#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2otg s ASP 7 N 0.00 3.39 0.25 1.20 1.11 -1.26 -4.97 116.67 116.38 2otg s ASP 7 Ca 0.00 1.39 0.23 0.00 0.18 0.00 0.00 52.55 54.35 2otg s ASP 7 Cb 0.00 -2.06 0.16 0.00 1.07 0.00 0.00 42.92 42.09 2otg s ASP 7 CO 0.00 -2.68 1.25 -0.65 1.18 0.00 0.00 175.17 174.27 2otg h PRO 8 N -1.58 0.00 0.00 8.23 0.11 -2.04 -3.01 132.00 133.71 2otg h PRO 8 Ca -0.50 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.61 2otg h PRO 8 Cb 1.29 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.40 2otg h PRO 8 CO 0.56 0.00 0.00 -0.25 -0.21 0.00 0.00 178.00 178.10 2otg n ASP 9 N -2.68 0.00 -0.32 -2.05 8.00 -1.26 -1.65 116.55 116.59 2otg n ASP 9 Ca 0.02 0.39 0.09 0.00 0.71 0.00 0.00 54.79 56.00 2otg n ASP 9 Cb 0.52 -0.44 0.18 0.00 -0.02 0.00 0.00 41.12 41.35 2otg n ASP 9 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 2otg n PHE 10 N -1.44 0.28 0.02 1.24 3.01 -1.14 -4.76 117.46 114.67 2otg n PHE 10 Ca 0.04 -0.98 -0.13 0.00 1.01 0.00 0.00 57.45 57.40 2otg n PHE 10 Cb 0.16 -0.20 -0.08 0.00 -0.01 0.00 0.00 39.48 39.34 2otg n PHE 10 CO 0.00 0.00 0.00 0.37 1.01 0.00 0.00 176.76 178.14 2otg h GLN 11 N 0.53 -0.01 -0.77 -1.08 4.15 -1.43 -3.15 115.11 113.35 2otg h GLN 11 Ca 0.00 0.00 -0.46 0.00 0.77 0.00 0.00 58.65 58.97 2otg h GLN 11 Cb 1.13 0.00 -0.26 0.00 0.21 0.00 0.00 27.48 28.57 2otg h GLN 11 CO 0.07 0.22 0.30 0.66 -1.93 0.00 0.00 178.83 178.15 2otg n TYR 12 N -4.99 2.45 0.00 3.99 4.02 -1.26 -4.58 117.16 116.79 2otg n TYR 12 Ca -0.08 -2.11 0.00 0.00 -0.01 0.00 0.00 57.90 55.70 2otg n TYR 12 Cb 0.14 -0.86 0.00 0.00 -0.02 0.00 0.00 39.34 38.60 2otg n TYR 12 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 176.86 177.13 2otg n LEU 13 N -1.04 2.06 -3.99 7.72 4.77 -1.20 -4.44 117.00 120.89 2otg n LEU 13 Ca 0.50 0.00 -0.21 0.00 -0.03 0.00 0.00 56.01 56.28 2otg n LEU 13 Cb 1.15 0.00 -0.16 0.00 -2.33 0.00 0.00 43.42 42.08 2otg n LEU 13 CO 0.50 0.33 -0.44 0.00 -1.33 0.00 0.00 177.39 176.45 2otg s ALA 14 N -1.85 0.87 0.78 -1.18 0.00 -1.21 -4.58 121.76 114.60 2otg s ALA 14 Ca 0.00 -0.31 0.00 0.00 0.00 0.00 0.00 51.96 51.65 2otg s ALA 14 Cb 0.00 -0.35 0.00 0.00 0.00 0.00 0.00 23.12 22.77 2otg s ALA 14 CO 0.00 0.12 0.00 0.28 0.00 0.00 0.00 175.76 176.16 2otg n VAL 15 N 3.42 0.00 -3.45 0.00 0.31 -1.26 -4.80 118.33 112.55 2otg n VAL 15 Ca -0.19 0.00 -0.39 0.00 -0.01 0.00 0.00 64.34 63.74 2otg n VAL 15 Cb 0.54 -1.78 -0.10 0.00 -0.91 0.00 0.00 33.84 31.59 2otg n VAL 15 CO 0.00 0.00 0.00 -1.81 -1.32 0.00 0.00 176.83 173.70 2otg s ASP 16 N -1.00 6.16 0.31 4.52 -0.00 -1.26 -4.96 116.67 120.44 2otg s ASP 16 Ca 0.00 0.03 -0.00 0.00 -0.00 0.00 0.00 52.55 52.58 2otg s ASP 16 Cb 0.00 -2.18 0.49 0.00 -0.00 0.00 0.00 42.92 41.23 2otg s ASP 16 CO 0.00 -0.20 1.94 0.08 -0.00 0.00 0.00 175.17 176.99 2otg h ARG 17 N 8.32 0.93 0.13 8.23 -0.00 -1.97 0.18 114.38 130.20 2otg h ARG 17 Ca -0.32 -0.09 -0.27 0.00 -0.00 0.00 0.00 59.98 59.30 2otg h ARG 17 Cb 1.16 -0.19 0.00 0.00 -0.00 0.00 0.00 29.97 30.95 2otg h ARG 17 CO 0.63 0.68 -1.36 -0.22 -0.00 0.00 0.00 179.97 179.70 2otg h LYS 18 N 0.94 0.27 -0.18 0.08 3.11 -1.97 -3.04 116.57 115.78 2otg h LYS 18 Ca 0.24 -0.46 -0.11 0.00 -2.81 0.00 0.00 60.65 57.51 2otg h LYS 18 Cb 0.01 0.17 -0.01 0.00 -1.00 0.00 0.00 32.23 31.40 2otg h LYS 18 CO -0.04 1.22 -0.36 -0.22 -2.81 0.00 0.00 179.45 177.24 2otg h LYS 19 N -0.27 0.38 0.00 1.90 3.64 -1.96 -1.09 116.57 119.18 2otg h LYS 19 Ca -0.29 -0.17 -0.06 0.00 -1.27 0.00 0.00 60.65 58.86 2otg h LYS 19 Cb 1.78 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 33.58 2otg h LYS 19 CO 0.09 0.69 -0.29 0.52 -2.27 0.00 0.00 179.45 178.18 2otg h MET 20 N 0.32 0.00 0.00 1.90 0.00 -0.78 -0.69 114.93 115.68 2otg h MET 20 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 59.70 59.74 2otg h MET 20 Cb 0.78 0.00 0.00 0.00 0.00 0.00 0.00 31.60 32.38 2otg h MET 20 CO 0.06 0.29 0.00 -0.12 0.00 0.00 0.00 176.91 177.15 2otg n MET 21 N -3.49 0.20 -0.68 1.72 0.00 -0.51 -2.53 117.12 111.83 2otg n MET 21 Ca -0.00 0.19 0.03 0.00 -0.00 0.00 0.00 57.70 57.92 2otg n MET 21 Cb 0.46 -1.75 0.28 0.00 0.00 0.00 0.00 33.22 32.22 2otg n MET 21 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 175.97 177.60 2otg n LYS 22 N -2.10 3.70 -0.79 2.12 4.76 -0.27 -4.20 118.16 121.38 2otg n LYS 22 Ca 0.06 -2.31 -0.12 0.00 -2.87 0.00 0.00 58.31 53.07 2otg n LYS 22 Cb 0.40 -2.05 0.02 0.00 -1.84 0.00 0.00 35.03 31.56 2otg n LYS 22 CO 0.00 0.00 0.00 -0.85 -1.37 0.00 0.00 177.40 175.18 2otg n GLU 23 N 0.35 1.57 0.00 1.97 0.00 -1.05 -4.63 120.64 118.85 2otg n GLU 23 Ca 0.23 -1.10 0.00 0.00 0.00 0.00 0.00 57.16 56.29 2otg n GLU 23 Cb 0.99 -1.44 0.00 0.00 0.00 0.00 0.00 31.44 30.99 2otg n GLU 23 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.13 178.17 2otg n GLN 24 N 0.74 0.79 0.00 3.44 6.02 -1.26 -4.65 117.38 122.46 2otg n GLN 24 Ca 0.21 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.20 2otg n GLN 24 Cb 0.56 -1.25 0.00 0.00 1.02 0.00 0.00 30.24 30.57 2otg n GLN 24 CO 0.00 0.00 0.00 2.41 -1.01 0.00 0.00 177.06 178.46 2otg n THR 25 N 0.36 0.00 -2.04 5.09 -1.04 -1.26 -4.92 114.28 110.47 2otg n THR 25 Ca 0.00 0.00 -0.41 0.00 -2.04 0.00 0.00 64.05 61.60 2otg n THR 25 Cb 0.30 -0.04 -0.02 0.00 -1.82 0.00 0.00 70.33 68.75 2otg n THR 25 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2otg s ALA 26 N -3.88 3.57 1.00 2.41 0.00 -1.26 -5.04 121.76 118.56 2otg s ALA 26 Ca 0.00 1.32 0.00 0.00 0.00 0.00 0.00 51.96 53.28 2otg s ALA 26 Cb 0.00 -3.53 0.00 0.00 0.00 0.00 0.00 23.12 19.59 2otg s ALA 26 CO 0.00 -0.73 0.00 -0.35 0.00 0.00 0.00 175.76 174.68 2otg n PRO 27 N 1.59 0.90 -3.70 0.00 -0.04 -1.26 -5.06 135.00 127.42 2otg n PRO 27 Ca 0.04 0.00 -0.12 0.00 -0.04 0.00 0.00 63.50 63.37 2otg n PRO 27 Cb 0.41 0.00 -0.13 0.00 -0.04 0.00 0.00 33.50 33.74 2otg n PRO 27 CO 0.00 0.00 0.00 0.12 -0.04 0.00 0.00 175.50 175.58 2otg s PHE 28 N -0.09 -0.42 -0.28 0.54 5.36 -1.26 -5.02 117.98 116.81 2otg s PHE 28 Ca 0.00 0.95 -0.01 0.00 -0.96 0.00 0.00 56.93 56.91 2otg s PHE 28 Cb 0.00 0.07 0.04 0.00 -0.34 0.00 0.00 43.02 42.79 2otg s PHE 28 CO 0.00 -0.30 -0.02 0.34 -1.46 0.00 0.00 175.22 173.78 2otg s ASP 29 N 1.71 4.72 0.25 6.13 2.15 -1.26 -4.94 116.67 125.43 2otg s ASP 29 Ca -0.06 -1.18 0.18 0.00 0.43 0.00 0.00 52.55 51.92 2otg s ASP 29 Cb -0.11 -1.69 0.93 0.00 -0.30 0.00 0.00 42.92 41.76 2otg s ASP 29 CO -0.09 -0.22 1.55 0.61 -0.17 0.00 0.00 175.17 176.84 2otg n GLY 30 N 4.62 -0.85 0.08 2.66 0.00 -1.26 -1.44 105.19 108.99 2otg n GLY 30 Ca -0.14 0.15 -0.09 0.00 0.00 0.00 0.00 46.02 45.93 2otg n GLY 30 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2otg h LYS 31 N 0.00 0.04 0.00 1.61 1.79 -1.99 -3.41 116.57 114.61 2otg h LYS 31 Ca 0.00 -0.07 -0.24 0.00 -2.18 0.00 0.00 60.65 58.17 2otg h LYS 31 Cb 0.05 0.02 -0.05 0.00 -1.58 0.00 0.00 32.23 30.68 2otg h LYS 31 CO 0.00 0.79 -1.92 1.63 -1.08 0.00 0.00 179.45 178.87 2otg n LYS 32 N -3.23 1.74 -3.26 3.15 4.01 -0.52 -4.81 118.16 115.24 2otg n LYS 32 Ca -0.10 -0.01 -0.39 0.00 -0.51 0.00 0.00 58.31 57.30 2otg n LYS 32 Cb 1.01 -1.35 -0.06 0.00 -0.51 0.00 0.00 35.03 34.12 2otg n LYS 32 CO 0.00 0.00 0.00 -0.80 -1.11 0.00 0.00 177.40 175.49 2otg s ASN 33 N -4.63 6.98 0.04 4.39 -0.87 -0.58 -0.43 114.94 119.85 2otg s ASN 33 Ca -0.07 1.17 -0.02 0.00 -1.57 0.00 0.00 52.86 52.37 2otg s ASN 33 Cb 0.04 -2.35 0.01 0.00 -0.02 0.00 0.00 41.25 38.93 2otg s ASN 33 CO 0.56 0.18 0.11 0.00 -2.57 0.00 0.00 177.10 175.38 2otg s TRP 35 N -7.14 2.62 -0.02 0.00 0.52 -0.40 -2.15 118.94 112.39 2otg s TRP 35 Ca 0.02 -0.22 -0.06 0.00 0.02 0.00 0.00 56.10 55.87 2otg s TRP 35 Cb -0.01 -1.37 0.00 0.00 -1.15 0.00 0.00 33.47 30.95 2otg s TRP 35 CO 0.01 0.42 0.12 0.08 0.02 0.00 0.00 176.95 177.61 2otg s VAL 36 N -1.25 0.05 0.04 4.03 1.01 -0.98 -2.42 120.40 120.88 2otg s VAL 36 Ca 0.20 -0.44 -0.34 0.00 0.00 0.00 0.00 61.98 61.41 2otg s VAL 36 Cb -0.10 -0.33 -0.13 0.00 0.00 0.00 0.00 36.38 35.82 2otg s VAL 36 CO 0.12 -0.24 1.74 -2.65 0.00 0.00 0.00 175.10 174.07 2otg n PRO 37 N 2.08 2.18 -4.01 2.72 -0.02 -1.26 0.45 135.00 137.14 2otg n PRO 37 Ca -0.19 0.79 -0.17 0.00 -2.02 0.00 0.00 63.50 61.91 2otg n PRO 37 Cb 0.57 -2.61 -0.16 0.00 -0.02 0.00 0.00 33.50 31.28 2otg n PRO 37 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 2otg s ASP 38 N 2.55 0.52 0.32 2.55 -1.08 -0.96 -4.81 116.67 115.76 2otg s ASP 38 Ca 0.86 -0.05 0.04 0.00 -0.52 0.00 0.00 52.55 52.87 2otg s ASP 38 Cb -0.68 -0.24 0.53 0.00 -1.46 0.00 0.00 42.92 41.07 2otg s ASP 38 CO 0.45 -0.07 1.82 1.55 0.52 0.00 0.00 175.17 179.44 2otg h PRO 39 N 7.04 0.50 0.11 4.34 0.13 -1.94 -1.51 132.00 140.67 2otg h PRO 39 Ca -0.40 -0.14 -0.33 0.00 -0.87 0.00 0.00 66.00 64.27 2otg h PRO 39 Cb 1.15 -0.06 -0.01 0.00 0.13 0.00 0.00 31.00 32.21 2otg h PRO 39 CO 0.48 0.60 -1.77 0.87 -0.23 0.00 0.00 178.00 177.96 2otg h LYS 40 N 0.46 0.24 -0.21 0.86 1.79 -1.96 -3.41 116.57 114.34 2otg h LYS 40 Ca 0.09 -0.40 -0.01 0.00 -2.18 0.00 0.00 60.65 58.15 2otg h LYS 40 Cb 0.46 0.15 -0.01 0.00 -1.58 0.00 0.00 32.23 31.26 2otg h LYS 40 CO 0.03 1.19 -0.01 0.39 -1.08 0.00 0.00 179.45 179.97 2otg n GLU 41 N -3.72 2.50 0.00 3.15 -0.58 -1.25 -4.63 120.64 116.12 2otg n GLU 41 Ca -0.30 -2.81 0.00 0.00 -0.42 0.00 0.00 57.16 53.63 2otg n GLU 41 Cb 0.97 -1.77 0.00 0.00 -0.57 0.00 0.00 31.44 30.07 2otg n GLU 41 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2otg n GLY 42 N -0.75 1.00 2.90 0.62 0.00 -0.57 -4.71 105.19 103.68 2otg n GLY 42 Ca 0.21 -0.00 -0.16 0.00 0.00 0.00 0.00 46.02 46.06 2otg n GLY 42 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2otg n PHE 43 N 0.00 -0.85 -3.57 1.61 3.72 -1.26 -2.25 117.46 114.86 2otg n PHE 43 Ca 0.00 -2.42 -0.02 0.00 -0.05 0.00 0.00 57.45 54.96 2otg n PHE 43 Cb 0.00 0.31 -0.05 0.00 -0.94 0.00 0.00 39.48 38.81 2otg n PHE 43 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2otg s ALA 44 N -3.09 -1.90 0.58 4.37 0.00 0.17 -4.53 121.76 117.37 2otg s ALA 44 Ca 0.34 2.09 -0.18 0.00 0.00 0.00 0.00 51.96 54.21 2otg s ALA 44 Cb 0.01 -1.76 -0.07 0.00 0.00 0.00 0.00 23.12 21.31 2otg s ALA 44 CO 0.24 -0.97 0.70 0.45 0.00 0.00 0.00 175.76 176.18 2otg n SER 45 N 5.43 -0.33 -3.59 0.00 2.88 -1.26 -2.32 113.62 114.44 2otg n SER 45 Ca -0.10 0.76 -0.07 0.00 -1.33 0.00 0.00 58.87 58.14 2otg n SER 45 Cb 0.49 -1.26 -0.02 0.00 -0.75 0.00 0.00 64.21 62.68 2otg n SER 45 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2otg s ALA 46 N -1.64 -1.76 -0.14 -1.46 0.00 -0.91 -3.85 121.76 111.99 2otg s ALA 46 Ca 0.72 0.68 0.00 0.00 0.00 0.00 0.00 51.96 53.37 2otg s ALA 46 Cb -0.43 0.51 -0.01 0.00 0.00 0.00 0.00 23.12 23.19 2otg s ALA 46 CO 0.51 -0.82 -0.15 -1.21 0.00 0.00 0.00 175.76 174.09 2otg s GLU 47 N -3.19 3.25 0.32 0.00 2.02 -0.77 -1.67 118.70 118.65 2otg s GLU 47 Ca 0.07 -0.74 -0.28 0.00 0.02 0.00 0.00 54.97 54.05 2otg s GLU 47 Cb -0.01 -2.60 -0.09 0.00 0.10 0.00 0.00 34.13 31.53 2otg s GLU 47 CO -0.05 0.09 1.10 0.42 0.02 0.00 0.00 175.26 176.84 2otg s ILE 48 N 0.63 3.49 0.02 -1.63 1.01 0.43 -2.01 121.20 123.14 2otg s ILE 48 Ca -0.08 1.39 -0.02 0.00 0.00 0.00 0.00 60.65 61.93 2otg s ILE 48 Cb -0.16 -3.84 -0.01 0.00 0.01 0.00 0.00 42.46 38.47 2otg s ILE 48 CO 0.03 0.24 -0.04 0.00 0.00 0.00 0.00 174.94 175.17 2otg n GLN 49 N 0.77 0.06 -4.29 2.79 1.13 -0.51 -4.93 117.38 112.40 2otg n GLN 49 Ca 0.01 0.02 -0.15 0.00 -1.94 0.00 0.00 57.00 54.94 2otg n GLN 49 Cb 0.46 -0.41 -0.10 0.00 0.11 0.00 0.00 30.24 30.30 2otg n GLN 49 CO 0.00 0.00 0.00 -1.54 -1.44 0.00 0.00 177.06 174.08 2otg s SER 50 N -5.38 1.38 0.01 1.08 1.04 -1.24 -5.03 113.70 105.56 2otg s SER 50 Ca -0.03 -1.26 0.00 0.00 0.48 0.00 0.00 55.95 55.14 2otg s SER 50 Cb 0.00 0.10 -0.01 0.00 0.10 0.00 0.00 66.02 66.22 2otg s SER 50 CO 0.05 -0.61 -0.02 -0.94 0.98 0.00 0.00 173.24 172.70 2otg s SER 51 N -3.26 0.18 -0.42 7.02 1.04 -1.26 -2.49 113.70 114.51 2otg s SER 51 Ca 0.30 -0.23 0.07 0.00 0.48 0.00 0.00 55.95 56.57 2otg s SER 51 Cb 0.07 0.04 0.23 0.00 0.10 0.00 0.00 66.02 66.45 2otg s SER 51 CO 0.08 -0.12 0.57 0.29 0.98 0.00 0.00 173.24 175.05 2otg n LYS 52 N 2.41 0.63 0.00 4.02 5.02 -1.10 -5.02 118.16 124.11 2otg n LYS 52 Ca -0.17 -2.86 0.00 0.00 -2.02 0.00 0.00 58.31 53.26 2otg n LYS 52 Cb 0.58 -1.35 0.00 0.00 -0.02 0.00 0.00 35.03 34.23 2otg n LYS 52 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2otg n GLY 53 N 1.78 2.19 0.50 0.72 0.00 -1.26 -3.04 105.19 106.09 2otg n GLY 53 Ca 0.20 -0.08 0.07 0.00 0.00 0.00 0.00 46.02 46.21 2otg n GLY 53 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2otg n GLU 54 N 0.00 1.45 -3.84 1.61 1.02 -1.26 -4.89 120.64 114.72 2otg n GLU 54 Ca 0.00 -3.07 -0.30 0.00 -0.02 0.00 0.00 57.16 53.77 2otg n GLU 54 Cb 0.00 -1.52 -0.14 0.00 -0.02 0.00 0.00 31.44 29.76 2otg n GLU 54 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 2otg s GLU 55 N -3.01 1.54 -0.17 3.49 2.02 -1.17 -3.77 118.70 117.63 2otg s GLU 55 Ca 0.36 -2.17 -0.17 0.00 0.02 0.00 0.00 54.97 53.01 2otg s GLU 55 Cb 0.35 -2.79 -0.04 0.00 0.10 0.00 0.00 34.13 31.75 2otg s GLU 55 CO -0.05 -1.10 0.46 0.42 0.02 0.00 0.00 175.26 175.01 2otg s ILE 56 N 0.25 5.17 -0.12 -1.63 -1.09 -0.72 -2.72 121.20 120.34 2otg s ILE 56 Ca 0.16 0.86 -0.05 0.00 -2.23 0.00 0.00 60.65 59.40 2otg s ILE 56 Cb -0.24 -3.79 -0.04 0.00 -1.58 0.00 0.00 42.46 36.81 2otg s ILE 56 CO -0.02 0.26 0.06 -0.89 -1.23 0.00 0.00 174.94 173.11 2otg s THR 57 N 1.16 4.76 0.29 2.92 2.01 -1.04 -0.97 115.64 124.78 2otg s THR 57 Ca 0.23 -0.07 0.03 0.00 0.31 0.00 0.00 61.69 62.20 2otg s THR 57 Cb -0.15 -3.06 -0.04 0.00 0.01 0.00 0.00 72.50 69.26 2otg s THR 57 CO 0.09 0.58 0.18 0.68 -0.69 0.00 0.00 174.62 175.46 2otg s VAL 58 N -0.63 0.19 -0.04 3.82 -7.23 -0.75 -1.43 120.40 114.34 2otg s VAL 58 Ca 0.11 -2.00 0.02 0.00 -1.81 0.00 0.00 61.98 58.30 2otg s VAL 58 Cb -0.12 -2.50 0.01 0.00 0.56 0.00 0.00 36.38 34.33 2otg s VAL 58 CO 0.02 0.00 -0.09 -0.75 -0.31 0.00 0.00 175.10 173.98 2otg s LYS 59 N -3.79 1.10 -0.26 4.82 2.20 -0.85 -2.82 119.74 120.14 2otg s LYS 59 Ca 0.37 -0.28 -0.25 0.00 -0.36 0.00 0.00 55.97 55.45 2otg s LYS 59 Cb 0.05 -1.00 0.00 0.00 -1.51 0.00 0.00 37.83 35.37 2otg s LYS 59 CO 0.19 0.04 0.88 0.42 -0.36 0.00 0.00 175.35 176.52 2otg s ILE 60 N 0.50 4.78 0.40 5.43 -1.09 -1.11 -1.85 121.20 128.26 2otg s ILE 60 Ca -0.08 1.60 0.21 0.00 -2.23 0.00 0.00 60.65 60.14 2otg s ILE 60 Cb -0.12 -4.18 0.41 0.00 -1.58 0.00 0.00 42.46 36.99 2otg s ILE 60 CO 0.01 -0.16 1.71 0.58 -1.23 0.00 0.00 174.94 175.86 2otg h VAL 61 N 5.49 0.37 0.30 2.92 2.07 -1.94 0.47 116.25 125.93 2otg h VAL 61 Ca -0.22 -0.10 -0.01 0.00 0.82 0.00 0.00 66.70 67.18 2otg h VAL 61 Cb 1.08 0.05 0.00 0.00 -1.52 0.00 0.00 31.29 30.91 2otg h VAL 61 CO 0.91 0.05 -0.15 0.77 0.02 0.00 0.00 177.57 179.17 2otg h SER 62 N 0.29 -0.35 -0.65 0.57 4.64 -1.92 -3.36 113.55 112.77 2otg h SER 62 Ca 0.69 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 62.02 2otg h SER 62 Cb 1.85 0.09 0.00 0.00 -0.31 0.00 0.00 62.40 64.03 2otg h SER 62 CO -0.38 -0.09 0.00 -0.90 -0.87 0.00 0.00 176.83 174.59 2otg n ASP 63 N -3.98 3.69 -3.24 4.97 5.68 -1.14 -4.96 116.55 117.57 2otg n ASP 63 Ca -0.05 -2.00 -0.17 0.00 -0.50 0.00 0.00 54.79 52.07 2otg n ASP 63 Cb 0.16 -0.43 -0.02 0.00 -1.14 0.00 0.00 41.12 39.68 2otg n ASP 63 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.20 176.46 2otg n ASN 64 N 1.53 -1.98 -2.07 -1.12 3.02 0.16 -4.93 115.26 109.88 2otg n ASN 64 Ca 0.23 -0.18 -0.01 0.00 -0.03 0.00 0.00 54.58 54.59 2otg n ASN 64 Cb 0.59 -1.75 0.00 0.00 -0.61 0.00 0.00 39.78 38.01 2otg n ASN 64 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 2otg n SER 65 N -1.95 0.04 -4.04 6.41 3.41 -1.26 -4.78 113.62 111.46 2otg n SER 65 Ca 0.02 -1.03 -0.21 0.00 -0.26 0.00 0.00 58.87 57.39 2otg n SER 65 Cb 0.50 -0.02 -0.15 0.00 -0.26 0.00 0.00 64.21 64.28 2otg n SER 65 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 2otg s THR 66 N 0.29 0.89 0.09 6.66 2.01 -1.26 -2.74 115.64 121.58 2otg s THR 66 Ca 0.02 -0.44 -0.08 0.00 0.31 0.00 0.00 61.69 61.50 2otg s THR 66 Cb -0.00 -0.77 -0.01 0.00 0.01 0.00 0.00 72.50 71.73 2otg s THR 66 CO 0.01 0.27 0.17 0.00 -0.69 0.00 0.00 174.62 174.38 2otg s ARG 67 N 0.01 0.85 -0.10 4.92 1.70 -1.13 -5.02 118.95 120.19 2otg s ARG 67 Ca -0.00 -1.02 0.00 0.00 -0.47 0.00 0.00 55.73 54.24 2otg s ARG 67 Cb -0.07 0.33 -0.02 0.00 -0.57 0.00 0.00 34.95 34.61 2otg s ARG 67 CO 0.00 -0.26 -0.10 0.99 -1.08 0.00 0.00 175.30 174.85 2otg s THR 68 N -3.88 3.38 -0.04 4.99 2.01 -1.26 -1.81 115.64 119.03 2otg s THR 68 Ca 0.07 -0.57 -0.04 0.00 0.31 0.00 0.00 61.69 61.45 2otg s THR 68 Cb 0.05 -2.40 0.01 0.00 0.01 0.00 0.00 72.50 70.17 2otg s THR 68 CO -0.10 0.55 0.11 0.68 -0.69 0.00 0.00 174.62 175.18 2otg s VAL 69 N -0.19 0.01 0.65 3.82 -7.23 -0.14 -5.00 120.40 112.32 2otg s VAL 69 Ca 0.01 -0.05 -0.17 0.00 -1.81 0.00 0.00 61.98 59.97 2otg s VAL 69 Cb -0.13 -0.18 -0.00 0.00 0.56 0.00 0.00 36.38 36.62 2otg s VAL 69 CO 0.03 -0.03 1.18 -0.54 -0.31 0.00 0.00 175.10 175.43 2otg s LYS 70 N -0.03 2.68 0.22 4.82 1.02 -1.26 -1.75 119.74 125.45 2otg s LYS 70 Ca -0.01 1.68 0.19 0.00 0.02 0.00 0.00 55.97 57.85 2otg s LYS 70 Cb -0.01 -1.91 0.90 0.00 -0.52 0.00 0.00 37.83 36.29 2otg s LYS 70 CO 0.00 -1.40 1.58 1.17 -0.92 0.00 0.00 175.35 175.79 2otg n LYS 71 N -2.14 0.13 0.09 1.68 4.81 -1.25 -2.43 118.16 119.05 2otg n LYS 71 Ca 0.13 0.49 0.11 0.00 -0.87 0.00 0.00 58.31 58.17 2otg n LYS 71 Cb 0.50 -1.82 0.00 0.00 0.02 0.00 0.00 35.03 33.74 2otg n LYS 71 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 2otg n ASP 72 N -2.08 0.78 0.01 3.14 8.00 -1.26 -3.96 116.55 121.19 2otg n ASP 72 Ca 0.01 0.27 0.12 0.00 0.71 0.00 0.00 54.79 55.90 2otg n ASP 72 Cb 0.13 0.53 0.25 0.00 -0.02 0.00 0.00 41.12 42.00 2otg n ASP 72 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 2otg n ASP 73 N -2.58 0.52 -4.74 -2.24 8.00 -1.02 -4.89 116.55 109.60 2otg n ASP 73 Ca 0.00 -0.13 -0.41 0.00 0.71 0.00 0.00 54.79 54.97 2otg n ASP 73 Cb 0.54 0.21 -0.05 0.00 -0.02 0.00 0.00 41.12 41.80 2otg n ASP 73 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2otg s ILE 74 N -3.04 4.01 0.05 0.53 1.01 -1.24 -4.58 121.20 117.94 2otg s ILE 74 Ca 0.10 1.84 0.09 0.00 0.00 0.00 0.00 60.65 62.69 2otg s ILE 74 Cb 0.17 -4.18 -0.03 0.00 0.01 0.00 0.00 42.46 38.43 2otg s ILE 74 CO 0.70 0.37 -0.26 -1.10 0.00 0.00 0.00 174.94 174.65 2otg s GLN 75 N -0.72 1.71 0.41 2.79 -0.21 -1.01 -4.98 119.66 117.64 2otg s GLN 75 Ca 0.45 -1.12 -0.26 0.00 0.02 0.00 0.00 55.36 54.45 2otg s GLN 75 Cb -0.27 -1.92 -0.10 0.00 1.00 0.00 0.00 33.01 31.72 2otg s GLN 75 CO 0.34 0.49 1.34 1.04 -2.12 0.00 0.00 175.29 176.38 2otg n GLN 76 N 1.69 2.14 -4.35 2.91 1.13 -1.26 -1.27 117.38 118.37 2otg n GLN 76 Ca -0.17 0.76 -0.32 0.00 -1.94 0.00 0.00 57.00 55.33 2otg n GLN 76 Cb 0.52 -2.47 -0.09 0.00 0.11 0.00 0.00 30.24 28.31 2otg n GLN 76 CO 0.00 0.00 0.00 1.41 -1.44 0.00 0.00 177.06 177.03 2otg s MET 77 N -2.19 2.69 0.11 -1.09 1.75 -1.26 -4.69 119.30 114.62 2otg s MET 77 Ca 0.59 -0.66 -0.20 0.00 -1.25 0.00 0.00 55.69 54.17 2otg s MET 77 Cb -0.50 -2.60 -0.07 0.00 2.84 0.00 0.00 34.83 34.50 2otg s MET 77 CO 0.59 0.61 0.62 -0.80 -0.65 0.00 0.00 175.02 175.40 2otg s ASN 78 N -1.51 7.10 0.97 1.11 0.01 -1.26 -4.92 114.94 116.44 2otg s ASN 78 Ca 0.19 1.33 -0.11 0.00 -0.71 0.00 0.00 52.86 53.55 2otg s ASN 78 Cb -0.11 -2.38 0.18 0.00 0.41 0.00 0.00 41.25 39.34 2otg s ASN 78 CO 0.09 0.22 1.10 -2.84 -1.51 0.00 0.00 177.10 174.16 2otg s PRO 79 N -1.28 0.58 0.28 -0.60 0.02 -1.26 -4.92 135.00 127.82 2otg s PRO 79 Ca 0.32 1.19 -0.01 0.00 0.02 0.00 0.00 61.00 62.52 2otg s PRO 79 Cb -0.19 -1.70 0.45 0.00 0.02 0.00 0.00 34.50 33.07 2otg s PRO 79 CO 0.21 -2.82 1.90 -1.35 -0.33 0.00 0.00 177.00 174.61 2otg h PRO 80 N -1.99 1.10 0.00 5.54 0.11 -1.97 -2.80 132.00 131.99 2otg h PRO 80 Ca -0.50 -0.07 0.00 0.00 0.11 0.00 0.00 66.00 65.55 2otg h PRO 80 Cb 1.29 -0.25 0.00 0.00 0.11 0.00 0.00 31.00 32.15 2otg h PRO 80 CO 0.47 0.73 0.07 0.36 -0.21 0.00 0.00 178.00 179.41 2otg n LYS 81 N -4.48 0.00 -0.43 1.05 2.85 -1.26 -1.47 118.16 114.41 2otg n LYS 81 Ca 0.14 0.33 0.11 0.00 -1.05 0.00 0.00 58.31 57.84 2otg n LYS 81 Cb 0.17 -1.57 0.32 0.00 -0.65 0.00 0.00 35.03 33.31 2otg n LYS 81 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 177.40 178.54 2otg n PHE 82 N -1.31 1.10 -2.20 5.58 3.01 -1.06 -5.00 117.46 117.59 2otg n PHE 82 Ca 0.00 -0.54 -0.40 0.00 1.01 0.00 0.00 57.45 57.53 2otg n PHE 82 Cb 0.07 -0.08 -0.02 0.00 -0.01 0.00 0.00 39.48 39.44 2otg n PHE 82 CO 0.00 0.00 0.00 -1.21 1.01 0.00 0.00 176.76 176.56 2otg s GLU 83 N -1.26 4.23 -1.34 -1.08 0.41 -0.54 -3.20 118.70 115.91 2otg s GLU 83 Ca 0.48 2.05 -0.03 0.00 -0.41 0.00 0.00 54.97 57.06 2otg s GLU 83 Cb 0.27 -2.91 -0.00 0.00 -1.78 0.00 0.00 34.13 29.71 2otg s GLU 83 CO 0.30 -0.24 0.53 1.63 -0.49 0.00 0.00 175.26 176.99 2otg n LYS 84 N 0.51 -3.28 -2.35 1.61 5.02 -1.26 -4.89 118.16 113.51 2otg n LYS 84 Ca 0.02 0.45 -0.40 0.00 -2.02 0.00 0.00 58.31 56.36 2otg n LYS 84 Cb 0.44 -4.58 -0.03 0.00 -0.02 0.00 0.00 35.03 30.83 2otg n LYS 84 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 2otg s LEU 85 N -6.83 4.48 0.13 -0.35 2.96 -1.19 -4.96 118.68 112.91 2otg s LEU 85 Ca 0.08 2.40 -0.06 0.00 -0.22 0.00 0.00 54.13 56.32 2otg s LEU 85 Cb -0.03 -3.67 -0.09 0.00 0.50 0.00 0.00 46.19 42.90 2otg s LEU 85 CO 0.87 -0.31 1.32 -0.33 -1.32 0.00 0.00 176.35 176.58 2otg h GLU 86 N 3.58 0.51 -4.08 1.98 5.08 -1.93 -3.41 114.58 116.31 2otg h GLU 86 Ca -0.48 -0.50 -0.61 0.00 -1.00 0.00 0.00 59.36 56.77 2otg h GLU 86 Cb 1.22 0.13 -0.40 0.00 0.50 0.00 0.00 28.75 30.20 2otg h GLU 86 CO 0.66 1.13 -0.75 0.34 -1.00 0.00 0.00 179.01 179.39 2otg s ASP 87 N -7.09 4.23 0.00 1.42 3.68 -1.26 -2.27 116.67 115.37 2otg s ASP 87 Ca -0.07 -1.72 0.00 0.00 2.13 0.00 0.00 52.55 52.89 2otg s ASP 87 Cb 0.09 -1.18 0.00 0.00 -1.45 0.00 0.00 42.92 40.38 2otg s ASP 87 CO 0.87 -0.37 0.47 0.23 0.13 0.00 0.00 175.17 176.51 2otg n MET 88 N 4.62 0.00 0.00 4.34 2.81 -1.01 -0.90 117.12 126.97 2otg n MET 88 Ca -0.02 0.01 0.14 0.00 -1.81 0.00 0.00 57.70 56.02 2otg n MET 88 Cb 0.42 -1.50 0.53 0.00 -0.71 0.00 0.00 33.22 31.96 2otg n MET 88 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2otg n ALA 89 N -0.97 2.87 0.81 3.04 0.00 -1.26 -3.41 120.51 121.59 2otg n ALA 89 Ca 0.00 -0.29 0.11 0.00 0.00 0.00 0.00 53.44 53.25 2otg n ALA 89 Cb 0.00 -1.28 -0.05 0.00 0.00 0.00 0.00 19.45 18.12 2otg n ALA 89 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2otg n ASN 90 N -0.97 0.75 -4.73 0.00 3.02 -0.08 -4.92 115.26 108.32 2otg n ASN 90 Ca 0.13 -0.64 -0.42 0.00 -0.03 0.00 0.00 54.58 53.62 2otg n ASN 90 Cb 0.30 0.96 -0.02 0.00 -0.61 0.00 0.00 39.78 40.41 2otg n ASN 90 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 2otg s MET 91 N -3.09 4.16 0.12 3.52 -1.94 -1.22 -4.92 119.30 115.94 2otg s MET 91 Ca 0.06 2.51 -0.32 0.00 -1.71 0.00 0.00 55.69 56.24 2otg s MET 91 Cb 0.16 -3.07 -0.09 0.00 2.01 0.00 0.00 34.83 33.83 2otg s MET 91 CO 0.84 -0.64 1.57 1.15 -0.01 0.00 0.00 175.02 177.93 2otg h THR 92 N 3.64 0.06 -3.61 2.05 2.02 -1.93 -3.36 112.91 111.79 2otg h THR 92 Ca -0.45 0.00 -0.64 0.00 0.77 0.00 0.00 66.41 66.09 2otg h THR 92 Cb 1.21 0.06 -0.20 0.00 -1.74 0.00 0.00 68.15 67.48 2otg h THR 92 CO 0.86 0.00 -0.59 -0.31 0.37 0.00 0.00 175.52 175.85 2otg s TYR 93 N -5.79 3.14 -0.68 3.16 2.02 -1.26 -4.61 117.35 113.33 2otg s TYR 93 Ca -0.15 -0.22 0.00 0.00 -0.37 0.00 0.00 57.07 56.33 2otg s TYR 93 Cb 0.08 -2.22 0.17 0.00 -0.40 0.00 0.00 41.96 39.59 2otg s TYR 93 CO 0.63 -0.21 0.49 -1.17 -1.57 0.00 0.00 175.55 173.71 2otg s LEU 94 N 1.35 5.03 0.00 -1.29 2.96 -1.26 -4.88 118.68 120.59 2otg s LEU 94 Ca 0.05 -3.28 0.04 0.00 -0.22 0.00 0.00 54.13 50.72 2otg s LEU 94 Cb -0.15 -1.78 -0.01 0.00 0.50 0.00 0.00 46.19 44.75 2otg s LEU 94 CO 0.04 -0.24 0.13 -0.46 -1.32 0.00 0.00 176.35 174.50 2otg n ASN 95 N 2.86 0.27 0.03 3.68 0.23 -1.26 -5.00 115.26 116.07 2otg n ASN 95 Ca 0.12 -2.28 -0.14 0.00 -0.53 0.00 0.00 54.58 51.75 2otg n ASN 95 Cb 0.36 0.81 -0.08 0.00 -2.08 0.00 0.00 39.78 38.79 2otg n ASN 95 CO 0.00 0.00 0.00 -0.33 -0.93 0.00 0.00 177.26 176.00 2otg h GLU 96 N 0.00 -0.56 0.00 -3.83 5.08 -1.97 0.16 114.58 113.46 2otg h GLU 96 Ca -0.16 0.04 -0.04 0.00 -1.00 0.00 0.00 59.36 58.19 2otg h GLU 96 Cb 0.71 0.13 -0.01 0.00 0.50 0.00 0.00 28.75 30.08 2otg h GLU 96 CO 0.24 -0.38 -0.21 0.00 -1.00 0.00 0.00 179.01 177.67 2otg h ALA 97 N -0.14 1.45 0.00 3.43 0.00 -1.97 -1.42 119.26 120.62 2otg h ALA 97 Ca 0.04 -0.19 -0.08 0.00 0.00 0.00 0.00 54.91 54.68 2otg h ALA 97 Cb 0.67 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 2otg h ALA 97 CO -0.37 0.26 -0.68 0.66 0.00 0.00 0.00 179.25 179.13 2otg h SER 98 N 0.00 0.00 0.15 0.00 4.64 -1.67 -2.70 113.55 113.96 2otg h SER 98 Ca -0.00 0.00 -0.26 0.00 -0.47 0.00 0.00 61.79 61.06 2otg h SER 98 Cb 0.43 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.53 2otg h SER 98 CO 0.03 0.34 -1.22 0.58 -0.87 0.00 0.00 176.83 175.68 2otg h VAL 99 N 0.00 1.23 -0.14 0.95 2.07 -0.45 -2.85 116.25 117.05 2otg h VAL 99 Ca -0.04 -2.49 0.03 0.00 0.82 0.00 0.00 66.70 65.02 2otg h VAL 99 Cb 1.29 2.94 -0.04 0.00 -1.52 0.00 0.00 31.29 33.96 2otg h VAL 99 CO 0.04 0.73 -0.08 0.25 0.02 0.00 0.00 177.57 178.53 2otg h LEU 100 N -0.25 -0.26 -0.31 2.57 5.85 -1.36 -2.36 115.31 119.19 2otg h LEU 100 Ca -0.24 0.06 -0.01 0.00 0.84 0.00 0.00 57.88 58.53 2otg h LEU 100 Cb 1.79 0.14 -0.01 0.00 0.37 0.00 0.00 40.66 42.94 2otg h LEU 100 CO 0.13 -0.11 0.16 -1.13 -0.34 0.00 0.00 178.44 177.15 2otg h ASN 101 N -0.07 0.40 -0.20 1.25 -0.73 -1.60 -1.42 115.58 113.21 2otg h ASN 101 Ca 0.08 -0.11 -0.08 0.00 1.87 0.00 0.00 56.30 58.06 2otg h ASN 101 Cb 0.19 -0.10 -0.02 0.00 0.27 0.00 0.00 38.32 38.67 2otg h ASN 101 CO -0.19 0.40 -0.12 -1.13 -0.37 0.00 0.00 177.43 176.02 2otg h ASN 102 N 0.37 0.57 0.25 1.15 -1.24 -1.43 0.42 115.58 115.69 2otg h ASN 102 Ca 0.11 -0.16 -0.01 0.00 0.71 0.00 0.00 56.30 56.95 2otg h ASN 102 Cb 0.10 -0.15 0.00 0.00 0.73 0.00 0.00 38.32 38.99 2otg h ASN 102 CO -0.02 0.73 -0.12 -0.07 -1.29 0.00 0.00 177.43 176.66 2otg h LEU 103 N 0.54 -0.29 -0.60 0.34 3.38 -1.33 -0.72 115.31 116.63 2otg h LEU 103 Ca 0.10 -0.24 0.11 0.00 0.09 0.00 0.00 57.88 57.94 2otg h LEU 103 Cb 0.53 0.07 -0.08 0.00 0.09 0.00 0.00 40.66 41.28 2otg h LEU 103 CO 0.03 0.14 0.16 -0.09 0.09 0.00 0.00 178.44 178.77 2otg h ARG 104 N -0.80 0.29 0.01 1.13 2.43 -1.20 0.19 114.38 116.43 2otg h ARG 104 Ca -0.03 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.12 2otg h ARG 104 Cb 0.51 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 29.98 2otg h ARG 104 CO 0.06 0.19 -0.09 0.78 -1.51 0.00 0.00 179.97 179.40 2otg h GLY 105 N 0.30 -1.27 0.64 2.80 0.00 -0.00 -0.10 103.07 105.43 2otg h GLY 105 Ca 0.31 0.57 0.11 0.00 0.00 0.00 0.00 47.33 48.33 2otg h GLY 105 CO -0.38 -0.45 0.58 3.21 0.00 0.00 0.00 176.54 179.50 2otg h ARG 106 N -0.12 0.81 0.72 4.80 3.08 -0.67 -2.84 114.38 120.15 2otg h ARG 106 Ca 0.00 -0.05 -0.04 0.00 0.07 0.00 0.00 59.98 59.97 2otg h ARG 106 Cb 0.13 -0.18 0.01 0.00 0.08 0.00 0.00 