.00 33.01 30.15 1oac s GLN 53 CO 0.00 0.64 0.87 -1.25 -0.25 0.00 0.00 175.29 175.30 1oac s PRO 54 N -1.07 4.73 -0.12 2.91 0.04 -1.26 -0.34 135.00 139.90 1oac s PRO 54 Ca 0.14 1.35 0.02 0.00 0.04 0.00 0.00 61.00 62.55 1oac s PRO 54 Cb -0.11 -3.28 0.01 0.00 0.04 0.00 0.00 34.50 31.16 1oac s PRO 54 CO 0.04 0.51 -0.16 -1.17 0.04 0.00 0.00 177.00 176.26 1oac s LEU 55 N -1.06 1.77 -0.01 -3.56 2.96 0.67 -4.93 118.68 114.52 1oac s LEU 55 Ca 0.39 -0.46 -0.30 0.00 -0.22 0.00 0.00 54.13 53.54 1oac s LEU 55 Cb -0.25 -1.15 -0.04 0.00 0.50 0.00 0.00 46.19 45.26 1oac s LEU 55 CO 0.29 0.02 1.18 0.00 -1.32 0.00 0.00 176.35 176.52 1oac s ALA 56 N 1.02 3.43 -0.03 5.97 0.00 -1.26 -0.26 121.76 130.62 1oac s ALA 56 Ca -0.05 0.69 -0.08 0.00 0.00 0.00 0.00 51.96 52.52 1oac s ALA 56 Cb -0.15 -3.47 -0.05 0.00 0.00 0.00 0.00 23.12 19.45 1oac s ALA 56 CO -0.03 -0.60 0.24 -0.51 0.00 0.00 0.00 175.76 174.87 1oac s LEU 57 N 1.71 4.39 -0.05 0.00 1.43 0.41 -4.95 118.68 121.62 1oac s LEU 57 Ca 0.56 0.57 -0.26 0.00 -1.03 0.00 0.00 54.13 53.97 1oac s LEU 57 Cb -0.26 -2.47 -0.21 0.00 0.03 0.00 0.00 46.19 43.28 1oac s LEU 57 CO 0.25 0.31 1.12 1.56 0.23 0.00 0.00 176.35 179.82 1oac h GLN 58 N 4.37 -0.03 -5.11 1.70 4.20 -1.97 -3.43 115.11 114.85 1oac h GLN 58 Ca -0.52 0.00 -0.66 0.00 0.06 0.00 0.00 58.65 57.53 1oac h GLN 58 Cb 1.21 0.01 -0.30 0.00 0.30 0.00 0.00 27.48 28.69 1oac h GLN 58 CO 0.63 0.56 -0.78 0.08 -0.67 0.00 0.00 178.83 178.65 1oac s VAL 59 N -3.75 2.81 0.94 -0.54 1.01 -1.26 -5.11 120.40 114.50 1oac s VAL 59 Ca -0.16 -0.70 -0.12 0.00 0.00 0.00 0.00 61.98 61.00 1oac s VAL 59 Cb 0.01 -2.22 0.15 0.00 0.00 0.00 0.00 36.38 34.32 1oac s VAL 59 CO 0.66 0.49 1.09 -2.84 0.00 0.00 0.00 175.10 174.50 1oac s PRO 60 N 1.10 0.90 0.17 2.72 0.02 -1.26 -4.80 135.00 133.85 1oac s PRO 60 Ca 0.00 0.88 -0.30 0.00 0.02 0.00 0.00 61.00 61.61 1oac s PRO 60 Cb -0.14 -1.76 -0.08 0.00 0.02 0.00 0.00 34.50 32.54 1oac s PRO 60 CO -0.04 -2.51 1.13 0.08 -0.33 0.00 0.00 177.00 175.34 1oac s VAL 61 N -2.84 3.79 -0.14 3.83 1.01 -1.26 -4.83 120.40 119.94 1oac s VAL 61 Ca 0.64 1.52 -0.02 0.00 0.00 0.00 0.00 61.98 64.12 1oac s VAL 61 Cb -0.19 -3.97 -0.02 0.00 0.00 0.00 0.00 36.38 32.19 1oac s VAL 61 CO 0.58 0.25 -0.06 -0.69 0.00 0.00 0.00 175.10 175.17 1oac s VAL 62 N -0.12 3.65 -0.09 2.92 1.01 -0.13 -0.20 120.40 127.45 1oac s VAL 62 Ca 0.51 -0.45 -0.05 0.00 0.00 0.00 0.00 61.98 61.99 1oac s VAL 62 Cb -0.30 -2.58 -0.04 0.00 0.00 0.00 0.00 36.38 33.46 1oac s VAL 62 CO 0.35 0.51 0.14 -0.32 0.00 0.00 0.00 175.10 175.78 1oac s MET 63 N 0.29 3.39 0.00 2.72 1.75 -1.26 0.18 119.30 126.37 1oac s MET 63 Ca -0.05 -0.21 0.00 0.00 -1.25 0.00 0.00 55.69 54.17 1oac s MET 63 Cb -0.14 -3.12 0.00 0.00 2.84 0.00 0.00 34.83 34.40 1oac s MET 63 CO 0.04 0.74 0.00 1.63 -0.65 0.00 0.00 175.02 176.78 1oac n LYS 64 N 1.71 0.00 -0.26 4.11 4.76 0.84 -4.96 118.16 124.36 1oac n LYS 64 Ca -0.17 0.00 -0.02 0.00 -2.87 0.00 0.00 58.31 55.25 1oac n LYS 64 Cb 0.54 0.00 0.01 0.00 -1.84 0.00 0.00 35.03 33.74 1oac n LYS 64 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 1oac n ASP 65 N 0.00 3.93 0.00 4.39 8.00 -1.26 -4.34 116.55 127.27 1oac n ASP 65 Ca 0.00 -2.26 0.00 0.00 0.71 0.00 0.00 54.79 53.24 1oac n ASP 65 Cb 0.00 -0.73 0.00 0.00 -0.02 0.00 0.00 41.12 40.37 1oac n ASP 65 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1oac n ASN 66 N 0.71 -0.62 -4.59 -2.24 3.02 -1.26 -5.05 115.26 105.22 1oac n ASN 66 Ca 0.05 0.00 -0.37 0.00 -0.03 0.00 0.00 54.58 54.23 1oac n ASN 66 Cb 0.56 -0.10 -0.11 0.00 -0.61 0.00 0.00 39.78 39.52 1oac n ASN 66 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 1oac s LYS 67 N -0.75 3.94 0.10 3.52 3.01 -1.26 -5.08 119.74 123.22 1oac s LYS 67 Ca 0.00 -0.34 -0.16 0.00 -1.01 0.00 0.00 55.97 54.46 1oac s LYS 67 Cb 0.00 -3.47 -0.07 0.00 -1.01 0.00 0.00 37.83 33.28 1oac s LYS 67 CO 0.00 -0.01 0.54 0.00 0.51 0.00 0.00 175.35 176.39 1oac s ALA 68 N 1.22 3.60 -0.06 5.17 0.00 -1.26 -0.11 121.76 130.32 1oac s ALA 68 Ca 0.06 -0.09 0.05 0.00 0.00 0.00 0.00 51.96 51.98 1oac s ALA 68 Cb -0.14 -2.54 -0.00 0.00 0.00 0.00 0.00 23.12 20.43 1oac s ALA 68 CO 0.05 0.44 -0.20 -1.58 0.00 0.00 0.00 175.76 174.47 1oac s TRP 69 N -1.30 2.04 0.19 0.00 0.52 0.49 -1.67 118.94 119.21 1oac s TRP 69 Ca 0.33 -0.65 0.08 0.00 0.02 0.00 0.00 56.10 55.89 1oac s TRP 69 Cb -0.17 -1.37 -0.04 0.00 -1.15 0.00 0.00 33.47 30.74 1oac s TRP 69 CO 0.18 -0.23 -0.17 0.14 0.02 0.00 0.00 176.95 176.90 1oac s VAL 70 N 0.06 1.84 0.90 4.03 -7.23 -0.02 -0.95 120.40 119.03 1oac s VAL 70 Ca -0.07 -2.09 -0.10 0.00 -1.81 0.00 0.00 61.98 57.91 1oac s VAL 70 Cb -0.13 -1.97 0.14 0.00 0.56 0.00 0.00 36.38 34.98 1oac s VAL 70 CO 0.04 -0.45 1.13 -0.55 -0.31 0.00 0.00 175.10 174.96 1oac s SER 71 N -3.02 3.08 0.32 4.85 0.15 -1.26 0.45 113.70 118.27 1oac s SER 71 Ca 0.20 2.07 0.26 0.00 0.70 0.00 0.00 55.95 59.18 1oac s SER 71 Cb -0.03 -2.54 0.88 0.00 -1.71 0.00 0.00 66.02 62.62 1oac s SER 71 CO 0.07 -2.98 1.76 -2.24 1.20 0.00 0.00 173.24 171.05 1oac h ASP 72 N -1.79 0.00 0.39 5.45 2.03 -1.90 -2.85 116.42 117.75 1oac h ASP 72 Ca -0.44 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 55.86 1oac h ASP 72 Cb 1.27 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.77 1oac h ASP 72 CO 0.44 0.00 -0.97 0.35 -1.03 0.00 0.00 179.24 178.03 1oac n THR 73 N -2.53 0.13 -0.34 1.15 -2.24 -1.26 -4.69 114.28 104.49 1oac n THR 73 Ca 0.03 -0.19 -0.01 0.00 -2.27 0.00 0.00 64.05 61.62 1oac n THR 73 Cb 0.36 0.29 0.05 0.00 -2.10 0.00 0.00 70.33 68.94 1oac n THR 73 CO 0.00 0.00 0.00 0.15 -0.57 0.00 0.00 175.07 174.65 1oac h PHE 74 N 0.00 -0.96 -0.83 4.78 3.04 -1.86 -0.94 116.94 120.16 1oac h PHE 74 Ca 0.00 0.10 0.06 0.00 3.98 0.00 0.00 57.97 62.10 1oac h PHE 74 Cb 0.68 0.56 -0.06 0.00 2.56 0.00 0.00 35.95 39.69 1oac h PHE 74 CO 0.00 -0.40 0.51 0.82 -2.02 0.00 0.00 178.31 177.22 1oac h ILE 75 N -0.03 1.05 -0.32 1.41 2.04 -1.83 -0.23 117.51 119.60 1oac h ILE 75 Ca 0.35 -0.32 -0.18 0.00 1.00 0.00 0.00 64.86 65.70 1oac h ILE 75 Cb 0.60 0.02 -0.00 0.00 -0.74 0.00 0.00 36.82 36.71 1oac h ILE 75 CO -0.93 0.17 -0.50 0.78 0.00 0.00 0.00 178.15 177.67 1oac h ASN 76 N 0.94 0.98 -0.27 1.72 2.35 -1.54 0.11 115.58 119.87 1oac h ASN 76 Ca 0.36 -0.50 -0.03 0.00 -0.55 0.00 0.00 56.30 55.57 1oac h ASN 76 Cb 0.15 -0.28 -0.01 0.00 0.05 0.00 0.00 38.32 38.23 1oac h ASN 76 CO -0.16 1.30 0.05 0.44 -1.65 0.00 0.00 177.43 177.41 1oac h ASP 77 N 0.70 0.42 0.00 5.81 3.32 -0.95 -2.25 116.42 123.48 1oac h ASP 77 Ca 0.03 -0.25 0.00 0.00 0.02 0.00 0.00 57.03 56.83 1oac h ASP 77 Cb 1.10 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 40.54 1oac h ASP 77 CO 0.11 0.57 -0.02 0.58 -1.72 0.00 0.00 179.24 178.76 1oac h VAL 78 N 0.26 0.00 -0.52 -1.35 2.07 -1.11 -3.26 116.25 112.35 1oac h VAL 78 Ca 0.08 -0.45 -0.10 0.00 0.82 0.00 0.00 66.70 67.05 1oac h VAL 78 Cb 0.32 0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 30.07 1oac h VAL 78 CO 0.00 0.00 -0.08 -0.26 0.02 0.00 0.00 177.57 177.26 1oac h PHE 79 N -0.45 1.04 -0.51 1.57 0.04 -0.94 -2.92 116.94 114.76 1oac h PHE 79 Ca 0.00 -0.19 0.00 0.00 2.80 0.00 0.00 57.97 60.58 1oac h PHE 79 Cb 0.02 -0.26 0.00 0.00 2.20 0.00 0.00 35.95 37.91 1oac h PHE 79 CO -0.01 0.97 0.00 1.04 -0.60 0.00 0.00 178.31 179.71 1oac n GLN 80 N -4.16 3.88 -0.09 1.51 3.00 -0.85 -4.66 117.38 116.01 1oac n GLN 80 Ca 0.02 -2.55 -0.00 0.00 -0.01 0.00 0.00 57.00 54.46 1oac n GLN 80 Cb 0.37 -2.00 0.28 0.00 0.00 0.00 0.00 30.24 28.89 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 3.41 0.65 0.00 1.08 4.64 -1.45 -3.47 113.55 118.41 1oac h SER 81 Ca 0.00 -0.08 0.00 0.00 -0.47 0.00 0.00 61.79 61.24 1oac h SER 81 Cb 1.55 -0.17 0.00 0.00 -0.31 0.00 0.00 62.40 63.47 1oac h SER 81 CO 0.32 0.59 0.00 0.61 -0.87 0.00 0.00 176.83 177.49 1oac n GLY 82 N -1.10 0.36 0.16 -0.77 0.00 -1.26 -4.92 105.19 97.65 1oac n GLY 82 Ca 0.04 0.00 0.05 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 -8.49 0.99 3.38 -1.91 -3.40 115.31 105.89 1oac h LEU 83 Ca 0.00 0.00 -0.63 0.00 0.09 0.00 0.00 57.88 57.34 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 0.38 0.40 -0.62 0.09 0.00 0.00 178.44 178.69 1oac s ASP 84 N -6.40 6.32 0.00 -0.43 2.15 -1.26 -4.85 116.67 112.21 1oac s ASP 84 Ca 0.05 -0.46 0.18 0.00 0.43 0.00 0.00 52.55 52.75 1oac s ASP 84 Cb 0.07 -2.39 0.50 0.00 -0.30 0.00 0.00 42.92 40.80 1oac s ASP 84 CO 0.73 -1.10 1.41 0.00 -0.17 0.00 0.00 175.17 176.04 1oac n GLN 85 N 7.03 2.11 0.05 4.34 1.13 -1.26 -4.55 117.38 126.22 1oac n GLN 85 Ca -0.00 -1.70 -0.11 0.00 -1.94 0.00 0.00 57.00 53.25 1oac n GLN 85 Cb 0.47 -1.40 -0.04 0.00 0.11 0.00 0.00 30.24 29.37 1oac n GLN 85 CO 0.00 0.00 0.00 1.15 -1.44 0.00 0.00 177.06 176.77 1oac h THR 86 N 2.97 0.55 -3.01 5.09 2.02 -1.90 -3.42 112.91 115.22 1oac h THR 86 Ca 0.00 0.00 -0.62 0.00 0.77 0.00 0.00 66.41 66.56 1oac h THR 86 Cb 0.67 0.55 -0.08 0.00 -1.74 0.00 0.00 68.15 67.55 1oac h THR 86 CO 0.00 0.00 -0.39 -0.36 0.37 0.00 0.00 175.52 175.14 1oac s PHE 87 N -6.12 3.55 0.19 3.16 0.08 -1.26 -0.39 117.98 117.20 1oac s PHE 87 Ca -0.15 0.60 0.07 0.00 0.12 0.00 0.00 56.93 57.57 1oac s PHE 87 Cb 0.09 -2.16 -0.05 0.00 -0.57 0.00 0.00 43.02 40.33 1oac s PHE 87 CO 0.67 0.49 -0.14 -0.65 -0.10 0.00 0.00 175.22 175.49 1oac s GLN 88 N -0.35 1.29 -0.07 0.44 -1.52 0.11 -4.93 119.66 114.63 1oac s GLN 88 Ca 0.16 -1.56 -0.11 0.00 -1.95 0.00 0.00 55.36 51.90 1oac s GLN 88 Cb -0.13 -1.07 -0.05 0.00 -0.22 0.00 0.00 33.01 31.54 1oac s GLN 88 CO 0.05 0.18 0.26 0.14 -0.25 0.00 0.00 175.29 175.66 1oac s VAL 89 N -2.95 5.29 -0.04 1.09 -7.23 -1.26 -2.53 120.40 112.76 1oac s VAL 89 Ca 0.21 0.50 -0.28 0.00 -1.81 0.00 0.00 61.98 60.59 1oac s VAL 89 Cb -0.01 -3.54 -0.03 0.00 0.56 0.00 0.00 36.38 33.36 1oac s VAL 89 CO 0.06 0.59 0.92 -0.70 -0.31 0.00 0.00 175.10 175.66 1oac s GLU 90 N -1.00 4.49 -0.19 4.82 2.12 -1.26 -4.82 118.70 122.86 1oac s GLU 90 Ca 0.19 1.28 0.02 0.00 0.36 0.00 0.00 54.97 56.82 1oac s GLU 90 Cb -0.14 -3.48 -0.22 0.00 0.26 0.00 0.00 34.13 30.56 1oac s GLU 90 CO 0.08 -0.09 0.08 1.17 -0.54 0.00 0.00 175.26 175.96 1oac n LYS 91 N 4.15 0.69 -3.73 4.30 4.81 -1.26 -4.74 118.16 122.37 1oac n LYS 91 Ca 0.05 0.18 -0.37 0.00 -0.87 0.00 0.00 58.31 57.29 1oac n LYS 91 Cb 0.51 -1.60 -0.11 0.00 0.02 0.00 0.00 35.03 33.84 1oac n LYS 91 CO 0.00 0.00 0.00 1.03 1.17 0.00 0.00 177.40 179.60 1oac s ARG 92 N -2.54 2.24 0.27 1.64 0.52 -1.26 -5.07 118.95 114.76 1oac s ARG 92 Ca -0.25 -1.65 -0.30 0.00 -0.52 0.00 0.00 55.73 53.01 1oac s ARG 92 Cb 0.08 -3.60 -0.11 0.00 0.52 0.00 0.00 34.95 31.84 1oac s ARG 92 CO 0.71 -0.99 1.53 -1.25 0.02 0.00 0.00 175.30 175.31 1oac s PRO 93 N 1.24 4.19 0.09 3.54 0.04 -1.26 -4.96 135.00 137.88 1oac s PRO 93 Ca 0.05 2.45 -0.31 0.00 0.04 0.00 0.00 61.00 63.23 1oac s PRO 93 Cb -0.23 -3.07 -0.06 0.00 0.04 0.00 0.00 34.50 31.18 1oac s PRO 93 CO -0.02 -0.54 1.23 -1.58 0.04 0.00 0.00 177.00 176.13 1oac s HIS 94 N 0.05 3.41 0.60 0.56 2.46 -1.26 -4.92 115.29 116.19 1oac s HIS 94 Ca 0.62 1.27 0.30 0.00 0.47 0.00 0.00 55.06 57.72 1oac s HIS 94 Cb -0.45 -3.46 1.63 0.00 -0.13 0.00 0.00 32.58 30.17 1oac s HIS 94 CO 0.45 -1.42 2.03 -1.00 -2.47 0.00 0.00 174.74 172.33 1oac h PRO 95 N 6.50 0.00 -0.36 2.88 0.13 -1.96 -0.38 132.00 138.80 1oac h PRO 95 Ca -0.42 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.71 1oac h PRO 95 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 1oac h PRO 95 CO 0.81 0.00 0.00 1.28 -0.23 0.00 0.00 178.00 179.86 1oac n LEU 96 N -3.63 2.76 -4.65 1.56 4.77 -1.26 -4.77 117.00 111.78 1oac n LEU 96 Ca 0.03 -1.23 -0.44 0.00 -0.03 0.00 0.00 56.01 54.34 1oac n LEU 96 Cb 0.42 -0.23 -0.02 0.00 -2.33 0.00 0.00 43.42 41.26 1oac n LEU 96 CO 0.25 0.62 0.82 0.59 -1.33 0.00 0.00 177.39 178.33 1oac n ASN 97 N 1.03 2.22 -4.29 -1.43 5.03 -0.16 -4.93 115.26 112.73 1oac n ASN 97 Ca 0.18 1.18 -0.29 0.00 0.87 0.00 0.00 54.58 56.52 1oac n ASN 97 Cb 0.48 -1.39 0.26 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 -0.77 -0.49 0.17 5.41 0.00 -1.26 -4.92 121.76 119.91 1oac s ALA 98 Ca 0.61 -0.33 -0.31 0.00 0.00 0.00 0.00 51.96 51.93 1oac s ALA 98 Cb -0.65 -3.16 -0.09 0.00 0.00 0.00 0.00 23.12 19.22 1oac s ALA 98 CO 0.58 -3.96 1.40 -0.51 0.00 0.00 0.00 175.76 173.27 1oac s LEU 99 N -7.30 4.39 0.77 0.00 1.43 -1.26 -5.01 118.68 111.70 1oac s LEU 99 Ca 0.68 2.46 -0.12 0.00 -1.03 0.00 0.00 54.13 56.13 1oac s LEU 99 Cb -0.22 -3.60 0.06 0.00 0.03 0.00 0.00 46.19 42.45 1oac s LEU 99 CO 0.63 -0.65 1.15 0.42 0.23 0.00 0.00 176.35 178.12 1oac s THR 100 N 0.59 2.58 0.40 5.49 -4.23 -1.26 -4.82 115.64 114.38 1oac s THR 100 Ca 0.62 0.19 0.12 0.00 -1.18 0.00 0.00 61.69 61.44 1oac s THR 100 Cb -0.39 -3.18 0.33 0.00 1.34 0.00 0.00 72.50 70.60 1oac s THR 100 CO 0.35 -0.25 1.92 0.00 -0.54 0.00 0.00 174.62 176.11 1oac h ALA 101 N -0.91 1.95 -0.23 3.99 0.00 -1.95 -0.95 119.26 121.16 1oac h ALA 101 Ca -0.46 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.41 1oac h ALA 101 Cb 1.30 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.98 1oac h ALA 101 CO 0.65 -0.14 -0.02 -0.44 0.00 0.00 0.00 179.25 179.30 1oac h ASP 102 N 0.55 0.41 -0.22 0.00 3.32 -1.99 -1.76 116.42 116.74 1oac h ASP 102 Ca 0.37 -0.33 -0.08 0.00 0.02 0.00 0.00 57.03 57.00 1oac h ASP 102 Cb 0.66 -0.11 -0.02 0.00 0.22 0.00 0.00 39.33 40.08 1oac h ASP 102 CO -0.13 0.65 -0.13 -0.33 -1.72 0.00 0.00 179.24 177.57 1oac h GLU 103 N 0.17 0.62 -0.11 3.56 5.08 -1.60 -0.94 114.58 121.36 1oac h GLU 103 Ca 0.06 -0.20 -0.02 0.00 -1.00 0.00 0.00 59.36 58.21 1oac h GLU 103 Cb 0.45 -0.06 -0.00 0.00 0.50 0.00 0.00 28.75 29.64 1oac h GLU 103 CO 0.02 0.74 0.01 0.82 -1.00 0.00 0.00 179.01 179.59 1oac h ILE 104 N 0.57 1.23 -0.70 3.13 2.04 -1.10 -2.14 117.51 120.54 1oac h ILE 104 Ca 0.10 -0.74 -0.00 0.00 1.00 0.00 0.00 64.86 65.22 1oac h ILE 104 Cb 0.56 1.51 -0.03 0.00 -0.74 0.00 0.00 36.82 38.11 1oac h ILE 104 CO 0.04 0.21 0.43 0.11 0.00 0.00 0.00 178.15 178.93 1oac h LYS 105 N -0.06 0.94 0.07 2.37 1.57 -1.19 -2.12 116.57 118.15 1oac h LYS 105 Ca 0.03 -0.08 0.01 0.00 -1.87 0.00 0.00 60.65 58.74 1oac h LYS 105 Cb 0.32 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 32.42 1oac h LYS 105 CO 0.00 0.66 -0.09 0.37 -0.57 0.00 0.00 179.45 179.83 1oac h GLN 106 N 0.95 -0.18 -0.65 3.15 4.15 -1.12 -1.94 115.11 119.47 1oac h GLN 106 Ca 0.25 0.01 0.06 0.00 0.77 0.00 0.00 58.65 59.74 1oac h GLN 106 Cb -0.04 0.04 -0.05 0.00 0.21 0.00 0.00 27.48 27.63 1oac h GLN 106 CO -0.05 -0.12 0.36 0.00 -1.93 0.00 0.00 178.83 177.09 1oac h ALA 107 N 0.74 0.87 -0.37 3.38 0.00 -1.26 -1.06 119.26 121.56 1oac h ALA 107 Ca 0.01 0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.88 1oac h ALA 107 Cb 0.19 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 1oac h ALA 107 CO -0.04 0.03 -0.02 0.28 0.00 0.00 0.00 179.25 179.50 1oac h VAL 108 N 0.66 1.22 -0.34 0.00 2.07 -1.19 -2.42 116.25 116.26 1oac h VAL 108 Ca 0.29 -0.89 -0.05 0.00 0.82 0.00 0.00 66.70 66.87 1oac h VAL 108 Cb 0.19 0.96 -0.01 0.00 -1.52 0.00 0.00 31.29 30.90 1oac h VAL 108 CO -0.18 0.31 0.02 -0.33 0.02 0.00 0.00 177.57 177.40 1oac h GLU 109 N 0.57 0.58 -0.23 1.57 5.08 -0.65 -2.13 114.58 119.37 1oac h GLU 109 Ca 0.12 -0.17 -0.02 0.00 -1.00 0.00 0.00 59.36 58.28 1oac h GLU 109 Cb 0.40 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.58 1oac h GLU 109 CO 0.02 0.69 0.07 0.82 -1.00 0.00 0.00 179.01 179.61 1oac h ILE 110 N 0.40 1.19 -0.17 3.13 2.04 -0.96 -2.44 117.51 120.70 1oac h ILE 110 Ca 0.10 -0.60 -0.14 0.00 1.00 0.00 0.00 64.86 65.22 1oac h ILE 110 Cb 0.41 1.16 -0.01 0.00 -0.74 0.00 0.00 36.82 37.64 1oac h ILE 110 CO 0.01 0.19 -0.48 -0.37 0.00 0.00 0.00 178.15 177.51 1oac h VAL 111 N 0.21 1.32 0.00 1.67 -1.51 -1.43 -2.95 116.25 113.56 1oac h VAL 111 Ca 0.07 -1.70 -0.02 0.00 -1.23 0.00 0.00 66.70 63.83 1oac h VAL 111 Cb 0.23 1.72 -0.00 0.00 -2.13 0.00 0.00 31.29 31.11 1oac h VAL 111 CO -0.00 0.52 -0.08 0.11 -1.23 0.00 0.00 177.57 176.89 1oac h LYS 112 N 0.35 0.00 0.00 5.19 1.57 -1.37 -1.33 116.57 120.97 1oac h LYS 112 Ca 0.02 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.80 1oac h LYS 112 Cb 0.98 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.29 1oac h LYS 112 CO 0.09 0.08 -0.22 0.00 -0.57 0.00 0.00 179.45 178.82 1oac n ALA 113 N -2.16 2.56 -1.76 3.86 0.00 -0.92 -4.85 120.51 117.23 1oac n ALA 113 Ca -0.01 -0.12 -0.40 0.00 0.00 0.00 0.00 53.44 52.91 1oac n ALA 113 Cb 0.27 -1.36 -0.03 0.00 0.00 0.00 0.00 19.45 18.33 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 -4.18 6.97 0.34 0.00 0.15 -0.50 -4.94 113.70 111.53 1oac s SER 114 Ca 0.10 2.40 0.06 0.00 0.70 0.00 0.00 55.95 59.20 1oac s SER 114 Cb 0.14 -2.63 0.71 0.00 -1.71 0.00 0.00 66.02 62.53 1oac s SER 114 CO 0.63 -0.37 1.91 0.00 1.20 0.00 0.00 173.24 176.62 1oac h ALA 115 N 3.42 1.70 0.00 5.45 0.00 -1.88 -2.23 119.26 125.72 1oac h ALA 115 Ca -0.48 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.43 1oac h ALA 115 Cb 1.22 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.82 1oac h ALA 115 CO 0.65 0.13 0.00 -0.25 0.00 0.00 0.00 179.25 179.78 1oac n ASP 116 N -4.51 0.00 -4.71 0.00 8.00 -1.26 -4.91 116.55 109.16 1oac n ASP 116 Ca 0.14 0.49 -0.42 0.00 0.71 0.00 0.00 54.79 55.71 1oac n ASP 116 Cb 0.31 -0.50 -0.03 0.00 -0.02 0.00 0.00 41.12 40.89 1oac n ASP 116 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 1oac s PHE 117 N -2.99 2.83 -0.01 1.24 5.36 -0.84 -5.03 117.98 118.54 1oac s PHE 117 Ca 0.14 0.53 0.02 0.00 -0.96 0.00 0.00 56.93 56.66 1oac s PHE 117 Cb 0.18 -3.92 -0.03 0.00 -0.34 0.00 0.00 43.02 38.90 1oac s PHE 117 CO 0.51 -3.51 -0.04 0.15 -1.46 0.00 0.00 175.22 170.86 1oac s LYS 118 N 1.72 2.67 0.55 10.12 1.02 -1.26 -5.03 119.74 129.52 1oac s LYS 118 Ca 0.71 -0.65 0.23 0.00 0.02 0.00 0.00 55.97 56.28 1oac s LYS 118 Cb -0.42 -2.59 1.47 0.00 -0.52 0.00 0.00 37.83 35.78 1oac s LYS 118 CO 0.31 0.62 2.11 -1.00 -0.92 0.00 0.00 175.35 176.48 1oac h PRO 119 N 4.53 0.00 0.00 -1.68 0.13 -2.01 -2.42 132.00 130.54 1oac h PRO 119 Ca -0.49 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 1oac h PRO 119 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 1oac h PRO 119 CO 0.55 0.00 -0.08 0.27 -0.23 0.00 0.00 178.00 178.51 1oac n ASN 120 N -4.23 0.11 -4.71 1.44 6.94 -1.26 -4.91 115.26 108.63 1oac n ASN 120 Ca 0.01 0.39 -0.43 0.00 -0.02 0.00 0.00 54.58 54.53 1oac n ASN 120 Cb 0.27 -0.39 -0.02 0.00 -2.36 0.00 0.00 39.78 37.28 1oac n ASN 120 CO 0.00 0.00 0.00 0.41 -1.03 0.00 0.00 177.26 176.64 1oac n THR 121 N -1.53 1.11 -4.36 5.53 -1.04 -0.91 -4.77 114.28 108.31 1oac n THR 121 Ca 0.07 -0.28 -0.24 0.00 -2.04 0.00 0.00 64.05 61.55 1oac n THR 121 Cb 0.34 -1.75 -0.09 0.00 -1.82 0.00 0.00 70.33 67.02 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 -0.64 1.98 -0.34 -2.82 0.52 -0.50 -4.97 118.95 112.18 1oac s ARG 122 Ca 0.64 -1.50 -0.11 0.00 -0.52 0.00 0.00 55.73 54.24 1oac s ARG 122 Cb -0.56 -2.01 -0.00 0.00 0.52 0.00 0.00 34.95 32.90 1oac s ARG 122 CO 0.51 0.37 0.20 -0.06 0.02 0.00 0.00 175.30 176.34 1oac s PHE 123 N -2.18 3.21 0.12 -0.53 0.40 0.23 -1.25 117.98 117.98 1oac s PHE 123 Ca 0.28 -0.48 -0.03 0.00 -0.60 0.00 0.00 56.93 56.10 1oac s PHE 123 Cb -0.07 -2.43 -0.14 0.00 0.51 0.00 0.00 43.02 40.89 1oac s PHE 123 CO 0.16 -0.45 1.26 1.79 0.70 0.00 0.00 175.22 178.68 1oac h THR 124 N 5.62 1.45 -2.39 0.64 1.35 -0.68 -3.37 112.91 115.53 1oac h THR 124 Ca -0.31 -2.68 -0.08 0.00 -0.55 0.00 0.00 66.41 62.80 1oac h THR 124 Cb 1.14 2.60 -0.22 0.00 -1.73 0.00 0.00 68.15 69.95 1oac h THR 124 CO 0.64 0.79 -0.04 -0.70 -0.25 0.00 0.00 175.52 175.96 1oac s GLU 125 N -3.06 0.73 -0.21 4.72 2.12 -1.07 -4.97 118.70 116.97 1oac s GLU 125 Ca -0.05 0.57 -0.02 0.00 0.36 0.00 0.00 54.97 55.84 1oac s GLU 125 Cb 0.08 0.35 0.06 0.00 0.26 0.00 0.00 34.13 34.89 1oac s GLU 125 CO 0.87 -0.14 0.00 0.42 -0.54 0.00 0.00 175.26 175.87 1oac s ILE 126 N -0.17 0.87 0.03 -3.70 1.01 -1.26 -0.86 121.20 117.12 1oac s ILE 126 Ca -0.04 -0.78 -0.06 0.00 0.00 0.00 0.00 60.65 59.77 1oac s ILE 126 Cb -0.03 -1.29 -0.01 0.00 0.01 0.00 0.00 42.46 41.14 1oac s ILE 126 CO 0.03 -0.17 0.11 -0.44 0.00 0.00 0.00 174.94 174.47 1oac s SER 127 N 1.70 0.14 0.47 3.58 0.01 -0.60 -4.67 113.70 114.32 1oac s SER 127 Ca -0.03 -0.46 -0.23 0.00 1.31 0.00 0.00 55.95 56.54 1oac s SER 127 Cb -0.18 0.23 -0.08 0.00 0.21 0.00 0.00 66.02 66.20 1oac s SER 127 CO -0.07 -0.49 1.16 -0.11 0.41 0.00 0.00 173.24 174.14 1oac n LEU 128 N 0.88 3.85 -4.14 2.44 7.94 -1.26 0.27 117.00 126.98 1oac n LEU 128 Ca -0.20 1.01 -0.36 0.00 -1.11 0.00 0.00 56.01 55.36 1oac n LEU 128 Cb 0.58 -1.46 -0.12 0.00 0.53 0.00 0.00 43.42 42.95 1oac n LEU 128 CO 0.22 -1.07 -0.21 -0.22 -1.11 0.00 0.00 177.39 175.00 1oac s LEU 129 N -1.74 4.94 0.50 -1.96 2.96 -0.39 -4.63 118.68 118.36 1oac s LEU 129 Ca 0.66 -1.84 -0.18 0.00 -0.22 0.00 0.00 54.13 52.55 1oac s LEU 129 Cb -0.49 -1.81 -0.08 0.00 0.50 0.00 0.00 46.19 44.31 1oac s LEU 129 CO 0.54 -0.48 0.98 -2.16 -1.32 0.00 0.00 176.35 173.92 1oac s PRO 130 N 1.17 3.99 1.24 0.98 0.04 -1.26 -4.05 135.00 137.11 1oac s PRO 130 Ca 0.05 1.01 -0.16 0.00 0.04 0.00 0.00 61.00 61.94 1oac s PRO 130 Cb -0.22 -2.14 0.31 0.00 0.04 0.00 0.00 34.50 32.48 1oac s PRO 130 CO -0.03 -0.23 1.01 -2.14 0.04 0.00 0.00 177.00 175.64 1oac s PRO 131 N -3.84 -1.49 0.39 0.56 0.02 -1.26 -4.95 135.00 124.44 1oac s PRO 131 Ca 0.60 0.53 -0.25 0.00 0.02 0.00 0.00 61.00 61.90 1oac s PRO 131 Cb -0.10 -1.51 -0.09 0.00 0.02 0.00 0.00 34.50 32.82 1oac s PRO 131 CO 0.27 -4.02 1.07 0.16 -0.33 0.00 0.00 177.00 174.15 1oac s ASP 132 N -2.86 6.74 0.23 2.53 -4.77 -1.26 -4.87 116.67 112.41 1oac s ASP 132 Ca 0.68 2.10 -0.17 0.00 -3.30 0.00 0.00 52.55 51.87 1oac s ASP 132 Cb -0.20 -2.59 0.24 0.00 -1.09 0.00 0.00 42.92 39.28 1oac s ASP 132 CO 0.62 -0.51 1.56 0.50 0.70 0.00 0.00 175.17 178.04 1oac h LYS 133 N 2.60 -0.03 -0.72 2.11 3.64 -1.99 -0.54 116.57 121.64 1oac h LYS 133 Ca -0.48 0.00 0.13 0.00 -1.27 0.00 0.00 60.65 59.03 1oac h LYS 133 Cb 1.22 0.01 -0.09 0.00 -0.41 0.00 0.00 32.23 32.95 1oac h LYS 133 CO 0.63 -0.02 0.28 1.49 -2.27 0.00 0.00 179.45 179.55 1oac h GLU 134 N -0.03 0.42 -0.38 1.90 4.81 -1.99 0.69 114.58 119.99 1oac h GLU 134 Ca 0.34 -0.03 -0.08 0.00 -0.13 0.00 0.00 59.36 59.46 1oac h GLU 134 Cb 0.60 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.87 1oac h GLU 134 CO -0.94 0.28 -0.09 0.00 -0.73 0.00 0.00 179.01 177.53 1oac h ALA 135 N 1.52 0.53 -0.40 2.92 0.00 -1.48 -2.48 119.26 119.86 1oac h ALA 135 Ca 0.39 -0.31 -0.04 0.00 0.00 0.00 0.00 54.91 54.95 1oac h ALA 135 Cb 0.57 