#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bmg s VAL 17 N 0.00 4.75 0.00 1.39 1.01 0.10 -4.28 120.40 123.37 2bmg s VAL 17 Ca 0.00 1.05 0.00 0.00 0.00 0.00 0.00 61.98 63.03 2bmg s VAL 17 Cb 0.00 -4.19 0.00 0.00 0.00 0.00 0.00 36.38 32.19 2bmg s VAL 17 CO 0.00 -0.35 0.00 0.61 0.00 0.00 0.00 175.10 175.36 2bmg n GLY 18 N 4.36 0.52 5.75 4.51 0.00 -1.26 -2.12 105.19 116.96 2bmg n GLY 18 Ca 0.04 -1.18 0.04 0.00 0.00 0.00 0.00 46.02 44.92 2bmg n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bmg n GLY 19 N 0.00 -1.09 3.57 -0.02 0.00 -1.26 -4.92 105.19 101.47 2bmg n GLY 19 Ca 0.00 -0.98 -0.26 0.00 0.00 0.00 0.00 46.02 44.78 2bmg n GLY 19 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2bmg s GLN 20 N -0.49 1.87 0.17 1.61 -1.52 -0.79 -4.97 119.66 115.54 2bmg s GLN 20 Ca 0.00 -2.06 -0.15 0.00 -1.95 0.00 0.00 55.36 51.19 2bmg s GLN 20 Cb 0.00 -1.36 -0.07 0.00 -0.22 0.00 0.00 33.01 31.35 2bmg s GLN 20 CO 0.00 -0.12 0.59 -1.83 -0.25 0.00 0.00 175.29 173.68 2bmg s GLU 21 N -3.78 4.04 -0.10 2.91 -1.05 -1.26 -0.23 118.70 119.23 2bmg s GLU 21 Ca 0.34 0.58 -0.29 0.00 -0.15 0.00 0.00 54.97 55.44 2bmg s GLU 21 Cb 0.09 -2.91 -0.05 0.00 -0.44 0.00 0.00 34.13 30.82 2bmg s GLU 21 CO 0.16 0.45 1.64 0.00 0.95 0.00 0.00 175.26 178.47 2bmg s LYS 23 N 4.20 1.37 -0.36 0.00 -0.14 -1.26 -4.87 119.74 118.68 2bmg s LYS 23 Ca 0.73 -0.25 -0.39 0.00 -1.36 0.00 0.00 55.97 54.70 2bmg s LYS 23 Cb -0.31 -1.95 -0.14 0.00 -1.68 0.00 0.00 37.83 33.74 2bmg s LYS 23 CO 0.29 -1.91 2.06 -3.47 -0.76 0.00 0.00 175.35 171.55 2bmg n ASP 24 N -3.44 1.89 -0.38 2.83 2.03 -1.26 -1.42 116.55 116.80 2bmg n ASP 24 Ca 0.12 0.66 -0.05 0.00 0.52 0.00 0.00 54.79 56.03 2bmg n ASP 24 Cb 0.60 -1.15 -0.02 0.00 -0.72 0.00 0.00 41.12 39.83 2bmg n ASP 24 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2bmg n GLY 25 N 6.11 0.75 0.11 0.27 0.00 -1.26 -4.92 105.19 106.25 2bmg n GLY 25 Ca 0.40 -0.61 0.10 0.00 0.00 0.00 0.00 46.02 45.92 2bmg n GLY 25 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2bmg n GLU 26 N -2.60 0.61 -2.95 1.61 1.02 -0.51 -4.38 120.64 113.43 2bmg n GLU 26 Ca -0.05 0.14 -0.16 0.00 -0.02 0.00 0.00 57.16 57.07 2bmg n GLU 26 Cb 0.19 -1.83 -0.01 0.00 -0.02 0.00 0.00 31.44 29.78 2bmg n GLU 26 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2bmg h PRO 28 N 2.98 0.00 -0.20 0.00 0.13 -1.76 -2.75 132.00 130.39 2bmg h PRO 28 Ca 0.04 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.17 2bmg h PRO 28 Cb 1.01 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.14 2bmg h PRO 28 CO 0.54 0.00 0.00 -2.67 -0.23 0.00 0.00 178.00 175.64 2bmg n TRP 29 N -2.44 0.25 -2.35 1.56 2.14 -1.15 -1.56 117.44 113.89 2bmg n TRP 29 Ca -0.01 -0.13 -0.41 0.00 2.07 0.00 0.00 57.50 59.02 2bmg n TRP 29 Cb 0.06 0.00 -0.03 0.00 -0.81 0.00 0.00 31.31 30.53 2bmg n TRP 29 CO 0.00 0.00 0.00 -1.14 2.07 0.00 0.00 177.69 178.62 2bmg s GLN 30 N -1.75 4.51 0.04 -2.67 2.00 -1.04 -1.39 119.66 119.36 2bmg s GLN 30 Ca 0.34 1.93 0.03 0.00 -2.00 0.00 0.00 55.36 55.67 2bmg s GLN 30 Cb 0.20 -3.19 -0.02 0.00 0.80 0.00 0.00 33.01 30.80 2bmg s GLN 30 CO 0.29 -0.02 -0.10 0.00 -0.50 0.00 0.00 175.29 174.96 2bmg s ALA 31 N -0.61 0.84 -0.05 1.58 0.00 -0.04 -4.44 121.76 119.04 2bmg s ALA 31 Ca 0.50 -0.75 0.06 0.00 0.00 0.00 0.00 51.96 51.76 2bmg s ALA 31 Cb -0.34 -0.07 -0.01 0.00 0.00 0.00 0.00 23.12 22.70 2bmg s ALA 31 CO 0.41 0.10 -0.23 -1.17 0.00 0.00 0.00 175.76 174.87 2bmg s LEU 32 N -1.28 2.04 -0.21 0.00 2.96 -0.45 -0.16 118.68 121.58 2bmg s LEU 32 Ca -0.03 -0.47 -0.14 0.00 -0.22 0.00 0.00 54.13 53.26 2bmg s LEU 32 Cb -0.08 -1.28 -0.04 0.00 0.50 0.00 0.00 46.19 45.28 2bmg s LEU 32 CO 0.01 0.23 0.30 -0.76 -1.32 0.00 0.00 176.35 174.82 2bmg s LEU 33 N -0.17 4.15 -0.03 -0.68 1.43 0.11 -0.64 118.68 122.86 2bmg s LEU 33 Ca -0.02 0.38 0.07 0.00 -1.03 0.00 0.00 54.13 53.53 2bmg s LEU 33 Cb -0.13 -2.36 -0.02 0.00 0.03 0.00 0.00 46.19 43.72 2bmg s LEU 33 CO 0.03 -0.01 -0.24 0.27 0.23 0.00 0.00 176.35 176.63 2bmg s ILE 34 N 1.11 1.90 0.69 -0.59 -4.36 -0.68 -1.49 121.20 117.79 2bmg s ILE 34 Ca 0.15 -1.02 -0.10 0.00 -0.26 0.00 0.00 60.65 59.42 2bmg s ILE 34 Cb -0.14 -1.58 0.16 0.00 1.25 0.00 0.00 42.46 42.14 2bmg s ILE 34 CO 0.06 0.54 0.94 -0.46 0.24 0.00 0.00 174.94 176.26 2bmg n ASN 35 N 2.60 0.29 0.14 4.36 0.23 -0.66 -1.44 115.26 120.79 2bmg n ASN 35 Ca -0.16 -1.47 0.09 0.00 -0.53 0.00 0.00 54.58 52.51 2bmg n ASN 35 Cb 0.52 -0.70 0.50 0.00 -2.08 0.00 0.00 39.78 38.01 2bmg n ASN 35 CO 0.00 0.00 0.00 -0.62 -0.93 0.00 0.00 177.26 175.71 2bmg n GLU 36 N -2.95 0.12 0.00 -3.83 1.02 -1.25 -0.04 120.64 113.70 2bmg n GLU 36 Ca 0.12 0.61 0.13 0.00 -0.02 0.00 0.00 57.16 58.00 2bmg n GLU 36 Cb 0.44 -1.89 0.30 0.00 -0.02 0.00 0.00 31.44 30.27 2bmg n GLU 36 CO 0.00 0.00 0.00 -1.91 1.18 0.00 0.00 177.13 176.40 2bmg n GLU 37 N -2.14 1.56 -1.01 3.49 4.07 -1.26 -4.96 120.64 120.40 2bmg n GLU 37 Ca -0.01 -1.10 -0.00 0.00 -0.06 0.00 0.00 57.16 55.99 2bmg n GLU 37 Cb 0.04 -1.48 -0.00 0.00 -0.06 0.00 0.00 31.44 29.94 2bmg n GLU 37 CO 0.00 0.00 0.00 0.09 -0.06 0.00 0.00 177.13 177.16 2bmg n ASN 38 N 0.24 -3.53 -4.88 4.31 5.03 0.94 -5.03 115.26 112.33 2bmg n ASN 38 Ca 0.15 0.00 -0.34 0.00 0.87 0.00 0.00 54.58 55.26 2bmg n ASN 38 Cb 0.43 -1.05 -0.05 0.00 -1.02 0.00 0.00 39.78 38.09 2bmg n ASN 38 CO 0.00 0.00 0.00 -1.83 -1.83 0.00 0.00 177.26 173.60 2bmg s GLU 39 N -0.45 3.64 -0.06 3.52 -1.05 -1.26 -4.80 118.70 118.24 2bmg s GLU 39 Ca 0.00 -0.02 -0.25 0.00 -0.15 0.00 0.00 54.97 54.55 2bmg s GLU 39 Cb 0.00 -3.00 -0.03 0.00 -0.44 0.00 0.00 34.13 30.65 2bmg s GLU 39 CO 0.00 0.58 0.76 0.20 0.95 0.00 0.00 175.26 177.75 2bmg s GLY 40 N -1.92 2.63 -0.01 -3.83 0.00 -1.26 -1.65 107.32 101.28 2bmg s GLY 40 Ca 0.32 0.20 0.04 0.00 0.00 0.00 0.00 44.72 45.28 2bmg s GLY 40 CO 0.19 1.31 0.08 1.97 0.00 0.00 0.00 173.10 176.65 2bmg n PHE 41 N 3.92 0.00 -3.79 1.90 -1.74 -0.56 -5.00 117.46 112.19 2bmg n PHE 41 Ca 0.00 0.00 -0.10 0.00 -0.56 0.00 0.00 57.45 56.80 2bmg n PHE 41 Cb 0.51 -0.12 -0.07 0.00 1.52 0.00 0.00 39.48 41.32 2bmg n PHE 41 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 2bmg s GLY 43 N -2.58 1.71 0.15 0.00 0.00 0.20 0.03 107.32 106.84 2bmg s GLY 43 Ca 0.01 -2.11 -0.25 0.00 0.00 0.00 0.00 44.72 42.37 2bmg s GLY 43 CO -0.09 -1.59 0.84 -0.32 0.00 0.00 0.00 173.10 171.94 2bmg s GLY 44 N -4.73 -0.30 -0.08 0.20 0.00 0.78 -3.67 107.32 99.52 2bmg s GLY 44 Ca 0.64 0.25 0.04 0.00 0.00 0.00 0.00 44.72 45.65 2bmg s GLY 44 CO 0.41 0.07 -0.21 -1.59 0.00 0.00 0.00 173.10 171.78 2bmg s THR 45 N -3.47 1.79 -0.16 0.90 2.01 0.17 -0.87 115.64 116.02 2bmg s THR 45 Ca 0.09 -0.88 -0.29 0.00 0.31 0.00 0.00 61.69 60.92 2bmg s THR 45 Cb -0.02 -1.55 -0.01 0.00 0.01 0.00 0.00 72.50 70.92 2bmg s THR 45 CO -0.01 0.50 1.22 -0.63 -0.69 0.00 0.00 174.62 175.01 2bmg s ILE 46 N 0.30 4.34 -0.16 1.82 1.01 -0.49 0.47 121.20 128.50 2bmg s ILE 46 Ca -0.14 1.63 0.17 0.00 0.00 0.00 0.00 60.65 62.30 2bmg s ILE 46 Cb -0.16 -4.05 -0.24 0.00 0.01 0.00 0.00 42.46 38.02 2bmg s ILE 46 CO 0.06 -0.12 0.11 0.18 0.00 0.00 0.00 174.94 175.18 2bmg n LEU 47 N 6.31 0.00 -3.90 2.97 4.77 -0.42 -1.55 117.00 125.18 2bmg n LEU 47 Ca 0.13 0.00 -0.02 0.00 -0.03 0.00 0.00 56.01 56.10 2bmg n LEU 47 Cb 0.45 0.39 0.02 0.00 -2.33 0.00 0.00 43.42 41.95 2bmg n LEU 47 CO 0.55 0.39 0.89 -0.94 -1.33 0.00 0.00 177.39 176.96 2bmg s SER 48 N -5.13 0.00 0.42 -1.43 1.04 -1.16 -4.73 113.70 102.72 2bmg s SER 48 Ca -0.09 -0.54 0.15 0.00 0.48 0.00 0.00 55.95 55.95 2bmg s SER 48 Cb 0.06 0.40 1.02 0.00 0.10 0.00 0.00 66.02 67.61 2bmg s SER 48 CO 0.76 -0.79 1.92 1.05 0.98 0.00 0.00 173.24 177.16 2bmg h GLU 49 N 2.00 0.43 -0.00 4.02 4.11 -1.97 -2.73 114.58 120.44 2bmg h GLU 49 Ca -0.26 -0.03 0.00 0.00 0.07 0.00 0.00 59.36 59.14 2bmg h GLU 49 Cb 1.21 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 30.36 2bmg h GLU 49 CO 0.34 0.29 -0.68 1.19 0.07 0.00 0.00 179.01 180.22 2bmg n PHE 50 N -4.48 0.00 -5.11 2.06 3.72 -1.26 0.26 117.46 112.64 2bmg n PHE 50 Ca 0.14 0.00 -0.32 0.00 -0.05 0.00 0.00 57.45 57.22 2bmg n PHE 50 Cb 0.50 0.00 -0.15 0.00 -0.94 0.00 0.00 39.48 38.90 2bmg n PHE 50 CO 0.00 0.00 0.00 0.71 -0.05 0.00 0.00 176.76 177.42 2bmg s TYR 51 N -2.39 2.51 -0.06 1.38 2.02 -1.03 -1.16 117.35 118.62 2bmg s TYR 51 Ca 0.07 -0.33 0.03 0.00 -0.37 0.00 0.00 57.07 56.47 2bmg s TYR 51 Cb 0.12 -1.57 0.00 0.00 -0.40 0.00 0.00 41.96 40.11 2bmg s TYR 51 CO 0.61 0.05 -0.16 0.42 -1.57 0.00 0.00 175.55 174.89 2bmg s ILE 52 N -0.62 1.41 -0.18 2.71 -1.09 -0.48 -1.30 121.20 121.65 2bmg s ILE 52 Ca 0.09 -0.67 -0.10 0.00 -2.23 0.00 0.00 60.65 57.74 2bmg s ILE 