29.97 30.00 2otg h ARG 106 CO -0.06 0.53 -0.35 -0.92 -1.07 0.00 0.00 179.97 178.11 2otg h TYR 107 N 0.83 -0.91 0.00 3.04 -0.00 -0.24 -1.10 116.97 118.59 2otg h TYR 107 Ca 0.43 -0.02 0.00 0.00 -0.00 0.00 0.00 58.73 59.14 2otg h TYR 107 Cb 0.52 0.30 0.00 0.00 -0.00 0.00 0.00 36.73 37.55 2otg h TYR 107 CO -0.00 -0.56 0.00 0.25 -0.00 0.00 0.00 178.16 177.85 2otg n THR 108 N -5.51 0.11 -0.53 1.81 -2.24 -0.09 -0.02 114.28 107.82 2otg n THR 108 Ca -0.14 0.03 0.06 0.00 -2.27 0.00 0.00 64.05 61.72 2otg n THR 108 Cb 0.39 -1.03 0.13 0.00 -2.10 0.00 0.00 70.33 67.72 2otg n THR 108 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2otg n ALA 109 N -1.02 2.32 0.00 6.98 0.00 -0.49 -5.00 120.51 123.31 2otg n ALA 109 Ca 0.00 -1.73 0.00 0.00 0.00 0.00 0.00 53.44 51.71 2otg n ALA 109 Cb 0.00 -0.35 0.00 0.00 0.00 0.00 0.00 19.45 19.10 2otg n ALA 109 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2otg n GLY 110 N -0.50 2.95 3.69 0.00 0.00 0.98 -5.00 105.19 107.29 2otg n GLY 110 Ca 0.11 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.71 2otg n GLY 110 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2otg s LEU 111 N 0.00 4.28 0.00 0.99 1.43 -0.79 -4.91 118.68 119.69 2otg s LEU 111 Ca 0.00 1.84 0.14 0.00 -1.03 0.00 0.00 54.13 55.08 2otg s LEU 111 Cb 0.00 -3.56 -0.01 0.00 0.03 0.00 0.00 46.19 42.65 2otg s LEU 111 CO 0.00 -0.60 0.76 2.30 0.23 0.00 0.00 176.35 179.05 2otg n ILE 112 N 4.62 0.00 -3.99 -0.59 -5.35 -1.26 -3.18 119.36 109.61 2otg n ILE 112 Ca 0.11 -0.35 -0.35 0.00 -0.27 0.00 0.00 62.75 61.89 2otg n ILE 112 Cb 0.46 1.16 -0.14 0.00 -1.74 0.00 0.00 39.64 39.38 2otg n ILE 112 CO 0.00 0.00 0.00 -0.31 -1.76 0.00 0.00 176.55 174.48 2otg s TYR 113 N -1.70 2.95 -0.02 4.28 2.02 -1.26 -2.45 117.35 121.16 2otg s TYR 113 Ca 0.11 -0.88 0.01 0.00 -0.37 0.00 0.00 57.07 55.94 2otg s TYR 113 Cb 0.11 -2.08 0.01 0.00 -0.40 0.00 0.00 41.96 39.60 2otg s TYR 113 CO 0.35 -0.50 -0.03 0.99 -1.57 0.00 0.00 175.55 174.80 2otg s THR 114 N 1.35 0.32 0.58 -0.71 2.01 -0.90 -4.58 115.64 113.70 2otg s THR 114 Ca 0.04 -0.08 -0.04 0.00 0.31 0.00 0.00 61.69 61.92 2otg s THR 114 Cb -0.14 -0.33 0.02 0.00 0.01 0.00 0.00 72.50 72.05 2otg s THR 114 CO -0.02 0.14 0.86 -0.31 -0.69 0.00 0.00 174.62 174.60 2otg s TYR 115 N 0.47 3.14 -0.38 4.92 2.02 -0.96 -0.26 117.35 126.30 2otg s TYR 115 Ca -0.05 0.46 0.04 0.00 -0.37 0.00 0.00 57.07 57.15 2otg s TYR 115 Cb -0.08 -2.74 0.31 0.00 -0.40 0.00 0.00 41.96 39.04 2otg s TYR 115 CO -0.01 -0.85 1.24 0.45 -1.57 0.00 0.00 175.55 174.81 2otg n SER 116 N -2.52 -1.74 0.00 2.29 2.88 -0.87 -2.41 113.62 111.25 2otg n SER 116 Ca 0.05 -2.52 0.00 0.00 -1.33 0.00 0.00 58.87 55.07 2otg n SER 116 Cb 0.58 1.37 0.00 0.00 -0.75 0.00 0.00 64.21 65.41 2otg n SER 116 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2otg n GLY 117 N 0.78 1.09 0.10 0.46 0.00 -1.26 -3.64 105.19 102.71 2otg n GLY 117 Ca 0.01 -1.03 0.05 0.00 0.00 0.00 0.00 46.02 45.05 2otg n GLY 117 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2otg n LEU 118 N 0.00 0.77 -4.77 0.99 4.77 -1.26 -4.94 117.00 112.56 2otg n LEU 118 Ca 0.00 0.32 -0.41 0.00 -0.03 0.00 0.00 56.01 55.89 2otg n LEU 118 Cb 0.00 0.02 -0.02 0.00 -2.33 0.00 0.00 43.42 41.09 2otg n LEU 118 CO 0.00 0.00 0.97 -0.36 -1.33 0.00 0.00 177.39 176.67 2otg s PHE 119 N -3.14 3.05 -0.29 -1.77 2.99 -1.24 -4.27 117.98 113.31 2otg s PHE 119 Ca -0.02 1.42 0.03 0.00 0.00 0.00 0.00 56.93 58.35 2otg s PHE 119 Cb 0.09 -3.67 0.08 0.00 0.00 0.00 0.00 43.02 39.52 2otg s PHE 119 CO 0.81 -1.84 -0.03 0.00 -0.00 0.00 0.00 175.22 174.16 2otg s ILE 121 N 1.11 4.71 -0.16 0.00 1.01 0.64 -0.44 121.20 128.07 2otg s ILE 121 Ca 0.00 1.57 -0.01 0.00 0.00 0.00 0.00 60.65 62.22 2otg s ILE 121 Cb -0.19 -4.09 0.04 0.00 0.01 0.00 0.00 42.46 38.23 2otg s ILE 121 CO -0.08 0.40 -0.04 0.00 0.00 0.00 0.00 174.94 175.22 2otg s ALA 122 N -0.24 1.38 -0.19 9.38 0.00 -0.72 -2.11 121.76 129.26 2otg s ALA 122 Ca 0.37 -0.76 -0.09 0.00 0.00 0.00 0.00 51.96 51.48 2otg s ALA 122 Cb -0.20 -1.09 -0.05 0.00 0.00 0.00 0.00 23.12 21.78 2otg s ALA 122 CO 0.22 -0.78 0.12 0.08 0.00 0.00 0.00 175.76 175.41 2otg s VAL 123 N 1.68 5.34 -0.21 0.00 1.01 -1.03 -1.90 120.40 125.29 2otg s VAL 123 Ca 0.01 0.16 -0.31 0.00 0.00 0.00 0.00 61.98 61.84 2otg s VAL 123 Cb -0.15 -3.42 -0.08 0.00 0.00 0.00 0.00 36.38 32.73 2otg s VAL 123 CO -0.08 0.47 2.15 -3.20 0.00 0.00 0.00 175.10 174.44 2otg n ASN 124 N 3.31 3.05 0.15 3.32 2.85 -1.13 -4.82 115.26 122.00 2otg n ASN 124 Ca -0.17 0.43 0.00 0.00 -0.11 0.00 0.00 54.58 54.73 2otg n ASN 124 Cb 0.52 -1.45 0.24 0.00 1.24 0.00 0.00 39.78 40.34 2otg n ASN 124 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 2otg h PRO 125 N 13.12 0.01 -5.50 1.20 0.13 -1.94 -3.44 132.00 135.57 2otg h PRO 125 Ca -0.39 -0.00 -0.37 0.00 -0.87 0.00 0.00 66.00 64.37 2otg h PRO 125 Cb 1.27 0.00 0.13 0.00 0.13 0.00 0.00 31.00 32.53 2otg h PRO 125 CO 0.97 0.53 -0.64 0.66 -0.23 0.00 0.00 178.00 179.29 2otg n TYR 126 N -3.91 -2.63 0.00 1.56 4.01 -1.26 -4.43 117.16 110.50 2otg n TYR 126 Ca -0.01 0.94 0.00 0.00 -0.16 0.00 0.00 57.90 58.67 2otg n TYR 126 Cb 0.54 -4.78 0.00 0.00 -0.31 0.00 0.00 39.34 34.79 2otg n TYR 126 CO 0.00 0.00 0.00 2.89 -0.46 0.00 0.00 176.86 179.29 2otg n ARG 127 N -4.62 0.00 -1.59 -0.72 1.85 -1.26 -4.60 116.66 105.72 2otg n ARG 127 Ca -0.02 0.00 -0.42 0.00 -1.00 0.00 0.00 57.85 56.41 2otg n ARG 127 Cb 0.57 0.00 0.01 0.00 -1.05 0.00 0.00 32.46 31.98 2otg n ARG 127 CO 0.00 0.00 0.00 0.54 -0.01 0.00 0.00 177.63 178.16 2otg n ARG 128 N 0.00 1.25 -4.18 2.89 5.12 -1.26 -5.01 116.66 115.46 2otg n ARG 128 Ca 0.00 0.45 -0.17 0.00 -1.93 0.00 0.00 57.85 56.20 2otg n ARG 128 Cb 0.00 -1.96 -0.12 0.00 -1.16 0.00 0.00 32.46 29.22 2otg n ARG 128 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 2otg s LEU 129 N -0.17 2.21 0.00 0.55 1.43 -1.26 -5.04 118.68 116.40 2otg s LEU 129 Ca 0.63 -0.49 0.01 0.00 -1.03 0.00 0.00 54.13 53.25 2otg s LEU 129 Cb -0.58 -0.39 0.04 0.00 0.03 0.00 0.00 46.19 45.30 2otg s LEU 129 CO 0.57 -0.07 0.24 -2.65 0.23 0.00 0.00 176.35 174.66 2otg n PRO 130 N 1.70 0.14 0.04 1.29 -0.02 -1.26 -3.95 135.00 132.94 2otg n PRO 130 Ca -0.20 0.00 -0.05 0.00 -2.02 0.00 0.00 63.50 61.24 2otg n PRO 130 Cb 0.55 -1.08 0.17 0.00 -0.02 0.00 0.00 33.50 33.11 2otg n PRO 130 CO 0.00 0.00 0.00 0.82 1.98 0.00 0.00 175.50 178.30 2otg h ILE 131 N 0.00 1.30 -0.77 4.25 2.04 -1.95 -3.33 117.51 119.05 2otg h ILE 131 Ca 0.00 -1.53 -0.46 0.00 1.00 0.00 0.00 64.86 63.87 2otg h ILE 131 Cb 0.00 1.60 -0.23 0.00 -0.74 0.00 0.00 36.82 37.45 2otg h ILE 131 CO 0.00 0.47 0.59 -1.22 0.00 0.00 0.00 178.15 177.99 2otg n TYR 132 N -4.03 2.44 -2.35 1.37 4.02 -1.25 -4.78 117.16 112.57 2otg n TYR 132 Ca -0.01 -2.04 -0.28 0.00 -0.01 0.00 0.00 57.90 55.55 2otg n TYR 132 Cb 0.49 -1.01 0.01 0.00 -0.02 0.00 0.00 39.34 38.81 2otg n TYR 132 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 176.86 176.80 2otg s THR 133 N -3.11 4.68 0.55 -0.72 -4.23 -1.25 -4.91 115.64 106.65 2otg s THR 133 Ca 0.47 0.40 0.22 0.00 -1.18 0.00 0.00 61.69 61.60 2otg s THR 133 Cb 0.38 -3.81 0.32 0.00 1.34 0.00 0.00 72.50 70.73 2otg s THR 133 CO 0.04 -0.90 2.15 0.44 -0.54 0.00 0.00 174.62 175.81 2otg h ASP 134 N -0.01 0.00 -0.26 3.99 3.32 -1.96 -0.81 116.42 120.69 2otg h ASP 134 Ca -0.46 0.00 -0.14 0.00 0.02 0.00 0.00 57.03 56.45 2otg h ASP 134 Cb 1.21 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.76 2otg h ASP 134 CO 0.62 0.00 -0.39 -1.28 -1.72 0.00 0.00 179.24 176.47 2otg h SER 135 N 0.00 0.80 0.05 6.45 0.87 -1.97 -2.90 113.55 116.84 2otg h SER 135 Ca 0.05 -0.51 -0.00 0.00 -1.23 0.00 0.00 61.79 60.09 2otg h SER 135 Cb 0.21 -0.23 0.00 0.00 -0.44 0.00 0.00 62.40 61.95 2otg h SER 135 CO -0.00 1.15 -0.02 0.58 -0.53 0.00 0.00 176.83 178.01 2otg h VAL 136 N 0.46 1.08 -0.80 2.23 2.07 -1.50 -2.98 116.25 116.82 2otg h VAL 136 Ca 0.03 -0.42 0.19 0.00 0.82 0.00 0.00 66.70 67.31 2otg h VAL 136 Cb 0.98 1.37 -0.13 0.00 -1.52 0.00 0.00 31.29 31.99 2otg h VAL 136 CO 0.09 0.11 0.13 0.40 0.02 0.00 0.00 177.57 178.31 2otg h ILE 137 N -0.25 0.37 -0.65 4.57 2.04 -1.23 0.21 117.51 122.57 2otg h ILE 137 Ca -0.01 -0.06 0.18 0.00 1.00 0.00 0.00 64.86 65.98 2otg h ILE 137 Cb 0.22 0.17 -0.03 0.00 -0.74 0.00 0.00 36.82 36.45 2otg h ILE 137 CO 0.01 0.03 0.47 0.00 0.00 0.00 0.00 178.15 178.66 2otg h ALA 138 N 1.71 2.57 0.10 1.87 0.00 -1.34 -1.43 119.26 122.73 2otg h ALA 138 Ca 0.47 -0.02 -0.26 0.00 0.00 0.00 0.00 54.91 55.10 2otg h ALA 138 Cb 0.86 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.69 2otg h ALA 138 CO -0.63 -0.75 -1.16 0.87 0.00 0.00 0.00 179.25 177.58 2otg h LYS 139 N 0.03 0.28 0.00 0.00 1.57 -0.61 -3.31 116.57 114.53 2otg h LYS 139 Ca 0.31 -0.42 0.00 0.00 -1.87 0.00 0.00 60.65 58.67 2otg h LYS 139 Cb 1.20 0.15 0.00 0.00 0.08 0.00 0.00 32.23 33.66 2otg h LYS 139 CO -0.01 1.18 -0.15 0.66 -0.57 0.00 0.00 179.45 180.55 2otg n TYR 140 N -3.57 0.53 -1.66 -1.35 4.02 -0.58 -4.76 117.16 109.78 2otg n TYR 140 Ca -0.07 0.15 -0.48 0.00 -0.01 0.00 0.00 57.90 57.49 2otg n TYR 140 Cb 0.98 -0.71 -0.05 0.00 -0.02 0.00 0.00 39.34 39.54 2otg n TYR 140 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 176.86 176.39 2otg n ARG 141 N -1.96 1.99 -1.93 -0.72 5.12 -0.95 -2.39 116.66 115.81 2otg n ARG 141 Ca 0.06 0.72 -0.14 0.00 -1.93 0.00 0.00 57.85 56.56 2otg n ARG 141 Cb 0.40 -2.49 -0.03 0.00 -1.16 0.00 0.00 32.46 29.18 2otg n ARG 141 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2otg n GLY 142 N 3.58 0.37 3.48 -0.13 0.00 -1.26 -4.97 105.19 106.25 2otg n GLY 142 Ca 0.19 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.86 2otg n GLY 142 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2otg s LYS 143 N -4.12 3.69 1.00 1.61 -0.14 -1.01 -5.09 119.74 115.68 2otg s LYS 143 Ca 0.00 -0.48 -0.14 0.00 -1.36 0.00 0.00 55.97 53.99 2otg s LYS 143 Cb 0.00 -3.16 0.08 0.00 -1.68 0.00 0.00 37.83 33.06 2otg s LYS 143 CO 0.00 0.01 0.43 0.54 -0.76 0.00 0.00 175.35 175.57 2otg n ARG 144 N 4.28 -0.73 -0.25 1.68 5.12 -1.26 -4.90 116.66 120.61 2otg n ARG 144 Ca -0.17 -0.17 -0.05 0.00 -1.93 0.00 0.00 57.85 55.53 2otg n ARG 144 Cb 0.52 -1.89 0.06 0.00 -1.16 0.00 0.00 32.46 29.98 2otg n ARG 144 CO 0.00 0.00 0.00 0.87 -1.93 0.00 0.00 177.63 176.57 2otg h LYS 145 N -1.78 0.90 0.00 5.56 1.57 -1.92 -2.95 116.57 117.95 2otg h LYS 145 Ca -0.47 -0.05 -0.05 0.00 -1.87 0.00 0.00 60.65 58.21 2otg h LYS 145 Cb 1.30 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 33.40 2otg h LYS 145 CO 0.37 0.59 -0.23 1.79 -0.57 0.00 0.00 179.45 181.40 2otg h THR 146 N 0.92 0.80 -1.83 -0.16 1.35 -2.00 -3.28 112.91 108.71 2otg h THR 146 Ca 0.26 -0.91 -0.73 0.00 -0.55 0.00 0.00 66.41 64.48 2otg h THR 146 Cb -0.09 1.55 -0.25 0.00 -1.73 0.00 0.00 68.15 67.63 2otg h THR 146 CO -0.06 0.22 0.99 -1.84 -0.25 0.00 0.00 175.52 174.58 2otg n GLU 147 N -3.74 3.14 0.00 4.72 0.28 -1.11 -4.91 120.64 119.02 2otg n GLU 147 Ca -0.01 -3.47 0.00 0.00 -0.16 0.00 0.00 57.16 53.52 2otg n GLU 147 Cb 0.34 -2.29 0.00 0.00 1.43 0.00 0.00 31.44 30.92 2otg n GLU 147 CO 0.00 0.00 0.00 1.51 -0.16 0.00 0.00 177.13 178.48 2otg n ILE 148 N -0.13 0.00 -1.66 3.84 3.06 -1.24 -4.80 119.36 118.43 2otg n ILE 148 Ca 0.52 0.00 -0.45 0.00 -2.50 0.00 0.00 62.75 60.32 2otg n ILE 148 Cb 0.29 0.00 -0.03 0.00 0.54 0.00 0.00 39.64 40.45 2otg n ILE 148 CO 0.00 0.00 0.00 -2.65 -2.50 0.00 0.00 176.55 171.40 2otg n PRO 149 N -0.48 1.97 -1.53 9.51 -0.02 -1.26 -4.84 135.00 138.35 2otg n PRO 149 Ca 0.00 0.70 -0.58 0.00 -2.02 0.00 0.00 63.50 61.60 2otg n PRO 149 Cb 0.00 -2.35 -0.08 0.00 -0.02 0.00 0.00 33.50 31.06 2otg n PRO 149 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 2otg n PRO 150 N 2.02 0.22 -3.64 0.52 -0.02 -1.26 -4.94 135.00 127.89 2otg n PRO 150 Ca 0.12 0.08 -0.12 0.00 -2.02 0.00 0.00 63.50 61.55 2otg n PRO 150 Cb 0.31 -1.61 -0.07 0.00 -0.02 0.00 0.00 33.50 32.11 2otg n PRO 150 CO 0.00 0.00 0.00 -1.58 1.98 0.00 0.00 175.50 175.90 2otg s HIS 151 N 0.23 -0.81 0.38 6.00 2.46 -1.26 -4.67 115.29 117.62 2otg s HIS 151 Ca 0.90 1.89 0.07 0.00 0.47 0.00 0.00 55.06 58.39 2otg s HIS 151 Cb -1.22 0.33 0.79 0.00 -0.13 0.00 0.00 32.58 32.36 2otg s HIS 151 CO 0.56 -0.40 2.00 1.25 -2.47 0.00 0.00 174.74 175.68 2otg h LEU 152 N 5.49 0.58 -2.00 8.88 5.85 -1.97 0.24 115.31 132.38 2otg h LEU 152 Ca -0.29 -0.00 0.13 0.00 0.84 0.00 0.00 57.88 58.55 2otg h LEU 152 Cb 1.18 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 42.06 2otg h LEU 152 CO 0.09 0.39 0.32 -0.26 -0.34 0.00 0.00 178.44 178.65 2otg h PHE 153 N 0.67 0.00 -0.03 1.25 0.04 -1.95 -0.91 116.94 116.00 2otg h PHE 153 Ca 0.25 0.00 -0.19 0.00 2.80 0.00 0.00 57.97 60.83 2otg h PHE 153 Cb 0.15 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.29 2otg h PHE 153 CO -0.00 0.00 -0.78 1.03 -0.60 0.00 0.00 178.31 177.96 2otg h SER 154 N 0.00 0.35 -0.12 2.17 0.87 -0.88 -0.79 113.55 115.15 2otg h SER 154 Ca 0.21 -0.25 -0.02 0.00 -1.23 0.00 0.00 61.79 60.50 2otg h SER 154 Cb 0.84 -0.10 -0.00 0.00 -0.44 0.00 0.00 62.40 62.69 2otg h SER 154 CO -0.00 1.00 -0.01 0.58 -0.53 0.00 0.00 176.83 177.87 2otg h VAL 155 N 0.18 1.26 -0.05 2.23 2.07 -1.05 -2.34 116.25 118.56 2otg h VAL 155 Ca -0.04 -0.86 -0.00 0.00 0.82 0.00 0.00 66.70 66.62 2otg h VAL 155 Cb 1.37 1.59 -0.00 0.00 -1.52 0.00 0.00 31.29 32.73 2otg h VAL 155 CO 0.13 0.25 0.01 0.00 0.02 0.00 0.00 177.57 177.98 2otg h ALA 156 N 0.73 0.06 -0.82 1.67 0.00 -1.45 -2.37 119.26 117.08 2otg h ALA 156 Ca 0.03 -0.11 0.07 0.00 0.00 0.00 0.00 54.91 54.91 2otg h ALA 156 Cb 0.39 -0.02 -0.06 0.00 0.00 0.00 0.00 17.79 18.10 2otg h ALA 156 CO 0.01 -0.33 0.49 0.22 0.00 0.00 0.00 179.25 179.63 2otg h ASP 157 N -0.13 0.74 0.91 0.00 1.82 -1.15 -0.29 116.42 118.32 2otg h ASP 157 Ca 0.01 0.03 -0.03 0.00 -0.39 0.00 0.00 57.03 56.65 2otg h ASP 157 Cb 0.21 -0.12 -0.00 0.00 0.68 0.00 0.00 39.33 40.10 2otg h ASP 157 CO -0.00 0.45 -0.17 0.78 -1.61 0.00 0.00 179.24 178.70 2otg h ASN 158 N 0.86 0.00 0.17 2.28 2.35 -1.37 0.13 115.58 120.00 2otg h ASN 158 Ca 0.37 0.00 -0.15 0.00 -0.55 0.00 0.00 56.30 55.97 2otg h ASN 158 Cb 0.25 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.61 2otg h ASN 158 CO -0.20 0.17 -0.58 0.00 -1.65 0.00 0.00 177.43 175.17 2otg h ALA 159 N 1.83 0.76 0.36 -0.83 0.00 -0.53 -1.97 119.26 118.89 2otg h ALA 159 Ca -0.00 -0.53 -0.02 0.00 0.00 0.00 0.00 54.91 54.37 2otg h ALA 159 Cb 0.67 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.38 2otg h ALA 159 CO 0.02 0.70 -0.17 -0.92 0.00 0.00 0.00 179.25 178.88 2otg h TYR 160 N 0.32 -0.45 0.00 0.00 3.20 -0.48 -0.91 116.97 118.64 2otg h TYR 160 Ca 0.00 -0.01 -0.00 0.00 3.14 0.00 0.00 58.73 61.86 2otg h TYR 160 Cb 1.10 0.15 -0.00 0.00 1.54 0.00 0.00 36.73 39.52 2otg h TYR 160 CO 0.04 -0.14 -0.01 0.37 -1.64 0.00 0.00 178.16 176.78 2otg h GLN 161 N -1.00 0.00 -0.10 1.82 5.75 -1.10 0.25 115.11 120.74 2otg h GLN 161 Ca -0.05 0.00 -0.20 0.00 -0.15 0.00 0.00 58.65 58.25 2otg h GLN 161 Cb 0.51 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.06 2otg h GLN 161 CO 0.08 0.01 -0.76 -0.91 -2.65 0.00 0.00 178.83 174.60 2otg h ASN 162 N 0.00 0.63 0.10 -0.69 4.21 -1.33 -3.06 115.58 115.45 2otg h ASN 162 Ca -0.00 -0.42 -0.01 0.00 1.21 0.00 0.00 56.30 57.09 2otg h ASN 162 Cb 0.01 -0.19 0.00 0.00 -1.12 0.00 0.00 38.32 37.03 2otg h ASN 162 CO 0.00 1.18 -0.05 -0.03 -1.29 0.00 0.00 177.43 177.24 2otg h MET 163 N 0.35 -0.13 0.00 0.81 4.05 0.94 -1.81 114.93 119.14 2otg h MET 163 Ca -0.04 0.01 0.00 0.00 -0.28 0.00 0.00 59.70 59.39 2otg h MET 163 Cb 1.35 0.03 0.00 0.00 -0.80 0.00 0.00 31.60 32.19 2otg h MET 163 CO 0.14 0.03 0.00 0.28 0.23 0.00 0.00 176.91 177.59 2otg n VAL 164 N -5.09 0.00 -0.12 -5.77 0.31 -0.75 -1.63 118.33 105.28 2otg n VAL 164 Ca -0.08 0.79 -0.03 0.00 -0.01 0.00 0.00 64.34 65.00 2otg n VAL 164 Cb 0.13 -1.72 -0.03 0.00 -0.91 0.00 0.00 33.84 31.31 2otg n VAL 164 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 2otg n THR 165 N -0.32 -0.20 0.31 2.52 -1.04 -1.16 -0.78 114.28 113.62 2otg n THR 165 Ca 0.00 1.17 0.16 0.00 -2.04 0.00 0.00 64.05 63.34 2otg n THR 165 Cb 0.00 -1.49 0.64 0.00 -1.82 0.00 0.00 70.33 67.66 2otg n THR 165 CO 0.00 0.00 0.00 0.44 -0.64 0.00 0.00 175.07 174.87 2otg h ASP 166 N 0.00 0.00 -5.71 8.00 3.32 -1.48 -3.47 116.42 117.08 2otg h ASP 166 Ca 0.05 0.00 -0.34 0.00 0.02 0.00 0.00 57.03 56.76 2otg h ASP 166 Cb 0.12 0.00 0.15 0.00 0.22 0.00 0.00 39.33 39.82 2otg h ASP 166 CO -0.28 0.00 -0.79 0.54 -1.72 0.00 0.00 179.24 176.99 2otg n ARG 167 N -2.86 -5.94 -3.91 3.56 5.12 0.04 -5.01 116.66 107.66 2otg n ARG 167 Ca 0.01 0.81 -0.09 0.00 -1.93 0.00 0.00 57.85 56.65 2otg n ARG 167 Cb 0.28 -5.74 -0.08 0.00 -1.16 0.00 0.00 32.46 25.76 2otg n ARG 167 CO 0.00 0.00 0.00 -2.00 -1.93 0.00 0.00 177.63 173.70 2otg s GLU 168 N -5.39 0.73 0.25 5.56 2.12 -1.21 -5.08 118.70 115.68 2otg s GLU 168 Ca 0.04 -0.90 -0.30 0.00 0.36 0.00 0.00 54.97 54.17 2otg s GLU 168 Cb -0.01 0.29 -0.09 0.00 0.26 0.00 0.00 34.13 34.58 2otg s GLU 168 CO 0.75 -0.21 1.17 -0.80 -0.54 0.00 0.00 175.26 175.63 2otg s ASN 169 N -2.59 7.12 0.33 -1.70 0.01 -1.26 -4.55 114.94 112.29 2otg s ASN 169 Ca 0.02 2.32 0.08 0.00 -0.71 0.00 0.00 52.86 54.57 2otg s ASN 169 Cb 0.03 -2.62 -0.04 0.00 0.41 0.00 0.00 41.25 39.03 2otg s ASN 169 CO -0.08 -0.30 0.16 -1.10 -1.51 0.00 0.00 177.10 174.27 2otg s GLN 170 N -1.01 2.47 -0.19 -0.60 -1.52 -1.12 0.71 119.66 118.40 2otg s GLN 170 Ca 0.49 -1.45 -0.18 0.00 -1.95 0.00 0.00 55.36 52.26 2otg s GLN 170 Cb -0.33 -2.26 0.05 0.00 -0.22 0.00 0.00 33.01 30.25 2otg s GLN 170 CO 0.41 0.15 0.52 -1.54 -0.25 0.00 0.00 175.29 174.59 2otg s SER 171 N -3.86 -0.54 -0.32 5.90 1.04 -0.95 -2.66 113.70 112.31 2otg s SER 171 Ca 0.37 1.04 0.01 0.00 0.48 0.00 0.00 55.95 57.86 2otg s SER 171 Cb -0.04 1.06 0.10 0.00 0.10 0.00 0.00 66.02 67.24 2otg s SER 171 CO 0.23 -0.19 0.07 0.00 0.98 0.00 0.00 173.24 174.33 2otg s LEU 173 N 1.32 4.52 -0.08 0.00 1.02 0.78 -2.62 118.68 123.61 2otg s LEU 173 Ca 0.09 1.54 0.00 0.00 0.02 0.00 0.00 54.13 55.78 2otg s LEU 173 Cb -0.18 -3.25 0.02 0.00 0.02 0.00 0.00 46.19 42.80 2otg s LEU 173 CO -0.17 0.12 -0.06 -0.63 0.02 0.00 0.00 176.35 175.63 2otg s ILE 174 N -0.61 0.82 0.08 -0.59 1.01 -1.14 -0.95 121.20 119.82 2otg s ILE 174 Ca 0.37 -0.20 0.02 0.00 0.00 0.00 0.00 60.65 60.83 2otg s ILE 174 Cb -0.22 -0.85 -0.01 0.00 0.01 0.00 0.00 42.46 41.40 2otg s ILE 174 CO 0.24 0.32 0.06 0.35 0.00 0.00 0.00 174.94 175.91 2otg n THR 175 N 4.66 0.00 0.00 2.92 -2.24 -1.06 -3.88 114.28 114.68 2otg n THR 175 Ca -0.15 -0.57 0.00 0.00 -2.27 0.00 0.00 64.05 61.06 2otg n THR 175 Cb 0.50 0.26 0.00 0.00 -2.10 0.00 0.00 70.33 68.99 2otg n THR 175 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2otg n GLY 176 N 0.42 0.97 0.00 3.38 0.00 -1.26 -0.97 105.19 107.74 2otg n GLY 176 Ca 0.01 -2.01 0.00 0.00 0.00 0.00 0.00 46.02 44.02 2otg n GLY 176 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2otg n GLU 177 N -1.41 0.37 -3.30 1.61 1.02 -1.26 -1.73 120.64 115.94 2otg n GLU 177 Ca 0.00 0.00 -0.38 0.00 -0.02 0.00 0.00 57.16 56.76 2otg n GLU 177 Cb 0.00 0.00 -0.06 0.00 -0.02 0.00 0.00 31.44 31.36 2otg n GLU 177 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 2otg s SER 178 N -1.23 6.80 0.00 1.62 0.15 -1.26 -3.75 113.70 116.03 2otg s SER 178 Ca 0.00 0.95 0.00 0.00 0.70 0.00 0.00 55.95 57.60 2otg s SER 178 Cb 0.00 -2.31 0.00 0.00 -1.71 0.00 0.00 66.02 62.00 2otg s SER 178 CO 0.00 0.07 0.00 0.61 1.20 0.00 0.00 173.24 175.12 2otg n GLY 179 N 2.82 0.57 0.14 9.45 0.00 -1.26 -4.81 105.19 112.09 2otg n GLY 179 Ca -0.08 -0.06 -0.00 0.00 0.00 0.00 0.00 46.02 45.88 2otg n GLY 179 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2otg h ALA 180 N 0.00 0.85 0.00 4.61 0.00 -1.90 -3.44 119.26 119.38 2otg h ALA 180 Ca 0.00 -0.55 0.00 0.00 0.00 0.00 0.00 54.91 54.36 2otg h ALA 180 Cb 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.69 2otg h ALA 180 CO 0.00 0.76 0.00 0.41 0.00 0.00 0.00 179.25 180.42 2otg n GLY 181 N 0.50 1.57 0.08 0.00 0.00 -1.26 -4.18 105.19 101.90 2otg n GLY 181 Ca -0.00 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.92 2otg n GLY 181 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 2otg h LYS 182 N 0.00 0.10 -0.25 1.61 2.10 -1.90 -2.96 116.57 115.27 2otg h LYS 182 Ca 0.00 -0.16 -0.01 0.00 -2.00 0.00 0.00 60.65 58.49 2otg h LYS 182 Cb 0.00 0.06 -0.01 0.00 -0.90 0.00 0.00 32.23 31.38 2otg h LYS 182 CO 0.00 1.06 0.13 1.15 -2.00 0.00 0.00 179.45 179.79 2otg h THR 183 N 0.03 1.13 0.00 0.07 2.02 -1.96 -2.00 112.91 112.19 2otg h THR 183 Ca -0.05 -0.35 0.00 0.00 0.77 0.00 0.00 66.41 66.78 2otg h THR 183 Cb 1.80 0.91 0.00 0.00 -1.74 0.00 0.00 68.15 69.12 2otg h THR 183 CO 0.15 0.13 0.00 -0.08 0.37 0.00 0.00 175.52 176.09 2otg h GLU 184 N 0.28 0.00 0.23 6.66 4.81 -1.99 -2.74 114.58 121.82 2otg h GLU 184 Ca 0.09 0.00 -0.31 0.00 -0.13 0.00 0.00 59.36 59.01 2otg h GLU 184 Cb 0.09 0.00 0.03 0.00 0.63 0.00 0.00 28.75 29.50 2otg h GLU 184 CO -0.01 0.00 -1.36 0.77 -0.73 0.00 0.00 179.01 177.68 2otg h SER 185 N 0.00 0.76 -0.43 1.04 0.02 -1.31 -3.13 113.55 110.50 2otg h SER 185 Ca 0.00 -0.93 0.08 0.00 -0.84 0.00 0.00 61.79 60.10 2otg h SER 185 Cb 0.54 -0.25 -0.07 0.00 0.14 0.00 0.00 62.40 62.76 2otg h SER 185 CO 0.00 1.65 0.01 0.74 -1.14 0.00 0.00 176.83 178.09 2otg h THR 186 N 0.03 0.68 -0.58 -2.27 2.02 -1.09 0.13 112.91 111.84 2otg h THR 186 Ca -0.24 -0.04 0.08 0.00 0.77 0.00 0.00 66.41 66.98 2otg h THR 186 Cb 2.06 0.55 -0.07 0.00 -1.74 0.00 0.00 68.15 68.95 2otg h THR 186 CO 0.25 0.02 0.22 0.11 0.37 0.00 0.00 175.52 176.49 2otg h LYS 187 N 0.12 0.40 -0.31 6.66 1.57 -1.59 -1.95 116.57 121.47 2otg h LYS 187 Ca 0.22 -0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.96 2otg h LYS 187 Cb 0.31 -0.09 -0.02 0.00 0.08 0.00 0.00 32.23 32.51 2otg h LYS 187 CO -0.35 0.27 0.16 0.87 -0.57 0.00 0.00 179.45 179.83 2otg h LYS 188 N 0.41 0.42 -0.00 3.15 6.56 -0.72 -0.41 116.57 125.99 2otg h LYS 188 Ca 0.29 -0.04 -0.12 0.00 -1.06 0.00 0.00 60.65 59.72 2otg h LYS 188 Cb 0.32 -0.09 -0.02 0.00 -0.57 0.00 0.00 32.23 31.88 2otg h LYS 188 CO -0.28 0.32 -0.57 0.28 -2.06 0.00 0.00 179.45 177.14 2otg h VAL 189 N 0.42 1.41 0.06 0.50 2.07 -0.54 -2.38 116.25 117.79 2otg h VAL 189 Ca 0.11 -1.96 -0.11 0.00 0.82 0.00 0.00 66.70 65.56 2otg h VAL 189 Cb 0.02 2.06 0.01 0.00 -1.52 0.00 0.00 31.29 31.86 2otg h VAL 189 CO -0.02 0.56 -0.48 0.40 0.02 0.00 0.00 177.57 178.05 2otg h ILE 190 N 0.00 1.57 -0.23 4.57 1.08 -1.07 -3.20 117.51 120.24 2otg h ILE 190 Ca -0.01 -2.30 0.01 0.00 -0.39 0.00 0.00 64.86 62.17 2otg h ILE 190 Cb 1.01 3.06 -0.01 0.00 -3.07 0.00 0.00 36.82 37.81 2otg h ILE 190 CO 0.07 0.64 0.15 -0.03 -0.69 0.00 0.00 178.15 178.29 2otg h MET 191 N -0.50 0.28 -0.35 2.37 4.05 -1.08 -2.10 114.93 117.59 2otg h MET 191 Ca -0.08 -0.02 -0.14 0.00 -0.28 0.00 0.00 59.70 59.19 2otg h MET 191 Cb 1.31 -0.06 -0.01 0.00 -0.80 0.00 0.00 31.60 32.04 2otg h MET 191 CO 0.09 0.19 -0.33 -0.92 0.23 0.00 0.00 176.91 176.17 2otg h TYR 192 N 0.29 0.91 -0.14 1.39 5.03 -1.48 -2.65 116.97 120.34 2otg h TYR 192 Ca 0.09 -0.25 -0.14 0.00 2.58 0.00 0.00 58.73 61.01 2otg h TYR 192 Cb -0.00 -0.20 0.00 0.00 1.55 0.00 0.00 36.73 38.08 2otg h TYR 192 CO -0.00 1.00 -0.46 0.74 -1.32 0.00 0.00 178.16 178.12 2otg h PHE 193 N 0.66 0.72 -0.94 -3.82 0.05 -1.45 -2.79 116.94 109.37 2otg h PHE 193 Ca 0.07 -0.30 0.19 0.00 3.82 0.00 0.00 57.97 61.75 2otg h PHE 193 Cb 0.87 -0.12 -0.08 0.00 2.00 0.00 0.00 35.95 38.62 2otg h PHE 193 CO 0.05 1.06 0.60 0.00 -0.18 0.00 0.00 178.31 179.84 2otg h ALA 194 N 0.52 1.96 -0.08 2.45 0.00 -1.38 0.14 119.26 122.88 2otg h ALA 194 Ca -0.02 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.93 2otg h ALA 194 Cb 1.09 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.81 2otg h ALA 194 CO 0.10 -0.27 0.00 0.54 0.00 0.00 0.00 179.25 179.62 2otg n ARG 195 N -4.60 1.53 0.00 0.00 1.74 -1.00 -3.52 116.66 110.81 2otg n ARG 195 Ca 0.20 -0.79 0.00 0.00 -0.77 0.00 0.00 57.85 56.49 2otg n ARG 195 Cb 0.61 -1.42 0.00 0.00 -1.02 0.00 0.00 32.46 30.63 2otg n ARG 195 CO 0.00 0.00 0.00 1.33 -1.52 0.00 0.00 177.63 177.44 2otg n VAL 196 N -0.01 0.00 -2.66 1.55 0.24 0.24 -4.83 118.33 112.86 2otg n VAL 196 Ca 0.18 -0.09 -0.11 0.00 -2.04 0.00 0.00 64.34 62.28 2otg n VAL 196 Cb 0.28 0.51 0.03 0.00 -1.47 0.00 0.00 33.84 33.18 2otg n VAL 196 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2otg n ALA 197 N -0.86 3.54 -2.60 2.33 0.00 0.24 -5.08 120.51 118.08 2otg n ALA 197 Ca 0.00 -3.25 -0.41 0.00 0.00 0.00 0.00 53.44 49.78 2otg n ALA 197 Cb 0.00 -0.90 -0.06 0.00 0.00 0.00 0.00 19.45 18.48 2otg n ALA 197 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2otg s ALA 198 N -3.14 3.54 0.12 0.00 0.00 -1.23 -2.26 121.76 118.78 2otg s ALA 198 Ca 0.29 -0.59 -0.10 0.00 0.00 0.00 0.00 51.96 51.56 2otg s ALA 198 Cb 0.45 -3.12 0.12 0.00 0.00 0.00 0.00 23.12 20.57 2otg s ALA 198 CO 0.02 -1.06 0.85 0.09 0.00 0.00 0.00 175.76 175.66 2otg n ASN 199 N 5.90 -0.38 -0.91 0.00 4.13 -1.26 -5.01 115.26 117.74 2otg n ASN 199 Ca -0.00 0.96 0.00 0.00 1.68 0.00 0.00 54.58 57.22 2otg n ASN 199 Cb 0.49 -0.21 0.00 0.00 -1.54 0.00 0.00 39.78 38.51 2otg n ASN 199 CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72 2otg n LEU 200 N -4.80 -1.21 -4.17 3.41 4.77 -1.26 -5.11 117.00 108.63 2otg n LEU 200 Ca 0.05 0.00 -0.26 0.00 -0.03 0.00 0.00 56.01 55.78 2otg n LEU 200 Cb 0.21 -0.32 0.23 0.00 -2.33 0.00 0.00 43.42 41.22 2otg n LEU 200 CO -0.08 0.00 0.20 -1.54 -1.33 0.00 0.00 177.39 174.65 2otg n SER 213 N -0.89 -3.44 -4.30 -1.43 3.41 -1.26 -5.27 113.62 100.45 2otg n SER 213 Ca 0.00 -0.59 -0.33 0.00 -0.26 0.00 0.00 58.87 57.69 2otg n SER 213 Cb 0.30 -0.94 0.14 0.00 -0.26 0.00 0.00 64.21 63.45 2otg n SER 213 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 2otg n ASN 214 N -3.83 -2.54 -0.02 4.04 3.02 -1.26 -4.73 115.26 109.95 2otg n ASN 214 Ca 0.09 0.08 -0.13 0.00 -0.03 0.00 0.00 54.58 54.59 2otg n ASN 214 Cb 0.50 -1.01 -0.09 0.00 -0.61 0.00 0.00 39.78 38.57 2otg n ASN 214 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 2otg h LEU 215 N -1.74 0.08 -0.89 3.41 3.38 -1.98 -2.47 115.31 115.10 2otg h LEU 215 Ca -0.48 -0.43 0.18 0.00 0.09 0.00 0.00 57.88 57.23 2otg h LEU 215 Cb 1.33 -0.02 -0.17 0.00 0.09 0.00 0.00 40.66 41.89 2otg h LEU 215 CO 0.35 0.49 -0.22 -0.33 0.09 0.00 0.00 178.44 178.83 2otg h GLU 216 N -0.34 0.00 0.76 1.13 3.07 -1.96 -0.32 114.58 116.92 2otg h GLU 216 Ca 0.01 -0.00 -0.04 0.00 -0.50 0.00 0.00 59.36 58.83 2otg h GLU 216 Cb 0.47 -0.00 0.01 0.00 -0.84 0.00 0.00 28.75 28.38 2otg h GLU 216 CO 0.01 0.00 -0.39 -0.44 -1.40 0.00 0.00 179.01 176.79 2otg h ASP 217 N 0.00 -0.94 -1.47 1.42 3.45 -1.89 -2.86 116.42 114.14 2otg h ASP 217 Ca 0.43 0.04 0.43 0.00 0.43 0.00 0.00 57.03 58.35 2otg h ASP 217 Cb 0.66 0.25 -0.07 0.00 -0.56 0.00 0.00 39.33 39.61 2otg h ASP 217 CO -0.91 -0.64 1.04 1.56 -1.57 0.00 0.00 179.24 178.72 2otg h GLN 218 N -1.05 0.04 0.00 3.56 4.20 -0.70 1.06 115.11 122.21 2otg h GLN 218 Ca -0.10 -0.00 -0.13 0.00 0.06 0.00 0.00 58.65 58.48 2otg h GLN 218 Cb 0.81 -0.01 -0.02 0.00 0.30 0.00 