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.21 1oac h ALA 135 CO -0.39 0.39 0.11 0.28 0.00 0.00 0.00 179.25 179.64 1oac h VAL 136 N 0.54 1.22 -0.54 0.00 2.07 -0.83 -1.64 116.25 117.07 1oac h VAL 136 Ca 0.10 -0.76 -0.06 0.00 0.82 0.00 0.00 66.70 66.80 1oac h VAL 136 Cb 0.61 0.95 -0.02 0.00 -1.52 0.00 0.00 31.29 31.31 1oac h VAL 136 CO 0.04 0.26 0.09 -0.50 0.02 0.00 0.00 177.57 177.48 1oac h TRP 137 N 0.51 0.90 -0.20 1.57 -0.00 -0.90 -1.91 115.95 115.91 1oac h TRP 137 Ca 0.13 -0.10 -0.09 0.00 -0.00 0.00 0.00 58.89 58.83 1oac h TRP 137 Cb 0.29 -0.26 -0.01 0.00 -0.00 0.00 0.00 29.16 29.18 1oac h TRP 137 CO 0.01 0.77 -0.27 0.00 -0.00 0.00 0.00 178.44 178.95 1oac h ALA 138 N 1.28 1.16 0.55 1.49 0.00 -1.15 -0.61 119.26 121.97 1oac h ALA 138 Ca 0.17 -0.34 -0.03 0.00 0.00 0.00 0.00 54.91 54.71 1oac h ALA 138 Cb 0.36 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 18.04 1oac h ALA 138 CO 0.01 0.54 -0.26 0.35 0.00 0.00 0.00 179.25 179.88 1oac h PHE 139 N 0.34 -0.69 -0.87 0.00 3.04 -0.93 0.45 116.94 118.29 1oac h PHE 139 Ca 0.05 -0.02 0.08 0.00 3.98 0.00 0.00 57.97 62.07 1oac h PHE 139 Cb 0.67 0.23 -0.06 0.00 2.56 0.00 0.00 35.95 39.34 1oac h PHE 139 CO 0.02 -0.36 0.56 0.00 -2.02 0.00 0.00 178.31 176.51 1oac h ALA 140 N -0.70 1.62 0.00 2.41 0.00 -1.23 -0.01 119.26 121.35 1oac h ALA 140 Ca -0.08 -0.01 -0.26 0.00 0.00 0.00 0.00 54.91 54.57 1oac h ALA 140 Cb 0.64 -0.22 -0.05 0.00 0.00 0.00 0.00 17.79 18.16 1oac h ALA 140 CO 0.12 0.21 -1.96 1.28 0.00 0.00 0.00 179.25 178.90 1oac n LEU 141 N -4.51 0.00 -0.10 0.00 4.77 -0.25 -4.67 117.00 112.24 1oac n LEU 141 Ca 0.14 0.00 0.01 0.00 -0.03 0.00 0.00 56.01 56.13 1oac n LEU 141 Cb 0.27 0.35 0.02 0.00 -2.33 0.00 0.00 43.42 41.73 1oac n LEU 141 CO 0.32 0.35 0.39 -0.62 -1.33 0.00 0.00 177.39 176.50 1oac n GLU 142 N -2.52 0.98 -2.11 3.23 1.02 0.15 -5.00 120.64 116.39 1oac n GLU 142 Ca -0.23 -1.08 -0.19 0.00 -0.02 0.00 0.00 57.16 55.64 1oac n GLU 142 Cb 0.96 -1.05 -0.03 0.00 -0.02 0.00 0.00 31.44 31.29 1oac n GLU 142 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 1oac n ASN 143 N -0.07 -5.33 -4.65 1.62 2.85 -0.02 -4.93 115.26 104.72 1oac n ASN 143 Ca 0.02 0.18 -0.43 0.00 -0.11 0.00 0.00 54.58 54.24 1oac n ASN 143 Cb 0.16 -4.55 -0.02 0.00 1.24 0.00 0.00 39.78 36.61 1oac n ASN 143 CO 0.00 0.00 0.00 -0.75 -2.11 0.00 0.00 177.26 174.40 1oac s LYS 144 N -4.55 4.21 0.42 1.20 2.20 -1.00 -4.91 119.74 117.31 1oac s LYS 144 Ca 0.00 1.32 -0.24 0.00 -0.36 0.00 0.00 55.97 56.69 1oac s LYS 144 Cb 0.00 -3.68 -0.08 0.00 -1.51 0.00 0.00 37.83 32.56 1oac s LYS 144 CO 0.00 -0.70 1.15 -1.25 -0.36 0.00 0.00 175.35 174.19 1oac s PRO 145 N 3.34 3.97 -0.41 4.03 0.04 -1.26 -2.84 135.00 141.87 1oac s PRO 145 Ca 0.45 1.78 -0.25 0.00 0.04 0.00 0.00 61.00 63.03 1oac s PRO 145 Cb -0.15 -2.57 0.02 0.00 0.04 0.00 0.00 34.50 31.84 1oac s PRO 145 CO 0.09 -0.38 0.87 0.08 0.04 0.00 0.00 177.00 177.70 1oac s VAL 146 N -1.49 4.60 -0.83 -0.36 1.01 -1.26 -4.95 120.40 117.12 1oac s VAL 146 Ca 0.59 0.87 -0.02 0.00 0.00 0.00 0.00 61.98 63.42 1oac s VAL 146 Cb -0.29 -4.33 0.28 0.00 0.00 0.00 0.00 36.38 32.03 1oac s VAL 146 CO 0.36 -0.63 2.16 0.47 0.00 0.00 0.00 175.10 177.46 1oac n ASP 147 N 6.80 7.33 -4.17 3.32 8.00 -1.26 -4.86 116.55 131.72 1oac n ASP 147 Ca 0.05 -3.65 -0.23 0.00 0.71 0.00 0.00 54.79 51.66 1oac n ASP 147 Cb 0.48 -1.13 -0.15 0.00 -0.02 0.00 0.00 41.12 40.30 1oac n ASP 147 CO 0.00 0.00 0.00 -1.58 -0.39 0.00 0.00 177.20 175.23 1oac s GLN 148 N -3.50 1.26 0.61 -1.24 0.74 -1.26 -5.13 119.66 111.13 1oac s GLN 148 Ca 0.51 -0.69 -0.15 0.00 0.05 0.00 0.00 55.36 55.08 1oac s GLN 148 Cb 0.37 -1.26 -0.03 0.00 1.10 0.00 0.00 33.01 33.20 1oac s GLN 148 CO -0.32 0.33 1.06 -1.25 -0.55 0.00 0.00 175.29 174.56 1oac s PRO 149 N -0.70 3.26 -0.14 1.67 0.04 -1.26 -5.00 135.00 132.87 1oac s PRO 149 Ca 0.06 1.17 -0.29 0.00 0.04 0.00 0.00 61.00 61.97 1oac s PRO 149 Cb -0.07 -2.03 -0.01 0.00 0.04 0.00 0.00 34.50 32.43 1oac s PRO 149 CO 0.00 -0.86 1.15 1.03 0.04 0.00 0.00 177.00 178.37 1oac s ARG 150 N -4.22 4.30 0.09 4.56 1.81 -1.26 -4.96 118.95 119.28 1oac s ARG 150 Ca 0.63 1.55 0.09 0.00 -1.72 0.00 0.00 55.73 56.28 1oac s ARG 150 Cb -0.16 -3.64 -0.04 0.00 -0.45 0.00 0.00 34.95 30.66 1oac s ARG 150 CO 0.40 -0.56 -0.20 0.15 -0.68 0.00 0.00 175.30 174.41 1oac s LYS 151 N 2.85 1.79 0.18 3.54 1.02 -1.26 -0.33 119.74 127.52 1oac s LYS 151 Ca 0.51 -1.16 0.09 0.00 0.02 0.00 0.00 55.97 55.44 1oac s LYS 151 Cb -0.20 -2.08 -0.04 0.00 -0.52 0.00 0.00 37.83 34.98 1oac s LYS 151 CO 0.15 0.49 -0.09 0.00 -0.92 0.00 0.00 175.35 174.98 1oac s ALA 152 N -1.05 2.95 -0.26 5.17 0.00 -0.67 -1.26 121.76 126.65 1oac s ALA 152 Ca 0.16 -1.48 -0.08 0.00 0.00 0.00 0.00 51.96 50.56 1oac s ALA 152 Cb -0.10 -0.74 -0.03 0.00 0.00 0.00 0.00 23.12 22.24 1oac s ALA 152 CO 0.08 0.46 0.10 -0.51 0.00 0.00 0.00 175.76 175.89 1oac s ASP 153 N -2.85 5.40 -0.20 0.00 1.01 0.14 -2.13 116.67 118.03 1oac s ASP 153 Ca 0.25 -0.14 0.01 0.00 0.71 0.00 0.00 52.55 53.38 1oac s ASP 153 Cb -0.09 -1.98 0.03 0.00 1.01 0.00 0.00 42.92 41.90 1oac s ASP 153 CO 0.15 -0.03 -0.17 -0.69 0.21 0.00 0.00 175.17 174.64 1oac s VAL 154 N 1.61 2.04 -0.21 -1.27 1.01 0.44 -1.56 120.40 122.45 1oac s VAL 154 Ca 0.06 -1.12 -0.03 0.00 0.00 0.00 0.00 61.98 60.90 1oac s VAL 154 Cb -0.15 -1.95 0.00 0.00 0.00 0.00 0.00 36.38 34.28 1oac s VAL 154 CO 0.06 0.36 -0.08 -0.63 0.00 0.00 0.00 175.10 174.81 1oac s ILE 155 N 1.25 3.07 0.14 2.22 1.01 -0.04 -0.12 121.20 128.73 1oac s ILE 155 Ca 0.01 -0.62 0.08 0.00 0.00 0.00 0.00 60.65 60.11 1oac s ILE 155 Cb -0.15 -2.39 -0.04 0.00 0.01 0.00 0.00 42.46 39.89 1oac s ILE 155 CO -0.10 0.43 -0.18 0.00 0.00 0.00 0.00 174.94 175.09 1oac s MET 156 N 1.43 1.18 -0.29 2.79 0.23 -0.24 0.05 119.30 124.44 1oac s MET 156 Ca 0.05 -1.31 -0.07 0.00 -1.03 0.00 0.00 55.69 53.33 1oac s MET 156 Cb -0.14 -1.23 -0.00 0.00 -1.53 0.00 0.00 34.83 31.92 1oac s MET 156 CO -0.05 0.26 0.09 -1.17 -2.03 0.00 0.00 175.02 172.12 1oac s LEU 157 N -2.44 3.83 -0.54 0.18 2.96 -0.38 -0.95 118.68 121.34 1oac s LEU 157 Ca 0.12 -0.59 -0.01 0.00 -0.22 0.00 0.00 54.13 53.43 1oac s LEU 157 Cb -0.07 -1.91 0.14 0.00 0.50 0.00 0.00 46.19 44.85 1oac s LEU 157 CO 0.05 -0.17 0.34 -0.62 -1.32 0.00 0.00 176.35 174.63 1oac s ASP 158 N 1.54 5.08 0.00 3.68 2.15 0.19 -1.41 116.67 127.91 1oac s ASP 158 Ca 0.04 -2.65 0.00 0.00 0.43 0.00 0.00 52.55 50.36 1oac s ASP 158 Cb -0.17 -1.80 0.00 0.00 -0.30 0.00 0.00 42.92 40.65 1oac s ASP 158 CO 0.03 -0.39 0.00 0.61 -0.17 0.00 0.00 175.17 175.25 1oac n GLY 159 N 3.73 2.09 0.00 2.66 0.00 -1.26 -0.86 105.19 111.55 1oac n GLY 159 Ca 0.05 0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.08 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 -0.02 -3.69 1.61 2.85 -1.26 -4.89 118.16 112.77 1oac n LYS 160 Ca 0.00 -0.33 -0.29 0.00 -1.05 0.00 0.00 58.31 56.64 1oac n LYS 160 Cb 0.00 -0.67 -0.04 0.00 -0.65 0.00 0.00 35.03 33.67 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 -0.08 3.48 -0.12 5.58 0.09 -0.03 -4.48 115.29 119.73 1oac s HIS 161 Ca 0.00 0.41 -0.02 0.00 -0.00 0.00 0.00 55.06 55.45 1oac s HIS 161 Cb 0.00 -1.90 -0.03 0.00 -0.00 0.00 0.00 32.58 30.65 1oac s HIS 161 CO 0.00 0.40 -0.03 0.42 -0.00 0.00 0.00 174.74 175.53 1oac s ILE 162 N -1.80 3.98 -0.01 0.60 -1.09 -1.26 0.56 121.20 122.19 1oac s ILE 162 Ca 0.39 -0.35 0.04 0.00 -2.23 0.00 0.00 60.65 58.51 1oac s ILE 162 Cb -0.11 -2.70 -0.01 0.00 -1.58 0.00 0.00 42.46 38.06 1oac s ILE 162 CO 0.28 0.55 -0.14 -0.63 -1.23 0.00 0.00 174.94 173.77 1oac s ILE 163 N -0.27 1.11 -0.24 2.92 1.01 -0.12 -1.00 121.20 124.61 1oac s ILE 163 Ca 0.05 -0.60 -0.01 0.00 0.00 0.00 0.00 60.65 60.08 1oac s ILE 163 Cb -0.13 -0.92 0.02 0.00 0.01 0.00 0.00 42.46 41.44 1oac s ILE 163 CO 0.02 0.31 -0.08 -1.61 0.00 0.00 0.00 174.94 173.59 1oac s GLU 164 N -0.33 2.92 0.11 2.79 2.02 0.13 -1.08 118.70 125.26 1oac s GLU 164 Ca 0.05 -0.92 0.08 0.00 0.02 0.00 0.00 54.97 54.21 1oac s GLU 164 Cb -0.05 -2.93 -0.04 0.00 0.10 0.00 0.00 34.13 31.21 1oac s GLU 164 CO -0.01 -0.35 -0.13 0.00 0.02 0.00 0.00 175.26 174.79 1oac s ALA 165 N 1.34 2.84 -0.08 5.21 0.00 0.82 -0.90 121.76 130.98 1oac s ALA 165 Ca 0.01 -1.30 0.04 0.00 0.00 0.00 0.00 51.96 50.72 1oac s ALA 165 Cb -0.16 -0.79 -0.00 0.00 0.00 0.00 0.00 23.12 22.17 1oac s ALA 165 CO -0.05 0.62 -0.22 0.08 0.00 0.00 0.00 175.76 176.18 1oac s VAL 166 N -1.20 1.92 0.03 0.00 1.01 -0.36 -0.42 120.40 121.37 1oac s VAL 166 Ca 0.20 -0.95 0.08 0.00 0.00 0.00 0.00 61.98 61.31 1oac s VAL 166 Cb -0.11 -1.65 -0.02 0.00 0.00 0.00 0.00 36.38 34.60 1oac s VAL 166 CO 0.12 0.53 -0.23 0.68 0.00 0.00 0.00 175.10 176.20 1oac s VAL 167 N 0.24 1.86 -0.41 2.92 -7.23 -0.91 0.35 120.40 117.23 1oac s VAL 167 Ca -0.14 -1.21 -0.16 0.00 -1.81 0.00 0.00 61.98 58.65 1oac s VAL 167 Cb -0.16 -1.59 0.02 0.00 0.56 0.00 0.00 36.38 35.20 1oac s VAL 167 CO 0.07 0.33 0.39 -0.62 -0.31 0.00 0.00 175.10 174.96 1oac s ASP 168 N -1.05 6.17 0.34 4.85 -1.08 0.58 -1.68 116.67 124.80 1oac s ASP 168 Ca 0.09 -0.73 0.23 0.00 -0.52 0.00 0.00 52.55 51.63 1oac s ASP 168 Cb -0.09 -2.20 0.33 0.00 -1.46 0.00 0.00 42.92 39.49 1oac s ASP 168 CO 0.01 -0.53 1.49 -0.07 0.52 0.00 0.00 175.17 176.60 1oac h LEU 169 N 8.90 0.00 0.24 -1.34 3.38 -0.98 -0.82 115.31 124.70 1oac h LEU 169 Ca -0.27 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.68 1oac h LEU 169 Cb 1.12 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.87 1oac h LEU 169 CO 0.77 0.01 -0.12 -0.61 0.09 0.00 0.00 178.44 178.58 1oac h GLN 170 N 0.00 -0.31 -0.02 1.13 4.15 -1.92 -3.34 115.11 114.79 1oac h GLN 170 Ca 0.00 0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.44 1oac h GLN 170 Cb 0.95 0.07 0.00 0.00 0.21 0.00 0.00 27.48 28.71 1oac h GLN 170 CO 0.00 0.06 -0.02 0.09 -1.93 0.00 0.00 178.83 177.03 1oac n ASN 171 N -5.02 1.95 -3.43 -0.69 3.02 -1.25 -5.00 115.26 104.84 1oac n ASN 171 Ca -0.08 -1.63 -0.21 0.00 -0.03 0.00 0.00 54.58 52.62 1oac n ASN 171 Cb 0.26 0.01 0.05 0.00 -0.61 0.00 0.00 39.78 39.49 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 0.50 -6.16 -3.69 6.41 5.15 -0.42 -5.02 115.26 112.03 1oac n ASN 172 Ca 0.17 -0.79 -0.14 0.00 -0.60 0.00 0.00 54.58 53.22 1oac n ASN 172 Cb 0.43 -4.35 -0.07 0.00 -0.53 0.00 0.00 39.78 35.26 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 -4.96 0.83 -0.13 1.20 -2.85 -0.58 -5.00 119.74 108.26 1oac s LYS 173 Ca 0.42 -0.20 -0.29 0.00 -1.00 0.00 0.00 55.97 54.89 1oac s LYS 173 Cb -0.10 0.37 -0.02 0.00 -2.06 0.00 0.00 37.83 36.02 1oac s LYS 173 CO 0.80 -0.26 1.20 -1.17 0.10 0.00 0.00 175.35 176.02 1oac s LEU 174 N -1.59 4.21 -0.01 2.77 2.96 -1.26 -0.31 118.68 125.46 1oac s LEU 174 Ca -0.10 1.69 0.18 0.00 -0.22 0.00 0.00 54.13 55.68 1oac s LEU 174 Cb -0.03 -3.55 -0.23 0.00 0.50 0.00 0.00 46.19 42.89 1oac s LEU 174 CO 0.02 -0.67 0.64 0.18 -1.32 0.00 0.00 176.35 175.20 1oac n LEU 175 N 5.97 0.55 -3.61 -0.68 4.77 0.16 -4.94 117.00 119.22 1oac n LEU 175 Ca 0.12 -0.33 -0.07 0.00 -0.03 0.00 0.00 56.01 55.71 1oac n LEU 175 Cb 0.46 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.50 1oac n LEU 175 CO 0.55 0.14 0.93 -0.94 -1.33 0.00 0.00 177.39 176.74 1oac s SER 176 N -3.18 -0.24 -0.04 -1.43 1.04 -1.07 -4.90 113.70 103.89 1oac s SER 176 Ca 0.02 0.31 -0.02 0.00 0.48 0.00 0.00 55.95 56.74 1oac s SER 176 Cb 0.13 0.26 0.03 0.00 0.10 0.00 0.00 66.02 66.54 1oac s SER 176 CO 0.74 -0.19 0.06 0.86 0.98 0.00 0.00 173.24 175.70 1oac s TRP 177 N -0.82 0.04 -0.22 5.02 -0.11 -1.26 -1.23 118.94 120.36 1oac s TRP 177 Ca 0.03 0.26 -0.05 0.00 1.22 0.00 0.00 56.10 57.56 1oac s TRP 177 Cb -0.02 -0.42 0.11 0.00 -1.50 0.00 0.00 33.47 31.65 1oac s TRP 177 CO -0.04 -0.17 0.42 -0.65 -4.62 0.00 0.00 176.95 171.88 1oac s GLN 178 N 1.95 0.35 0.29 5.86 -0.21 -0.08 -4.97 119.66 122.85 1oac s GLN 178 Ca 0.02 0.84 -0.29 0.00 0.02 0.00 0.00 55.36 55.95 1oac s GLN 178 Cb -0.12 0.03 -0.10 0.00 1.00 0.00 0.00 33.01 33.83 1oac s GLN 178 CO -0.03 -0.43 1.10 -1.25 -2.12 0.00 0.00 175.29 172.56 1oac s PRO 179 N 2.61 4.61 -0.41 2.91 0.05 -1.26 0.21 135.00 143.72 1oac s PRO 179 Ca 0.05 1.79 -0.05 0.00 0.05 0.00 0.00 61.00 62.85 1oac s PRO 179 Cb -0.14 -3.16 0.10 0.00 0.05 0.00 0.00 34.50 31.35 1oac s PRO 179 CO -0.15 0.19 0.21 0.42 0.05 0.00 0.00 177.00 177.73 1oac s ILE 180 N -1.19 3.59 0.42 0.56 -1.09 -0.17 -4.92 121.20 118.41 1oac s ILE 180 Ca 0.45 -1.78 -0.25 0.00 -2.23 0.00 0.00 60.65 56.84 1oac s ILE 180 Cb -0.32 -3.34 -0.08 0.00 -1.58 0.00 0.00 42.46 37.15 1oac s ILE 180 CO 0.41 -0.59 1.23 -1.59 -1.23 0.00 0.00 174.94 173.17 1oac s LYS 181 N 1.25 3.94 0.00 2.79 0.00 -1.26 -3.73 119.74 122.73 1oac s LYS 181 Ca 0.05 1.97 0.00 0.00 0.00 0.00 0.00 55.97 57.99 1oac s LYS 181 Cb -0.23 -2.66 0.00 0.00 0.00 0.00 0.00 37.83 34.95 1oac s LYS 181 CO -0.02 -0.45 0.00 -0.25 0.00 0.00 0.00 175.35 174.63 1oac n ASP 182 N -0.02 0.00 -4.73 0.03 8.00 -1.26 -5.01 116.55 113.56 1oac n ASP 182 Ca 0.05 0.00 -0.42 0.00 0.71 0.00 0.00 54.79 55.13 1oac n ASP 182 Cb 0.45 0.00 -0.01 0.00 -0.02 0.00 0.00 41.12 41.55 1oac n ASP 182 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1oac n ALA 183 N 0.00 1.88 -2.82 2.24 0.00 -1.24 -5.05 120.51 115.52 1oac n ALA 183 Ca 0.00 0.36 -0.31 0.00 0.00 0.00 0.00 53.44 53.49 1oac n ALA 183 Cb 0.00 -2.35 -0.06 0.00 0.00 0.00 0.00 19.45 17.04 1oac n ALA 183 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 1oac s HIS 184 N -0.91 3.30 0.41 0.00 3.76 -1.26 -4.41 115.29 116.18 1oac s HIS 184 Ca 0.56 0.14 -0.02 0.00 -0.15 0.00 0.00 55.06 55.59 1oac s HIS 184 Cb -0.53 -1.67 -0.03 0.00 1.11 0.00 0.00 32.58 31.46 1oac s HIS 184 CO 0.60 0.54 0.65 0.20 -0.85 0.00 0.00 174.74 175.89 1oac s GLY 185 N -2.40 1.41 1.06 -2.22 0.00 -1.26 -4.55 107.32 99.36 1oac s GLY 185 Ca 0.31 -0.74 -0.13 0.00 0.00 0.00 0.00 44.72 44.16 1oac s GLY 185 CO 0.24 -0.63 1.08 -3.16 0.00 0.00 0.00 173.10 170.62 1oac s MET 186 N -4.51 -0.04 0.18 2.90 0.23 -1.26 -4.87 119.30 111.93 1oac s MET 186 Ca 0.43 0.55 -0.30 0.00 -1.03 0.00 0.00 55.69 55.34 1oac s MET 186 Cb -0.10 -1.68 -0.08 0.00 -1.53 0.00 0.00 34.83 31.44 1oac s MET 186 CO 0.40 -3.06 1.25 0.08 -2.03 0.00 0.00 175.02 171.66 1oac s VAL 187 N -2.85 3.45 0.23 5.16 1.01 0.75 -5.02 120.40 123.13 1oac s VAL 187 Ca 0.66 1.19 0.07 0.00 0.00 0.00 0.00 61.98 63.90 1oac s VAL 187 Cb -0.20 -3.76 -0.04 0.00 0.00 0.00 0.00 36.38 32.38 1oac s VAL 187 CO 0.59 0.18 0.17 -0.76 0.00 0.00 0.00 175.10 175.28 1oac s LEU 188 N -0.09 3.77 0.37 3.92 1.43 -1.26 -4.60 118.68 122.22 1oac s LEU 188 Ca 0.55 -0.24 0.06 0.00 -1.03 0.00 0.00 54.13 53.47 1oac s LEU 188 Cb -0.34 -2.32 0.72 0.00 0.03 0.00 0.00 46.19 44.28 1oac s LEU 188 CO 0.37 -0.00 1.95 -0.07 0.23 0.00 0.00 176.35 178.83 1oac h LEU 189 N 1.79 0.46 -2.10 1.79 3.38 -1.97 -1.78 115.31 116.89 1oac h LEU 189 Ca -0.48 -0.06 -0.02 0.00 0.09 0.00 0.00 57.88 57.42 1oac h LEU 189 Cb 1.23 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 41.86 1oac h LEU 189 CO 0.61 0.46 -0.08 -2.24 0.09 0.00 0.00 178.44 177.28 1oac h ASP 190 N 0.51 0.00 -0.33 -0.43 2.03 -2.01 -2.01 116.42 114.18 1oac h ASP 190 Ca 0.12 0.00 -0.01 0.00 -0.73 0.00 0.00 57.03 56.41 1oac h ASP 190 Cb 0.17 0.00 -0.02 0.00 -0.83 0.00 0.00 39.33 38.65 1oac h ASP 190 CO -0.01 0.08 0.17 0.44 -1.03 0.00 0.00 179.24 178.89 1oac h ASP 191 N 0.00 0.45 -0.42 4.15 3.32 -1.73 0.48 116.42 122.66 1oac h ASP 191 Ca -0.00 -0.03 0.01 0.00 0.02 0.00 0.00 57.03 57.02 1oac h ASP 191 Cb 0.25 -0.11 -0.02 0.00 0.22 0.00 0.00 39.33 39.67 1oac h ASP 191 CO 0.01 0.39 0.28 -0.26 -1.72 0.00 0.00 179.24 177.93 1oac h PHE 192 N 0.50 0.53 -0.13 4.55 -1.00 -1.45 0.00 116.94 119.94 1oac h PHE 192 Ca 0.13 0.01 -0.03 0.00 2.81 0.00 0.00 57.97 60.89 1oac h PHE 192 Cb 0.06 -0.18 -0.00 0.00 3.61 0.00 0.00 35.95 39.44 1oac h PHE 192 CO 0.00 0.33 -0.05 0.00 -1.61 0.00 0.00 178.31 176.98 1oac h ALA 193 N 1.16 0.19 -0.19 2.45 0.00 -1.30 -2.90 119.26 118.66 1oac h ALA 193 Ca 0.16 -0.25 0.06 0.00 0.00 0.00 0.00 54.91 54.87 1oac h ALA 193 Cb -0.06 -0.05 -0.07 0.00 0.00 0.00 0.00 17.79 17.62 1oac h ALA 193 CO -0.04 -0.04 -0.26 1.03 0.00 0.00 0.00 179.25 179.94 1oac h SER 194 N -0.06 -0.82 -0.63 0.00 0.87 -0.85 0.52 113.55 112.58 1oac h SER 194 Ca 0.03 0.14 0.04 0.00 -1.23 0.00 0.00 61.79 60.77 1oac h SER 194 Cb 0.50 0.37 -0.05 0.00 -0.44 0.00 0.00 62.40 62.78 1oac h SER 194 CO 0.02 -0.30 0.36 0.58 -0.53 0.00 0.00 176.83 176.96 1oac h VAL 195 N -0.30 1.01 -0.78 2.23 2.07 -1.04 -0.92 116.25 118.53 1oac h VAL 195 Ca 0.12 -0.24 -0.03 0.00 0.82 0.00 0.00 66.70 67.37 1oac h VAL 195 Cb 0.48 0.26 -0.04 0.00 -1.52 0.00 0.00 31.29 30.48 1oac h VAL 195 CO -0.36 0.13 0.36 -0.61 0.02 0.00 0.00 177.57 177.11 1oac h GLN 196 N 0.69 1.13 -0.17 1.57 5.75 -1.16 -2.48 115.11 120.44 1oac h GLN 196 Ca 0.27 -0.18 -0.05 0.00 -0.15 0.00 0.00 58.65 58.55 1oac h GLN 196 Cb 0.11 -0.20 -0.00 0.00 1.07 0.00 0.00 27.48 28.46 1oac h GLN 196 CO -0.15 0.89 -0.08 -0.91 -2.65 0.00 0.00 178.83 175.93 1oac h ASN 197 N 1.11 0.37 -0.65 -0.69 -0.26 -0.33 -1.93 115.58 113.20 1oac h ASN 197 Ca 0.27 -0.41 0.10 0.00 -0.56 0.00 0.00 56.30 55.69 1oac h ASN 197 Cb 0.14 -0.10 -0.07 0.00 -1.06 0.00 0.00 38.32 37.22 1oac h ASN 197 CO -0.03 0.70 0.28 0.40 -1.06 0.00 0.00 177.43 177.72 1oac h ILE 198 N 0.04 0.78 -0.40 2.81 2.04 -1.03 -0.08 117.51 121.67 1oac h ILE 198 Ca 0.04 -0.16 -0.08 0.00 1.00 0.00 0.00 64.86 65.66 1oac h ILE 198 Cb 0.56 0.27 -0.02 0.00 -0.74 0.00 0.00 36.82 36.89 1oac h ILE 198 CO 0.03 0.09 -0.07 0.40 0.00 0.00 0.00 178.15 178.59 1oac h ILE 199 N 0.47 1.24 -0.37 -0.67 5.03 -1.43 -2.54 117.51 119.25 1oac h ILE 199 Ca 0.33 -1.04 -0.00 0.00 -0.12 0.00 0.00 64.86 64.03 1oac h ILE 199 Cb 0.40 1.01 -0.02 0.00 -3.03 0.00 0.00 36.82 35.18 1oac h ILE 199 CO -0.30 0.35 0.21 0.78 -0.68 0.00 0.00 178.15 178.52 1oac h ASN 200 N 0.62 0.45 1.81 1.72 -0.26 -0.22 -2.98 115.58 116.73 1oac h ASN 200 Ca 0.12 -0.07 0.00 0.00 -0.56 0.00 0.00 56.30 55.79 1oac h ASN 200 Cb 0.50 -0.11 0.00 0.00 -1.06 0.00 0.00 38.32 37.64 1oac h ASN 200 CO 0.03 0.39 -0.10 0.78 -1.06 0.00 0.00 177.43 177.47 1oac h ASN 201 N 0.48 0.00 -3.26 5.81 -0.26 -1.27 -3.46 115.58 113.62 1oac h ASN 201 Ca 0.13 -0.00 -0.57 0.00 -0.56 0.00 0.00 56.30 55.30 1oac h ASN 201 Cb 0.03 0.00 -0.05 0.00 -1.06 0.00 0.00 38.32 37.23 1oac h ASN 201 CO -0.02 0.00 0.99 -0.55 -1.06 0.00 0.00 177.43 176.79 1oac s SER 202 N -5.83 6.58 0.13 5.81 0.15 -0.96 -4.92 113.70 114.66 1oac s SER 202 Ca 0.07 1.00 -0.29 0.00 0.70 0.00 0.00 55.95 57.43 1oac s SER 202 Cb 0.07 -2.54 -0.06 0.00 -1.71 0.00 0.00 66.02 61.77 1oac s SER 202 CO 0.67 -1.19 1.59 1.05 1.20 0.00 0.00 173.24 176.56 1oac h GLU 203 N 9.63 -0.50 -0.06 5.44 9.09 -1.89 0.18 114.58 136.47 1oac h GLU 203 Ca -0.26 0.03 -0.00 0.00 0.05 0.00 0.00 59.36 59.19 1oac h GLU 203 Cb 1.09 0.11 -0.00 0.00 -1.65 0.00 0.00 28.75 28.30 1oac h GLU 203 CO 1.06 -0.33 0.04 0.93 0.05 0.00 0.00 179.01 180.75 1oac h GLU 204 N -0.52 0.08 -0.68 1.06 5.08 -1.97 -2.34 114.58 115.29 1oac h GLU 204 Ca 0.06 -0.01 0.04 0.00 -1.00 0.00 0.00 59.36 58.45 1oac h GLU 204 Cb 0.62 -0.02 -0.05 0.00 0.50 0.00 0.00 28.75 29.81 1oac h GLU 204 CO -0.33 0.09 0.41 0.35 -1.00 0.00 0.00 179.01 178.53 1oac h PHE 205 N 0.05 0.77 -0.66 4.33 3.04 -1.84 -2.38 116.94 120.25 1oac h PHE 205 Ca 0.02 0.02 -0.03 0.00 3.98 0.00 0.00 57.97 61.96 1oac h PHE 205 Cb 0.03 -0.25 -0.03 0.00 2.56 0.00 0.00 35.95 38.26 1oac h PHE 205 CO -0.06 0.43 0.29 0.00 -2.02 0.00 0.00 178.31 176.94 1oac h ALA 206 N 1.30 1.27 0.12 2.41 0.00 -0.59 -2.54 119.26 121.23 1oac h ALA 206 Ca 0.28 -0.15 0.02 0.00 0.00 0.00 0.00 54.91 55.05 1oac h ALA 206 Cb 0.06 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.55 1oac h ALA 206 CO -0.12 0.55 -0.25 0.00 0.00 0.00 0.00 179.25 179.43 1oac h ALA 207 N 1.37 -0.43 -0.52 0.00 0.00 -1.15 0.57 119.26 119.10 1oac h ALA 207 Ca 0.23 -0.04 0.05 0.00 0.00 0.00 0.00 54.91 55.15 1oac h ALA 207 Cb 0.14 0.41 -0.05 0.00 0.00 0.00 0.00 17.79 18.29 1oac h ALA 207 CO -0.02 -0.79 0.24 0.00 0.00 0.00 0.00 179.25 178.67 1oac h ALA 208 N 0.28 0.66 -0.32 0.00 0.00 -1.22 -2.36 119.26 116.29 1oac h ALA 208 Ca 0.03 0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.91 1oac h ALA 208 Cb 0.49 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 1oac h ALA 208 CO -0.14 -0.13 -0.04 0.28 0.00 0.00 0.00 179.25 179.22 1oac h VAL 209 N 0.46 1.27 -0.84 0.00 2.07 -1.29 -2.76 116.25 115.17 1oac h VAL 209 Ca 0.24 -1.06 0.13 0.00 0.82 0.00 0.00 66.70 66.83 1oac h VAL 209 Cb 0.19 1.31 -0.06 0.00 -1.52 0.00 0.00 31.29 31.20 1oac h VAL 209 CO -0.19 0.34 0.54 0.50 0.02 0.00 0.00 177.57 178.79 1oac h LYS 210 N 0.38 0.64 0.00 1.57 3.64 -0.43 1.00 116.57 123.37 1oac h LYS 210 Ca 0.09 -0.04 -0.05 0.00 -1.27 0.00 0.00 60.65 59.37 1oac h LYS 210 Cb 0.52 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 32.19 1oac h LYS 210 CO 0.03 0.42 -0.26 -0.22 -2.27 0.00 0.00 179.45 177.15 1oac h LYS 211 N 0.65 0.00 -0.50 1.90 3.64 -1.16 -2.39 116.57 118.72 1oac h LYS 211 Ca 0.41 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.79 1oac h LYS 211 Cb 0.66 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.48 1oac h LYS 211 CO -0.17 0.26 0.00 0.54 -2.27 0.00 0.00 179.45 177.81 1oac n ARG 212 N -3.62 2.15 -0.03 1.90 1.74 0.30 -4.92 116.66 114.19 1oac n ARG 212 Ca -0.01 -1.78 0.00 0.00 -0.77 0.00 0.00 57.85 55.29 1oac n ARG 212 Cb 0.39 -1.39 0.00 0.00 -1.02 0.00 0.00 32.46 30.44 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 1.28 0.36 3.62 -0.13 0.00 -0.90 -4.66 105.19 104.76 1oac n GLY 213 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 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 -2.07 4.79 -0.01 -0.61 1.09 -0.94 -4.93 121.20 118.51 1oac s ILE 214 Ca 0.00 1.32 -0.01 0.00 -1.10 0.00 0.00 60.65 60.86 1oac s ILE 214 Cb 0.00 -4.15 -0.01 0.00 -1.06 0.00 0.00 42.46 37.24 1oac s ILE 214 CO 0.00 -0.22 0.30 0.71 -0.10 0.00 0.00 174.94 175.63 1oac h THR 215 N 5.56 0.00 -2.89 2.92 1.35 -1.88 -3.24 112.91 114.73 1oac h THR 215 Ca -0.24 -0.09 -0.61 0.00 -0.55 0.00 0.00 66.41 64.92 1oac h THR 215 Cb 1.09 0.00 -0.13 0.00 -1.73 0.00 0.00 68.15 67.39 1oac h THR 215 CO 0.89 0.00 0.61 -0.62 -0.25 0.00 0.00 175.52 176.15 1oac s ASP 216 N -3.01 6.25 0.00 5.36 -1.08 -1.26 -4.85 116.67 118.08 1oac s ASP 216 Ca -0.01 -0.62 0.17 0.00 -0.52 0.00 0.00 52.55 51.57 1oac s ASP 216 Cb 0.00 -2.44 1.00 0.00 -1.46 0.00 0.00 42.92 40.02 1oac s ASP 216 CO 0.02 -1.38 1.63 0.00 0.52 0.00 0.00 175.17 175.96 1oac n ALA 217 N 7.76 2.58 0.17 3.66 0.00 -1.26 -2.57 120.51 130.85 1oac n ALA 217 Ca -0.00 -0.10 0.12 0.00 0.00 0.00 0.00 53.44 53.45 1oac n ALA 217 Cb 0.47 -1.27 0.09 0.00 0.00 0.00 0.00 19.45 18.73 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 -0.16 0.00 6.56 -1.97 -3.26 116.57 117.74 1oac h LYS 218 Ca 0.00 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.59 1oac h LYS 218 Cb 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 31.66 1oac h LYS 218 CO 0.00 0.00 0.00 1.63 -2.06 0.00 0.00 179.45 179.02 1oac n LYS 219 N -2.88 1.40 -3.28 3.15 5.02 -1.06 -4.86 118.16 115.65 1oac n LYS 219 Ca 0.02 -0.62 -0.39 0.00 -2.02 0.00 0.00 58.31 55.30 1oac n LYS 219 Cb 0.54 -1.18 -0.07 0.00 -0.02 0.00 0.00 35.03 34.30 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 -1.79 5.13 -0.17 -0.18 1.01 -1.23 -0.76 120.40 122.41 1oac s VAL 220 Ca 0.15 0.90 -0.05 0.00 0.00 0.00 0.00 61.98 62.98 1oac s VAL 220 Cb 0.08 -3.81 -0.03 0.00 0.00 0.00 0.00 36.38 32.61 1oac s VAL 220 CO 0.11 0.20 0.01 -0.63 0.00 0.00 0.00 175.10 174.79 1oac s ILE 221 N 1.50 4.28 0.39 2.22 1.09 0.59 -4.96 121.20 126.30 1oac s ILE 221 Ca 0.23 -0.22 0.07 0.00 -1.10 0.00 0.00 60.65 59.63 1oac s ILE 221 Cb -0.15 -2.90 0.00 0.00 -1.06 0.00 0.00 42.46 38.35 1oac s ILE 221 CO 0.09 0.48 0.54 0.42 -0.10 0.00 0.00 174.94 176.37 1oac s THR 222 N 0.40 3.53 -0.14 2.92 -4.23 -1.26 -0.85 115.64 116.00 1oac s THR 222 Ca -0.01 -0.95 -0.08 0.00 -1.18 0.00 0.00 61.69 59.47 1oac s THR 222 Cb -0.13 -3.21 0.05 0.00 1.34 0.00 0.00 72.50 70.54 1oac s THR 222 CO 0.02 -0.09 0.34 0.28 -0.54 0.00 0.00 174.62 174.63 1oac s THR 223 N -2.31 -0.03 0.04 3.99 -1.32 -0.63 -4.97 115.64 110.41 1oac s THR 223 Ca 0.50 0.11 -0.25 0.00 -1.21 0.00 0.00 61.69 60.85 1oac s THR 223 Cb -0.10 -0.51 -0.05 0.00 -1.51 0.00 0.00 72.50 70.33 1oac s THR 223 CO 0.33 0.04 0.75 -2.16 -2.21 0.00 0.00 174.62 171.37 1oac s PRO 224 N 1.25 4.48 0.02 7.08 0.04 -1.26 -2.40 135.00 144.21 1oac s PRO 224 Ca -0.09 1.03 0.07 0.00 0.04 0.00 0.00 61.00 62.06 1oac s PRO 224 Cb -0.09 -3.37 -0.02 0.00 0.04 0.00 0.00 34.50 31.07 1oac s PRO 224 CO -0.10 0.28 -0.21 -0.51 0.04 0.00 0.00 177.00 176.50 1oac s LEU 225 N -0.03 2.12 0.61 -3.56 1.43 0.14 -4.98 118.68 114.41 1oac s LEU 225 Ca 0.38 -0.47 -0.14 0.00 -1.03 0.00 0.00 54.13 52.87 1oac s LEU 225 Cb -0.20 -1.02 -0.03 0.00 0.03 0.00 0.00 46.19 44.96 1oac s LEU 225 CO 0.22 0.20 1.04 0.42 0.23 0.00 0.00 176.35 178.46 1oac s THR 226 N -0.69 4.21 -0.35 5.49 -4.23 -1.26 -0.89 115.64 117.92 1oac s THR 226 Ca 0.08 0.88 0.22 0.00 -1.18 0.00 0.00 61.69 61.70 1oac s THR 226 Cb -0.09 -3.55 -0.16 0.00 1.34 0.00 0.00 72.50 70.04 1oac s THR 226 CO 0.01 -0.77 0.85 1.33 -0.54 0.00 0.00 174.62 175.49 1oac n VAL 227 N -2.39 0.22 -4.24 2.29 0.24 -1.26 -4.73 118.33 108.46 1oac n VAL 227 Ca 0.07 -0.39 0.00 0.00 -2.04 0.00 0.00 64.34 61.98 1oac n VAL 227 Cb 0.54 0.04 0.00 0.00 -1.47 0.00 0.00 33.84 32.95 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 1.29 -0.74 2.76 7.63 0.00 -1.26 -4.86 105.19 110.02 1oac n GLY 228 Ca -0.00 -1.15 -0.19 0.00 0.00 0.00 0.00 46.02 44.68 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 -0.09 -0.15 1.61 5.04 -1.26 -4.46 117.35 118.05 1oac s TYR 229 Ca 0.00 0.39 0.18 0.00 -2.44 0.00 0.00 57.07 55.20 1oac s TYR 229 Cb 0.00 -0.37 0.34 0.00 0.35 0.00 0.00 41.96 42.28 1oac s TYR 229 CO 0.00 -0.31 1.21 1.19 -1.34 0.00 0.00 175.55 176.30 1oac n PHE 230 N 5.31 0.18 -3.55 4.97 3.72 -1.26 -4.73 117.46 122.09 1oac n PHE 230 Ca -0.04 -1.03 -0.25 0.00 -0.05 0.00 0.00 57.45 56.08 1oac n PHE 230 Cb 0.50 -0.19 0.06 0.00 -0.94 0.00 0.00 39.48 38.91 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 -1.26 -5.98 0.00 4.37 2.03 -1.26 -1.81 116.55 112.64 1oac n ASP 231 Ca 0.17 -0.54 0.00 0.00 0.52 0.00 0.00 54.79 54.95 1oac n ASP 231 Cb 0.69 -4.74 0.00 0.00 -0.72 0.00 0.00 41.12 36.35 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 -1.84 2.86 0.28 0.27 0.00 -1.26 -4.90 105.19 100.60 1oac n GLY 232 Ca -0.01 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.15 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 1.84 0.00 0.00 1.61 1.57 -1.73 0.22 116.57 120.07 1oac h LYS 233 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1oac h LYS 233 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 1oac h LYS 233 CO 0.00 0.03 0.00 -0.40 -0.57 0.00 0.00 179.45 178.51 1oac n ASP 234 N -3.86 0.00 -2.00 0.86 5.75 -1.26 -4.91 116.55 111.13 1oac n ASP 234 Ca -0.03 0.50 -0.09 0.00 -0.01 0.00 0.00 54.79 55.16 1oac n ASP 234 Cb 0.12 -0.50 0.04 0.00 -1.03 0.00 0.00 41.12 39.75 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 0.95 0.17 2.99 6.12 0.00 0.07 -5.05 105.19 110.44 1oac n GLY 235 Ca 0.06 -0.24 -0.19 0.00 0.00 0.00 0.00 46.02 45.65 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 -3.90 1.87 0.09 0.99 1.43 -1.26 -5.13 118.68 112.78 1oac s LEU 236 Ca 0.12 -0.15 -0.30 0.00 -1.03 0.00 0.00 54.13 52.77 1oac s LEU 236 Cb -0.05 -0.44 -0.06 0.00 0.03 0.00 0.00 46.19 45.66 1oac s LEU 236 CO 0.33 0.07 1.10 -0.75 0.23 0.00 0.00 176.35 177.33 1oac s LYS 237 N 0.04 4.53 0.48 1.70 2.20 -1.26 -4.66 119.74 122.77 1oac s LYS 237 Ca -0.00 1.66 0.25 0.00 -0.36 0.00 0.00 55.97 57.51 1oac s LYS 237 Cb -0.06 -3.35 1.19 0.00 -1.51 0.00 0.00 37.83 34.10 1oac s LYS 237 CO -0.00 -0.07 1.96 0.37 -0.36 0.00 0.00 175.35 177.25 1oac h GLN 238 N 6.14 0.00 0.61 4.03 5.75 -2.00 -3.26 115.11 126.38 1oac h GLN 238 Ca -0.42 0.00 -0.03 0.00 -0.15 0.00 0.00 58.65 58.05 1oac h GLN 238 Cb 1.21 0.00 0.01 0.00 1.07 0.00 0.00 27.48 29.77 1oac h GLN 238 CO 0.76 0.19 -0.29 0.22 -2.65 0.00 0.00 178.83 177.06 1oac h ASP 239 N 0.00 -0.69 -4.02 -0.69 1.82 -1.99 -3.47 116.42 107.38 1oac h ASP 239 Ca -0.00 0.00 -0.56 0.00 -0.39 0.00 0.00 57.03 56.08 1oac h ASP 239 Cb 0.52 0.18 0.16 0.00 0.68 0.00 0.00 39.33 40.87 1oac h ASP 239 CO 0.02 -0.30 0.46 0.00 -1.61 0.00 0.00 179.24 177.82 1oac n ALA 240 N -2.69 1.02 -2.88 -0.78 0.00 -1.23 -4.98 120.51 108.97 1oac n ALA 240 Ca -0.11 0.01 -0.43 0.00 0.00 0.00 0.00 53.44 52.91 1oac n ALA 240 Cb 0.33 -2.29 -0.03 0.00 0.00 0.00 0.00 19.45 17.46 1oac n ALA 240 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 1oac s ARG 241 N -3.26 3.50 0.22 0.00 3.52 -1.26 -5.01 118.95 116.67 1oac s ARG 241 Ca 0.81 -1.52 0.09 0.00 -0.13 0.00 0.00 55.73 54.98 1oac s ARG 241 Cb -0.39 -4.83 -0.04 0.00 -1.56 0.00 0.00 34.95 28.13 1oac s ARG 241 CO 0.42 -1.82 -0.01 -0.51 -0.81 0.00 0.00 175.30 172.56 1oac s LEU 242 N 3.17 3.20 -0.01 -0.88 1.43 -1.26 -1.47 118.68 122.87 1oac s LEU 242 Ca 0.32 -0.55 -0.05 0.00 -1.03 0.00 0.00 54.13 52.82 1oac s LEU 242 Cb -0.07 -1.79 -0.00 0.00 0.03 0.00 0.00 46.19 44.36 1oac s LEU 242 CO -0.06 0.04 0.09 -0.76 0.23 0.00 0.00 176.35 175.90 1oac s LEU 243 N -3.31 1.72 -0.00 1.79 1.43 -0.61 -4.67 118.68 115.02 1oac s LEU 243 Ca 0.29 -0.14 -0.05 0.00 -1.03 0.00 0.00 54.13 53.20 1oac s LEU 243 Cb -0.08 0.45 -0.04 0.00 0.03 0.00 0.00 46.19 46.55 1oac s LEU 243 CO 0.19 -0.25 0.23 -0.54 0.23 0.00 0.00 176.35 176.21 1oac s LYS 244 N -0.94 3.52 -0.11 1.70 1.02 -0.07 -1.08 119.74 123.77 1oac s LYS 244 Ca -0.10 -0.17 0.01 0.00 0.02 0.00 0.00 55.97 55.73 1oac s LYS 244 Cb -0.06 -3.09 0.02 0.00 -0.52 0.00 0.00 37.83 34.18 1oac s LYS 244 CO 0.01 0.66 -0.14 0.08 -0.92 0.00 0.00 175.35 175.04 1oac s VAL 245 N -1.30 1.46 -0.02 3.17 1.01 0.30 -0.69 120.40 124.33 1oac s VAL 245 Ca 0.27 -0.60 -0.01 0.00 0.00 0.00 0.00 61.98 61.63 1oac s VAL 245 Cb -0.13 -1.35 -0.04 0.00 0.00 0.00 0.00 36.38 34.86 1oac s VAL 245 CO 0.16 0.43 0.09 -0.63 0.00 0.00 0.00 175.10 175.16 1oac s ILE 246 N 1.13 4.86 0.10 2.22 -1.09 -1.01 -1.96 121.20 125.45 1oac s ILE 246 Ca -0.04 -0.32 0.07 0.00 -2.23 0.00 0.00 60.65 58.14 1oac s ILE 246 Cb -0.14 -3.21 -0.03 0.00 -1.58 0.00 0.00 42.46 37.49 1oac s ILE 246 CO -0.04 0.38 -0.19 -0.44 -1.23 0.00 0.00 174.94 173.43 1oac s SER 247 N -1.66 2.30 0.10 3.58 0.01 -1.26 -1.60 113.70 115.17 1oac s SER 247 Ca 0.22 -0.69 0.03 0.00 1.31 0.00 0.00 55.95 56.82 1oac s SER 247 Cb -0.12 -0.11 -0.04 0.00 0.21 0.00 0.00 66.02 65.96 1oac s SER 247 CO 0.13 0.00 -0.09 -0.31 0.41 0.00 0.00 173.24 173.38 1oac s TYR 248 N -1.33 1.02 -0.19 2.43 2.02 -0.03 -2.02 117.35 119.25 1oac s TYR 248 Ca 0.05 -0.69 -0.09 0.00 -0.37 0.00 0.00 57.07 55.97 1oac s TYR 248 Cb -0.09 -0.56 -0.05 0.00 -0.40 0.00 0.00 41.96 40.86 1oac s TYR 248 CO 0.04 -0.02 0.11 -1.17 -1.57 0.00 0.00 175.55 172.93 1oac s LEU 249 N -2.52 4.09 -0.33 -1.29 2.96 -0.29 -0.30 118.68 121.00 1oac s LEU 249 Ca 0.06 0.19 -0.24 0.00 -0.22 0.00 0.00 54.13 53.93 1oac s LEU 249 Cb -0.02 -2.05 0.00 0.00 0.50 0.00 0.00 46.19 44.63 1oac s LEU 249 CO -0.01 0.19 0.80 -0.62 -1.32 0.00 0.00 176.35 175.39 1oac s ASP 250 N 0.30 6.64 0.00 3.68 -1.08 0.06 -4.61 116.67 121.65 1oac s ASP 250 Ca 0.07 0.58 0.13 0.00 -0.52 0.00 0.00 52.55 52.80 1oac s ASP 250 Cb -0.11 -2.41 0.16 0.00 -1.46 0.00 0.00 42.92 39.10 1oac s ASP 250 CO -0.01 -0.66 1.01 0.52 0.52 0.00 0.00 175.17 176.54 1oac n VAL 251 N 5.64 0.24 -0.88 1.11 0.31 -1.26 -4.94 118.33 118.55 1oac n VAL 251 Ca 0.04 -0.62 0.00 0.00 -0.01 0.00 0.00 64.34 63.75 1oac n VAL 251 Cb 0.48 1.09 0.00 0.00 -0.91 0.00 0.00 33.84 34.50 1oac n VAL 251 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1oac n GLY 252 N 0.72 0.63 0.53 2.92 0.00 -1.26 -4.95 105.19 103.78 1oac n GLY 252 Ca 0.09 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.22 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 0.00 1.60 0.00 1.61 5.75 -1.26 -4.92 116.55 119.32 1oac n ASP 253 Ca 0.00 -1.67 0.00 0.00 -0.01 0.00 0.00 54.79 53.11 1oac n ASP 253 Cb 0.00 -0.09 0.00 0.00 -1.03 0.00 0.00 41.12 40.00 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 1.13 0.83 2.57 6.12 0.00 -1.26 -3.85 105.19 110.73 1oac n GLY 254 Ca 0.16 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.91 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 -0.01 2.16 0.32 1.61 5.15 -1.26 -4.93 115.26 118.30 1oac n ASN 255 Ca 0.00 -3.04 0.21 0.00 -0.60 0.00 0.00 54.58 51.14 1oac n ASN 255 Cb 0.00 -0.68 1.03 0.00 -0.53 0.00 0.00 39.78 39.60 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 4.89 0.00 -0.10 1.20 -0.00 -1.92 -2.58 116.97 118.46 1oac h TYR 256 Ca 0.18 0.00 0.03 0.00 0.00 0.00 0.00 58.73 58.93 1oac h TYR 256 Cb 0.77 0.00 -0.00 0.00 0.00 0.00 0.00 36.73 37.50 1oac h TYR 256 CO 0.57 0.00 0.12 -1.49 -0.00 0.00 0.00 178.16 177.37 1oac h TRP 257 N 0.00 0.00 -0.02 0.10 4.06 -1.92 -1.02 115.95 117.15 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 0.19 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.35 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 -2.29 2.62 -3.09 1.49 0.00 -0.97 -4.39 120.51 113.88 1oac n ALA 258 Ca -0.00 -0.19 -0.21 0.00 0.00 0.00 0.00 53.44 53.04 1oac n ALA 258 Cb 0.22 -1.32 -0.03 0.00 0.00 0.00 0.00 19.45 18.32 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 -0.69 1.65 -2.11 0.00 8.25 -0.39 -4.71 115.22 117.22 1oac n HIS 259 Ca 0.16 -3.87 -0.37 0.00 -0.26 0.00 0.00 57.72 53.38 1oac n HIS 259 Cb 0.11 -0.44 0.01 0.00 1.12 0.00 0.00 29.99 30.79 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 -2.83 3.46 -0.74 -0.41 0.04 -1.26 -1.14 135.00 132.13 1oac s PRO 260 Ca 0.43 1.88 -0.07 0.00 0.04 0.00 0.00 61.00 63.28 1oac s PRO 260 Cb 0.33 -2.27 0.19 0.00 0.04 0.00 0.00 34.50 32.79 1oac s PRO 260 CO -0.10 -0.82 0.61 0.42 0.04 0.00 0.00 177.00 177.14 1oac s ILE 261 N -1.51 4.58 0.46 0.56 1.01 -0.86 -4.36 121.20 121.08 1oac s ILE 261 Ca 0.68 -2.84 -0.22 0.00 0.00 0.00 0.00 60.65 58.27 1oac s ILE 261 Cb -0.31 -3.89 -0.08 0.00 0.01 0.00 0.00 42.46 38.19 1oac s ILE 261 CO 0.37 -0.96 1.11 -0.70 0.00 0.00 0.00 174.94 174.76 1oac s GLU 262 N -0.09 3.83 -0.89 2.79 2.56 -1.26 -4.11 118.70 121.52 1oac s GLU 262 Ca 0.18 1.63 -0.03 0.00 0.00 0.00 0.00 54.97 56.75 1oac s GLU 262 Cb -0.15 -2.36 0.00 0.00 2.00 0.00 0.00 34.13 33.63 1oac s GLU 262 CO -0.06 -0.45 0.76 0.09 -0.56 0.00 0.00 175.26 175.04 1oac n ASN 263 N -0.53 -3.30 -3.46 -1.70 5.03 -1.26 -4.55 115.26 105.49 1oac n ASN 263 Ca 0.07 -0.41 -0.17 0.00 0.87 0.00 0.00 54.58 54.94 1oac n ASN 263 Cb 0.49 -3.75 -0.12 0.00 -1.02 0.00 0.00 39.78 35.39 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 -5.24 -0.20 -0.14 3.41 2.96 -1.26 -0.24 118.68 117.98 1oac s LEU 264 Ca 0.17 -0.22 0.01 0.00 -0.22 0.00 0.00 54.13 53.88 1oac s LEU 264 Cb -0.08 0.51 0.02 0.00 0.50 0.00 0.00 46.19 47.14 1oac s LEU 264 CO 0.52 -0.33 -0.18 -0.69 -1.32 0.00 0.00 176.35 174.35 1oac s VAL 265 N 2.36 1.77 -0.10 1.68 1.01 -0.34 -4.44 120.40 122.34 1oac s VAL 265 Ca 0.08 -0.79 -0.03 0.00 0.00 0.00 0.00 61.98 61.24 1oac s VAL 265 Cb -0.16 -1.61 -0.03 0.00 0.00 0.00 0.00 36.38 34.58 1oac s VAL 265 CO -0.15 0.49 0.04 0.00 0.00 0.00 0.00 175.10 175.48 1oac s ALA 266 N 1.13 3.43 -0.22 5.51 0.00 -0.83 -0.35 121.76 130.45 1oac s ALA 266 Ca -0.01 -0.76 -0.06 0.00 0.00 0.00 0.00 51.96 51.12 1oac s ALA 266 Cb -0.14 -1.62 -0.03 0.00 0.00 0.00 0.00 23.12 21.33 1oac s ALA 266 CO -0.06 0.58 0.04 0.08 0.00 0.00 0.00 175.76 176.40 1oac s VAL 267 N -0.86 4.30 -0.02 0.00 1.01 0.63 -0.54 120.40 124.90 1oac s VAL 267 Ca 0.13 -0.19 0.08 0.00 0.00 0.00 0.00 61.98 62.00 1oac s VAL 267 Cb -0.12 -2.97 -0.02 0.00 0.00 0.00 0.00 36.38 33.28 1oac s VAL 267 CO 0.03 0.40 -0.25 -0.69 0.00 0.00 0.00 175.10 174.58 1oac s VAL 268 N 1.10 2.02 -0.33 2.92 1.01 -0.24 -0.20 120.40 126.68 1oac s VAL 268 Ca 0.04 -1.09 -0.13 0.00 0.00 0.00 0.00 61.98 60.80 1oac s VAL 268 Cb -0.14 -1.68 -0.02 0.00 0.00 0.00 0.00 36.38 34.54 1oac s VAL 268 CO 0.03 0.57 0.27 -0.62 0.00 0.00 0.00 175.10 175.35 1oac s ASP 269 N -0.54 6.09 0.14 3.32 -1.08 0.76 -1.58 116.67 123.79 1oac s ASP 269 Ca 0.08 -0.32 0.08 0.00 -0.52 0.00 0.00 52.55 51.87 1oac s ASP 269 Cb -0.10 -2.15 -0.14 0.00 -1.46 0.00 0.00 42.92 39.06 1oac s ASP 269 CO -0.00 -0.24 1.32 -0.07 0.52 0.00 0.00 175.17 176.69 1oac h LEU 270 N 8.55 0.00 -0.10 -1.34 3.38 -1.53 0.42 115.31 124.68 1oac h LEU 270 Ca -0.31 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.51 1oac h LEU 270 Cb 1.16 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.91 1oac h LEU 270 CO 0.64 0.95 -0.52 -0.33 0.09 0.00 0.00 178.44 179.27 1oac h GLU 271 N 0.00 0.53 0.00 1.13 5.08 -1.90 -3.15 114.58 116.27 1oac h GLU 271 Ca -0.01 -0.44 0.00 0.00 -1.00 0.00 0.00 59.36 57.91 1oac h GLU 271 Cb 1.69 0.09 0.00 0.00 0.50 0.00 0.00 28.75 31.03 1oac h GLU 271 CO 0.12 1.07 -0.07 0.37 -1.00 0.00 0.00 179.01 179.50 1oac h GLN 272 N 0.13 0.00 -5.67 2.33 4.15 -1.93 -3.48 115.11 110.65 1oac h GLN 272 Ca -0.04 0.00 -0.37 0.00 0.77 0.00 0.00 58.65 59.01 1oac h GLN 272 Cb 1.17 0.00 0.14 0.00 0.21 0.00 0.00 27.48 29.00 1oac h GLN 272 CO 0.11 0.00 -0.68 1.63 -1.93 0.00 0.00 178.83 177.96 1oac n LYS 273 N -2.77 -7.51 -3.98 1.69 4.76 0.14 -5.00 118.16 105.49 1oac n LYS 273 Ca 0.04 0.81 -0.09 0.00 -2.87 0.00 0.00 58.31 56.20 1oac n LYS 273 Cb 0.50 -5.78 -0.10 0.00 -1.84 0.00 0.00 35.03 27.80 1oac n LYS 273 CO 0.00 0.00 0.00 0.21 -1.37 0.00 0.00 177.40 176.24 1oac s LYS 274 N -6.10 0.48 -0.33 1.97 2.20 -0.53 -4.93 119.74 112.50 1oac s LYS 274 Ca 0.46 -0.76 -0.29 0.00 -0.36 0.00 0.00 55.97 55.02 1oac s LYS 274 Cb -0.20 0.18 0.01 0.00 -1.51 0.00 0.00 37.83 36.30 1oac s LYS 274 CO 0.71 -0.10 1.26 0.42 -0.36 0.00 0.00 175.35 177.28 1oac s ILE 275 N -2.33 4.19 -0.03 5.43 1.01 -1.26 -0.17 121.20 128.04 1oac s ILE 275 Ca -0.08 1.33 0.12 0.00 0.00 0.00 0.00 60.65 62.02 1oac s ILE 275 Cb -0.03 -4.24 -0.23 0.00 0.01 0.00 0.00 42.46 37.97 1oac s ILE 275 CO -0.04 -0.54 0.73 -0.37 0.00 0.00 0.00 174.94 174.72 1oac h VAL 276 N 5.98 0.92 -2.52 2.92 -1.51 -0.93 -3.48 116.25 117.64 1oac h VAL 276 Ca -0.25 -2.76 -0.09 0.00 -1.23 0.00 0.00 66.70 62.37 1oac h VAL 276 Cb 1.09 2.45 -0.20 0.00 -2.13 0.00 0.00 31.29 32.50 1oac h VAL 276 CO 1.04 0.53 -0.05 -0.75 -1.23 0.00 0.00 177.57 177.11 1oac s LYS 277 N -2.61 0.83 -0.29 5.19 2.20 -1.15 -5.01 119.74 118.90 1oac s LYS 277 Ca -0.04 0.12 0.02 0.00 -0.36 0.00 0.00 55.97 55.70 1oac s LYS 277 Cb 0.08 0.38 0.08 0.00 -1.51 0.00 0.00 37.83 36.87 1oac s LYS 277 CO 0.82 -0.23 0.01 0.42 -0.36 0.00 0.00 175.35 176.01 1oac s ILE 278 N -1.06 1.69 -0.11 5.43 1.01 -1.26 -0.27 121.20 126.62 1oac s ILE 278 Ca -0.11 -1.65 -0.21 0.00 0.00 0.00 0.00 60.65 58.69 1oac s ILE 278 Cb -0.03 -2.09 -0.04 0.00 0.01 0.00 0.00 42.46 40.31 1oac s ILE 278 CO 0.06 -0.37 0.59 -1.61 0.00 0.00 0.00 174.94 173.61 1oac s GLU 279 N 1.26 4.35 0.01 2.79 2.02 0.53 -4.97 118.70 124.69 1oac s GLU 279 Ca 0.02 0.64 0.06 0.00 0.02 0.00 0.00 54.97 55.72 1oac s GLU 279 Cb -0.19 -3.47 -0.02 0.00 0.10 0.00 0.00 34.13 30.56 1oac s GLU 279 CO -0.11 0.04 -0.19 -1.21 0.02 0.00 0.00 175.26 173.82 1oac s GLU 280 N 0.94 1.43 0.00 1.61 2.02 -1.26 -1.20 118.70 122.24 1oac s GLU 280 Ca 0.31 -0.75 0.00 0.00 0.02 0.00 0.00 54.97 54.55 1oac s GLU 280 Cb -0.16 -1.43 0.00 0.00 0.10 0.00 0.00 34.13 32.64 1oac s GLU 280 CO 0.13 0.38 0.00 0.41 0.02 0.00 0.00 175.26 176.20 1oac n GLY 281 N 2.34 5.52 3.72 -1.39 0.00 0.67 -4.99 105.19 111.07 1oac n GLY 281 Ca -0.16 -2.05 -0.37 0.00 0.00 0.00 0.00 46.02 43.44 1oac n GLY 281 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1oac n PRO 282 N 0.00 1.17 -2.76 1.61 -0.04 -1.26 -4.92 135.00 128.80 1oac n PRO 282 Ca 0.00 0.45 -0.42 0.00 -0.04 0.00 0.00 63.50 63.49 1oac n PRO 282 Cb 0.00 -2.49 -0.03 0.00 -0.04 0.00 0.00 33.50 30.94 1oac n PRO 282 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1oac s VAL 283 N -1.39 4.82 -0.09 0.52 1.01 -1.26 -4.66 120.40 119.35 1oac s VAL 283 Ca 0.80 1.89 0.02 0.00 0.00 0.00 0.00 61.98 64.70 1oac s VAL 283 Cb -0.39 -4.25 0.01 0.00 0.00 0.00 0.00 36.38 31.75 1oac s VAL 283 CO 0.42 0.01 -0.16 -0.69 0.00 0.00 0.00 175.10 174.69 1oac s VAL 284 N 2.05 1.46 0.30 2.92 1.01 -1.26 -5.10 120.40 121.78 1oac s VAL 284 Ca 0.45 -0.64 -0.29 0.00 0.00 0.00 0.00 61.98 61.49 1oac s VAL 284 Cb -0.18 -1.32 -0.10 0.00 0.00 0.00 0.00 36.38 34.78 1oac s VAL 284 CO 0.16 0.43 1.36 -2.84 0.00 0.00 0.00 175.10 174.21 1oac s PRO 285 N 0.78 4.31 0.03 2.72 0.02 -1.26 -4.56 135.00 137.04 1oac s PRO 285 Ca -0.11 2.26 -0.30 0.00 0.02 0.00 0.00 61.00 62.87 1oac s PRO 285 Cb -0.16 -3.08 -0.06 0.00 0.02 0.00 0.00 34.50 31.22 1oac s PRO 285 CO 0.02 -0.29 1.34 0.08 -0.33 0.00 0.00 177.00 177.82 1oac s VAL 286 N -0.72 3.74 -0.02 3.83 1.01 -1.26 -4.74 120.40 122.23 1oac s VAL 286 Ca 0.53 1.18 -0.30 0.00 0.00 0.00 0.00 61.98 63.39 1oac s VAL 286 Cb -0.41 -3.76 -0.06 0.00 0.00 0.00 0.00 36.38 32.15 1oac s VAL 286 CO 0.50 0.04 1.68 -2.84 0.00 0.00 0.00 175.10 174.48 1oac s PRO 287 N 1.85 4.18 -0.16 2.72 0.02 -1.26 -4.89 135.00 137.47 1oac s PRO 287 Ca 0.62 2.25 0.17 0.00 0.02 0.00 0.00 61.00 64.06 1oac s PRO 287 Cb -0.31 -3.94 -0.25 0.00 0.02 0.00 0.00 34.50 30.02 1oac s PRO 287 CO 0.27 -0.83 0.23 -1.33 -0.33 0.00 0.00 177.00 175.01 1oac n MET 288 N 6.91 0.67 -1.60 5.54 2.81 -1.26 -4.44 117.12 125.76 1oac n MET 288 Ca 0.17 0.07 -0.49 0.00 -1.81 0.00 0.00 57.70 55.64 1oac n MET 288 Cb 0.42 -1.59 -0.05 0.00 -0.71 0.00 0.00 33.22 31.29 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 -2.82 0.54 -2.27 2.03 -1.04 -1.26 -4.90 114.28 104.56 1oac n THR 289 Ca -0.28 -0.13 -0.41 0.00 -2.04 0.00 0.00 64.05 61.18 1oac n THR 289 Cb 1.12 -0.95 -0.03 0.00 -1.82 0.00 0.00 70.33 68.65 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 0.13 3.50 -0.38 2.41 0.00 -1.26 -4.97 121.76 121.18 1oac s ALA 290 Ca 0.77 1.05 0.10 0.00 0.00 0.00 0.00 51.96 53.87 1oac s ALA 290 Cb -0.85 -3.47 0.29 0.00 0.00 0.00 0.00 23.12 19.09 1oac s ALA 290 CO 0.49 -0.50 0.61 0.54 0.00 0.00 0.00 175.76 176.90 1oac n ARG 291 N 2.96 0.83 -2.16 0.00 5.12 -1.26 -5.12 116.66 117.03 1oac n ARG 291 Ca 0.07 -3.29 -0.35 0.00 -1.93 0.00 0.00 57.85 52.34 1oac n ARG 291 Cb 0.43 -1.43 0.01 0.00 -1.16 0.00 0.00 32.46 30.32 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 -1.71 3.20 0.00 5.56 0.04 -1.25 -4.70 135.00 136.14 1oac s PRO 292 Ca 0.37 1.71 0.09 0.00 0.04 0.00 0.00 61.00 63.21 1oac s PRO 292 Cb 0.25 -1.98 0.04 0.00 0.04 0.00 0.00 34.50 32.85 1oac s PRO 292 CO -0.10 -0.99 0.70 1.97 0.04 0.00 0.00 177.00 178.62 1oac n PHE 293 N -1.40 0.00 1.36 0.56 1.16 -1.26 -4.68 117.46 113.19 1oac n PHE 293 Ca 0.12 0.00 0.07 0.00 -1.87 0.00 0.00 57.45 55.78 1oac n PHE 293 Cb 0.50 0.00 0.28 0.00 -1.61 0.00 0.00 39.48 38.65 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 0.20 1.21 0.00 5.98 5.75 -1.26 -4.94 116.55 123.49 1oac n ASP 294 Ca 0.04 -1.79 0.00 0.00 -0.01 0.00 0.00 54.79 53.03 1oac n ASP 294 Cb 0.20 -0.11 0.00 0.00 -1.03 0.00 0.00 41.12 40.18 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 0.96 0.82 0.31 6.12 0.00 -1.26 -4.94 105.19 107.20 1oac n GLY 295 Ca 0.12 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.27 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 2.88 0.00 -0.45 1.61 0.11 -1.92 -1.94 114.38 114.67 1oac h ARG 296 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 1oac h ARG 296 Cb 0.00 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.08 1oac h ARG 296 CO 0.00 0.00 0.00 -0.40 0.10 0.00 0.00 179.97 179.67 1oac n ASP 297 N -4.32 3.44 -4.44 0.08 5.75 -1.26 -5.00 116.55 110.80 1oac n ASP 297 Ca 0.01 -2.15 -0.26 0.00 -0.01 0.00 0.00 54.79 52.39 1oac n ASP 297 Cb 0.26 -0.35 -0.11 0.00 -1.03 0.00 0.00 41.12 39.89 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 -1.27 1.57 -0.24 0.11 1.81 -0.73 -5.12 118.95 115.07 1oac s ARG 298 Ca 0.34 -1.61 -0.12 0.00 -1.72 0.00 0.00 55.73 52.62 1oac s ARG 298 Cb 0.19 -1.80 -0.05 0.00 -0.45 0.00 0.00 34.95 32.85 1oac s ARG 298 CO 0.20 0.37 0.21 0.08 -0.68 0.00 0.00 175.30 175.48 1oac s VAL 299 N -1.99 5.31 -0.10 3.52 1.01 -1.26 -4.97 120.40 121.93 1oac s VAL 299 Ca 0.24 0.28 -0.24 0.00 0.00 0.00 0.00 61.98 62.26 1oac s VAL 299 Cb -0.07 -3.55 -0.03 0.00 0.00 0.00 0.00 36.38 32.73 1oac s VAL 299 CO 0.12 0.30 0.75 0.00 0.00 0.00 0.00 175.10 176.26 1oac s ALA 300 N 1.30 3.38 0.60 5.51 0.00 -1.26 -5.03 121.76 126.27 1oac s ALA 300 Ca 0.09 0.10 -0.18 0.00 0.00 0.00 0.00 51.96 51.98 1oac s ALA 300 Cb -0.14 -3.05 -0.03 0.00 0.00 0.00 0.00 23.12 19.89 1oac s ALA 300 CO 0.07 -0.29 1.18 -1.25 0.00 0.00 0.00 175.76 175.47 1oac s PRO 301 N 1.25 2.98 -0.16 0.00 0.04 -1.26 -4.99 135.00 132.87 1oac s PRO 301 Ca 0.38 1.72 -0.24 0.00 0.04 0.00 0.00 61.00 62.91 1oac s PRO 301 Cb -0.17 -1.94 -0.02 0.00 0.04 0.00 0.00 34.50 32.40 1oac s PRO 301 CO 0.17 -1.17 0.75 0.00 0.04 0.00 0.00 177.00 176.78 1oac s ALA 302 N -1.75 3.49 -0.11 8.56 0.00 -1.26 -5.04 121.76 