52 Cb -0.11 -1.24 -0.05 0.00 -1.58 0.00 0.00 42.46 39.49 2bmg s ILE 52 CO 0.00 0.41 0.16 -0.22 -1.23 0.00 0.00 174.94 174.06 2bmg s LEU 53 N 0.34 4.24 0.00 2.97 2.96 0.18 -0.13 118.68 129.22 2bmg s LEU 53 Ca -0.11 0.31 0.00 0.00 -0.22 0.00 0.00 54.13 54.11 2bmg s LEU 53 Cb -0.14 -2.14 0.00 0.00 0.50 0.00 0.00 46.19 44.41 2bmg s LEU 53 CO 0.04 0.19 0.00 1.07 -1.32 0.00 0.00 176.35 176.33 2bmg n THR 54 N 3.36 0.00 -3.92 3.68 5.66 -0.13 0.44 114.28 123.37 2bmg n THR 54 Ca -0.16 0.00 -0.35 0.00 -3.05 0.00 0.00 64.05 60.49 2bmg n THR 54 Cb 0.52 0.00 -0.08 0.00 -1.55 0.00 0.00 70.33 69.22 2bmg n THR 54 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2bmg s ALA 55 N -1.73 3.62 0.23 1.79 0.00 -1.26 -1.86 121.76 122.56 2bmg s ALA 55 Ca 0.00 -0.70 -0.06 0.00 0.00 0.00 0.00 51.96 51.19 2bmg s ALA 55 Cb 0.00 -1.97 0.31 0.00 0.00 0.00 0.00 23.12 21.46 2bmg s ALA 55 CO 0.00 0.34 1.84 0.00 0.00 0.00 0.00 175.76 177.94 2bmg h ALA 56 N 6.04 1.09 0.00 0.00 0.00 -1.71 -1.48 119.26 123.20 2bmg h ALA 56 Ca -0.45 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.46 2bmg h ALA 56 Cb 1.18 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.78 2bmg h ALA 56 CO 0.67 0.20 -0.01 1.12 0.00 0.00 0.00 179.25 181.23 2bmg h HIS 57 N 0.87 0.00 0.00 0.00 2.07 -1.92 -1.31 115.15 114.87 2bmg h HIS 57 Ca 0.35 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.87 2bmg h HIS 57 Cb 0.19 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.17 2bmg h HIS 57 CO -0.05 0.01 0.00 0.00 -3.07 0.00 0.00 177.93 174.82 2bmg n LEU 59 N -2.80 0.00 -0.61 0.00 4.77 -0.49 -2.83 117.00 115.04 2bmg n LEU 59 Ca 0.01 0.11 0.09 0.00 -0.03 0.00 0.00 56.01 56.19 2bmg n LEU 59 Cb 0.28 -0.11 0.05 0.00 -2.33 0.00 0.00 43.42 41.30 2bmg n LEU 59 CO 0.25 -0.01 0.45 -1.22 -1.33 0.00 0.00 177.39 175.53 2bmg n TYR 60 N -1.11 0.00 -0.67 -1.77 0.53 -1.15 -4.47 117.16 108.52 2bmg n TYR 60 Ca 0.18 0.00 0.06 0.00 -1.02 0.00 0.00 57.90 57.12 2bmg n TYR 60 Cb 0.15 0.00 0.36 0.00 -1.03 0.00 0.00 39.34 38.82 2bmg n TYR 60 CO 0.00 0.00 0.00 1.04 -1.02 0.00 0.00 176.86 176.88 2bmg n GLN 61 N 0.66 4.44 0.00 -0.72 6.02 -1.13 -4.92 117.38 121.73 2bmg n GLN 61 Ca 0.09 -2.78 0.00 0.00 -0.01 0.00 0.00 57.00 54.31 2bmg n GLN 61 Cb 0.42 -2.18 0.00 0.00 1.02 0.00 0.00 30.24 29.50 2bmg n GLN 61 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2bmg n ALA 61 N 0.56 0.00 -0.02 -1.58 0.00 -1.26 -5.02 120.51 113.18 2bmg n ALA 61 Ca 0.24 0.00 -0.16 0.00 0.00 0.00 0.00 53.44 53.53 2bmg n ALA 61 Cb 1.09 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 20.42 2bmg n ALA 61 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 177.50 179.07 2bmg h LYS 62 N 0.00 0.25 -5.19 0.00 2.10 -1.91 -3.46 116.57 108.36 2bmg h LYS 62 Ca 0.00 -0.26 -0.44 0.00 -2.00 0.00 0.00 60.65 57.96 2bmg h LYS 62 Cb 0.00 0.07 -0.26 0.00 -0.90 0.00 0.00 32.23 31.14 2bmg h LYS 62 CO 0.00 0.97 -0.79 1.03 -2.00 0.00 0.00 179.45 178.65 2bmg s ARG 63 N -3.18 0.92 0.00 0.07 1.81 -1.26 -5.15 118.95 112.16 2bmg s ARG 63 Ca -0.15 -0.64 -0.26 0.00 -1.72 0.00 0.00 55.73 52.96 2bmg s ARG 63 Cb 0.02 -0.91 0.06 0.00 -0.45 0.00 0.00 34.95 33.67 2bmg s ARG 63 CO 0.76 0.23 0.59 -0.59 -0.68 0.00 0.00 175.30 175.61 2bmg s PHE 64 N -0.67 -0.53 0.50 -0.53 -0.71 -1.26 -3.85 117.98 110.93 2bmg s PHE 64 Ca 0.02 0.77 0.04 0.00 -1.04 0.00 0.00 56.93 56.72 2bmg s PHE 64 Cb -0.07 0.37 -0.00 0.00 -1.21 0.00 0.00 43.02 42.11 2bmg s PHE 64 CO 0.01 -0.62 0.21 0.15 -1.34 0.00 0.00 175.22 173.63 2bmg s LYS 65 N -1.83 2.22 -0.08 1.99 1.02 -0.52 -4.36 119.74 118.18 2bmg s LYS 65 Ca -0.08 -2.12 0.02 0.00 0.02 0.00 0.00 55.97 53.82 2bmg s LYS 65 Cb -0.01 -1.87 0.01 0.00 -0.52 0.00 0.00 37.83 35.44 2bmg s LYS 65 CO 0.04 -0.41 -0.15 0.08 -0.92 0.00 0.00 175.35 173.98 2bmg s VAL 66 N -2.77 1.42 -0.08 3.17 1.01 0.20 -1.68 120.40 121.67 2bmg s VAL 66 Ca 0.26 -0.63 -0.00 0.00 0.00 0.00 0.00 61.98 61.61 2bmg s VAL 66 Cb 0.01 -1.28 -0.03 0.00 0.00 0.00 0.00 36.38 35.08 2bmg s VAL 66 CO 0.15 0.42 -0.06 -0.60 0.00 0.00 0.00 175.10 175.01 2bmg s ARG 67 N 0.68 2.89 0.18 2.72 3.52 0.19 0.00 118.95 129.13 2bmg s ARG 67 Ca -0.13 -0.52 0.07 0.00 -0.13 0.00 0.00 55.73 55.01 2bmg s ARG 67 Cb -0.16 -2.66 -0.04 0.00 -1.56 0.00 0.00 34.95 30.53 2bmg s ARG 67 CO 0.04 0.62 -0.14 0.14 -0.81 0.00 0.00 