0.00 27.48 28.57 2otg h GLN 218 CO 0.16 0.02 -0.60 0.82 -0.67 0.00 0.00 178.83 178.56 2otg h ILE 219 N 0.04 1.38 -0.11 2.54 2.04 -0.89 -2.49 117.51 120.02 2otg h ILE 219 Ca 0.73 -2.11 -0.16 0.00 1.00 0.00 0.00 64.86 64.32 2otg h ILE 219 Cb 2.77 2.15 0.01 0.00 -0.74 0.00 0.00 36.82 41.01 2otg h ILE 219 CO -0.08 0.59 -0.55 0.40 0.00 0.00 0.00 178.15 178.51 2otg h ILE 220 N 0.00 1.35 0.00 -0.67 1.08 0.12 -3.22 117.51 116.17 2otg h ILE 220 Ca -0.01 -1.85 -0.01 0.00 -0.39 0.00 0.00 64.86 62.60 2otg h ILE 220 Cb 1.10 2.16 -0.00 0.00 -3.07 0.00 0.00 36.82 37.01 2otg h ILE 220 CO 0.08 0.56 -0.06 -0.33 -0.69 0.00 0.00 178.15 177.71 2otg h GLU 221 N 0.19 0.00 0.00 2.37 4.39 -1.18 -2.80 114.58 117.55 2otg h GLU 221 Ca -0.04 0.00 -0.04 0.00 0.34 0.00 0.00 59.36 59.62 2otg h GLU 221 Cb 1.20 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.84 2otg h GLU 221 CO 0.11 0.06 -0.20 0.00 -1.16 0.00 0.00 179.01 177.83 2otg h ALA 222 N 1.94 1.18 -0.03 3.43 0.00 -1.46 -3.15 119.26 121.17 2otg h ALA 222 Ca -0.00 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.72 2otg h ALA 222 Cb 0.23 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 17.98 2otg h ALA 222 CO 0.01 0.25 -0.00 -0.91 0.00 0.00 0.00 179.25 178.60 2otg h ASN 223 N 0.00 0.05 -0.50 0.00 2.35 -1.65 -2.49 115.58 113.34 2otg h ASN 223 Ca -0.00 -0.33 0.09 0.00 -0.55 0.00 0.00 56.30 55.51 2otg h ASN 223 Cb 0.55 -0.01 -0.10 0.00 0.05 0.00 0.00 38.32 38.81 2otg h ASN 223 CO 0.03 0.37 -0.34 -0.65 -1.65 0.00 0.00 177.43 175.18 2otg h PRO 224 N -0.26 -0.20 -0.58 0.81 0.11 -1.72 1.13 132.00 131.28 2otg h PRO 224 Ca 0.01 0.01 -0.05 0.00 0.11 0.00 0.00 66.00 66.08 2otg h PRO 224 Cb 0.34 0.05 -0.02 0.00 0.11 0.00 0.00 31.00 31.47 2otg h PRO 224 CO 0.00 -0.13 0.18 -0.39 -0.21 0.00 0.00 178.00 177.44 2otg h VAL 225 N -0.21 1.24 -0.44 3.15 -1.51 -1.67 0.15 116.25 116.96 2otg h VAL 225 Ca 0.20 -0.82 -0.03 0.00 -1.23 0.00 0.00 66.70 64.82 2otg h VAL 225 Cb 0.55 0.68 -0.02 0.00 -2.13 0.00 0.00 31.29 30.37 2otg h VAL 225 CO -0.62 0.31 0.18 -0.07 -1.23 0.00 0.00 177.57 176.14 2otg h LEU 226 N 0.82 0.61 -1.17 4.19 3.38 -0.84 -1.69 115.31 120.61 2otg h LEU 226 Ca 0.19 -0.17 0.00 0.00 0.09 0.00 0.00 57.88 57.99 2otg h LEU 226 Cb 0.29 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.89 2otg h LEU 226 CO -0.00 0.61 0.00 -0.33 0.09 0.00 0.00 178.44 178.80 2otg h GLU 227 N 0.57 0.00 -0.31 1.13 5.08 0.15 0.43 114.58 121.64 2otg h GLU 227 Ca 0.15 0.00 -0.16 0.00 -1.00 0.00 0.00 59.36 58.35 2otg h GLU 227 Cb 0.19 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.43 2otg h GLU 227 CO -0.01 0.00 -0.44 0.00 -1.00 0.00 0.00 179.01 177.56 2otg h ALA 228 N 2.10 0.64 -0.00 3.43 0.00 -0.00 -2.81 119.26 122.62 2otg h ALA 228 Ca 0.00 -0.47 0.00 0.00 0.00 0.00 0.00 54.91 54.44 2otg h ALA 228 Cb 0.47 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.16 2otg h ALA 228 CO 0.00 0.67 -0.41 1.19 0.00 0.00 0.00 179.25 180.70 2otg n PHE 229 N -4.03 0.00 -0.04 0.00 3.01 -1.13 0.50 117.46 115.78 2otg n PHE 229 Ca -0.02 0.00 0.03 0.00 1.01 0.00 0.00 57.45 58.47 2otg n PHE 229 Cb 0.56 0.00 -0.15 0.00 -0.01 0.00 0.00 39.48 39.88 2otg n PHE 229 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2otg n GLY 230 N 1.19 -0.89 3.69 1.37 0.00 0.15 -4.93 105.19 105.77 2otg n GLY 230 Ca 0.02 -0.41 -0.23 0.00 0.00 0.00 0.00 46.02 45.40 2otg n GLY 230 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2otg s ASN 231 N -4.58 4.54 0.24 1.61 -0.87 -1.06 0.15 114.94 114.98 2otg s ASN 231 Ca -0.08 -0.78 -0.18 0.00 -1.57 0.00 0.00 52.86 50.26 2otg s ASN 231 Cb 0.10 -0.72 0.02 0.00 -0.02 0.00 0.00 41.25 40.62 2otg s ASN 231 CO 0.78 -0.20 0.58 0.00 -2.57 0.00 0.00 177.10 175.69 2otg s ALA 232 N -2.42 -0.86 -0.29 0.60 0.00 -0.94 -2.85 121.76 115.00 2otg s ALA 232 Ca 0.35 -0.41 -0.17 0.00 0.00 0.00 0.00 51.96 51.74 2otg s ALA 232 Cb -0.03 0.91 -0.02 0.00 0.00 0.00 0.00 23.12 23.98 2otg s ALA 232 CO 0.21 -0.89 0.45 0.21 0.00 0.00 0.00 175.76 175.73 2otg s LYS 233 N -3.92 3.89 0.37 0.00 2.20 -1.26 -1.65 119.74 119.36 2otg s LYS 233 Ca 0.13 0.03 0.08 0.00 -0.36 0.00 0.00 55.97 55.85 2otg s LYS 233 Cb -0.03 -3.71 -0.07 0.00 -1.51 0.00 0.00 37.83 32.52 2otg s LYS 233 CO 0.03 -0.41 -0.04 -0.08 -0.36 0.00 0.00 175.35 174.49 2otg s THR 234 N 2.21 2.06 0.58 3.43 -1.32 0.49 -2.07 115.64 121.02 2otg s THR 234 Ca 0.17 -2.10 0.31 0.00 -1.21 0.00 0.00 61.69 58.86 2otg s THR 234 Cb -0.16 -2.80 0.36 0.00 -1.51 0.00 0.00 72.50 68.39 2otg s THR 234 CO 0.11 -0.11 2.25 0.58 -2.21 0.00 0.00 174.62 175.24 2otg h VAL 235 N 1.93 0.49 0.00 5.08 2.07 -1.92 -3.07 116.25 120.83 2otg h VAL 235 Ca -0.43 -0.06 -0.08 0.00 0.82 0.00 0.00 66.70 66.96 2otg h VAL 235 Cb 1.24 1.04 -0.01 0.00 -1.52 0.00 0.00 31.29 32.04 2otg h VAL 235 CO 0.75 0.01 -0.54 0.03 0.02 0.00 0.00 177.57 177.85 2otg h ARG 236 N 0.00 0.00 -6.18 1.57 2.47 -1.95 -3.48 114.38 106.81 2otg h ARG 236 Ca -0.00 0.00 -0.59 0.00 -1.26 0.00 0.00 59.98 58.13 2otg h ARG 236 Cb 0.04 0.00 -0.25 0.00 -1.65 0.00 0.00 29.97 28.10 2otg h ARG 236 CO 0.00 0.64 -0.84 1.21 0.56 0.00 0.00 179.97 181.54 2otg s ASN 237 N -6.24 2.58 0.00 7.04 3.04 -1.16 -4.76 114.94 115.44 2otg s ASN 237 Ca -0.18 -0.55 0.22 0.00 0.04 0.00 0.00 52.86 52.38 2otg s ASN 237 Cb 0.02 -0.21 0.85 0.00 -1.54 0.00 0.00 41.25 40.37 2otg s ASN 237 CO 0.45 0.16 1.60 0.59 -3.04 0.00 0.00 177.10 176.86 2otg n ASN 238 N 1.74 1.45 -2.76 -4.21 5.03 -1.26 -0.38 115.26 114.87 2otg n ASN 238 Ca -0.17 -1.64 -0.09 0.00 0.87 0.00 0.00 54.58 53.55 2otg n ASN 238 Cb 0.53 -0.08 0.08 0.00 -1.02 0.00 0.00 39.78 39.29 2otg n ASN 238 CO 0.00 0.00 0.00 -3.20 -1.83 0.00 0.00 177.26 172.23 2otg n ASN 239 N 0.17 -2.31 -4.61 6.41 5.15 -1.25 -4.54 115.26 114.28 2otg n ASN 239 Ca 0.16 -3.60 -0.42 0.00 -0.60 0.00 0.00 54.58 50.13 2otg n ASN 239 Cb 0.30 1.80 -0.05 0.00 -0.53 0.00 0.00 39.78 41.31 2otg n ASN 239 CO 0.00 0.00 0.00 -0.55 1.40 0.00 0.00 177.26 178.11 2otg s SER 240 N -1.39 6.68 -0.11 1.20 0.15 -0.66 -4.83 113.70 114.72 2otg s SER 240 Ca 0.25 0.68 -0.29 0.00 0.70 0.00 0.00 55.95 57.28 2otg s SER 240 Cb 0.28 -2.42 -0.04 0.00 -1.71 0.00 0.00 66.02 62.13 2otg s SER 240 CO -0.09 -0.63 1.56 -0.94 1.20 0.00 0.00 173.24 174.33 2otg s SER 241 N 1.62 6.67 -0.29 5.45 1.04 -1.26 -2.20 113.70 124.73 2otg s SER 241 Ca 0.33 1.98 0.03 0.00 0.48 0.00 0.00 55.95 58.77 2otg s SER 241 Cb -0.14 -2.53 0.44 0.00 0.10 0.00 0.00 66.02 63.88 2otg s SER 241 CO 0.13 -0.96 1.59 0.54 0.98 0.00 0.00 173.24 175.52 2otg n ARG 242 N 7.12 1.87 -3.59 4.02 5.12 0.12 -4.89 116.66 126.44 2otg n ARG 242 Ca 0.17 -1.96 -0.11 0.00 -1.93 0.00 0.00 57.85 54.02 2otg n ARG 242 Cb 0.44 -1.77 -0.04 0.00 -1.16 0.00 0.00 32.46 29.92 2otg n ARG 242 CO 0.00 0.00 0.00 -0.59 -1.93 0.00 0.00 177.63 175.11 2otg s PHE 243 N -2.14 -0.28 -0.12 -1.55 -0.12 -1.26 -2.44 117.98 110.06 2otg s PHE 243 Ca 0.37 -0.01 -0.10 0.00 -0.05 0.00 0.00 56.93 57.14 2otg s PHE 243 Cb 0.31 0.32 -0.05 0.00 -0.63 0.00 0.00 43.02 42.98 2otg s PHE 243 CO 0.07 -0.73 0.21 0.20 -0.05 0.00 0.00 175.22 174.92 2otg s GLY 244 N -2.78 2.20 -0.08 1.99 0.00 0.08 -4.88 107.32 103.86 2otg s GLY 244 Ca 0.02 -0.54 0.02 0.00 0.00 0.00 0.00 44.72 44.23 2otg s GLY 244 CO -0.12 -0.04 -0.14 -1.59 0.00 0.00 0.00 173.10 171.21 2otg s LYS 245 N -0.50 1.95 -0.29 2.90 -2.85 -1.15 -0.11 119.74 119.69 2otg s LYS 245 Ca 0.16 -0.49 -0.05 0.00 -1.00 0.00 0.00 55.97 54.59 2otg s LYS 245 Cb -0.13 -1.61 0.03 0.00 -2.06 0.00 0.00 37.83 34.05 2otg s LYS 245 CO 0.05 0.01 0.04 0.12 0.10 0.00 0.00 175.35 175.66 2otg s PHE 246 N 0.75 3.17 -0.18 1.78 5.36 -0.29 -2.50 117.98 126.08 2otg s PHE 246 Ca -0.12 -1.35 -0.04 0.00 -0.96 0.00 0.00 56.93 54.45 2otg s PHE 246 Cb -0.16 -2.19 -0.02 0.00 -0.34 0.00 0.00 43.02 40.31 2otg s PHE 246 CO 0.03 -0.68 -0.03 0.42 -1.46 0.00 0.00 175.22 173.50 2otg s ILE 247 N 1.40 3.86 -0.17 3.12 1.01 -0.62 -1.23 121.20 128.57 2otg s ILE 247 Ca -0.00 -0.36 -0.01 0.00 0.00 0.00 0.00 60.65 60.28 2otg s ILE 247 Cb -0.18 -2.71 -0.01 0.00 0.01 0.00 0.00 42.46 39.57 2otg s ILE 247 CO 0.00 0.46 -0.11 -0.13 0.00 0.00 0.00 174.94 175.16 2otg s ARG 248 N 0.68 3.31 -0.31 2.79 0.52 -0.65 0.54 118.95 125.83 2otg s ARG 248 Ca -0.01 -0.69 -0.10 0.00 -0.52 0.00 0.00 55.73 54.40 2otg s ARG 248 Cb -0.14 -2.75 -0.02 0.00 0.52 0.00 0.00 34.95 32.56 2otg s ARG 248 CO 0.02 -0.01 0.17 0.42 0.02 0.00 0.00 175.30 175.92 2otg s ILE 249 N 0.92 4.79 0.07 1.52 -1.09 0.04 -2.03 121.20 125.41 2otg s ILE 249 Ca -0.02 -0.29 -0.20 0.00 -2.23 0.00 0.00 60.65 57.90 2otg s ILE 249 Cb -0.15 -3.41 -0.07 0.00 -1.58 0.00 0.00 42.46 37.25 2otg s ILE 249 CO -0.01 0.10 0.61 -1.00 -1.23 0.00 0.00 174.94 173.41 2otg s HIS 250 N 1.65 3.80 0.18 3.97 3.76 0.14 -1.90 115.29 126.90 2otg s HIS 250 Ca 0.05 1.31 0.11 0.00 -0.15 0.00 0.00 55.06 56.38 2otg s HIS 250 Cb -0.17 -2.56 -0.04 0.00 1.11 0.00 0.00 32.58 30.92 2otg s HIS 250 CO 0.07 0.53 -0.22 -0.06 -0.85 0.00 0.00 174.74 174.21 2otg s PHE 251 N -0.94 2.16 0.45 1.40 0.40 -0.16 0.70 117.98 122.00 2otg s PHE 251 Ca 0.30 -0.39 0.07 0.00 -0.60 0.00 0.00 56.93 56.31 2otg s PHE 251 Cb -0.20 -1.07 0.02 0.00 0.51 0.00 0.00 43.02 42.28 2otg s PHE 251 CO 0.20 0.45 0.62 0.20 0.70 0.00 0.00 175.22 177.39 2otg s GLY 252 N -2.64 1.91 0.00 4.36 0.00 0.79 -1.54 107.32 110.20 2otg s GLY 252 Ca 0.19 -1.65 0.00 0.00 0.00 0.00 0.00 44.72 43.26 2otg s GLY 252 CO 0.09 -1.43 0.46 -1.05 0.00 0.00 0.00 173.10 171.17 2otg n PRO 253 N -1.97 0.00 -0.05 2.90 -0.02 -1.26 0.47 135.00 135.06 2otg n PRO 253 Ca 0.09 0.10 0.05 0.00 -2.02 0.00 0.00 63.50 61.72 2otg n PRO 253 Cb 0.59 -1.63 0.08 0.00 -0.02 0.00 0.00 33.50 32.52 2otg n PRO 253 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 2otg n THR 254 N -0.96 1.47 -2.95 3.45 -2.24 -1.26 -4.98 114.28 106.81 2otg n THR 254 Ca 0.00 -1.65 -0.14 0.00 -2.27 0.00 0.00 64.05 59.99 2otg n THR 254 Cb 0.13 0.12 0.04 0.00 -2.10 0.00 0.00 70.33 68.51 2otg n THR 254 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2otg n GLY 255 N -0.93 -0.02 3.48 3.38 0.00 0.18 -5.03 105.19 106.25 2otg n GLY 255 Ca 0.09 -0.16 -0.31 0.00 0.00 0.00 0.00 46.02 45.64 2otg n GLY 255 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2otg s LYS 256 N -5.53 2.20 0.09 1.61 -0.14 -1.22 -4.72 119.74 112.02 2otg s LYS 256 Ca 0.28 -0.91 -0.33 0.00 -1.36 0.00 0.00 55.97 53.65 2otg s LYS 256 Cb -0.12 -2.26 -0.12 0.00 -1.68 0.00 0.00 37.83 33.65 2otg s LYS 256 CO 0.34 0.56 1.78 -0.89 -0.76 0.00 0.00 175.35 176.38 2otg n ILE 257 N 1.64 0.31 -0.03 2.17 5.41 -0.96 -0.15 119.36 127.75 2otg n ILE 257 Ca -0.16 -0.06 -0.02 0.00 1.00 0.00 0.00 62.75 63.51 2otg n ILE 257 Cb 0.52 -1.91 -0.04 0.00 -0.71 0.00 0.00 39.64 37.49 2otg n ILE 257 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2otg n ALA 258 N 5.26 1.88 -3.93 -1.39 0.00 0.22 -4.77 120.51 117.79 2otg n ALA 258 Ca 0.19 -0.36 -0.00 0.00 0.00 0.00 0.00 53.44 53.26 2otg n ALA 258 Cb 0.33 0.11 0.02 0.00 0.00 0.00 0.00 19.45 19.91 2otg n ALA 258 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2otg s GLY 259 N -3.63 0.00 0.17 0.00 0.00 -0.94 -4.54 107.32 98.38 2otg s GLY 259 Ca -0.03 -0.16 -0.24 0.00 0.00 0.00 0.00 44.72 44.30 2otg s GLY 259 CO 0.23 3.88 0.73 0.00 0.00 0.00 0.00 173.10 177.94 2otg s ALA 260 N -2.10 -1.53 0.12 3.20 0.00 -1.22 0.25 121.76 120.49 2otg s ALA 260 Ca 0.25 0.28 -0.20 0.00 0.00 0.00 0.00 51.96 52.29 2otg s ALA 260 Cb -0.02 0.77 0.05 0.00 0.00 0.00 0.00 23.12 23.93 2otg s ALA 260 CO 0.02 -0.88 0.50 0.16 0.00 0.00 0.00 175.76 175.57 2otg s ASP 261 N -2.79 -0.40 0.11 0.00 1.47 -0.86 -4.31 116.67 109.90 2otg s ASP 261 Ca 0.06 -0.11 0.07 0.00 1.18 0.00 0.00 52.55 53.75 2otg s ASP 261 Cb -0.03 0.52 -0.04 0.00 -0.34 0.00 0.00 42.92 43.04 2otg s ASP 261 CO -0.04 -0.87 -0.17 -0.63 0.68 0.00 0.00 175.17 174.14 2otg s ILE 262 N -3.53 1.48 0.03 2.11 1.01 -1.26 -1.64 121.20 119.40 2otg s ILE 262 Ca 0.01 -1.61 0.03 0.00 0.00 0.00 0.00 60.65 59.08 2otg s ILE 262 Cb 0.00 -1.49 -0.02 0.00 0.01 0.00 0.00 42.46 40.96 2otg s ILE 262 CO -0.10 -0.25 -0.09 -1.61 0.00 0.00 0.00 174.94 172.88 2otg s GLU 263 N -2.26 0.63 0.27 2.79 0.41 -0.37 -4.95 118.70 115.21 2otg s GLU 263 Ca 0.07 -0.66 0.07 0.00 -0.41 0.00 0.00 54.97 54.05 2otg s GLU 263 Cb -0.08 -0.52 -0.06 0.00 -1.78 0.00 0.00 34.13 31.70 2otg s GLU 263 CO 0.04 0.12 -0.09 0.95 -0.49 0.00 0.00 175.26 175.79 2otg s THR 264 N -0.98 1.74 -0.05 3.63 -4.23 -1.26 -1.13 115.64 113.36 2otg s THR 264 Ca -0.04 -2.16 -0.09 0.00 -1.18 0.00 0.00 61.69 58.22 2otg s THR 264 Cb -0.08 -2.37 0.02 0.00 1.34 0.00 0.00 72.50 71.41 2otg s THR 264 CO 0.01 -0.36 0.22 -0.31 -0.54 0.00 0.00 174.62 173.63 2otg s TYR 265 N -2.95 -0.15 -0.95 3.99 2.02 0.84 -4.91 117.35 115.24 2otg s TYR 265 Ca 0.28 0.32 -0.18 0.00 -0.37 0.00 0.00 57.07 57.12 2otg s TYR 265 Cb 0.02 0.05 0.03 0.00 -0.40 0.00 0.00 41.96 41.65 2otg s TYR 265 CO 0.11 -0.22 0.58 1.28 -1.57 0.00 0.00 175.55 175.73 2otg n LEU 266 N 2.18 -0.76 -4.75 -1.29 4.77 -1.26 -0.74 117.00 115.15 2otg n LEU 266 Ca -0.17 -1.06 -0.41 0.00 -0.03 0.00 0.00 56.01 54.33 2otg n LEU 266 Cb 0.57 -1.44 -0.02 0.00 -2.33 0.00 0.00 43.42 40.20 2otg n LEU 266 CO 0.20 0.59 1.08 -0.22 -1.33 0.00 0.00 177.39 177.71 2otg s LEU 267 N -6.15 4.39 -0.92 2.23 2.96 -1.26 -4.53 118.68 115.41 2otg s LEU 267 Ca 0.25 2.69 -0.24 0.00 -0.22 0.00 0.00 54.13 56.61 2otg s LEU 267 Cb -0.14 -3.63 0.05 0.00 0.50 0.00 0.00 46.19 42.97 2otg s LEU 267 CO 0.86 -0.68 1.36 -0.70 -1.32 0.00 0.00 176.35 175.87 2otg s GLU 268 N -0.74 3.45 0.09 1.98 2.12 -1.02 -4.86 118.70 119.71 2otg s GLU 268 Ca 0.57 -0.87 -0.13 0.00 0.36 0.00 0.00 54.97 54.90 2otg s GLU 268 Cb -0.42 -4.93 -0.17 0.00 0.26 0.00 0.00 34.13 28.87 2otg s GLU 268 CO 0.46 -2.16 1.28 0.87 -0.54 0.00 0.00 175.26 175.17 2otg h LYS 269 N 9.81 0.77 -0.59 4.30 1.57 -1.92 -3.30 116.57 127.21 2otg h LYS 269 Ca 0.03 -0.67 0.17 0.00 -1.87 0.00 0.00 60.65 58.31 2otg h LYS 269 Cb 1.03 0.15 -0.02 0.00 0.08 0.00 0.00 32.23 33.46 2otg h LYS 269 CO 1.36 1.27 0.62 0.66 -0.57 0.00 0.00 179.45 182.79 2otg h SER 270 N 0.50 0.00 -0.12 0.86 4.64 -1.95 -0.53 113.55 116.95 2otg h SER 270 Ca -0.07 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 61.14 2otg h SER 270 Cb 1.47 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.55 2otg h SER 270 CO 0.17 0.00 -0.26 -0.09 -0.87 0.00 0.00 176.83 175.78 2otg h ARG 271 N 0.00 0.57 -1.14 4.77 2.43 -1.72 -2.47 114.38 116.82 2otg h ARG 271 Ca 0.28 -0.23 0.32 0.00 -0.81 0.00 0.00 59.98 59.54 2otg h ARG 271 Cb 1.51 -0.03 -0.10 0.00 -0.42 0.00 0.00 29.97 30.94 2otg h ARG 271 CO -0.00 0.78 0.74 0.28 -1.51 0.00 0.00 179.97 180.26 2otg h VAL 272 N 0.50 0.40 -0.00 0.20 2.07 -1.30 -2.17 116.25 115.95 2otg h VAL 272 Ca 0.07 -0.09 0.00 0.00 0.82 0.00 0.00 66.70 67.50 2otg h VAL 272 Cb 0.72 0.12 0.00 0.00 -1.52 0.00 0.00 31.29 30.60 2otg h VAL 272 CO 0.05 0.05 -0.09 0.35 0.02 0.00 0.00 177.57 177.96 2otg n THR 273 N -4.58 0.00 -4.35 2.57 -2.24 -1.21 -4.84 114.28 99.63 2otg n THR 273 Ca 0.28 -0.46 -0.20 0.00 -2.27 0.00 0.00 64.05 61.41 2otg n THR 273 Cb 1.07 1.02 -0.15 0.00 -2.10 0.00 0.00 70.33 70.17 2otg n THR 273 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 2otg s TYR 274 N -0.95 0.90 -0.01 4.78 5.04 -0.82 -4.77 117.35 121.53 2otg s TYR 274 Ca 0.02 -0.22 0.05 0.00 -2.44 0.00 0.00 57.07 54.47 2otg s TYR 274 Cb 0.02 -0.65 -0.01 0.00 0.35 0.00 0.00 41.96 41.67 2otg s TYR 274 CO 0.08 -0.10 -0.16 -0.65 -1.34 0.00 0.00 175.55 173.38 2otg s GLN 275 N 0.23 1.28 0.35 4.97 1.11 -1.26 -4.17 119.66 122.17 2otg s GLN 275 Ca -0.04 -0.60 -0.05 0.00 0.01 0.00 0.00 55.36 54.69 2otg s GLN 275 Cb -0.09 -1.25 -0.05 0.00 -1.01 0.00 0.00 33.01 30.62 2otg s GLN 275 CO 0.00 0.34 0.62 -1.14 0.01 0.00 0.00 175.29 175.13 2otg s GLN 276 N -0.47 3.61 0.39 2.91 0.74 -1.26 -4.38 119.66 121.20 2otg s GLN 276 Ca 0.06 0.03 -0.24 0.00 0.05 0.00 0.00 55.36 55.27 2otg s GLN 276 Cb -0.06 -2.57 -0.13 0.00 1.10 0.00 0.00 33.01 31.35 2otg s GLN 276 CO -0.00 0.09 0.69 0.45 -0.55 0.00 0.00 175.29 175.97 2otg n SER 277 N -1.40 -0.21 -2.21 6.67 2.88 -1.26 -1.62 113.62 116.47 2otg n SER 277 Ca -0.01 0.98 -0.18 0.00 -1.33 0.00 0.00 58.87 58.33 2otg n SER 277 Cb 0.55 -1.17 -0.02 0.00 -0.75 0.00 0.00 64.21 62.81 2otg n SER 277 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2otg n ALA 278 N -0.62 -0.59 -2.57 -1.46 0.00 -1.26 -4.86 120.51 109.16 2otg n ALA 278 Ca 0.11 0.18 -0.18 0.00 0.00 0.00 0.00 53.44 53.55 2otg n ALA 278 Cb 0.38 -1.90 -0.11 0.00 0.00 0.00 0.00 19.45 17.81 2otg n ALA 278 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 2otg s GLU 279 N -4.69 0.93 0.37 0.00 2.02 -0.64 -4.47 118.70 112.21 2otg s GLU 279 Ca 0.00 -1.12 0.08 0.00 0.02 0.00 0.00 54.97 53.95 2otg s GLU 279 Cb 0.00 -0.83 -0.06 0.00 0.10 0.00 0.00 34.13 33.34 2otg s GLU 279 CO 0.00 0.17 -0.01 1.03 0.02 0.00 0.00 175.26 176.47 2otg s ARG 280 N -2.35 1.98 0.00 1.61 0.52 -0.88 -2.45 118.95 117.39 2otg s ARG 280 Ca 0.04 -1.92 0.00 0.00 -0.52 0.00 0.00 55.73 53.34 2otg s ARG 280 Cb -0.06 -1.78 0.00 0.00 0.52 0.00 0.00 34.95 33.62 2otg s ARG 280 CO 0.02 0.06 0.00 -1.71 0.02 0.00 0.00 175.30 173.69 2otg n ASN 281 N -0.94 0.00 -4.78 0.23 2.85 -1.26 -4.26 115.26 107.11 2otg n ASN 281 Ca -0.04 -0.10 -0.37 0.00 -0.11 0.00 0.00 54.58 53.96 2otg n ASN 281 Cb 0.64 0.00 -0.02 0.00 1.24 0.00 0.00 39.78 41.64 2otg n ASN 281 CO 0.00 0.00 0.00 -0.31 -2.11 0.00 0.00 177.26 174.84 2otg s TYR 282 N -0.06 3.00 0.27 1.20 2.02 -1.26 -4.24 117.35 118.27 2otg s TYR 282 Ca 0.00 1.57 -0.03 0.00 -0.37 0.00 0.00 57.07 58.24 2otg s TYR 282 Cb 0.00 -3.29 0.55 0.00 -0.40 0.00 0.00 41.96 38.82 2otg s TYR 282 CO 0.00 -1.21 1.63 0.45 -1.57 0.00 0.00 175.55 174.85 2otg h HIS 283 N 2.15 0.07 -0.97 2.71 3.86 -1.54 -2.03 115.15 119.40 2otg h HIS 283 Ca -0.49 0.06 0.23 0.00 -1.16 0.00 0.00 60.37 59.01 2otg h HIS 283 Cb 1.24 0.10 -0.18 0.00 1.06 0.00 0.00 27.41 29.62 2otg h HIS 283 CO 0.55 -0.25 -0.10 0.97 0.86 0.00 0.00 177.93 179.96 2otg h ILE 284 N 0.13 0.03 -0.87 2.45 6.09 -0.25 0.23 117.51 125.32 2otg h ILE 284 Ca 0.48 -0.00 0.09 0.00 -1.37 0.00 0.00 64.86 64.05 2otg h ILE 284 Cb 0.90 0.02 -0.07 0.00 0.47 0.00 0.00 36.82 38.14 2otg h ILE 284 CO -0.69 0.00 0.52 -0.26 -3.07 0.00 0.00 178.15 174.65 2otg h PHE 285 N 0.01 0.96 0.00 2.19 0.04 -1.63 -0.79 116.94 117.71 2otg h PHE 285 Ca 0.53 0.03 0.00 0.00 2.80 0.00 0.00 57.97 61.33 2otg h PHE 285 Cb 0.97 -0.30 0.00 0.00 2.20 0.00 0.00 35.95 38.82 2otg h PHE 285 CO -0.62 0.43 0.00 0.66 -0.60 0.00 0.00 178.31 178.18 2otg n TYR 286 N -4.67 0.00 -0.11 -0.55 4.02 0.77 -2.39 117.16 114.23 2otg n TYR 286 Ca 0.14 0.00 -0.22 0.00 -0.01 0.00 0.00 57.90 57.81 2otg n TYR 286 Cb 0.25 -0.27 -0.11 0.00 -0.02 0.00 0.00 39.34 39.19 2otg n TYR 286 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 176.86 176.89 2otg n GLN 287 N -1.27 0.56 0.07 -0.72 6.02 -0.38 -3.30 117.38 118.36 2otg n GLN 287 Ca 0.15 0.54 0.08 0.00 -0.01 0.00 0.00 57.00 57.76 2otg n GLN 287 Cb 0.23 -1.72 0.35 0.00 1.02 0.00 0.00 30.24 30.12 2otg n GLN 287 CO 0.00 0.00 0.00 0.44 -1.01 0.00 0.00 177.06 176.49 2otg n ILE 288 N -4.42 1.16 -0.22 5.09 -5.35 -0.74 -0.61 119.36 114.26 2otg n ILE 288 Ca -0.33 0.38 0.10 0.00 -0.27 0.00 0.00 62.75 62.63 2otg n ILE 288 Cb 0.68 -1.28 0.26 0.00 -1.74 0.00 0.00 39.64 37.56 2otg n ILE 288 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2otg h SER 290 N 3.61 0.00 -1.64 0.00 4.64 -0.85 -3.36 113.55 115.95 2otg h SER 290 Ca 0.00 0.00 -0.17 0.00 -0.47 0.00 0.00 61.79 61.15 2otg h SER 290 Cb 0.90 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 63.00 2otg h SER 290 CO 0.00 0.78 -0.24 -3.20 -0.87 0.00 0.00 176.83 173.31 2otg n ASN 291 N -3.09 -3.22 0.22 4.97 2.85 -1.26 -4.89 115.26 110.83 2otg n ASN 291 Ca -0.08 -0.06 0.12 0.00 -0.11 0.00 0.00 54.58 54.46 2otg n ASN 291 Cb 0.91 -2.34 0.19 0.00 1.24 0.00 0.00 39.78 39.77 2otg n ASN 291 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2otg h ALA 292 N 0.41 1.00 -2.03 5.20 0.00 -1.86 -3.32 119.26 118.66 2otg h ALA 292 Ca -0.21 0.00 -0.54 0.00 0.00 0.00 0.00 54.91 54.16 2otg h ALA 292 Cb 1.15 0.00 -0.40 0.00 0.00 0.00 0.00 17.79 18.54 2otg h ALA 292 CO 0.24 0.00 -1.07 -0.89 0.00 0.00 0.00 179.25 177.53 2otg n ILE 293 N -3.08 -0.06 -0.33 0.00 5.41 -1.26 -4.98 119.36 115.07 2otg n ILE 293 Ca 0.04 -4.40 0.23 0.00 1.00 0.00 0.00 62.75 59.63 2otg n ILE 293 Cb 0.52 -1.35 0.44 0.00 -0.71 0.00 0.00 39.64 38.54 2otg n ILE 293 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 176.55 175.90 2otg h PRO 294 N 3.61 0.06 0.00 0.38 0.11 -1.98 0.15 132.00 134.33 2otg h PRO 294 Ca 0.09 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.20 2otg h PRO 294 Cb 0.87 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 31.97 2otg h PRO 294 CO 0.52 0.04 0.29 -0.85 -0.21 0.00 0.00 178.00 177.80 2otg n GLU 295 N -5.31 0.04 -0.06 1.05 0.28 -1.26 0.85 120.64 116.23 2otg n GLU 295 Ca 0.31 0.39 -0.02 0.00 -0.16 0.00 0.00 57.16 57.67 2otg n GLU 295 Cb 1.01 -1.90 -0.16 0.00 1.43 0.00 0.00 31.44 31.82 2otg n GLU 295 CO 0.00 0.00 0.00 1.28 -0.16 0.00 0.00 177.13 178.25 2otg n LEU 296 N -1.59 0.09 -0.35 -1.84 4.77 0.52 -4.47 117.00 114.13 2otg n LEU 296 Ca -0.00 0.04 0.33 0.00 -0.03 0.00 0.00 56.01 56.34 2otg n LEU 296 Cb 0.30 0.29 0.58 0.00 -2.33 0.00 0.00 43.42 42.26 2otg n LEU 296 CO 0.02 0.30 1.04 0.59 -1.33 0.00 0.00 177.39 178.02 2otg n ASN 297 N -2.61 0.29 -0.01 -1.43 5.03 0.25 -0.48 115.26 116.30 2otg n ASN 297 Ca -0.21 1.48 -0.17 0.00 0.87 0.00 0.00 54.58 56.55 2otg n ASN 297 Cb 0.94 -0.72 -0.13 0.00 -1.02 0.00 0.00 39.78 38.85 2otg n ASN 297 CO 0.00 0.00 0.00 -0.33 -1.83 0.00 0.00 177.26 175.10 2otg h GLU 298 N 0.00 0.21 0.00 3.52 5.08 -1.78 0.55 114.58 122.15 2otg h GLU 298 Ca 0.81 -0.29 0.00 0.00 -1.00 0.00 0.00 59.36 58.88 2otg h GLU 298 Cb 2.29 0.10 0.00 0.00 0.50 0.00 0.00 28.75 31.64 2otg h GLU 298 CO -0.63 1.07 0.01 0.28 -1.00 0.00 0.00 179.01 178.74 2otg h VAL 299 N -0.51 0.00 0.00 3.13 2.07 -1.03 -0.27 116.25 119.64 2otg h VAL 299 Ca -0.07 0.00 -0.28 0.00 0.82 0.00 0.00 66.70 67.17 2otg h VAL 299 Cb 1.25 0.71 -0.05 0.00 -1.52 0.00 0.00 31.29 31.69 2otg h VAL 299 CO 0.08 0.00 -2.06 0.23 0.02 0.00 0.00 177.57 175.84 2otg n MET 300 N -2.64 1.06 -1.83 1.57 2.81 -0.67 -4.80 117.12 112.62 2otg n MET 300 Ca -0.02 0.05 0.00 0.00 -1.81 0.00 0.00 57.70 55.92 2otg n MET 300 Cb 0.06 -1.38 0.00 0.00 -0.71 0.00 0.00 33.22 31.19 2otg n MET 300 CO 0.00 0.00 0.00 -0.11 1.51 0.00 0.00 175.97 177.37 2otg n LEU 301 N -2.79 -1.22 -4.54 4.03 0.00 0.18 -4.77 117.00 107.89 2otg n LEU 301 Ca -0.29 0.00 -0.29 0.00 0.00 0.00 0.00 56.01 55.44 2otg n LEU 301 Cb 0.93 -0.41 -0.10 0.00 0.00 0.00 0.00 43.42 43.84 2otg n LEU 301 CO 0.26 0.00 -0.44 -0.63 0.00 0.00 0.00 177.39 176.58 2otg s ILE 302 N -2.40 3.12 -0.24 1.96 1.01 -0.21 -5.00 121.20 119.43 2otg s ILE 302 Ca 0.00 -1.49 -0.09 0.00 0.00 0.00 0.00 60.65 59.07 2otg s ILE 302 Cb 0.00 -2.48 -0.04 0.00 0.01 0.00 0.00 42.46 39.95 2otg s ILE 302 CO 0.00 0.03 0.12 -0.89 0.00 0.00 0.00 174.94 174.20 2otg s THR 303 N -1.36 4.94 0.00 2.92 2.01 -1.26 -4.75 115.64 118.14 2otg s THR 303 Ca 0.21 0.04 0.00 0.00 0.31 0.00 0.00 61.69 62.25 2otg s THR 303 Cb -0.10 -3.30 0.00 0.00 0.01 0.00 0.00 72.50 69.11 2otg s THR 303 CO 0.13 0.34 0.00 -2.65 -0.69 0.00 0.00 174.62 171.75 2otg n PRO 304 N 4.49 0.00 -4.00 4.92 -0.02 -1.26 -4.59 135.00 134.54 2otg n PRO 304 Ca -0.15 0.00 -0.31 0.00 -2.02 0.00 0.00 63.50 61.02 2otg n PRO 304 Cb 0.52 -0.67 -0.16 0.00 -0.02 0.00 0.00 33.50 33.18 2otg n PRO 304 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 2otg s ASP 305 N 0.21 3.49 0.15 2.55 -1.08 -1.26 -4.77 116.67 115.96 2otg s ASP 305 Ca 0.00 -0.93 -0.09 0.00 -0.52 0.00 0.00 52.55 51.01 2otg s ASP 305 Cb 0.00 -1.26 -0.01 0.00 -1.46 0.00 0.00 42.92 40.19 2otg s ASP 305 CO 0.00 -0.15 1.47 0.28 0.52 0.00 0.00 175.17 177.29 2otg h SER 306 N 7.96 0.91 0.00 -0.34 0.02 -1.81 -3.09 113.55 117.19 2otg h SER 306 Ca -0.27 -0.45 0.00 0.00 -0.84 0.00 0.00 61.79 60.23 2otg h SER 306 Cb 1.09 -0.26 0.00 0.00 0.14 0.00 0.00 62.40 63.38 2otg h SER 306 CO 0.48 1.22 0.00 0.61 -1.14 0.00 0.00 176.83 178.00 2otg n GLY 307 N 0.21 -0.52 0.10 -3.77 0.00 -1.26 -3.20 105.19 96.74 2otg n GLY 307 Ca -0.03 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.87 2otg n GLY 307 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2otg n LEU 308 N -0.49 1.37 -4.71 0.99 7.94 -1.17 -4.90 117.00 116.03 2otg n LEU 308 Ca 0.00 0.37 -0.35 0.00 -1.11 0.00 0.00 56.01 54.92 2otg n LEU 308 Cb 0.00 -0.19 -0.08 0.00 0.53 0.00 0.00 43.42 43.68 2otg n LEU 308 CO 0.00 0.52 -0.20 -0.31 -1.11 0.00 0.00 177.39 176.29 2otg s TYR 309 N -2.59 3.38 0.62 1.96 1.51 -1.19 -5.01 117.35 116.02 2otg s TYR 309 Ca -0.09 0.27 0.37 0.00 -1.01 0.00 0.00 57.07 56.61 2otg s TYR 309 Cb 0.08 -2.12 2.11 0.00 -0.11 0.00 0.00 41.96 41.92 2otg s TYR 309 CO 0.81 0.28 2.31 0.66 -1.11 0.00 0.00 175.55 178.50 2otg h SER 310 N 6.57 0.00 0.88 2.29 4.64 -1.86 -0.86 113.55 125.20 2otg h SER 310 Ca -0.41 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.91 2otg h SER 310 Cb 1.16 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.25 2otg h SER 310 CO 0.73 0.00 -0.00 0.49 -0.87 0.00 0.00 176.83 177.18 2otg n PHE 311 N -3.46 0.00 -0.68 4.77 3.72 -1.26 -4.05 117.46 116.50 2otg n PHE 311 Ca -0.03 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.37 2otg n PHE 311 Cb 0.08 -0.44 0.00 0.00 -0.94 0.00 0.00 39.48 38.18 2otg n PHE 311 CO 0.00 0.00 0.00 0.44 -0.05 0.00 0.00 176.76 177.15 2otg n ILE 312 N -1.44 0.00 -0.94 4.37 -5.35 -0.96 -4.56 119.36 110.48 2otg n ILE 312 Ca 0.09 -0.06 0.03 0.00 -0.27 0.00 0.00 62.75 62.54 2otg n ILE 312 Cb 0.31 1.68 0.38 0.00 -1.74 0.00 0.00 39.64 40.27 2otg n ILE 312 CO 0.00 0.00 0.00 -0.46 -1.76 0.00 0.00 176.55 174.33 2otg n ASN 313 N -0.03 5.49 -0.08 7.28 2.04 -0.37 -4.60 115.26 125.00 2otg n ASN 313 Ca 0.00 -3.03 -0.18 0.00 -0.44 0.00 0.00 54.58 50.93 2otg n ASN 313 Cb 0.17 -0.71 -0.12 0.00 -2.53 0.00 0.00 39.78 36.59 2otg n ASN 313 CO 0.00 0.00 0.00 1.56 -0.44 0.00 0.00 177.26 178.38 2otg h GLN 314 N 3.59 0.03 0.00 -3.83 4.20 -1.84 -3.47 115.11 113.79 2otg h GLN 314 Ca 0.09 -0.05 0.00 0.00 0.06 0.00 0.00 58.65 58.75 2otg h GLN 314 Cb 2.11 0.02 0.00 0.00 0.30 0.00 0.00 27.48 29.91 2otg h GLN 314 CO 0.58 1.02 0.00 0.41 -0.67 0.00 0.00 178.83 180.17 2otg n GLY 315 N 1.55 0.79 3.89 3.46 0.00 -1.25 -4.81 105.19 108.81 2otg n GLY 315 Ca -0.21 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.58 2otg n GLY 315 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2otg n LEU 317 N -1.67 0.00 -4.73 0.00 4.77 -1.26 -4.50 117.00 109.61 2otg n LEU 317 Ca 0.02 0.00 -0.24 0.00 -0.03 0.00 0.00 56.01 55.75 2otg n LEU 317 Cb 0.63 0.03 -0.07 0.00 -2.33 0.00 0.00 43.42 41.68 2otg n LEU 317 CO 0.41 0.03 -0.17 0.42 -1.33 0.00 0.00 177.39 176.74 2otg s THR 318 N -2.36 2.49 -0.00 -5.08 -4.23 -1.26 -5.07 115.64 100.12 2otg s THR 318 Ca -0.02 -1.71 0.00 0.00 -1.18 0.00 0.00 61.69 58.78 2otg s THR 318 Cb 0.03 -2.97 0.00 0.00 1.34 0.00 0.00 72.50 70.90 2otg