125.65 1oac s ALA 302 Ca 0.75 -0.03 0.03 0.00 0.00 0.00 0.00 51.96 52.71 1oac s ALA 302 Cb -0.28 -3.10 0.01 0.00 0.00 0.00 0.00 23.12 19.75 1oac s ALA 302 CO 0.33 -0.52 -0.22 0.08 0.00 0.00 0.00 175.76 175.44 1oac s VAL 303 N 1.81 1.95 0.58 0.00 1.01 -1.26 -5.13 120.40 119.38 1oac s VAL 303 Ca 0.35 -0.94 -0.19 0.00 0.00 0.00 0.00 61.98 61.21 1oac s VAL 303 Cb -0.17 -1.71 -0.04 0.00 0.00 0.00 0.00 36.38 34.46 1oac s VAL 303 CO 0.13 0.53 1.17 -0.54 0.00 0.00 0.00 175.10 176.39 1oac s LYS 304 N 0.61 3.09 0.56 2.72 1.02 -1.26 -4.97 119.74 121.51 1oac s LYS 304 Ca -0.13 1.70 -0.20 0.00 0.02 0.00 0.00 55.97 57.36 1oac s LYS 304 Cb -0.17 -1.96 -0.04 0.00 -0.52 0.00 0.00 37.83 35.14 1oac s LYS 304 CO 0.03 -1.08 1.24 -1.25 -0.92 0.00 0.00 175.35 173.37 1oac s PRO 305 N -3.40 3.11 -0.04 -1.68 0.04 -1.26 -5.05 135.00 126.72 1oac s PRO 305 Ca 0.74 1.93 -0.01 0.00 0.04 0.00 0.00 61.00 63.70 1oac s PRO 305 Cb -0.27 -2.07 0.03 0.00 0.04 0.00 0.00 34.50 32.23 1oac s PRO 305 CO 0.32 -1.12 0.02 1.41 0.04 0.00 0.00 177.00 177.66 1oac s MET 306 N -3.13 0.23 0.02 4.56 1.75 -1.26 -5.15 119.30 116.32 1oac s MET 306 Ca 0.74 0.18 0.07 0.00 -1.25 0.00 0.00 55.69 55.43 1oac s MET 306 Cb -0.33 -0.58 -0.02 0.00 2.84 0.00 0.00 34.83 36.74 1oac s MET 306 CO 0.37 -0.23 -0.20 -0.65 -0.65 0.00 0.00 175.02 173.66 1oac s GLN 307 N 1.58 1.39 -0.22 4.11 -0.21 -1.26 -5.00 119.66 120.06 1oac s GLN 307 Ca -0.02 -0.84 -0.03 0.00 0.02 0.00 0.00 55.36 54.49 1oac s GLN 307 Cb -0.13 -1.45 0.00 0.00 1.00 0.00 0.00 33.01 32.44 1oac s GLN 307 CO -0.03 0.38 -0.08 0.42 -2.12 0.00 0.00 175.29 173.86 1oac s ILE 308 N -0.69 3.05 0.08 1.08 1.01 -1.26 -5.10 121.20 119.38 1oac s ILE 308 Ca 0.07 -0.64 0.08 0.00 0.00 0.00 0.00 60.65 60.15 1oac s ILE 308 Cb -0.08 -2.39 -0.03 0.00 0.01 0.00 0.00 42.46 39.97 1oac s ILE 308 CO 0.01 0.42 -0.20 0.27 0.00 0.00 0.00 174.94 175.44 1oac s ILE 309 N 1.42 1.61 -0.53 2.92 -4.36 -1.26 -3.84 121.20 117.17 1oac s ILE 309 Ca 0.05 -1.41 0.04 0.00 -0.26 0.00 0.00 60.65 59.07 1oac s ILE 309 Cb -0.14 -1.45 0.17 0.00 1.25 0.00 0.00 42.46 42.28 1oac s ILE 309 CO -0.05 -0.01 0.39 -1.61 0.24 0.00 0.00 174.94 173.89 1oac s GLU 310 N -1.69 1.57 0.60 0.37 2.02 -1.26 -5.00 118.70 115.31 1oac s GLU 310 Ca 0.05 -2.59 0.39 0.00 0.02 0.00 0.00 54.97 52.84 1oac s GLU 310 Cb -0.10 -2.31 1.86 0.00 0.10 0.00 0.00 34.13 33.69 1oac s GLU 310 CO 0.03 -1.32 2.16 -1.00 0.02 0.00 0.00 175.26 175.16 1oac h PRO 311 N 5.66 0.00 -0.37 0.39 0.13 -1.97 -2.78 132.00 133.06 1oac h PRO 311 Ca 0.19 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.32 1oac h PRO 311 Cb 0.85 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.98 1oac h PRO 311 CO 0.52 0.00 0.00 0.39 -0.23 0.00 0.00 178.00 178.68 1oac n GLU 312 N -3.08 3.34 0.00 0.86 1.02 -1.26 -3.54 120.64 117.98 1oac n GLU 312 Ca -0.01 -2.78 0.00 0.00 -0.02 0.00 0.00 57.16 54.35 1oac n GLU 312 Cb 0.20 -1.83 0.00 0.00 -0.02 0.00 0.00 31.44 29.78 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 0.01 -3.88 3.94 0.62 0.00 -1.05 -4.84 105.19 99.99 1oac n GLY 313 Ca 0.21 -2.06 -0.24 0.00 0.00 0.00 0.00 46.02 43.93 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 -0.87 3.49 0.23 1.61 -0.14 -1.26 -4.86 119.74 117.94 1oac s LYS 314 Ca 0.00 -0.40 0.25 0.00 -1.36 0.00 0.00 55.97 54.46 1oac s LYS 314 Cb 0.00 -2.75 0.66 0.00 -1.68 0.00 0.00 37.83 34.05 1oac s LYS 314 CO 0.00 0.27 1.67 -0.91 -0.76 0.00 0.00 175.35 175.62 1oac h ASN 315 N 1.21 0.00 -2.44 2.83 -0.26 -1.96 -3.45 115.58 111.51 1oac h ASN 315 Ca -0.50 -0.03 -0.53 0.00 -0.56 0.00 0.00 56.30 54.68 1oac h ASN 315 Cb 1.21 0.00 -0.04 0.00 -1.06 0.00 0.00 38.32 38.43 1oac h ASN 315 CO 0.63 0.02 -0.51 -0.72 -1.06 0.00 0.00 177.43 175.79 1oac s TYR 316 N -3.13 3.27 -0.05 1.19 -0.85 -1.26 -4.44 117.35 112.07 1oac s TYR 316 Ca 0.09 -0.02 0.03 0.00 -0.52 0.00 0.00 57.07 56.65 1oac s TYR 316 Cb 0.11 -1.52 0.01 0.00 0.38 0.00 0.00 41.96 40.94 1oac s TYR 316 CO 0.63 0.50 -0.12 0.99 -1.52 0.00 0.00 175.55 176.03 1oac s THR 317 N -1.90 1.12 -0.33 -3.49 2.01 -0.69 -4.76 115.64 107.59 1oac s THR 317 Ca 0.33 -0.49 -0.04 0.00 0.31 0.00 0.00 61.69 61.80 1oac s THR 317 Cb -0.09 -1.01 0.05 0.00 0.01 0.00 0.00 72.50 71.46 1oac s THR 317 CO 0.26 0.34 0.07 -0.63 -0.69 0.00 0.00 174.62 173.98 1oac s ILE 318 N 0.49 3.37 -0.47 1.82 1.01 0.48 -1.32 121.20 126.59 1oac s ILE 318 Ca -0.11 -1.37 -0.07 0.00 0.00 0.00 0.00 60.65 59.10 1oac s ILE 318 Cb -0.14 -2.98 0.12 0.00 0.01 0.00 0.00 42.46 39.47 1oac s ILE 318 CO 0.03 -0.22 0.32 -0.89 0.00 0.00 0.00 174.94 174.18 1oac s THR 319 N 1.30 3.96 0.00 2.92 2.01 -0.35 0.07 115.64 125.55 1oac s THR 319 Ca -0.02 -1.92 0.00 0.00 0.31 0.00 0.00 61.69 60.06 1oac s THR 319 Cb -0.20 -3.63 0.00 0.00 0.01 0.00 0.00 72.50 68.68 1oac s THR 319 CO 0.00 -0.76 0.00 0.61 -0.69 0.00 0.00 174.62 173.78 1oac n GLY 320 N 4.76 2.40 0.59 4.40 0.00 -1.05 -2.17 105.19 114.12 1oac n GLY 320 Ca -0.05 -0.36 0.07 0.00 0.00 0.00 0.00 46.02 45.68 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 8.28 2.32 -4.75 1.61 8.00 -1.26 -4.98 116.55 125.76 1oac n ASP 321 Ca 0.00 -1.65 -0.40 0.00 0.71 0.00 0.00 54.79 53.45 1oac n ASP 321 Cb 0.00 -0.05 -0.05 0.00 -0.02 0.00 0.00 41.12 41.00 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 -1.12 4.53 -0.09 -1.24 -1.94 -0.92 -1.36 119.30 117.16 1oac s MET 322 Ca 0.18 1.12 0.04 0.00 -1.71 0.00 0.00 55.69 55.32 1oac s MET 322 Cb 0.12 -3.33 -0.01 0.00 2.01 0.00 0.00 34.83 33.62 1oac s MET 322 CO 0.18 0.36 -0.21 0.42 -0.01 0.00 0.00 175.02 175.76 1oac s ILE 323 N -0.37 2.34 -0.15 2.53 1.01 -0.38 -1.21 121.20 124.97 1oac s ILE 323 Ca 0.38 -0.93 0.01 0.00 0.00 0.00 0.00 60.65 60.10 1oac s ILE 323 Cb -0.21 -1.91 -0.00 0.00 0.01 0.00 0.00 42.46 40.35 1oac s ILE 323 CO 0.24 0.56 -0.16 -2.28 0.00 0.00 0.00 174.94 173.30 1oac s HIS 324 N 0.14 2.76 -0.24 3.97 5.65 -0.43 -1.95 115.29 125.19 1oac s HIS 324 Ca -0.11 -1.04 -0.03 0.00 0.25 0.00 0.00 55.06 54.13 1oac s HIS 324 Cb -0.16 -1.87 0.13 0.00 -1.18 0.00 0.00 32.58 29.50 1oac s HIS 324 CO 0.06 -0.46 0.35 -0.46 -0.65 0.00 0.00 174.74 173.58 1oac s TRP 325 N 0.75 -0.74 0.00 3.88 -0.00 -0.70 -1.71 118.94 120.42 1oac s TRP 325 Ca -0.07 0.73 0.00 0.00 -0.00 0.00 0.00 56.10 56.77 1oac s TRP 325 Cb -0.16 -0.04 0.00 0.00 -0.00 0.00 0.00 33.47 33.27 1oac s TRP 325 CO 0.01 -0.70 0.00 0.54 -0.00 0.00 0.00 176.95 176.80 1oac n ARG 326 N 5.36 0.00 0.00 5.86 5.12 -1.26 -1.38 116.66 130.35 1oac n ARG 326 Ca -0.04 0.00 0.12 0.00 -1.93 0.00 0.00 57.85 56.00 1oac n ARG 326 Cb 0.50 0.00 0.25 0.00 -1.16 0.00 0.00 32.46 32.05 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 8.31 0.57 -4.84 0.55 5.03 -1.26 -4.93 115.26 118.70 1oac n ASN 327 Ca 0.00 -0.34 -0.36 0.00 0.87 0.00 0.00 54.58 54.75 1oac n ASN 327 Cb 0.00 0.26 -0.06 0.00 -1.02 0.00 0.00 39.78 38.97 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 -2.95 3.65 -0.05 3.10 0.52 -0.48 -0.74 118.94 122.00 1oac s TRP 328 Ca 0.12 1.12 0.01 0.00 0.02 0.00 0.00 56.10 57.38 1oac s TRP 328 Cb 0.18 -2.41 0.02 0.00 -1.15 0.00 0.00 33.47 30.11 1oac s TRP 328 CO 0.69 0.46 -0.06 -0.51 0.02 0.00 0.00 176.95 177.54 1oac s ASP 329 N -1.59 1.07 0.17 2.95 1.01 -1.00 -1.71 116.67 117.57 1oac s ASP 329 Ca 0.36 -0.16 -0.15 0.00 0.71 0.00 0.00 52.55 53.32 1oac s ASP 329 Cb -0.16 -0.51 0.02 0.00 1.01 0.00 0.00 42.92 43.28 1oac s ASP 329 CO 0.19 -0.03 0.42 0.72 0.21 0.00 0.00 175.17 176.68 1oac s PHE 330 N 0.83 -0.00 -0.09 4.23 -0.71 -0.82 -1.01 117.98 120.41 1oac s PHE 330 Ca -0.12 -0.34 0.01 0.00 -1.04 0.00 0.00 56.93 55.43 1oac s PHE 330 Cb -0.15 0.24 -0.03 0.00 -1.21 0.00 0.00 43.02 41.87 1oac s PHE 330 CO 0.01 -0.81 -0.10 -1.58 -1.34 0.00 0.00 175.22 171.41 1oac s HIS 331 N -3.88 2.86 -0.17 3.49 2.46 0.11 -1.25 115.29 118.91 1oac s HIS 331 Ca 0.09 -0.20 0.01 0.00 0.47 0.00 0.00 55.06 55.43 1oac s HIS 331 Cb 0.01 -1.75 0.01 0.00 -0.13 0.00 0.00 32.58 30.72 1oac s HIS 331 CO -0.05 0.13 -0.18 -1.17 -2.47 0.00 0.00 174.74 171.01 1oac s LEU 332 N -0.40 2.27 0.27 8.88 2.96 -0.46 -1.43 118.68 130.77 1oac s LEU 332 Ca 0.05 -0.57 0.02 0.00 -0.22 0.00 0.00 54.13 53.41 1oac s LEU 332 Cb -0.12 -1.51 -0.04 0.00 0.50 0.00 0.00 46.19 45.01 1oac s LEU 332 CO 0.02 0.04 0.13 -0.94 -1.32 0.00 0.00 176.35 174.29 1oac s SER 333 N 1.05 1.22 -0.03 3.68 1.04 -0.24 -4.79 113.70 115.62 1oac s SER 333 Ca -0.01 -1.47 0.06 0.00 0.48 0.00 0.00 55.95 55.01 1oac s SER 333 Cb -0.14 0.30 -0.01 0.00 0.10 0.00 0.00 66.02 66.27 1oac s SER 333 CO -0.06 -0.82 -0.21 -0.32 0.98 0.00 0.00 173.24 172.81 1oac s MET 334 N -3.94 1.94 -0.03 4.02 1.75 -1.26 -1.02 119.30 120.76 1oac s MET 334 Ca 0.37 -0.77 0.07 0.00 -1.25 0.00 0.00 55.69 54.11 1oac s MET 334 Cb 0.06 -1.77 -0.01 0.00 2.84 0.00 0.00 34.83 35.95 1oac s MET 334 CO 0.15 0.40 -0.23 1.21 -0.65 0.00 0.00 175.02 175.90 1oac s ASN 335 N -0.31 2.74 0.53 1.11 3.84 0.14 -4.93 114.94 118.07 1oac s ASN 335 Ca 0.03 -0.43 0.30 0.00 0.21 0.00 0.00 52.86 52.97 1oac s ASN 335 Cb -0.10 -0.46 1.42 0.00 -0.55 0.00 0.00 41.25 41.56 1oac s ASN 335 CO 0.01 0.26 2.03 0.77 -2.79 0.00 0.00 177.10 177.38 1oac h SER 336 N 5.75 0.00 0.00 -4.21 4.64 -1.91 -0.95 113.55 116.87 1oac h SER 336 Ca -0.38 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 60.94 1oac h SER 336 Cb 1.14 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.23 1oac h SER 336 CO 0.47 0.10 -0.18 -0.09 -0.87 0.00 0.00 176.83 176.27 1oac h ARG 337 N 0.00 0.00 -0.14 4.77 2.43 -1.89 0.57 114.38 120.11 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 0.44 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.99 1oac h ARG 337 CO 0.01 0.02 0.00 1.33 -1.51 0.00 0.00 179.97 179.82 1oac n VAL 338 N -4.72 0.19 -2.70 0.20 0.24 -1.25 -1.10 118.33 109.19 1oac n VAL 338 Ca -0.03 -0.60 0.00 0.00 -2.04 0.00 0.00 64.34 61.68 1oac n VAL 338 Cb 0.10 1.25 0.00 0.00 -1.47 0.00 0.00 33.84 33.72 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 0.32 3.77 7.63 0.00 -0.36 -4.39 105.19 113.35 1oac n GLY 339 Ca 0.14 -0.86 -0.38 0.00 0.00 0.00 0.00 46.02 44.91 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 3.78 -0.09 1.61 0.04 -1.26 -0.68 135.00 138.39 1oac s PRO 340 Ca 0.00 1.94 0.01 0.00 0.04 0.00 0.00 61.00 62.99 1oac s PRO 340 Cb 0.00 -2.52 0.02 0.00 0.04 0.00 0.00 34.50 32.04 1oac s PRO 340 CO 0.00 -0.58 -0.12 -1.64 0.04 0.00 0.00 177.00 174.70 1oac s MET 341 N -2.54 1.80 -0.30 4.56 -1.94 -0.19 -4.38 119.30 116.32 1oac s MET 341 Ca 0.62 -0.41 -0.09 0.00 -1.71 0.00 0.00 55.69 54.10 1oac s MET 341 Cb -0.33 -1.61 -0.01 0.00 2.01 0.00 0.00 34.83 34.89 1oac s MET 341 CO 0.41 -0.10 0.14 0.42 -0.01 0.00 0.00 175.02 175.88 1oac s ILE 342 N 1.10 4.53 0.21 2.53 -1.09 -0.59 -1.08 121.20 126.81 1oac s ILE 342 Ca -0.06 -0.41 0.06 0.00 -2.23 0.00 0.00 60.65 58.00 1oac s ILE 342 Cb -0.14 -3.29 -0.05 0.00 -1.58 0.00 0.00 42.46 37.39 1oac s ILE 342 CO -0.02 0.10 -0.08 -0.44 -1.23 0.00 0.00 174.94 173.26 1oac s SER 343 N 1.61 2.22 -1.26 3.58 0.01 -0.51 -0.24 113.70 119.10 1oac s SER 343 Ca 0.05 -1.10 -0.30 0.00 1.31 0.00 0.00 55.95 55.91 1oac s SER 343 Cb -0.17 -0.07 0.04 0.00 0.21 0.00 0.00 66.02 66.03 1oac s SER 343 CO 0.06 -0.33 0.57 0.35 0.41 0.00 0.00 173.24 174.30 1oac n THR 344 N -0.38 -2.34 -2.76 1.44 -2.24 -0.01 0.05 114.28 108.05 1oac n THR 344 Ca -0.07 -0.57 -0.43 0.00 -2.27 0.00 0.00 64.05 60.71 1oac n THR 344 Cb 0.62 -2.01 -0.03 0.00 -2.10 0.00 0.00 70.33 66.81 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 -3.67 4.64 0.26 2.28 1.01 -0.22 -4.28 120.40 120.42 1oac s VAL 345 Ca 0.42 1.55 0.09 0.00 0.00 0.00 0.00 61.98 64.04 1oac s VAL 345 Cb -0.24 -4.30 -0.05 0.00 0.00 0.00 0.00 36.38 31.79 1oac s VAL 345 CO 0.97 -0.36 -0.14 0.42 0.00 0.00 0.00 175.10 176.00 1oac s THR 346 N 3.33 2.02 -0.11 3.92 -4.23 -0.18 -1.26 115.64 119.13 1oac s THR 346 Ca 0.40 -2.26 0.02 0.00 -1.18 0.00 0.00 61.69 58.66 1oac s THR 346 Cb -0.13 -2.26 0.02 0.00 1.34 0.00 0.00 72.50 71.46 1oac s THR 346 CO 0.13 -0.44 -0.14 -0.47 -0.54 0.00 0.00 174.62 173.16 1oac s TYR 347 N -2.79 1.87 -0.57 3.99 6.14 -0.53 -2.36 117.35 123.09 1oac s TYR 347 Ca 0.27 -0.87 -0.25 0.00 0.64 0.00 0.00 57.07 56.86 1oac s TYR 347 Cb -0.01 -1.37 0.04 0.00 0.42 0.00 0.00 41.96 41.04 1oac s TYR 347 CO 0.11 -0.46 0.99 1.21 0.64 0.00 0.00 175.55 178.05 1oac s ASN 348 N 1.04 6.33 -0.70 4.32 2.47 0.08 -0.27 114.94 128.21 1oac s ASN 348 Ca -0.06 -0.36 -0.15 0.00 0.42 0.00 0.00 52.86 52.71 1oac s ASN 348 Cb -0.15 -2.46 0.17 0.00 -1.45 0.00 0.00 41.25 37.37 1oac s ASN 348 CO -0.02 -1.31 0.66 -0.62 -3.72 0.00 0.00 177.10 172.09 1oac s ASP 349 N 2.99 6.49 -1.51 -4.21 -1.08 0.26 -4.57 116.67 115.04 1oac s ASP 349 Ca 0.31 -2.22 -0.08 0.00 -0.52 0.00 0.00 52.55 50.04 1oac s ASP 349 Cb -0.12 -2.22 0.06 0.00 -1.46 0.00 0.00 42.92 39.18 1oac s ASP 349 CO 0.19 -0.74 0.68 0.59 0.52 0.00 0.00 175.17 176.41 1oac n ASN 350 N 4.73 -2.21 0.00 -0.34 5.03 -1.26 -1.16 115.26 120.04 1oac n ASN 350 Ca 0.01 -0.94 0.00 0.00 0.87 0.00 0.00 54.58 54.52 1oac n ASN 350 Cb 0.44 -3.27 0.00 0.00 -1.02 0.00 0.00 39.78 35.93 1oac n ASN 350 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1oac n GLY 351 N -1.71 3.26 3.56 7.41 0.00 -1.26 -5.05 105.19 111.41 1oac n GLY 351 Ca -0.13 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.54 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 -2.85 4.68 -0.38 2.61 2.01 -0.31 -5.06 115.64 116.34 1oac s THR 352 Ca 0.00 -0.06 -0.28 0.00 0.31 0.00 0.00 61.69 61.66 1oac s THR 352 Cb 0.00 -3.15 0.02 0.00 0.01 0.00 0.00 72.50 69.38 1oac s THR 352 CO 0.00 0.39 1.07 -0.54 -0.69 0.00 0.00 174.62 174.85 1oac s LYS 353 N 1.01 3.91 -0.15 4.92 1.02 -1.26 0.90 119.74 130.08 1oac s LYS 353 Ca 0.04 0.82 -0.06 0.00 0.02 0.00 0.00 55.97 56.79 1oac s LYS 353 Cb -0.14 -3.81 -0.04 0.00 -0.52 0.00 0.00 37.83 33.32 1oac s LYS 353 CO 0.03 -1.08 0.07 1.03 -0.92 0.00 0.00 175.35 174.49 1oac s ARG 354 N 3.90 3.65 0.32 1.68 0.52 0.62 -4.90 118.95 124.75 1oac s ARG 354 Ca 0.45 -0.29 -0.29 0.00 -0.52 0.00 0.00 55.73 55.08 1oac s ARG 354 Cb -0.10 -3.13 -0.10 0.00 0.52 0.00 0.00 34.95 32.13 1oac s ARG 354 CO 0.22 0.49 1.41 0.15 0.02 0.00 0.00 175.30 177.59 1oac s LYS 355 N -0.25 4.25 0.09 3.54 1.02 -1.26 -1.46 119.74 125.67 1oac s LYS 355 Ca 0.09 2.36 0.00 0.00 0.02 0.00 0.00 55.97 58.43 1oac s LYS 355 Cb -0.12 -3.05 0.00 0.00 -0.52 0.00 0.00 37.83 34.14 1oac s LYS 355 CO 0.01 -0.37 0.00 0.28 -0.92 0.00 0.00 175.35 174.36 1oac n VAL 356 N 1.19 0.57 -3.68 3.17 0.31 -0.39 -0.21 118.33 119.31 1oac n VAL 356 Ca 0.02 0.19 -0.18 0.00 -0.01 0.00 0.00 64.34 64.36 1oac n VAL 356 Cb 0.40 -1.31 -0.17 0.00 -0.91 0.00 0.00 33.84 31.86 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 -0.03 0.04 5.55 -2.45 -1.04 -1.23 119.30 118.14 1oac s MET 357 Ca 0.00 0.45 -0.22 0.00 -1.25 0.00 0.00 55.69 54.67 1oac s MET 357 Cb 0.00 -0.39 -0.14 0.00 1.25 0.00 0.00 34.83 35.54 1oac s MET 357 CO 0.00 -0.31 1.43 -0.92 1.05 0.00 0.00 175.02 176.27 1oac h TYR 358 N 8.33 0.25 -1.89 4.11 3.20 -1.08 -0.56 116.97 129.32 1oac h TYR 358 Ca -0.15 -0.05 -0.02 0.00 3.14 0.00 0.00 58.73 61.65 1oac h TYR 358 Cb 1.12 -0.06 -0.22 0.00 1.54 0.00 0.00 36.73 39.11 1oac h TYR 358 CO 0.46 0.52 0.23 -2.00 -1.64 0.00 0.00 178.16 175.72 1oac s GLU 359 N -4.76 0.78 0.01 1.82 2.12 -1.21 -0.83 118.70 116.64 1oac s GLU 359 Ca -0.14 0.78 -0.00 0.00 0.36 0.00 0.00 54.97 55.97 1oac s GLU 359 Cb 0.05 0.38 -0.01 0.00 0.26 0.00 0.00 34.13 34.81 1oac s GLU 359 CO 0.71 -0.12 -0.01 0.20 -0.54 0.00 0.00 175.26 175.50 1oac s GLY 360 N 0.09 0.10 0.22 -1.50 0.00 0.66 0.58 107.32 107.47 1oac s GLY 360 Ca -0.01 -0.24 -0.22 0.00 0.00 0.00 0.00 44.72 44.26 1oac s GLY 360 CO 0.01 -0.26 0.92 -1.35 0.00 0.00 0.00 173.10 172.41 1oac s SER 361 N -0.59 -0.10 0.45 1.64 1.04 -0.64 -1.54 113.70 113.96 1oac s SER 361 Ca -0.06 -0.65 -0.25 0.00 0.48 0.00 0.00 55.95 55.47 1oac s SER 361 Cb -0.04 0.59 -0.08 0.00 0.10 0.00 0.00 66.02 66.59 1oac s SER 361 CO -0.00 -1.14 1.44 -0.22 0.98 0.00 0.00 173.24 174.30 1oac s LEU 362 N -3.09 4.12 -0.11 2.42 2.96 -1.26 -1.43 118.68 122.29 1oac s LEU 362 Ca 0.15 2.95 -0.07 0.00 -0.22 0.00 0.00 54.13 56.95 1oac s LEU 362 Cb -0.03 -3.92 -0.02 0.00 0.50 0.00 0.00 46.19 42.72 1oac s LEU 362 CO 0.05 -1.18 -0.13 1.23 -1.32 0.00 0.00 176.35 175.00 1oac h GLY 363 N 2.34 0.00 -2.18 7.98 0.00 0.05 -3.41 103.07 107.84 1oac h GLY 363 Ca -0.51 0.00 0.27 0.00 0.00 0.00 0.00 47.33 47.09 1oac h GLY 363 CO 0.61 0.00 0.74 -0.32 0.00 0.00 0.00 176.54 177.57 1oac s GLY 364 N -3.79 -0.19 0.11 4.60 0.00 -1.03 -4.47 107.32 102.55 1oac s GLY 364 Ca -0.11 0.19 -0.13 0.00 0.00 0.00 0.00 44.72 44.67 1oac s GLY 364 CO 0.16 2.04 0.33 -3.16 0.00 0.00 0.00 173.10 172.47 1oac s MET 365 N -2.40 1.00 -0.02 2.90 0.23 -1.26 -1.22 119.30 118.53 1oac s MET 365 Ca 0.20 -0.80 -0.02 0.00 -1.03 0.00 0.00 55.69 54.03 1oac s MET 365 Cb 0.01 0.43 0.00 0.00 -1.53 0.00 0.00 34.83 33.74 1oac s MET 365 CO 0.00 -0.37 0.05 -1.50 -2.03 0.00 0.00 175.02 171.17 1oac s ILE 366 N -3.83 0.01 -0.56 3.16 2.07 -0.19 -3.17 121.20 118.70 1oac s ILE 366 Ca 0.04 -0.09 0.04 0.00 -1.41 0.00 0.00 60.65 59.23 1oac s ILE 366 Cb 0.03 -0.11 0.15 0.00 0.13 0.00 0.00 42.46 42.66 1oac s ILE 366 CO -0.11 -0.05 0.36 -0.69 -1.91 0.00 0.00 174.94 172.54 1oac s VAL 367 N -0.13 2.12 0.16 4.00 1.01 0.04 -0.66 120.40 126.93 1oac s VAL 367 Ca -0.02 -3.43 -0.20 0.00 0.00 0.00 0.00 61.98 58.33 1oac s VAL 367 Cb -0.01 -2.43 -0.08 0.00 0.00 0.00 0.00 36.38 33.86 1oac s VAL 367 CO 0.00 -0.97 0.67 -2.16 0.00 0.00 0.00 175.10 172.65 1oac s PRO 368 N -0.56 4.28 0.34 2.72 0.04 -1.24 -1.99 135.00 138.59 1oac s PRO 368 Ca 0.22 0.86 0.06 0.00 0.04 0.00 0.00 61.00 62.18 1oac s PRO 368 Cb -0.13 -3.08 -0.01 0.00 0.04 0.00 0.00 34.50 31.32 1oac s PRO 368 CO -0.09 0.52 0.49 0.71 0.04 0.00 0.00 177.00 178.66 1oac s TYR 369 N -1.31 3.14 -0.13 0.56 1.51 -0.94 -2.43 117.35 117.74 1oac s TYR 369 Ca 0.37 -0.16 0.19 0.00 -1.01 0.00 0.00 57.07 56.45 1oac s TYR 369 Cb -0.19 -2.02 0.30 0.00 -0.11 0.00 0.00 41.96 39.95 1oac s TYR 369 CO 0.21 -0.04 1.16 0.41 -1.11 0.00 0.00 175.55 176.19 1oac n GLY 370 N -1.68 4.88 3.73 0.71 0.00 -0.89 -4.97 105.19 106.96 1oac n GLY 370 Ca -0.00 -1.14 -0.35 0.00 0.00 0.00 0.00 46.02 44.52 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 -2.87 5.92 0.00 1.61 -1.08 -1.26 -4.96 116.67 114.03 1oac s ASP 371 Ca 0.32 0.24 0.29 0.00 -0.52 0.00 0.00 52.55 52.88 1oac s ASP 371 Cb 0.28 -1.95 1.18 0.00 -1.46 0.00 0.00 42.92 40.98 1oac s ASP 371 CO 0.03 0.27 1.83 -0.81 0.52 0.00 0.00 175.17 177.01 1oac n PRO 372 N 2.87 0.77 -0.92 4.34 -0.04 -1.26 -3.16 135.00 137.60 1oac n PRO 372 Ca -0.18 -0.29 -0.30 0.00 -0.04 0.00 0.00 63.50 62.69 1oac n PRO 372 Cb 0.53 -1.49 0.16 0.00 -0.04 0.00 0.00 33.50 32.66 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 -2.44 3.06 0.30 3.54 1.01 -1.26 -4.35 116.67 116.53 1oac s ASP 373 Ca 0.29 1.82 0.04 0.00 0.71 0.00 0.00 52.55 55.42 1oac s ASP 373 Cb 0.20 -2.41 0.68 0.00 1.01 0.00 0.00 42.92 42.40 1oac s ASP 373 CO 0.47 -2.95 1.80 0.16 0.21 0.00 0.00 175.17 174.86 1oac h ILE 374 N -1.76 0.79 -0.06 0.77 3.07 -1.99 0.14 117.51 118.46 1oac h ILE 374 Ca -0.48 -0.29 0.00 0.00 1.55 0.00 0.00 64.86 65.64 1oac h ILE 374 Cb 1.28 -0.13 0.00 0.00 -0.27 0.00 0.00 36.82 37.69 1oac h ILE 374 CO 0.48 0.15 0.00 0.61 -1.05 0.00 0.00 178.15 178.35 1oac n GLY 375 N -1.34 -0.31 0.00 0.16 0.00 -1.26 -4.38 105.19 98.06 1oac n GLY 375 Ca 0.22 -0.32 0.00 0.00 0.00 0.00 0.00 46.02 45.91 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 -0.20 0.00 -0.22 1.61 7.02 -0.20 -4.87 117.44 120.58 1oac n TRP 376 Ca 0.18 0.00 0.15 0.00 -1.02 0.00 0.00 57.50 56.81 1oac n TRP 376 Cb 0.24 0.00 0.45 0.00 -2.42 0.00 0.00 31.31 29.59 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 0.63 0.00 -5.99 -0.00 -0.77 -1.06 116.97 109.78 1oac h TYR 377 Ca 0.00 0.02 0.00 0.00 0.00 0.00 0.00 58.73 58.75 1oac h TYR 377 Cb 0.67 -0.20 0.00 0.00 0.00 0.00 0.00 36.73 37.20 1oac h TYR 377 CO 0.00 0.22 -0.54 1.97 -0.00 0.00 0.00 178.16 179.81 1oac n PHE 378 N -4.52 0.01 -1.92 0.10 -1.74 -1.26 -4.94 117.46 103.19 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 0.54 -0.24 -0.03 0.00 1.52 0.00 0.00 39.48 41.27 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 -3.00 3.41 -0.27 3.97 2.20 -0.40 -4.68 119.74 120.97 1oac s LYS 379 Ca 0.11 1.66 -0.05 0.00 -0.36 0.00 0.00 55.97 57.33 1oac s LYS 379 Cb 0.17 -4.21 0.14 0.00 -1.51 0.00 0.00 37.83 32.43 1oac s LYS 379 CO 0.71 -1.77 0.54 0.00 -0.36 0.00 0.00 175.35 174.48 1oac s ALA 380 N 6.78 -1.77 -0.18 3.13 0.00 -1.26 -2.23 121.76 126.23 1oac s ALA 380 Ca 0.83 1.78 -0.17 0.00 0.00 0.00 0.00 51.96 54.40 1oac s ALA 380 Cb -0.26 -1.79 -0.04 0.00 0.00 0.00 0.00 23.12 21.03 1oac s ALA 380 CO 0.34 -1.07 0.46 0.71 0.00 0.00 0.00 175.76 176.19 1oac s TYR 381 N 2.77 3.41 -0.98 0.00 1.51 -0.84 -4.85 117.35 118.37 1oac s TYR 381 Ca 0.06 0.74 -0.07 0.00 -1.01 0.00 0.00 57.07 56.79 1oac s TYR 381 Cb -0.14 -2.58 0.25 0.00 -0.11 0.00 0.00 41.96 39.38 1oac s TYR 381 CO -0.18 0.01 0.92 -0.51 -1.11 0.00 0.00 175.55 174.68 1oac s LEU 382 N 1.22 6.10 0.17 -1.29 1.02 -1.26 -0.78 118.68 123.86 1oac s LEU 382 Ca 0.22 -3.46 -0.16 0.00 0.02 0.00 0.00 54.13 50.75 1oac s LEU 382 Cb -0.15 -2.10 0.12 0.00 0.02 0.00 0.00 46.19 44.09 1oac s LEU 382 CO 0.09 -0.30 1.68 0.44 0.02 0.00 0.00 176.35 178.28 1oac h ASP 383 N 6.64 -0.24 0.04 2.29 3.32 -1.93 -0.86 116.42 125.67 1oac h ASP 383 Ca 0.15 0.11 -0.07 0.00 0.02 0.00 0.00 57.03 57.24 1oac h ASP 383 Cb 0.88 0.20 0.01 0.00 0.22 0.00 0.00 39.33 40.64 1oac h ASP 383 CO 0.91 -0.08 -0.30 0.77 -1.72 0.00 0.00 179.24 178.81 1oac h SER 384 N 0.07 0.20 -0.40 6.45 4.64 -1.84 -2.70 113.55 119.98 1oac h SER 384 Ca 0.21 -0.92 -0.02 0.00 -0.47 0.00 0.00 61.79 60.59 1oac h SER 384 Cb 0.31 -0.06 -0.02 0.00 -0.31 0.00 0.00 62.40 62.31 1oac h SER 384 CO -0.38 1.10 0.19 1.23 -0.87 0.00 0.00 176.83 178.10 1oac h GLY 385 N -0.67 0.62 1.28 -0.77 0.00 -1.84 -0.43 103.07 101.26 1oac h GLY 385 Ca -0.05 -0.31 -0.23 0.00 0.00 0.00 0.00 47.33 46.74 1oac h GLY 385 CO 0.06 0.30 -1.40 -0.55 0.00 0.00 0.00 176.54 174.95 1oac h ASP 386 N 0.50 0.00 0.00 0.19 3.32 -1.34 -3.43 116.42 115.67 1oac h ASP 386 Ca 0.14 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.19 1oac h ASP 386 Cb 0.13 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.68 1oac h ASP 386 CO -0.02 0.87 -0.81 -1.22 -1.72 0.00 0.00 179.24 176.34 1oac n TYR 387 N -3.09 0.00 -1.49 4.55 4.02 -1.03 -0.18 117.16 119.94 1oac n TYR 387 