175.30 175.14 2bmg s VAL 68 N -0.68 1.58 -0.95 7.11 -7.23 -0.37 -1.35 120.40 118.52 2bmg s VAL 68 Ca 0.10 -2.07 -0.01 0.00 -1.81 0.00 0.00 61.98 58.20 2bmg s VAL 68 Cb -0.11 -1.90 0.00 0.00 0.56 0.00 0.00 36.38 34.93 2bmg s VAL 68 CO 0.02 -0.56 0.12 0.61 -0.31 0.00 0.00 175.10 174.98 2bmg n GLY 69 N -0.11 -0.07 3.35 2.32 0.00 -1.26 -1.78 105.19 107.65 2bmg n GLY 69 Ca -0.10 -0.36 -0.32 0.00 0.00 0.00 0.00 46.02 45.24 2bmg n GLY 69 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2bmg s ASP 70 N -2.61 3.44 0.00 1.61 2.15 -1.26 -2.65 116.67 117.36 2bmg s ASP 70 Ca 0.06 -0.38 0.00 0.00 0.43 0.00 0.00 52.55 52.66 2bmg s ASP 70 Cb -0.03 -0.75 0.00 0.00 -0.30 0.00 0.00 42.92 41.84 2bmg s ASP 70 CO 0.08 0.29 0.00 0.54 -0.17 0.00 0.00 175.17 175.91 2bmg n ARG 71 N 2.64 3.38 -3.62 4.34 1.74 -1.26 -4.83 116.66 119.04 2bmg n ARG 71 Ca -0.17 0.00 -0.26 0.00 -0.77 0.00 0.00 57.85 56.65 2bmg n ARG 71 Cb 0.52 -0.59 -0.17 0.00 -1.02 0.00 0.00 32.46 31.19 2bmg n ARG 71 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 2bmg s ASN 72 N -1.04 2.45 0.00 0.55 3.04 -1.25 -1.21 114.94 117.48 2bmg s ASN 72 Ca 0.00 -0.66 0.01 0.00 0.04 0.00 0.00 52.86 52.25 2bmg s ASN 72 Cb 0.00 -0.28 0.06 0.00 -1.54 0.00 0.00 41.25 39.49 2bmg s ASN 72 CO 0.00 -0.35 0.51 0.35 -3.04 0.00 0.00 177.10 174.57 2bmg n THR 73 N 5.26 0.00 -2.56 -5.21 -2.24 -0.10 -3.29 114.28 106.13 2bmg n THR 73 Ca -0.07 0.00 -0.12 0.00 -2.27 0.00 0.00 64.05 61.59 2bmg n THR 73 Cb 0.49 -0.30 0.03 0.00 -2.10 0.00 0.00 70.33 68.44 2bmg n THR 73 CO 0.00 0.00 0.00 -1.84 -0.57 0.00 0.00 175.07 172.66 2bmg n GLU 74 N -0.53 2.23 -3.91 -0.78 0.28 -1.26 -5.08 120.64 111.59 2bmg n GLU 74 Ca 0.01 -3.73 0.01 0.00 -0.16 0.00 0.00 57.16 53.28 2bmg n GLU 74 Cb 0.00 -1.75 0.01 0.00 1.43 0.00 0.00 31.44 31.14 2bmg n GLU 74 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 177.13 176.32 2bmg s GLN 75 N -3.53 0.69 -0.45 3.44 -0.21 -1.21 -5.12 119.66 113.28 2bmg s GLN 75 Ca 0.35 -0.44 0.02 0.00 0.02 0.00 0.00 55.36 55.32 2bmg s GLN 75 Cb 0.39 0.20 0.13 0.00 1.00 0.00 0.00 33.01 34.73 2bmg s GLN 75 CO -0.03 -0.32 0.23 -1.21 -2.12 0.00 0.00 175.29 171.84 2bmg s GLU 76 N -2.14 1.43 0.00 2.91 0.41 -1.26 -4.93 118.70 115.11 2bmg s GLU 76 Ca 0.25 -2.10 0.00 0.00 -0.41 0.00 0.00 54.97 52.71 2bmg s GLU 76 Cb -0.01 -2.57 0.00 0.00 -1.78 0.00 0.00 34.13 29.77 2bmg s GLU 76 CO 0.01 -1.13 0.66 -1.91 -0.49 0.00 0.00 175.26 172.40 2bmg n GLU 77 N 3.53 0.72 0.00 1.61 2.13 -1.26 -4.79 120.64 122.58 2bmg n GLU 77 Ca 0.07 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.89 2bmg n GLU 77 Cb 0.34 -1.05 0.00 0.00 0.27 0.00 0.00 31.44 31.00 2bmg n GLU 77 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2bmg n GLY 78 N 0.20 0.97 0.08 8.31 0.00 -1.26 -4.68 105.19 108.81 2bmg n GLY 78 Ca 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.96 2bmg n GLY 78 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2bmg h GLY 79 N 0.00 0.00 -2.06 -0.02 0.00 -1.87 -3.47 103.07 95.66 2bmg h GLY 79 Ca 0.00 0.00 -0.53 0.00 0.00 0.00 0.00 47.33 46.80 2bmg h GLY 79 CO 0.00 0.00 -0.72 1.18 0.00 0.00 0.00 176.54 177.00 2bmg n GLU 80 N -3.22 -0.25 -3.64 4.80 4.71 -1.08 -4.60 120.64 117.35 2bmg n GLU 80 Ca -0.05 -0.04 -0.03 0.00 -0.01 0.00 0.00 57.16 57.03 2bmg n GLU 80 Cb 0.95 -1.76 -0.07 0.00 -1.01 0.00 0.00 31.44 29.56 2bmg n GLU 80 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2bmg s ALA 81 N -2.35 -2.21 -0.12 0.62 0.00 -0.73 -4.97 121.76 112.00 2bmg s ALA 81 Ca 0.55 2.25 -0.06 0.00 0.00 0.00 0.00 51.96 54.70 2bmg s ALA 81 Cb -0.21 -1.67 -0.04 0.00 0.00 0.00 0.00 23.12 21.21 2bmg s ALA 81 CO 0.69 -0.37 0.09 0.08 0.00 0.00 0.00 175.76 176.25 2bmg s VAL 82 N 1.43 5.04 -0.02 0.00 1.01 -1.26 -1.23 120.40 125.36 2bmg s VAL 82 Ca -0.09 0.04 0.03 0.00 0.00 0.00 0.00 61.98 61.96 2bmg s VAL 82 Cb -0.04 -3.19 -0.00 0.00 0.00 0.00 0.00 36.38 33.15 2bmg s VAL 82 CO -0.16 0.58 -0.12 -1.00 0.00 0.00 0.00 175.10 174.41 2bmg s HIS 83 N -0.71 1.16 0.17 5.22 3.76 0.10 -4.96 115.29 120.03 2bmg s HIS 83 Ca 0.12 -0.28 -0.19 0.00 -0.15 0.00 0.00 55.06 54.57 2bmg s HIS 83 Cb -0.12 -0.79 -0.08 0.00 1.11 0.00 0.00 32.58 32.71 2bmg s HIS 83 CO 0.03 -0.09 0.66 -1.21 -0.85 0.00 0.00 174.74 173.28 2bmg s GLU 84 N 0.00 4.21 -0.14 1.40 2.02 -1.26 -0.63 118.70 