s THR 318 CO 0.25 -0.06 -0.01 -0.69 -0.54 0.00 0.00 174.62 173.57 2otg s VAL 319 N -2.55 0.10 0.03 2.29 1.01 -1.26 -5.04 120.40 114.97 2otg s VAL 319 Ca 0.40 -0.04 -0.25 0.00 0.00 0.00 0.00 61.98 62.09 2otg s VAL 319 Cb 0.02 -0.10 -0.14 0.00 0.00 0.00 0.00 36.38 36.16 2otg s VAL 319 CO 0.22 0.04 1.20 0.44 0.00 0.00 0.00 175.10 177.00 2otg h ASP 320 N 6.21 -0.78 -0.09 3.32 3.32 -2.00 -3.17 116.42 123.23 2otg h ASP 320 Ca -0.27 0.03 0.00 0.00 0.02 0.00 0.00 57.03 56.81 2otg h ASP 320 Cb 1.20 0.20 0.00 0.00 0.22 0.00 0.00 39.33 40.95 2otg h ASP 320 CO 0.51 -0.48 0.00 -0.46 -1.72 0.00 0.00 179.24 177.09 2otg n ASN 321 N -4.89 1.67 -4.07 6.45 2.04 -1.26 -4.75 115.26 110.44 2otg n ASN 321 Ca -0.11 -2.14 -0.31 0.00 -0.44 0.00 0.00 54.58 51.58 2otg n ASN 321 Cb 0.36 -0.50 -0.16 0.00 -2.53 0.00 0.00 39.78 36.95 2otg n ASN 321 CO 0.00 0.00 0.00 -0.63 -0.44 0.00 0.00 177.26 176.19 2otg s ILE 322 N -1.32 1.81 -0.86 1.53 -1.09 -1.20 -5.05 121.20 115.03 2otg s ILE 322 Ca 0.09 -0.79 -0.09 0.00 -2.23 0.00 0.00 60.65 57.63 2otg s ILE 322 Cb 0.06 -1.66 0.22 0.00 -1.58 0.00 0.00 42.46 39.50 2otg s ILE 322 CO 0.03 0.50 0.78 -0.62 -1.23 0.00 0.00 174.94 174.39 2otg s ASP 323 N 1.36 6.48 0.64 3.58 -1.08 -1.26 -4.52 116.67 121.87 2otg s ASP 323 Ca 0.04 -3.05 0.27 0.00 -0.52 0.00 0.00 52.55 49.29 2otg s ASP 323 Cb -0.13 -2.10 1.41 0.00 -1.46 0.00 0.00 42.92 40.64 2otg s ASP 323 CO -0.11 -0.42 1.81 0.44 0.52 0.00 0.00 175.17 177.40 2otg h ASP 324 N 7.16 0.00 0.15 -0.34 3.32 -1.93 -1.66 116.42 123.13 2otg h ASP 324 Ca 0.11 0.00 -0.27 0.00 0.02 0.00 0.00 57.03 56.89 2otg h ASP 324 Cb 0.96 0.00 0.01 0.00 0.22 0.00 0.00 39.33 40.52 2otg h ASP 324 CO 0.81 0.00 -1.30 0.58 -1.72 0.00 0.00 179.24 177.61 2otg h VAL 325 N 0.00 1.19 -0.23 -1.35 2.07 -1.90 -3.01 116.25 113.03 2otg h VAL 325 Ca 0.07 -2.50 -0.04 0.00 0.82 0.00 0.00 66.70 65.05 2otg h VAL 325 Cb 1.00 2.91 -0.01 0.00 -1.52 0.00 0.00 31.29 33.67 2otg h VAL 325 CO -0.00 0.75 -0.01 -0.33 0.02 0.00 0.00 177.57 177.99 2otg h GLU 326 N -0.20 0.41 -0.76 1.57 4.39 -1.77 -2.94 114.58 115.27 2otg h GLU 326 Ca -0.26 -0.14 0.04 0.00 0.34 0.00 0.00 59.36 59.35 2otg h GLU 326 Cb 1.84 -0.03 -0.04 0.00 -0.10 0.00 0.00 28.75 30.41 2otg h GLU 326 CO 0.14 0.60 0.50 1.49 -1.16 0.00 0.00 179.01 180.58 2otg h GLU 327 N 0.17 0.87 -0.51 2.33 4.57 -1.48 0.32 114.58 120.84 2otg h GLU 327 Ca 0.06 -0.05 -0.10 0.00 -1.18 0.00 0.00 59.36 58.09 2otg h GLU 327 Cb 0.43 -0.20 -0.02 0.00 -0.16 0.00 0.00 28.75 28.81 2otg h GLU 327 CO 0.01 0.57 -0.08 0.35 -1.18 0.00 0.00 179.01 178.69 2otg h PHE 328 N 0.89 1.06 0.09 0.92 3.57 -1.51 -1.42 116.94 120.54 2otg h PHE 328 Ca 0.31 -0.21 0.02 0.00 3.53 0.00 0.00 57.97 61.61 2otg h PHE 328 Cb 0.11 -0.26 -0.03 0.00 2.79 0.00 0.00 35.95 38.56 2otg h PHE 328 CO -0.00 1.00 -0.18 0.87 -2.23 0.00 0.00 178.31 177.77 2otg h LYS 329 N 0.82 -0.33 -0.98 1.11 1.57 -1.01 -1.66 116.57 116.08 2otg h LYS 329 Ca 0.13 0.02 0.01 0.00 -1.87 0.00 0.00 60.65 58.95 2otg h LYS 329 Cb 0.63 0.08 -0.05 0.00 0.08 0.00 0.00 32.23 32.97 2otg h LYS 329 CO 0.04 -0.22 0.65 -0.07 -0.57 0.00 0.00 179.45 179.28 2otg h LEU 330 N -0.35 1.12 -0.74 2.94 3.38 -0.80 -2.29 115.31 118.58 2otg h LEU 330 Ca 0.03 -0.03 -0.10 0.00 0.09 0.00 0.00 57.88 57.87 2otg h LEU 330 Cb 0.37 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.83 2otg h LEU 330 CO -0.11 0.81 -0.14 0.00 0.09 0.00 0.00 178.44 179.09 2otg h ASP 332 N 0.73 1.00 -0.02 0.00 3.58 -0.77 0.13 116.42 121.08 2otg h ASP 332 Ca 0.12 0.00 -0.15 0.00 0.42 0.00 0.00 57.03 57.42 2otg h ASP 332 Cb 0.64 -0.21 -0.01 0.00 1.72 0.00 0.00 39.33 41.47 2otg h ASP 332 CO 0.04 0.66 -0.48 -0.08 -2.88 0.00 0.00 179.24 176.51 2otg h GLU 333 N 1.15 0.57 -0.58 0.28 4.57 -0.94 -3.21 114.58 116.42 2otg h GLU 333 Ca 0.40 -0.32 0.11 0.00 -1.18 0.00 0.00 59.36 58.36 2otg h GLU 333 Cb 0.09 0.02 -0.08 0.00 -0.16 0.00 0.00 28.75 28.62 2otg h GLU 333 CO -0.15 0.92 0.12 0.00 -1.18 0.00 0.00 179.01 178.72 2otg h ALA 334 N 1.02 0.67 0.00 2.92 0.00 0.13 -1.08 119.26 122.92 2otg h ALA 334 Ca 0.02 0.13 -0.02 0.00 0.00 0.00 0.00 54.91 55.04 2otg h ALA 334 Cb 1.00 0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.96 2otg h ALA 334 CO 0.09 -0.31 -0.09 0.74 0.00 0.00 0.00 179.25 179.68 2otg h PHE 335 N 0.25 0.00 0.12 0.00 -1.00 -1.41 -2.65 116.94 112.25 2otg h PHE 335 Ca 0.30 0.00 -0.01 0.00 2.81 0.00 0.00 57.97 61.07 2otg h PHE 335 Cb 0.44 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.00 2otg h PHE 335 CO -0.25 0.09 -0.06 -0.44 -1.61 0.00 0.00 178.31 176.05 2otg h ASP 336 N 0.00 -0.14 -0.62 2.17 3.32 -1.29 0.44 116.42 120.30 2otg h ASP 336 Ca -0.00 -0.39 0.18 0.00 0.02 0.00 0.00 57.03 56.83 2otg h ASP 336 Cb 0.37 0.04 -0.02 0.00 0.22 0.00 0.00 39.33 39.93 2otg h ASP 336 CO 0.01 0.47 0.46 0.40 -1.72 0.00 0.00 179.24 178.86 2otg h ILE 337 N -0.90 0.65 0.00 0.35 2.04 -1.42 0.53 117.51 118.76 2otg h ILE 337 Ca -0.02 0.00 -0.09 0.00 1.00 0.00 0.00 64.86 65.76 2otg h ILE 337 Cb 0.53 0.68 -0.01 0.00 -0.74 0.00 0.00 36.82 37.27 2otg h ILE 337 CO 0.03 0.00 -0.41 -0.07 0.00 0.00 0.00 178.15 177.70 2otg h LEU 338 N 0.00 0.00 -0.03 1.44 3.38 -1.45 -3.40 115.31 115.25 2otg h LEU 338 Ca 0.29 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.26 2otg h LEU 338 Cb 1.21 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.96 2otg h LEU 338 CO -0.00 0.41 0.00 0.61 0.09 0.00 0.00 178.44 179.54 2otg n GLY 339 N 1.07 1.58 3.78 0.83 0.00 0.19 -4.83 105.19 107.79 2otg n GLY 339 Ca 0.02 -0.09 -0.39 0.00 0.00 0.00 0.00 46.02 45.56 2otg n GLY 339 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2otg s PHE 340 N -2.03 3.84 0.65 1.61 0.40 0.15 -5.02 117.98 117.59 2otg s PHE 340 Ca 0.00 1.50 -0.11 0.00 -0.60 0.00 0.00 56.93 57.72 2otg s PHE 340 Cb 0.00 -2.71 -0.02 0.00 0.51 0.00 0.00 43.02 40.81 2otg s PHE 340 CO 0.00 0.48 1.05 0.99 0.70 0.00 0.00 175.22 178.44 2otg s THR 341 N -0.90 4.36 0.34 0.64 2.01 -1.26 -4.66 115.64 116.17 2otg s THR 341 Ca 0.34 0.76 0.03 0.00 0.31 0.00 0.00 61.69 63.14 2otg s THR 341 Cb -0.22 -3.69 0.21 0.00 0.01 0.00 0.00 72.50 68.82 2otg s THR 341 CO 0.24 -1.00 1.94 0.50 -0.69 0.00 0.00 174.62 175.61 2otg h LYS 342 N -0.48 0.70 -0.13 4.92 3.64 -1.98 -0.45 116.57 122.79 2otg h LYS 342 Ca -0.44 -0.09 0.00 0.00 -1.27 0.00 0.00 60.65 58.85 2otg h LYS 342 Cb 1.20 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 32.89 2otg h LYS 342 CO 0.61 0.56 0.08 1.05 -2.27 0.00 0.00 179.45 179.48 2otg h GLU 343 N 0.70 0.17 0.43 1.90 4.11 -1.99 -0.56 114.58 119.33 2otg h GLU 343 Ca 0.17 -0.01 -0.02 0.00 0.07 0.00 0.00 59.36 59.57 2otg h GLU 343 Cb 0.11 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.32 2otg h GLU 343 CO -0.02 0.13 -0.21 0.93 0.07 0.00 0.00 179.01 179.91 2otg h GLU 344 N 0.17 -0.56 -0.92 1.06 5.08 -1.82 -1.20 114.58 116.39 2otg h GLU 344 Ca 0.05 0.04 0.14 0.00 -1.00 0.00 0.00 59.36 58.58 2otg h GLU 344 Cb -0.01 0.13 -0.15 0.00 0.50 0.00 0.00 28.75 29.22 2otg h GLU 344 CO -0.01 -0.37 -0.38 1.17 -1.00 0.00 0.00 179.01 178.42 2otg n LYS 345 N -3.81 -0.24 -0.05 2.33 4.81 -0.22 0.25 118.16 121.24 2otg n LYS 345 Ca -0.07 1.42 -0.09 0.00 -0.87 0.00 0.00 58.31 58.69 2otg n LYS 345 Cb 0.23 -2.11 -0.03 0.00 0.02 0.00 0.00 35.03 33.14 2otg n LYS 345 CO 0.00 0.00 0.00 1.15 1.17 0.00 0.00 177.40 179.72 2otg h THR 346 N 0.00 1.00 -0.86 3.15 2.02 -1.11 -1.88 112.91 115.23 2otg h THR 346 Ca 0.30 -0.08 0.23 0.00 0.77 0.00 0.00 66.41 67.63 2otg h THR 346 Cb 0.54 0.75 -0.14 0.00 -1.74 0.00 0.00 68.15 67.56 2otg h THR 346 CO -0.91 0.04 0.19 0.28 0.37 0.00 0.00 175.52 175.49 2otg h SER 347 N 0.23 -0.07 0.17 4.18 0.02 0.11 0.41 113.55 118.60 2otg h SER 347 Ca 0.08 0.20 -0.00 0.00 -0.84 0.00 0.00 61.79 61.23 2otg h SER 347 Cb 0.02 0.29 -0.02 0.00 0.14 0.00 0.00 62.40 62.83 2otg h SER 347 CO -0.06 -0.17 -0.27 0.24 -1.14 0.00 0.00 176.83 175.44 2otg h MET 348 N 0.18 -0.44 -0.61 3.45 2.07 -0.37 0.11 114.93 119.33 2otg h MET 348 Ca 0.53 0.03 0.16 0.00 -2.07 0.00 0.00 59.70 58.35 2otg h MET 348 Cb 1.05 0.10 -0.03 0.00 -1.87 0.00 0.00 31.60 30.86 2otg h MET 348 CO -0.67 -0.29 0.43 0.74 1.07 0.00 0.00 176.91 178.19 2otg h PHE 349 N -0.46 0.11 0.44 -0.22 0.04 -0.36 -0.25 116.94 116.24 2otg h PHE 349 Ca -0.02 0.00 -0.02 0.00 2.80 0.00 0.00 57.97 60.73 2otg h PHE 349 Cb 0.42 -0.03 0.00 0.00 2.20 0.00 0.00 35.95 38.54 2otg h PHE 349 CO -0.26 0.04 -0.21 0.87 -0.60 0.00 0.00 178.31 178.15 2otg h LYS 350 N 0.09 -0.57 0.00 1.51 1.57 0.42 0.39 116.57 119.98 2otg h LYS 350 Ca 0.29 0.04 -0.01 0.00 -1.87 0.00 0.00 60.65 59.10 2otg h LYS 350 Cb 1.03 0.13 -0.00 0.00 0.08 0.00 0.00 32.23 33.46 2otg h LYS 350 CO -0.03 -0.31 -0.03 0.00 -0.57 0.00 0.00 179.45 178.51 2otg h THR 352 N 0.00 1.56 -0.62 0.00 2.02 -0.99 -3.31 112.91 111.58 2otg h THR 352 Ca -0.00 -1.99 0.06 0.00 0.77 0.00 0.00 66.41 65.25 2otg h THR 352 Cb 0.08 2.83 -0.05 0.00 -1.74 0.00 0.00 68.15 69.27 2otg h THR 352 CO 0.00 0.54 0.32 0.00 0.37 0.00 0.00 175.52 176.76 2otg h ALA 353 N 0.23 0.81 -0.70 6.16 0.00 -0.13 -2.28 119.26 123.36 2otg h ALA 353 Ca -0.03 0.03 0.20 0.00 0.00 0.00 0.00 54.91 55.11 2otg h ALA 353 Cb 1.02 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.70 2otg h ALA 353 CO 0.05 -0.02 0.50 0.66 0.00 0.00 0.00 179.25 180.44 2otg h SER 354 N 0.60 0.00 0.02 0.00 4.64 -1.28 0.26 113.55 117.79 2otg h SER 354 Ca 0.28 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.55 2otg h SER 354 Cb 0.20 -0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.28 2otg h SER 354 CO -0.19 0.00 -0.14 0.40 -0.87 0.00 0.00 176.83 176.02 2otg h ILE 355 N 0.00 1.19 -0.62 0.95 2.04 -1.51 -1.45 117.51 118.11 2otg h ILE 355 Ca 0.33 -0.83 -0.06 0.00 1.00 0.00 0.00 64.86 65.30 2otg h ILE 355 Cb 1.33 1.23 -0.03 0.00 -0.74 0.00 0.00 36.82 38.61 2otg h ILE 355 CO -0.00 0.26 0.17 -0.07 0.00 0.00 0.00 178.15 178.50 2otg h LEU 356 N 0.24 0.90 -0.14 1.44 3.38 -0.58 -3.04 115.31 117.51 2otg h LEU 356 Ca 0.05 -0.17 -0.22 0.00 0.09 0.00 0.00 57.88 57.63 2otg h LEU 356 Cb 0.40 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.91 2otg h LEU 356 CO 0.02 0.87 -0.99 0.45 0.09 0.00 0.00 178.44 178.89 2otg h HIS 357 N 0.93 0.33 -0.61 1.13 3.86 -1.41 -3.22 115.15 116.17 2otg h HIS 357 Ca 0.20 -0.21 0.03 0.00 -1.16 0.00 0.00 60.37 59.24 2otg h HIS 357 Cb 0.31 -0.03 -0.03 0.00 1.06 0.00 0.00 27.41 28.72 2otg h HIS 357 CO 0.02 1.07 0.40 0.52 0.86 0.00 0.00 177.93 180.80 2otg h MET 358 N 0.10 0.71 0.00 2.45 2.86 -1.18 0.29 114.93 120.16 2otg h MET 358 Ca -0.06 -0.04 0.00 0.00 -2.06 0.00 0.00 59.70 57.53 2otg h MET 358 Cb 1.66 -0.16 0.00 0.00 0.06 0.00 0.00 31.60 33.16 2otg h MET 358 CO 0.15 0.47 0.00 0.78 1.06 0.00 0.00 176.91 179.37 2otg h GLY 359 N 0.73 0.00 -0.24 8.32 0.00 -1.55 -2.87 103.07 107.46 2otg h GLY 359 Ca 0.24 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.57 2otg h GLY 359 CO -0.06 0.00 -0.33 1.18 0.00 0.00 0.00 176.54 177.33 2otg n GLU 360 N -2.47 1.00 -2.30 4.80 -0.58 0.94 -4.73 120.64 117.31 2otg n GLU 360 Ca 0.03 -0.70 -0.42 0.00 -0.42 0.00 0.00 57.16 55.65 2otg n GLU 360 Cb 0.35 -1.49 -0.03 0.00 -0.57 0.00 0.00 31.44 29.70 2otg n GLU 360 CO 0.00 0.00 0.00 -1.64 -0.48 0.00 0.00 177.13 175.01 2otg s MET 361 N -2.48 4.28 0.15 3.49 -1.94 -0.81 -4.89 119.30 117.10 2otg s MET 361 Ca 0.23 1.86 0.05 0.00 -1.71 0.00 0.00 55.69 56.11 2otg s MET 361 Cb 0.19 -3.64 -0.04 0.00 2.01 0.00 0.00 34.83 33.35 2otg s MET 361 CO 0.53 -0.59 0.11 0.15 -0.01 0.00 0.00 175.02 175.21 2otg s LYS 362 N 2.69 2.84 -0.00 2.03 1.02 -1.26 -5.06 119.74 122.00 2otg s LYS 362 Ca 0.61 -0.86 0.03 0.00 0.02 0.00 0.00 55.97 55.77 2otg s LYS 362 Cb -0.28 -2.63 -0.01 0.00 -0.52 0.00 0.00 37.83 34.39 2otg s LYS 362 CO 0.23 0.50 -0.10 -0.06 -0.92 0.00 0.00 175.35 175.00 2otg s PHE 363 N -1.68 0.93 -0.22 3.18 0.40 -1.26 -2.20 117.98 117.14 2otg s PHE 363 Ca 0.30 -0.20 -0.13 0.00 -0.60 0.00 0.00 56.93 56.30 2otg s PHE 363 Cb -0.10 -0.59 -0.04 0.00 0.51 0.00 0.00 43.02 42.79 2otg s PHE 363 CO 0.23 -0.01 0.28 0.21 0.70 0.00 0.00 175.22 176.63 2otg s LYS 364 N -0.39 4.13 -0.20 0.44 2.20 0.23 -4.84 119.74 121.32 2otg s LYS 364 Ca 0.03 -0.02 -0.14 0.00 -0.36 0.00 0.00 55.97 55.48 2otg s LYS 364 Cb -0.05 -3.53 -0.04 0.00 -1.51 0.00 0.00 37.83 32.70 2otg s LYS 364 CO -0.00 0.02 0.32 1.14 -0.36 0.00 0.00 175.35 176.47 2otg s GLN 365 N 1.17 4.18 0.32 4.03 -2.07 -1.26 -1.39 119.66 124.64 2otg s GLN 365 Ca 0.14 0.08 -0.01 0.00 -1.82 0.00 0.00 55.36 53.75 2otg s GLN 365 Cb -0.14 -3.50 0.01 0.00 -1.09 0.00 0.00 33.01 28.29 2otg s GLN 365 CO 0.06 0.06 0.03 -2.13 -1.32 0.00 0.00 175.29 171.99 2otg n ARG 366 N 4.17 1.63 0.00 9.60 0.63 -1.24 -4.93 116.66 126.52 2otg n ARG 366 Ca -0.11 -0.06 0.00 0.00 -0.92 0.00 0.00 57.85 56.77 2otg n ARG 366 Cb 0.51 -0.60 0.00 0.00 0.45 0.00 0.00 32.46 32.82 2otg n ARG 366 CO 0.00 0.00 0.00 -2.30 -2.51 0.00 0.00 177.63 172.82 2otg n PRO 367 N 1.32 0.00 -0.23 -0.14 -0.02 -1.26 -4.65 135.00 130.01 2otg n PRO 367 Ca 0.01 0.06 0.08 0.00 -2.02 0.00 0.00 63.50 61.63 2otg n PRO 367 Cb 0.02 -0.79 0.18 0.00 -0.02 0.00 0.00 33.50 32.89 2otg n PRO 367 CO 0.00 0.00 0.00 -2.13 1.98 0.00 0.00 175.50 175.35 2otg n ARG 368 N -0.69 2.26 0.00 -0.52 3.00 -1.26 -5.04 116.66 114.42 2otg n ARG 368 Ca 0.00 -2.56 0.00 0.00 -0.00 0.00 0.00 57.85 55.29 2otg n ARG 368 Cb 0.00 -1.59 0.00 0.00 0.00 0.00 0.00 32.46 30.87 2otg n ARG 368 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.63 178.02 2otg n GLU 369 N -0.80 3.72 -1.88 -0.14 1.02 -1.26 -5.10 120.64 116.19 2otg n GLU 369 Ca 0.17 0.00 -0.03 0.00 -0.02 0.00 0.00 57.16 57.28 2otg n GLU 369 Cb 0.70 0.00 0.06 0.00 -0.02 0.00 0.00 31.44 32.18 2otg n GLU 369 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 2otg n GLU 370 N 0.00 1.60 -3.58 3.49 1.02 -1.26 -4.88 120.64 117.03 2otg n GLU 370 Ca 0.00 -3.18 -0.13 0.00 -0.02 0.00 0.00 57.16 53.83 2otg n GLU 370 Cb 0.00 -1.29 -0.05 0.00 -0.02 0.00 0.00 31.44 30.08 2otg n GLU 370 CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 2otg s GLN 371 N -2.57 1.04 0.39 3.49 -1.52 -1.26 -4.75 119.66 114.48 2otg s GLN 371 Ca 0.36 -0.31 0.08 0.00 -1.95 0.00 0.00 55.36 53.53 2otg s GLN 371 Cb 0.37 0.47 -0.07 0.00 -0.22 0.00 0.00 33.01 33.56 2otg s GLN 371 CO -0.07 -0.38 0.02 0.00 -0.25 0.00 0.00 175.29 174.61 2otg s ALA 372 N -2.68 3.20 -0.25 6.09 0.00 -1.24 -3.72 121.76 123.17 2otg s ALA 372 Ca -0.04 -2.22 -0.22 0.00 0.00 0.00 0.00 51.96 49.49 2otg s ALA 372 Cb -0.00 0.01 0.06 0.00 0.00 0.00 0.00 23.12 23.19 2otg s ALA 372 CO -0.04 -0.08 0.65 -2.00 0.00 0.00 0.00 175.76 174.29 2otg s GLU 373 N -3.72 0.75 1.12 0.00 2.12 -0.48 -4.89 118.70 113.58 2otg s GLU 373 Ca 0.35 0.93 -0.17 0.00 0.36 0.00 0.00 54.97 56.44 2otg s GLU 373 Cb 0.07 0.34 0.16 0.00 0.26 0.00 0.00 34.13 34.96 2otg s GLU 373 CO 0.19 -0.10 0.20 -1.13 -0.54 0.00 0.00 175.26 173.88 2otg n SER 374 N 2.90 -2.76 -3.21 -1.70 3.41 -1.26 0.77 113.62 111.77 2otg n SER 374 Ca -0.15 -0.29 -0.24 0.00 -0.26 0.00 0.00 58.87 57.93 2otg n SER 374 Cb 0.56 -0.89 -0.07 0.00 -0.26 0.00 0.00 64.21 63.55 2otg n SER 374 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 2otg n ASP 375 N -1.95 -0.18 0.00 4.04 2.03 -0.93 -3.96 116.55 115.60 2otg n ASP 375 Ca 0.04 -2.65 0.00 0.00 0.52 0.00 0.00 54.79 52.69 2otg n ASP 375 Cb 0.53 -0.46 0.00 0.00 -0.72 0.00 0.00 41.12 40.46 2otg n ASP 375 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2otg n GLY 376 N 1.75 1.05 0.00 0.27 0.00 -1.26 -4.67 105.19 102.33 2otg n GLY 376 Ca 0.22 -2.28 0.00 0.00 0.00 0.00 0.00 46.02 43.96 2otg n GLY 376 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2otg n THR 377 N -0.86 0.00 -0.33 2.61 -1.04 -1.26 -4.82 114.28 108.59 2otg n THR 377 Ca 0.00 0.00 0.24 0.00 -2.04 0.00 0.00 64.05 62.25 2otg n THR 377 Cb 0.00 0.08 0.46 0.00 -1.82 0.00 0.00 70.33 69.05 2otg n THR 377 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2otg h ALA 378 N 0.00 1.77 0.01 2.41 0.00 -1.98 1.34 119.26 122.80 2otg h ALA 378 Ca 0.00 0.28 -0.07 0.00 0.00 0.00 0.00 54.91 55.12 2otg h ALA 378 Cb 0.00 0.39 0.01 0.00 0.00 0.00 0.00 17.79 18.19 2otg h ALA 378 CO 0.00 -0.76 -0.26 0.93 0.00 0.00 0.00 179.25 179.16 2otg h GLU 379 N 0.06 0.16 0.00 0.00 3.07 -1.90 -2.37 114.58 113.60 2otg h GLU 379 Ca 0.74 -0.19 -0.03 0.00 -0.50 0.00 0.00 59.36 59.38 2otg h GLU 379 Cb 1.78 0.06 -0.00 0.00 -0.84 0.00 0.00 28.75 29.74 2otg h GLU 379 CO -0.79 0.95 -0.14 0.00 -1.40 0.00 0.00 179.01 177.63 2otg h ALA 380 N 0.22 1.36 0.01 3.43 0.00 -1.09 -2.33 119.26 120.86 2otg h ALA 380 Ca -0.04 -0.13 -0.04 0.00 0.00 0.00 0.00 54.91 54.71 2otg h ALA 380 Cb 1.05 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.82 2otg h ALA 380 CO 0.05 0.17 -0.22 0.93 0.00 0.00 0.00 179.25 180.19 2otg h GLU 381 N 0.00 0.02 -0.71 0.00 5.08 0.16 -2.75 114.58 116.38 2otg h GLU 381 Ca -0.00 -0.04 0.14 0.00 -1.00 0.00 0.00 59.36 58.46 2otg h GLU 381 Cb 0.34 0.01 -0.05 0.00 0.50 0.00 0.00 28.75 29.56 2otg h GLU 381 CO 0.02 1.02 0.48 0.87 -1.00 0.00 0.00 179.01 180.39 2otg h LYS 382 N -0.95 0.38 0.61 2.33 1.57 -1.32 0.39 116.57 119.59 2otg h LYS 382 Ca -0.05 -0.02 -0.03 0.00 -1.87 0.00 0.00 60.65 58.67 2otg h LYS 382 Cb 1.09 -0.09 0.01 0.00 0.08 0.00 0.00 32.23 33.32 2otg h LYS 382 CO -0.01 0.25 -0.30 0.28 -0.57 0.00 0.00 179.45 179.10 2otg h VAL 383 N 0.39 0.05 -0.78 0.50 2.07 -1.51 -2.40 116.25 114.58 2otg h VAL 383 Ca 0.35 -0.39 0.11 0.00 0.82 0.00 0.00 66.70 67.58 2otg h VAL 383 Cb 0.80 0.07 -0.05 0.00 -1.52 0.00 0.00 31.29 30.58 2otg h VAL 383 CO -0.10 0.01 0.51 0.00 0.02 0.00 0.00 177.57 178.01 2otg h ALA 384 N -1.16 1.84 0.48 1.67 0.00 -1.06 0.36 119.26 121.39 2otg h ALA 384 Ca -0.08 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.80 2otg h ALA 384 Cb 0.65 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.30 2otg h ALA 384 CO 0.14 -0.02 -0.23 0.35 0.00 0.00 0.00 179.25 179.49 2otg h PHE 385 N 0.65 -0.60 -0.52 0.00 -0.00 -0.24 0.77 116.94 117.00 2otg h PHE 385 Ca 0.37 -0.01 0.12 0.00 -0.00 0.00 0.00 57.97 58.44 2otg h PHE 385 Cb 0.54 0.20 -0.03 0.00 -0.00 0.00 0.00 35.95 36.66 2otg h PHE 385 CO -0.00 -0.37 0.36 -0.07 -0.00 0.00 0.00 178.31 178.23 2otg h LEU 386 N -0.65 0.16 0.00 0.59 3.38 -1.06 0.93 115.31 118.66 2otg h LEU 386 Ca -0.07 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.91 2otg h LEU 386 Cb 0.49 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.22 2otg h LEU 386 CO 0.11 0.09 -0.11 0.00 0.09 0.00 0.00 178.44 178.62 2otg n GLY 388 N 1.42 0.04 2.59 0.00 0.00 0.32 -4.45 105.19 105.10 2otg n GLY 388 Ca 0.06 -0.42 -0.20 0.00 0.00 0.00 0.00 46.02 45.46 2otg n GLY 388 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2otg n ILE 389 N -3.93 0.00 -3.34 -0.61 -5.35 0.05 -2.22 119.36 103.96 2otg n ILE 389 Ca -0.09 -1.82 -0.38 0.00 -0.27 0.00 0.00 62.75 60.19 2otg n ILE 389 Cb 0.57 0.63 -0.07 0.00 -1.74 0.00 0.00 39.64 39.03 2otg n ILE 389 CO 0.00 0.00 0.00 0.21 -1.76 0.00 0.00 176.55 175.00 2otg s ASN 390 N -2.94 6.53 0.36 7.28 2.47 -1.26 -4.36 114.94 123.02 2otg s ASN 390 Ca 0.14 0.63 0.10 0.00 0.42 0.00 0.00 52.86 54.15 2otg s ASN 390 Cb 0.01 -2.26 0.69 0.00 -1.45 0.00 0.00 41.25 38.24 2otg s ASN 390 CO 0.10 -0.08 1.84 0.00 -3.72 0.00 0.00 177.10 175.24 2otg h ALA 391 N 7.21 1.38 0.06 1.71 0.00 -1.89 0.26 119.26 127.99 2otg h ALA 391 Ca -0.37 -0.29 -0.00 0.00 0.00 0.00 0.00 54.91 54.25 2otg h ALA 391 Cb 1.16 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.88 2otg h ALA 391 CO 0.73 0.44 -0.03 0.78 0.00 0.00 0.00 179.25 181.17 2otg h GLY 392 N 0.95 -0.08 0.05 0.00 0.00 -1.93 0.12 103.07 102.18 2otg h GLY 392 Ca 0.02 0.03 0.05 0.00 0.00 0.00 0.00 47.33 47.43 2otg h GLY 392 CO 0.04 -0.03 -0.35 -0.55 0.00 0.00 0.00 176.54 175.65 2otg h ASP 393 N -0.40 -1.11 -0.21 0.19 5.19 -1.92 0.13 116.42 118.29 2otg h ASP 393 Ca -0.01 0.16 0.06 0.00 -0.62 0.00 0.00 57.03 56.62 2otg h ASP 393 Cb 0.36 0.47 -0.07 0.00 0.18 0.00 0.00 39.33 40.27 2otg h ASP 393 CO 0.01 -0.37 -0.27 0.25 -3.12 0.00 0.00 179.24 175.75 2otg h LEU 394 N -0.40 -0.84 -0.72 1.55 5.85 -0.83 -0.06 115.31 119.86 2otg h LEU 394 Ca 0.10 0.14 0.00 0.00 0.84 0.00 0.00 57.88 58.97 2otg h LEU 394 Cb 0.57 0.38 0.00 0.00 0.37 0.00 0.00 40.66 41.98 2otg h LEU 394 CO -0.40 -0.30 0.00 -0.07 -0.34 0.00 0.00 178.44 177.33 2otg h LEU 395 N -0.29 0.00 0.22 2.25 3.38 -0.47 0.68 115.31 121.08 2otg h LEU 395 Ca 0.13 0.00 -0.32 0.00 0.09 0.00 0.00 57.88 57.78 2otg h LEU 395 Cb 0.48 0.00 0.04 0.00 0.09 0.00 0.00 40.66 41.27 2otg h LEU 395 CO -0.38 0.00 -1.38 0.50 0.09 0.00 0.00 178.44 177.27 2otg h LYS 396 N 0.00 0.54 0.00 1.13 3.64 0.46 -1.75 116.57 120.59 2otg h LYS 396 Ca 0.00 -0.88 -0.22 0.00 -1.27 0.00 0.00 60.65 58.28 2otg h LYS 396 Cb 0.55 0.32 -0.03 0.00 -0.41 0.00 0.00 32.23 32.65 2otg h LYS 396 CO 0.00 1.42 -1.08 0.00 -2.27 0.00 0.00 179.45 177.52 2otg h ALA 397 N 0.17 0.39 -0.10 5.00 0.00 -0.95 -2.49 119.26 121.29 2otg h ALA 397 Ca -0.23 -0.97 -0.18 0.00 0.00 0.00 0.00 54.91 53.53 2otg h ALA 397 Cb 2.08 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 19.77 2otg h ALA 397 CO 0.26 1.28 -0.70 1.25 0.00 0.00 0.00 179.25 181.34 2otg h LEU 398 N 0.00 0.52 0.00 0.00 5.85 -0.96 -3.07 115.31 117.64 2otg h LEU 398 Ca -0.04 -0.33 0.00 0.00 0.84 0.00 0.00 57.88 58.35 2otg h LEU 398 Cb 1.80 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 42.68 2otg h LEU 398 CO 0.13 1.06 0.00 0.18 -0.34 0.00 0.00 178.44 179.47 2otg n LEU 399 N -3.86 0.00 -4.39 2.25 4.77 -0.66 -4.77 117.00 110.34 2otg n LEU 399 Ca -0.04 0.00 -0.44 0.00 -0.03 0.00 0.00 56.01 55.50 2otg n LEU 399 Cb 0.69 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.70 2otg n LEU 399 CO 0.48 0.00 0.01 -0.75 -1.33 0.00 0.00 177.39 175.80 2otg s LYS 400 N 0.00 2.96 0.00 3.23 2.20 -0.94 -4.08 119.74 123.12 2otg s LYS 400 Ca 0.00 -1.32 0.00 0.00 -0.36 0.00 0.00 55.97 54.29 2otg s LYS 400 Cb 0.00 -4.10 0.00 0.00 -1.51 0.00 0.00 37.83 32.22 2otg s LYS 400 CO 0.00 -1.00 0.00 -2.30 -0.36 0.00 0.00 175.35 171.69 2otg n PRO 401 N 5.18 -0.40 -3.37 4.03 -0.02 -1.15 -4.30 135.00 134.97 2otg n PRO 401 Ca -0.12 0.00 -0.12 0.00 -2.02 0.00 0.00 63.50 61.24 2otg n PRO 401 Cb 0.44 0.00 -0.09 0.00 -0.02 0.00 0.00 33.50 33.83 2otg n PRO 401 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 2otg s LYS 402 N -1.73 0.33 0.38 -0.52 2.20 -1.26 -3.48 119.74 115.66 2otg s LYS 402 Ca 0.00 0.32 -0.06 0.00 -0.36 0.00 0.00 55.97 55.87 2otg s LYS 402 Cb 0.00 -0.59 0.08 0.00 -1.51 0.00 0.00 37.83 35.82 2otg s LYS 402 CO 0.00 -0.77 0.51 1.55 -0.36 0.00 0.00 175.35 176.28 2otg n VAL 403 N 5.35 0.00 -3.27 4.02 3.14 -1.12 -4.17 118.33 122.27 2otg n VAL 403 Ca -0.03 -0.43 -0.25 0.00 -2.96 0.00 0.00 64.34 60.67 2otg n VAL 403 Cb 0.49 -1.70 -0.07 0.00 -1.06 0.00 0.00 33.84 31.50 2otg n VAL 403 CO 0.00 0.00 0.00 1.17 -6.46 0.00 0.00 176.83 171.54 2otg n LYS 404 N -2.06 1.52 -2.90 1.45 4.81 -1.26 -4.24 118.16 115.48 2otg n LYS 404 Ca 0.07 -3.86 -0.38 0.00 -0.87 0.00 0.00 58.31 53.27 2otg n LYS 404 Cb 0.23 -1.68 -0.06 0.00 0.02 0.00 0.00 35.03 33.54 2otg n LYS 404 CO 0.00 0.00 0.00 0.08 1.17 0.00 0.00 177.40 178.65 2otg s VAL 405 N -1.85 4.30 -0.43 3.15 1.01 -1.26 -4.91 120.40 120.40 2otg s VAL 405 Ca 0.38 1.75 -0.45 0.00 0.00 0.00 0.00 61.98 63.65 2otg s VAL 405 Cb 0.17 -4.11 -0.19 0.00 0.00 0.00 0.00 36.38 32.26 2otg s VAL 405 CO -0.07 0.38 1.62 0.61 0.00 0.00 0.00 175.10 177.64 2otg n GLY 406 N 1.18 0.33 4.67 4.51 0.00 -1.26 -1.98 105.19 112.64 2otg n GLY 406 Ca -0.02 0.98 0.00 0.00 0.00 0.00 0.00 46.02 46.98 2otg n GLY 406 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2otg n THR 407 N 4.07 0.00 -3.03 2.61 -1.04 -1.26 -4.73 114.28 110.90 2otg n THR 407 Ca 0.30 0.00 -0.15 0.00 -2.04 0.00 0.00 64.05 62.16 2otg n THR 407 Cb -0.01 0.00 -0.03 0.00 -1.82 0.00 0.00 70.33 68.47 2otg n THR 407 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 2otg n GLU 408 N -1.36 0.47 -1.71 -2.82 1.02 -0.84 -5.13 120.64 110.27 2otg n GLU 408 Ca 0.00 -2.54 -0.43 0.00 -0.02 0.00 0.00 57.16 54.18 2otg n GLU 408 Cb 0.00 -1.51 -0.03 0.00 -0.02 0.00 0.00 31.44 29.88 2otg n GLU 408 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2otg n MET 409 N 2.54 2.65 -0.43 3.49 0.00 -1.10 -4.52 117.12 119.75 2otg n MET 409 Ca 0.21 0.95 0.00 0.00 0.00 0.00 0.00 57.70 58.87 2otg n MET 409 Cb 0.54 -2.78 0.00 0.00 0.00 0.00 0.00 33.22 30.98 2otg n MET 409 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 175.97 176.25 2otg n VAL 410 N 3.66 0.00 -4.44 3.17 0.31 -1.26 -4.88 118.33 114.89 2otg n VAL 410 Ca 0.15 0.00 -0.33 0.00 -0.01 0.00 0.00 64.34 64.15 2otg n VAL 410 Cb 0.34 -1.45 -0.15 0.00 -0.91 0.00 0.00 33.84 31.67 2otg n VAL 410 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 2otg s THR 411 N 0.32 2.54 -0.10 2.52 2.01 -1.26 -2.80 115.64 118.87 2otg s THR 411 Ca 0.00 -0.81 -0.05 0.00 0.31 0.00 0.00 61.69 61.15 2otg s THR 411 Cb 0.00 -2.07 -0.04 0.00 0.01 0.00 0.00 72.50 70.40 2otg s THR 411 CO 0.00 0.52 0.08 -0.54 -0.69 0.00 0.00 174.62 173.99 2otg s LYS 412 N 0.93 3.23 -0.17 4.92 1.02 -1.23 -4.97 119.74 123.48 2otg s LYS 412 Ca -0.03 -0.26 -0.13 0.00 0.02 0.00 0.00 55.97 55.57 2otg s LYS 412 Cb -0.15 -3.01 -0.05 0.00 -0.52 0.00 0.00 37.83 34.10 2otg s LYS 412 CO -0.02 0.75 0.25 0.20 -0.92 0.00 0.00 175.35 175.60 2otg s GLY 413 N -0.98 2.17 -0.01 -3.33 0.00 -1.26 -2.92 107.32 100.99 2otg s GLY 413 Ca 0.14 -0.51 -0.11 0.00 0.00 0.00 0.00 44.72 44.23 2otg s GLY 413 CO 0.03 0.35 0.34 1.20 0.00 0.00 0.00 173.10 175.02 2otg s GLN 414 N 0.43 3.76 0.00 2.90 -1.52 -1.26 -5.01 119.66 118.96 2otg s GLN 414 Ca 0.14 0.21 0.00 0.00 -1.95 0.00 0.00 55.36 53.76 2otg s GLN 414 Cb -0.12 -3.16 0.00 0.00 -0.22 0.00 0.00 33.01 29.50 2otg s GLN 414 CO 0.02 0.68 0.00 -1.71 -0.25 0.00 0.00 175.29 174.04 2otg n ASN 415 N 1.63 0.00 0.00 5.90 2.85 -1.26 -3.70 115.26 120.69 2otg n ASN 415 Ca -0.14 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.33 2otg n ASN 415 Cb 0.53 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.55 2otg n ASN 415 CO 0.00 0.00 0.00 -0.11 -2.11 0.00 0.00 177.26 175.04 2otg n LEU 416 N 0.00 0.33 0.00 1.20 -0.00 -1.26 -4.17 117.00 113.10 2otg n LEU 416 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.01 2otg n LEU 416 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.42 2otg n LEU 416 CO 0.00 0.00 0.06 0.00 -0.00 0.00 0.00 177.39 177.45 2otg n GLN 417 N -0.14 0.00 0.00 1.96 1.13 -1.26 -1.55 117.38 117.52 2otg n GLN 417 Ca 0.00 0.11 0.00 0.00 -1.94 0.00 0.00 57.00 55.17 2otg n GLN 417 Cb 0.00 -0.29 0.00 0.00 0.11 0.00 0.00 30.24 30.06 2otg n GLN 417 CO 0.00 0.00 0.00 1.04 -1.44 0.00 0.00 177.06 176.66 2otg n GLN 418 N -0.41 0.00 -0.32 -1.09 6.02 -1.26 0.44 117.38 120.75 2otg n GLN 418 Ca 0.00 0.00 -0.07 0.00 -0.01 0.00 0.00 57.00 56.92 2otg n GLN 418 Cb 0.00 0.00 -0.05 0.00 1.02 0.00 0.00 30.24 31.21 2otg n GLN 418 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.06 176.33 2otg n VAL 419 N -0.51 -0.50 -0.29 5.09 0.31 -0.59 0.17 118.33 122.01 2otg n VAL 419 Ca 0.00 1.86 0.11 0.00 -0.01 0.00 0.00 64.34 66.30 2otg n VAL 419 Cb 0.00 -2.33 0.28 0.00 -0.91 0.00 0.00 33.84 30.88 2otg n VAL 419 CO 0.00 0.00 0.00 0.40 -1.32 0.00 0.00 176.83 175.91 2otg h ILE 420 N 0.00 0.49 0.00 2.52 2.04 0.93 0.20 117.51 123.69 2otg h ILE 420 Ca 0.15 -0.13 0.00 0.00 1.00 0.00 0.00 64.86 65.88 2otg h ILE 420 Cb 0.35 0.08 0.00 0.00 -0.74 0.00 0.00 36.82 36.50 2otg h ILE 420 CO -0.73 0.07 0.00 0.78 0.00 0.00 0.00 178.15 178.27 2otg h ASN 421 N 0.38 0.00 0.64 1.72 4.21 0.22 -2.51 115.58 120.25 2otg h ASN 421 Ca 0.52 0.00 0.00 0.00 1.21 0.00 0.00 56.30 58.03 2otg h ASN 421 Cb 0.96 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.16 2otg h ASN 421 CO -0.52 0.00 -1.18 -1.20 -1.29 0.00 0.00 177.43 173.25 2otg n SER 422 N -2.86 0.61 -0.04 5.81 7.64 0.61 -2.63 113.62 122.77 2otg n SER 422 Ca 0.01 0.10 -0.15 0.00 1.01 0.00 0.00 58.87 59.84 2otg n SER 422 Cb 0.28 0.82 -0.13 0.00 -1.01 0.00 0.00 64.21 64.18 2otg n SER 422 CO 0.00 0.00 0.00 0.58 -3.01 0.00 0.00 175.04 172.61 2otg h VAL 423 N 0.00 1.65 -0.67 0.44 2.07 -0.94 -1.90 116.25 116.90 2otg h VAL 423 Ca 0.00 -2.18 -0.04 0.00 0.82 0.00 0.00 66.70 65.31 2otg h VAL 423 Cb 0.91 3.10 -0.03 0.00 -1.52 0.00 0.00 31.29 33.75 2otg h VAL 423 CO 0.00 0.58 0.28 1.23 0.02 0.00 0.00 177.57 179.68 2otg h GLY 424 N -0.72 1.07 2.00 2.17 0.00 -1.61 -0.92 103.07 105.06 2otg h GLY 424 Ca -0.03 -0.58 -0.03 0.00 0.00 0.00 0.00 47.33 46.69 2otg h GLY 424 CO 0.04 0.54 -0.15 0.00 0.00 0.00 0.00 176.54 176.97 2otg h ALA 425 N 1.12 1.67 -0.01 3.60 0.00 -1.57 0.11 119.26 124.18 2otg h ALA 425 Ca 0.22 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 2otg h ALA 425 Cb 0.19 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.96 2otg h ALA 425 CO -0.02 0.19 -0.03 1.25 0.00 0.00 0.00 179.25 180.64 2otg h LEU 426 N 0.00 0.04 0.12 0.00 5.85 -0.49 -2.02 115.31 118.81 2otg h LEU 426 Ca -0.00 -0.62 -0.00 0.00 0.84 0.00 0.00 57.88 58.09 2otg h LEU 426 Cb 0.28 -0.01 -0.00 0.00 0.37 0.00 0.00 40.66 41.29 2otg h LEU 426 CO 0.02 0.66 -0.11 -1.28 -0.34 0.00 0.00 178.44 177.39 2otg h SER 427 N -0.57 -0.29 -0.59 1.25 0.87 -0.62 0.19 113.55 113.79 2otg h SER 427 Ca -0.00 0.02 0.05 0.00 -1.23 0.00 0.00 61.79 60.63 2otg h SER 427 Cb 0.65 0.09 -0.07 0.00 -0.44 0.00 0.00 62.40 62.63 2otg h SER 427 CO 0.01 -0.14 -0.35 0.29 -0.53 0.00 0.00 176.83 176.11 2otg n LYS 428 N -2.92 -0.26 -0.01 2.24 5.02 0.33 0.73 118.16 123.29 2otg n LYS 428 Ca -0.03 1.13 0.14 0.00 -2.02 0.00 0.00 58.31 57.53 2otg n LYS 428 Cb 0.10 -1.66 0.58 0.00 -0.02 0.00 0.00 35.03 34.03 2otg n LYS 428 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 2otg h SER 429 N 0.00 0.20 -0.02 4.39 0.87 -1.26 -1.39 113.55 116.34 2otg h SER 429 Ca 0.09 0.00 -0.25 0.00 -1.23 0.00 0.00 61.79 60.41 2otg h SER 429 Cb 0.24 -0.04 0.02 0.00 -0.44 0.00 0.00 62.40 62.18 2otg h SER 429 CO -0.55 0.12 -0.96 0.25 -0.53 0.00 0.00 176.83 175.16 2otg h LEU 430 N 0.22 0.87 -0.71 2.23 5.85 0.35 -2.79 115.31 121.33 2otg h LEU 430 Ca 0.23 -0.73 -0.05 0.00 0.84 0.00 0.00 57.88 58.17 2otg h LEU 430 Cb 0.62 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 41.35 2otg h LEU 430 CO -0.04 1.48 0.25 0.22 -0.34 0.00 0.00 178.44 180.01 2otg h TYR 431 N 0.35 1.13 0.43 1.25 5.03 -0.02 -1.17 116.97 123.96 2otg h TYR 431 Ca -0.12 -0.10 -0.02 0.00 2.58 0.00 0.00 58.73 61.07 2otg h TYR 431 Cb 1.62 -0.33 0.00 0.00 1.55 0.00 0.00 36.73 39.57 2otg h TYR 431 CO 0.11 0.89 -0.21 0.22 -1.32 0.00 0.00 178.16 177.85 2otg h ASP 432 N 1.04 -0.49 -0.66 -2.11 -0.00 -1.32 -0.41 116.42 112.47 2otg h ASP 432 Ca 0.23 -0.03 0.10 0.00 -0.00 0.00 0.00 57.03 57.34 2otg h ASP 432 Cb 0.27 0.13 -0.08 0.00 -0.00 0.00 0.00 39.33 39.65 2otg h ASP 432 CO -0.01 -0.29 0.27 0.03 -0.00 0.00 0.00 179.24 179.25 2otg h ARG 433 N -0.66 0.45 0.56 0.28 3.08 -1.37 0.05 114.38 116.78 2otg h ARG 433 Ca -0.06 -0.03 -0.02 0.00 0.07 0.00 0.00 59.98 59.94 2otg h ARG 433 Cb 0.49 -0.10 -0.00 0.00 0.08 0.00 0.00 29.97 30.43 2otg h ARG 433 CO 0.10 0.30 -0.31 1.98 -1.07 0.00 0.00 179.97 180.96 2otg h MET 434 N 0.46 -0.78 -0.47 0.04 4.05 -1.07 -1.16 114.93 116.01 2otg h MET 434 Ca 0.34 0.05 0.09 0.00 -0.28 0.00 0.00 59.70 59.90 2otg h MET 434 Cb 0.43 0.18 -0.07 0.00 -0.80 0.00 0.00 31.60 31.33 2otg h MET 434 CO -0.32 -0.52 0.02 0.35 0.23 0.00 0.00 176.91 176.67 2otg h PHE 435 N -0.81 0.02 -0.62 1.39 3.04 -0.47 0.12 116.94 119.60 2otg h PHE 435 Ca -0.07 0.03 0.05 0.00 3.98 0.00 0.00 57.97 61.96 2otg h PHE 435 Cb 0.65 0.06 -0.05 0.00 2.56 0.00 0.00 35.95 39.17 2otg h PHE 435 CO -0.07 -0.08 0.35 -0.91 -2.02 0.00 0.00 178.31 175.58 2otg h ASN 436 N 0.14 0.54 -0.40 0.41 2.35 -0.85 -1.01 115.58 116.76 2otg h ASN 436 Ca 0.23 0.02 0.05 0.00 -0.55 0.00 0.00 56.30 56.05 2otg h ASN 436 Cb 0.34 -0.09 -0.04 0.00 0.05 0.00 0.00 38.32 38.58 2otg h ASN 436 CO -0.37 0.36 0.14 -0.25 -1.65 0.00 0.00 177.43 175.66 2otg h TRP 437 N 0.67 0.26 -0.54 1.19 7.01 0.18 -2.01 115.95 122.70 2otg h TRP 437 Ca 0.27 0.02 0.09 0.00 2.11 0.00 0.00 58.89 61.38 2otg h TRP 437 Cb 0.13 -0.06 -0.07 0.00 -2.10 0.00 0.00 29.16 27.06 2otg h TRP 437 CO -0.08 0.10 0.13 1.25 -2.79 0.00 0.00 178.44 177.06 2otg h LEU 438 N 0.31 0.05 0.08 0.65 6.46 0.44 0.45 115.31 123.74 2otg h LEU 438 Ca 0.18 0.09 -0.00 0.00 -0.12 0.00 0.00 57.88 58.03 2otg h LEU 438 Cb 0.16 0.11 0.00 0.00 -0.73 0.00 0.00 40.66 40.20 2otg h LEU 438 CO -0.18 0.05 -0.04 0.58 -0.62 0.00 0.00 178.44 178.23 2otg h VAL 439 N 0.27 1.05 -0.70 1.05 2.07 -1.05 -1.76 116.25 117.18 2otg h VAL 439 Ca 0.27 -0.44 0.09 0.00 0.82 0.00 0.00 66.70 67.45 2otg h VAL 439 Cb 0.37 1.33 -0.05 0.00 -1.52 0.00 0.00 31.29 31.42 2otg h VAL 439 CO -0.33 0.11 0.46 0.07 0.02 0.00 0.00 177.57 177.90 2otg h LYS 440 N -0.30 0.57 0.26 1.57 2.10 -0.82 -0.63 116.57 119.31 2otg h LYS 440 Ca -0.01 -0.03 -0.01 0.00 -2.00 0.00 0.00 60.65 58.59 2otg h LYS 440 Cb 0.26 -0.13 0.00 0.00 -0.90 0.00 0.00 32.23 31.47 2otg h LYS 440 CO 0.02 0.37 -0.12 -0.09 -2.00 0.00 0.00 179.45 177.63 2otg h ARG 441 N 0.58 -0.34 -0.77 0.07 9.65 -0.69 -1.96 114.38 120.93 2otg h ARG 441 Ca 0.32 0.02 0.14 0.00 -1.10 0.00 0.00 59.98 59.36 2otg h ARG 441 Cb 0.48 0.08 -0.09 0.00 -1.39 0.00 0.00 29.97 29.04 2otg h ARG 441 CO -0.11 -0.05 0.33 0.28 2.80 0.00 0.00 179.97 183.22 2otg h VAL 442 N -0.61 0.69 -0.92 0.20 2.07 -0.40 0.45 116.25 117.72 2otg h VAL 442 Ca -0.04 -0.17 0.06 0.00 0.82 0.00 0.00 66.70 67.38 2otg h VAL 442 Cb 0.44 0.15 -0.06 0.00 -1.52 0.00 0.00 31.29 30.30 2otg h VAL 442 CO 0.06 0.09 0.60 0.78 0.02 0.00 0.00 177.57 179.12 2otg h ASN 443 N 0.49 0.94 -0.29 0.57 2.35 -1.02 -0.59 115.58 118.02 2otg h ASN 443 Ca 0.42 0.00 0.05 0.00 -0.55 0.00 0.00 56.30 56.22 2otg h ASN 443 Cb 0.61 -0.20 -0.05 0.00 0.05 0.00 0.00 38.32 38.73 2otg h ASN 443 CO -0.38 0.61 0.01 0.03 -1.65 0.00 0.00 177.43 176.04 2otg h ARG 444 N 1.07 0.09 0.62 0.81 3.08 0.65 0.23 114.38 120.93 2otg h ARG 444 Ca 0.39 -0.01 -0.03 0.00 0.07 0.00 0.00 59.98 60.41 2otg h ARG 444 Cb 0.17 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.19 2otg h ARG 444 CO -0.14 0.06 -0.35 1.15 -1.07 0.00 0.00 179.97 179.61 2otg h THR 445 N 0.10 0.00 0.00 2.04 2.02 -0.24 -3.01 112.91 113.82 2otg h THR 445 Ca 0.14 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.32 2otg h THR 445 Cb 0.18 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 66.59 2otg h THR 445 CO -0.23 0.00 0.03 -0.07 0.37 0.00 0.00 175.52 175.62 2otg h LEU 446 N -0.90 0.00 -8.01 2.58 3.38 -1.15 -3.37 115.31 107.84 2otg h LEU 446 Ca -0.08 0.00 -0.65 0.00 0.09 0.00 0.00 57.88 57.23 2otg h LEU 446 Cb 0.71 0.00 -0.14 0.00 0.09 0.00 0.00 40.66 41.33 2otg h LEU 446 CO 0.10 0.00 1.26 -0.62 0.09 0.00 0.00 178.44 179.27 2otg s ASP 447 N -4.05 6.62 -0.36 -0.43 2.15 0.06 -3.45 116.67 117.21 2otg s ASP 447 Ca -0.02 -1.89 -0.26 0.00 0.43 0.00 0.00 52.55 50.81 2otg s ASP 447 Cb 0.06 -2.49 0.01 0.00 -0.30 0.00 0.00 42.92 40.21 2otg s ASP 447 CO 0.20 -1.24 0.93 0.42 -0.17 0.00 0.00 175.17 175.32 2otg s THR 448 N 3.70 4.58 -0.24 1.71 -4.23 -1.26 -4.88 115.64 115.03 2otg s THR 448 Ca 0.41 1.24 -0.27 0.00 -1.18 0.00 0.00 61.69 61.88 2otg s THR 448 Cb -0.02 -4.34 -0.32 0.00 1.34 0.00 0.00 72.50 69.17 2otg s THR 448 CO -0.08 -0.53 1.62 0.29 -0.54 0.00 0.00 174.62 175.39 2otg n LYS 449 N 6.77 0.02 -4.60 3.99 4.76 -1.26 -4.78 118.16 123.06 2otg n LYS 449 Ca 0.07 -1.07 -0.23 0.00 -2.87 0.00 0.00 58.31 54.22 2otg n LYS 449 Cb 0.48 -2.70 -0.14 0.00 -1.84 0.00 0.00 35.03 30.83 2otg n LYS 449 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2otg s ALA 450 N 8.95 1.32 -0.16 7.82 0.00 -1.26 -5.09 121.76 133.34 2otg s ALA 450 Ca 0.66 -0.77 -0.38 0.00 0.00 0.00 0.00 51.96 51.47 2otg s ALA 450 Cb 0.09 -0.29 -0.15 0.00 0.00 0.00 0.00 23.12 22.78 2otg s ALA 450 CO 0.28 0.30 1.72 1.63 0.00 0.00 0.00 175.76 179.69 2otg n LYS 451 N 2.33 1.47 -4.99 0.00 4.76 -1.26 -4.91 118.16 115.55 2otg n LYS 451 Ca -0.16 0.54 -0.32 0.00 -2.87 0.00 0.00 58.31 55.50 2otg n LYS 451 Cb 0.54 -2.26 -0.15 0.00 -1.84 0.00 0.00 35.03 31.33 2otg n LYS 451 CO 0.00 0.00 0.00 -0.98 -1.37 0.00 0.00 177.40 175.05 2otg s ARG 452 N 3.11 2.77 -0.27 1.97 3.03 -1.26 -4.52 118.95 123.78 2otg s ARG 452 Ca 0.94 -0.77 -0.10 0.00 2.03 0.00 0.00 55.73 57.83 2otg s ARG 452 Cb -0.94 -2.37 -0.14 0.00 -1.03 0.00 0.00 34.95 30.47 2otg s ARG 452 CO 0.58 0.42 -0.31 0.09 -1.13 0.00 0.00 175.30 174.95 2otg n ASN 453 N 2.88 1.96 -4.24 -2.89 5.03 -0.59 -5.00 115.26 112.41 2otg n ASN 453 Ca -0.18 0.22 -0.14 0.00 0.87 0.00 0.00 54.58 55.36 2otg n ASN 453 Cb 0.52 -0.72 -0.10 0.00 -1.02 0.00 0.00 39.78 38.46 2otg n ASN 453 CO 0.00 0.00 0.00 -0.31 -1.83 0.00 0.00 177.26 175.12 2otg s TYR 454 N -2.51 1.26 0.30 3.10 2.02 -1.21 -5.02 117.35 115.29 2otg s TYR 454 Ca -0.38 -1.24 0.05 0.00 -0.37 0.00 0.00 57.07 55.14 2otg s TYR 454 Cb 0.13 -0.69 -0.03 0.00 -0.40 0.00 0.00 41.96 40.97 2otg s TYR 454 CO 0.52 -0.45 0.24 1.52 -1.57 0.00 0.00 175.55 175.81 2otg s TYR 455 N -3.93 1.63 -0.18 2.71 -0.85 -1.26 -0.99 117.35 114.48 2otg s TYR 455 Ca 0.34 -1.59 -0.05 0.00 -0.52 0.00 0.00 57.07 55.26 2otg s TYR 455 Cb 0.07 -0.70 0.09 0.00 0.38 0.00 0.00 41.96 41.81 2otg s TYR 455 CO 0.10 -0.80 0.31 0.42 -1.52 0.00 0.00 175.55 174.06 2otg s ILE 456 N -3.60 -0.49 0.49 -3.49 1.01 -0.80 -2.80 121.20 111.53 2otg s ILE 456 Ca 0.40 0.12 0.00 0.00 0.00 0.00 0.00 60.65 61.17 2otg s ILE 456 Cb 0.03 -0.61 0.01 0.00 0.01 0.00 0.00 42.46 41.91 2otg s ILE 456 CO 0.24 0.00 0.72 -0.83 0.00 0.00 0.00 174.94 175.07 2otg s GLY 457 N 2.47 1.65 -0.18 6.18 0.00 -1.09 -0.78 107.32 115.56 2otg s GLY 457 Ca 0.04 -1.11 -0.04 0.00 0.00 0.00 0.00 44.72 43.61 2otg s GLY 457 CO -0.11 -0.90 0.18 0.14 0.00 0.00 0.00 173.10 172.40 2otg s VAL 458 N -2.65 -0.25 0.35 1.40 1.01 0.19 -1.78 120.40 118.67 2otg s VAL 458 Ca 0.51 -0.09 -0.04 0.00 0.00 0.00 0.00 61.98 62.37 2otg s VAL 458 Cb -0.10 -0.61 -0.04 0.00 0.00 0.00 0.00 36.38 35.62 2otg s VAL 458 CO 0.39 -0.20 0.61 -0.22 0.00 0.00 0.00 175.10 175.68 2otg s LEU 459 N 2.27 3.95 -0.49 3.92 2.96 -1.08 -1.58 118.68 128.63 2otg s LEU 459 Ca 0.05 0.70 0.05 0.00 -0.22 0.00 0.00 54.13 54.71 2otg s LEU 459 Cb -0.15 -3.56 0.20 0.00 0.50 0.00 0.00 46.19 43.18 2otg s LEU 459 CO -0.11 -0.31 0.82 -0.67 -1.32 0.00 0.00 176.35 174.76 2otg n ASP 460 N -1.48 -3.04 -4.70 3.68 2.03 -1.04 -2.88 116.55 109.12 2otg n ASP 460 Ca -0.02 -2.68 -0.29 0.00 0.52 0.00 0.00 54.79 52.32 2otg n ASP 460 Cb 0.55 1.60 -0.09 0.00 -0.72 0.00 0.00 41.12 42.46 2otg n ASP 460 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 2otg s ILE 461 N 0.83 1.79 0.89 5.18 1.01 -1.25 -2.91 121.20 126.74 2otg s ILE 461 Ca 0.29 -1.91 -0.10 0.00 0.00 0.00 0.00 60.65 58.93 2otg s ILE 461 Cb 0.06 -2.70 0.13 0.00 0.01 0.00 0.00 42.46 39.96 2otg s ILE 461 CO -0.09 0.00 1.12 0.00 0.00 0.00 0.00 174.94 175.97 2otg s ALA 462 N -2.74 1.56 0.33 9.38 0.00 -1.26 -4.51 121.76 124.52 2otg s ALA 462 Ca 0.27 0.43 0.05 0.00 0.00 0.00 0.00 51.96 52.71 2otg s ALA 462 Cb 0.06 -3.38 0.05 0.00 0.00 0.00 0.00 23.12 19.85 2otg s ALA 462 CO 0.15 -2.54 0.42 0.41 0.00 0.00 0.00 175.76 174.20 2otg n GLY 463 N -0.21 2.07 3.68 0.00 0.00 -0.70 -4.78 105.19 105.25 2otg n GLY 463 Ca 0.10 -2.19 -0.42 0.00 0.00 0.00 0.00 46.02 43.51 2otg n GLY 463 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2otg s PHE 464 N -1.10 2.60 -0.02 1.61 5.36 -1.26 -4.79 117.98 120.38 2otg s PHE 464 Ca 0.32 0.60 0.01 0.00 -0.96 0.00 0.00 56.93 56.90 2otg s PHE 464 Cb -0.03 -3.77 0.01 0.00 -0.34 0.00 0.00 43.02 38.90 2otg s PHE 464 CO 0.20 -2.98 -0.02 -2.00 -1.46 0.00 0.00 175.22 168.96 2otg s GLU 465 N 2.80 0.37 -0.01 10.12 2.12 -1.26 -4.92 118.70 127.93 2otg s GLU 465 Ca 0.67 -0.04 0.02 0.00 0.36 0.00 0.00 54.97 55.98 2otg s GLU 465 Cb -0.33 -0.44 -0.03 0.00 0.26 0.00 0.00 34.13 33.58 2otg s GLU 465 CO 0.28 -0.03 -0.05 0.42 -0.54 0.00 0.00 175.26 175.34 2otg s ILE 466 N 0.51 3.81 0.23 -3.70 1.01 -1.26 -4.94 121.20 116.86 2otg s ILE 466 Ca -0.05 -0.67 0.03 0.00 0.00 0.00 0.00 60.65 59.96 2otg s ILE 466 Cb -0.08 -2.65 -0.01 0.00 0.01 0.00 0.00 42.46 39.73 2otg s ILE 466 CO -0.01 0.43 0.10 0.49 0.00 0.00 0.00 174.94 175.95 2otg n PHE 467 N 1.64 -0.00 -0.04 3.97 3.72 -1.26 -5.04 117.46 120.45 2otg n PHE 467 Ca -0.16 -1.56 -0.14 0.00 -0.05 0.00 0.00 57.45 55.55 2otg n PHE 467 Cb 0.53 0.02 -0.09 0.00 -0.94 0.00 0.00 39.48 39.00 2otg n PHE 467 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 176.76 176.27 2otg h ASP 468 N 0.99 0.30 -3.51 4.37 3.32 -1.95 -3.43 116.42 116.51 2otg h ASP 468 Ca -0.18 -0.55 -0.68 0.00 0.02 0.00 0.00 57.03 55.64 2otg h ASP 468 Cb 0.71 -0.09 -0.31 0.00 0.22 0.00 0.00 39.33 39.86 2otg h ASP 468 CO 0.28 0.80 -0.86 0.12 -1.72 0.00 0.00 179.24 177.86 2otg s PHE 469 N -4.01 2.58 0.03 4.55 5.36 -1.26 -1.56 117.98 123.67 2otg s PHE 469 Ca -0.15 -0.89 0.05 0.00 -0.96 0.00 0.00 56.93 54.99 2otg s PHE 469 Cb 0.04 -1.70 -0.02 0.00 -0.34 0.00 0.00 43.02 40.99 2otg s PHE 469 CO 0.74 -0.32 -0.15 -0.80 -1.46 0.00 0.00 175.22 173.23 2otg s ASN 470 N 0.20 1.79 0.00 6.13 0.02 -1.26 -5.04 114.94 116.78 2otg s ASN 470 Ca -0.13 -0.43 0.00 0.00 -1.02 0.00 0.00 52.86 51.27 2otg s ASN 470 Cb -0.16 -0.14 0.00 0.00 0.02 0.00 0.00 41.25 40.97 2otg s ASN 470 CO 0.07 0.08 0.00 -0.24 0.02 0.00 0.00 177.10 177.03 2otg n SER 471 N 2.03 0.06 -0.37 -1.22 2.88 -1.26 -1.89 113.62 113.85 2otg n SER 471 Ca -0.17 -0.83 0.30 0.00 -1.33 0.00 0.00 58.87 56.83 2otg n SER 471 Cb 0.55 0.00 0.59 0.00 -0.75 0.00 0.00 64.21 64.60 2otg n SER 471 CO 0.00 0.00 0.00 0.15 -1.23 0.00 0.00 175.04 173.96 2otg h PHE 472 N 0.83 0.52 -0.15 0.66 3.57 -1.94 0.41 116.94 120.83 2otg h PHE 472 Ca 0.00 0.02 -0.13 0.00 3.53 0.00 0.00 57.97 61.39 2otg h PHE 472 Cb 0.00 -0.14 -0.01 0.00 2.79 0.00 0.00 35.95 38.59 2otg h PHE 472 CO 0.00 -0.04 -0.47 0.93 -2.23 0.00 0.00 178.31 176.50 2otg h GLU 473 N 0.23 0.39 -0.05 1.11 3.07 -1.98 -2.81 114.58 114.55 2otg h GLU 473 Ca 0.68 -0.21 -0.08 0.00 -0.50 0.00 0.00 59.36 59.25 2otg h GLU 473 Cb 2.01 0.01 0.00 0.00 -0.84 0.00 0.00 28.75 29.94 2otg h GLU 473 CO -0.30 0.78 -0.27 1.96 -1.40 0.00 0.00 179.01 179.78 2otg h GLN 474 N 0.31 0.27 -0.46 2.33 7.50 -0.64 -3.22 115.11 121.20 2otg h GLN 474 Ca 0.02 -0.22 0.09 0.00 0.50 0.00 0.00 58.65 59.04 2otg h GLN 474 Cb 0.95 0.05 -0.09 0.00 0.05 0.00 0.00 27.48 28.44 2otg h GLN 474 CO 0.08 0.88 -0.13 1.25 -1.50 0.00 0.00 178.83 179.42 2otg h LEU 475 N -0.28 -0.46 -0.28 1.46 6.46 -1.15 -1.73 115.31 119.32 2otg h LEU 475 Ca -0.02 0.14 0.06 0.00 -0.12 0.00 0.00 57.88 57.95 2otg h LEU 475 Cb 0.94 0.30 -0.08 0.00 -0.73 0.00 0.00 40.66 41.09 2otg h LEU 475 CO 0.06 -0.16 -0.34 0.00 -0.62 0.00 0.00 178.44 177.38 2otg h ILE 477 N -0.33 0.17 -0.88 0.00 1.08 -1.46 -1.85 117.51 114.25 2otg h ILE 477 Ca 0.13 0.00 0.08 0.00 -0.39 0.00 0.00 64.86 64.68 2otg h ILE 477 Cb 0.55 0.17 -0.06 0.00 -3.07 0.00 0.00 36.82 34.41 2otg h ILE 477 CO -0.46 0.00 0.57 0.78 -0.69 0.00 0.00 178.15 178.35 2otg h ASN 478 N -0.82 0.84 0.57 1.72 -0.26 -1.12 -0.68 115.58 115.83 2otg h ASN 478 Ca -0.03 0.01 -0.03 0.00 -0.56 0.00 0.00 56.30 55.69 2otg h ASN 478 Cb 0.74 -0.17 -0.00 0.00 -1.06 0.00 0.00 38.32 37.83 2otg h ASN 478 CO -0.08 0.52 -0.14 0.22 -1.06 0.00 0.00 177.43 176.89 2otg h TYR 479 N 0.94 0.00 0.00 1.19 3.20 0.19 -0.31 116.97 122.18 2otg h TYR 479 Ca 0.39 0.00 -0.00 0.00 3.14 0.00 0.00 58.73 62.25 2otg h TYR 479 Cb 0.28 0.00 -0.00 0.00 1.54 0.00 0.00 36.73 38.55 2otg h TYR 479 CO -0.00 0.14 -0.03 1.15 -1.64 0.00 0.00 178.16 177.78 2otg h THR 480 N 0.00 0.84 -0.50 1.81 2.02 -0.34 -3.16 112.91 113.59 2otg h THR 480 Ca -0.00 -1.64 0.09 0.00 0.77 0.00 0.00 66.41 65.63 2otg h THR 480 Cb 0.46 1.60 -0.03 0.00 -1.74 0.00 0.00 68.15 68.45 2otg h THR 480 CO 0.02 0.29 0.34 0.78 0.37 0.00 0.00 175.52 177.32 2otg h ASN 481 N -1.00 0.26 0.55 4.18 2.35 -1.27 0.15 115.58 120.79 2otg h ASN 481 Ca -0.00 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 55.73 2otg h ASN 481 Cb 0.49 -0.05 -0.01 0.00 0.05 0.00 0.00 38.32 38.80 2otg h ASN 481 CO -0.00 0.16 -0.41 -0.08 -1.65 0.00 0.00 177.43 175.45 2otg h GLU 482 N 0.29 -0.89 -0.97 0.81 4.57 -1.14 1.31 114.58 118.56 2otg h GLU 482 Ca 0.23 0.06 0.10 0.00 -1.18 0.00 0.00 59.36 58.58 2otg h GLU 482 Cb 0.54 0.20 -0.07 0.00 -0.16 0.00 0.00 28.75 29.26 2otg h GLU 482 CO -0.05 -0.60 0.62 0.00 -1.18 0.00 0.00 179.01 177.80 2otg h ARG 483 N -0.93 0.96 0.00 1.92 2.47 -1.22 -1.39 114.38 116.18 2otg h ARG 483 Ca -0.06 -0.06 -0.07 0.00 -1.26 0.00 0.00 59.98 58.53 2otg h ARG 483 Cb 0.78 -0.22 -0.01 0.00 -1.65 0.00 0.00 29.97 28.87 2otg h ARG 483 CO 0.02 0.63 -0.35 -0.07 0.56 0.00 0.00 179.97 180.76 2otg h LEU 484 N 0.99 0.00 0.19 3.04 3.38 0.27 -2.70 115.31 120.48 2otg h LEU 484 Ca 0.46 0.00 -0.26 0.00 0.09 0.00 0.00 57.88 58.17 2otg h LEU 484 Cb 0.41 0.00 0.03 0.00 0.09 0.00 0.00 40.66 41.19 2otg h LEU 484 CO -0.22 0.35 -1.13 -0.61 0.09 0.00 0.00 178.44 176.93 2otg h GLN 485 N 0.00 0.42 -0.54 1.13 5.75 0.27 -3.19 115.11 118.96 2otg h GLN 485 Ca -0.00 -0.71 0.13 0.00 -0.15 0.00 0.00 58.65 57.91 2otg h GLN 485 Cb 0.86 0.26 -0.03 0.00 1.07 0.00 0.00 27.48 29.65 2otg h GLN 485 CO 0.05 1.34 0.37 0.37 -2.65 0.00 0.00 178.83 178.31 2otg h GLN 486 N -0.11 0.14 -0.60 1.69 4.15 -1.26 0.25 115.11 119.38 2otg h GLN 486 Ca -0.20 -0.01 -0.10 0.00 0.77 0.00 0.00 58.65 59.12 2otg h GLN 486 Cb 1.89 -0.03 -0.02 0.00 0.21 0.00 0.00 27.48 29.52 2otg h GLN 486 CO 0.21 0.10 -0.01 0.35 -1.93 0.00 0.00 178.83 177.55 2otg h PHE 487 N 0.15 1.15 -0.09 3.99 3.57 -1.49 -2.34 116.94 121.88 2otg h PHE 487 Ca 0.26 -0.20 -0.03 0.00 3.53 0.00 0.00 57.97 61.53 2otg h PHE 487 Cb 0.81 -0.30 -0.00 0.00 2.79 0.00 0.00 35.95 39.25 2otg h PHE 487 CO -0.00 1.02 -0.05 0.35 -2.23 0.00 0.00 178.31 177.40 2otg h PHE 488 N 0.96 0.21 -0.79 0.41 3.04 -0.54 -2.07 116.94 118.17 2otg h PHE 488 Ca 0.17 -0.06 0.13 0.00 3.98 0.00 0.00 57.97 62.19 2otg h PHE 488 Cb 0.56 -0.05 -0.06 0.00 2.56 0.00 0.00 35.95 38.97 2otg h PHE 488 CO 0.04 0.56 0.52 -0.91 -2.02 0.00 0.00 178.31 176.50 2otg h ASN 489 N -0.20 0.54 0.76 0.41 -0.26 -1.28 0.27 115.58 115.82 2otg h ASN 489 Ca 0.02 0.02 -0.09 0.00 -0.56 0.00 0.00 56.30 55.69 2otg h ASN 489 Cb 0.51 -0.09 -0.01 0.00 -1.06 0.00 0.00 38.32 37.67 2otg h ASN 489 CO 0.01 0.30 -0.45 -0.74 -1.06 0.00 0.00 177.43 175.49 2otg h HIS 490 N 0.58 0.00 0.04 1.19 2.76 -1.16 0.64 115.15 119.20 2otg h HIS 490 Ca 0.38 0.00 -0.15 0.00 -2.20 0.00 0.00 60.37 58.40 2otg h HIS 490 Cb 0.66 0.00 0.01 0.00 1.55 0.00 0.00 27.41 29.63 2otg h HIS 490 CO -0.00 0.45 -0.62 1.25 -1.30 0.00 0.00 177.93 177.70 2otg h HIS 491 N 0.00 0.56 -0.32 5.26 -0.00 -0.03 -2.98 115.15 117.64 2otg h HIS 491 Ca -0.00 -0.33 0.06 0.00 -0.00 0.00 0.00 60.37 60.09 2otg h HIS 491 Cb 0.95 -0.05 -0.05 0.00 -0.00 0.00 0.00 27.41 28.25 2otg h HIS 491 CO 0.00 1.17 0.00 0.52 -0.00 0.00 0.00 177.93 179.62 2otg h MET 492 N -0.21 0.09 -0.88 5.26 2.07 -0.40 -2.32 114.93 118.53 2otg h MET 492 Ca -0.09 -0.01 0.08 0.00 -2.07 0.00 0.00 59.70 57.62 2otg h MET 492 Cb 1.37 -0.02 -0.07 0.00 -1.87 0.00 0.00 31.60 31.01 2otg h MET 492 CO 0.12 0.06 0.53 0.35 1.07 0.00 0.00 176.91 179.05 2otg h PHE 493 N 0.09 0.98 0.20 -0.22 3.04 -0.92 -1.41 116.94 118.70 2otg h PHE 493 Ca 0.16 0.03 -0.01 0.00 3.98 0.00 0.00 57.97 62.13 2otg h PHE 493 Cb 0.21 -0.31 0.00 0.00 2.56 0.00 0.00 35.95 38.41 2otg h PHE 493 CO -0.23 0.45 -0.09 0.28 -2.02 0.00 0.00 178.31 176.69 2otg h VAL 494 N 0.93 0.90 -0.67 1.41 2.07 -1.33 -2.14 116.25 117.41 2otg h VAL 494 Ca 0.41 -0.75 0.14 0.00 0.82 0.00 0.00 66.70 67.32 2otg h VAL 494 Cb 0.29 1.32 -0.12 0.00 -1.52 0.00 0.00 31.29 31.26 2otg h VAL 494 CO -0.21 0.16 -0.06 -0.07 0.02 0.00 0.00 177.57 177.41 2otg h LEU 495 N -0.65 -0.43 -0.12 2.57 3.38 -1.18 -0.33 115.31 118.55 2otg h LEU 495 Ca -0.03 0.18 -0.01 0.00 0.09 0.00 0.00 57.88 58.12 2otg h LEU 495 Cb 0.47 0.35 -0.01 0.00 0.09 0.00 0.00 40.66 41.56 2otg h LEU 495 CO 0.04 -0.17 0.05 -0.08 0.09 0.00 0.00 178.44 178.37 2otg h GLU 496 N 0.07 0.18 0.19 1.13 4.57 -1.30 -1.89 114.58 117.52 2otg h GLU 496 Ca 0.35 -0.03 0.01 0.00 -1.18 0.00 0.00 59.36 58.51 2otg h GLU 496 Cb 0.57 -0.03 -0.04 0.00 -0.16 0.00 0.00 28.75 29.09 2otg h GLU 496 CO -0.63 0.29 -0.43 1.96 -1.18 0.00 0.00 179.01 179.02 2otg h GLN 497 N 0.03 -0.68 0.00 1.92 4.20 -0.58 0.53 115.11 120.53 2otg h GLN 497 Ca 0.04 0.05 0.00 0.00 0.06 0.00 0.00 58.65 58.80 2otg h GLN 497 Cb 0.17 0.15 0.00 0.00 0.30 0.00 0.00 27.48 28.11 2otg h GLN 497 CO -0.00 -0.45 0.00 0.93 -0.67 0.00 0.00 178.83 178.63 2otg h GLU 498 N -0.70 0.00 0.00 1.46 4.39 -1.09 0.35 114.58 118.98 2otg h GLU 498 Ca 0.01 0.00 -0.05 0.00 0.34 0.00 0.00 59.36 59.65 2otg h GLU 498 Cb 0.70 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.34 2otg h GLU 498 CO -0.21 0.00 -0.32 1.49 -1.16 0.00 0.00 179.01 178.81 2otg h GLU 499 N 0.00 0.00 -0.32 2.33 4.57 -0.36 -2.75 114.58 118.05 2otg h GLU 499 Ca 0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 2otg h GLU 499 Cb 0.07 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 28.64 2otg h GLU 499 CO 0.00 0.79 0.21 1.88 -1.18 0.00 0.00 179.01 180.71 2otg h TYR 500 N -1.00 0.41 -0.84 0.92 0.05 -0.50 -2.45 116.97 113.56 2otg h TYR 500 Ca -0.08 0.01 -0.01 0.00 0.05 0.00 0.00 58.73 58.69 2otg h TYR 500 Cb 0.89 -0.14 -0.04 0.00 1.01 0.00 0.00 36.73 38.46 2otg h TYR 500 CO 0.17 0.27 0.48 -0.22 -1.05 0.00 0.00 178.16 177.80 2otg h LYS 501 N 0.43 1.16 0.00 4.88 3.64 -1.09 -2.65 116.57 122.94 2otg h LYS 501 Ca 0.12 -0.12 -0.01 0.00 -1.27 0.00 0.00 60.65 59.37 2otg h LYS 501 Cb -0.04 -0.24 -0.00 0.00 -0.41 0.00 0.00 32.23 31.55 2otg h LYS 501 CO -0.02 0.84 -0.03 -0.22 -2.27 0.00 0.00 179.45 177.74 2otg h LYS 502 N 1.17 0.00 -0.45 1.90 3.64 -1.13 -2.72 116.57 118.99 2otg h LYS 502 Ca 0.30 0.00 -0.07 0.00 -1.27 0.00 0.00 60.65 59.61 2otg h LYS 502 Cb -0.00 0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 31.77 2otg h LYS 502 CO -0.05 0.03 0.06 0.39 -2.27 0.00 0.00 179.45 177.61 2otg n GLU 503 N -3.50 3.41 0.00 1.90 -0.58 -1.00 -4.94 120.64 115.93 2otg n GLU 503 Ca -0.02 -3.01 0.00 0.00 -0.42 0.00 0.00 57.16 53.70 2otg n GLU 503 Cb 0.13 -2.02 0.00 0.00 -0.57 0.00 0.00 31.44 28.98 2otg n GLU 503 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2otg n GLY 504 N -0.27 2.16 0.00 0.62 0.00 -1.03 -2.21 105.19 104.47 2otg n GLY 504 Ca 0.29 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.31 2otg n GLY 504 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 2otg n ILE 505 N -0.07 0.00 0.00 -0.61 3.06 -1.22 -4.99 119.36 115.54 2otg n ILE 505 Ca 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 62.75 60.25 2otg n ILE 505 Cb 0.00 -0.08 0.00 0.00 0.54 0.00 0.00 39.64 40.10 2otg n ILE 505 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 2otg n GLN 506 N 0.00 0.00 -3.68 9.51 10.64 -1.25 -4.52 117.38 128.09 2otg n GLN 506 Ca 0.00 0.00 -0.14 0.00 -1.83 0.00 0.00 57.00 55.03 2otg n GLN 506 Cb 0.00 0.00 -0.08 0.00 -0.86 0.00 0.00 30.24 29.30 2otg n GLN 506 CO 0.00 0.00 0.00 -0.46 -1.83 0.00 0.00 177.06 174.77 2otg s TRP 507 N 0.63 -0.62 -1.21 2.61 -0.11 -1.26 -4.19 118.94 114.78 2otg s TRP 507 Ca 0.00 1.49 0.11 0.00 1.22 0.00 0.00 56.10 58.92 2otg s TRP 507 Cb 0.00 0.22 0.15 0.00 -1.50 0.00 0.00 33.47 32.34 2otg s TRP 507 CO 0.00 -0.31 0.96 -1.91 -4.62 0.00 0.00 176.95 171.07 2otg n GLU 508 N 2.68 1.21 0.00 5.86 2.13 -1.26 -5.09 120.64 126.17 2otg n GLU 508 Ca -0.14 -1.41 0.00 0.00 0.66 0.00 0.00 57.16 56.27 2otg n GLU 508 Cb 0.56 -1.22 0.00 0.00 0.27 0.00 0.00 31.44 31.05 2otg n GLU 508 CO 0.00 0.00 0.00 0.34 -0.41 0.00 0.00 177.13 177.06 2otg n PHE 509 N 0.57 -0.04 0.00 4.31 7.35 -1.26 -5.16 117.46 123.23 2otg n PHE 509 Ca 0.08 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.77 2otg n PHE 509 Cb 0.31 0.03 0.00 0.00 0.35 0.00 0.00 39.48 40.17 2otg n PHE 509 CO 0.00 0.00 0.00 -0.89 -0.76 0.00 0.00 176.76 175.11 2otg n ILE 510 N -1.09 0.00 -3.64 -2.13 5.41 -1.26 -5.17 119.36 111.49 2otg n ILE 510 Ca 0.00 0.00 -0.05 0.00 1.00 0.00 0.00 62.75 63.70 2otg n ILE 510 Cb 0.00 0.00 -0.06 0.00 -0.71 0.00 0.00 39.64 38.87 2otg n ILE 510 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 2otg s ASP 511 N 1.00 -0.20 0.09 4.38 -1.08 -1.26 -5.05 116.67 114.56 2otg s ASP 511 Ca 0.00 0.34 0.25 0.00 -0.52 0.00 0.00 52.55 52.62 2otg s ASP 511 Cb 0.00 0.33 0.96 0.00 -1.46 0.00 0.00 42.92 42.76 2otg s ASP 511 CO 0.00 -0.10 1.77 0.49 0.52 0.00 0.00 175.17 177.85 2otg n PHE 512 N 1.49 0.37 -2.65 -5.34 3.72 -1.26 -3.95 117.46 109.84 2otg n PHE 512 Ca -0.09 0.12 -0.43 0.00 -0.05 0.00 0.00 57.45 56.99 2otg n PHE 512 Cb 0.57 -0.70 0.00 0.00 -0.94 0.00 0.00 39.48 38.42 2otg n PHE 512 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2otg n GLY 513 N 0.94 3.31 0.00 1.37 0.00 -1.26 -4.68 105.19 104.87 2otg n GLY 513 Ca 0.05 -1.79 0.00 0.00 0.00 0.00 0.00 46.02 44.28 2otg n GLY 513 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 2otg n MET 514 N 6.50 0.00 0.00 1.61 0.00 -1.25 -4.66 117.12 119.31 2otg n MET 514 Ca 0.43 0.00 0.08 0.00 0.00 0.00 0.00 57.70 58.21 2otg n MET 514 Cb 0.43 0.00 0.41 0.00 0.00 0.00 0.00 33.22 34.06 2otg n MET 514 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 175.97 175.72 2otg n ASP 515 N -0.47 0.00 -0.07 3.17 10.43 -1.26 -1.98 116.55 126.37 2otg n ASP 515 Ca 0.00 -0.02 -0.14 0.00 2.57 0.00 0.00 54.79 57.20 2otg n ASP 515 Cb 0.00 -0.24 -0.06 0.00 1.84 0.00 0.00 41.12 42.66 2otg n ASP 515 CO 0.00 0.00 0.00 -0.07 -1.07 0.00 0.00 177.20 176.06 2otg h LEU 516 N 0.00 0.62 -0.38 0.64 -0.00 -1.86 -3.27 115.31 111.07 2otg h LEU 516 Ca 0.00 -0.52 0.06 0.00 -0.00 0.00 0.00 57.88 57.42 2otg h LEU 516 Cb 0.13 -0.18 -0.05 0.00 -0.00 0.00 0.00 40.66 40.56 2otg h LEU 516 CO 0.00 1.02 0.06 1.56 -0.00 0.00 0.00 178.44 181.08 2otg h GLN 517 N 0.24 0.17 -0.20 1.13 1.08 -1.67 -1.18 115.11 114.69 2otg h GLN 517 Ca 0.02 -0.01 0.04 0.00 -1.45 0.00 0.00 58.65 57.25 2otg h GLN 517 Cb 0.89 -0.04 -0.04 0.00 -0.05 0.00 0.00 27.48 28.24 2otg h GLN 517 CO 0.07 0.11 -0.04 0.52 -0.95 0.00 0.00 178.83 178.54 2otg h MET 518 N 0.18 0.01 -0.29 1.46 2.86 -1.70 0.77 114.93 118.21 2otg h MET 518 Ca 0.18 -0.00 0.01 0.00 -2.06 