Ca -0.10 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.79 1oac n TYR 387 Cb 0.96 -0.00 0.00 0.00 -0.02 0.00 0.00 39.34 40.27 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 2.21 -2.14 0.22 2.72 0.00 -0.17 -4.81 105.19 103.21 1oac n GLY 388 Ca -0.00 -0.21 -0.05 0.00 0.00 0.00 0.00 46.02 45.76 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 0.00 0.44 0.00 1.61 2.86 -1.10 -2.09 114.93 116.66 1oac h MET 389 Ca 0.00 -0.20 0.01 0.00 -2.06 0.00 0.00 59.70 57.44 1oac h MET 389 Cb 0.00 -0.01 -0.01 0.00 0.06 0.00 0.00 31.60 31.64 1oac h MET 389 CO 0.00 0.75 -0.05 0.78 1.06 0.00 0.00 176.91 179.45 1oac h GLY 390 N 1.11 -0.05 1.21 8.32 0.00 -0.93 -2.12 103.07 110.60 1oac h GLY 390 Ca 0.04 0.05 0.04 0.00 0.00 0.00 0.00 47.33 47.46 1oac h GLY 390 CO 0.07 -0.05 0.44 -0.84 0.00 0.00 0.00 176.54 176.15 1oac h THR 391 N -0.09 1.07 -0.53 4.70 2.02 -0.95 -1.97 112.91 117.16 1oac h THR 391 Ca 0.02 -0.26 -0.10 0.00 0.77 0.00 0.00 66.41 66.84 1oac h THR 391 Cb 0.11 0.24 -0.06 0.00 -1.74 0.00 0.00 68.15 66.70 1oac h THR 391 CO -0.05 0.14 0.13 0.18 0.37 0.00 0.00 175.52 176.29 1oac n LEU 392 N -4.46 4.98 -4.58 2.58 4.77 -0.81 -4.97 117.00 114.51 1oac n LEU 392 Ca 0.08 -2.56 -0.47 0.00 -0.03 0.00 0.00 56.01 53.04 1oac n LEU 392 Cb 0.15 -0.67 -0.03 0.00 -2.33 0.00 0.00 43.42 40.54 1oac n LEU 392 CO 0.35 0.64 0.63 0.41 -1.33 0.00 0.00 177.39 178.08 1oac n THR 393 N 0.17 1.46 -3.65 -5.08 -1.04 -0.74 -2.64 114.28 102.75 1oac n THR 393 Ca 0.28 -0.36 -0.37 0.00 -2.04 0.00 0.00 64.05 61.55 1oac n THR 393 Cb 1.09 -0.90 -0.11 0.00 -1.82 0.00 0.00 70.33 68.60 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 -0.30 5.83 0.23 8.00 0.01 0.15 -4.84 113.70 122.78 1oac s SER 394 Ca 0.66 -0.03 -0.32 0.00 1.31 0.00 0.00 55.95 57.57 1oac s SER 394 Cb -0.78 -2.07 -0.13 0.00 0.21 0.00 0.00 66.02 63.25 1oac s SER 394 CO 0.56 -0.02 1.50 -2.65 0.41 0.00 0.00 173.24 173.04 1oac n PRO 395 N 4.86 2.23 -2.01 12.44 -0.02 -1.26 -4.51 135.00 146.72 1oac n PRO 395 Ca -0.15 0.80 -0.42 0.00 -2.02 0.00 0.00 63.50 61.71 1oac n PRO 395 Cb 0.52 -2.51 -0.03 0.00 -0.02 0.00 0.00 33.50 31.46 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 0.26 3.15 -0.64 4.25 1.01 0.97 -4.95 121.20 125.25 1oac s ILE 396 Ca 0.70 0.65 -0.28 0.00 0.00 0.00 0.00 60.65 61.73 1oac s ILE 396 Cb -0.62 -3.42 0.03 0.00 0.01 0.00 0.00 42.46 38.46 1oac s ILE 396 CO 0.45 0.01 1.25 0.00 0.00 0.00 0.00 174.94 176.65 1oac s ALA 397 N 2.23 2.88 0.07 9.38 0.00 -1.26 -4.93 121.76 130.14 1oac s ALA 397 Ca 0.70 -1.02 -0.37 0.00 0.00 0.00 0.00 51.96 51.27 1oac s ALA 397 Cb -0.38 -4.13 -0.18 0.00 0.00 0.00 0.00 23.12 18.43 1oac s ALA 397 CO 0.31 -2.93 1.22 0.54 0.00 0.00 0.00 175.76 174.89 1oac n ARG 398 N 8.82 0.78 -0.02 0.00 1.74 -1.26 -1.46 116.66 125.27 1oac n ARG 398 Ca 0.07 0.28 0.00 0.00 -0.77 0.00 0.00 57.85 57.43 1oac n ARG 398 Cb 0.49 -1.85 0.00 0.00 -1.02 0.00 0.00 32.46 30.08 1oac n ARG 398 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1oac n GLY 399 N 2.14 2.45 0.87 -0.13 0.00 -0.82 -4.70 105.19 105.01 1oac n GLY 399 Ca 0.18 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.17 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 0.09 0.18 1.61 5.02 -0.73 -4.66 118.16 117.67 1oac n LYS 400 Ca 0.00 0.04 0.05 0.00 -2.02 0.00 0.00 58.31 56.38 1oac n LYS 400 Cb 0.00 -0.66 0.22 0.00 -0.02 0.00 0.00 35.03 34.57 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 -0.17 0.00 -5.11 4.39 3.32 -1.53 -3.45 116.42 113.87 1oac h ASP 401 Ca -0.05 0.00 -0.13 0.00 0.02 0.00 0.00 57.03 56.87 1oac h ASP 401 Cb 0.55 0.00 -0.17 0.00 0.22 0.00 0.00 39.33 39.92 1oac h ASP 401 CO -0.03 0.39 -0.58 0.00 -1.72 0.00 0.00 179.24 177.30 1oac s ALA 402 N -3.32 0.08 0.76 3.45 0.00 -1.25 -4.96 121.76 116.53 1oac s ALA 402 Ca 0.02 -0.70 -0.11 0.00 0.00 0.00 0.00 51.96 51.16 1oac s ALA 402 Cb 0.09 0.25 0.05 0.00 0.00 0.00 0.00 23.12 23.51 1oac s ALA 402 CO 0.70 -0.31 1.10 -1.25 0.00 0.00 0.00 175.76 176.00 1oac s PRO 403 N -2.78 2.26 0.64 0.00 0.04 -1.26 -1.94 135.00 131.96 1oac s PRO 403 Ca -0.04 1.25 0.29 0.00 0.04 0.00 0.00 61.00 62.54 1oac s PRO 403 Cb -0.00 -1.89 1.55 0.00 0.04 0.00 0.00 34.50 34.20 1oac s PRO 403 CO -0.06 -1.65 1.89 0.66 0.04 0.00 0.00 177.00 177.89 1oac h SER 404 N -0.96 0.00 -0.53 6.66 4.64 -1.87 -1.38 113.55 120.12 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 0.51 0.00 0.00 -0.46 -0.87 0.00 0.00 176.83 176.01 1oac n ASN 405 N -3.11 3.46 -4.85 4.97 6.94 -1.25 -4.90 115.26 116.51 1oac n ASN 405 Ca 0.01 -2.20 -0.32 0.00 -0.02 0.00 0.00 54.58 52.05 1oac n ASN 405 Cb 0.47 -0.45 -0.01 0.00 -2.36 0.00 0.00 39.78 37.43 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 -1.55 3.03 -0.20 -2.53 0.00 -0.52 -4.71 121.76 115.27 1oac s ALA 406 Ca 0.39 0.09 -0.07 0.00 0.00 0.00 0.00 51.96 52.36 1oac s ALA 406 Cb 0.23 -3.12 -0.04 0.00 0.00 0.00 0.00 23.12 20.20 1oac s ALA 406 CO 0.22 -0.52 0.06 0.08 0.00 0.00 0.00 175.76 175.60 1oac s VAL 407 N -2.85 4.55 -0.21 0.00 1.01 -0.28 -4.44 120.40 118.19 1oac s VAL 407 Ca 0.58 -0.11 -0.08 0.00 0.00 0.00 0.00 61.98 62.37 1oac s VAL 407 Cb -0.11 -3.08 -0.04 0.00 0.00 0.00 0.00 36.38 33.16 1oac s VAL 407 CO 0.42 0.42 0.07 -0.76 0.00 0.00 0.00 175.10 175.25 1oac s LEU 408 N 0.82 3.69 -0.11 3.92 1.43 -1.26 -0.71 118.68 126.45 1oac s LEU 408 Ca 0.03 -0.03 -0.06 0.00 -1.03 0.00 0.00 54.13 53.05 1oac s LEU 408 Cb -0.14 -1.96 -0.04 0.00 0.03 0.00 0.00 46.19 44.09 1oac s LEU 408 CO 0.02 0.09 0.10 -0.76 0.23 0.00 0.00 176.35 176.03 1oac s LEU 409 N 0.90 4.16 0.23 1.79 1.43 0.69 -4.78 118.68 123.11 1oac s LEU 409 Ca 0.04 0.38 -0.14 0.00 -1.03 0.00 0.00 54.13 53.37 1oac s LEU 409 Cb -0.14 -2.00 -0.08 0.00 0.03 0.00 0.00 46.19 44.00 1oac s LEU 409 CO 0.03 0.40 0.63 0.20 0.23 0.00 0.00 176.35 177.84 1oac s ASN 410 N -0.97 6.81 0.02 2.29 0.01 -1.26 -0.35 114.94 121.49 1oac s ASN 410 Ca 0.14 1.16 0.01 0.00 -0.71 0.00 0.00 52.86 53.46 1oac s ASN 410 Cb -0.12 -2.32 -0.02 0.00 0.41 0.00 0.00 41.25 39.20 1oac s ASN 410 CO 0.03 -0.04 -0.05 -1.61 -1.51 0.00 0.00 177.10 173.93 1oac s GLU 411 N -2.44 0.37 -0.13 -0.60 0.41 0.00 -4.92 118.70 111.39 1oac s GLU 411 Ca 0.45 -0.55 -0.00 0.00 -0.41 0.00 0.00 54.97 54.46 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 0.20 0.01 -0.12 0.99 -0.49 0.00 0.00 175.26 175.84 1oac s THR 412 N -1.14 3.13 0.26 3.63 2.01 -1.26 0.85 115.64 123.13 1oac s THR 412 Ca -0.10 -0.64 0.02 0.00 0.31 0.00 0.00 61.69 61.28 1oac s THR 412 Cb -0.08 -2.32 -0.05 0.00 0.01 0.00 0.00 72.50 70.06 1oac s THR 412 CO -0.00 0.52 0.08 0.27 -0.69 0.00 0.00 174.62 174.80 1oac s ILE 413 N 0.30 0.71 0.09 1.82 -4.36 -0.41 -4.89 121.20 114.46 1oac s ILE 413 Ca -0.09 -2.00 -0.16 0.00 -0.26 0.00 0.00 60.65 58.14 1oac s ILE 413 Cb -0.16 -2.61 -0.07 0.00 1.25 0.00 0.00 42.46 40.88 1oac s ILE 413 CO 0.05 -0.06 0.53 0.00 0.24 0.00 0.00 174.94 175.70 1oac s ALA 414 N -3.64 3.61 0.84 2.27 0.00 -1.26 0.79 121.76 124.36 1oac s ALA 414 Ca 0.36 -0.10 -0.07 0.00 0.00 0.00 0.00 51.96 52.16 1oac s ALA 414 Cb 0.08 -2.53 0.15 0.00 0.00 0.00 0.00 23.12 20.82 1oac s ALA 414 CO 0.13 0.44 0.93 -0.40 0.00 0.00 0.00 175.76 176.87 1oac n ASP 415 N 1.32 0.58 0.15 0.00 5.68 0.14 -4.85 116.55 119.57 1oac n ASP 415 Ca -0.09 -1.65 0.11 0.00 -0.50 0.00 0.00 54.79 52.67 1oac n ASP 415 Cb 0.52 -0.67 0.53 0.00 -1.14 0.00 0.00 41.12 40.36 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 -3.02 0.78 0.99 2.11 4.11 -1.26 -0.92 117.16 119.95 1oac n TYR 416 Ca 0.13 0.35 0.12 0.00 -0.00 0.00 0.00 57.90 58.50 1oac n TYR 416 Cb 0.47 -1.06 0.26 0.00 -0.00 0.00 0.00 39.34 39.00 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 -2.25 0.13 -0.85 -3.48 -2.24 -1.26 0.76 114.28 105.10 1oac n THR 417 Ca 0.00 -0.48 0.00 0.00 -2.27 0.00 0.00 64.05 61.31 1oac n THR 417 Cb 0.14 1.02 0.00 0.00 -2.10 0.00 0.00 70.33 69.39 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 1.32 0.55 3.80 3.38 0.00 -0.10 -4.92 105.19 109.21 1oac n GLY 418 Ca 0.17 -0.27 -0.37 0.00 0.00 0.00 0.00 46.02 45.55 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 5.36 0.34 1.61 1.01 -1.26 -4.65 120.40 120.82 1oac s VAL 419 Ca 0.00 0.39 -0.29 0.00 0.00 0.00 0.00 61.98 62.08 1oac s VAL 419 Cb 0.00 -3.52 -0.11 0.00 0.00 0.00 0.00 36.38 32.74 1oac s VAL 419 CO 0.00 0.52 1.51 -2.65 0.00 0.00 0.00 175.10 174.48 1oac n PRO 420 N 2.69 2.63 -3.98 2.72 -0.02 -1.26 0.28 135.00 138.06 1oac n PRO 420 Ca -0.16 0.93 -0.27 0.00 -2.02 0.00 0.00 63.50 61.98 1oac n PRO 420 Cb 0.53 -2.66 -0.17 0.00 -0.02 0.00 0.00 33.50 31.18 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 -1.49 1.60 -0.17 -0.52 1.75 0.24 -4.79 119.30 115.91 1oac s MET 421 Ca 0.57 -0.29 -0.19 0.00 -1.25 0.00 0.00 55.69 54.54 1oac s MET 421 Cb -0.49 -1.60 -0.03 0.00 2.84 0.00 0.00 34.83 35.54 1oac s MET 421 CO 0.58 -0.24 0.53 -2.00 -0.65 0.00 0.00 175.02 173.24 1oac s GLU 422 N 1.59 4.25 -0.26 4.11 2.12 -1.26 -1.29 118.70 127.95 1oac s GLU 422 Ca 0.03 0.47 -0.09 0.00 0.36 0.00 0.00 54.97 55.74 1oac s GLU 422 Cb -0.13 -3.52 -0.04 0.00 0.26 0.00 0.00 34.13 30.70 1oac s GLU 422 CO -0.07 -0.06 0.14 0.42 -0.54 0.00 0.00 175.26 175.15 1oac s ILE 423 N 1.33 4.91 0.31 -3.70 1.01 0.25 -4.92 121.20 120.38 1oac s ILE 423 Ca 0.26 0.03 -0.27 0.00 0.00 0.00 0.00 60.65 60.67 1oac s ILE 423 Cb -0.15 -3.32 -0.10 0.00 0.01 0.00 0.00 42.46 38.90 1oac s ILE 423 CO 0.10 0.30 0.97 -2.16 0.00 0.00 0.00 174.94 174.15 1oac s PRO 424 N 1.62 4.60 -1.45 2.79 0.04 -1.26 -0.82 135.00 140.52 1oac s PRO 424 Ca 0.07 1.42 -0.04 0.00 0.04 0.00 0.00 61.00 62.49 1oac s PRO 424 Cb -0.15 -2.91 0.03 0.00 0.04 0.00 0.00 34.50 31.51 1oac s PRO 424 CO 0.07 0.28 0.57 0.54 0.04 0.00 0.00 177.00 178.50 1oac n ARG 425 N 0.74 -3.75 0.06 4.56 1.74 -1.23 -4.42 116.66 114.36 1oac n ARG 425 Ca 0.01 0.45 -0.19 0.00 -0.77 0.00 0.00 57.85 57.35 1oac n ARG 425 Cb 0.49 -4.80 -0.10 0.00 -1.02 0.00 0.00 32.46 27.03 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 0.87 0.15 -3.89 7.54 0.00 -0.82 0.28 119.26 123.39 1oac h ALA 426 Ca -0.62 -0.72 -0.44 0.00 0.00 0.00 0.00 54.91 53.14 1oac h ALA 426 Cb 1.37 0.05 -0.26 0.00 0.00 0.00 0.00 17.79 18.95 1oac h ALA 426 CO 0.64 0.72 -0.79 0.42 0.00 0.00 0.00 179.25 180.24 1oac s ILE 427 N -3.24 1.03 -0.10 0.00 1.01 -0.98 -4.48 121.20 114.44 1oac s ILE 427 Ca -0.09 -0.81 0.01 0.00 0.00 0.00 0.00 60.65 59.76 1oac s ILE 427 Cb 0.07 -0.91 -0.02 0.00 0.01 0.00 0.00 42.46 41.61 1oac s ILE 427 CO 0.91 0.10 -0.13 0.00 0.00 0.00 0.00 174.94 175.82 1oac s ALA 428 N -0.64 2.65 -0.12 9.38 0.00 -0.03 -0.22 121.76 132.78 1oac s ALA 428 Ca 0.02 -0.91 0.02 0.00 0.00 0.00 0.00 51.96 51.09 1oac s ALA 428 Cb -0.07 -1.15 -0.01 0.00 0.00 0.00 0.00 23.12 21.90 1oac s ALA 428 CO 0.01 0.35 -0.18 0.08 0.00 0.00 0.00 175.76 176.02 1oac s VAL 429 N -0.02 2.60 -0.03 0.00 1.01 0.11 -0.42 120.40 123.64 1oac s VAL 429 Ca -0.03 -0.82 -0.26 0.00 0.00 0.00 0.00 61.98 60.87 1oac s VAL 429 Cb -0.14 -2.05 0.06 0.00 0.00 0.00 0.00 36.38 34.24 1oac s VAL 429 CO 0.04 0.54 0.56 0.72 0.00 0.00 0.00 175.10 176.96 1oac s PHE 430 N 0.39 -0.51 0.01 5.22 -0.71 -0.18 -1.12 117.98 121.08 1oac s PHE 430 Ca -0.14 0.84 -0.02 0.00 -1.04 0.00 0.00 56.93 56.58 1oac s PHE 430 Cb -0.17 0.31 -0.04 0.00 -1.21 0.00 0.00 43.02 41.92 1oac s PHE 430 CO 0.06 -0.55 0.18 -2.00 -1.34 0.00 0.00 175.22 171.58 1oac s GLU 431 N -1.29 3.42 0.02 1.99 2.12 -1.26 -0.57 118.70 123.13 1oac s GLU 431 Ca -0.12 -0.36 -0.04 0.00 0.36 0.00 0.00 54.97 54.81 1oac s GLU 431 Cb -0.02 -3.07 -0.01 0.00 0.26 0.00 0.00 34.13 31.29 1oac s GLU 431 CO 0.08 0.66 0.05 -0.98 -0.54 0.00 0.00 175.26 174.52 1oac s ARG 432 N -2.09 0.44 0.09 4.30 1.70 -0.08 -4.98 118.95 118.33 1oac s ARG 432 Ca 0.29 -0.60 -0.31 0.00 -0.47 0.00 0.00 55.73 54.64 1oac s ARG 432 Cb -0.13 0.17 -0.06 0.00 -0.57 0.00 0.00 34.95 34.36 1oac s ARG 432 CO 0.21 -0.09 1.21 -0.47 -1.08 0.00 0.00 175.30 175.07 1oac s TYR 433 N -1.81 3.43 -0.29 5.89 5.04 -1.26 -0.41 117.35 127.95 1oac s TYR 433 Ca -0.12 1.31 0.16 0.00 -2.44 0.00 0.00 57.07 55.97 1oac s TYR 433 Cb -0.06 -3.43 0.48 0.00 0.35 0.00 0.00 41.96 39.30 1oac s TYR 433 CO -0.01 -1.31 1.13 0.00 -1.34 0.00 0.00 175.55 174.02 1oac n ALA 434 N 3.64 3.70 0.00 3.97 0.00 0.17 -4.90 120.51 127.09 1oac n ALA 434 Ca 0.08 -3.26 0.00 0.00 0.00 0.00 0.00 53.44 50.26 1oac n ALA 434 Cb 0.46 -0.65 0.00 0.00 0.00 0.00 0.00 19.45 19.26 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 -2.17 3.75 0.00 0.00 -1.26 -4.74 105.19 100.16 1oac n GLY 435 Ca 0.23 -1.51 -0.41 0.00 0.00 0.00 0.00 46.02 44.33 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 -0.27 4.47 0.13 1.61 0.04 -1.26 -0.57 135.00 139.15 1oac s PRO 436 Ca 0.00 1.98 -0.13 0.00 0.04 0.00 0.00 61.00 62.89 1oac s PRO 436 Cb 0.00 -3.18 -0.03 0.00 0.04 0.00 0.00 34.50 31.33 1oac s PRO 436 CO 0.00 -0.09 1.52 1.49 0.04 0.00 0.00 177.00 179.96 1oac h GLU 437 N 4.59 0.80 -2.75 4.56 4.57 -0.92 -3.42 114.58 122.01 1oac h GLU 437 Ca -0.46 -0.32 0.03 0.00 -1.18 0.00 0.00 59.36 57.43 1oac h GLU 437 Cb 1.22 -0.04 -0.13 0.00 -0.16 0.00 0.00 28.75 29.64 1oac h GLU 437 CO 0.72 0.95 0.31 1.52 -1.18 0.00 0.00 179.01 181.32 1oac s TYR 438 N -4.73 -0.45 -0.13 0.92 -0.85 -1.25 -4.97 117.35 105.90 1oac s TYR 438 Ca -0.12 0.25 -0.24 0.00 -0.52 0.00 0.00 57.07 56.44 1oac s TYR 438 Cb 0.10 0.56 0.06 0.00 0.38 0.00 0.00 41.96 43.06 1oac s TYR 438 CO 0.83 -0.77 0.60 0.21 -1.52 0.00 0.00 175.55 174.89 1oac s LYS 439 N -3.54 0.85 -0.23 -3.49 2.20 -1.26 -2.30 119.74 111.96 1oac s LYS 439 Ca 0.03 0.46 -0.06 0.00 -0.36 0.00 0.00 55.97 56.04 1oac s LYS 439 Cb -0.01 0.40 0.12 0.00 -1.51 0.00 0.00 37.83 36.83 1oac s LYS 439 CO -0.10 -0.20 0.46 -1.58 -0.36 0.00 0.00 175.35 173.56 1oac s HIS 440 N -0.53 -0.95 -0.93 4.03 2.46 0.80 -5.00 115.29 115.17 1oac s HIS 440 Ca -0.06 1.49 -0.08 0.00 0.47 0.00 0.00 55.06 56.87 1oac s HIS 440 Cb -0.03 0.33 0.24 0.00 -0.13 0.00 0.00 32.58 32.99 1oac s HIS 440 CO 0.05 -0.60 0.86 -1.14 -2.47 0.00 0.00 174.74 171.44 1oac s GLN 441 N 2.66 3.64 0.08 2.88 2.00 -1.26 -1.73 119.66 127.92 1oac s GLN 441 Ca 0.03 -2.93 -0.31 0.00 -2.00 0.00 0.00 55.36 50.15 1oac s GLN 441 Cb -0.13 -4.30 -0.07 0.00 0.80 0.00 0.00 33.01 29.31 1oac s GLN 441 CO -0.15 -1.25 1.40 -2.00 -0.50 0.00 0.00 175.29 172.79 1oac s GLU 442 N -0.72 4.31 0.08 1.67 2.56 -1.26 -4.91 118.70 120.42 1oac s GLU 442 Ca 0.25 2.04 -0.34 0.00 0.00 0.00 0.00 54.97 56.92 1oac s GLU 442 Cb -0.11 -3.36 -0.14 0.00 2.00 0.00 0.00 34.13 32.52 1oac s GLU 442 CO -0.09 -0.48 1.63 -0.12 -0.56 0.00 0.00 175.26 175.64 1oac n MET 443 N 4.45 2.03 -1.02 4.30 0.00 -1.26 -1.16 117.12 124.45 1oac n MET 443 Ca 0.12 0.73 -0.01 0.00 -0.00 0.00 0.00 57.70 58.55 1oac n MET 443 Cb 0.43 -2.51 -0.00 0.00 0.00 0.00 0.00 33.22 31.14 1oac n MET 443 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1oac n GLY 444 N 3.58 0.41 3.51 -5.12 0.00 -1.26 -5.01 105.19 101.30 1oac n GLY 444 Ca 0.19 -0.09 -0.25 0.00 0.00 0.00 0.00 46.02 45.87 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 -0.81 1.75 0.52 1.61 -1.52 -0.31 -5.12 119.66 115.78 1oac s GLN 445 Ca 0.00 -1.86 -0.22 0.00 -1.95 0.00 0.00 55.36 51.33 1oac s GLN 445 Cb 0.00 -1.70 -0.06 0.00 -0.22 0.00 0.00 33.01 31.03 1oac s GLN 445 CO 0.00 0.21 1.24 -1.25 -0.25 0.00 0.00 175.29 175.24 1oac s PRO 446 N -3.58 3.39 0.51 2.91 0.05 -1.26 -4.65 135.00 132.37 1oac s PRO 446 Ca 0.31 1.95 -0.21 0.00 0.05 0.00 0.00 61.00 63.10 1oac s PRO 446 Cb -0.00 -2.26 -0.06 0.00 0.05 0.00 0.00 34.50 32.23 1oac s PRO 446 CO 0.16 -0.91 1.20 1.21 0.05 0.00 0.00 177.00 178.71 1oac s ASN 447 N -1.26 5.78 -0.21 6.66 3.84 -1.26 -4.59 114.94 123.91 1oac s ASN 447 Ca 0.69 2.38 0.01 0.00 0.21 0.00 0.00 52.86 56.15 1oac s ASN 447 Cb -0.33 -2.60 0.04 0.00 -0.55 0.00 0.00 41.25 37.81 1oac s ASN 447 CO 0.39 -1.19 -0.12 -0.69 -2.79 0.00 0.00 177.10 172.70 1oac s VAL 448 N -1.55 1.80 -0.03 -5.21 1.01 -0.71 -5.02 120.40 110.70 1oac s VAL 448 Ca 0.69 -1.10 -0.07 0.00 0.00 0.00 0.00 61.98 61.49 1oac s VAL 448 Cb -0.30 -1.83 0.01 0.00 0.00 0.00 0.00 36.38 34.25 1oac s VAL 448 CO 0.35 0.20 0.16 -0.44 0.00 0.00 0.00 175.10 175.37 1oac s SER 449 N 1.33 -0.07 0.03 3.32 0.01 -1.26 -0.14 113.70 116.92 1oac s SER 449 Ca -0.02 0.04 0.02 0.00 1.31 0.00 0.00 55.95 57.30 1oac s SER 449 Cb -0.16 0.28 -0.02 0.00 0.21 0.00 0.00 66.02 66.32 1oac s SER 449 CO -0.08 -0.24 -0.06 0.42 0.41 0.00 0.00 173.24 173.68 1oac s THR 450 N -0.76 0.42 0.36 1.44 -4.23 -0.97 -5.02 115.64 106.86 1oac s THR 450 Ca -0.09 -0.97 -0.15 0.00 -1.18 0.00 0.00 61.69 59.31 1oac s THR 450 Cb -0.05 -0.50 -0.09 0.00 1.34 0.00 0.00 72.50 73.21 1oac s THR 450 CO 0.01 -0.37 0.78 -1.83 -0.54 0.00 0.00 174.62 172.67 1oac s GLU 451 N -1.43 4.01 -0.17 3.99 -1.05 -1.26 -0.42 118.70 122.37 1oac s GLU 451 Ca -0.11 0.73 -0.09 0.00 -0.15 0.00 0.00 54.97 55.35 1oac s GLU 451 Cb -0.09 -2.38 -0.05 0.00 -0.44 0.00 0.00 34.13 31.18 1oac s GLU 451 CO 0.00 0.09 0.11 0.50 0.95 0.00 0.00 175.26 176.91 1oac s ARG 452 N -3.15 3.94 -0.05 -4.83 3.52 0.27 -4.26 118.95 114.38 1oac s ARG 452 Ca 0.55 -0.23 0.06 0.00 -0.13 0.00 0.00 55.73 55.99 1oac s ARG 452 Cb -0.10 -3.31 -0.01 0.00 -1.56 0.00 0.00 34.95 29.97 1oac s ARG 452 CO 0.19 0.42 -0.25 1.03 -0.81 0.00 0.00 175.30 175.88 1oac s ARG 453 N -0.00 2.51 -0.02 5.12 1.81 -1.26 -0.65 118.95 126.46 1oac s ARG 453 Ca 0.09 -0.91 0.08 0.00 -1.72 0.00 0.00 55.73 53.27 1oac s ARG 453 Cb -0.11 -2.15 -0.02 0.00 -0.45 0.00 0.00 34.95 32.22 1oac s ARG 453 CO -0.00 0.40 -0.26 -1.21 -0.68 0.00 0.00 175.30 173.55 1oac s GLU 454 N -0.20 2.08 -0.29 3.54 2.02 0.45 -3.90 118.70 122.41 1oac s GLU 454 Ca -0.02 -0.93 -0.11 0.00 0.02 0.00 0.00 54.97 53.93 1oac s GLU 454 Cb -0.13 -2.02 -0.04 0.00 0.10 0.00 0.00 34.13 32.03 1oac s GLU 454 CO 0.03 0.55 0.19 -1.17 0.02 0.00 0.00 175.26 174.89 1oac s LEU 455 N -0.63 4.06 -0.14 1.80 2.96 -0.08 -0.90 118.68 125.74 1oac s LEU 455 Ca 0.10 -0.08 -0.04 0.00 -0.22 0.00 0.00 54.13 53.89 1oac s LEU 455 Cb -0.10 -2.11 -0.03 0.00 0.50 0.00 0.00 46.19 44.45 1oac s LEU 455 CO -0.01 -0.07 -0.00 -0.69 -1.32 0.00 0.00 176.35 174.26 1oac s VAL 456 N 1.75 4.23 -0.36 1.68 1.01 0.27 -0.60 120.40 128.38 1oac s VAL 456 Ca 0.07 -0.25 -0.05 0.00 0.00 0.00 0.00 61.98 61.75 1oac s VAL 456 Cb -0.16 -2.85 0.07 0.00 0.00 0.00 0.00 36.38 33.44 1oac s VAL 456 CO 0.11 0.52 0.13 -0.69 0.00 0.00 0.00 175.10 175.17 1oac s VAL 457 N 0.02 3.58 -0.08 2.92 1.01 -0.11 -1.01 120.40 126.72 1oac s VAL 457 Ca 0.02 -1.45 0.02 0.00 0.00 0.00 0.00 61.98 60.58 1oac s VAL 457 Cb -0.13 -3.16 -0.02 0.00 0.00 0.00 0.00 36.38 33.07 1oac s VAL 457 CO 0.02 -0.34 -0.13 -0.60 0.00 0.00 0.00 175.10 174.05 1oac s ARG 458 N 1.32 2.87 -0.01 2.72 3.52 0.43 -1.11 118.95 128.69 1oac s ARG 458 Ca 0.01 -0.67 0.01 0.00 -0.13 0.00 0.00 55.73 54.94 1oac s ARG 458 Cb -0.21 -2.50 0.00 0.00 -1.56 0.00 0.00 34.95 30.68 1oac s ARG 458 CO 0.00 0.47 -0.04 -0.46 -0.81 0.00 0.00 175.30 174.47 1oac s TRP 459 N -0.33 0.41 -0.06 5.12 -0.00 -0.22 -0.85 118.94 123.01 1oac s TRP 459 Ca 0.03 -0.07 0.06 0.00 -0.00 0.00 0.00 56.10 56.11 1oac s TRP 459 Cb -0.13 -0.31 -0.01 0.00 -0.00 0.00 0.00 33.47 33.02 1oac s TRP 459 CO 0.02 -0.04 -0.23 0.42 -0.00 0.00 0.00 176.95 177.12 1oac s ILE 460 N 0.15 2.20 -0.05 5.86 1.01 -1.26 -0.28 121.20 128.83 1oac s ILE 460 Ca -0.01 -1.01 0.01 0.00 0.00 0.00 0.00 60.65 59.64 1oac s ILE 460 Cb -0.05 -1.81 0.02 0.00 0.01 0.00 0.00 42.46 40.63 1oac s ILE 460 CO -0.00 0.57 -0.07 -0.55 0.00 0.00 0.00 174.94 174.89 1oac s SER 461 N -0.19 1.20 -0.25 3.58 0.15 0.04 -0.68 113.70 117.55 1oac s SER 461 Ca -0.02 -0.18 -0.03 0.00 0.70 0.00 0.00 55.95 56.42 1oac s SER 461 Cb -0.14 -0.56 0.02 0.00 -1.71 0.00 0.00 66.02 63.63 1oac s SER 461 CO 0.03 -0.03 -0.03 -0.89 1.20 0.00 0.00 173.24 173.52 1oac s THR 462 N 0.84 3.13 -0.39 6.45 2.01 -1.08 -0.58 115.64 126.02 1oac s THR 462 Ca -0.12 -0.91 0.00 0.00 0.31 0.00 0.00 61.69 60.97 1oac s THR 462 Cb -0.15 -2.58 0.11 0.00 0.01 0.00 0.00 72.50 69.89 1oac s THR 462 CO 0.01 0.20 0.15 -0.69 -0.69 0.00 0.00 174.62 173.60 1oac s VAL 463 N 1.37 2.83 0.00 3.82 1.01 -1.26 -4.85 120.40 123.33 1oac s VAL 463 Ca 0.01 -2.28 0.00 0.00 0.00 0.00 0.00 61.98 59.71 1oac s VAL 463 Cb -0.16 -2.99 0.00 0.00 0.00 0.00 0.00 36.38 33.22 1oac s VAL 463 CO -0.03 -0.66 0.00 0.61 0.00 0.00 0.00 175.10 175.02 1oac n GLY 464 N 4.33 2.04 0.82 4.51 0.00 -1.26 -4.80 105.19 110.83 1oac n GLY 464 Ca 0.01 0.02 0.01 0.00 0.00 0.00 0.00 46.02 46.06 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 10.45 2.06 -3.65 1.61 2.04 -1.26 -5.02 115.26 121.50 1oac n ASN 465 Ca 0.00 -2.20 0.01 0.00 -0.44 0.00 0.00 54.58 51.95 1oac n ASN 465 Cb 0.00 -0.54 -0.06 0.00 -2.53 0.00 0.00 39.78 36.65 1oac n ASN 465 CO 0.00 0.00 0.00 -1.81 -0.44 0.00 0.00 177.26 175.01 1oac s ASP 467 N -0.08 -0.19 -0.05 0.53 1.11 -0.65 -0.33 116.67 117.01 1oac s ASP 467 Ca 0.11 0.30 0.06 0.00 0.18 0.00 0.00 52.55 53.20 1oac s ASP 467 Cb 0.08 1.04 -0.01 0.00 1.07 0.00 0.00 42.92 45.10 1oac s ASP 467 CO 0.03 -0.05 -0.24 -0.31 1.18 0.00 0.00 175.17 175.78 1oac s TYR 468 N 1.08 2.36 -0.12 4.23 2.02 0.26 -1.34 117.35 125.83 1oac s TYR 468 Ca -0.08 -0.67 0.02 0.00 -0.37 0.00 0.00 57.07 55.97 1oac s TYR 468 Cb -0.03 -1.55 -0.01 0.00 -0.40 0.00 0.00 41.96 39.98 1oac s TYR 468 CO -0.11 -0.19 -0.18 0.42 -1.57 0.00 0.00 175.55 173.92 1oac s ILE 469 N -0.20 2.63 -0.09 2.71 1.01 0.18 -0.78 121.20 126.64 1oac s ILE 469 Ca -0.02 -0.81 0.04 0.00 0.00 0.00 0.00 60.65 59.86 1oac s ILE 469 Cb -0.13 -2.07 0.00 0.00 0.01 0.00 0.00 42.46 40.27 1oac s ILE 469 CO 0.03 0.54 -0.23 -0.36 0.00 0.00 0.00 174.94 174.91 1oac s PHE 470 N 0.38 2.48 -0.12 3.97 0.40 0.61 -0.21 117.98 125.48 1oac s PHE 470 Ca -0.14 -0.99 0.02 0.00 -0.60 0.00 0.00 56.93 55.22 1oac s PHE 470 Cb -0.17 -1.66 -0.01 0.00 0.51 0.00 0.00 43.02 41.70 1oac s PHE 470 CO 0.07 -0.39 -0.18 -0.51 0.70 0.00 0.00 175.22 174.90 1oac s ASP 471 N 0.32 3.60 -0.29 1.36 1.01 -0.30 -1.05 116.67 121.31 1oac s ASP 471 Ca -0.18 -0.44 -0.09 0.00 0.71 0.00 0.00 52.55 52.56 1oac s ASP 471 Cb -0.18 -1.52 -0.01 0.00 1.01 0.00 0.00 42.92 42.22 1oac s ASP 471 CO 0.08 0.15 0.12 0.26 0.21 0.00 0.00 175.17 176.00 1oac s TRP 472 N 0.41 3.15 -0.21 4.23 0.52 -0.26 -1.15 118.94 125.63 1oac s TRP 472 Ca -0.13 -0.58 -0.00 0.00 0.02 0.00 0.00 56.10 55.41 1oac s TRP 472 Cb -0.17 -2.32 0.02 0.00 -1.15 0.00 0.00 33.47 29.86 1oac s TRP 472 CO 0.06 -0.44 -0.13 0.42 0.02 0.00 0.00 176.95 176.88 1oac s ILE 473 N 1.60 2.46 -0.25 2.03 1.01 0.14 -0.93 121.20 127.25 