124.31 2bmg s GLU 84 Ca -0.01 0.79 -0.29 0.00 0.02 0.00 0.00 54.97 55.48 2bmg s GLU 84 Cb -0.08 -2.99 -0.01 0.00 0.10 0.00 0.00 34.13 31.15 2bmg s GLU 84 CO 0.00 0.47 1.09 0.08 0.02 0.00 0.00 175.26 176.93 2bmg s VAL 85 N -1.40 4.58 -0.06 2.63 1.01 -1.26 -1.01 120.40 124.89 2bmg s VAL 85 Ca 0.39 1.88 -0.02 0.00 0.00 0.00 0.00 61.98 64.23 2bmg s VAL 85 Cb -0.17 -4.21 -0.01 0.00 0.00 0.00 0.00 36.38 31.99 2bmg s VAL 85 CO 0.21 -0.06 -0.04 -0.08 0.00 0.00 0.00 175.10 175.13 2bmg h GLU 86 N 7.40 0.00 -6.55 2.72 4.81 0.75 -3.44 114.58 120.27 2bmg h GLU 86 Ca -0.28 0.00 -0.68 0.00 -0.13 0.00 0.00 59.36 58.27 2bmg h GLU 86 Cb 1.12 0.00 -0.21 0.00 0.63 0.00 0.00 28.75 30.29 2bmg h GLU 86 CO 0.91 0.00 -0.79 0.08 -0.73 0.00 0.00 179.01 178.47 2bmg s VAL 87 N -1.44 2.88 -0.35 0.32 1.01 -0.78 -4.98 120.40 117.06 2bmg s VAL 87 Ca -0.03 -1.15 0.01 0.00 0.00 0.00 0.00 61.98 60.81 2bmg s VAL 87 Cb 0.00 -2.22 0.10 0.00 0.00 0.00 0.00 36.38 34.26 2bmg s VAL 87 CO 0.05 0.34 0.09 -0.69 0.00 0.00 0.00 175.10 174.88 2bmg s VAL 88 N -0.94 2.70 -0.53 2.92 1.01 -1.26 -1.15 120.40 123.16 2bmg s VAL 88 Ca 0.15 -2.09 -0.19 0.00 0.00 0.00 0.00 61.98 59.85 2bmg s VAL 88 Cb -0.11 -2.86 0.07 0.00 0.00 0.00 0.00 36.38 33.49 2bmg s VAL 88 CO 0.06 -0.54 0.63 -0.63 0.00 0.00 0.00 175.10 174.62 2bmg s ILE 89 N 1.04 4.88 0.01 2.22 1.01 0.19 -4.99 121.20 125.56 2bmg s ILE 89 Ca 0.07 -0.67 0.01 0.00 0.00 0.00 0.00 60.65 60.05 2bmg s ILE 89 Cb -0.20 -4.34 -0.04 0.00 0.01 0.00 0.00 42.46 37.89 2bmg s ILE 89 CO -0.06 -0.88 0.05 -0.75 0.00 0.00 0.00 174.94 173.31 2bmg s LYS 90 N 2.57 2.94 -0.20 2.79 2.20 -1.26 -0.12 119.74 128.66 2bmg s LYS 90 Ca 0.13 -0.56 -0.29 0.00 -0.36 0.00 0.00 55.97 54.89 2bmg s LYS 90 Cb -0.21 -2.78 -0.02 0.00 -1.51 0.00 0.00 37.83 33.32 2bmg s LYS 90 CO 0.10 0.63 1.43 -1.58 -0.36 0.00 0.00 175.35 175.57 2bmg s HIS 91 N -1.18 2.47 0.57 4.03 5.65 -1.14 -4.90 115.29 120.79 2bmg s HIS 91 Ca 0.22 0.72 0.27 0.00 0.25 0.00 0.00 55.06 56.52 2bmg s HIS 91 Cb -0.12 -3.81 1.59 0.00 -1.18 0.00 0.00 32.58 29.06 2bmg s HIS 91 CO 0.14 -2.37 2.11 -2.95 -0.65 0.00 0.00 174.74 171.02 2bmg h ASN 92 N 9.40 0.00 -0.16 9.88 7.08 -1.94 -1.96 115.58 137.89 2bmg h ASN 92 Ca -0.30 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 52.92 2bmg h ASN 92 Cb 1.13 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 37.37 2bmg h ASN 92 CO 0.99 0.00 0.00 0.54 -2.08 0.00 0.00 177.43 176.88 2bmg n ARG 93 N -3.98 1.47 -2.41 4.14 1.74 -1.26 -4.88 116.66 111.47 2bmg n ARG 93 Ca 0.02 -0.72 -0.41 0.00 -0.77 0.00 0.00 57.85 55.97 2bmg n ARG 93 Cb 0.31 -1.26 -0.03 0.00 -1.02 0.00 0.00 32.46 30.45 2bmg n ARG 93 CO 0.00 0.00 0.00 0.12 -1.52 0.00 0.00 177.63 176.23 2bmg s PHE 94 N -1.79 3.46 -0.01 -1.55 5.36 -0.74 -4.74 117.98 117.96 2bmg s PHE 94 Ca 0.23 1.41 0.02 0.00 -0.96 0.00 0.00 56.93 57.62 2bmg s PHE 94 Cb 0.12 -3.40 -0.00 0.00 -0.34 0.00 0.00 43.02 39.39 2bmg s PHE 94 CO 0.17 -1.14 -0.07 0.99 -1.46 0.00 0.00 175.22 173.71 2bmg s THR 95 N 0.26 0.57 0.16 0.12 2.01 -1.22 -5.02 115.64 112.52 2bmg s THR 95 Ca 0.54 -0.28 -0.10 0.00 0.31 0.00 0.00 61.69 62.16 2bmg s THR 95 Cb -0.31 -0.50 0.02 0.00 0.01 0.00 0.00 72.50 71.71 2bmg s THR 95 CO 0.34 0.17 1.57 0.50 -0.69 0.00 0.00 174.62 176.51 2bmg h LYS 96 N 6.17 1.02 -0.97 4.92 1.63 -1.96 0.80 116.57 128.19 2bmg h LYS 96 Ca -0.31 -0.41 0.24 0.00 -0.85 0.00 0.00 60.65 59.32 2bmg h LYS 96 Cb 1.18 -0.05 -0.07 0.00 -0.60 0.00 0.00 32.23 32.69 2bmg h LYS 96 CO 0.49 1.10 0.65 0.93 -3.45 0.00 0.00 179.45 179.17 2bmg h GLU 97 N 0.89 0.31 0.00 1.90 4.39 -2.00 -3.15 114.58 116.92 2bmg h GLU 97 Ca 0.12 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.81 2bmg h GLU 97 Cb 0.75 -0.07 0.00 0.00 -0.10 0.00 0.00 28.75 29.33 2bmg h GLU 97 CO 0.06 0.20 -0.55 -2.37 -1.16 0.00 0.00 179.01 175.19 2bmg n THR 98 N -4.49 0.00 -1.32 1.13 5.66 -1.12 -5.01 114.28 109.13 2bmg n THR 98 Ca 0.22 -0.14 -0.11 0.00 -3.05 0.00 0.00 64.05 60.96 2bmg n THR 98 Cb 0.84 0.62 -0.05 0.00 -1.55 0.00 0.00 70.33 70.19 2bmg n THR 98 CO 0.00 0.00 0.00 -1.22 -3.05 0.00 0.00 175.07 170.80 2bmg n TYR 99 N -1.12 0.00 -2.86 1.09 4.02 0.28 -4.98 117.16 113.59 2bmg n TYR 99 Ca 0.00 0.00 -0.34 0.00 -0.01 0.00 0.00 57.90 57.55 2bmg n TYR 99 Cb 0.00 -2.41 -0.07 0.00 -0.02 0.00 0.00 39.34 