0.00 0.00 59.70 57.83 2otg h MET 518 Cb 0.22 -0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.86 2otg h MET 518 CO -0.25 0.01 0.16 0.00 1.06 0.00 0.00 176.91 177.88 2otg h ILE 520 N 0.32 1.20 -0.55 0.00 2.04 -0.70 -2.91 117.51 116.92 2otg h ILE 520 Ca 0.11 -0.51 -0.01 0.00 1.00 0.00 0.00 64.86 65.46 2otg h ILE 520 Cb 0.01 0.43 -0.03 0.00 -0.74 0.00 0.00 36.82 36.50 2otg h ILE 520 CO -0.06 0.22 0.30 0.44 0.00 0.00 0.00 178.15 179.05 2otg h ASP 521 N 0.82 0.68 -1.01 1.72 3.45 0.11 -0.85 116.42 121.34 2otg h ASP 521 Ca 0.21 -0.09 0.23 0.00 0.43 0.00 0.00 57.03 57.81 2otg h ASP 521 Cb 0.05 -0.17 -0.11 0.00 -0.56 0.00 0.00 39.33 38.54 2otg h ASP 521 CO -0.03 0.57 0.61 0.25 -1.57 0.00 0.00 179.24 179.07 2otg h LEU 522 N 0.74 0.68 0.01 1.55 6.46 -0.83 -0.32 115.31 123.59 2otg h LEU 522 Ca 0.19 0.12 -0.00 0.00 -0.12 0.00 0.00 57.88 58.07 2otg h LEU 522 Cb 0.04 0.01 0.00 0.00 -0.73 0.00 0.00 40.66 39.98 2otg h LEU 522 CO -0.03 0.15 -0.00 0.40 -0.62 0.00 0.00 178.44 178.34 2otg h ILE 523 N 0.61 0.38 0.00 4.05 2.04 -1.33 -1.19 117.51 122.07 2otg h ILE 523 Ca 0.62 -1.28 0.00 0.00 1.00 0.00 0.00 64.86 65.20 2otg h ILE 523 Cb 1.16 0.72 0.00 0.00 -0.74 0.00 0.00 36.82 37.97 2otg h ILE 523 CO -0.42 0.13 -0.67 -1.84 0.00 0.00 0.00 178.15 175.35 2otg n GLU 524 N -4.75 0.11 -1.82 2.37 0.28 -0.37 -2.94 120.64 113.52 2otg n GLU 524 Ca -0.02 0.01 -0.30 0.00 -0.16 0.00 0.00 57.16 56.69 2otg n GLU 524 Cb 0.11 -1.55 0.07 0.00 1.43 0.00 0.00 31.44 31.49 2otg n GLU 524 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 177.13 177.12 2otg s LYS 525 N -3.07 2.50 0.05 3.44 -0.14 -0.14 -4.90 119.74 117.48 2otg s LYS 525 Ca 0.08 0.41 -0.11 0.00 -1.36 0.00 0.00 55.97 55.00 2otg s LYS 525 Cb 0.16 -1.98 -0.02 0.00 -1.68 0.00 0.00 37.83 34.30 2otg s LYS 525 CO 0.74 -1.28 0.80 -2.30 -0.76 0.00 0.00 175.35 172.54 2otg n PRO 526 N -3.16 -0.15 -1.02 -1.68 -0.02 -1.26 -1.82 135.00 125.88 2otg n PRO 526 Ca 0.07 0.79 -0.07 0.00 -2.02 0.00 0.00 63.50 62.27 2otg n PRO 526 Cb 0.58 -1.16 0.30 0.00 -0.02 0.00 0.00 33.50 33.19 2otg n PRO 526 CO 0.00 0.00 0.00 -1.33 1.98 0.00 0.00 175.50 176.15 2otg n MET 527 N -3.82 3.61 -2.27 -0.52 2.81 -1.26 -4.70 117.12 110.97 2otg n MET 527 Ca 0.01 -3.09 -0.26 0.00 -1.81 0.00 0.00 57.70 52.54 2otg n MET 527 Cb 0.09 -2.20 0.14 0.00 -0.71 0.00 0.00 33.22 30.54 2otg n MET 527 CO 0.00 0.00 0.00 0.20 1.51 0.00 0.00 175.97 177.68 2otg s GLY 528 N -1.11 1.76 0.00 3.03 0.00 -0.76 -4.79 107.32 105.46 2otg s GLY 528 Ca 0.55 -1.45 0.00 0.00 0.00 0.00 0.00 44.72 43.82 2otg s GLY 528 CO 0.13 -0.80 0.48 1.39 0.00 0.00 0.00 173.10 174.30 2otg n ILE 529 N -3.26 0.00 -0.28 0.90 5.41 -0.45 -1.21 119.36 120.48 2otg n ILE 529 Ca 0.15 0.85 0.10 0.00 1.00 0.00 0.00 62.75 64.84 2otg n ILE 529 Cb 0.60 -1.22 0.23 0.00 -0.71 0.00 0.00 39.64 38.54 2otg n ILE 529 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 2otg h LEU 530 N 0.00 -0.10 -0.78 1.39 3.38 -1.79 0.59 115.31 118.00 2otg h LEU 530 Ca 0.00 0.19 0.11 0.00 0.09 0.00 0.00 57.88 58.27 2otg h LEU 530 Cb 0.00 0.28 -0.08 0.00 0.09 0.00 0.00 40.66 40.95 2otg h LEU 530 CO 0.00 -0.14 0.40 -1.28 0.09 0.00 0.00 178.44 177.51 2otg h SER 531 N 0.19 0.52 -0.07 -0.43 0.87 -1.30 -0.37 113.55 112.95 2otg h SER 531 Ca 0.49 0.07 -0.15 0.00 -1.23 0.00 0.00 61.79 60.97 2otg h SER 531 Cb 0.93 -0.02 -0.01 0.00 -0.44 0.00 0.00 62.40 62.87 2otg h SER 531 CO -0.64 0.27 -0.48 0.40 -0.53 0.00 0.00 176.83 175.86 2otg h ILE 532 N 0.64 1.30 0.02 2.23 2.04 0.05 -1.04 117.51 122.75 2otg h ILE 532 Ca 0.39 -1.69 0.01 0.00 1.00 0.00 0.00 64.86 64.58 2otg h ILE 532 Cb 0.46 1.64 -0.01 0.00 -0.74 0.00 0.00 36.82 38.16 2otg h ILE 532 CO -0.30 0.53 -0.07 0.25 0.00 0.00 0.00 178.15 178.57 2otg h LEU 533 N 0.50 -0.19 -0.49 1.44 6.46 -0.67 0.69 115.31 123.05 2otg h LEU 533 Ca 0.03 0.03 0.08 0.00 -0.12 0.00 0.00 57.88 57.90 2otg h LEU 533 Cb 1.02 0.08 -0.07 0.00 -0.73 0.00 0.00 40.66 40.96 2otg h LEU 533 CO 0.10 -0.10 0.09 -0.33 -0.62 0.00 0.00 178.44 177.58 2otg h GLU 534 N -0.13 0.22 -0.07 1.25 5.08 -0.82 -2.01 114.58 118.10 2otg h GLU 534 Ca 0.02 -0.01 -0.14 0.00 -1.00 0.00 0.00 59.36 58.23 2otg h GLU 534 Cb 0.15 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.34 2otg h GLU 534 CO -0.06 0.15 -0.57 1.49 -1.00 0.00 0.00 179.01 179.01 2otg h GLU 535 N 0.23 0.23 -0.02 2.33 4.81 -0.73 -3.17 114.58 118.27 2otg h GLU 535 Ca 0.25 -0.15 0.00 0.00 -0.13 0.00 0.00 59.36 59.33 2otg h GLU 535 Cb 0.33 0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.73 2otg h GLU 535 CO -0.33 0.74 0.00 -1.91 -0.73 0.00 0.00 179.01 176.78 2otg n GLU 536 N -3.89 1.11 -0.04 1.92 4.07 0.24 -3.69 120.64 120.35 2otg n GLU 536 Ca -0.02 -0.16 -0.14 0.00 -0.06 0.00 0.00 57.16 56.78 2otg n GLU 536 Cb 0.60 -1.39 -0.14 0.00 -0.06 0.00 0.00 31.44 30.45 2otg n GLU 536 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 2otg n MET 538 N -3.15 0.68 -4.33 0.00 -0.00 -1.24 -4.56 117.12 104.52 2otg n MET 538 Ca -0.28 0.00 -0.34 0.00 -0.00 0.00 0.00 57.70 57.09 2otg n MET 538 Cb 1.06 -1.12 -0.15 0.00 -0.00 0.00 0.00 33.22 33.02 2otg n MET 538 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 175.97 175.91 2otg s PHE 539 N -1.65 2.85 0.09 3.17 0.40 -1.26 -5.04 117.98 116.54 2otg s PHE 539 Ca 0.00 -0.98 -0.26 0.00 -0.60 0.00 0.00 56.93 55.09 2otg s PHE 539 Cb 0.00 -1.95 -0.15 0.00 0.51 0.00 0.00 43.02 41.42 2otg s PHE 539 CO 0.00 -0.47 1.71 -1.35 0.70 0.00 0.00 175.22 175.80 2otg h PRO 540 N 7.49 -0.24 -1.96 0.24 0.11 -1.91 -3.24 132.00 132.48 2otg h PRO 540 Ca -0.36 0.02 -0.44 0.00 0.11 0.00 0.00 66.00 65.34 2otg h PRO 540 Cb 1.18 0.06 -0.16 0.00 0.11 0.00 0.00 31.00 32.19 2otg h PRO 540 CO 0.59 -0.16 0.27 1.17 -0.21 0.00 0.00 178.00 179.66 2otg n LYS 541 N -5.21 2.28 -3.46 1.05 4.81 -1.26 -4.92 118.16 111.46 2otg n LYS 541 Ca -0.09 -2.07 -0.37 0.00 -0.87 0.00 0.00 58.31 54.92 2otg n LYS 541 Cb 0.13 -2.07 -0.07 0.00 0.02 0.00 0.00 35.03 33.04 2otg n LYS 541 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2otg s ALA 542 N -1.31 3.55 0.24 3.14 0.00 -1.23 -5.02 121.76 121.14 2otg s ALA 542 Ca 0.57 -0.40 0.06 0.00 0.00 0.00 0.00 51.96 52.19 2otg s ALA 542 Cb 0.36 -2.50 -0.03 0.00 0.00 0.00 0.00 23.12 20.95 2otg s ALA 542 CO -0.17 -0.00 0.27 0.34 0.00 0.00 0.00 175.76 176.20 2otg s ASP 543 N 0.62 5.90 0.60 0.00 -1.08 -1.26 -4.92 116.67 116.53 2otg s ASP 543 Ca 0.19 -0.09 0.30 0.00 -0.52 0.00 0.00 52.55 52.43 2otg s ASP 543 Cb -0.14 -1.63 1.78 0.00 -1.46 0.00 0.00 42.92 41.48 2otg s ASP 543 CO 0.06 -0.04 2.18 0.44 0.52 0.00 0.00 175.17 178.33 2otg h ASP 544 N 1.41 0.00 0.73 -0.34 3.32 -1.98 0.12 116.42 119.68 2otg h ASP 544 Ca -0.50 0.00 -0.20 0.00 0.02 0.00 0.00 57.03 56.35 2otg h ASP 544 Cb 1.23 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.75 2otg h ASP 544 CO 0.61 0.00 -1.39 0.11 -1.72 0.00 0.00 179.24 176.85 2otg h LYS 545 N 0.00 0.00 0.15 3.56 6.56 -1.96 -2.51 116.57 122.38 2otg h LYS 545 Ca 0.04 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.63 2otg h LYS 545 Cb 0.25 0.00 -0.01 0.00 -0.57 0.00 0.00 32.23 31.90 2otg h LYS 545 CO -0.00 0.39 -0.12 1.03 -2.06 0.00 0.00 179.45 178.69 2otg h SER 546 N 0.00 -0.32 -0.54 0.86 0.87 -1.16 0.44 113.55 113.70 2otg h SER 546 Ca -0.17 0.03 0.04 0.00 -1.23 0.00 0.00 61.79 60.46 2otg h SER 546 Cb 1.69 0.11 -0.04 0.00 -0.44 0.00 0.00 62.40 63.71 2otg h SER 546 CO 0.06 -0.20 0.29 0.15 -0.53 0.00 0.00 176.83 176.61 2otg h PHE 547 N -0.29 0.54 -0.43 2.24 3.57 -1.38 -1.31 116.94 119.87 2otg h PHE 547 Ca -0.00 0.02 -0.05 0.00 3.53 0.00 0.00 57.97 61.46 2otg h PHE 547 Cb 0.26 -0.16 -0.02 0.00 2.79 0.00 0.00 35.95 38.82 2otg h PHE 547 CO -0.11 0.27 0.04 0.37 -2.23 0.00 0.00 178.31 176.65 2otg h GLN 548 N 0.56 0.68 0.70 1.11 4.15 -1.14 -2.22 115.11 118.95 2otg h GLN 548 Ca 0.23 -0.15 -0.03 0.00 0.77 0.00 0.00 58.65 59.47 2otg h GLN 548 Cb 0.12 -0.10 0.01 0.00 0.21 0.00 0.00 27.48 27.72 2otg h GLN 548 CO -0.15 0.67 -0.33 -0.44 -1.93 0.00 0.00 178.83 176.64 2otg h ASP 549 N 0.65 -0.79 -0.02 -0.69 5.19 0.10 -2.25 116.42 118.61 2otg h ASP 549 Ca 0.14 0.02 -0.00 0.00 -0.62 0.00 0.00 57.03 56.57 2otg h ASP 549 Cb 0.34 0.20 -0.00 0.00 0.18 0.00 0.00 39.33 40.06 2otg h ASP 549 CO 0.01 -0.56 0.01 1.88 -3.12 0.00 0.00 179.24 177.46 2otg h TYR 550 N -0.95 0.03 0.00 4.55 -1.99 -1.41 -1.07 116.97 116.13 2otg h TYR 550 Ca -0.10 -0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.63 2otg h TYR 550 Cb 0.72 -0.01 0.00 0.00 2.00 0.00 0.00 36.73 39.44 2otg h TYR 550 CO -0.02 0.19 0.00 -1.13 -0.00 0.00 0.00 178.16 177.20 2otg n SER 551 N -4.99 0.00 -0.12 3.88 3.41 -0.84 0.31 113.62 115.27 2otg n SER 551 Ca -0.07 0.07 -0.18 0.00 -0.26 0.00 0.00 58.87 58.42 2otg n SER 551 Cb 0.11 -0.10 -0.11 0.00 -0.26 0.00 0.00 64.21 63.85 2otg n SER 551 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 2otg n TYR 552 N -1.10 0.00 0.31 7.33 4.02 -0.85 -4.04 117.16 122.83 2otg n TYR 552 Ca 0.01 0.00 -0.16 0.00 -0.01 0.00 0.00 57.90 57.73 2otg n TYR 552 Cb 0.01 -0.93 -0.09 0.00 -0.02 0.00 0.00 39.34 38.31 2otg n TYR 552 CO 0.00 0.00 0.00 1.96 -1.01 0.00 0.00 176.86 177.81 2otg h GLN 553 N -0.12 -0.93 0.00 -0.72 4.20 0.11 -1.45 115.11 116.21 2otg h GLN 553 Ca -0.56 0.06 0.00 0.00 0.06 0.00 0.00 58.65 58.22 2otg h GLN 553 Cb 1.81 0.21 0.00 0.00 0.30 0.00 0.00 27.48 29.80 2otg h GLN 553 CO -0.12 -0.62 0.00 -0.91 -0.67 0.00 0.00 178.83 176.51 2otg h ASN 554 N -0.96 0.00 0.00 1.46 2.35 -0.98 -3.41 115.58 114.03 2otg h ASN 554 Ca -0.07 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.68 2otg h ASN 554 Cb 0.80 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.17 2otg h ASN 554 CO 0.01 0.00 -0.11 1.41 -1.65 0.00 0.00 177.43 177.09 2otg n HIS 555 N -2.37 0.00 -2.03 1.19 8.25 -1.12 -4.91 115.22 114.23 2otg n HIS 555 Ca 0.01 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.05 2otg n HIS 555 Cb 0.19 0.06 -0.03 0.00 1.12 0.00 0.00 29.99 31.34 2otg n HIS 555 CO 0.00 0.00 0.00 -1.50 0.64 0.00 0.00 176.34 175.48 2otg s ILE 556 N -1.24 3.55 0.00 1.59 2.07 -0.56 -1.14 121.20 125.47 2otg s ILE 556 Ca 0.00 0.74 0.00 0.00 -1.41 0.00 0.00 60.65 59.98 2otg s ILE 556 Cb 0.00 -3.48 0.00 0.00 0.13 0.00 0.00 42.46 39.11 2otg s ILE 556 CO 0.00 -0.05 0.00 0.61 -1.91 0.00 0.00 174.94 173.59 2otg n GLY 557 N 4.05 0.57 0.00 1.50 0.00 -1.26 -4.83 105.19 105.21 2otg n GLY 557 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 2otg n GLY 557 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2otg n LYS 558 N -1.94 1.71 -4.00 1.61 3.00 -0.29 -5.06 118.16 113.19 2otg n LYS 558 Ca 0.00 0.00 -0.31 0.00 -0.00 0.00 0.00 58.31 58.00 2otg n LYS 558 Cb 0.00 -0.83 -0.06 0.00 0.00 0.00 0.00 35.03 34.14 2otg n LYS 558 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.40 178.61 2otg s ASN 559 N -2.81 5.85 -0.06 3.14 3.84 -0.49 -4.99 114.94 119.42 2otg s ASN 559 Ca 0.00 0.11 -0.09 0.00 0.21 0.00 0.00 52.86 53.08 2otg s ASN 559 Cb 0.00 -1.67 -0.29 0.00 -0.55 0.00 0.00 41.25 38.73 2otg s ASN 559 CO 0.00 0.18 0.60 0.08 -2.79 0.00 0.00 177.10 175.17 2otg h ARG 560 N 3.27 0.36 0.00 0.43 0.11 -1.97 -3.32 114.38 113.26 2otg h ARG 560 Ca -0.46 -0.61 0.00 0.00 0.10 0.00 0.00 59.98 59.01 2otg h ARG 560 Cb 1.16 0.23 0.00 0.00 1.11 0.00 0.00 29.97 32.47 2otg h ARG 560 CO 0.69 1.28 0.00 -1.33 0.10 0.00 0.00 179.97 180.72 2otg n MET 561 N -3.55 0.70 -3.84 0.08 2.81 -1.26 -4.57 117.12 107.49 2otg n MET 561 Ca -0.26 0.00 -0.26 0.00 -1.81 0.00 0.00 57.70 55.36 2otg n MET 561 Cb 1.07 -1.42 -0.17 0.00 -0.71 0.00 0.00 33.22 31.99 2otg n MET 561 CO 0.00 0.00 0.00 0.12 1.51 0.00 0.00 175.97 177.60 2otg s PHE 562 N -2.00 1.28 0.00 2.03 5.36 -1.25 -2.60 117.98 120.81 2otg s PHE 562 Ca 0.29 -0.73 0.00 0.00 -0.96 0.00 0.00 56.93 55.52 2otg s PHE 562 Cb 0.13 -1.12 -0.00 0.00 -0.34 0.00 0.00 43.02 41.69 2otg s PHE 562 CO 0.22 -0.52 0.00 0.25 -1.46 0.00 0.00 175.22 173.71 2otg n THR 563 N 4.99 0.00 -3.30 0.12 -2.24 -1.02 -4.60 114.28 108.23 2otg n THR 563 Ca -0.10 -0.03 -0.24 0.00 -2.27 0.00 0.00 64.05 61.41 2otg n THR 563 Cb 0.49 0.01 -0.01 0.00 -2.10 0.00 0.00 70.33 68.72 2otg n THR 563 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2otg s LYS 564 N -2.01 3.46 0.49 -0.78 1.02 -1.26 -1.42 119.74 119.23 2otg s LYS 564 Ca 0.00 -0.31 -0.21 0.00 0.02 0.00 0.00 55.97 55.47 2otg s LYS 564 Cb 0.00 -2.63 -0.09 0.00 -0.52 0.00 0.00 37.83 34.58 2otg s LYS 564 CO 0.00 0.09 0.83 -2.30 -0.92 0.00 0.00 175.35 173.06 2otg n PRO 565 N -1.84 0.96 -2.71 -1.68 -0.02 -1.26 -4.51 135.00 123.94 2otg n PRO 565 Ca -0.04 0.36 -0.10 0.00 -2.02 0.00 0.00 63.50 61.70 2otg n PRO 565 Cb 0.56 -1.92 -0.02 0.00 -0.02 0.00 0.00 33.50 32.10 2otg n PRO 565 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2otg n GLY 566 N 1.42 3.74 3.69 -1.23 0.00 -1.26 -5.05 105.19 106.49 2otg n GLY 566 Ca 0.11 -2.25 -0.42 0.00 0.00 0.00 0.00 46.02 43.46 2otg n GLY 566 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2otg s LYS 567 N -2.62 4.27 -0.35 1.61 2.36 -1.26 -4.91 119.74 118.84 2otg s LYS 567 Ca 0.02 2.07 -0.44 0.00 -2.55 0.00 0.00 55.97 55.07 2otg s LYS 567 Cb -0.00 -3.51 -0.19 0.00 -1.05 0.00 0.00 37.83 33.08 2otg s LYS 567 CO 0.02 -0.58 1.56 -2.30 1.55 0.00 0.00 175.35 175.60 2otg n PRO 568 N 5.13 0.36 0.05 4.03 -0.02 -1.26 -4.93 135.00 138.36 2otg n PRO 568 Ca 0.13 0.13 -0.20 0.00 -2.02 0.00 0.00 63.50 61.55 2otg n PRO 568 Cb 0.43 -1.69 -0.13 0.00 -0.02 0.00 0.00 33.50 32.09 2otg n PRO 568 CO 0.00 0.00 0.00 1.15 1.98 0.00 0.00 175.50 178.63 2otg h THR 569 N 4.74 1.43 -2.19 3.45 2.02 -2.00 -3.47 112.91 116.89 2otg h THR 569 Ca -0.46 -2.38 -0.56 0.00 0.77 0.00 0.00 66.41 63.79 2otg h THR 569 Cb 1.36 2.91 -0.13 0.00 -1.74 0.00 0.00 68.15 70.55 2otg h THR 569 CO 0.93 0.69 -0.60 -0.13 0.37 0.00 0.00 175.52 176.78 2otg s ARG 570 N -2.79 1.83 0.41 6.66 1.81 -1.26 -5.12 118.95 120.48 2otg s ARG 570 Ca -0.12 -2.04 -0.24 0.00 -1.72 0.00 0.00 55.73 51.61 2otg s ARG 570 Cb 0.03 -1.23 -0.09 0.00 -0.45 0.00 0.00 34.95 33.21 2otg s ARG 570 CO 0.85 -0.15 1.06 -2.14 -0.68 0.00 0.00 175.30 174.25 2otg s PRO 571 N -3.80 4.11 -0.22 3.54 0.02 -1.26 -3.48 135.00 133.90 2otg s PRO 571 Ca 0.34 1.53 0.00 0.00 0.02 0.00 0.00 61.00 62.89 2otg s PRO 571 Cb 0.09 -2.50 0.00 0.00 0.02 0.00 0.00 34.50 32.10 2otg s PRO 571 CO 0.16 -0.20 0.00 -1.71 -0.33 0.00 0.00 177.00 174.92 2otg n ASN 572 N -0.16 -3.32 -4.60 2.53 4.05 -1.26 -4.95 115.26 107.56 2otg n ASN 572 Ca 0.05 0.05 -0.45 0.00 0.45 0.00 0.00 54.58 54.68 2otg n ASN 572 Cb 0.50 -1.00 -0.04 0.00 1.23 0.00 0.00 39.78 40.46 2otg n ASN 572 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 2otg n GLN 573 N -2.85 1.98 0.00 1.20 6.02 -1.23 -4.73 117.38 117.78 2otg n GLN 573 Ca -0.02 0.63 0.00 0.00 -0.01 0.00 0.00 57.00 57.59 2otg n GLN 573 Cb 0.08 -2.93 0.00 0.00 1.02 0.00 0.00 30.24 28.41 2otg n GLN 573 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2otg n GLY 574 N 5.45 -3.52 3.78 1.08 0.00 -0.60 -5.00 105.19 106.37 2otg n GLY 574 Ca 0.29 -1.25 -0.29 0.00 0.00 0.00 0.00 46.02 44.77 2otg n GLY 574 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2otg s HIS 575 N -0.80 2.18 -0.10 1.61 2.46 -1.26 -4.94 115.29 114.45 2otg s HIS 575 Ca 0.00 0.76 -0.30 0.00 0.47 0.00 0.00 55.06 55.99 2otg s HIS 575 Cb 0.00 -3.47 0.12 0.00 -0.13 0.00 0.00 32.58 29.10 2otg s HIS 575 CO 0.00 -2.58 0.98 0.00 -2.47 0.00 0.00 174.74 170.67 2otg s ALA 576 N -3.30 -1.91 -0.05 1.58 0.00 -1.26 -4.62 121.76 112.20 2otg s ALA 576 Ca 0.66 1.33 0.06 0.00 0.00 0.00 0.00 51.96 54.01 2otg s ALA 576 Cb -0.13 -0.12 -0.08 0.00 0.00 0.00 0.00 23.12 22.78 2otg s ALA 576 CO 0.54 -0.52 0.04 0.72 0.00 0.00 0.00 175.76 176.54 2otg n HIS 577 N 0.16 0.00 -3.48 0.00 8.25 0.66 -4.93 115.22 115.88 2otg n HIS 577 Ca -0.08 0.00 -0.12 0.00 -0.26 0.00 0.00 57.72 57.26 2otg n HIS 577 Cb 0.60 -0.29 -0.03 0.00 1.12 0.00 0.00 29.99 31.38 2otg n HIS 577 CO 0.00 0.00 0.00 -0.59 0.64 0.00 0.00 176.34 176.39 2otg s PHE 578 N -2.21 -0.49 -0.00 4.41 -0.12 -1.22 -4.62 117.98 113.74 2otg s PHE 578 Ca -0.03 0.50 0.02 0.00 -0.05 0.00 0.00 56.93 57.37 2otg s PHE 578 Cb 0.02 0.51 -0.04 0.00 -0.63 0.00 0.00 43.02 42.89 2otg s PHE 578 CO 0.27 -0.65 -0.00 -1.21 -0.05 0.00 0.00 175.22 173.58 2otg s GLU 579 N -2.70 2.77 -0.12 1.99 2.02 -0.51 -2.36 118.70 119.80 2otg s GLU 579 Ca -0.01 -0.62 0.03 0.00 0.02 0.00 0.00 54.97 54.39 2otg s GLU 579 Cb -0.01 -2.66 0.01 0.00 0.10 0.00 0.00 34.13 31.57 2otg s GLU 579 CO -0.05 0.62 -0.22 -1.17 0.02 0.00 0.00 175.26 174.46 2otg s LEU 580 N -1.55 2.05 -1.27 1.80 2.96 -0.88 -2.43 118.68 119.36 2otg s LEU 580 Ca 0.19 -0.56 -0.13 0.00 -0.22 0.00 0.00 54.13 53.41 2otg s LEU 580 Cb -0.11 -1.38 0.14 0.00 0.50 0.00 0.00 46.19 45.34 2otg s LEU 580 CO 0.10 0.11 1.70 1.41 -1.32 0.00 0.00 176.35 178.35 2otg n HIS 581 N 3.84 4.18 -1.47 5.38 8.25 -1.07 -0.28 115.22 134.05 2otg n HIS 581 Ca -0.20 -3.07 -0.30 0.00 -0.26 0.00 0.00 57.72 53.90 2otg n HIS 581 Cb 0.52 -2.23 0.21 0.00 1.12 0.00 0.00 29.99 29.61 2otg n HIS 581 CO 0.00 0.00 0.00 -1.01 0.64 0.00 0.00 176.34 175.97 2otg s HIS 582 N 1.83 1.13 -0.81 4.41 3.76 -0.73 -4.87 115.29 120.02 2otg s HIS 582 Ca 0.44 0.46 0.21 0.00 -0.15 0.00 0.00 55.06 56.02 2otg s HIS 582 Cb 0.04 -3.72 0.85 0.00 1.11 0.00 0.00 32.58 30.86 2otg s HIS 582 CO 0.01 -3.24 1.65 2.48 -0.85 0.00 0.00 174.74 174.79 2otg n TYR 583 N -4.26 0.36 -0.40 1.40 0.18 -1.26 -2.60 117.16 110.56 2otg n TYR 583 Ca 0.13 0.13 0.06 0.00 1.88 0.00 0.00 57.90 60.11 2otg n TYR 583 Cb 0.59 -0.71 0.18 0.00 -0.38 0.00 0.00 39.34 39.03 2otg n TYR 583 CO 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 176.86 174.78 2otg n ALA 584 N -1.62 2.41 0.00 -3.48 0.00 -1.26 -5.04 120.51 111.52 2otg n ALA 584 Ca 0.04 -1.47 0.00 0.00 0.00 0.00 0.00 53.44 52.01 2otg n ALA 584 Cb 0.24 -0.51 0.00 0.00 0.00 0.00 0.00 19.45 19.18 2otg n ALA 584 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2otg n GLY 585 N 0.21 2.61 3.59 0.00 0.00 -1.07 -4.84 105.19 105.70 2otg n GLY 585 Ca 0.14 -2.03 -0.43 0.00 0.00 0.00 0.00 46.02 43.70 2otg n GLY 585 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2otg s ASN 586 N 0.00 6.58 -0.26 1.61 -0.87 -1.26 -1.77 114.94 118.97 2otg s ASN 586 Ca 0.00 0.34 -0.10 0.00 -1.57 0.00 0.00 52.86 51.53 2otg s ASN 586 Cb 0.00 -2.53 -0.05 0.00 -0.02 0.00 0.00 41.25 38.65 2otg s ASN 586 CO 0.00 -1.25 0.16 -0.69 -2.57 0.00 0.00 177.10 172.75 2otg s VAL 587 N 4.40 5.20 -0.36 1.60 1.01 0.61 -4.84 120.40 128.03 2otg s VAL 587 Ca 0.45 0.13 -0.29 0.00 0.00 0.00 0.00 61.98 62.27 2otg s VAL 587 Cb -0.08 -3.45 0.01 0.00 0.00 0.00 0.00 36.38 32.86 2otg s VAL 587 CO 0.30 0.30 1.25 -2.84 0.00 0.00 0.00 175.10 174.11 2otg s PRO 588 N 1.46 3.84 0.09 2.72 0.02 -1.26 -2.08 135.00 139.79 2otg s PRO 588 Ca 0.07 1.02 0.04 0.00 0.02 0.00 0.00 61.00 62.15 2otg s PRO 588 Cb -0.15 -3.89 -0.04 0.00 0.02 0.00 0.00 34.50 30.45 2otg s PRO 588 CO 0.08 -1.21 0.03 0.71 -0.33 0.00 0.00 177.00 176.27 2otg s TYR 589 N 4.45 3.05 -0.19 6.54 2.02 -0.99 -4.04 117.35 128.18 2otg s TYR 589 Ca 0.53 0.00 0.01 0.00 -0.37 0.00 0.00 57.07 57.25 2otg s TYR 589 Cb -0.13 -1.56 0.04 0.00 -0.40 0.00 0.00 41.96 39.91 2otg s TYR 589 CO 0.25 0.50 -0.11 0.45 -1.57 0.00 0.00 175.55 175.07 2otg s SER 590 N -2.38 3.33 -0.08 2.29 0.15 -0.79 -0.25 113.70 115.96 2otg s SER 590 Ca 0.27 -0.85 0.02 0.00 0.70 0.00 0.00 55.95 56.09 2otg s SER 590 Cb -0.12 -1.23 0.18 0.00 -1.71 0.00 0.00 66.02 63.15 2otg s SER 590 CO 0.20 -0.14 1.02 2.30 1.20 0.00 0.00 173.24 177.82 2otg n ILE 591 N 4.69 1.12 -2.23 6.45 -6.64 -1.26 -4.50 119.36 116.99 2otg n ILE 591 Ca -0.15 -0.41 -0.43 0.00 -1.77 0.00 0.00 62.75 60.00 2otg n ILE 591 Cb 0.47 -0.66 -0.02 0.00 -1.44 0.00 0.00 39.64 37.98 2otg n ILE 591 CO 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 176.55 174.78 2otg s ALA 592 N -1.12 3.48 0.00 -1.28 0.00 -1.26 -2.92 121.76 118.67 2otg s ALA 592 Ca 0.14 0.51 0.00 0.00 0.00 0.00 0.00 51.96 52.61 2otg s ALA 592 Cb 0.11 -3.75 0.00 0.00 0.00 0.00 0.00 23.12 19.48 2otg s ALA 592 CO 0.03 -1.57 0.00 0.41 0.00 0.00 0.00 175.76 174.64 2otg n GLY 593 N 4.17 1.90 0.41 0.00 0.00 -1.26 -4.90 105.19 105.50 2otg n GLY 593 Ca 0.16 0.00 0.17 0.00 0.00 0.00 0.00 46.02 46.35 2otg n GLY 593 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 173.32 174.81 2otg h TRP 594 N 0.00 0.00 0.00 1.61 4.06 -1.88 0.79 115.95 120.53 2otg h TRP 594 Ca 0.00 0.00 -0.12 0.00 2.06 0.00 0.00 58.89 60.83 2otg h TRP 594 Cb 0.00 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 28.14 2otg h TRP 594 CO 0.00 0.00 -0.57 -0.07 -3.56 0.00 0.00 178.44 174.24 2otg h LEU 595 N 0.00 0.00 0.02 -4.49 4.07 -1.91 -3.13 115.31 109.88 2otg h LEU 595 Ca 0.20 0.00 -0.28 0.00 0.08 0.00 0.00 57.88 57.87 2otg h LEU 595 Cb 1.80 0.00 -0.04 0.00 1.08 0.00 0.00 40.66 43.50 2otg h LEU 595 CO -0.00 0.57 -1.58 0.44 -1.08 0.00 0.00 178.44 176.80 2otg h ASP 596 N 0.00 0.08 0.78 -0.43 3.32 0.27 -3.32 116.42 117.12 2otg h ASP 596 Ca -0.01 -0.14 0.00 0.00 0.02 0.00 0.00 57.03 56.90 2otg h ASP 596 Cb 1.26 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 40.78 2otg h ASP 596 CO 0.07 1.12 0.00 0.29 -1.72 0.00 0.00 179.24 179.01 2otg n LYS 597 N -3.19 0.08 -0.13 3.56 5.02 -0.93 -3.96 118.16 118.60 2otg n LYS 597 Ca -0.15 0.07 -0.23 0.00 -2.02 0.00 0.00 58.31 55.98 2otg n LYS 597 Cb 1.03 -1.50 -0.11 0.00 -0.02 0.00 0.00 35.03 34.43 2otg n LYS 597 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 2otg n ASN 598 N -1.46 1.97 -4.87 4.39 4.05 -1.18 -4.95 115.26 113.22 2otg n ASN 598 Ca 0.07 0.08 -0.37 0.00 0.45 0.00 0.00 54.58 54.82 2otg n ASN 598 Cb 0.27 -0.61 -0.06 0.00 1.23 0.00 0.00 39.78 40.62 2otg n ASN 598 CO 0.00 0.00 0.00 -1.59 -3.05 0.00 0.00 177.26 172.62 2otg s LYS 599 N -2.51 3.58 -0.35 1.20 -2.85 -1.25 -3.32 119.74 114.24 2otg s LYS 599 Ca -0.36 0.02 -0.09 0.00 -1.00 0.00 0.00 55.97 54.53 2otg s LYS 599 Cb 0.12 -3.19 0.02 0.00 -2.06 0.00 0.00 37.83 32.72 2otg s LYS 599 CO 0.56 0.74 0.16 0.34 0.10 0.00 0.00 175.35 177.25 2otg s ASP 600 N -1.11 5.55 -0.03 0.03 2.15 -1.26 -4.82 116.67 117.19 2otg s ASP 600 Ca 0.19 -0.93 -0.30 0.00 0.43 0.00 0.00 52.55 51.94 2otg s ASP 600 Cb -0.13 -1.97 -0.03 0.00 -0.30 0.00 0.00 42.92 40.48 2otg s ASP 600 CO 0.08 -0.33 1.15 -2.84 -0.17 0.00 0.00 175.17 173.06 2otg s PRO 601 N 1.52 4.41 -0.14 4.34 0.02 -1.26 -5.01 135.00 138.88 2otg s PRO 601 Ca 0.02 1.63 -0.07 0.00 0.02 0.00 0.00 61.00 62.60 2otg s PRO 601 Cb -0.19 -3.49 0.06 0.00 0.02 0.00 0.00 34.50 30.90 2otg s PRO 601 CO 0.05 -0.33 0.33 -1.50 -0.33 0.00 0.00 177.00 175.22 2otg s ILE 602 N 1.76 -0.20 -0.87 2.83 -1.16 -1.26 -4.81 121.20 117.49 2otg s ILE 602 Ca 0.55 0.16 -0.32 0.00 -0.51 0.00 0.00 60.65 60.54 2otg s ILE 602 Cb -0.24 -0.51 -0.19 0.00 0.61 0.00 0.00 42.46 42.12 2otg s ILE 602 CO 0.24 0.07 2.60 0.59 -2.81 0.00 0.00 174.94 175.62 2otg n ASN 603 N 4.65 0.66 0.20 4.50 4.13 -1.26 -4.74 115.26 123.40 2otg n ASN 603 Ca -0.18 0.13 0.18 0.00 1.68 0.00 0.00 54.58 56.40 2otg n ASN 603 Cb 0.52 -1.02 0.80 0.00 -1.54 0.00 0.00 39.78 38.55 2otg n ASN 603 CO 0.00 0.00 0.00 -0.33 0.28 0.00 0.00 177.26 177.21 2otg h GLU 604 N 12.80 0.00 0.02 3.52 3.07 -1.98 0.35 114.58 132.36 2otg h GLU 604 Ca -0.09 0.00 -0.03 0.00 -0.50 0.00 0.00 59.36 58.74 2otg h GLU 604 Cb 1.31 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.23 2otg h GLU 604 CO 1.32 0.00 -0.15 -0.97 -1.40 0.00 0.00 179.01 177.82 2otg h ASN 605 N 0.00 0.10 -0.57 1.42 -0.73 -1.85 -3.21 115.58 110.74 2otg h ASN 605 Ca 0.11 -0.92 0.02 0.00 1.87 0.00 0.00 56.30 57.37 2otg h ASN 605 Cb 0.78 -0.03 -0.03 0.00 0.27 0.00 0.00 38.32 39.31 2otg h ASN 605 CO -0.00 1.01 0.37 0.58 -0.37 0.00 0.00 177.43 179.02 2otg h VAL 606 N -0.80 1.12 -0.00 2.57 2.07 -1.29 -2.81 116.25 117.10 2otg h VAL 606 Ca -0.02 -0.25 -0.00 0.00 0.82 0.00 0.00 66.70 67.25 2otg h VAL 606 Cb 1.05 0.33 -0.00 0.00 -1.52 0.00 0.00 31.29 31.15 2otg h VAL 606 CO 0.03 0.13 0.00 0.58 0.02 0.00 0.00 177.57 178.33 2otg h VAL 607 N 0.73 1.06 -0.95 2.57 2.07 -1.37 -2.32 116.25 118.03 2otg h VAL 607 Ca 0.21 -0.16 0.11 0.00 0.82 0.00 0.00 66.70 67.68 2otg h VAL 607 Cb -0.02 1.16 -0.08 0.00 -1.52 0.00 0.00 31.29 30.82 2otg h VAL 607 CO -0.05 0.04 0.58 0.77 0.02 0.00 0.00 177.57 178.93 2otg h SER 608 N -0.06 0.85 -0.50 0.57 4.64 -1.50 0.56 113.55 118.12 2otg h SER 608 Ca 0.00 0.05 -0.05 0.00 -0.47 0.00 0.00 61.79 61.32 2otg h SER 608 Cb 0.07 -0.12 -0.03 0.00 -0.31 0.00 0.00 62.40 62.01 2otg h SER 608 CO -0.00 0.47 0.13 -0.07 -0.87 0.00 0.00 176.83 176.49 2otg h LEU 609 N 0.94 0.79 0.00 5.97 3.38 -1.24 -2.23 115.31 122.92 2otg h LEU 609 Ca 0.46 -0.14 -0.19 0.00 0.09 0.00 0.00 57.88 58.10 2otg h LEU 609 Cb 0.44 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.95 2otg h LEU 609 CO -0.26 0.77 -0.94 -0.07 0.09 0.00 0.00 178.44 178.04 2otg h LEU 610 N 0.81 0.00 -0.72 1.67 3.38 -0.82 -2.92 115.31 116.72 2otg h LEU 610 Ca 0.18 0.00 0.08 0.00 0.09 0.00 0.00 57.88 58.23 2otg h LEU 610 Cb 0.30 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 40.98 2otg h LEU 610 CO -0.00 0.86 0.39 0.00 0.09 0.00 0.00 178.44 179.77 2otg h ALA 611 N 1.14 0.98 -0.38 1.53 0.00 0.57 0.84 119.26 123.95 2otg h ALA 611 Ca -0.03 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2otg h ALA 611 Cb 1.68 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.37 2otg h ALA 611 CO 0.11 0.04 0.00 0.28 0.00 0.00 0.00 179.25 179.67 2otg n VAL 612 N -4.80 0.61 -0.72 0.00 0.31 -0.88 -4.67 118.33 108.19 2otg n VAL 612 Ca 0.10 -0.54 -0.32 0.00 -0.01 0.00 0.00 64.34 63.57 2otg n VAL 612 Cb 0.22 0.19 0.15 0.00 -0.91 0.00 0.00 33.84 33.50 2otg n VAL 612 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 2otg n SER 613 N 0.60 -1.82 -0.03 4.52 2.88 0.29 -4.96 113.62 115.10 2otg n SER 613 Ca 0.13 0.18 -0.11 0.00 -1.33 0.00 0.00 58.87 57.74 2otg n SER 613 Cb 0.37 -1.18 -0.14 0.00 -0.75 0.00 0.00 64.21 62.51 2otg n SER 613 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 2otg n LYS 614 N -2.39 0.66 -2.37 -1.46 5.02 -0.94 -4.66 118.16 112.02 2otg n LYS 614 Ca 0.06 0.26 -0.43 0.00 -2.02 0.00 0.00 58.31 56.17 2otg n LYS 614 Cb 0.56 -1.74 -0.02 0.00 -0.02 0.00 0.00 35.03 33.80 2otg n LYS 614 CO 0.00 0.00 0.00 -2.00 -0.52 0.00 0.00 177.40 174.88 2otg s GLU 615 N -2.58 3.96 0.23 1.97 2.12 -1.26 -4.91 118.70 118.24 2otg s GLU 615 Ca -0.09 1.39 0.03 0.00 0.36 0.00 0.00 54.97 56.66 2otg s GLU 615 Cb 0.08 -3.88 0.59 0.00 0.26 0.00 0.00 34.13 31.18 2otg s GLU 615 CO 0.81 -1.06 1.14 -2.30 -0.54 0.00 0.00 175.26 173.31 2otg n PRO 616 N 7.22 -0.06 0.30 4.30 -0.02 -1.26 -1.13 135.00 144.35 2otg n PRO 616 Ca 0.15 1.09 -0.12 0.00 -2.02 0.00 0.00 63.50 62.60 2otg n PRO 616 Cb 0.46 -1.74 -0.06 0.00 -0.02 0.00 0.00 33.50 32.14 2otg n PRO 616 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 2otg h LEU 617 N 0.00 -0.65 -0.74 2.45 5.85 -1.98 -0.24 115.31 120.00 2otg h LEU 617 Ca 0.46 0.02 0.14 0.00 0.84 0.00 0.00 57.88 59.34 2otg h LEU 617 Cb 0.97 0.17 -0.14 0.00 0.37 0.00 0.00 40.66 42.03 2otg h LEU 617 CO -0.68 -0.42 -0.22 0.58 -0.34 0.00 0.00 178.44 177.36 2otg h VAL 618 N -0.86 0.22 -0.57 1.05 2.07 -1.48 0.42 116.25 117.11 2otg h VAL 618 Ca -0.08 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.47 2otg h VAL 618 Cb 0.59 0.22 -0.04 0.00 -1.52 0.00 0.00 31.29 30.55 2otg h VAL 618 CO 0.13 0.00 0.35 0.00 0.02 0.00 0.00 177.57 178.07 2otg h ALA 619 N 1.63 0.73 0.00 1.67 0.00 -1.22 -1.41 119.26 120.66 2otg h ALA 619 Ca 0.34 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 55.18 2otg h ALA 619 Cb 0.55 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 2otg h ALA 619 CO -0.77 0.08 -0.28 1.49 0.00 0.00 0.00 179.25 179.77 2otg h GLU 620 N 0.69 0.00 0.00 0.00 4.81 0.13 -2.68 114.58 117.53 2otg h GLU 620 Ca 0.23 0.00 -0.07 0.00 -0.13 0.00 0.00 59.36 59.39 2otg h GLU 620 Cb 0.01 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.38 2otg h GLU 620 CO -0.09 0.28 -0.32 -0.07 -0.73 0.00 0.00 179.01 178.08 2otg h LEU 621 N 0.00 0.00 -4.56 1.64 3.38 0.72 -3.34 115.31 113.15 2otg h LEU 621 Ca -0.00 0.00 -0.58 0.00 0.09 0.00 0.00 57.88 57.39 2otg h LEU 621 Cb 0.64 0.00 -0.42 0.00 0.09 0.00 0.00 40.66 40.97 2otg h LEU 621 CO 0.04 0.32 -0.75 0.49 0.09 0.00 0.00 178.44 178.62 2otg n PHE 622 N -3.40 3.34 -2.63 1.13 3.01 -0.84 -5.00 117.46 113.06 2otg n PHE 622 Ca 0.00 -3.13 0.00 0.00 1.01 0.00 0.00 57.45 55.33 2otg n PHE 622 Cb 0.51 -0.10 0.00 0.00 -0.01 0.00 0.00 39.48 39.87 2otg n PHE 622 CO 0.00 0.00 0.00 0.54 1.01 0.00 0.00 176.76 178.31 2otg n ARG 623 N -0.45 2.74 -4.62 -1.08 1.74 -1.23 -4.04 116.66 109.72 2otg n ARG 623 Ca 0.37 0.00 -0.28 0.00 -0.77 0.00 0.00 57.85 57.17 2otg n ARG 623 Cb 0.66 0.00 -0.09 0.00 -1.02 0.00 0.00 32.46 32.01 2otg n ARG 623 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2otg s ALA 624 N -2.00 3.34 0.00 7.54 0.00 -1.26 -5.12 121.76 124.26 2otg s ALA 624 Ca 0.00 -1.30 0.00 0.00 0.00 0.00 0.00 51.96 50.66 2otg s ALA 624 Cb 0.00 0.32 0.00 0.00 0.00 0.00 0.00 23.12 23.44 2otg s ALA 624 CO 0.00 -0.16 0.00 -0.35 0.00 0.00 0.00 175.76 175.25 2otg n PRO 625 N -1.02 0.00 -0.16 0.00 -0.04 -1.26 -5.23 135.00 127.28 2otg n PRO 625 Ca -0.10 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.36 2otg n PRO 625 Cb 0.66 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.12 2otg n PRO 625 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2otg n ASP 626 N 0.00 0.00 0.00 3.54 8.00 -1.26 -5.37 116.55 121.46 2otg n ASP 626 Ca 0.00 -1.04 0.00 0.00 0.71 0.00 0.00 54.79 54.46 2otg n ASP 626 Cb 0.00 -0.01 0.00 0.00 -0.02 0.00 0.00 41.12 41.09 2otg n ASP 626 CO 0.00 0.00 0.00 1.67 -0.39 0.00 0.00 177.20 178.48 2otg n GLN 643 N 0.00 0.00 -0.60 -1.24 -0.06 -1.26 -5.35 117.38 108.87 2otg n GLN 643 Ca 0.00 0.00 -0.30 0.00 -2.00 0.00 0.00 57.00 54.70 2otg n GLN 643 Cb 0.51 0.00 0.20 0.00 -4.06 0.00 0.00 30.24 26.89 2otg n GLN 643 CO 0.00 0.00 0.00 -2.37 -0.20 0.00 0.00 177.06 174.49 2otg n THR 644 N 0.00 0.00 0.00 1.69 5.66 -1.26 -4.83 114.28 115.54 2otg n THR 644 Ca 0.00 -0.24 0.00 0.00 -3.05 0.00 0.00 64.05 60.76 2otg n THR 644 Cb 0.00 -0.91 0.00 0.00 -1.55 0.00 0.00 70.33 67.87 2otg n THR 644 CO 0.00 0.00 0.00 -0.38 -3.05 0.00 0.00 175.07 171.64 2otg n ILE 645 N -4.52 0.00 -0.50 1.09 5.41 -1.21 -1.10 119.36 118.54 2otg n ILE 645 Ca 0.06 0.90 0.41 0.00 1.00 0.00 0.00 62.75 65.13 2otg n ILE 645 Cb 0.54 -1.87 0.73 0.00 -0.71 0.00 0.00 39.64 38.33 2otg n ILE 645 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 176.55 177.32 2otg h SER 646 N 0.00 0.11 0.10 4.38 4.64 -1.95 2.26 113.55 123.10 2otg h SER 646 Ca 0.00 0.05 -0.18 0.00 -0.47 0.00 0.00 61.79 61.19 2otg h SER 646 Cb 0.00 0.04 -0.00 0.00 -0.31 0.00 0.00 62.40 62.13 2otg h SER 646 CO 0.00 -0.05 -0.68 0.00 -0.87 0.00 0.00 176.83 175.23 2otg h ALA 647 N 1.35 0.57 0.80 5.18 0.00 -1.96 -2.21 119.26 122.99 2otg h ALA 647 Ca 0.78 -0.57 -0.04 0.00 0.00 0.00 0.00 54.91 55.08 2otg h ALA 647 Cb 2.84 -0.06 0.01 0.00 0.00 0.00 0.00 17.79 20.58 2otg h ALA 647 CO -0.16 0.72 -0.38 0.28 0.00 0.00 0.00 179.25 179.71 2otg h VAL 648 N 0.38 0.03 -0.90 0.00 2.07 0.54 -3.05 116.25 115.31 2otg h VAL 648 Ca -0.02 -0.20 0.12 0.00 0.82 0.00 0.00 66.70 67.41 2otg h VAL 648 Cb 1.25 0.04 -0.08 0.00 -1.52 0.00 0.00 31.29 30.98 2otg h VAL 648 CO 0.12 0.00 0.53 -0.74 0.02 0.00 0.00 177.57 177.50 2otg h HIS 649 N -1.27 0.95 0.00 1.57 6.17 -1.23 0.16 115.15 121.49 2otg h HIS 649 Ca -0.11 0.03 0.00 0.00 0.71 0.00 0.00 60.37 61.00 2otg h HIS 649 Cb 0.83 -0.29 0.00 0.00 2.52 0.00 0.00 27.41 30.47 2otg h HIS 649 CO -0.00 0.35 0.00 -0.09 0.71 0.00 0.00 177.93 178.90 2otg h ARG 650 N 0.83 0.00 0.14 5.26 2.43 -1.44 -0.23 114.38 121.37 2otg h ARG 650 Ca 0.45 0.00 -0.30 0.00 -0.81 0.00 0.00 59.98 59.32 2otg h ARG 650 Cb 0.48 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.03 2otg h ARG 650 CO -0.28 0.00 -1.48 1.49 -1.51 0.00 0.00 179.97 178.19 2otg h GLU 651 N 0.00 0.30 0.00 0.20 4.57 -0.61 -3.18 114.58 115.87 2otg h GLU 651 Ca 0.00 -0.52 0.00 0.00 -1.18 0.00 0.00 59.36 57.66 2otg h GLU 651 Cb 0.35 0.19 0.00 0.00 -0.16 0.00 0.00 28.75 29.13 2otg h GLU 651 CO 0.00 1.25 0.00 0.66 -1.18 0.00 0.00 179.01 179.74 2otg h SER 652 N -0.17 0.00 0.02 1.04 4.64 -1.00 -2.72 113.55 115.37 2otg h SER 652 Ca -0.31 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.01 2otg h SER 652 Cb 1.87 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.96 2otg h SER 652 CO 0.11 0.00 -0.01 0.25 -0.87 0.00 0.00 176.83 176.31 2otg h LEU 653 N 0.00 -0.03 -2.11 5.97 6.46 -1.13 -2.01 115.31 122.46 2otg h LEU 653 Ca 0.00 -0.67 0.02 0.00 -0.12 0.00 0.00 57.88 57.11 2otg h LEU 653 Cb 0.52 0.01 -0.00 0.00 -0.73 0.00 0.00 40.66 40.45 2otg h LEU 653 CO 0.00 0.69 0.06 0.78 -0.62 0.00 0.00 178.44 179.35 2otg h ASN 654 N -0.78 0.00 0.44 1.25 2.35 -1.51 0.34 115.58 117.68 2otg h ASN 654 Ca -0.00 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 55.73 2otg h ASN 654 Cb 0.70 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.07 2otg h ASN 654 CO 0.01 0.00 -0.21 0.50 -1.65 0.00 0.00 177.43 176.08 2otg h LYS 655 N 0.00 -0.57 -0.65 0.81 3.64 -1.48 -1.87 116.57 116.46 2otg h LYS 655 Ca 0.04 0.04 0.13 0.00 -1.27 0.00 0.00 60.65 59.59 2otg h LYS 655 Cb 0.16 0.13 -0.12 0.00 -0.41 0.00 0.00 32.23 31.99 2otg h LYS 655 CO -0.00 -0.26 -0.17 1.25 -2.27 0.00 0.00 179.45 178.00 2otg h LEU 656 N -0.99 -0.61 -0.39 5.20 5.85 -0.47 -1.82 115.31 122.09 2otg h LEU 656 Ca -0.06 0.20 -0.02 0.00 0.84 0.00 0.00 57.88 58.84 2otg h LEU 656 Cb 0.56 0.41 -0.02 0.00 0.37 0.00 0.00 40.66 41.98 2otg h LEU 656 CO 0.10 -0.22 0.16 0.24 -0.34 0.00 0.00 178.44 178.38 2otg h MET 657 N -0.00 0.58 -0.68 1.25 2.86 -0.99 -0.53 114.93 117.42 2otg h MET 657 Ca 0.31 -0.10 0.14 0.00 -2.06 0.00 0.00 59.70 57.99 2otg h MET 657 Cb 0.48 -0.10 -0.10 0.00 0.06 0.00 0.00 31.60 31.94 2otg h MET 657 CO -0.67 0.54 0.14 0.00 1.06 0.00 0.00 176.91 177.98 2otg h ASN 659 N 0.25 0.13 -0.53 0.00 2.35 -0.98 -3.06 115.58 113.75 2otg h ASN 659 Ca 0.37 -0.07 -0.08 0.00 -0.55 0.00 0.00 56.30 55.97 2otg h ASN 659 Cb 0.60 -0.03 -0.02 0.00 0.05 0.00 0.00 38.32 38.92 2otg h ASN 659 CO -0.48 0.16 0.02 -0.07 -1.65 0.00 0.00 177.43 175.42 2otg h LEU 660 N 0.09 0.93 0.00 1.61 3.38 -0.22 -2.34 115.31 118.75 2otg h LEU 660 Ca 0.04 -0.24 0.00 0.00 0.09 0.00 0.00 57.88 57.76 2otg h LEU 660 Cb 0.06 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 40.56 2otg h LEU 660 CO -0.01 0.98 0.00 0.54 0.09 0.00 0.00 178.44 180.04 2otg n ARG 661 N -4.20 0.29 -1.47 1.13 5.12 0.44 -1.94 116.66 116.03 2otg n ARG 661 Ca 0.03 0.00 -0.08 0.00 -1.93 0.00 0.00 57.85 55.87 2otg n ARG 661 Cb 0.32 -1.47 0.10 0.00 -1.16 0.00 0.00 32.46 30.25 2otg n ARG 661 CO 0.00 0.00 0.00 0.54 -1.93 0.00 0.00 177.63 176.24 2otg n ARG 662 N -0.97 2.38 -4.08 5.56 5.12 -0.88 -5.05 116.66 118.74 2otg n ARG 662 Ca 0.06 -3.61 -0.13 0.00 -1.93 0.00 0.00 57.85 52.25 2otg n ARG 662 Cb 0.03 -1.79 -0.05 0.00 -1.16 0.00 0.00 32.46 29.49 2otg n ARG 662 CO 0.00 0.00 0.00 0.95 -1.93 0.00 0.00 177.63 176.65 2otg s THR 663 N -3.64 0.00 -0.38 0.55 -4.23 -0.82 -4.47 115.64 102.64 2otg s THR 663 Ca 0.43 -1.60 -0.12 0.00 -1.18 0.00 0.00 61.69 59.22 2otg s THR 663 Cb 0.39 -2.53 0.03 0.00 1.34 0.00 0.00 72.50 71.72 2otg s THR 663 CO -0.03 0.00 0.23 0.21 -0.54 0.00 0.00 174.62 174.49 2otg s ASN 664 N -3.18 5.82 1.04 3.99 2.47 0.22 -4.93 114.94 120.37 2otg s ASN 664 Ca 0.30 -1.00 -0.12 0.00 0.42 0.00 0.00 52.86 52.46 2otg s ASN 664 Cb 0.00 -2.05 0.21 0.00 -1.45 0.00 0.00 41.25 37.96 2otg s ASN 664 CO 0.17 -0.41 1.07 -2.84 -3.72 0.00 0.00 177.10 171.37 2otg s PRO 665 N 1.58 0.05 -0.25 0.43 0.02 -1.26 -2.24 135.00 133.32 2otg s PRO 665 Ca 0.03 0.78 -0.16 0.00 0.02 0.00 0.00 61.00 61.67 2otg s PRO 665 Cb -0.19 -1.67 0.07 0.00 0.02 0.00 0.00 34.50 32.73 2otg s PRO 665 CO 0.07 -3.06 0.62 -1.01 -0.33 0.00 0.00 177.00 173.30 2otg s HIS 666 N -2.73 -0.90 -0.03 6.54 3.76 -0.11 -4.80 115.29 117.01 2otg s HIS 666 Ca 0.66 1.88 0.07 0.00 -0.15 0.00 0.00 55.06 57.52 2otg s HIS 666 Cb -0.21 0.48 -0.01 0.00 1.11 0.00 0.00 32.58 33.94 2otg s HIS 666 CO 0.60 -0.45 -0.23 -0.06 -0.85 0.00 0.00 174.74 173.75 2otg s PHE 667 N 1.33 2.13 -0.10 1.40 0.40 -1.26 -0.15 117.98 121.73 2otg s PHE 667 Ca -0.08 -0.48 0.02 0.00 -0.60 0.00 0.00 56.93 55.79 2otg s PHE 667 Cb -0.06 -1.39 0.01 0.00 0.51 0.00 0.00 43.02 42.10 2otg s PHE 667 CO -0.14 -0.09 -0.15 0.08 0.70 0.00 0.00 175.22 175.61 2otg s VAL 668 N -0.39 1.47 -0.31 -0.44 1.01 -0.13 -1.83 120.40 119.78 2otg s VAL 668 Ca 0.05 -0.63 -0.05 0.00 0.00 0.00 0.00 61.98 61.34 2otg s VAL 668 Cb -0.10 -1.34 0.03 0.00 0.00 0.00 0.00 36.38 34.96 2otg s VAL 668 CO 0.01 0.43 0.06 -0.13 0.00 0.00 0.00 175.10 175.47 2otg s ARG 669 N 0.94 2.80 -0.10 2.72 1.81 0.42 -2.55 118.95 124.99 2otg s ARG 669 Ca -0.08 -1.04 -0.23 0.00 -1.72 0.00 0.00 55.73 52.66 2otg s ARG 669 Cb -0.15 -3.34 -0.03 0.00 -0.45 0.00 0.00 34.95 30.98 2otg s ARG 669 CO -0.01 -0.54 0.68 0.00 -0.68 0.00 0.00 175.30 174.75 2otg s ILE 671 N 1.05 1.17 -0.25 0.00 1.01 -0.80 -4.09 121.20 119.29 2otg s ILE 671 Ca 0.35 -0.48 -0.19 0.00 0.00 0.00 0.00 60.65 60.34 2otg s ILE 671 Cb -0.17 -1.08 -0.03 0.00 0.01 0.00 0.00 42.46 41.19 2otg s ILE 671 CO 0.16 0.37 0.55 -0.51 0.00 0.00 0.00 174.94 175.51 2otg s ILE 672 N 0.82 5.05 0.30 2.92 2.07 -1.26 -2.85 121.20 128.25 2otg s ILE 672 Ca -0.11 0.97 0.14 0.00 -1.41 0.00 0.00 60.65 60.24 2otg s ILE 672 Cb -0.15 -3.86 0.06 0.00 0.13 0.00 0.00 42.46 38.64 2otg s ILE 672 CO 0.02 0.08 1.74 1.55 -1.91 0.00 0.00 174.94 176.42 2otg h PRO 673 N 7.90 0.00 -2.84 3.50 0.13 -1.87 -3.42 132.00 135.39 2otg h PRO 673 Ca -0.29 0.00 0.08 0.00 -0.87 0.00 0.00 66.00 64.92 2otg h PRO 673 Cb 1.14 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.23 2otg h PRO 673 CO 0.74 0.45 0.31 0.54 -0.23 0.00 0.00 178.00 179.81 2otg s ASN 674 N -6.78 -0.16 -0.39 1.44 2.20 -1.26 -1.96 114.94 108.03 2otg s ASN 674 Ca -0.02 -0.71 0.05 0.00 -0.94 0.00 0.00 52.86 51.25 2otg s ASN 674 Cb 0.13 0.70 0.64 0.00 -2.00 0.00 0.00 41.25 40.72 2otg s ASN 674 CO 0.73 -1.32 1.83 0.18 -2.94 0.00 0.00 177.10 175.57 2otg n LEU 675 N -0.50 6.34 0.00 3.54 4.77 -1.26 -4.27 117.00 125.62 2otg n LEU 675 Ca -0.05 -3.37 0.00 0.00 -0.03 0.00 0.00 56.01 52.56 2otg n LEU 675 Cb 0.60 -0.80 0.00 0.00 -2.33 0.00 0.00 43.42 40.89 2otg n LEU 675 CO 0.18 0.96 0.23 -0.62 -1.33 0.00 0.00 177.39 176.80 2otg n GLU 676 N -0.82 0.42 -1.77 3.23 1.02 -1.26 -5.03 120.64 116.43 2otg n GLU 676 Ca 0.52 -0.54 -0.14 0.00 -0.02 0.00 0.00 57.16 56.98 2otg n GLU 676 Cb 1.54 -0.64 -0.04 0.00 -0.02 0.00 0.00 31.44 32.27 2otg n GLU 676 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 2otg n LYS 677 N -0.09 -1.60 -3.27 3.49 5.02 -1.26 -4.94 118.16 115.51 2otg n LYS 677 Ca 0.00 0.76 -0.38 0.00 -2.02 0.00 0.00 58.31 56.67 2otg n LYS 677 Cb 0.33 -5.15 -0.06 0.00 -0.02 0.00 0.00 35.03 30.14 2otg n LYS 677 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2otg s ASP 678 N -2.12 6.78 0.54 4.39 1.01 -1.26 -4.93 116.67 121.08 2otg s ASP 678 Ca 0.00 0.93 -0.19 0.00 0.71 0.00 0.00 52.55 54.01 2otg s ASP 678 Cb 0.00 -2.31 -0.06 0.00 1.01 0.00 0.00 42.92 41.55 2otg s ASP 678 CO 0.00 0.02 1.08 -2.84 0.21 0.00 0.00 175.17 173.64 2otg s PRO 679 N 0.41 3.49 0.00 8.23 0.02 -1.26 -3.46 135.00 142.42 2otg s PRO 679 Ca 0.28 1.42 0.00 0.00 0.02 0.00 0.00 61.00 62.73 2otg s PRO 679 Cb -0.16 -2.04 0.00 0.00 0.02 0.00 0.00 34.50 32.32 2otg s PRO 679 CO 0.13 -0.70 0.00 0.41 -0.33 0.00 0.00 177.00 176.51 2otg n GLY 680 N -0.25 1.61 3.71 0.52 0.00 -1.26 -4.97 105.19 104.55 2otg n GLY 680 Ca 0.10 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.72 2otg n GLY 680 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2otg s LEU 681 N 0.00 4.30 -0.04 0.99 2.96 -1.22 -4.82 118.68 120.84 2otg s LEU 681 Ca 0.00 1.13 0.07 0.00 -0.22 0.00 0.00 54.13 55.10 2otg s LEU 681 Cb 0.00 -3.03 -0.01 0.00 0.50 0.00 0.00 46.19 43.64 2otg s LEU 681 CO 0.00 -0.12 -0.25 -0.69 -1.32 0.00 0.00 176.35 173.97 2otg s VAL 682 N 0.89 2.03 -0.33 1.68 1.01 -1.26 -4.43 120.40 119.99 2otg s VAL 682 Ca 0.36 -1.07 0.01 0.00 0.00 0.00 0.00 61.98 61.27 2otg s VAL 682 Cb -0.17 -1.71 0.08 0.00 0.00 0.00 0.00 36.38 34.58 2otg s VAL 682 CO 0.17 0.57 0.05 -0.62 0.00 0.00 0.00 175.10 175.26 2otg s ASP 683 N -0.32 4.85 0.13 3.32 -1.08 -0.83 -5.03 116.67 117.72 2otg s ASP 683 Ca 0.01 -1.79 -0.29 0.00 -0.52 0.00 0.00 52.55 49.96 2otg s ASP 683 Cb -0.12 -1.68 -0.06 0.00 -1.46 0.00 0.00 42.92 39.60 2otg s ASP 683 CO 0.02 -0.36 1.58 0.00 0.52 0.00 0.00 175.17 176.93 2otg h ALA 684 N 7.83 -0.61 -0.85 3.66 0.00 -1.86 -1.55 119.26 125.88 2otg h ALA 684 Ca -0.13 -0.01 0.16 0.00 0.00 0.00 0.00 54.91 54.94 2otg h ALA 684 Cb 1.04 0.82 -0.06 0.00 0.00 0.00 0.00 17.79 19.59 2otg h ALA 684 CO 0.55 -0.94 0.56 1.49 0.00 0.00 0.00 179.25 180.91 2otg h GLU 685 N -0.49 0.51 0.39 0.00 4.81 -1.91 0.19 114.58 118.08 2otg h GLU 685 Ca 0.08 -0.03 -0.02 0.00 -0.13 0.00 0.00 59.36 59.26 2otg h GLU 685 Cb 0.63 -0.11 0.00 0.00 0.63 0.00 0.00 28.75 29.90 2otg h GLU 685 CO -0.42 0.33 -0.19 1.25 -0.73 0.00 0.00 179.01 179.26 2otg h LEU 686 N 0.52 -0.44 -0.03 1.64 5.85 -1.77 -2.09 115.31 118.99 2otg h LEU 686 Ca 0.43 -0.11 0.02 0.00 0.84 0.00 0.00 57.88 59.06 2otg h LEU 686 Cb 0.89 0.11 -0.02 0.00 0.37 0.00 0.00 40.66 42.01 2otg h LEU 686 CO -0.17 -0.01 -0.09 0.58 -0.34 0.00 0.00 178.44 178.42 2otg h VAL 687 N -1.01 0.77 -0.75 1.05 2.07 -1.01 -1.56 116.25 115.80 2otg h VAL 687 Ca -0.05 0.00 0.14 0.00 0.82 0.00 0.00 66.70 67.61 2otg h VAL 687 Cb 0.52 0.77 -0.10 0.00 -1.52 0.00 0.00 31.29 30.97 2otg h VAL 687 CO 0.09 0.00 0.30 -0.07 0.02 0.00 0.00 177.57 177.90 2otg h LEU 688 N -0.13 0.27 -0.55 2.57 3.38 -0.72 -0.57 115.31 119.57 2otg h LEU 688 Ca 0.05 0.11 0.01 0.00 0.09 0.00 0.00 57.88 58.14 2otg h LEU 688 Cb 0.19 0.09 -0.03 0.00 0.09 0.00 0.00 40.66 41.00 2otg h LEU 688 CO -0.11 0.10 0.35 -0.74 0.09 0.00 0.00 178.44 178.12 2otg h HIS 689 N 0.44 0.66 -0.05 1.13 2.76 -0.63 -2.15 115.15 117.29 2otg h HIS 689 Ca 0.41 0.02 -0.00 0.00 -2.20 0.00 0.00 60.37 58.60 2otg h HIS 689 Cb 0.63 -0.22 -0.00 0.00 1.55 0.00 0.00 27.41 29.37 2otg h HIS 689 CO -0.17 0.40 0.02 1.96 -1.30 0.00 0.00 177.93 178.84 2otg h GLN 690 N 0.70 0.08 -0.86 5.26 4.20 -0.33 -2.48 115.11 121.68 2otg h GLN 690 Ca 0.21 -0.01 0.23 0.00 0.06 0.00 0.00 58.65 59.13 2otg h GLN 690 Cb -0.04 -0.01 -0.05 0.00 0.30 0.00 0.00 27.48 27.68 2otg h GLN 690 CO -0.07 0.20 0.60 -0.07 -0.67 0.00 0.00 178.83 178.82 2otg h LEU 691 N -0.06 0.15 -0.73 1.46 3.38 -0.77 3.30 115.31 122.05 2otg h LEU 691 Ca 0.02 0.02 -0.12 0.00 0.09 0.00 0.00 57.88 57.88 2otg h LEU 691 Cb 0.15 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 2otg h LEU 691 CO -0.00 0.06 -0.33 -0.61 0.09 0.00 0.00 178.44 177.65 2otg h GLN 692 N 0.15 0.61 0.00 1.13 5.75 -0.94 -3.16 115.11 118.65 2otg h GLN 692 Ca 0.43 -0.28 0.00 0.00 -0.15 0.00 0.00 58.65 58.65 2otg h GLN 692 Cb 1.44 -0.01 0.00 0.00 1.07 0.00 0.00 27.48 29.98 2otg h GLN 692 CO -0.07 0.86 -0.97 0.00 -2.65 0.00 0.00 178.83 175.99 2otg h ASN 694 N 0.00 -0.87 0.00 0.00 -1.24 0.59 -3.43 115.58 110.63 2otg h ASN 694 Ca 0.00 0.06 0.00 0.00 0.71 0.00 0.00 56.30 57.07 2otg h ASN 694 Cb 0.41 0.28 0.00 0.00 0.73 0.00 0.00 38.32 39.73 2otg h ASN 694 CO 0.00 -0.50 0.00 0.61 -1.29 0.00 0.00 177.43 176.25 2otg n GLY 695 N -1.46 0.86 0.21 1.57 0.00 -1.24 -5.00 105.19 100.13 2otg n GLY 695 Ca -0.11 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.75 2otg n GLY 695 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 2otg h VAL 696 N 0.00 1.31 -0.36 1.61 -1.51 -1.92 -1.08 116.25 114.30 2otg h VAL 696 Ca 0.00 -1.82 -0.16 0.00 -1.23 0.00 0.00 66.70 63.50 2otg h VAL 696 Cb 0.00 1.96 -0.00 0.00 -2.13 0.00 0.00 31.29 31.11 2otg h VAL 696 CO 0.00 0.57 -0.39 -0.07 -1.23 0.00 0.00 177.57 176.45 2otg h LEU 697 N 0.40 0.97 -1.60 4.19 3.38 -1.89 -2.81 115.31 117.94 2otg h LEU 697 Ca -0.02 -0.48 -0.04 0.00 0.09 0.00 0.00 57.88 57.43 2otg h LEU 697 Cb 1.21 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.68 2otg h LEU 697 CO 0.12 1.25 -0.13 -0.08 0.09 0.00 0.00 178.44 179.69 2otg h GLU 698 N 0.71 0.09 -0.01 1.13 4.57 -1.80 -1.68 114.58 117.58 2otg h GLU 698 Ca 0.05 -0.02 0.00 0.00 -1.18 0.00 0.00 59.36 58.22 2otg h GLU 698 Cb 0.99 -0.01 0.00 0.00 -0.16 0.00 0.00 28.75 29.56 2otg h GLU 698 CO 0.10 0.23 -0.04 0.41 -1.18 0.00 0.00 179.01 178.53 2otg n GLY 699 N -1.04 -0.42 0.12 1.92 0.00 -0.41 -2.18 105.19 103.17 2otg n GLY 699 Ca -0.02 -0.36 -0.23 0.00 0.00 0.00 0.00 46.02 45.42 2otg n GLY 699 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2otg n ILE 700 N -0.33 1.52 -0.27 -0.61 5.41 -0.74 -3.46 119.36 120.88 2otg n ILE 700 Ca 0.19 -0.17 0.06 0.00 1.00 0.00 0.00 62.75 63.83 2otg n ILE 700 Cb 0.28 -2.04 0.30 0.00 -0.71 0.00 0.00 39.64 37.47 2otg n ILE 700 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 176.55 176.46 2otg h ARG 701 N -1.00 0.86 0.29 0.38 2.43 -1.42 0.11 114.38 116.04 2otg h ARG 701 Ca -0.45 -0.05 -0.01 0.00 -0.81 0.00 0.00 59.98 58.65 2otg h ARG 701 Cb 1.36 -0.19 0.00 0.00 -0.42 0.00 0.00 29.97 30.72 2otg h ARG 701 CO -0.27 0.57 -0.14 0.82 -1.51 0.00 0.00 179.97 179.44 2otg h ILE 702 N 0.89 0.73 0.00 1.20 1.08 -1.63 -2.78 117.51 117.00 2otg h ILE 702 Ca 0.39 -0.09 -0.00 0.00 -0.39 0.00 0.00 64.86 64.76 2otg h ILE 702 Cb 0.33 0.78 -0.00 0.00 -3.07 0.00 0.00 36.82 34.86 2otg h ILE 702 CO -0.15 0.02 -0.01 0.00 -0.69 0.00 0.00 178.15 177.32 2otg h ARG 704 N 0.00 1.15 -0.18 0.00 2.43 -0.53 -3.01 114.38 114.25 2otg h ARG 704 Ca -0.00 -0.26 0.05 0.00 -0.81 0.00 0.00 59.98 58.96 2otg h ARG 704 Cb 0.31 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 29.69 2otg h ARG 704 CO 0.00 0.99 0.46 0.87 -1.51 0.00 0.00 179.97 180.79 2otg h LYS 705 N 1.10 0.00 0.00 0.20 1.57 -1.49 -3.41 116.57 114.53 2otg h LYS 705 Ca 0.23 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.01 2otg h LYS 705 Cb 0.34 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.65 2otg h LYS 705 CO -0.00 0.00 0.00 0.41 -0.57 0.00 0.00 179.45 179.29 2otg n GLY 706 N -1.35 1.19 2.74 3.86 0.00 -1.14 -5.08 105.19 105.41 2otg n GLY 706 Ca 0.02 -0.18 -0.30 0.00 0.00 0.00 0.00 46.02 45.56 2otg n GLY 706 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2otg s PHE 707 N 4.07 1.93 0.00 1.61 0.08 -1.26 -4.67 117.98 119.75 2otg s PHE 707 Ca 0.00 -2.06 -0.01 0.00 0.12 0.00 0.00 56.93 54.97 2otg s PHE 707 Cb 0.00 -1.84 -0.01 0.00 -0.57 0.00 0.00 43.02 40.60 2otg s PHE 707 CO 0.00 -0.85 1.00 -1.35 -0.10 0.00 0.00 175.22 173.92 2otg h PRO 708 N 7.56 -0.05 -6.54 0.24 0.11 -1.63 -3.41 132.00 128.28 2otg h PRO 708 Ca -0.08 0.00 -0.53 0.00 0.11 0.00 0.00 66.00 65.51 2otg h PRO 708 Cb 0.98 0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.11 2otg h PRO 708 CO 0.47 -0.03 0.51 -1.54 -0.21 0.00 0.00 178.00 177.19 2otg s SER 709 N -2.10 7.18 0.09 -2.05 1.04 -1.23 -4.94 113.70 111.69 2otg s SER 709 Ca -0.01 2.01 0.02 0.00 0.48 0.00 0.00 55.95 58.45 2otg s SER 709 Cb 0.00 -2.59 -0.04 0.00 0.10 0.00 0.00 66.02 63.49 2otg s SER 709 CO 0.02 -0.35 -0.06 0.00 0.98 0.00 0.00 173.24 173.83 2otg s ARG 710 N 0.48 0.78 0.03 4.02 3.03 -1.26 -2.07 118.95 123.96 2otg s ARG 710 Ca 0.54 -1.26 -0.08 0.00 2.03 0.00 0.00 55.73 56.96 2otg s ARG 710 Cb -0.28 -0.19 0.00 0.00 -1.03 0.00 0.00 34.95 33.45 2otg s ARG 710 CO 0.31 -0.01 0.17 -0.51 -1.13 0.00 0.00 175.30 174.13 2otg s LEU 711 N -2.86 1.47 -0.12 -1.89 1.43 -1.01 -4.97 118.68 110.74 2otg s LEU 711 Ca 0.09 -0.37 -0.18 0.00 -1.03 0.00 0.00 54.13 52.64 2otg s LEU 711 Cb 0.04 0.86 -0.04 0.00 0.03 0.00 0.00 46.19 47.07 2otg s LEU 711 CO -0.04 -0.52 0.47 0.27 0.23 0.00 0.00 176.35 176.76 2otg s ILE 712 N -2.40 5.18 0.12 -0.59 -4.36 -1.26 0.16 121.20 118.05 2otg s ILE 712 Ca -0.06 0.95 -0.02 0.00 -0.26 0.00 0.00 60.65 61.25 2otg s ILE 712 Cb -0.02 -3.81 0.18 0.00 1.25 0.00 0.00 42.46 40.06 2otg s ILE 712 CO -0.03 0.33 0.62 -1.22 0.24 0.00 0.00 174.94 174.88 2otg n TYR 713 N 3.63 0.18 -0.24 1.37 4.01 -1.17 0.31 117.16 125.24 2otg n TYR 713 Ca -0.07 0.48 0.04 0.00 -0.16 0.00 0.00 57.90 58.19 2otg n TYR 713 Cb 0.52 -0.75 0.16 0.00 -0.31 0.00 0.00 39.34 38.95 2otg n TYR 713 CO 0.00 0.00 0.00 0.77 -0.46 0.00 0.00 176.86 177.17 2otg h SER 714 N 0.00 -0.10 -0.06 7.72 0.02 -1.86 -1.59 113.55 117.68 2otg h SER 714 Ca 0.21 0.15 -0.06 0.00 -0.84 0.00 0.00 61.79 61.25 2otg h SER 714 Cb 0.35 0.23 0.00 0.00 0.14 0.00 0.00 62.40 63.12 2otg h SER 714 CO -0.40 -0.07 -0.20 -0.33 -1.14 0.00 0.00 176.83 174.69 2otg h GLU 715 N 0.21 0.24 -0.77 3.45 5.08 -0.54 -3.16 114.58 119.09 2otg h GLU 715 Ca 0.39 -0.18 0.15 0.00 -1.00 0.00 0.00 59.36 58.72 2otg h GLU 715 Cb 0.66 0.03 -0.15 0.00 0.50 0.00 0.00 28.75 29.79 2otg h GLU 715 CO -0.53 0.81 -0.23 0.35 -1.00 0.00 0.00 179.01 178.42 2otg h PHE 716 N -0.29 -0.52 0.29 4.33 3.57 -1.12 0.25 116.94 123.45 2otg h PHE 716 Ca -0.01 0.07 -0.01 0.00 3.53 0.00 0.00 57.97 61.55 2otg h PHE 716 Cb 0.84 0.35 0.00 0.00 2.79 0.00 0.00 35.95 39.93 2otg h PHE 716 CO 0.13 -0.35 -0.14 1.57 -2.23 0.00 0.00 178.31 177.29 2otg h LYS 717 N -0.02 -0.38 -0.61 1.11 2.10 -1.39 0.19 116.57 117.57 2otg h LYS 717 Ca 0.36 0.03 0.10 0.00 -2.00 0.00 0.00 60.65 59.13 2otg h LYS 717 Cb 0.57 0.09 -0.04 0.00 -0.90 0.00 0.00 32.23 31.95 2otg h LYS 717 CO -0.80 -0.24 0.41 0.37 -2.00 0.00 0.00 179.45 177.18 2otg h GLN 718 N -0.40 0.39 0.13 0.07 4.15 -0.97 -2.19 115.11 116.29 2otg h GLN 718 Ca -0.04 -0.02 -0.31 0.00 0.77 0.00 0.00 58.65 59.05 2otg h GLN 718 Cb 0.31 -0.09 -0.00 0.00 0.21 0.00 0.00 27.48 27.91 2otg h GLN 718 CO 0.07 0.26 -1.54 -0.09 -1.93 0.00 0.00 178.83 175.59 2otg h ARG 719 N 0.40 0.28 -0.15 1.69 9.65 -0.02 -3.40 114.38 122.83 2otg h ARG 719 Ca 0.28 -0.48 -0.11 0.00 -1.10 0.00 0.00 59.98 58.57 2otg h ARG 719 Cb 0.57 0.18 -0.09 0.00 -1.39 0.00 0.00 29.97 29.23 2otg h ARG 719 CO -0.08 1.16 -0.57 0.66 2.80 0.00 0.00 179.97 183.94 2otg n TYR 720 N -3.48 0.57 0.09 2.20 4.02 0.60 -4.60 117.16 116.56 2otg n TYR 720 Ca -0.17 -1.64 -0.05 0.00 -0.01 0.00 0.00 57.90 56.02 2otg n TYR 720 Cb 1.05 -0.27 -0.01 0.00 -0.02 0.00 0.00 39.34 40.09 2otg n TYR 720 CO 0.00 0.00 0.00 0.77 -1.01 0.00 0.00 176.86 176.62 2otg h SER 721 N 1.24 0.02 0.00 7.72 0.02 -1.60 -2.92 113.55 118.05 2otg h SER 721 Ca 0.07 -0.02 0.00 0.00 -0.84 0.00 0.00 61.79 61.00 2otg h SER 721 Cb 1.12 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 63.65 2otg h SER 721 CO 0.16 0.87 0.00 0.00 -1.14 0.00 0.00 176.83 176.72 2otg n ILE 722 N -3.54 0.00 0.33 3.27 3.06 -1.26 -2.50 119.36 118.72 2otg n ILE 722 Ca -0.01 0.00 0.04 0.00 -2.50 0.00 0.00 62.75 60.28 2otg n ILE 722 Cb 0.82 -0.36 -0.02 0.00 0.54 0.00 0.00 39.64 40.61 2otg n ILE 722 CO 0.00 0.00 0.00 0.18 -2.50 0.00 0.00 176.55 174.23 2otg n LEU 723 N 0.03 0.73 -2.69 9.51 4.77 -1.10 -4.80 117.00 123.45 2otg n LEU 723 Ca 0.00 -0.65 -0.05 0.00 -0.03 0.00 0.00 56.01 55.28 2otg n LEU 723 Cb 0.18 0.00 0.09 0.00 -2.33 0.00 0.00 43.42 41.36 2otg n LEU 723 CO 0.00 0.16 0.57 0.00 -1.33 0.00 0.00 177.39 176.79 2otg n ALA 724 N -0.68 -1.90 0.23 -1.18 0.00 -1.04 -4.90 120.51 111.03 2otg n ALA 724 Ca 0.02 -0.85 0.07 0.00 0.00 0.00 0.00 53.44 52.68 2otg n ALA 724 Cb 0.14 -2.06 0.54 0.00 0.00 0.00 0.00 19.45 18.07 2otg n ALA 724 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 2otg h PRO 725 N 2.34 0.00 -0.60 0.00 0.11 -1.84 -2.88 132.00 129.13 2otg h PRO 725 Ca -0.27 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.84 2otg h PRO 725 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 2otg h PRO 725 CO 0.02 0.18 0.00 0.09 -0.21 0.00 0.00 178.00 178.08 2otg n ASN 726 N -4.17 1.29 0.00 -2.05 3.02 -1.26 -2.74 115.26 109.35 2otg n ASN 726 Ca -0.02 -2.09 0.00 0.00 -0.03 0.00 0.00 54.58 52.44 2otg n ASN 726 Cb 0.25 -0.34 0.00 0.00 -0.61 0.00 0.00 39.78 39.08 2otg n ASN 726 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2otg n ALA 727 N -0.01 1.61 -2.61 5.41 0.00 -1.09 -5.03 120.51 118.80 2otg n ALA 727 Ca 0.04 -0.24 -0.39 0.00 0.00 0.00 0.00 53.44 52.85 2otg n ALA 727 Cb 0.28 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.64 2otg n ALA 727 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2otg s ILE 728 N -0.21 5.20 0.12 0.00 -1.09 -1.11 -5.00 121.20 119.11 2otg s ILE 728 Ca 0.00 0.53 -0.28 0.00 -2.23 0.00 0.00 60.65 58.66 2otg s ILE 728 Cb 0.00 -3.68 -0.08 0.00 -1.58 0.00 0.00 42.46 37.13 2otg s ILE 728 CO 0.00 0.18 1.61 -0.65 -1.23 0.00 0.00 174.94 174.86 2otg h PRO 729 N 8.08 -0.52 -3.88 2.79 0.11 -1.96 -3.50 132.00 133.12 2otg h PRO 729 Ca -0.33 0.04 -0.04 0.00 0.11 0.00 0.00 66.00 65.78 2otg h PRO 729 Cb 1.17 0.12 0.03 0.00 0.11 0.00 0.00 31.00 32.43 2otg h PRO 729 CO 0.64 -0.35 -0.15 0.94 -0.21 0.00 0.00 178.00 178.87 2otg n GLN 730 N -5.43 -0.64 0.00 1.05 7.27 -1.26 -5.22 117.38 113.15 2otg n GLN 730 Ca -0.06 0.60 0.00 0.00 0.07 0.00 0.00 57.00 57.61 2otg n GLN 730 Cb 0.34 -3.07 0.00 0.00 2.41 0.00 0.00 30.24 29.92 2otg n GLN 730 CO 0.00 0.00 0.00 -3.47 0.07 0.00 0.00 177.06 173.66 2otg n ASP 734 N -1.68 0.00 0.00 1.69 -0.08 -1.26 -5.31 116.55 109.90 2otg n ASP 734 Ca -0.01 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.27 2otg n ASP 734 Cb 0.52 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.98 2otg n ASP 734 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2otg n GLY 735 N 3.26 -0.23 0.08 0.27 0.00 -1.26 -4.86 105.19 102.45 2otg n GLY 735 Ca 0.00 0.03 -0.10 0.00 0.00 0.00 0.00 46.02 45.95 2otg n GLY 735 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2otg h LYS 736 N 0.00 0.05 0.75 1.61 3.64 -1.99 -3.28 116.57 117.35 2otg h LYS 736 Ca 0.00 -0.08 -0.04 0.00 -1.27 0.00 0.00 60.65 59.26 2otg h LYS 736 Cb 0.00 0.03 0.00 0.00 -0.41 0.00 0.00 32.23 31.85 2otg h LYS 736 CO 0.00 0.74 -0.41 1.15 -2.27 0.00 0.00 179.45 178.66 2otg h THR 737 N 0.01 0.00 -0.75 1.00 2.02 -1.98 0.35 112.91 113.56 2otg h THR 737 Ca -0.22 0.00 0.17 0.00 0.77 0.00 0.00 66.41 67.13 2otg h THR 737 Cb 1.96 0.00 -0.13 0.00 -1.74 0.00 0.00 68.15 68.24 2otg h THR 737 CO 0.10 0.00 0.05 0.58 0.37 0.00 0.00 175.52 176.62 2otg h VAL 738 N -1.06 0.37 -0.38 3.16 2.07 -1.89 0.26 116.25 118.77 2otg h VAL 738 Ca -0.10 -0.05 -0.00 0.00 0.82 0.00 0.00 66.70 67.37 2otg h VAL 738 Cb 0.83 0.23 -0.02 0.00 -1.52 0.00 0.00 31.29 30.81 2otg h VAL 738 CO 0.14 0.02 0.24 0.28 0.02 0.00 0.00 177.57 178.27 2otg h SER 739 N 0.13 0.46 0.22 0.57 0.02 -1.56 0.20 113.55 113.59 2otg h SER 739 Ca 0.42 -0.04 -0.03 0.00 -0.84 0.00 0.00 61.79 61.30 2otg h SER 739 Cb 0.74 -0.11 -0.00 0.00 0.14 0.00 0.00 62.40 63.16 2otg h SER 739 CO -0.63 0.36 -0.13 -0.33 -1.14 0.00 0.00 176.83 174.95 2otg h GLU 740 N 0.51 0.00 0.07 3.45 5.08 0.26 -1.12 114.58 122.83 2otg h GLU 740 Ca 0.14 0.00 -0.26 0.00 -1.00 0.00 0.00 59.36 58.24 2otg h GLU 740 Cb -0.02 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.24 2otg h GLU 740 CO -0.03 0.13 -1.11 -0.22 -1.00 0.00 0.00 179.01 176.79 2otg h LYS 741 N 0.00 0.46 -0.14 2.33 3.64 0.69 -1.46 116.57 122.10 2otg h LYS 741 Ca -0.00 -0.58 -0.06 0.00 -1.27 0.00 0.00 60.65 58.73 2otg h LYS 741 Cb 0.28 0.19 -0.00 0.00 -0.41 0.00 0.00 32.23 32.28 2otg h LYS 741 CO 0.02 1.23 -0.16 0.82 -2.27 0.00 0.00 179.45 179.08 2otg h ILE 742 N 0.22 1.36 0.24 2.00 2.04 -0.13 0.62 117.51 123.85 2otg h ILE 742 Ca -0.13 -1.35 -0.01 0.00 1.00 0.00 0.00 64.86 64.37 2otg h ILE 742 Cb 1.78 1.92 0.00 0.00 -0.74 0.00 0.00 36.82 39.78 2otg h ILE 742 CO 0.20 0.39 -0.11 -0.07 0.00 0.00 0.00 178.15 178.56 2otg h LEU 743 N -0.04 -0.27 -1.59 1.44 3.38 -1.30 0.89 115.31 117.82 2otg h LEU 743 Ca 0.02 -0.08 -0.04 0.00 0.09 0.00 0.00 57.88 57.87 2otg h LEU 743 Cb 0.70 0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.52 2otg h LEU 743 CO 0.04 -0.09 -0.19 0.74 0.09 0.00 0.00 178.44 179.03 2otg h THR 744 N -0.44 1.14 -0.43 0.22 2.02 -1.33 -2.27 112.91 111.82 2otg h THR 744 Ca -0.03 -0.68 -0.09 0.00 0.77 0.00 0.00 66.41 66.37 2otg h THR 744 Cb 0.33 1.35 -0.02 0.00 -1.74 0.00 0.00 68.15 68.08 2otg h THR 744 CO 0.05 0.20 -0.11 1.23 0.37 0.00 0.00 175.52 177.26 2otg h GLY 745 N 0.60 0.84 -1.08 2.16 0.00 -0.21 -2.35 103.07 103.04 2otg h GLY 745 Ca 0.00 -0.63 0.00 0.00 0.00 0.00 0.00 47.33 46.70 2otg h GLY 745 CO 0.03 0.58 0.00 1.04 0.00 0.00 0.00 176.54 178.19 2otg n LEU 746 N -4.17 1.55 -3.48 3.11 4.77 0.25 -4.88 117.00 114.16 2otg n LEU 746 Ca 0.01 -0.78 -0.25 0.00 -0.03 0.00 0.00 56.01 54.96 2otg n LEU 746 Cb 0.36 -0.23 0.03 0.00 -2.33 0.00 0.00 43.42 41.25 2otg n LEU 746 CO 0.43 0.35 0.07 0.00 -1.33 0.00 0.00 177.39 176.90 2otg n GLN 747 N 0.24 -5.25 -1.68 3.23 10.64 -0.88 -4.90 117.38 118.78 2otg n GLN 747 Ca 0.09 0.70 -0.44 0.00 -1.83 0.00 0.00 57.00 55.52 2otg n GLN 747 Cb 0.27 -5.57 -0.01 0.00 -0.86 0.00 0.00 30.24 24.07 2otg n GLN 747 CO 0.00 0.00 0.00 -1.33 -1.83 0.00 0.00 177.06 173.90 2otg n MET 748 N -4.33 2.00 -2.20 2.61 2.81 -0.89 -4.93 117.12 112.19 2otg n MET 748 Ca -0.02 0.71 -0.42 0.00 -1.81 0.00 0.00 57.70 56.16 2otg n MET 748 Cb 0.56 -2.29 -0.03 0.00 -0.71 0.00 0.00 33.22 30.75 2otg n MET 748 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 2otg s ASP 749 N -0.12 6.85 0.27 7.83 -1.08 -1.26 -4.93 116.67 124.23 2otg s ASP 749 Ca 0.60 2.27 -0.01 0.00 -0.52 0.00 0.00 52.55 54.90 2otg s ASP 749 Cb -0.61 -2.58 0.62 0.00 -1.46 0.00 0.00 42.92 38.88 2otg s ASP 749 CO 0.57 -0.64 1.66 -0.65 0.52 0.00 0.00 175.17 176.63 2otg h PRO 750 N 6.90 0.22 0.07 4.34 0.11 -1.91 -1.88 132.00 139.85 2otg h PRO 750 Ca -0.42 -0.01 -0.00 0.00 0.11 0.00 0.00 66.00 65.68 2otg h PRO 750 Cb 1.21 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.27 2otg h PRO 750 CO 0.86 0.15 -0.03 0.66 -0.21 0.00 0.00 178.00 179.43 2otg h SER 751 N 0.23 -0.08 -1.81 -2.05 4.64 -2.03 -3.13 113.55 109.33 2otg h SER 751 Ca 0.50 -0.23 0.52 0.00 -0.47 0.00 0.00 61.79 62.11 2otg h SER 751 Cb 0.96 0.02 -0.07 0.00 -0.31 0.00 0.00 62.40 63.00 2otg h SER 751 CO -0.61 0.19 1.36 -0.62 -0.87 0.00 0.00 176.83 176.28 2otg n GLU 752 N -5.01 0.00 -4.21 4.77 4.71 -0.71 -4.66 120.64 115.53 2otg n GLU 752 Ca -0.08 1.04 -0.18 0.00 -0.01 0.00 0.00 57.16 57.93 2otg n GLU 752 Cb 0.17 -2.43 -0.07 0.00 -1.01 0.00 0.00 31.44 28.11 2otg n GLU 752 CO 0.00 0.00 0.00 1.52 0.09 0.00 0.00 177.13 178.74 2otg s TYR 753 N -4.73 1.51 0.03 -0.32 1.13 -1.18 -1.43 117.35 112.37 2otg s TYR 753 Ca -0.05 -1.54 -0.21 0.00 -1.41 0.00 0.00 57.07 53.87 2otg s TYR 753 Cb 0.24 -0.49 0.04 0.00 -1.10 0.00 0.00 41.96 40.66 2otg s TYR 753 CO 0.81 -0.97 0.47 1.03 -2.51 0.00 0.00 175.55 174.38 2otg s ARG 754 N -3.29 0.96 -0.32 -3.49 1.81 0.13 -4.91 118.95 109.84 2otg s ARG 754 Ca 0.37 -0.24 -0.01 0.00 -1.72 0.00 0.00 55.73 54.13 2otg s ARG 754 Cb 0.01 0.43 0.06 0.00 -0.45 0.00 0.00 34.95 35.01 2otg s ARG 754 CO 0.25 -0.33 0.03 -0.51 -0.68 0.00 0.00 175.30 174.06 2otg s LEU 755 N -1.85 4.16 0.00 2.53 1.43 -1.26 -0.84 118.68 122.84 2otg s LEU 755 Ca -0.07 -1.47 -0.16 0.00 -1.03 0.00 0.00 54.13 51.40 2otg s LEU 755 Cb -0.01 -1.71 0.22 0.00 0.03 0.00 0.00 46.19 44.71 2otg s LEU 755 CO -0.00 -0.31 1.28 0.61 0.23 0.00 0.00 176.35 178.15 2otg n GLY 756 N 4.58 -1.43 0.34 -3.19 0.00 -0.32 -4.54 105.19 100.63 2otg n GLY 756 Ca -0.10 -1.72 0.13 0.00 0.00 0.00 0.00 46.02 44.33 2otg n GLY 756 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2otg n THR 757 N -3.75 0.00 0.00 2.61 -2.24 -0.94 -4.40 114.28 105.56 2otg n THR 757 Ca 0.16 -0.18 0.00 0.00 -2.27 0.00 0.00 64.05 61.76 2otg n THR 757 Cb 0.56 0.54 0.00 0.00 -2.10 0.00 0.00 70.33 69.33 2otg n THR 757 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 2otg n THR 758 N -0.37 0.00 -4.15 4.28 -2.24 -1.26 -5.09 114.28 105.46 2otg n THR 758 Ca 0.13 0.00 -0.11 0.00 -2.27 0.00 0.00 64.05 61.80 2otg n THR 758 Cb 0.37 -0.02 -0.09 0.00 -2.10 0.00 0.00 70.33 68.49 2otg n THR 758 CO 0.00 0.00 0.00 -1.59 -0.57 0.00 0.00 175.07 172.91 2otg s LYS 759 N -0.64 1.29 -0.12 -0.78 -2.85 -1.26 -3.02 119.74 112.35 2otg s LYS 759 Ca 0.00 -1.53 0.00 0.00 -1.00 0.00 0.00 55.97 53.44 2otg s LYS 759 Cb 0.00 0.32 -0.02 0.00 -2.06 0.00 0.00 37.83 36.07 2otg s LYS 759 CO 0.00 -0.45 -0.13 0.54 0.10 0.00 0.00 175.35 175.41 2otg s VAL 760 N -4.12 3.07 -0.17 1.79 0.11 0.42 -1.17 120.40 120.32 2otg s VAL 760 Ca 0.35 -0.66 -0.13 0.00 -2.93 0.00 0.00 61.98 58.60 2otg s VAL 760 Cb 0.05 -2.28 -0.05 0.00 -1.53 0.00 0.00 36.38 32.58 2otg s VAL 760 CO 0.11 0.53 0.28 -0.36 -3.33 0.00 0.00 175.10 172.33 2otg s PHE 761 N 0.23 3.44 0.13 1.54 0.40 -0.02 -2.41 117.98 121.28 2otg s PHE 761 Ca -0.08 0.55 0.09 0.00 -0.60 0.00 0.00 56.93 56.89 2otg s PHE 761 Cb -0.15 -2.34 -0.04 0.00 0.51 0.00 0.00 43.02 41.00 2otg s PHE 761 CO 0.05 0.20 -0.22 -0.06 0.70 0.00 0.00 175.22 175.89 2otg s PHE 762 N 0.59 1.97 1.03 0.36 0.08 -0.88 0.18 117.98 121.30 2otg s PHE 762 Ca 0.15 -0.41 -0.14 0.00 0.12 0.00 0.00 56.93 56.65 2otg s PHE 762 Cb -0.13 -1.05 0.20 0.00 -0.57 0.00 0.00 43.02 41.47 2otg s PHE 762 CO 0.04 0.29 1.12 0.15 -0.10 0.00 0.00 175.22 176.71 2otg s LYS 763 N -2.17 0.20 -0.09 0.44 -0.14 -0.51 -2.34 119.74 115.13 2otg s LYS 763 Ca 0.11 0.29 -0.30 0.00 -1.36 0.00 0.00 55.97 54.71 2otg s LYS 763 Cb -0.09 -1.73 -0.02 0.00 -1.68 0.00 0.00 37.83 34.31 2otg s LYS 763 CO 0.06 -2.83 1.10 0.00 -0.76 0.00 0.00 175.35 172.91 2otg s ALA 764 N -3.09 3.46 0.00 5.17 0.00 -1.26 -3.31 121.76 122.73 2otg s ALA 764 Ca 0.67 0.47 0.00 0.00 0.00 0.00 0.00 51.96 53.10 2otg s ALA 764 Cb -0.15 -3.48 0.00 0.00 0.00 0.00 0.00 23.12 19.49 2otg s ALA 764 CO 0.56 -0.71 0.00 0.41 0.00 0.00 0.00 175.76 176.02 2otg n GLY 765 N 3.23 1.35 0.41 0.00 0.00 -1.26 -4.96 105.19 103.95 2otg n GLY 765 Ca 0.10 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.96 2otg n GLY 765 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2otg h VAL 766 N 0.00 0.00 0.00 1.61 2.07 -1.94 -2.29 116.25 115.71 2otg h VAL 766 Ca 0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 2otg h VAL 766 Cb 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 29.77 2otg h VAL 766 CO 0.00 0.00 0.32 0.25 0.02 0.00 0.00 177.57 178.16 2otg h LEU 767 N -1.00 0.00 -0.22 2.57 5.85 -1.93 0.29 115.31 120.87 2otg h LEU 767 Ca -0.10 0.00 -0.18 0.00 0.84 0.00 0.00 57.88 58.45 2otg h LEU 767 Cb 0.78 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.81 2otg h LEU 767 CO 0.14 0.00 -0.55 1.23 -0.34 0.00 0.00 178.44 178.92 2otg h GLY 768 N 0.00 0.83 0.72 3.75 0.00 -1.74 -2.31 103.07 104.31 2otg h GLY 768 Ca 0.00 -1.03 -0.02 0.00 0.00 0.00 0.00 47.33 46.28 2otg h GLY 768 CO 0.00 0.92 -0.20 3.43 0.00 0.00 0.00 176.54 180.69 2otg h ASN 769 N 0.49 -0.48 0.00 0.19 -0.26 -0.29 -1.91 115.58 113.31 2otg h ASN 769 Ca -0.01 -0.10 0.00 0.00 -0.56 0.00 0.00 56.30 55.63 2otg h ASN 769 Cb 1.16 0.13 0.00 0.00 -1.06 0.00 0.00 38.32 38.55 2otg h ASN 769 CO 0.12 -0.14 0.49 -0.07 -1.06 0.00 0.00 177.43 176.77 2otg h LEU 770 N -0.86 0.00 0.23 1.61 3.38 -1.48 0.18 115.31 118.37 2otg h LEU 770 Ca -0.06 0.00 -0.34 0.00 0.09 0.00 0.00 57.88 57.57 2otg h LEU 770 Cb 0.56 0.00 0.03 0.00 0.09 0.00 0.00 40.66 41.33 2otg h LEU 770 CO 0.10 0.00 -1.59 -0.33 0.09 0.00 0.00 178.44 176.71 2otg h GLU 771 N 0.00 0.48 -0.11 1.13 4.39 -0.77 -2.72 114.58 116.99 2otg h GLU 771 Ca 0.00 -0.82 -0.15 0.00 0.34 0.00 0.00 59.36 58.72 2otg h GLU 771 Cb 0.99 0.31 0.01 0.00 -0.10 0.00 0.00 28.75 29.95 2otg h GLU 771 CO 0.00 1.39 -0.53 0.93 -1.16 0.00 0.00 179.01 179.64 2otg h GLU 772 N 0.13 0.55 -0.96 2.33 5.08 -0.25 -2.71 114.58 118.75 2otg h GLU 772 Ca -0.29 -0.45 0.22 0.00 -1.00 0.00 0.00 59.36 57.85 2otg h GLU 772 Cb 2.14 0.09 -0.08 0.00 0.50 0.00 0.00 28.75 31.41 2otg h GLU 772 CO 0.24 1.07 0.63 0.52 -1.00 0.00 0.00 179.01 180.47 2otg h MET 773 N 0.17 0.43 0.00 2.33 2.86 -1.23 0.82 114.93 120.30 2otg h MET 773 Ca -0.03 -0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.58 2otg h MET 773 Cb 1.17 -0.10 0.00 0.00 0.06 0.00 0.00 31.60 32.74 2otg h MET 773 CO 0.11 0.28 0.00 -0.09 1.06 0.00 0.00 176.91 178.27 2otg h ARG 774 N 0.44 0.00 0.12 1.72 2.43 -1.32 -2.98 114.38 114.79 2otg h ARG 774 Ca 0.52 0.00 -0.28 0.00 -0.81 0.00 0.00 59.98 59.41 2otg h ARG 774 Cb 1.26 0.00 0.03 0.00 -0.42 0.00 0.00 29.97 30.84 2otg h ARG 774 CO -0.23 0.00 -1.17 -0.44 -1.51 0.00 0.00 179.97 176.62 2otg h ASP 775 N 0.00 0.82 -0.21 -3.80 3.32 0.97 -2.95 116.42 114.58 2otg h ASP 775 Ca 0.00 -0.83 -0.05 0.00 0.02 0.00 0.00 57.03 56.16 2otg h ASP 775 Cb 0.91 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 40.20 2otg h ASP 775 CO 0.00 1.57 -0.08 -0.33 -1.72 0.00 0.00 179.24 178.68 2otg h GLU 776 N 0.18 0.43 -0.15 3.56 5.08 -1.55 -2.15 114.58 119.99 2otg h GLU 776 Ca -0.18 -0.18 -0.05 0.00 -1.00 0.00 0.00 59.36 57.95 2otg h GLU 776 Cb 1.86 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 31.08 2otg h GLU 776 CO 0.22 0.70 -0.13 0.00 -1.00 0.00 0.00 179.01 178.80 2otg h ARG 777 N 0.14 0.24 -0.12 2.33 2.47 -1.64 0.22 114.38 118.02 2otg h ARG 777 Ca 0.05 -0.05 -0.23 0.00 -1.26 0.00 0.00 59.98 58.48 2otg h ARG 777 Cb 0.56 -0.03 0.01 0.00 -1.65 0.00 0.00 29.97 28.86 2otg h ARG 777 CO 0.03 0.38 -0.84 1.25 0.56 0.00 0.00 179.97 181.35 2otg h LEU 778 N 0.23 0.94 0.33 3.04 5.85 -1.50 -2.42 115.31 121.77 2otg h LEU 778 Ca 0.05 -0.66 0.00 0.00 0.84 0.00 0.00 57.88 58.11 2otg h LEU 778 Cb 0.37 -0.28 -0.03 0.00 0.37 0.00 0.00 40.66 41.10 2otg h LEU 778 CO 0.02 1.45 -0.42 -1.28 -0.34 0.00 0.00 178.44 177.87 2otg h SER 779 N 0.50 -1.16 -0.31 1.25 0.87 -0.60 -1.35 113.55 112.74 2otg h SER 779 Ca -0.07 0.11 -0.02 0.00 -1.23 0.00 0.00 61.79 60.58 2otg h SER 779 Cb 1.47 0.40 -0.01 0.00 -0.44 0.00 0.00 62.40 63.82 2otg h SER 779 CO 0.17 -0.54 0.11 0.11 -0.53 0.00 0.00 176.83 176.15 2otg h LYS 780 N -0.79 0.47 -0.56 2.24 1.57 -0.67 -0.39 116.57 118.44 2otg h LYS 780 Ca -0.02 -0.09 0.11 0.00 -1.87 0.00 0.00 60.65 58.78 2otg h LYS 780 Cb 0.73 -0.07 -0.09 0.00 0.08 0.00 0.00 32.23 32.87 2otg h LYS 780 CO -0.12 0.49 -0.01 0.82 -0.57 0.00 0.00 179.45 180.07 2otg h ILE 781 N 0.35 0.54 0.53 1.86 2.04 -1.35 1.15 117.51 122.63 2otg h ILE 781 Ca 0.10 -0.04 -0.02 0.00 1.00 0.00 0.00 64.86 65.90 2otg h ILE 781 Cb 0.21 0.42 0.00 0.00 -0.74 0.00 0.00 36.82 36.71 2otg h ILE 781 CO -0.01 0.02 -0.28 0.40 0.00 0.00 0.00 178.15 178.28 2otg h ILE 782 N 0.11 0.43 -0.89 -0.67 2.04 -0.92 -0.05 117.51 117.57 2otg h ILE 782 Ca 0.29 0.00 0.23 0.00 1.00 0.00 0.00 64.86 66.37 2otg h ILE 782 Cb 0.45 0.43 -0.13 0.00 -0.74 0.00 0.00 36.82 36.82 2otg h ILE 782 CO -0.48 0.00 0.34 0.28 0.00 0.00 0.00 178.15 178.29 2otg h SER 783 N -0.75 0.22 -0.63 1.72 0.02 0.22 0.11 113.55 114.46 2otg h SER 783 Ca -0.07 0.17 -0.03 0.00 -0.84 0.00 0.00 61.79 61.02 2otg h SER 783 Cb 0.59 0.18 -0.03 0.00 0.14 0.00 0.00 62.40 63.28 2otg h SER 783 CO 0.10 -0.06 0.27 0.24 -1.14 0.00 0.00 176.83 176.24 2otg h MET 784 N 0.32 0.95 0.00 3.45 2.86 0.25 -0.30 114.93 122.47 2otg h MET 784 Ca 0.56 -0.15 -0.11 0.00 -2.06 0.00 0.00 59.70 57.94 2otg h MET 784 Cb 1.10 -0.17 -0.02 0.00 0.06 0.00 0.00 31.60 32.57 2otg h MET 784 CO -0.57 0.77 -0.52 0.35 1.06 0.00 0.00 176.91 178.00 2otg h PHE 785 N 0.94 0.00 -0.23 -0.22 3.57 0.99 -1.79 116.94 120.20 2otg h PHE 785 Ca 0.22 0.00 -0.14 0.00 3.53 0.00 0.00 57.97 61.59 2otg h PHE 785 Cb 0.17 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 38.90 2otg h PHE 785 CO 0.01 0.52 -0.42 1.96 -2.23 0.00 0.00 178.31 178.15 2otg h GLN 786 N 0.00 0.56 0.00 1.11 4.20 -0.60 -2.56 115.11 117.82 2otg h GLN 786 Ca -0.01 -0.29 -0.09 0.00 0.06 0.00 0.00 58.65 58.32 2otg h GLN 786 Cb 0.94 0.01 -0.01 0.00 0.30 0.00 0.00 27.48 28.71 2otg h GLN 786 CO 0.07 0.88 -0.45 0.00 -0.67 0.00 0.00 178.83 178.65 2otg h ALA 787 N 1.08 1.10 -0.05 3.87 0.00 -0.51 -1.43 119.26 123.34 2otg h ALA 787 Ca 0.04 -0.41 -0.19 0.00 0.00 0.00 0.00 54.91 54.34 2otg h ALA 787 Cb 0.93 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.64 2otg h ALA 787 CO 0.08 0.56 -0.80 1.25 0.00 0.00 0.00 179.25 180.35 2otg h HIS 788 N 0.00 0.51 -0.17 0.00 6.17 -1.12 -2.82 115.15 117.72 2otg h HIS 788 Ca -0.00 -0.24 -0.16 0.00 0.71 0.00 0.00 60.37 60.67 2otg h HIS 788 Cb 0.88 -0.07 0.00 0.00 2.52 0.00 0.00 27.41 30.74 2otg h HIS 788 CO 0.00 1.02 -0.51 0.82 0.71 0.00 0.00 177.93 179.97 2otg h ILE 789 N 0.23 1.32 -0.89 6.26 2.04 -1.20 -1.43 117.51 123.84 2otg h ILE 789 Ca -0.04 -1.76 -0.00 0.00 1.00 0.00 0.00 64.86 64.06 2otg h ILE 789 Cb 1.39 1.95 -0.04 0.00 -0.74 0.00 0.00 36.82 39.38 2otg h ILE 789 CO 0.13 0.55 0.56 0.03 0.00 0.00 0.00 178.15 179.42 2otg h ARG 790 N 0.33 1.20 -0.43 2.37 3.08 -1.27 -1.35 114.38 118.30 2otg h ARG 790 Ca -0.01 -0.10 -0.07 0.00 0.07 0.00 0.00 59.98 59.87 2otg h ARG 790 Cb 1.13 -0.26 -0.02 0.00 0.08 0.00 0.00 29.97 30.91 2otg h ARG 790 CO 0.11 0.82 0.01 0.78 -1.07 0.00 0.00 179.97 180.62 2otg h GLY 791 N 1.22 0.82 1.28 0.04 0.00 -1.40 -2.64 103.07 102.39 2otg h GLY 791 Ca 0.32 -0.60 0.05 0.00 0.00 0.00 0.00 47.33 47.10 2otg h GLY 791 CO -0.06 0.55 0.37 -1.82 0.00 0.00 0.00 176.54 175.58 2otg h TYR 792 N 0.60 0.57 -0.07 5.60 5.03 -0.64 -0.47 116.97 127.59 2otg h TYR 792 Ca 0.12 0.01 -0.02 0.00 2.58 0.00 0.00 58.73 61.43 2otg h TYR 792 Cb 0.48 -0.19 -0.00 0.00 1.55 0.00 0.00 36.73 38.56 2otg h TYR 792 CO 0.04 0.32 -0.04 -0.07 -1.32 0.00 0.00 178.16 177.09 2otg h LEU 793 N 0.58 0.16 -1.07 2.82 3.38 -0.96 -2.67 115.31 117.55 2otg h LEU 793 Ca 0.23 -0.42 -0.10 0.00 0.09 0.00 0.00 57.88 57.69 2otg h LEU 793 Cb 0.20 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 2otg h LEU 793 CO -0.06 0.54 -0.46 0.40 0.09 0.00 0.00 178.44 178.95 2otg h ILE 794 N -0.22 1.31 -0.09 1.22 2.04 -1.15 -2.28 117.51 118.34 2otg h ILE 794 Ca 0.02 -1.59 -0.14 0.00 1.00 0.00 0.00 64.86 64.15 2otg h ILE 794 Cb 0.48 1.86 -0.01 0.00 -0.74 0.00 0.00 36.82 38.41 2otg h ILE 794 CO 0.01 0.45 -0.56 0.03 0.00 0.00 0.00 178.15 178.08 2otg h ARG 795 N 0.00 0.28 -0.03 2.37 -0.00 -1.09 -0.76 114.38 115.16 2otg h ARG 795 Ca -0.00 -0.18 -0.02 0.00 -0.50 0.00 0.00 59.98 59.28 2otg h ARG 795 Cb 0.82 0.02 -0.00 0.00 0.00 0.00 0.00 29.97 30.82 2otg h ARG 795 CO 0.06 0.77 -0.04 -0.22 0.00 0.00 0.00 179.97 180.53 2otg h LYS 796 N 0.22 0.07 -0.04 0.04 1.63 -1.26 -3.16 116.57 114.06 2otg h LYS 796 Ca 0.00 -0.05 -0.03 0.00 -0.85 0.00 0.00 60.65 59.72 2otg h LYS 796 Cb 1.05 0.01 -0.01 0.00 -0.60 0.00 0.00 32.23 32.68 2otg h LYS 796 CO 0.09 0.61 -0.11 0.00 -3.45 0.00 0.00 179.45 176.58 2otg h ALA 797 N 0.47 1.74 -1.17 5.00 0.00 -1.38 -3.28 119.26 120.63 2otg h ALA 797 Ca 0.00 -0.13 0.39 0.00 0.00 0.00 0.00 54.91 55.17 2otg h ALA 797 Cb 0.60 -0.04 -0.11 0.00 0.00 0.00 0.00 17.79 18.25 2otg h ALA 797 CO 0.01 0.20 0.76 0.98 0.00 0.00 0.00 179.25 181.20 2otg n TYR 798 N -4.37 0.49 0.04 0.00 9.36 -0.30 -0.57 117.16 121.81 2otg n TYR 798 Ca -0.02 0.49 -0.18 0.00 3.32 0.00 0.00 57.90 61.52 2otg n TYR 798 Cb 0.21 -0.90 -0.08 0.00 -0.63 0.00 0.00 39.34 37.94 2otg n TYR 798 CO 0.00 0.00 0.00 -0.22 0.22 0.00 0.00 176.86 176.86 2otg h LYS 799 N 0.00 0.63 -0.39 2.98 3.64 -1.78 -2.88 116.57 118.76 2otg h LYS 799 Ca 0.71 -0.64 -0.05 0.00 -1.27 0.00 0.00 60.65 59.40 2otg h LYS 799 Cb 2.37 0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 34.35 2otg h LYS 799 CO -0.33 1.24 0.04 -0.22 -2.27 0.00 0.00 179.45 177.91 2otg h LYS 800 N 0.37 0.67 -0.95 1.90 3.64 -1.09 -1.79 116.57 119.32 2otg h LYS 800 Ca -0.10 -0.19 0.04 0.00 -1.27 0.00 0.00 60.65 59.13 2otg h LYS 800 Cb 1.61 -0.07 -0.06 0.00 -0.41 0.00 0.00 32.23 33.30 2otg h LYS 800 CO 0.18 0.74 0.62 -0.07 -2.27 0.00 0.00 179.45 178.65 2otg h LEU 801 N 0.50 1.02 -0.18 5.20 4.07 -1.52 0.57 115.31 124.96 2otg h LEU 801 Ca 0.12 -0.01 -0.02 0.00 0.08 0.00 0.00 57.88 58.05 2otg h LEU 801 Cb 0.41 -0.23 -0.01 0.00 1.08 0.00 0.00 40.66 41.92 2otg h LEU 801 CO 0.01 0.69 0.06 1.56 -1.08 0.00 0.00 178.44 179.68 2otg h GLN 802 N 1.18 0.29 0.24 1.13 4.20 -1.23 -2.57 115.11 118.35 2otg h GLN 802 Ca 0.38 -0.06 -0.01 0.00 0.06 0.00 0.00 58.65 59.02 2otg h GLN 802 Cb 0.04 -0.04 0.00 0.00 0.30 0.00 0.00 27.48 27.78 2otg h GLN 802 CO -0.12 0.40 -0.12 -0.44 -0.67 0.00 0.00 178.83 177.88 2otg h ASP 803 N 0.12 -0.27 -0.03 1.46 3.32 -0.74 -2.95 116.42 117.32 2otg h ASP 803 Ca 0.06 -0.22 0.01 0.00 0.02 0.00 0.00 57.03 56.90 2otg h ASP 803 Cb 0.23 0.07 -0.00 0.00 0.22 0.00 0.00 39.33 39.85 2otg h ASP 803 CO -0.00 0.10 0.51 1.56 -1.72 0.00 0.00 179.24 179.68 2otg h GLN 804 N -0.68 0.00 -0.07 3.56 4.20 0.12 0.72 115.11 122.95 2otg h GLN 804 Ca -0.03 0.00 -0.17 0.00 0.06 0.00 0.00 58.65 58.51 2otg h GLN 804 Cb 0.47 0.00 0.01 0.00 0.30 0.00 0.00 27.48 28.26 2otg h GLN 804 CO 0.05 0.00 -0.60 -0.09 -0.67 0.00 0.00 178.83 177.52 2otg h ARG 805 N 0.00 0.53 -0.13 1.46 2.43 -1.27 -1.80 114.38 115.60 2otg h ARG 805 Ca 0.02 -0.48 -0.07 0.00 -0.81 0.00 0.00 59.98 58.64 2otg h ARG 805 Cb 1.03 0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 30.68 2otg h ARG 805 CO -0.00 1.11 -0.24 0.82 -1.51 0.00 0.00 179.97 180.15 2otg h ILE 806 N 0.12 1.23 -0.22 1.20 2.04 -0.92 0.14 117.51 121.09 2otg h ILE 806 Ca -0.06 -1.06 -0.19 0.00 1.00 0.00 0.00 64.86 64.55 2otg h ILE 806 Cb 1.27 1.40 0.00 0.00 -0.74 0.00 0.00 36.82 38.75 2otg h ILE 806 CO 0.12 0.32 -0.60 1.23 0.00 0.00 0.00 178.15 179.23 2otg h GLY 807 N 0.93 0.88 1.94 5.37 0.00 -1.39 0.93 103.07 111.73 2otg h GLY 807 Ca 0.03 -1.11 -0.17 0.00 0.00 0.00 0.00 47.33 46.09 2otg h GLY 807 CO 0.04 0.99 -0.80 -2.00 0.00 0.00 0.00 176.54 174.76 2otg h LEU 808 N 0.55 0.07 0.10 3.11 5.85 -1.23 -2.35 115.31 121.41 2otg h LEU 808 Ca -0.01 -0.06 0.01 0.00 0.84 0.00 0.00 57.88 58.66 2otg h LEU 808 Cb 1.22 -0.02 -0.01 0.00 0.37 0.00 0.00 40.66 42.21 2otg h LEU 808 CO 0.13 0.84 -0.11 0.28 -0.34 0.00 0.00 178.44 179.24 2otg h SER 809 N 0.03 -0.30 0.14 1.25 0.02 -0.55 -1.14 113.55 113.00 2otg h SER 809 Ca -0.02 0.03 0.01 0.00 -0.84 0.00 0.00 61.79 60.97 2otg h SER 809 Cb 1.41 0.11 -0.03 0.00 0.14 0.00 0.00 62.40 64.03 2otg h SER 809 CO 0.11 -0.17 -0.38 0.58 -1.14 0.00 0.00 176.83 175.83 2otg h VAL 810 N -0.24 0.00 -0.57 2.27 2.07 -0.66 -0.65 116.25 118.47 2otg h VAL 810 Ca 0.01 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.64 2otg h VAL 810 Cb 0.24 0.00 -0.11 0.00 -1.52 0.00 0.00 31.29 29.90 2otg h VAL 810 CO -0.04 0.00 -0.25 0.40 0.02 0.00 0.00 177.57 177.70 2otg h ILE 811 N -0.58 0.27 -0.37 4.57 2.04 -1.33 0.25 117.51 122.35 2otg h ILE 811 Ca -0.01 0.00 0.01 0.00 1.00 0.00 0.00 64.86 65.86 2otg h ILE 811 Cb 0.57 0.27 -0.02 0.00 -0.74 0.00 0.00 36.82 36.90 2otg h ILE 811 CO -0.18 0.00 0.24 1.56 0.00 0.00 0.00 178.15 179.76 2otg h GLN 812 N -0.11 0.47 0.12 2.37 4.20 -1.09 -0.11 115.11 120.95 2otg h GLN 812 Ca 0.25 -0.03 0.02 0.00 0.06 0.00 0.00 58.65 58.95 2otg h GLN 812 Cb 0.51 -0.11 -0.04 0.00 0.30 0.00 0.00 27.48 28.14 2otg h GLN 812 CO -0.64 0.31 -0.34 -0.09 -0.67 0.00 0.00 178.83 177.40 2otg h ARG 813 N 0.48 -0.55 -0.35 1.46 2.43 0.47 -2.61 114.38 115.71 2otg h ARG 813 Ca 0.14 0.04 -0.05 0.00 -0.81 0.00 0.00 59.98 59.30 2otg h ARG 813 Cb -0.03 0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 29.63 2otg h ARG 813 CO -0.05 -0.36 0.02 -0.91 -1.51 0.00 0.00 179.97 177.16 2otg h ASN 814 N -0.57 0.60 0.16 -3.80 2.35 -0.93 -2.62 115.58 110.78 2otg h ASN 814 Ca 0.03 -0.29 -0.05 0.00 -0.55 0.00 0.00 56.30 55.44 2otg h ASN 814 Cb 0.60 -0.16 -0.01 0.00 0.05 0.00 0.00 38.32 38.80 2otg h ASN 814 CO -0.20 0.74 -0.19 0.40 -1.65 0.00 0.00 177.43 176.53 2otg h ILE 815 N 0.43 1.16 -0.00 2.81 2.04 -1.04 -0.48 117.51 122.44 2otg h ILE 815 Ca 0.10 -0.75 -0.12 0.00 1.00 0.00 0.00 64.86 65.10 2otg h ILE 815 Cb 0.42 1.35 -0.02 0.00 -0.74 0.00 0.00 36.82 37.83 2otg h ILE 815 CO 0.01 0.22 -0.55 0.03 0.00 0.00 0.00 178.15 177.86 2otg h ARG 816 N 0.06 0.00 0.42 2.37 3.08 -1.35 -2.39 114.38 116.57 2otg h ARG 816 Ca 0.01 -0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.04 2otg h ARG 816 Cb 0.38 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.43 2otg h ARG 816 CO 0.03 0.55 -0.20 0.87 -1.07 0.00 0.00 179.97 180.15 2otg h LYS 817 N 0.00 -0.54 0.00 0.04 1.79 -0.72 -0.92 116.57 116.22 2otg h LYS 817 Ca -0.01 0.04 0.00 0.00 -2.18 0.00 0.00 60.65 58.50 2otg h LYS 817 Cb 0.97 0.12 0.00 0.00 -1.58 0.00 0.00 32.23 31.75 2otg h LYS 817 CO 0.07 -0.36 0.48 2.35 -1.08 0.00 0.00 179.45 180.91 2otg h TRP 818 N -0.87 0.00 0.00 -1.35 7.01 -1.46 2.64 115.95 121.93 2otg h TRP 818 Ca -0.06 0.00 -0.00 0.00 2.11 0.00 0.00 58.89 60.94 2otg h TRP 818 Cb 0.43 0.00 -0.00 0.00 -2.10 0.00 0.00 29.16 27.49 2otg h TRP 818 CO 0.04 0.00 -0.84 1.25 -2.79 0.00 0.00 178.44 176.10 2otg h LEU 819 N 0.00 0.00 0.00 0.65 6.46 -1.15 -3.16 115.31 118.11 2otg h LEU 819 Ca 0.00 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.76 2otg h LEU 819 Cb 0.96 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.89 2otg h LEU 819 CO 0.00 0.00 0.00 0.52 -0.62 0.00 0.00 178.44 178.34 2otg n VAL 820 N -2.75 0.00 -0.21 1.05 0.31 0.82 -4.49 118.33 113.06 2otg n VAL 820 Ca 0.01 0.38 -0.01 0.00 -0.01 0.00 0.00 64.34 64.71 2otg n VAL 820 Cb 0.55 -1.27 0.02 0.00 -0.91 0.00 0.00 33.84 32.23 2otg n VAL 820 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 2otg n LEU 821 N -1.97 -0.35 -0.17 7.52 4.77 0.25 0.97 117.00 128.03 2otg n LEU 821 Ca 0.00 0.94 0.00 0.00 -0.03 0.00 0.00 56.01 56.92 2otg n LEU 821 Cb 0.00 -0.21 0.00 0.00 -2.33 0.00 0.00 43.42 40.88 2otg n LEU 821 CO 0.00 -0.84 0.19 0.54 -1.33 0.00 0.00 177.39 175.95 2otg n ARG 822 N -4.79 0.46 0.00 3.23 1.74 -1.19 -1.37 116.66 114.73 2otg n ARG 822 Ca 0.05 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.13 2otg n ARG 822 Cb 0.21 -1.08 0.00 0.00 -1.02 0.00 0.00 32.46 30.58 2otg n ARG 822 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 2otg n ASN 823 N -0.24 0.16 -4.59 0.55 3.02 0.27 -4.89 115.26 109.54 2otg n ASN 823 Ca 0.00 -0.54 -0.42 0.00 -0.03 0.00 0.00 54.58 53.58 2otg n ASN 823 Cb 0.04 0.20 -0.02 0.00 -0.61 0.00 0.00 39.78 39.38 2otg n ASN 823 CO 0.00 0.00 0.00 0.86 -2.62 0.00 0.00 177.26 175.50 2otg s TRP 824 N -0.20 2.18 0.56 3.10 -0.00 -0.47 -4.82 118.94 119.29 2otg s TRP 824 Ca 0.00 0.63 0.41 0.00 -0.00 0.00 0.00 56.10 57.13 2otg s TRP 824 Cb 0.00 -4.27 1.53 0.00 -0.00 0.00 0.00 33.47 30.73 2otg s TRP 824 CO 0.00 -2.22 1.64 1.96 -0.00 0.00 0.00 176.95 178.33 2otg h GLN 825 N 11.61 0.00 0.00 5.86 1.08 -1.93 -1.11 115.11 130.61 2otg h GLN 825 Ca -0.29 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 56.91 2otg h GLN 825 Cb 1.12 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.55 2otg h GLN 825 CO 1.11 0.00 0.00 0.91 -0.95 0.00 0.00 178.83 179.90 2otg n TRP 826 N -3.90 0.00 -0.26 2.96 5.03 -1.26 -2.94 117.44 117.08 2otg n TRP 826 Ca 0.32 0.00 0.05 0.00 3.03 0.00 0.00 57.50 60.90 2otg n TRP 826 Cb 1.58 -0.27 0.16 0.00 -1.03 0.00 0.00 31.31 31.75 2otg n TRP 826 CO 0.00 0.00 0.00 2.35 -0.03 0.00 0.00 177.69 180.01 2otg h TRP 827 N 0.00 -0.00 -0.35 -5.99 7.01 -1.56 0.80 115.95 115.85 2otg h TRP 827 Ca 0.00 0.05 0.10 0.00 2.11 0.00 0.00 58.89 61.16 2otg h TRP 827 Cb 0.00 0.12 -0.01 0.00 -2.10 0.00 0.00 29.16 27.17 2otg h TRP 827 CO 0.09 -0.22 0.32 -0.22 -2.79 0.00 0.00 178.44 175.61 2otg h LYS 828 N 0.12 0.00 0.01 2.65 3.11 -1.37 -1.17 116.57 119.92 2otg h LYS 828 Ca 0.42 0.00 -0.37 0.00 -2.81 0.00 0.00 60.65 57.89 2otg h LYS 828 Cb 0.74 0.00 -0.07 0.00 -1.00 0.00 0.00 32.23 31.90 2otg h LYS 828 CO -0.65 0.00 -2.32 1.28 -2.81 0.00 0.00 179.45 174.95 2otg n LEU 829 N -4.02 1.03 -0.12 5.20 4.77 0.13 -4.52 117.00 119.47 2otg n LEU 829 Ca 0.06 0.02 -0.05 0.00 -0.03 0.00 0.00 56.01 56.00 2otg n LEU 829 Cb 0.49 0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.61 2otg n LEU 829 CO 0.31 0.62 0.95 0.22 -1.33 0.00 0.00 177.39 178.17 2otg h TYR 830 N 0.00 0.27 0.00 -1.77 5.03 0.16 -0.68 116.97 119.98 2otg h TYR 830 Ca -0.52 0.02 0.00 0.00 2.58 0.00 0.00 58.73 60.81 2otg h TYR 830 Cb 2.12 -0.06 0.00 0.00 1.55 0.00 0.00 36.73 40.34 2otg h TYR 830 CO 0.01 0.11 0.00 0.00 -1.32 0.00 0.00 178.16 176.96 2otg n ALA 831 N -2.35 2.06 -0.40 1.82 0.00 -0.93 -1.79 120.51 118.92 2otg n ALA 831 Ca 0.02 0.00 0.08 0.00 0.00 0.00 0.00 53.44 53.55 2otg n ALA 831 Cb 0.14 -1.00 0.25 0.00 0.00 0.00 0.00 19.45 18.84 2otg n ALA 831 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2otg n LYS 832 N -0.40 3.00 0.00 0.00 5.02 -0.26 -4.21 118.16 121.32 2otg n LYS 832 Ca 0.00 -2.45 0.00 0.00 -2.02 0.00 0.00 58.31 53.84 2otg n LYS 832 Cb 0.02 -1.52 0.00 0.00 -0.02 0.00 0.00 35.03 33.51 2otg n LYS 832 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 2otg n VAL 833 N 0.81 0.00 0.32 -0.18 0.31 -0.74 -4.66 118.33 114.19 2otg n VAL 833 Ca 0.19 -0.50 0.10 0.00 -0.01 0.00 0.00 64.34 64.12 2otg n VAL 833 Cb 0.61 1.01 0.18 0.00 -0.91 0.00 0.00 33.84 34.72 2otg n VAL 833 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 2otg n LYS 834 N -0.26 2.27 0.00 5.55 5.02 -1.26 -4.48 118.16 125.00 2otg n LYS 834 Ca 0.00 -2.09 0.00 0.00 -2.02 0.00 0.00 58.31 54.21 2otg n LYS 834 Cb 0.01 -1.44 0.00 0.00 -0.02 0.00 0.00 35.03 33.58 2otg n LYS 834 CO 0.00 0.00 0.00 -2.30 -0.52 0.00 0.00 177.40 174.58 2otg n PRO 835 N 1.26 0.77 0.00 1.97 -0.02 -1.26 -5.16 135.00 132.55 2otg n PRO 835 Ca 0.16 0.00 0.12 0.00 -2.02 0.00 0.00 63.50 61.76 2otg n PRO 835 Cb 0.54 -1.37 0.69 0.00 -0.02 0.00 0.00 33.50 33.35 2otg n PRO 835 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76