1oac s ILE 473 Ca 0.05 -0.98 -0.11 0.00 0.00 0.00 0.00 60.65 59.61 1oac s ILE 473 Cb -0.17 -2.15 -0.05 0.00 0.01 0.00 0.00 42.46 40.10 1oac s ILE 473 CO 0.05 0.37 0.17 -0.36 0.00 0.00 0.00 174.94 175.17 1oac s PHE 474 N 1.30 3.27 -0.05 3.97 0.40 0.23 -0.23 117.98 126.88 1oac s PHE 474 Ca 0.02 0.17 -0.04 0.00 -0.60 0.00 0.00 56.93 56.48 1oac s PHE 474 Cb -0.15 -2.31 -0.04 0.00 0.51 0.00 0.00 43.02 41.04 1oac s PHE 474 CO -0.09 -0.03 0.16 -1.01 0.70 0.00 0.00 175.22 174.96 1oac s HIS 475 N 1.32 3.55 0.47 0.36 3.76 -0.14 -0.90 115.29 123.71 1oac s HIS 475 Ca 0.07 0.41 0.14 0.00 -0.15 0.00 0.00 55.06 55.53 1oac s HIS 475 Cb -0.14 -1.86 1.08 0.00 1.11 0.00 0.00 32.58 32.76 1oac s HIS 475 CO 0.07 0.67 2.05 1.49 -0.85 0.00 0.00 174.74 178.17 1oac h GLU 476 N 4.23 0.04 -0.53 1.40 4.81 -1.85 -2.08 114.58 120.60 1oac h GLU 476 Ca -0.51 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 58.71 1oac h GLU 476 Cb 1.20 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.57 1oac h GLU 476 CO 0.65 0.14 0.00 0.27 -0.73 0.00 0.00 179.01 179.34 1oac n ASN 477 N -4.41 1.25 0.00 1.04 2.04 -1.26 -4.86 115.26 109.06 1oac n ASN 477 Ca -0.02 -2.08 0.00 0.00 -0.44 0.00 0.00 54.58 52.04 1oac n ASN 477 Cb 0.18 -0.31 0.00 0.00 -2.53 0.00 0.00 39.78 37.12 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 0.40 2.52 3.78 4.83 0.00 -0.78 -4.80 105.19 111.13 1oac n GLY 478 Ca 0.04 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.70 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 -2.67 3.45 -0.08 2.61 2.01 -1.26 -4.38 115.64 115.32 1oac s THR 479 Ca 0.00 1.07 0.02 0.00 0.31 0.00 0.00 61.69 63.09 1oac s THR 479 Cb 0.00 -3.53 0.01 0.00 0.01 0.00 0.00 72.50 68.99 1oac s THR 479 CO 0.00 -0.04 -0.15 -0.63 -0.69 0.00 0.00 174.62 173.11 1oac s ILE 480 N -1.65 1.41 0.09 1.82 1.01 -0.42 -0.96 121.20 122.50 1oac s ILE 480 Ca 0.62 -0.62 0.08 0.00 0.00 0.00 0.00 60.65 60.73 1oac s ILE 480 Cb -0.24 -1.27 -0.04 0.00 0.01 0.00 0.00 42.46 40.92 1oac s ILE 480 CO 0.30 0.42 -0.19 -0.83 0.00 0.00 0.00 174.94 174.64 1oac s GLY 481 N 0.71 1.64 -0.20 6.18 0.00 0.68 -0.41 107.32 115.92 1oac s GLY 481 Ca -0.13 -1.30 -0.03 0.00 0.00 0.00 0.00 44.72 43.26 1oac s GLY 481 CO 0.03 -1.25 0.05 -0.42 0.00 0.00 0.00 173.10 171.51 1oac s ILE 482 N -1.06 0.39 0.11 0.90 1.01 -0.96 0.23 121.20 121.82 1oac s ILE 482 Ca 0.16 -0.52 0.07 0.00 0.00 0.00 0.00 60.65 60.37 1oac s ILE 482 Cb -0.10 -0.96 -0.04 0.00 0.01 0.00 0.00 42.46 41.36 1oac s ILE 482 CO 0.08 -0.26 -0.11 -1.81 0.00 0.00 0.00 174.94 172.84 1oac s ASP 483 N 1.91 4.32 -0.06 3.58 1.01 -0.30 -1.34 116.67 125.80 1oac s ASP 483 Ca 0.00 -0.42 0.01 0.00 0.71 0.00 0.00 52.55 52.85 1oac s ASP 483 Cb -0.17 -0.79 0.02 0.00 1.01 0.00 0.00 42.92 42.99 1oac s ASP 483 CO -0.10 0.17 -0.07 0.00 0.21 0.00 0.00 175.17 175.38 1oac s ALA 484 N -1.25 0.91 0.18 5.23 0.00 -0.80 -1.15 121.76 124.88 1oac s ALA 484 Ca 0.21 -0.21 0.11 0.00 0.00 0.00 0.00 51.96 52.08 1oac s ALA 484 Cb -0.11 -0.51 -0.04 0.00 0.00 0.00 0.00 23.12 22.46 1oac s ALA 484 CO 0.13 -0.01 -0.24 0.20 0.00 0.00 0.00 175.76 175.84 1oac s GLY 485 N 0.92 1.68 -0.02 0.00 0.00 0.71 -1.08 107.32 109.52 1oac s GLY 485 Ca -0.11 -1.59 0.01 0.00 0.00 0.00 0.00 44.72 43.03 1oac s GLY 485 CO 0.01 -1.61 -0.04 0.00 0.00 0.00 0.00 173.10 171.46 1oac s ALA 486 N -1.52 0.51 0.18 3.20 0.00 -0.39 -0.65 121.76 123.09 1oac s ALA 486 Ca 0.19 -0.08 -0.02 0.00 0.00 0.00 0.00 51.96 52.05 1oac s ALA 486 Cb -0.08 -0.27 0.01 0.00 0.00 0.00 0.00 23.12 22.77 1oac s ALA 486 CO 0.09 0.03 0.28 -2.37 0.00 0.00 0.00 175.76 173.79 1oac n THR 487 N 3.61 0.00 0.00 0.00 5.66 -0.45 -1.19 114.28 121.91 1oac n THR 487 Ca -0.21 -0.82 0.00 0.00 -3.05 0.00 0.00 64.05 59.97 1oac n THR 487 Cb 0.54 0.54 0.00 0.00 -1.55 0.00 0.00 70.33 69.86 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 -0.29 -0.05 3.53 1.09 0.00 -1.25 -1.64 105.19 106.58 1oac n GLY 488 Ca -0.01 -2.17 -0.33 0.00 0.00 0.00 0.00 46.02 43.51 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 3.47 0.45 -0.61 -1.09 0.55 -1.29 121.20 122.68 1oac s ILE 489 Ca 0.00 -0.56 -0.21 0.00 -2.23 0.00 0.00 60.65 57.65 1oac s ILE 489 Cb 0.00 -2.41 -0.09 0.00 -1.58 0.00 0.00 42.46 38.37 1oac s ILE 489 CO 0.00 0.58 1.02 -1.61 -1.23 0.00 0.00 174.94 173.70 1oac s GLU 490 N -0.61 3.98 -0.44 2.79 2.02 -1.26 -4.76 118.70 120.43 1oac s GLU 490 Ca 0.09 1.33 -0.27 0.00 0.02 0.00 0.00 54.97 56.14 1oac s GLU 490 Cb -0.11 -2.21 0.03 0.00 0.10 0.00 0.00 34.13 31.93 1oac s GLU 490 CO 0.02 -0.27 1.03 0.00 0.02 0.00 0.00 175.26 176.05 1oac s ALA 491 N -1.96 3.26 0.21 5.21 0.00 -1.26 -4.93 121.76 122.30 1oac s ALA 491 Ca 0.64 -0.53 0.08 0.00 0.00 0.00 0.00 51.96 52.15 1oac s ALA 491 Cb -0.16 -3.73 -0.04 0.00 0.00 0.00 0.00 23.12 19.19 1oac s ALA 491 CO 0.20 -2.01 0.02 0.14 0.00 0.00 0.00 175.76 174.11 1oac s VAL 492 N 4.00 3.73 -0.13 0.00 -7.23 -1.26 -3.81 120.40 115.69 1oac s VAL 492 Ca 0.43 -1.58 -0.01 0.00 -1.81 0.00 0.00 61.98 59.00 1oac s VAL 492 Cb -0.09 -2.93 -0.02 0.00 0.56 0.00 0.00 36.38 33.89 1oac s VAL 492 CO 0.26 -0.23 -0.09 -0.75 -0.31 0.00 0.00 175.10 173.99 1oac s LYS 493 N -3.29 3.38 0.15 4.82 2.20 -0.51 -4.86 119.74 121.63 1oac s LYS 493 Ca 0.29 -0.60 -0.30 0.00 -0.36 0.00 0.00 55.97 55.00 1oac s LYS 493 Cb -0.08 -2.73 -0.07 0.00 -1.51 0.00 0.00 37.83 33.44 1oac s LYS 493 CO 0.20 0.30 1.19 0.20 -0.36 0.00 0.00 175.35 176.88 1oac s GLY 494 N 0.15 2.61 0.08 5.54 0.00 -1.26 -1.57 107.32 112.86 1oac s GLY 494 Ca -0.04 0.92 -0.03 0.00 0.00 0.00 0.00 44.72 45.56 1oac s GLY 494 CO 0.04 1.89 0.05 -1.34 0.00 0.00 0.00 173.10 173.74 1oac s VAL 495 N 0.22 0.18 0.06 1.40 -7.23 -0.49 -4.88 120.40 109.65 1oac s VAL 495 Ca 0.54 -1.66 0.09 0.00 -1.81 0.00 0.00 61.98 59.14 1oac s VAL 495 Cb -0.32 -1.58 -0.16 0.00 0.56 0.00 0.00 36.38 34.89 1oac s VAL 495 CO 0.34 -0.80 1.26 0.11 -0.31 0.00 0.00 175.10 175.70 1oac h LYS 496 N 2.98 0.00 -6.81 4.82 1.57 -1.93 -3.40 116.57 113.80 1oac h LYS 496 Ca -0.34 0.00 -0.52 0.00 -1.87 0.00 0.00 60.65 57.92 1oac h LYS 496 Cb 1.17 0.00 0.06 0.00 0.08 0.00 0.00 32.23 33.53 1oac h LYS 496 CO 0.62 0.87 0.67 0.00 -0.57 0.00 0.00 179.45 181.04 1oac s ALA 497 N -2.75 3.53 -0.15 3.86 0.00 -1.26 -4.78 121.76 120.21 1oac s ALA 497 Ca 0.01 1.25 -0.12 0.00 0.00 0.00 0.00 51.96 53.09 1oac s ALA 497 Cb 0.09 -3.50 -0.23 0.00 0.00 0.00 0.00 23.12 19.48 1oac s ALA 497 CO 0.81 -0.64 0.30 1.63 0.00 0.00 0.00 175.76 177.86 1oac n LYS 498 N 1.52 0.69 -4.33 0.00 5.02 -1.26 -0.63 118.16 119.16 1oac n LYS 498 Ca 0.03 0.38 -0.17 0.00 -2.02 0.00 0.00 58.31 56.52 1oac n LYS 498 Cb 0.42 -1.72 -0.10 0.00 -0.02 0.00 0.00 35.03 33.60 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 0.49 -1.16 -0.18 -4.23 -1.26 -4.05 115.64 102.77 1oac s THR 499 Ca -0.25 -2.00 0.18 0.00 -1.18 0.00 0.00 61.69 58.44 1oac s THR 499 Cb 0.06 -2.59 0.21 0.00 1.34 0.00 0.00 72.50 71.52 1oac s THR 499 CO 0.70 0.00 1.55 0.23 -0.54 0.00 0.00 174.62 176.56 1oac n MET 500 N -0.51 0.10 0.06 3.99 2.81 -1.26 -2.67 117.12 119.63 1oac n MET 500 Ca 0.00 0.17 0.12 0.00 -1.81 0.00 0.00 57.70 56.18 1oac n MET 500 Cb 0.66 -1.50 0.22 0.00 -0.71 0.00 0.00 33.22 31.88 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 -1.42 0.51 -2.03 2.03 8.25 -1.26 -4.82 115.22 116.48 1oac n HIS 501 Ca 0.06 0.15 -0.35 0.00 -0.26 0.00 0.00 57.72 57.32 1oac n HIS 501 Cb 0.18 -0.63 0.03 0.00 1.12 0.00 0.00 29.99 30.69 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 -4.08 5.31 0.32 0.41 1.01 -1.09 -4.96 116.67 113.59 1oac s ASP 502 Ca 0.07 2.26 0.03 0.00 0.71 0.00 0.00 52.55 55.62 1oac s ASP 502 Cb 0.14 -2.59 0.63 0.00 1.01 0.00 0.00 42.92 42.11 1oac s ASP 502 CO 0.70 -1.50 1.89 1.05 0.21 0.00 0.00 175.17 177.52 1oac h GLU 503 N 0.81 0.88 -0.01 8.23 4.11 -1.92 -1.95 114.58 124.73 1oac h GLU 503 Ca -0.50 -0.05 0.00 0.00 0.07 0.00 0.00 59.36 58.88 1oac h GLU 503 Cb 1.28 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 30.33 1oac h GLU 503 CO 0.55 0.58 -0.00 0.25 0.07 0.00 0.00 179.01 180.46 1oac n THR 504 N -4.53 0.00 -0.22 -1.06 -2.24 -1.26 -4.55 114.28 100.42 1oac n THR 504 Ca 0.15 -0.20 0.03 0.00 -2.27 0.00 0.00 64.05 61.76 1oac n THR 504 Cb 0.30 0.29 0.13 0.00 -2.10 0.00 0.00 70.33 68.95 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 4.28 0.73 -0.42 6.98 0.00 -1.62 0.23 119.26 129.43 1oac h ALA 505 Ca 0.00 0.18 -0.09 0.00 0.00 0.00 0.00 54.91 55.00 1oac h ALA 505 Cb 0.40 0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.46 1oac h ALA 505 CO 0.00 -0.37 -0.11 -0.22 0.00 0.00 0.00 179.25 178.55 1oac h LYS 506 N 0.17 0.75 0.03 0.00 3.11 -1.81 -0.07 116.57 118.75 1oac h LYS 506 Ca 0.36 -0.25 -0.23 0.00 -2.81 0.00 0.00 60.65 57.72 1oac h LYS 506 Cb 0.59 -0.07 0.02 0.00 -1.00 0.00 0.00 32.23 31.77 1oac h LYS 506 CO -0.52 0.84 -0.91 -0.44 -2.81 0.00 0.00 179.45 175.60 1oac h ASP 507 N 0.68 0.75 -0.38 4.20 3.32 -1.79 -3.13 116.42 120.07 1oac h ASP 507 Ca 0.12 -0.77 0.05 0.00 0.02 0.00 0.00 57.03 56.44 1oac h ASP 507 Cb 0.58 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.88 1oac h ASP 507 CO 0.04 1.43 0.26 0.44 -1.72 0.00 0.00 179.24 179.68 1oac h ASP 508 N 0.15 0.28 -0.52 6.45 3.32 -0.82 -2.50 116.42 122.78 1oac h ASP 508 Ca -0.12 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.93 1oac h ASP 508 Cb 1.60 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 41.08 1oac h ASP 508 CO 0.18 0.19 0.00 0.35 -1.72 0.00 0.00 179.24 178.24 1oac n THR 509 N -4.48 2.67 0.08 0.35 -2.24 -0.05 -4.55 114.28 106.07 1oac n THR 509 Ca 0.04 -1.49 0.00 0.00 -2.27 0.00 0.00 64.05 60.33 1oac n THR 509 Cb 0.21 -0.27 0.31 0.00 -2.10 0.00 0.00 70.33 68.49 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 3.62 0.31 -0.27 -0.78 2.43 -1.39 -3.18 114.38 115.12 1oac h ARG 510 Ca 0.00 -0.09 0.00 0.00 -0.81 0.00 0.00 59.98 59.08 1oac h ARG 510 Cb 1.88 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 31.40 1oac h ARG 510 CO 0.44 0.50 0.00 0.66 -1.51 0.00 0.00 179.97 180.06 1oac n TYR 511 N -4.20 0.71 0.00 2.20 4.01 -1.26 -5.06 117.16 113.56 1oac n TYR 511 Ca -0.01 -0.74 0.00 0.00 -0.16 0.00 0.00 57.90 57.00 1oac n TYR 511 Cb 0.33 -0.20 0.00 0.00 -0.31 0.00 0.00 39.34 39.16 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 -0.19 0.87 3.81 2.72 0.00 -1.20 -1.07 105.19 110.12 1oac n GLY 512 Ca 0.17 -0.81 -0.34 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 4.26 -0.52 2.61 2.01 -1.20 -4.50 115.64 116.30 1oac s THR 513 Ca 0.00 1.52 -0.28 0.00 0.31 0.00 0.00 61.69 63.23 1oac s THR 513 Cb 0.00 -3.68 0.02 0.00 0.01 0.00 0.00 72.50 68.85 1oac s THR 513 CO 0.00 -0.19 1.26 -0.22 -0.69 0.00 0.00 174.62 174.78 1oac s LEU 514 N -2.93 3.51 0.00 4.42 2.96 -1.26 -0.28 118.68 125.10 1oac s LEU 514 Ca 0.60 0.35 0.19 0.00 -0.22 0.00 0.00 54.13 55.05 1oac s LEU 514 Cb -0.12 -3.30 0.00 0.00 0.50 0.00 0.00 46.19 43.26 1oac s LEU 514 CO 0.17 -1.47 0.96 2.30 -1.32 0.00 0.00 176.35 176.99 1oac n ILE 515 N 6.83 0.00 -3.70 6.68 -5.35 -0.74 -4.81 119.36 118.27 1oac n ILE 515 Ca 0.12 -0.31 -0.05 0.00 -0.27 0.00 0.00 62.75 62.24 1oac n ILE 515 Cb 0.49 1.23 -0.01 0.00 -1.74 0.00 0.00 39.64 39.60 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 -2.12 -0.22 0.17 7.28 -1.08 -1.20 -4.66 116.67 114.84 1oac s ASP 516 Ca 0.16 -0.32 -0.32 0.00 -0.52 0.00 0.00 52.55 51.55 1oac s ASP 516 Cb 0.15 0.47 -0.12 0.00 -1.46 0.00 0.00 42.92 41.96 1oac s ASP 516 CO 0.47 -0.85 1.73 1.41 0.52 0.00 0.00 175.17 178.45 1oac n HIS 517 N -0.43 2.63 -0.98 -5.34 8.25 -1.26 -2.05 115.22 116.04 1oac n HIS 517 Ca -0.07 0.03 0.00 0.00 -0.26 0.00 0.00 57.72 57.42 1oac n HIS 517 Cb 0.61 -2.67 0.00 0.00 1.12 0.00 0.00 29.99 29.05 1oac n HIS 517 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1oac n ASN 518 N 4.37 -4.66 -4.13 0.41 4.13 0.19 -4.94 115.26 110.63 1oac n ASN 518 Ca 0.17 0.00 -0.29 0.00 1.68 0.00 0.00 54.58 56.14 1oac n ASN 518 Cb 0.34 -2.40 -0.17 0.00 -1.54 0.00 0.00 39.78 36.02 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 -1.39 1.68 -0.05 2.41 1.01 -0.87 -1.39 121.20 122.59 1oac s ILE 519 Ca 0.00 -0.79 0.06 0.00 0.00 0.00 0.00 60.65 59.92 1oac s ILE 519 Cb 0.00 -1.48 -0.01 0.00 0.01 0.00 0.00 42.46 40.98 1oac s ILE 519 CO 0.00 0.47 -0.24 -0.69 0.00 0.00 0.00 174.94 174.48 1oac s VAL 520 N 0.53 1.98 -0.62 2.92 1.01 -0.61 -1.79 120.40 123.82 1oac s VAL 520 Ca -0.16 -1.04 -0.18 0.00 0.00 0.00 0.00 61.98 60.60 1oac s VAL 520 Cb -0.17 -1.67 0.12 0.00 0.00 0.00 0.00 36.38 34.66 1oac s VAL 520 CO 0.06 0.55 0.71 -0.83 0.00 0.00 0.00 175.10 175.59 1oac s GLY 521 N -0.24 1.89 0.15 4.51 0.00 0.62 -1.42 107.32 112.83 1oac s GLY 521 Ca -0.01 -2.38 -0.34 0.00 0.00 0.00 0.00 44.72 41.99 1oac s GLY 521 CO 0.03 1.54 1.36 2.41 0.00 0.00 0.00 173.10 178.43 1oac n THR 522 N 5.39 0.41 -1.91 0.90 -1.04 -1.25 -3.22 114.28 113.56 1oac n THR 522 Ca -0.06 -0.10 -0.40 0.00 -2.04 0.00 0.00 64.05 61.45 1oac n THR 522 Cb 0.43 -1.11 0.00 0.00 -1.82 0.00 0.00 70.33 67.83 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 0.31 2.30 0.31 12.58 2.01 -0.24 -4.92 115.64 127.99 1oac s THR 523 Ca 0.77 0.27 -0.18 0.00 0.31 0.00 0.00 61.69 62.86 1oac s THR 523 Cb -0.81 -3.16 0.06 0.00 0.01 0.00 0.00 72.50 68.59 1oac s THR 523 CO 0.47 0.04 0.84 -1.38 -0.69 0.00 0.00 174.62 173.90 1oac s HIS 524 N -1.21 0.05 0.28 4.92 -3.43 -1.05 -2.10 115.29 112.75 1oac s HIS 524 Ca 0.58 -0.61 0.09 0.00 -0.80 0.00 0.00 55.06 54.31 1oac s HIS 524 Cb -0.42 0.78 -0.06 0.00 -1.43 0.00 0.00 32.58 31.46 1oac s HIS 524 CO 0.54 -1.34 -0.11 -0.65 -2.00 0.00 0.00 174.74 171.18 1oac s GLN 525 N -2.57 1.59 -0.23 -0.38 -0.21 -1.02 -0.83 119.66 116.01 1oac s GLN 525 Ca 0.16 -1.78 0.02 0.00 0.02 0.00 0.00 55.36 53.78 1oac s GLN 525 Cb -0.04 -1.40 0.05 0.00 1.00 0.00 0.00 33.01 32.62 1oac s GLN 525 CO 0.09 0.15 -0.10 -1.01 -2.12 0.00 0.00 175.29 172.30 1oac s HIS 526 N -2.81 2.80 -0.18 0.91 3.76 -0.63 -3.72 115.29 115.43 1oac s HIS 526 Ca 0.29 -1.94 0.01 0.00 -0.15 0.00 0.00 55.06 53.27 1oac s HIS 526 Cb 0.01 -1.77 0.02 0.00 1.11 0.00 0.00 32.58 31.94 1oac s HIS 526 CO 0.13 -0.81 -0.19 0.42 -0.85 0.00 0.00 174.74 173.43 1oac s ILE 527 N 1.26 2.18 0.04 0.60 1.01 0.17 -1.30 121.20 125.17 1oac s ILE 527 Ca -0.05 -0.91 0.04 0.00 0.00 0.00 0.00 60.65 59.74 1oac s ILE 527 Cb -0.18 -1.92 -0.04 0.00 0.01 0.00 0.00 42.46 40.34 1oac s ILE 527 CO -0.07 0.53 -0.07 -0.31 0.00 0.00 0.00 174.94 175.03 1oac s TYR 528 N 1.21 2.86 -0.04 3.97 1.51 0.26 -1.02 117.35 126.10 1oac s TYR 528 Ca 0.03 -0.07 0.02 0.00 -1.01 0.00 0.00 57.07 56.04 1oac s TYR 528 Cb -0.14 -1.55 0.01 0.00 -0.11 0.00 0.00 41.96 40.18 1oac s TYR 528 CO -0.10 0.40 -0.08 1.21 -1.11 0.00 0.00 175.55 175.87 1oac s ASN 529 N -1.76 1.28 -0.13 2.29 2.47 -0.36 -0.74 114.94 117.99 1oac s ASN 529 Ca 0.20 -0.20 0.00 0.00 0.42 0.00 0.00 52.86 53.28 1oac s ASN 529 Cb -0.11 -0.53 -0.01 0.00 -1.45 0.00 0.00 41.25 39.15 1oac s ASN 529 CO 0.11 0.01 -0.14 -0.36 -3.72 0.00 0.00 177.10 173.00 1oac s PHE 530 N 0.59 2.79 -0.37 0.43 0.08 0.91 0.76 117.98 123.17 1oac s PHE 530 Ca -0.10 -0.74 -0.16 0.00 0.12 0.00 0.00 56.93 56.05 1oac s PHE 530 Cb -0.13 -1.84 -0.00 0.00 -0.57 0.00 0.00 43.02 40.48 1oac s PHE 530 CO 0.01 -0.27 0.40 0.50 -0.10 0.00 0.00 175.22 175.76 1oac s ARG 531 N 0.43 3.41 -0.29 0.44 3.52 -0.52 -0.98 118.95 124.97 1oac s ARG 531 Ca -0.11 -0.51 0.03 0.00 -0.13 0.00 0.00 55.73 55.01 1oac s ARG 531 Cb -0.16 -3.86 0.08 0.00 -1.56 0.00 0.00 34.95 29.45 1oac s ARG 531 CO 0.05 -0.64 -0.03 -0.51 -0.81 0.00 0.00 175.30 173.36 1oac s LEU 532 N 2.08 3.76 -1.24 -0.88 1.43 0.48 -1.62 118.68 122.69 1oac s LEU 532 Ca 0.12 -1.67 -0.15 0.00 -1.03 0.00 0.00 54.13 51.41 1oac s LEU 532 Cb -0.17 -1.49 0.14 0.00 0.03 0.00 0.00 46.19 44.71 1oac s LEU 532 CO 0.12 -0.28 1.55 -0.67 0.23 0.00 0.00 176.35 177.30 1oac n ASP 533 N 4.42 5.12 -4.75 2.29 2.03 0.20 -1.15 116.55 124.70 1oac n ASP 533 Ca -0.06 -2.96 -0.41 0.00 0.52 0.00 0.00 54.79 51.88 1oac n ASP 533 Cb 0.42 -1.62 -0.03 0.00 -0.72 0.00 0.00 41.12 39.17 1oac n ASP 533 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1oac s LEU 534 N 2.28 4.48 -0.59 -2.67 1.43 -1.26 -0.48 118.68 121.88 1oac s LEU 534 Ca 0.46 2.39 0.05 0.00 -1.03 0.00 0.00 54.13 55.99 1oac s LEU 534 Cb -0.00 -3.63 0.17 0.00 0.03 0.00 0.00 46.19 42.76 1oac s LEU 534 CO 0.02 -0.34 0.44 0.47 0.23 0.00 0.00 176.35 177.18 1oac n ASP 535 N 1.52 1.70 -4.55 2.29 8.00 -0.37 -4.67 116.55 120.48 1oac n ASP 535 Ca 0.01 -2.90 -0.32 0.00 0.71 0.00 0.00 54.79 52.29 1oac n ASP 535 Cb 0.44 -0.68 -0.04 0.00 -0.02 0.00 0.00 41.12 40.82 1oac n ASP 535 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1oac s VAL 536 N -0.92 3.14 -1.38 2.53 1.01 -1.25 -3.02 120.40 120.50 1oac s VAL 536 Ca 0.28 0.02 -0.07 0.00 0.00 0.00 0.00 61.98 62.21 1oac s VAL 536 Cb -0.01 -3.36 0.05 0.00 0.00 0.00 0.00 36.38 33.06 1oac s VAL 536 CO -0.18 -0.35 0.53 -0.67 0.00 0.00 0.00 175.10 174.44 1oac n ASP 537 N 15.39 -4.65 0.00 3.32 2.03 0.71 -4.59 116.55 128.76 1oac n ASP 537 Ca 0.34 -0.34 0.00 0.00 0.52 0.00 0.00 54.79 55.32 1oac n ASP 537 Cb 0.51 -3.81 0.00 0.00 -0.72 0.00 0.00 41.12 37.11 1oac n ASP 537 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1oac n GLY 538 N -1.31 3.80 0.17 0.27 0.00 -1.17 -4.85 105.19 102.11 1oac n GLY 538 Ca -0.05 -1.62 -0.16 0.00 0.00 0.00 0.00 46.02 44.18 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 0.52 -6.45 1.61 3.07 -1.86 -3.40 114.58 108.07 1oac h GLU 539 Ca 0.00 -0.57 -0.56 0.00 -0.50 0.00 0.00 59.36 57.73 1oac h GLU 539 Cb 0.00 0.17 -0.08 0.00 -0.84 0.00 0.00 28.75 28.00 1oac h GLU 539 CO 0.00 1.20 0.95 -0.80 -1.40 0.00 0.00 179.01 178.96 1oac s ASN 540 N -7.18 6.37 0.43 1.42 0.01 -1.26 -3.53 114.94 111.21 1oac s ASN 540 Ca -0.07 -0.07 0.04 0.00 -0.71 0.00 0.00 52.86 52.04 1oac s ASN 540 Cb 0.08 -2.54 -0.05 0.00 0.41 0.00 0.00 41.25 39.15 1oac s ASN 540 CO 0.89 -1.53 0.03 0.20 -1.51 0.00 0.00 177.10 175.18 1oac s ASN 541 N 3.13 3.54 0.02 -1.22 0.01 0.58 -4.42 114.94 116.58 1oac s ASN 541 Ca 0.40 -1.50 -0.01 0.00 -0.71 0.00 0.00 52.86 51.03 1oac s ASN 541 Cb -0.08 0.07 -0.02 0.00 0.41 0.00 0.00 41.25 41.63 1oac s ASN 541 CO 0.22 -0.67 -0.01 -0.44 -1.51 0.00 0.00 177.10 174.69 1oac s SER 542 N -3.71 0.24 -0.27 -1.22 0.01 -0.27 -0.49 113.70 107.99 1oac s SER 542 Ca 0.24 -0.52 -0.11 0.00 1.31 0.00 0.00 55.95 56.88 1oac s SER 542 Cb 0.06 0.12 -0.05 0.00 0.21 0.00 0.00 66.02 66.36 1oac s SER 542 CO 0.12 -0.34 0.18 -0.22 0.41 0.00 0.00 173.24 173.40 1oac s LEU 543 N -1.60 4.05 -0.04 2.44 2.96 -1.26 -0.79 118.68 124.44 1oac s LEU 543 Ca -0.14 0.04 0.06 0.00 -0.22 0.00 0.00 54.13 53.87 1oac s LEU 543 Cb -0.08 -2.12 -0.02 0.00 0.50 0.00 0.00 46.19 44.47 1oac s LEU 543 CO -0.02 -0.01 -0.21 -0.69 -1.32 0.00 0.00 176.35 174.10 1oac s VAL 544 N 1.53 2.46 -0.10 1.68 1.01 0.63 -0.08 120.40 127.53 1oac s VAL 544 Ca 0.07 -0.95 -0.04 0.00 0.00 0.00 0.00 61.98 61.07 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 0.58 0.04 0.00 0.00 0.00 0.00 175.10 175.81 1oac s ALA 545 N -0.55 3.46 -0.29 5.51 0.00 0.11 -1.06 121.76 128.93 1oac s ALA 545 Ca 0.08 -0.75 -0.03 0.00 0.00 0.00 0.00 51.96 51.25 1oac s ALA 545 Cb -0.11 -1.66 0.10 0.00 0.00 0.00 0.00 23.12 21.45 1oac s ALA 545 CO 0.00 0.56 0.12 -1.64 0.00 0.00 0.00 175.76 174.80 1oac s MET 546 N -0.80 0.33 -0.28 0.00 -1.94 -0.28 -1.29 119.30 115.04 1oac s MET 546 Ca 0.13 -0.66 -0.08 0.00 -1.71 0.00 0.00 55.69 53.37 1oac s MET 546 Cb -0.12 -1.41 -0.02 0.00 2.01 0.00 0.00 34.83 35.30 1oac s MET 546 CO 0.03 -0.99 0.10 -0.51 -0.01 0.00 0.00 175.02 173.63 1oac s ASP 547 N 1.97 5.27 0.13 3.03 1.01 0.12 -1.64 116.67 126.55 1oac s ASP 547 Ca 0.09 -0.39 -0.31 0.00 0.71 0.00 0.00 52.55 52.64 1oac s ASP 547 Cb -0.16 -1.94 -0.09 0.00 1.01 0.00 0.00 42.92 41.73 1oac s ASP 547 CO -0.33 -0.11 1.55 -2.84 0.21 0.00 0.00 175.17 173.65 1oac s PRO 548 N 1.60 4.23 0.03 8.23 0.02 -1.26 0.54 135.00 148.39 1oac s PRO 548 Ca 0.05 2.28 0.00 0.00 0.02 0.00 0.00 61.00 63.36 1oac s PRO 548 Cb -0.16 -3.29 -0.02 0.00 0.02 0.00 0.00 34.50 31.05 1oac s PRO 548 CO 0.04 -0.60 -0.04 0.14 -0.33 0.00 0.00 177.00 176.21 1oac s VAL 549 N 1.52 0.23 -0.21 3.83 -7.23 0.19 -4.89 120.40 113.85 1oac s VAL 549 Ca 0.70 -1.09 -0.17 0.00 -1.81 0.00 0.00 61.98 59.61 1oac s VAL 549 Cb -0.41 -0.53 -0.04 0.00 0.56 0.00 0.00 36.38 35.96 1oac s VAL 549 CO 0.31 -0.55 0.44 -0.69 -0.31 0.00 0.00 175.10 174.30 1oac s VAL 550 N -1.83 5.16 0.11 1.32 1.01 -1.26 -0.67 120.40 124.24 1oac s VAL 550 Ca -0.11 0.79 0.09 0.00 0.00 0.00 0.00 61.98 62.75 1oac s VAL 550 Cb -0.07 -3.77 -0.04 0.00 0.00 0.00 0.00 36.38 32.50 1oac s VAL 550 CO -0.02 0.21 -0.22 -0.54 0.00 0.00 0.00 175.10 174.53 1oac s LYS 551 N 1.53 1.19 0.35 2.72 1.02 -0.46 -4.94 119.74 121.14 1oac s LYS 551 Ca 0.21 -1.20 -0.26 0.00 0.02 0.00 0.00 55.97 54.74 1oac s LYS 551 Cb -0.15 -1.50 -0.13 0.00 -0.52 0.00 0.00 37.83 35.53 1oac s LYS 551 CO 0.09 0.35 0.95 -2.30 -0.92 0.00 0.00 175.35 173.52 1oac n PRO 552 N 1.06 1.24 -2.59 -1.68 -0.02 -1.26 0.45 135.00 132.21 1oac n PRO 552 Ca -0.19 0.44 -0.43 0.00 -2.02 0.00 0.00 63.50 61.30 1oac n PRO 552 Cb 0.53 -1.86 -0.02 0.00 -0.02 0.00 0.00 33.50 32.13 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 -0.67 7.12 0.00 2.55 3.04 0.79 -4.57 114.94 123.20 1oac s ASN 553 Ca 0.61 1.60 0.14 0.00 0.04 0.00 0.00 52.86 55.25 1oac s ASN 553 Cb -0.64 -2.55 0.02 0.00 -1.54 0.00 0.00 41.25 36.53 1oac s ASN 553 CO 0.59 -0.57 0.82 0.35 -3.04 0.00 0.00 177.10 175.25 1oac n THR 554 N 4.83 0.00 1.20 -5.21 -2.24 -1.26 -4.57 114.28 107.03 1oac n THR 554 Ca 0.11 -0.38 0.10 0.00 -2.27 0.00 0.00 64.05 61.60 1oac n THR 554 Cb 0.47 1.19 0.35 0.00 -2.10 0.00 0.00 70.33 70.24 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 0.02 2.51 0.00 6.98 0.00 -1.26 -5.08 120.51 123.68 1oac n ALA 555 Ca 0.06 -0.52 0.00 0.00 0.00 0.00 0.00 53.44 52.98 1oac n ALA 555 Cb 0.31 -1.08 0.00 0.00 0.00 0.00 0.00 19.45 18.69 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 1.11 -1.69 0.00 0.00 0.00 -1.26 -5.10 105.19 98.24 1oac n GLY 556 Ca 0.15 -1.53 0.00 0.00 0.00 0.00 0.00 46.02 44.65 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 -2.03 -3.78 0.27 -0.02 0.00 -1.26 -4.65 105.19 93.72 1oac n GLY 557 Ca 0.00 -1.95 0.16 0.00 0.00 0.00 0.00 46.02 44.23 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 -6.82 1.61 0.11 -2.03 -3.45 132.00 121.42 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 0.03 0.00 0.11 0.00 0.00 31.00 31.14 1oac h PRO 558 CO 0.00 0.06 0.54 1.03 -0.21 0.00 0.00 178.00 179.42 1oac