36.84 2bmg n TYR 99 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 176.86 176.19 2bmg s ASP 100 N -2.56 7.04 -1.05 7.72 2.15 -1.25 -3.77 116.67 124.95 2bmg s ASP 100 Ca 0.00 1.67 -0.05 0.00 0.43 0.00 0.00 52.55 54.60 2bmg s ASP 100 Cb 0.00 -2.53 0.01 0.00 -0.30 0.00 0.00 42.92 40.10 2bmg s ASP 100 CO 0.00 -0.24 0.69 0.49 -0.17 0.00 0.00 175.17 175.95 2bmg n PHE 101 N -0.19 -1.84 -2.47 -5.34 3.01 -1.26 -3.46 117.46 105.91 2bmg n PHE 101 Ca 0.05 0.59 -0.39 0.00 1.01 0.00 0.00 57.45 58.71 2bmg n PHE 101 Cb 0.53 -3.80 -0.02 0.00 -0.01 0.00 0.00 39.48 36.18 2bmg n PHE 101 CO 0.00 0.00 0.00 0.34 1.01 0.00 0.00 176.76 178.11 2bmg s ASP 102 N -3.05 6.39 -0.10 4.37 2.15 -1.25 -4.44 116.67 120.75 2bmg s ASP 102 Ca 0.34 -2.03 -0.24 0.00 0.43 0.00 0.00 52.55 51.06 2bmg s ASP 102 Cb -0.15 -2.58 0.05 0.00 -0.30 0.00 0.00 42.92 39.94 2bmg s ASP 102 CO 0.43 -1.63 0.56 -0.51 -0.17 0.00 0.00 175.17 173.85 2bmg s ILE 103 N 5.77 0.01 -0.01 4.11 2.07 -1.26 -4.09 121.20 127.80 2bmg s ILE 103 Ca 0.55 -0.11 -0.26 0.00 -1.41 0.00 0.00 60.65 59.42 2bmg s ILE 103 Cb 0.02 -0.85 0.06 0.00 0.13 0.00 0.00 42.46 41.82 2bmg s ILE 103 CO 0.05 -0.06 0.59 0.00 -1.91 0.00 0.00 174.94 173.60 2bmg s ALA 104 N -0.72 -1.53 0.10 1.50 0.00 -0.77 -2.87 121.76 117.47 2bmg s ALA 104 Ca -0.08 0.97 0.10 0.00 0.00 0.00 0.00 51.96 52.95 2bmg s ALA 104 Cb -0.03 0.16 -0.04 0.00 0.00 0.00 0.00 23.12 23.22 2bmg s ALA 104 CO 0.06 -0.41 -0.25 0.08 0.00 0.00 0.00 175.76 175.23 2bmg s VAL 105 N -1.67 2.34 -0.08 0.00 1.01 0.83 -0.95 120.40 121.87 2bmg s VAL 105 Ca -0.09 -1.59 0.04 0.00 0.00 0.00 0.00 61.98 60.34 2bmg s VAL 105 Cb -0.01 -2.00 0.00 0.00 0.00 0.00 0.00 36.38 34.37 2bmg s VAL 105 CO 0.05 0.19 -0.20 -0.76 0.00 0.00 0.00 175.10 174.37 2bmg s LEU 106 N -1.80 1.95 -0.24 3.92 1.43 0.81 -0.64 118.68 124.12 2bmg s LEU 106 Ca 0.14 -0.46 -0.09 0.00 -1.03 0.00 0.00 54.13 52.69 2bmg s LEU 106 Cb -0.10 -1.20 -0.04 0.00 0.03 0.00 0.00 46.19 44.88 2bmg s LEU 106 CO 0.05 0.13 0.12 -0.60 0.23 0.00 0.00 176.35 176.29 2bmg s ARG 107 N 0.33 3.92 0.18 1.70 6.06 -0.30 -1.39 118.95 129.46 2bmg s ARG 107 Ca -0.14 -0.35 -0.10 0.00 -2.50 0.00 0.00 55.73 52.64 2bmg s ARG 107 Cb -0.16 -3.44 -0.07 0.00 0.06 0.00 0.00 34.95 31.34 2bmg s ARG 107 CO 0.06 -0.00 0.50 -0.51 -2.50 0.00 0.00 175.30 172.85 2bmg s LEU 108 N 1.19 4.24 0.33 -0.88 1.43 -0.31 0.13 118.68 124.81 2bmg s LEU 108 Ca 0.06 0.88 0.07 0.00 -1.03 0.00 0.00 54.13 54.11 2bmg s LEU 108 Cb -0.14 -3.44 0.58 0.00 0.03 0.00 0.00 46.19 43.22 2bmg s LEU 108 CO 0.05 0.02 1.79 0.11 0.23 0.00 0.00 176.35 178.55 2bmg h LYS 109 N 2.95 0.27 -6.04 1.70 1.57 -1.37 -3.42 116.57 112.23 2bmg h LYS 109 Ca -0.47 -0.10 -0.60 0.00 -1.87 0.00 0.00 60.65 57.62 2bmg h LYS 109 Cb 1.18 -0.02 -0.28 0.00 0.08 0.00 0.00 32.23 33.18 2bmg h LYS 109 CO 0.69 0.53 -0.85 0.95 -0.57 0.00 0.00 179.45 180.19 2bmg s THR 110 N -4.44 1.64 0.35 -0.16 -4.23 -1.26 -5.04 115.64 102.50 2bmg s THR 110 Ca -0.05 -0.99 -0.27 0.00 -1.18 0.00 0.00 61.69 59.20 2bmg s THR 110 Cb 0.14 -1.39 -0.09 0.00 1.34 0.00 0.00 72.50 72.51 2bmg s THR 110 CO 0.76 0.37 1.16 -2.16 -0.54 0.00 0.00 174.62 174.20 2bmg s PRO 111 N -0.73 4.29 0.35 3.99 0.04 -1.26 -4.85 135.00 136.83 2bmg s PRO 111 Ca 0.08 1.85 -0.27 0.00 0.04 0.00 0.00 61.00 62.70 2bmg s PRO 111 Cb -0.08 -2.88 -0.09 0.00 0.04 0.00 0.00 34.50 31.48 2bmg s PRO 111 CO 0.00 -0.11 1.19 0.42 0.04 0.00 0.00 177.00 178.54 2bmg s ILE 112 N -1.32 3.11 -0.44 0.56 1.01 0.14 -4.99 121.20 119.27 2bmg s ILE 112 Ca 0.52 1.04 -0.14 0.00 0.00 0.00 0.00 60.65 62.07 2bmg s ILE 112 Cb -0.32 -3.63 0.05 0.00 0.01 0.00 0.00 42.46 38.57 2bmg s ILE 112 CO 0.40 0.19 0.34 -0.89 0.00 0.00 0.00 174.94 174.98 2bmg s THR 113 N -1.26 5.12 0.39 2.92 2.01 -1.26 -4.78 115.64 118.78 2bmg s THR 113 Ca 0.51 -0.93 -0.26 0.00 0.31 0.00 0.00 61.69 61.32 2bmg s THR 113 Cb -0.34 -3.97 -0.09 0.00 0.01 0.00 0.00 72.50 68.11 2bmg s THR 113 CO 0.43 -0.45 1.31 -0.36 -0.69 0.00 0.00 174.62 174.86 2bmg s PHE 114 N 1.63 2.85 0.00 4.92 0.08 -1.26 -4.91 117.98 121.29 2bmg s PHE 114 Ca 0.04 1.41 0.00 0.00 0.12 0.00 0.00 56.93 58.50 2bmg s PHE 114 Cb -0.22 -3.68 0.00 0.00 -0.57 0.00 0.00 43.02 38.55 2bmg s PHE 114 CO 0.07 -2.07 0.00 2.89 -0.10 0.00 0.00 175.22 176.02 2bmg n ARG 115 N 0.24 0.00 -1.91 0.44 