s ARG 559 N -3.77 4.53 -0.03 1.05 1.81 -1.26 -4.95 118.95 116.32 1oac s ARG 559 Ca -0.00 1.96 0.17 0.00 -1.72 0.00 0.00 55.73 56.14 1oac s ARG 559 Cb 0.10 -3.15 -0.20 0.00 -0.45 0.00 0.00 34.95 31.25 1oac s ARG 559 CO 0.55 0.04 0.59 0.25 -0.68 0.00 0.00 175.30 176.06 1oac n THR 560 N 1.16 1.22 -4.15 0.02 -2.24 -1.26 -4.64 114.28 104.39 1oac n THR 560 Ca -0.00 -0.74 -0.10 0.00 -2.27 0.00 0.00 64.05 60.95 1oac n THR 560 Cb 0.44 -0.68 -0.10 0.00 -2.10 0.00 0.00 70.33 67.89 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 -5.67 0.65 0.21 3.42 1.04 -1.26 -0.15 113.70 111.93 1oac s SER 561 Ca -0.05 -1.10 0.04 0.00 0.48 0.00 0.00 55.95 55.32 1oac s SER 561 Cb 0.08 0.20 -0.05 0.00 0.10 0.00 0.00 66.02 66.36 1oac s SER 561 CO 0.83 -0.62 -0.04 0.42 0.98 0.00 0.00 173.24 174.81 1oac s THR 562 N -3.88 1.12 -0.32 2.02 -4.23 0.17 -4.61 115.64 105.92 1oac s THR 562 Ca 0.16 -2.05 -0.09 0.00 -1.18 0.00 0.00 61.69 58.53 1oac s THR 562 Cb 0.07 -2.19 0.01 0.00 1.34 0.00 0.00 72.50 71.73 1oac s THR 562 CO -0.03 -0.46 0.14 -0.04 -0.54 0.00 0.00 174.62 173.69 1oac s MET 563 N -3.82 3.11 0.34 3.99 -1.94 -1.26 -1.35 119.30 118.37 1oac s MET 563 Ca 0.25 -0.87 0.04 0.00 -1.71 0.00 0.00 55.69 53.40 1oac s MET 563 Cb 0.04 -3.54 -0.06 0.00 2.01 0.00 0.00 34.83 33.29 1oac s MET 563 CO 0.06 -0.50 0.06 -0.65 -0.01 0.00 0.00 175.02 173.98 1oac s GLN 564 N 1.55 1.69 -0.08 2.03 -0.21 0.15 -4.98 119.66 119.82 1oac s GLN 564 Ca 0.03 -1.95 0.03 0.00 0.02 0.00 0.00 55.36 53.49 1oac s GLN 564 Cb -0.18 -0.90 0.00 0.00 1.00 0.00 0.00 33.01 32.94 1oac s GLN 564 CO 0.05 -0.20 -0.19 0.08 -2.12 0.00 0.00 175.29 172.91 1oac s VAL 565 N -3.26 1.65 -0.57 1.09 1.01 -1.26 0.57 120.40 119.63 1oac s VAL 565 Ca 0.35 -0.79 -0.21 0.00 0.00 0.00 0.00 61.98 61.33 1oac s VAL 565 Cb 0.08 -1.44 0.06 0.00 0.00 0.00 0.00 36.38 35.08 1oac s VAL 565 CO 0.15 0.47 0.81 0.21 0.00 0.00 0.00 175.10 176.75 1oac s ASN 566 N 0.41 6.23 -0.14 3.32 3.84 0.19 -4.88 114.94 123.91 1oac s ASN 566 Ca -0.15 -0.88 -0.02 0.00 0.21 0.00 0.00 52.86 52.01 1oac s ASN 566 Cb -0.16 -2.36 -0.02 0.00 -0.55 0.00 0.00 41.25 38.15 1oac s ASN 566 CO 0.06 -1.17 -0.07 -1.58 -2.79 0.00 0.00 177.10 171.55 1oac s GLN 567 N 3.37 3.54 0.02 0.43 0.74 -1.26 0.10 119.66 126.61 1oac s GLN 567 Ca 0.20 -0.58 -0.24 0.00 0.05 0.00 0.00 55.36 54.79 1oac s GLN 567 Cb -0.18 -2.80 0.05 0.00 1.10 0.00 0.00 33.01 31.19 1oac s GLN 567 CO 0.12 0.25 0.54 1.52 -0.55 0.00 0.00 175.29 177.17 1oac s TYR 568 N 0.32 -0.47 0.36 1.67 1.13 -0.41 -5.00 117.35 114.95 1oac s TYR 568 Ca -0.06 0.61 -0.21 0.00 -1.41 0.00 0.00 57.07 55.99 1oac s TYR 568 Cb -0.15 0.35 -0.10 0.00 -1.10 0.00 0.00 41.96 40.96 1oac s TYR 568 CO 0.04 -0.62 0.89 -0.80 -2.51 0.00 0.00 175.55 172.54 1oac s ASN 569 N -1.76 7.04 -0.36 -0.18 -0.87 -1.26 0.07 114.94 117.62 1oac s ASN 569 Ca -0.07 1.63 -0.01 0.00 -1.57 0.00 0.00 52.86 52.83 1oac s ASN 569 Cb -0.01 -2.51 0.09 0.00 -0.02 0.00 0.00 41.25 38.80 1oac s ASN 569 CO 0.01 -0.21 0.10 -0.63 -2.57 0.00 0.00 177.10 173.81 1oac s ILE 570 N -1.91 3.00 -0.67 0.60 1.01 0.89 -4.89 121.20 119.23 1oac s ILE 570 Ca 0.55 -1.86 0.26 0.00 0.00 0.00 0.00 60.65 59.59 1oac s ILE 570 Cb -0.13 -2.96 0.29 0.00 0.01 0.00 0.00 42.46 39.67 1oac s ILE 570 CO 0.18 -0.46 1.76 1.23 0.00 0.00 0.00 174.94 177.64 1oac h GLY 571 N 7.96 0.00 -2.52 6.18 0.00 -1.90 -3.38 103.07 109.40 1oac h GLY 571 Ca -0.14 0.00 -0.10 0.00 0.00 0.00 0.00 47.33 47.09 1oac h GLY 571 CO 0.61 0.00 -0.26 0.54 0.00 0.00 0.00 176.54 177.43 1oac s ASN 572 N -4.71 -0.02 0.45 0.19 4.22 -1.26 -0.66 114.94 113.16 1oac s ASN 572 Ca 0.10 -0.94 0.11 0.00 -2.14 0.00 0.00 52.86 49.99 1oac s ASN 572 Cb 0.11 0.50 1.01 0.00 1.28 0.00 0.00 41.25 44.15 1oac s ASN 572 CO 0.59 -0.99 2.08 -0.33 -2.04 0.00 0.00 177.10 176.40 1oac h GLU 573 N 2.42 0.29 -0.27 3.55 5.08 -1.36 -2.06 114.58 122.22 1oac h GLU 573 Ca -0.30 -0.02 -0.09 0.00 -1.00 0.00 0.00 59.36 57.95 1oac h GLU 573 Cb 1.24 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 30.42 1oac h GLU 573 CO 0.43 0.22 -0.19 0.37 -1.00 0.00 0.00 179.01 178.84 1oac h GLN 574 N 0.29 0.60 0.00 2.33 5.75 -1.87 -2.50 115.11 119.73 1oac h GLN 574 Ca 0.08 -0.29 -0.09 0.00 -0.15 0.00 0.00 58.65 58.19 1oac h GLN 574 Cb 0.02 -0.00 -0.01 0.00 1.07 0.00 0.00 27.48 28.55 1oac h GLN 574 CO -0.01 0.88 -0.45 -0.44 -2.65 0.00 0.00 178.83 176.15 1oac h ASP 575 N 0.33 0.00 1.40 -0.69 3.32 -1.91 -2.98 116.42 115.89 1oac h ASP 575 Ca 0.05 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.10 1oac h ASP 575 Cb 0.73 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.28 1oac h ASP 575 CO 0.05 0.45 0.00 0.00 -1.72 0.00 0.00 179.24 178.02 1oac h ALA 576 N 1.55 1.00 -1.98 3.45 0.00 -1.29 -3.43 119.26 118.57 1oac h ALA 576 Ca -0.00 0.00 -0.59 0.00 0.00 0.00 0.00 54.91 54.32 1oac h ALA 576 Cb 0.85 0.00 -0.09 0.00 0.00 0.00 0.00 17.79 18.56 1oac h ALA 576 CO 0.06 0.00 0.68 0.00 0.00 0.00 0.00 179.25 179.99 1oac s ALA 577 N -3.21 3.37 0.21 0.00 0.00 -0.95 -4.03 121.76 117.15 1oac s ALA 577 Ca 0.08 -0.42 -0.16 0.00 0.00 0.00 0.00 51.96 51.45 1oac s ALA 577 Cb 0.10 -3.61 0.02 0.00 0.00 0.00 0.00 23.12 19.63 1oac s ALA 577 CO 0.57 -1.71 0.52 1.14 0.00 0.00 0.00 175.76 176.27 1oac s GLN 578 N 3.65 1.42 0.45 0.00 -2.07 0.17 -4.99 119.66 118.28 1oac s GLN 578 Ca 0.40 -0.95 -0.22 0.00 -1.82 0.00 0.00 55.36 52.77 1oac s GLN 578 Cb -0.11 0.51 -0.09 0.00 -1.09 0.00 0.00 33.01 32.23 1oac s GLN 578 CO 0.20 -0.60 1.04 0.15 -1.32 0.00 0.00 175.29 174.76 1oac s LYS 579 N -3.90 3.96 -0.27 9.60 -0.14 -1.26 -1.25 119.74 126.47 1oac s LYS 579 Ca 0.12 1.41 -0.10 0.00 -1.36 0.00 0.00 55.97 56.03 1oac s LYS 579 Cb -0.01 -2.27 -0.05 0.00 -1.68 0.00 0.00 37.83 33.83 1oac s LYS 579 CO -0.00 -0.30 0.17 0.12 -0.76 0.00 0.00 175.35 174.58 1oac s PHE 580 N -1.87 3.20 -0.37 3.18 5.36 -1.26 -4.81 117.98 121.42 1oac s PHE 580 Ca 0.63 0.04 -0.14 0.00 -0.96 0.00 0.00 56.93 56.51 1oac s PHE 580 Cb -0.18 -2.35 -0.00 0.00 -0.34 0.00 0.00 43.02 40.14 1oac s PHE 580 CO 0.22 -0.18 0.30 0.34 -1.46 0.00 0.00 175.22 174.44 1oac s ASP 581 N 1.70 6.11 0.00 6.13 -1.08 -1.26 -4.95 116.67 123.32 1oac s ASP 581 Ca 0.07 -0.56 0.09 0.00 -0.52 0.00 0.00 52.55 51.63 1oac s ASP 581 Cb -0.16 -2.16 0.47 0.00 -1.46 0.00 0.00 42.92 39.61 1oac s ASP 581 CO 0.10 -0.35 1.12 -0.81 0.52 0.00 0.00 175.17 175.75 1oac n PRO 582 N 5.22 0.17 0.00 4.34 -0.04 -1.26 -0.12 135.00 143.31 1oac n PRO 582 Ca -0.11 0.15 0.12 0.00 -0.04 0.00 0.00 63.50 63.63 1oac n PRO 582 Cb 0.49 -1.50 0.31 0.00 -0.04 0.00 0.00 33.50 32.75 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 -0.50 -0.79 3.84 0.55 0.00 -1.26 -4.92 105.19 102.11 1oac n GLY 583 Ca 0.05 -0.40 -0.22 0.00 0.00 0.00 0.00 46.02 45.45 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 -2.66 2.56 -0.10 2.61 -4.23 0.83 -4.57 115.64 110.08 1oac s THR 584 Ca 0.20 -1.45 0.03 0.00 -1.18 0.00 0.00 61.69 59.29 1oac s THR 584 Cb 0.19 -3.00 -0.00 0.00 1.34 0.00 0.00 72.50 71.02 1oac s THR 584 CO 0.59 -0.00 -0.22 -0.63 -0.54 0.00 0.00 174.62 173.82 1oac s ILE 585 N -2.51 2.28 -0.13 2.99 1.01 -0.65 -4.95 121.20 119.24 1oac s ILE 585 Ca 0.46 -0.95 0.00 0.00 0.00 0.00 0.00 60.65 60.16 1oac s ILE 585 Cb -0.01 -1.88 0.02 0.00 0.01 0.00 0.00 42.46 40.60 1oac s ILE 585 CO 0.26 0.55 -0.12 -0.13 0.00 0.00 0.00 174.94 175.51 1oac s ARG 586 N 0.25 2.05 0.10 2.79 1.81 -1.26 -1.13 118.95 123.55 1oac s ARG 586 Ca -0.15 -0.46 0.10 0.00 -1.72 0.00 0.00 55.73 53.50 1oac s ARG 586 Cb -0.17 -1.92 -0.03 0.00 -0.45 0.00 0.00 34.95 32.38 1oac s ARG 586 CO 0.07 -0.23 -0.26 -0.51 -0.68 0.00 0.00 175.30 173.70 1oac s LEU 587 N 1.50 2.26 -0.35 2.53 1.43 -0.23 -0.62 118.68 125.20 1oac s LEU 587 Ca 0.04 -0.68 -0.09 0.00 -1.03 0.00 0.00 54.13 52.36 1oac s LEU 587 Cb -0.13 -1.18 0.02 0.00 0.03 0.00 0.00 46.19 44.93 1oac s LEU 587 CO -0.09 0.19 0.16 -0.22 0.23 0.00 0.00 176.35 176.62 1oac s LEU 588 N -1.73 4.44 0.31 1.79 2.96 -0.30 -0.27 118.68 125.87 1oac s LEU 588 Ca 0.12 -0.90 0.09 0.00 -0.22 0.00 0.00 54.13 53.22 1oac s LEU 588 Cb -0.10 -1.98 -0.04 0.00 0.50 0.00 0.00 46.19 44.57 1oac s LEU 588 CO 0.04 -0.32 0.07 -0.44 -1.32 0.00 0.00 176.35 174.39 1oac s SER 589 N 1.53 4.56 -0.37 3.68 0.01 0.03 -1.14 113.70 122.01 1oac s SER 589 Ca 0.02 -0.76 -0.05 0.00 1.31 0.00 0.00 55.95 56.47 1oac s SER 589 Cb -0.19 -0.74 0.08 0.00 0.21 0.00 0.00 66.02 65.38 1oac s SER 589 CO 0.05 -0.18 0.15 0.21 0.41 0.00 0.00 173.24 173.88 1oac s ASN 590 N -3.77 5.26 0.59 2.44 3.84 -0.06 -1.12 114.94 122.12 1oac s ASN 590 Ca 0.35 -1.58 0.39 0.00 0.21 0.00 0.00 52.86 52.23 1oac s ASN 590 Cb -0.03 -1.84 1.87 0.00 -0.55 0.00 0.00 41.25 40.70 1oac s ASN 590 CO 0.21 -0.44 2.16 1.55 -2.79 0.00 0.00 177.10 177.80 1oac h PRO 591 N 8.14 0.00 0.00 0.43 0.13 -1.87 -2.57 132.00 136.26 1oac h PRO 591 Ca -0.19 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.94 1oac h PRO 591 Cb 1.06 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.19 1oac h PRO 591 CO 0.65 0.00 -0.71 -0.91 -0.23 0.00 0.00 178.00 176.80 1oac h ASN 592 N 0.00 0.00 -4.00 1.44 2.35 -1.92 -3.46 115.58 109.98 1oac h ASN 592 Ca 0.00 -0.05 -0.57 0.00 -0.55 0.00 0.00 56.30 55.12 1oac h ASN 592 Cb 0.24 0.00 -0.31 0.00 0.05 0.00 0.00 38.32 38.31 1oac h ASN 592 CO 0.00 0.03 -0.84 -0.54 -1.65 0.00 0.00 177.43 174.42 1oac s LYS 593 N -3.28 1.80 0.23 0.81 1.02 -0.97 -5.10 119.74 114.24 1oac s LYS 593 Ca 0.03 -0.65 0.11 0.00 0.02 0.00 0.00 55.97 55.48 1oac s LYS 593 Cb 0.10 -1.59 -0.05 0.00 -0.52 0.00 0.00 37.83 35.77 1oac s LYS 593 CO 0.75 0.29 -0.20 -1.21 -0.92 0.00 0.00 175.35 174.06 1oac s GLU 594 N -0.07 1.52 0.68 1.68 2.02 -1.26 -1.48 118.70 121.79 1oac s GLU 594 Ca -0.02 -1.63 -0.08 0.00 0.02 0.00 0.00 54.97 53.27 1oac s GLU 594 Cb -0.11 -1.62 0.15 0.00 0.10 0.00 0.00 34.13 32.65 1oac s GLU 594 CO 0.02 0.32 0.93 0.27 0.02 0.00 0.00 175.26 176.81 1oac n ASN 595 N -0.22 0.47 0.25 -0.19 2.04 0.15 -4.82 115.26 112.93 1oac n ASN 595 Ca -0.09 -1.58 0.17 0.00 -0.44 0.00 0.00 54.58 52.65 1oac n ASN 595 Cb 0.59 -0.67 0.89 0.00 -2.53 0.00 0.00 39.78 38.05 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 0.00 -0.18 -3.83 2.43 -1.88 -1.64 114.38 109.29 1oac h ARG 596 Ca -0.30 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.87 1oac h ARG 596 Cb 0.93 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.48 1oac h ARG 596 CO 0.25 0.00 0.00 -1.33 -1.51 0.00 0.00 179.97 177.38 1oac n MET 597 N -3.68 1.99 -0.88 0.20 2.81 -1.26 -4.93 117.12 111.36 1oac n MET 597 Ca -0.00 -1.47 0.00 0.00 -1.81 0.00 0.00 57.70 54.42 1oac n MET 597 Cb 0.24 -1.45 0.00 0.00 -0.71 0.00 0.00 33.22 31.30 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 1.26 0.47 3.87 3.03 0.00 -0.61 -5.05 105.19 108.15 1oac n GLY 598 Ca 0.17 -0.85 -0.36 0.00 0.00 0.00 0.00 46.02 44.98 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 -2.77 6.51 0.24 1.61 0.02 -1.26 -4.81 114.94 114.48 1oac s ASN 599 Ca 0.00 0.59 -0.31 0.00 -1.02 0.00 0.00 52.86 52.12 1oac s ASN 599 Cb 0.00 -2.11 -0.11 0.00 0.02 0.00 0.00 41.25 39.05 1oac s ASN 599 CO 0.00 0.32 1.65 -2.84 0.02 0.00 0.00 177.10 176.26 1oac s PRO 600 N -1.37 4.13 0.12 -0.60 0.02 -1.26 0.34 135.00 136.38 1oac s PRO 600 Ca 0.22 2.57 -0.31 0.00 0.02 0.00 0.00 61.00 63.50 1oac s PRO 600 Cb -0.13 -3.06 -0.09 0.00 0.02 0.00 0.00 34.50 31.23 1oac s PRO 600 CO 0.11 -0.69 1.56 0.14 -0.33 0.00 0.00 177.00 177.79 1oac s VAL 601 N 0.70 2.92 0.23 3.83 -7.23 -0.55 -4.74 120.40 115.56 1oac s VAL 601 Ca 0.70 0.57 0.00 0.00 -1.81 0.00 0.00 61.98 61.44 1oac s VAL 601 Cb -0.48 -3.37 -0.04 0.00 0.56 0.00 0.00 36.38 33.05 1oac s VAL 601 CO 0.38 0.03 0.18 -0.44 -0.31 0.00 0.00 175.10 174.94 1oac s SER 602 N 1.56 0.44 -0.03 4.85 0.01 -0.81 -0.89 113.70 118.84 1oac s SER 602 Ca 0.70 -1.44 0.03 0.00 1.31 0.00 0.00 55.95 56.55 1oac s SER 602 Cb -0.41 0.43 -0.00 0.00 0.21 0.00 0.00 66.02 66.25 1oac s SER 602 CO 0.31 -0.90 -0.12 -0.31 0.41 0.00 0.00 173.24 172.63 1oac s TYR 603 N -4.00 1.17 -0.15 2.43 1.51 -0.29 -0.12 117.35 117.89 1oac s TYR 603 Ca 0.39 -0.29 -0.17 0.00 -1.01 0.00 0.00 57.07 55.99 1oac s TYR 603 Cb 0.06 -0.80 -0.04 0.00 -0.11 0.00 0.00 41.96 41.06 1oac s TYR 603 CO 0.15 -0.09 0.44 -1.14 -1.11 0.00 0.00 175.55 173.80 1oac s GLN 604 N 0.03 4.28 -0.24 -0.62 0.74 0.12 -1.15 119.66 122.82 1oac s GLN 604 Ca -0.01 0.35 -0.09 0.00 0.05 0.00 0.00 55.36 55.66 1oac s GLN 604 Cb -0.08 -3.47 -0.04 0.00 1.10 0.00 0.00 33.01 30.52 1oac s GLN 604 CO 0.01 0.10 0.11 0.42 -0.55 0.00 0.00 175.29 175.37 1oac s ILE 605 N 0.84 4.80 -0.48 -2.34 1.01 0.20 -1.59 121.20 123.65 1oac s ILE 605 Ca 0.23 -0.01 0.03 0.00 0.00 0.00 0.00 60.65 60.90 1oac s ILE 605 Cb -0.15 -3.24 0.13 0.00 0.01 0.00 0.00 42.46 39.22 1oac s ILE 605 CO 0.09 0.34 0.26 -0.63 0.00 0.00 0.00 174.94 175.00 1oac s ILE 606 N 1.33 1.93 0.36 2.92 1.01 0.48 -4.49 121.20 124.75 1oac s ILE 606 Ca 0.06 -2.94 0.23 0.00 0.00 0.00 0.00 60.65 58.00 1oac s ILE 606 Cb -0.15 -2.34 0.23 0.00 0.01 0.00 0.00 42.46 40.21 1oac s ILE 606 CO 0.05 -0.86 1.97 -0.65 0.00 0.00 0.00 174.94 175.45 1oac h PRO 607 N 6.57 0.00 -4.35 2.79 0.11 -1.90 -0.68 132.00 134.53 1oac h PRO 607 Ca -0.03 0.00 -0.63 0.00 0.11 0.00 0.00 66.00 65.45 1oac h PRO 607 Cb 0.91 0.00 -0.39 0.00 0.11 0.00 0.00 31.00 31.62 1oac h PRO 607 CO 0.58 0.20 -0.76 -0.47 -0.21 0.00 0.00 178.00 177.34 1oac s TYR 608 N -4.13 2.83 -0.31 0.65 5.04 -1.26 -4.68 117.35 115.50 1oac s TYR 608 Ca -0.02 -2.26 0.08 0.00 -2.44 0.00 0.00 57.07 52.43 1oac s TYR 608 Cb 0.13 -2.13 0.20 0.00 0.35 0.00 0.00 41.96 40.51 1oac s TYR 608 CO 0.63 -0.87 1.15 0.00 -1.34 0.00 0.00 175.55 175.12 1oac n ALA 609 N 4.53 2.22 0.00 3.97 0.00 -0.29 -4.91 120.51 126.03 1oac n ALA 609 Ca -0.04 -1.48 0.00 0.00 0.00 0.00 0.00 53.44 51.92 1oac n ALA 609 Cb 0.43 -0.28 0.00 0.00 0.00 0.00 0.00 19.45 19.60 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 -0.37 2.20 3.61 0.00 0.00 -1.24 -4.77 105.19 104.62 1oac n GLY 610 Ca 0.09 -2.19 -0.01 0.00 0.00 0.00 0.00 46.02 43.91 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 -0.33 0.00 -0.02 0.00 -1.26 -0.68 107.32 105.03 1oac s GLY 611 Ca 0.00 1.41 0.24 0.00 0.00 0.00 0.00 44.72 46.37 1oac s GLY 611 CO 0.00 0.42 1.27 -1.30 0.00 0.00 0.00 173.10 173.49 1oac n THR 612 N -0.22 0.00 -4.41 0.90 -2.24 -0.16 -4.89 114.28 103.26 1oac n THR 612 Ca -0.02 -0.17 -0.24 0.00 -2.27 0.00 0.00 64.05 61.36 1oac n THR 612 Cb 0.60 0.85 -0.09 0.00 -2.10 0.00 0.00 70.33 69.58 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 -2.58 2.43 0.30 4.78 4.02 -1.26 -4.96 115.29 118.02 1oac s HIS 613 Ca 0.19 -0.31 -0.28 0.00 1.02 0.00 0.00 55.06 55.68 1oac s HIS 613 Cb 0.18 -1.10 -0.14 0.00 -1.02 0.00 0.00 32.58 30.50 1oac s HIS 613 CO 0.59 0.67 1.01 -2.30 1.02 0.00 0.00 174.74 175.73 1oac n PRO 614 N -0.73 1.35 -2.87 8.40 -0.02 -1.26 -4.84 135.00 135.03 1oac n PRO 614 Ca -0.05 0.47 -0.34 0.00 -2.02 0.00 0.00 63.50 61.56 1oac n PRO 614 Cb 0.60 -1.85 -0.07 0.00 -0.02 0.00 0.00 33.50 32.16 1oac n PRO 614 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1oac s VAL 615 N -1.07 4.40 -0.34 -1.45 0.11 -1.26 -0.96 120.40 119.83 1oac s VAL 615 Ca 0.59 1.48 -0.22 0.00 -2.93 0.00 0.00 61.98 60.89 1oac s VAL 615 Cb -0.69 -3.70 0.00 0.00 -1.53 0.00 0.00 36.38 30.46 1oac s VAL 615 CO 0.60 -0.17 0.74 0.00 -3.33 0.00 0.00 175.10 172.93 1oac s ALA 616 N -2.00 3.48 0.10 1.54 0.00 -0.71 -4.38 121.76 119.79 1oac s ALA 616 Ca 0.57 -0.62 -0.02 0.00 0.00 0.00 0.00 51.96 51.89 1oac s ALA 616 Cb -0.12 -3.28 -0.20 0.00 0.00 0.00 0.00 23.12 19.52 1oac s ALA 616 CO 0.16 -1.32 1.22 0.87 0.00 0.00 0.00 175.76 176.69 1oac h LYS 617 N 8.33 0.26 0.00 0.00 1.57 -1.95 -3.43 116.57 121.35 1oac h LYS 617 Ca -0.25 -0.38 0.00 0.00 -1.87 0.00 0.00 60.65 58.15 1oac h LYS 617 Cb 1.10 0.13 0.00 0.00 0.08 0.00 0.00 32.23 33.54 1oac h LYS 617 CO 0.88 1.14 0.00 0.41 -0.57 0.00 0.00 179.45 181.31 1oac n GLY 618 N 1.32 1.97 3.71 3.86 0.00 -1.26 -4.89 105.19 109.88 1oac n GLY 618 Ca -0.07 -0.69 -0.42 0.00 0.00 0.00 0.00 46.02 44.84 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 3.46 -0.60 4.61 0.00 -1.24 -4.91 121.76 122.09 1oac s ALA 619 Ca 0.00 0.86 -0.06 0.00 0.00 0.00 0.00 51.96 52.76 1oac s ALA 619 Cb 0.00 -3.49 -0.08 0.00 0.00 0.00 0.00 23.12 19.56 1oac s ALA 619 CO 0.00 -0.56 3.07 1.04 0.00 0.00 0.00 175.76 179.30 1oac n GLN 620 N 4.28 2.78 -4.17 0.00 1.13 -1.26 -4.85 117.38 115.29 1oac n GLN 620 Ca 0.10 -1.99 -0.17 0.00 -1.94 0.00 0.00 57.00 53.01 1oac n GLN 620 Cb 0.45 -2.26 -0.12 0.00 0.11 0.00 0.00 30.24 28.42 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 -0.02 0.98 0.61 1.08 0.08 -1.26 -5.02 117.98 114.44 1oac s PHE 621 Ca 0.63 -0.43 -0.17 0.00 0.12 0.00 0.00 56.93 57.08 1oac s PHE 621 Cb 0.30 -0.57 -0.02 0.00 -0.57 0.00 0.00 43.02 42.15 1oac s PHE 621 CO -0.10 0.00 1.15 0.00 -0.10 0.00 0.00 175.22 176.17 1oac s ALA 622 N -1.15 2.52 -0.85 5.36 0.00 -1.26 -4.89 121.76 121.49 1oac s ALA 622 Ca -0.04 0.78 0.15 0.00 0.00 0.00 0.00 51.96 52.86 1oac s ALA 622 Cb -0.09 -3.38 0.64 0.00 0.00 0.00 0.00 23.12 20.29 1oac s ALA 622 CO 0.01 -1.15 1.47 -0.35 0.00 0.00 0.00 175.76 175.74 1oac n PRO 623 N -1.89 0.05 0.00 0.00 -0.04 -1.26 -1.77 135.00 130.09 1oac n PRO 623 Ca 0.12 0.34 0.14 0.00 -0.04 0.00 0.00 63.50 64.06 1oac n PRO 623 Cb 0.51 -1.60 0.53 0.00 -0.04 0.00 0.00 33.50 32.89 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 -1.69 1.31 -4.75 3.54 5.75 -1.26 -4.69 116.55 114.75 1oac n ASP 624 Ca 0.03 -1.34 -0.41 0.00 -0.01 0.00 0.00 54.79 53.06 1oac n ASP 624 Cb 0.15 0.02 -0.04 0.00 -1.03 0.00 0.00 41.12 40.22 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 -2.10 4.61 0.22 0.11 0.41 -0.73 -4.96 118.70 116.26 1oac s GLU 625 Ca 0.36 1.81 -0.09 0.00 -0.41 0.00 0.00 54.97 56.64 1oac s GLU 625 Cb 0.21 -3.21 0.23 0.00 -1.78 0.00 0.00 34.13 29.58 1oac s GLU 625 CO 0.37 0.15 1.85 -1.49 -0.49 0.00 0.00 175.26 175.64 1oac h TRP 626 N 4.20 0.86 -0.80 1.61 4.06 -1.89 -1.31 115.95 122.67 1oac h TRP 626 Ca -0.46 0.02 0.04 0.00 2.06 0.00 0.00 58.89 60.55 1oac h TRP 626 Cb 1.21 -0.28 -0.05 0.00 -1.00 0.00 0.00 29.16 29.04 1oac h TRP 626 CO 0.60 0.47 0.50 0.97 -3.56 0.00 0.00 178.44 177.42 1oac h ILE 627 N 0.88 1.10 -0.31 1.49 2.10 -1.93 0.47 117.51 121.29 1oac h ILE 627 Ca 0.31 -0.33 0.02 0.00 1.08 0.00 0.00 64.86 65.94 1oac h ILE 627 Cb 0.08 0.05 -0.03 0.00 -1.09 0.00 0.00 36.82 35.83 1oac h ILE 627 CO -0.13 0.18 0.16 0.22 -1.08 0.00 0.00 178.15 177.49 1oac h TYR 628 N 0.97 0.29 -0.30 2.19 5.03 -1.79 0.59 116.97 123.95 1oac h TYR 628 Ca 0.33 0.01 -0.03 0.00 2.58 0.00 0.00 58.73 61.62 1oac h TYR 628 Cb 0.05 -0.08 -0.01 0.00 1.55 0.00 0.00 36.73 38.24 1oac h TYR 628 CO -0.03 0.16 0.06 1.25 -1.32 0.00 0.00 178.16 178.28 1oac h HIS 629 N 0.33 0.51 -0.12 -3.82 2.76 0.03 -3.22 115.15 111.61 1oac h HIS 629 Ca 0.13 -0.07 -0.12 0.00 -2.20 0.00 0.00 60.37 58.11 1oac h HIS 629 Cb 0.05 -0.14 -0.01 0.00 1.55 0.00 0.00 27.41 28.85 1oac h HIS 629 CO -0.10 0.56 -0.46 0.00 -1.30 0.00 0.00 177.93 176.63 1oac h ARG 630 N 0.31 0.30 -2.97 5.26 3.08 0.06 -3.38 114.38 117.04 1oac h ARG 630 Ca 0.09 -0.16 -0.62 0.00 0.07 0.00 0.00 59.98 59.37 1oac h ARG 630 Cb 0.31 0.01 -0.41 0.00 0.08 0.00 0.00 29.97 29.96 1oac h ARG 630 CO 0.00 0.70 -0.64 -0.51 -1.07 0.00 0.00 179.97 178.45 1oac s LEU 631 N -8.22 4.25 0.42 3.04 1.43 0.18 -3.82 118.68 115.96 1oac s LEU 631 Ca -0.05 -3.71 0.28 0.00 -1.03 0.00 0.00 54.13 49.63 1oac s LEU 631 Cb 0.13 -1.44 1.03 0.00 0.03 0.00 0.00 46.19 45.94 1oac s LEU 631 CO 0.79 -0.10 1.83 0.77 0.23 0.00 0.00 176.35 179.86 1oac h SER 632 N 5.46 0.00 -0.19 2.29 4.64 -1.77 -3.18 113.55 120.80 1oac h SER 632 Ca 0.16 0.00 0.05 0.00 -0.47 0.00 0.00 61.79 61.53 1oac h SER 632 Cb 0.78 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.86 1oac h SER 632 CO 0.66 0.00 0.14 2.19 -0.87 0.00 0.00 176.83 178.95 1oac h PHE 633 N 0.00 0.00 -0.04 4.77 -0.00 -1.92 -2.83 116.94 116.92 1oac h PHE 633 Ca 0.00 0.00 -0.03 0.00 -0.00 0.00 0.00 57.97 57.94 1oac h PHE 633 Cb 0.58 0.00 -0.01 0.00 -0.00 0.00 0.00 35.95 36.52 1oac h PHE 633 CO 0.00 0.00 -0.12 0.52 -0.00 0.00 0.00 178.31 178.71 1oac h MET 634 N 0.00 0.06 0.00 6.09 2.86 -1.94 -3.31 114.93 118.69 1oac h MET 634 Ca 0.09 -0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.72 1oac h MET 634 Cb 0.37 -0.01 0.00 0.00 0.06 0.00 0.00 31.60 32.02 1oac h MET 634 CO -0.00 0.19 -0.99 -3.47 1.06 0.00 0.00 176.91 173.70 1oac n ASP 635 N -4.36 0.68 -4.39 1.22 2.03 -1.07 -3.62 116.55 107.05 1oac n ASP 635 Ca -0.02 -0.48 -0.30 0.00 0.52 0.00 0.00 54.79 54.51 1oac n ASP 635 Cb 0.22 0.85 -0.14 0.00 -0.72 0.00 0.00 41.12 41.33 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 -3.11 1.76 0.01 -0.67 -0.14 -1.25 -4.68 119.74 111.66 1oac s LYS 636 Ca 0.06 -1.15 0.17 0.00 -1.36 0.00 0.00 55.97 53.69 1oac s LYS 636 Cb 0.15 -2.01 -0.17 0.00 -1.68 0.00 0.00 37.83 34.12 1oac s LYS 636 CO 0.81 0.50 0.69 1.04 -0.76 0.00 0.00 175.35 177.64 1oac n GLN 637 N 1.46 0.63 -4.62 1.68 3.00 -0.38 -4.52 117.38 114.63 1oac n GLN 637 Ca -0.17 0.17 -0.24 0.00 -0.01 0.00 0.00 57.00 56.75 1oac n GLN 637 Cb 0.52 -1.75 -0.16 0.00 0.00 0.00 0.00 30.24 28.85 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 -5.69 1.74 -0.02 1.08 2.96 -0.40 -0.96 118.68 117.41 1oac s LEU 638 Ca -0.04 -0.30 0.01 0.00 -0.22 0.00 0.00 54.13 53.58 1oac s LEU 638 Cb 0.09 -0.82 0.01 0.00 0.50 0.00 0.00 46.19 45.97 1oac s LEU 638 CO 0.82 0.07 -0.01 0.26 -1.32 0.00 0.00 176.35 176.17 1oac s TRP 639 N 0.42 0.29 -0.09 5.38 0.52 -0.86 0.41 118.94 125.01 1oac s TRP 639 Ca -0.10 -0.03 -0.00 0.00 0.02 0.00 0.00 56.10 55.99 1oac s TRP 639 Cb -0.13 -0.29 0.02 0.00 -1.15 0.00 0.00 33.47 31.92 1oac s TRP 639 CO 0.03 -0.07 -0.06 0.08 0.02 0.00 0.00 176.95 176.96 1oac s VAL 640 N 0.47 0.80 0.26 4.03 1.01 -1.26 -0.58 120.40 125.13 1oac s VAL 640 Ca -0.05 -0.17 0.12 0.00 0.00 0.00 0.00 61.98 61.88 1oac s VAL 640 Cb -0.07 -0.84 -0.05 0.00 0.00 0.00 0.00 36.38 35.41 1oac s VAL 640 CO -0.01 0.32 -0.21 0.42 0.00 0.00 0.00 175.10 175.62 1oac s THR 641 N 1.59 2.44 0.30 3.92 -4.23 0.26 -4.58 115.64 115.34 1oac s THR 641 Ca 0.01 -2.34 -0.28 0.00 -1.18 0.00 0.00 61.69 57.90 1oac s THR 641 Cb -0.13 -2.26 -0.09 0.00 1.34 0.00 0.00 72.50 71.35 1oac s THR 641 CO -0.05 -0.35 1.03 -0.60 -0.54 0.00 0.00 174.62 174.11 1oac s ARG 642 N -3.36 4.61 0.10 3.99 6.06 -1.26 0.08 118.95 129.17 1oac s ARG 642 Ca 0.28 1.63 -0.31 0.00 -2.50 0.00 0.00 55.73 54.83 1oac s ARG 642 Cb -0.05 -3.06 -0.09 0.00 0.06 0.00 0.00 