1.85 -0.35 -5.00 116.66 111.94 2bmg n ARG 115 Ca 0.03 0.00 -0.42 0.00 -1.00 0.00 0.00 57.85 56.46 2bmg n ARG 115 Cb 0.43 0.00 -0.03 0.00 -1.05 0.00 0.00 32.46 31.81 2bmg n ARG 115 CO 0.00 0.00 0.00 1.41 -0.01 0.00 0.00 177.63 179.03 2bmg s MET 116 N 1.32 4.20 0.00 2.89 -2.45 -1.26 -1.87 119.30 122.13 2bmg s MET 116 Ca 0.00 2.37 0.00 0.00 -1.25 0.00 0.00 55.69 56.81 2bmg s MET 116 Cb 0.00 -3.41 0.00 0.00 1.25 0.00 0.00 34.83 32.67 2bmg s MET 116 CO 0.00 -0.69 0.00 0.09 1.05 0.00 0.00 175.02 175.47 2bmg n ASN 117 N 4.91 -0.29 -3.65 1.11 3.02 -1.26 -4.93 115.26 114.16 2bmg n ASN 117 Ca 0.15 0.00 -0.29 0.00 -0.03 0.00 0.00 54.58 54.41 2bmg n ASN 117 Cb 0.39 -0.79 -0.15 0.00 -0.61 0.00 0.00 39.78 38.62 2bmg n ASN 117 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2bmg s VAL 118 N -3.00 0.54 0.21 2.41 1.01 -0.78 -4.08 120.40 116.71 2bmg s VAL 118 Ca 0.00 -1.25 -0.13 0.00 0.00 0.00 0.00 61.98 60.59 2bmg s VAL 118 Cb 0.00 -1.42 0.00 0.00 0.00 0.00 0.00 36.38 34.96 2bmg s VAL 118 CO 0.00 -0.72 0.45 0.00 0.00 0.00 0.00 175.10 174.83 2bmg s ALA 119 N 1.69 -0.39 0.29 5.51 0.00 -0.60 -1.21 121.76 127.05 2bmg s ALA 119 Ca 0.10 -0.69 0.03 0.00 0.00 0.00 0.00 51.96 51.40 2bmg s ALA 119 Cb -0.17 0.96 -0.03 0.00 0.00 0.00 0.00 23.12 23.87 2bmg s ALA 119 CO -0.27 -0.80 0.45 -1.25 0.00 0.00 0.00 175.76 173.90 2bmg s PRO 120 N -3.97 3.46 0.05 0.00 0.04 -1.26 -2.93 135.00 130.39 2bmg s PRO 120 Ca 0.17 -0.55 -0.12 0.00 0.04 0.00 0.00 61.00 60.54 2bmg s PRO 120 Cb 0.00 -2.78 -0.06 0.00 0.04 0.00 0.00 34.50 31.71 2bmg s PRO 120 CO 0.04 0.29 0.42 0.00 0.04 0.00 0.00 177.00 177.78 2bmg s ALA 121 N -2.15 3.70 0.52 8.56 0.00 -0.59 -4.90 121.76 126.91 2bmg s ALA 121 Ca 0.37 -0.29 -0.18 0.00 0.00 0.00 0.00 51.96 51.86 2bmg s ALA 121 Cb -0.09 -2.34 -0.07 0.00 0.00 0.00 0.00 23.12 20.62 2bmg s ALA 121 CO 0.33 0.52 1.02 0.00 0.00 0.00 0.00 175.76 177.63 2bmg s LEU 123 N -3.95 4.02 0.65 0.00 1.43 -1.26 -0.02 118.68 119.55 2bmg s LEU 123 Ca 0.64 0.06 -0.05 0.00 -1.03 0.00 0.00 54.13 53.75 2bmg s LEU 123 Cb -0.14 -2.08 0.05 0.00 0.03 0.00 0.00 46.19 44.05 2bmg s LEU 123 CO 0.28 0.05 0.94 -2.16 0.23 0.00 0.00 176.35 175.69 2bmg s PRO 124 N 1.15 2.38 0.34 1.29 0.04 -1.26 -5.00 135.00 133.94 2bmg s PRO 124 Ca 0.07 -0.34 -0.26 0.00 0.04 0.00 0.00 61.00 60.50 2bmg s PRO 124 Cb -0.14 -2.26 -0.09 0.00 0.04 0.00 0.00 34.50 32.05 2bmg s PRO 124 CO 0.05 -1.04 1.01 -2.00 0.04 0.00 0.00 177.00 175.07 2bmg s GLU 124 N -5.10 4.45 0.09 4.56 2.56 -1.26 -4.92 118.70 119.08 2bmg s GLU 124 Ca 0.58 1.50 -0.33 0.00 0.00 0.00 0.00 54.97 56.72 2bmg s GLU 124 Cb -0.11 -2.80 -0.15 0.00 2.00 0.00 0.00 34.13 33.07 2bmg s GLU 124 CO 0.43 0.12 1.60 -0.09 -0.56 0.00 0.00 175.26 176.75 2bmg h ARG 125 N 3.08 -0.83 -0.15 4.30 2.43 -1.97 -0.21 114.38 121.04 2bmg h ARG 125 Ca -0.47 0.06 0.01 0.00 -0.81 0.00 0.00 59.98 58.77 2bmg h ARG 125 Cb 1.20 0.19 -0.01 0.00 -0.42 0.00 0.00 29.97 30.93 2bmg h ARG 125 CO 0.64 -0.55 0.06 -0.44 -1.51 0.00 0.00 179.97 178.17 2bmg h ASP 126 N -0.86 0.08 -0.11 -3.80 3.32 -1.95 -0.53 116.42 112.57 2bmg h ASP 126 Ca -0.04 0.01 -0.00 0.00 0.02 0.00 0.00 57.03 57.01 2bmg h ASP 126 Cb 0.75 -0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.29 2bmg h ASP 126 CO -0.03 0.07 0.07 -0.25 -1.72 0.00 0.00 179.24 177.37 2bmg h TRP 127 N 0.14 0.14 -0.13 4.55 7.01 -1.97 -0.31 115.95 125.38 2bmg h TRP 127 Ca 0.06 0.00 0.05 0.00 2.11 0.00 0.00 58.89 61.11 2bmg h TRP 127 Cb 0.02 -0.05 -0.06 0.00 -2.10 0.00 0.00 29.16 26.98 2bmg h TRP 127 CO -0.10 0.12 -0.27 0.00 -2.79 0.00 0.00 178.44 175.41 2bmg h ALA 128 N 1.01 -0.28 -0.42 2.65 0.00 -0.88 0.52 119.26 121.86 2bmg h ALA 128 Ca 0.04 0.03 0.03 0.00 0.00 0.00 0.00 54.91 55.01 2bmg h ALA 128 Cb 0.02 0.52 -0.02 0.00 0.00 0.00 0.00 17.79 18.31 2bmg h ALA 128 CO -0.01 -0.74 0.28 0.93 0.00 0.00 0.00 179.25 179.72 2bmg h GLU 129 N -0.34 0.44 0.00 0.00 5.08 -0.83 0.10 114.58 119.03 2bmg h GLU 129 Ca 0.10 -0.03 -0.08 0.00 -1.00 0.00 0.00 59.36 58.36 2bmg h GLU 129 Cb 0.49 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.63 2bmg h GLU 129 CO -0.32 0.29 -1.72 -1.13 -1.00 0.00 0.00 179.01 175.13 2bmg n SER 130 N -4.48 0.34 -0.01 1.42 3.41 -0.15 -4.45 113.62 109.71 2bmg n SER 130 Ca 0.04 0.14 -0.01 0.00 -0.26 0.00 0.00 58.87 58.78 2bmg