34.95 31.80 1oac s ARG 642 CO 0.14 0.23 1.73 -0.47 -2.50 0.00 0.00 175.30 174.43 1oac s TYR 643 N -1.30 2.34 -0.13 5.12 5.04 0.08 -4.78 117.35 123.72 1oac s TYR 643 Ca 0.47 0.18 -0.04 0.00 -2.44 0.00 0.00 57.07 55.24 1oac s TYR 643 Cb -0.27 -4.06 0.06 0.00 0.35 0.00 0.00 41.96 38.04 1oac s TYR 643 CO 0.35 -4.30 0.22 -1.01 -1.34 0.00 0.00 175.55 169.47 1oac s HIS 644 N 2.57 -0.31 0.32 4.97 3.76 -1.26 -5.03 115.29 120.32 1oac s HIS 644 Ca 0.77 0.69 0.08 0.00 -0.15 0.00 0.00 55.06 56.44 1oac s HIS 644 Cb -0.43 -0.18 0.92 0.00 1.11 0.00 0.00 32.58 34.00 1oac s HIS 644 CO 0.34 -0.38 1.59 -1.35 -0.85 0.00 0.00 174.74 174.10 1oac h PRO 645 N 8.32 0.06 -0.09 8.40 0.11 -2.04 0.75 132.00 147.51 1oac h PRO 645 Ca -0.14 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.96 1oac h PRO 645 Cb 1.12 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.22 1oac h PRO 645 CO 0.17 0.04 0.00 0.41 -0.21 0.00 0.00 178.00 178.41 1oac n GLY 646 N -1.40 0.14 3.44 -0.55 0.00 -1.26 -4.75 105.19 100.81 1oac n GLY 646 Ca 0.27 -0.43 -0.43 0.00 0.00 0.00 0.00 46.02 45.43 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 -1.89 3.11 0.00 1.61 2.02 0.25 -4.79 118.70 119.01 1oac s GLU 647 Ca 0.35 -0.90 0.00 0.00 0.02 0.00 0.00 54.97 54.45 1oac s GLU 647 Cb 0.19 -4.22 0.00 0.00 0.10 0.00 0.00 34.13 30.20 1oac s GLU 647 CO 0.30 -1.74 0.00 0.54 0.02 0.00 0.00 175.26 174.38 1oac n ARG 648 N 7.42 3.19 -4.74 1.61 1.74 -1.26 -4.86 116.66 119.75 1oac n ARG 648 Ca -0.05 0.00 -0.31 0.00 -0.77 0.00 0.00 57.85 56.72 1oac n ARG 648 Cb 0.45 -0.43 -0.17 0.00 -1.02 0.00 0.00 32.46 31.29 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 -0.62 2.42 0.39 -1.55 0.08 -1.26 -4.81 117.98 112.63 1oac s PHE 649 Ca 0.00 -1.14 0.06 0.00 0.12 0.00 0.00 56.93 55.97 1oac s PHE 649 Cb 0.00 -1.66 0.79 0.00 -0.57 0.00 0.00 43.02 41.58 1oac s PHE 649 CO 0.00 -0.52 2.04 -1.00 -0.10 0.00 0.00 175.22 175.64 1oac h PRO 650 N 7.19 0.63 -0.03 0.24 0.13 -1.94 -2.08 132.00 136.13 1oac h PRO 650 Ca -0.29 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 64.80 1oac h PRO 650 Cb 1.20 -0.14 0.00 0.00 0.13 0.00 0.00 31.00 32.19 1oac h PRO 650 CO 0.52 0.42 0.00 -0.85 -0.23 0.00 0.00 178.00 177.86 1oac n GLU 651 N -4.46 1.81 0.00 0.86 0.00 -1.26 0.08 120.64 117.67 1oac n GLU 651 Ca 0.04 -1.18 0.00 0.00 0.00 0.00 0.00 57.16 56.02 1oac n GLU 651 Cb 0.06 -1.47 0.00 0.00 0.00 0.00 0.00 31.44 30.03 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 1.21 -0.35 0.17 -1.84 0.00 -0.78 -4.22 105.19 99.39 1oac n GLY 652 Ca 0.18 -1.64 -0.07 0.00 0.00 0.00 0.00 46.02 44.48 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 0.46 -3.02 1.61 3.64 -1.81 -3.34 116.57 114.10 1oac h LYS 653 Ca 0.00 -0.03 -0.62 0.00 -1.27 0.00 0.00 60.65 58.73 1oac h LYS 653 Cb 0.00 -0.10 -0.41 0.00 -0.41 0.00 0.00 32.23 31.30 1oac h LYS 653 CO 0.00 0.30 -0.63 0.71 -2.27 0.00 0.00 179.45 177.56 1oac s TYR 654 N -6.16 3.20 -1.11 1.91 2.02 -1.26 -4.96 117.35 110.99 1oac s TYR 654 Ca -0.13 -3.18 0.24 0.00 -0.37 0.00 0.00 57.07 53.63 1oac s TYR 654 Cb 0.11 -2.48 1.06 0.00 -0.40 0.00 0.00 41.96 40.25 1oac s TYR 654 CO 0.72 -0.60 1.76 -0.35 -1.57 0.00 0.00 175.55 175.51 1oac n PRO 655 N 2.22 0.09 -2.01 -1.71 -0.04 -1.26 -4.49 135.00 127.80 1oac n PRO 655 Ca 0.19 0.09 -0.43 0.00 -0.04 0.00 0.00 63.50 63.31 1oac n PRO 655 Cb 0.36 -1.50 -0.03 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 -2.89 6.25 -1.72 3.54 2.47 -1.26 -2.69 114.94 118.64 1oac s ASN 656 Ca 0.14 1.71 -0.01 0.00 0.42 0.00 0.00 52.86 55.12 1oac s ASN 656 Cb 0.16 -2.53 0.00 0.00 -1.45 0.00 0.00 41.25 37.43 1oac s ASN 656 CO 0.41 -1.35 0.18 0.54 -3.72 0.00 0.00 177.10 173.16 1oac n ARG 657 N 7.82 -2.63 -2.03 0.43 1.74 -1.26 -4.14 116.66 116.59 1oac n ARG 657 Ca 0.20 0.98 -0.34 0.00 -0.77 0.00 0.00 57.85 57.92 1oac n ARG 657 Cb 0.45 -5.70 0.02 0.00 -1.02 0.00 0.00 32.46 26.21 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 -2.24 5.42 0.00 0.55 1.04 -1.10 -4.83 113.70 112.54 1oac s SER 658 Ca 0.09 2.12 0.13 0.00 0.48 0.00 0.00 55.95 58.76 1oac s SER 658 Cb -0.04 -2.57 -0.01 0.00 0.10 0.00 0.00 66.02 63.50 1oac s SER 658 CO 0.11 -1.42 0.72 0.35 0.98 0.00 0.00 173.24 173.97 1oac n THR 659 N -1.80 0.00 -3.83 2.02 -2.24 -1.26 -4.55 114.28 102.62 1oac n THR 659 Ca 0.11 -0.36 -0.06 0.00 -2.27 0.00 0.00 64.05 61.48 1oac n THR 659 Cb 0.51 1.14 0.01 0.00 -2.10 0.00 0.00 70.33 69.89 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 -1.63 0.04 -0.52 4.78 -3.43 -1.26 -4.89 115.29 108.37 1oac s HIS 660 Ca 0.10 -0.54 -0.26 0.00 -0.80 0.00 0.00 55.06 53.56 1oac s HIS 660 Cb 0.10 0.75 0.03 0.00 -1.43 0.00 0.00 32.58 32.03 1oac s HIS 660 CO 0.33 -1.20 1.02 0.34 -2.00 0.00 0.00 174.74 173.22 1oac s ASP 661 N -3.16 6.44 0.00 7.38 -1.08 -1.25 -4.83 116.67 120.17 1oac s ASP 661 Ca 0.17 -0.02 0.18 0.00 -0.52 0.00 0.00 52.55 52.35 1oac s ASP 661 Cb -0.04 -2.48 0.23 0.00 -1.46 0.00 0.00 42.92 39.18 1oac s ASP 661 CO 0.07 -1.24 1.16 0.35 0.52 0.00 0.00 175.17 176.04 1oac n THR 662 N 6.44 0.26 0.00 1.71 -2.24 -1.26 -3.50 114.28 115.69 1oac n THR 662 Ca 0.06 -0.63 0.00 0.00 -2.27 0.00 0.00 64.05 61.21 1oac n THR 662 Cb 0.48 1.15 0.00 0.00 -2.10 0.00 0.00 70.33 69.86 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 1.05 0.57 0.34 3.38 0.00 -1.26 -4.27 105.19 105.00 1oac n GLY 663 Ca 0.13 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.24 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 0.44 -0.34 0.99 3.38 -0.53 -1.07 115.31 118.18 1oac h LEU 664 Ca 0.00 0.00 0.05 0.00 0.09 0.00 0.00 57.88 58.02 1oac h LEU 664 Cb 0.00 -0.09 -0.05 0.00 0.09 0.00 0.00 40.66 40.61 1oac h LEU 664 CO 0.00 0.28 0.06 1.23 0.09 0.00 0.00 178.44 180.10 1oac h GLY 665 N 0.50 0.39 0.91 0.83 0.00 -1.84 -2.12 103.07 101.74 1oac h GLY 665 Ca 0.26 -0.02 -0.08 0.00 0.00 0.00 0.00 47.33 47.49 1oac h GLY 665 CO -0.07 -0.03 -0.12 -1.61 0.00 0.00 0.00 176.54 174.71 1oac h GLN 666 N 0.18 0.62 -0.40 4.80 4.15 -1.28 -2.53 115.11 120.65 1oac h GLN 666 Ca 0.16 -0.26 -0.02 0.00 0.77 0.00 0.00 58.65 59.31 1oac h GLN 666 Cb 0.19 -0.02 -0.02 0.00 0.21 0.00 0.00 27.48 27.83 1oac h GLN 666 CO -0.22 0.83 0.18 1.88 -1.93 0.00 0.00 178.83 179.57 1oac h TYR 667 N 0.38 0.54 -0.01 3.99 0.05 -1.09 -2.80 116.97 118.03 1oac h TYR 667 Ca 0.07 -0.01 0.00 0.00 0.05 0.00 0.00 58.73 58.84 1oac h TYR 667 Cb 0.63 -0.17 0.00 0.00 1.01 0.00 0.00 36.73 38.20 1oac h TYR 667 CO 0.06 0.41 -0.56 -1.13 -1.05 0.00 0.00 178.16 175.89 1oac n SER 668 N -4.40 1.10 -0.30 3.88 3.41 -0.81 -4.44 113.62 112.06 1oac n SER 668 Ca 0.03 -0.88 -0.01 0.00 -0.26 0.00 0.00 58.87 57.74 1oac n SER 668 Cb 0.12 0.46 0.11 0.00 -0.26 0.00 0.00 64.21 64.64 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 0.85 0.98 0.00 4.33 1.63 -1.16 -1.39 116.57 121.80 1oac h LYS 669 Ca 0.00 -0.06 0.00 0.00 -0.85 0.00 0.00 60.65 59.74 1oac h LYS 669 Cb 0.56 -0.22 0.00 0.00 -0.60 0.00 0.00 32.23 31.97 1oac h LYS 669 CO 0.00 0.65 0.00 -0.40 -3.45 0.00 0.00 179.45 176.25 1oac n ASP 670 N -4.59 0.00 -4.04 4.20 5.75 -1.26 -4.94 116.55 111.67 1oac n ASP 670 Ca 0.10 0.03 -0.43 0.00 -0.01 0.00 0.00 54.79 54.49 1oac n ASP 670 Cb 0.11 -0.32 0.01 0.00 -1.03 0.00 0.00 41.12 39.89 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 -1.32 -3.73 -4.79 -1.12 4.05 -0.52 -4.94 115.26 102.88 1oac n ASN 671 Ca 0.11 -1.25 -0.31 0.00 0.45 0.00 0.00 54.58 53.57 1oac n ASN 671 Cb 0.21 -1.96 0.07 0.00 1.23 0.00 0.00 39.78 39.33 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 -7.20 2.62 0.27 1.20 2.02 -1.26 -4.50 118.70 111.85 1oac s GLU 672 Ca 0.43 1.11 -0.29 0.00 0.02 0.00 0.00 54.97 56.24 1oac s GLU 672 Cb -0.22 -1.94 -0.10 0.00 0.10 0.00 0.00 34.13 31.97 1oac s GLU 672 CO 0.96 -1.36 1.29 0.45 0.02 0.00 0.00 175.26 176.62 1oac s SER 673 N -3.42 6.87 -0.23 -0.19 0.15 -1.26 -1.15 113.70 114.47 1oac s SER 673 Ca 0.61 2.53 0.13 0.00 0.70 0.00 0.00 55.95 59.92 1oac s SER 673 Cb -0.16 -2.63 0.52 0.00 -1.71 0.00 0.00 66.02 62.04 1oac s SER 673 CO 0.53 -0.50 1.45 0.18 1.20 0.00 0.00 173.24 176.11 1oac n LEU 674 N 1.63 4.05 -4.51 3.45 4.77 0.16 -4.89 117.00 121.68 1oac n LEU 674 Ca 0.03 -3.32 -0.43 0.00 -0.03 0.00 0.00 56.01 52.26 1oac n LEU 674 Cb 0.42 -0.59 -0.05 0.00 -2.33 0.00 0.00 43.42 40.87 1oac n LEU 674 CO 0.58 0.90 0.54 -0.62 -1.33 0.00 0.00 177.39 177.46 1oac s ASP 675 N -2.15 6.32 -1.21 -1.43 2.15 -1.26 -4.22 116.67 114.88 1oac s ASP 675 Ca 0.43 -0.44 -0.10 0.00 0.43 0.00 0.00 52.55 52.87 1oac s ASP 675 Cb 0.37 -2.37 -0.01 0.00 -0.30 0.00 0.00 42.92 40.61 1oac s ASP 675 CO 0.06 -0.99 0.73 -3.20 -0.17 0.00 0.00 175.17 171.60 1oac n ASN 676 N 6.76 -3.62 -3.69 -0.34 4.05 -0.76 -5.00 115.26 112.65 1oac n ASN 676 Ca -0.01 -0.92 -0.19 0.00 0.45 0.00 0.00 54.58 53.92 1oac n ASN 676 Cb 0.47 -3.78 -0.09 0.00 1.23 0.00 0.00 39.78 37.62 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 -3.58 0.13 -0.50 -0.44 -1.32 0.35 -4.54 115.64 105.74 1oac s THR 677 Ca 0.27 -2.00 -0.28 0.00 -1.21 0.00 0.00 61.69 58.47 1oac s THR 677 Cb -0.08 -2.48 0.01 0.00 -1.51 0.00 0.00 72.50 68.43 1oac s THR 677 CO 0.83 0.00 1.43 -0.62 -2.21 0.00 0.00 174.62 174.06 1oac s ASP 678 N -3.37 6.18 0.19 8.08 -1.08 -1.23 -0.31 116.67 125.13 1oac s ASP 678 Ca 0.38 0.51 0.05 0.00 -0.52 0.00 0.00 52.55 52.97 1oac s ASP 678 Cb 0.04 -2.54 -0.04 0.00 -1.46 0.00 0.00 42.92 38.92 1oac s ASP 678 CO 0.22 -1.62 0.17 0.00 0.52 0.00 0.00 175.17 174.45 1oac s ALA 679 N 5.92 3.60 -0.09 3.66 0.00 -1.26 -0.74 121.76 132.85 1oac s ALA 679 Ca 0.57 -1.26 0.02 0.00 0.00 0.00 0.00 51.96 51.29 1oac s ALA 679 Cb -0.12 -1.38 0.01 0.00 0.00 0.00 0.00 23.12 21.63 1oac s ALA 679 CO 0.28 0.43 -0.15 0.08 0.00 0.00 0.00 175.76 176.40 1oac s VAL 680 N -1.86 1.43 -0.12 0.00 1.01 0.11 -4.31 120.40 116.66 1oac s VAL 680 Ca 0.32 -0.62 -0.07 0.00 0.00 0.00 0.00 61.98 61.61 1oac s VAL 680 Cb -0.09 -1.29 -0.04 0.00 0.00 0.00 0.00 36.38 34.95 1oac s VAL 680 CO 0.24 0.42 0.12 -0.69 0.00 0.00 0.00 175.10 175.19 1oac s VAL 681 N 0.81 5.31 -0.11 2.92 1.01 -0.30 -0.57 120.40 129.46 1oac s VAL 681 Ca -0.11 0.14 0.01 0.00 0.00 0.00 0.00 61.98 62.02 1oac s VAL 681 Cb -0.16 -3.32 0.02 0.00 0.00 0.00 0.00 36.38 32.92 1oac s VAL 681 CO 0.02 0.60 -0.15 0.26 0.00 0.00 0.00 175.10 175.82 1oac s TRP 682 N -0.83 1.99 -0.14 5.22 0.52 0.25 -0.39 118.94 125.57 1oac s TRP 682 Ca 0.14 -0.96 -0.01 0.00 0.02 0.00 0.00 56.10 55.29 1oac s TRP 682 Cb -0.12 -1.44 -0.01 0.00 -1.15 0.00 0.00 33.47 30.74 1oac s TRP 682 CO 0.03 -0.51 -0.12 -1.64 0.02 0.00 0.00 176.95 174.73 1oac s MET 683 N 1.08 3.39 -0.13 4.98 -1.94 -0.15 -2.02 119.30 124.51 1oac s MET 683 Ca -0.05 -0.68 -0.03 0.00 -1.71 0.00 0.00 55.69 53.23 1oac s MET 683 Cb -0.15 -2.67 -0.03 0.00 2.01 0.00 0.00 34.83 33.99 1oac s MET 683 CO -0.03 0.18 -0.02 0.99 -0.01 0.00 0.00 175.02 176.13 1oac s THR 684 N 0.45 4.09 0.08 2.05 2.01 -0.13 -0.06 115.64 124.12 1oac s THR 684 Ca -0.09 -0.30 -0.14 0.00 0.31 0.00 0.00 61.69 61.47 1oac s THR 684 Cb -0.16 -2.76 0.02 0.00 0.01 0.00 0.00 72.50 69.61 1oac s THR 684 CO 0.05 0.53 0.32 0.28 -0.69 0.00 0.00 174.62 175.11 1oac s THR 685 N -0.11 0.09 -0.20 -0.82 -1.32 0.08 -4.53 115.64 108.83 1oac s THR 685 Ca 0.03 -0.73 0.00 0.00 -1.21 0.00 0.00 61.69 59.78 1oac s THR 685 Cb -0.13 -1.09 0.00 0.00 -1.51 0.00 0.00 72.50 69.77 1oac s THR 685 CO 0.02 -0.40 0.00 0.61 -2.21 0.00 0.00 174.62 172.64 1oac n GLY 686 N 0.19 -1.23 3.38 6.08 0.00 -1.26 0.89 105.19 113.25 1oac n GLY 686 Ca -0.17 -0.86 -0.19 0.00 0.00 0.00 0.00 46.02 44.80 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 -2.81 1.04 -0.27 2.61 -4.23 -0.42 -1.74 115.64 109.82 1oac s THR 687 Ca 0.00 -2.02 -0.01 0.00 -1.18 0.00 0.00 61.69 58.48 1oac s THR 687 Cb 0.00 -2.60 0.04 0.00 1.34 0.00 0.00 72.50 71.28 1oac s THR 687 CO 0.00 -0.12 -0.04 -0.89 -0.54 0.00 0.00 174.62 173.03 1oac s THR 688 N -3.41 2.87 -0.47 3.99 2.01 -0.13 -1.60 115.64 118.90 1oac s THR 688 Ca 0.34 -1.23 -0.16 0.00 0.31 0.00 0.00 61.69 60.95 1oac s THR 688 Cb 0.07 -2.56 0.07 0.00 0.01 0.00 0.00 72.50 70.09 1oac s THR 688 CO 0.13 0.05 0.42 -2.28 -0.69 0.00 0.00 174.62 172.25 1oac s HIS 689 N 1.28 3.22 -0.24 4.92 5.04 -0.01 -4.03 115.29 125.46 1oac s HIS 689 Ca -0.03 -0.84 -0.08 0.00 -1.54 0.00 0.00 55.06 52.57 1oac s HIS 689 Cb -0.18 -3.19 -0.04 0.00 0.04 0.00 0.00 32.58 29.22 1oac s HIS 689 CO -0.03 -0.82 0.09 0.08 -2.34 0.00 0.00 174.74 171.73 1oac s VAL 690 N 1.79 4.63 0.61 0.89 1.01 -1.26 -2.54 120.40 125.53 1oac s VAL 690 Ca 0.06 -0.07 -0.09 0.00 0.00 0.00 0.00 61.98 61.87 1oac s VAL 690 Cb -0.23 -3.16 -0.02 0.00 0.00 0.00 0.00 36.38 32.97 1oac s VAL 690 CO 0.08 0.34 0.99 0.00 0.00 0.00 0.00 175.10 176.51 1oac s ALA 691 N 1.38 3.13 0.08 5.51 0.00 -1.26 -5.04 121.76 125.55 1oac s ALA 691 Ca 0.06 -0.29 -0.08 0.00 0.00 0.00 0.00 51.96 51.65 1oac s ALA 691 Cb -0.15 -2.93 -0.01 0.00 0.00 0.00 0.00 23.12 20.04 1oac s ALA 691 CO 0.05 -0.74 0.16 -0.98 0.00 0.00 0.00 175.76 174.24 1oac s ARG 692 N -5.12 0.78 0.54 0.00 1.70 -1.26 -4.56 118.95 111.04 1oac s ARG 692 Ca 0.54 -0.95 0.23 0.00 -0.47 0.00 0.00 55.73 55.08 1oac s ARG 692 Cb -0.11 0.31 1.44 0.00 -0.57 0.00 0.00 34.95 36.02 1oac s ARG 692 CO 0.51 -0.23 2.10 0.00 -1.08 0.00 0.00 175.30 176.59 1oac h ALA 693 N 2.92 2.08 0.00 7.88 0.00 -1.87 -2.12 119.26 128.15 1oac h ALA 693 Ca -0.34 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.57 1oac h ALA 693 Cb 1.19 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.00 1oac h ALA 693 CO 0.56 -0.28 0.00 0.93 0.00 0.00 0.00 179.25 180.47 1oac h GLU 694 N 0.00 0.00 -0.57 0.00 3.07 -1.96 -2.72 114.58 112.40 1oac h GLU 694 Ca 0.10 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.96 1oac h GLU 694 Cb 0.44 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.35 1oac h GLU 694 CO -0.00 0.00 0.00 0.39 -1.40 0.00 0.00 179.01 178.00 1oac n GLU 695 N -2.34 3.77 -4.02 2.33 1.02 -0.80 -4.60 120.64 116.01 1oac n GLU 695 Ca -0.01 -2.87 -0.24 0.00 -0.02 0.00 0.00 57.16 54.02 1oac n GLU 695 Cb 0.10 -1.90 -0.17 0.00 -0.02 0.00 0.00 31.44 29.45 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 -2.04 1.11 -0.96 -0.32 -0.11 -1.03 -2.74 118.94 112.85 1oac s TRP 696 Ca 0.49 -0.45 0.28 0.00 1.22 0.00 0.00 56.10 57.65 1oac s TRP 696 Cb 0.33 -0.98 1.17 0.00 -1.50 0.00 0.00 33.47 32.49 1oac s TRP 696 CO 0.21 -0.36 1.90 -0.35 -4.62 0.00 0.00 176.95 173.73 1oac n PRO 697 N 4.64 0.04 -4.14 5.86 -0.04 -1.26 -4.97 135.00 135.14 1oac n PRO 697 Ca -0.15 0.04 -0.15 0.00 -0.04 0.00 0.00 63.50 63.19 1oac n PRO 697 Cb 0.50 -1.55 -0.13 0.00 -0.04 0.00 0.00 33.50 32.28 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 -3.02 0.53 -0.31 0.52 2.07 -1.25 -4.68 121.20 115.06 1oac s ILE 698 Ca 0.13 -0.65 -0.20 0.00 -1.41 0.00 0.00 60.65 58.53 1oac s ILE 698 Cb 0.18 -0.52 -0.01 0.00 0.13 0.00 0.00 42.46 42.24 1oac s ILE 698 CO 0.54 -0.10 0.60 -0.32 -1.91 0.00 0.00 174.94 173.75 1oac s MET 699 N -0.82 3.84 0.32 3.50 -2.45 -0.42 -4.54 119.30 118.73 1oac s MET 699 Ca -0.03 0.19 -0.28 0.00 -1.25 0.00 0.00 55.69 54.32 1oac s MET 699 Cb -0.06 -3.74 -0.13 0.00 1.25 0.00 0.00 34.83 32.15 1oac s MET 699 CO 0.00 -0.58 1.17 -2.30 1.05 0.00 0.00 175.02 174.36 1oac n PRO 700 N 5.84 1.79 -1.67 4.11 -0.02 -1.26 -3.91 135.00 139.89 1oac n PRO 700 Ca -0.02 0.63 -0.46 0.00 -2.02 0.00 0.00 63.50 61.63 1oac n PRO 700 Cb 0.49 -2.12 -0.04 0.00 -0.02 0.00 0.00 33.50 31.81 1oac n PRO 700 CO 0.00 0.00 0.00 2.41 1.98 0.00 0.00 175.50 179.89 1oac n THR 701 N 0.32 0.27 -5.03 3.45 -1.04 -1.26 -4.79 114.28 106.20 1oac n THR 701 Ca 0.07 -0.07 -0.32 0.00 -2.04 0.00 0.00 64.05 61.69 1oac n THR 701 Cb 0.34 -1.48 -0.15 0.00 -1.82 0.00 0.00 70.33 67.23 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 0.51 2.61 0.19 -2.82 0.41 -0.33 -4.93 118.70 114.34 1oac s GLU 702 Ca 0.76 -0.78 0.10 0.00 -0.41 0.00 0.00 54.97 54.64 1oac s GLU 702 Cb -0.69 -2.32 -0.04 0.00 -1.78 0.00 0.00 34.13 29.30 1oac s GLU 702 CO 0.42 0.48 -0.18 -1.58 -0.49 0.00 0.00 175.26 173.91 1oac s TRP 703 N -0.38 2.43 0.03 1.61 0.52 -1.26 -1.26 118.94 120.63 1oac s TRP 703 Ca 0.04 -0.30 0.05 0.00 0.02 0.00 0.00 56.10 55.90 1oac s TRP 703 Cb -0.12 -1.19 -0.02 0.00 -1.15 0.00 0.00 33.47 30.99 1oac s TRP 703 CO 0.02 0.51 -0.14 0.14 0.02 0.00 0.00 176.95 177.50 1oac s VAL 704 N -1.72 1.13 0.02 4.03 -7.23 -0.24 -0.99 120.40 115.40 1oac s VAL 704 Ca 0.23 -0.95 0.07 0.00 -1.81 0.00 0.00 61.98 59.52 1oac s VAL 704 Cb -0.08 -1.02 -0.02 0.00 0.56 0.00 0.00 36.38 35.82 1oac s VAL 704 CO 0.12 0.05 -0.22 -1.00 -0.31 0.00 0.00 175.10 173.75 1oac s HIS 705 N -0.78 1.93 0.13 2.82 0.09 0.14 -1.90 115.29 117.73 1oac s HIS 705 Ca 0.02 -0.38 0.03 0.00 -0.00 0.00 0.00 55.06 54.73 1oac s HIS 705 Cb -0.08 -1.19 -0.04 0.00 -0.00 0.00 0.00 32.58 31.27 1oac s HIS 705 CO 0.01 0.05 -0.07 0.95 -0.00 0.00 0.00 174.74 175.68 1oac s THR 706 N -0.69 0.86 -0.02 1.30 -4.23 -0.45 -1.13 115.64 111.28 1oac s THR 706 Ca 0.08 -1.99 -0.12 0.00 -1.18 0.00 0.00 61.69 58.49 1oac s THR 706 Cb -0.09 -1.82 0.02 0.00 1.34 0.00 0.00 72.50 71.95 1oac s THR 706 CO 0.01 -0.76 0.25 -0.22 -0.54 0.00 0.00 174.62 173.35 1oac s LEU 707 N -3.11 1.09 -0.20 4.79 2.96 -0.26 -2.27 118.68 121.68 1oac s LEU 707 Ca 0.16 0.06 0.01 0.00 -0.22 0.00 0.00 54.13 54.14 1oac s LEU 707 Cb 0.04 1.03 0.04 0.00 0.50 0.00 0.00 46.19 47.80 1oac s LEU 707 CO -0.01 -0.37 -0.10 -0.76 -1.32 0.00 0.00 176.35 173.78 1oac s LEU 708 N -1.12 2.30 -0.02 -0.68 1.43 0.45 -0.39 118.68 120.65 1oac s LEU 708 Ca -0.12 -0.89 0.07 0.00 -1.03 0.00 0.00 54.13 52.16 1oac s LEU 708 Cb -0.05 -1.24 -0.02 0.00 0.03 0.00 0.00 46.19 44.90 1oac s LEU 708 CO 0.03 -0.14 -0.23 -0.54 0.23 0.00 0.00 176.35 175.69 1oac s LYS 709 N 1.39 2.16 0.39 1.70 1.02 -0.62 -1.30 119.74 124.48 1oac s LYS 709 Ca -0.01 -0.90 -0.28 0.00 0.02 0.00 0.00 55.97 54.80 1oac s LYS 709 Cb -0.16 -2.11 -0.11 0.00 -0.52 0.00 0.00 37.83 34.94 1oac s LYS 709 CO -0.08 0.57 1.48 -1.25 -0.92 0.00 0.00 175.35 175.15 1oac s PRO 710 N -0.72 4.04 -0.34 -1.68 0.04 -1.26 -0.70 135.00 134.37 1oac s PRO 710 Ca 0.11 2.56 -0.01 0.00 0.04 0.00 0.00 61.00 63.70 1oac s PRO 710 Cb -0.10 -2.92 0.12 0.00 0.04 0.00 0.00 34.50 31.64 1oac s PRO 710 CO -0.00 -0.58 0.18 -0.46 0.04 0.00 0.00 177.00 176.18 1oac s TRP 711 N -1.13 0.92 -1.32 0.56 -0.11 0.82 -4.76 118.94 113.93 1oac s TRP 711 Ca 0.54 -1.57 0.00 0.00 1.22 0.00 0.00 56.10 56.29 1oac s TRP 711 Cb -0.46 -1.15 0.00 0.00 -1.50 0.00 0.00 33.47 30.36 1oac s TRP 711 CO 0.62 -0.83 0.00 0.09 -4.62 0.00 0.00 176.95 172.22 1oac n ASN 712 N 4.37 -4.45 0.04 5.86 3.02 -1.26 -1.92 115.26 120.92 1oac n ASN 712 Ca 0.05 0.16 -0.20 0.00 -0.03 0.00 0.00 54.58 54.56 1oac n ASN 712 Cb 0.38 -3.40 -0.12 0.00 -0.61 0.00 0.00 39.78 36.03 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 0.81 -1.24 3.10 3.57 -1.85 -3.36 116.94 117.96 1oac h PHE 713 Ca -0.31 -0.48 -0.45 0.00 3.53 0.00 0.00 57.97 60.27 1oac h PHE 713 Cb 1.08 -0.08 0.02 0.00 2.79 0.00 0.00 35.95 39.76 1oac h PHE 713 CO 0.38 1.32 -0.22 -0.06 -2.23 0.00 0.00 178.31 177.49 1oac s PHE 714 N -3.05 2.38 -1.00 0.41 0.08 -1.26 -4.89 117.98 110.65 1oac s PHE 714 Ca -0.12 -0.51 0.21 0.00 0.12 0.00 0.00 56.93 56.64 1oac s PHE 714 Cb 0.04 -2.30 -0.22 0.00 -0.57 0.00 0.00 43.02 39.97 1oac s PHE 714 CO 0.88 -0.61 0.91 -0.25 -0.10 0.00 0.00 175.22 176.05 1oac n ASP 715 N -1.94 0.99 -3.58 1.36 8.00 -1.26 -4.85 116.55 115.27 1oac n ASP 715 Ca 0.10 -0.99 -0.01 0.00 0.71 0.00 0.00 54.79 54.60 1oac n ASP 715 Cb 0.60 0.99 0.00 0.00 -0.02 0.00 0.00 41.12 42.70 1oac n ASP 715 CO 0.00 0.00 0.00 -1.83 -0.39 0.00 0.00 177.20 174.98 1oac s GLU 716 N -3.00 0.97 -0.46 -1.24 -1.05 -1.26 -4.95 118.70 107.70 1oac s GLU 716 Ca 0.08 -0.59 -0.45 0.00 -0.15 0.00 0.00 54.97 53.86 1oac s GLU 716 Cb 0.16 0.30 -0.19 0.00 -0.44 0.00 0.00 34.13 33.96 1oac s GLU 716 CO 0.87 -0.45 1.73 2.41 0.95 0.00 0.00 175.26 180.77 1oac n THR 717 N -0.62 0.05 0.27 1.83 -1.04 -1.26 -4.83 114.28 108.68 1oac n THR 717 Ca -0.04 -0.02 0.16 0.00 -2.04 0.00 0.00 64.05 62.12 1oac n THR 717 Cb 0.60 -0.64 0.61 0.00 -1.82 0.00 0.00 70.33 69.08 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 6.22 0.00 -0.58 -2.82 0.11 -1.97 -3.16 132.00 129.80 1oac h PRO 718 Ca -0.38 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.72 1oac h PRO 718 Cb 1.37 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.47 1oac h PRO 718 CO 1.00 0.02 0.01 0.25 -0.21 0.00 0.00 178.00 179.06 1oac n THR 719 N -3.11 2.78 0.03 -1.15 -2.24 -1.26 -4.47 114.28 104.86 1oac n THR 719 Ca 0.01 -1.43 -0.11 0.00 -2.27 0.00 0.00 64.05 60.25 1oac n THR 719 Cb 0.34 -0.28 0.02 0.00 -2.10 0.00 0.00 70.33 68.30 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 3.94 0.60 0.00 3.22 3.38 -1.94 -3.50 115.31 121.01 1oac h LEU 720 Ca 0.01 -0.37 0.00 0.00 0.09 0.00 0.00 57.88 57.61 1oac h LEU 720 Cb 2.00 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 42.57 1oac h LEU 720 CO 0.50 1.12 0.00 0.61 0.09 0.00 0.00 178.44 180.76 1oac n GLY 721 N 0.50 2.13 3.76 0.83 0.00 -1.26 -5.03 105.19 106.12 1oac n GLY 721 Ca -0.05 -2.15 -0.41 0.00 0.00 0.00 0.00 46.02 43.42 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 -1.85 3.45 -0.33 4.61 0.00 -1.26 -4.96 121.76 121.42 1oac s ALA 722 Ca 0.00 1.06 -0.29 0.00 0.00 0.00 0.00 51.96 52.73 1oac s ALA 722 Cb 0.00 -3.40 0.00 0.00 0.00 0.00 0.00 23.12 19.72 1oac s ALA 722 CO 0.00 -0.38 1.38 -1.17 0.00 0.00 0.00 175.76 175.59 1oac s LEU 723 N -1.50 3.78 0.28 0.00 2.96 -1.26 -4.88 118.68 118.05 1oac s LEU 723 Ca 0.47 1.12 0.06 0.00 -0.22 0.00 0.00 54.13 55.56 1oac s LEU 723 Cb -0.35 -3.54 0.40 0.00 0.50 0.00 0.00 46.19 43.20 1oac s LEU 723 CO 0.46 -1.23 1.66 0.11 -1.32 0.00 0.00 176.35 176.03 1oac h LYS 724 N 9.98 0.23 -6.39 1.98 1.57 -1.98 -3.45 116.57 118.51 1oac h LYS 724 Ca -0.28 -0.12 -0.63 0.00 -1.87 0.00 0.00 60.65 57.76 1oac h LYS 724 Cb 1.11 0.00 -0.25 0.00 0.08 0.00 0.00 32.23 33.17 1oac h LYS 724 CO 1.05 0.65 -0.85 0.15 -0.57 0.00 0.00 179.45 179.88 1oac s LYS 725 N -4.02 1.48 2.87 3.15 1.02 -1.26 -5.07 119.74 117.92 1oac s LYS 725 Ca -0.04 -1.07 0.00 0.00 0.02 0.00 0.00 55.97 54.88 1oac s LYS 725 Cb 0.13 -1.68 0.00 0.00 -0.52 0.00 0.00 37.83 35.76 1oac s LYS 725 CO 0.78 0.42 0.00 -0.25 -0.92 0.00 0.00 175.35 175.38 1oac n ASP 726 N 1.63 0.00 -0.74 2.83 8.00 -1.26 -5.25 116.55 121.76 1oac n ASP 726 Ca -0.17 0.00 0.09 0.00 0.71 0.00 0.00 54.79 55.42 1oac n ASP 726 Cb 0.53 0.00 0.08 0.00 -0.02 0.00 0.00 41.12 41.71 1oac n ASP 726 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10