n SER 130 Cb 0.15 1.20 -0.02 0.00 -0.26 0.00 0.00 64.21 65.28 2bmg n SER 130 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 2bmg n THR 131 N -2.53 0.15 -0.09 6.66 -1.04 0.17 -4.59 114.28 113.01 2bmg n THR 131 Ca -0.08 -0.10 -0.21 0.00 -2.04 0.00 0.00 64.05 61.62 2bmg n THR 131 Cb 0.69 -0.74 -0.12 0.00 -1.82 0.00 0.00 70.33 68.33 2bmg n THR 131 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 2bmg h LEU 131 N 0.00 0.03 -0.04 -4.42 3.38 -0.86 -3.37 115.31 110.02 2bmg h LEU 131 Ca -0.06 -0.57 0.00 0.00 0.09 0.00 0.00 57.88 57.34 2bmg h LEU 131 Cb 1.01 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.75 2bmg h LEU 131 CO 0.00 1.48 -0.00 0.23 0.09 0.00 0.00 178.44 180.24 2bmg n MET 131 N -4.39 0.95 0.00 1.13 2.81 -0.88 -2.43 117.12 114.31 2bmg n MET 131 Ca -0.30 -0.04 0.12 0.00 -1.81 0.00 0.00 57.70 55.66 2bmg n MET 131 Cb 0.69 -1.50 0.13 0.00 -0.71 0.00 0.00 33.22 31.83 2bmg n MET 131 CO 0.00 0.00 0.00 0.25 1.51 0.00 0.00 175.97 177.73 2bmg n THR 132 N -0.99 0.00 -1.34 2.03 -2.24 -1.26 -4.93 114.28 105.54 2bmg n THR 132 Ca 0.22 -0.37 -0.30 0.00 -2.27 0.00 0.00 64.05 61.33 2bmg n THR 132 Cb 0.14 1.24 0.10 0.00 -2.10 0.00 0.00 70.33 69.71 2bmg n THR 132 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 2bmg s GLN 133 N -2.19 1.91 0.02 -0.78 -1.52 -1.02 -4.98 119.66 111.10 2bmg s GLN 133 Ca 0.26 0.88 -0.25 0.00 -1.95 0.00 0.00 55.36 54.30 2bmg s GLN 133 Cb 0.19 -1.88 -0.18 0.00 -0.22 0.00 0.00 33.01 30.93 2bmg s GLN 133 CO 0.41 -1.81 1.42 -0.22 -0.25 0.00 0.00 175.29 174.84 2bmg h LYS 134 N -1.23 -0.12 -5.02 2.91 1.63 -1.92 -3.42 116.57 109.41 2bmg h LYS 134 Ca -0.47 0.01 -0.57 0.00 -0.85 0.00 0.00 60.65 58.77 2bmg h LYS 134 Cb 1.26 0.03 -0.13 0.00 -0.60 0.00 0.00 32.23 32.78 2bmg h LYS 134 CO 0.55 0.18 -0.50 0.95 -3.45 0.00 0.00 179.45 177.18 2bmg s THR 135 N -5.00 0.49 0.31 1.00 -4.23 -1.26 -0.74 115.64 106.21 2bmg s THR 135 Ca -0.15 -2.00 -0.06 0.00 -1.18 0.00 0.00 61.69 58.30 2bmg s THR 135 Cb 0.03 -2.30 0.00 0.00 1.34 0.00 0.00 72.50 71.57 2bmg s THR 135 CO 0.64 0.00 0.47 -0.83 -0.54 0.00 0.00 174.62 174.36 2bmg s GLY 136 N -3.61 1.13 -0.08 3.99 0.00 -1.02 -4.65 107.32 103.08 2bmg s GLY 136 Ca 0.23 -1.29 0.02 0.00 0.00 0.00 0.00 44.72 43.68 2bmg s GLY 136 CO 0.16 -0.88 -0.14 -0.42 0.00 0.00 0.00 173.10 171.82 2bmg s ILE 137 N -3.38 1.36 -0.01 0.90 1.01 0.18 -0.59 121.20 120.68 2bmg s ILE 137 Ca 0.28 -0.59 0.03 0.00 0.00 0.00 0.00 60.65 60.37 2bmg s ILE 137 Cb -0.00 -1.23 -0.03 0.00 0.01 0.00 0.00 42.46 41.21 2bmg s ILE 137 CO 0.16 0.41 -0.08 0.54 0.00 0.00 0.00 174.94 175.96 2bmg s VAL 138 N 0.74 3.53 0.06 2.92 0.11 -0.12 -0.88 120.40 126.76 2bmg s VAL 138 Ca -0.12 -0.77 -0.04 0.00 -2.93 0.00 0.00 61.98 58.11 2bmg s VAL 138 Cb -0.16 -2.51 -0.02 0.00 -1.53 0.00 0.00 36.38 32.16 2bmg s VAL 138 CO 0.03 0.43 0.05 -0.94 -3.33 0.00 0.00 175.10 171.34 2bmg s SER 139 N -1.30 0.32 0.00 3.54 1.04 -1.05 0.42 113.70 116.67 2bmg s SER 139 Ca 0.16 -0.79 0.00 0.00 0.48 0.00 0.00 55.95 55.80 2bmg s SER 139 Cb -0.11 0.24 0.00 0.00 0.10 0.00 0.00 66.02 66.25 2bmg s SER 139 CO 0.06 -0.60 0.00 0.61 0.98 0.00 0.00 173.24 174.29 2bmg n GLY 140 N 0.29 -0.34 1.22 7.32 0.00 -0.65 -4.16 105.19 108.87 2bmg n GLY 140 Ca -0.16 -1.17 0.08 0.00 0.00 0.00 0.00 46.02 44.77 2bmg n GLY 140 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2bmg n PHE 141 N -0.69 1.17 -0.06 1.61 3.72 -1.26 -1.78 117.46 120.17 2bmg n PHE 141 Ca 0.00 -0.67 -0.08 0.00 -0.05 0.00 0.00 57.45 56.65 2bmg n PHE 141 Cb 0.00 -0.24 0.08 0.00 -0.94 0.00 0.00 39.48 38.38 2bmg n PHE 141 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2bmg n GLY 142 N 0.50 -3.76 3.77 1.37 0.00 -1.24 -2.01 105.19 103.82 2bmg n GLY 142 Ca 0.22 -1.23 -0.35 0.00 0.00 0.00 0.00 46.02 44.65 2bmg n GLY 142 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2bmg s ARG 143 N -3.52 3.33 0.09 1.61 0.52 -0.89 -2.58 118.95 117.51 2bmg s ARG 143 Ca 0.17 1.60 0.23 0.00 -0.52 0.00 0.00 55.73 57.21 2bmg s ARG 143 Cb -0.03 -2.00 0.15 0.00 0.52 0.00 0.00 34.95 33.58 2bmg s ARG 143 CO 0.15 -0.87 1.13 0.25 0.02 0.00 0.00 175.30 175.98 2bmg n THR 144 N -1.36 0.27 -3.98 0.02 -2.24 -1.26 -0.31 114.28 105.42 2bmg n THR 144 Ca 0.12 -0.28 -0.09 0.00 -2.27 0.00 0.00 64.05 61.53 2bmg n THR 144 Cb 0.51 0.03 -0.10 0.00 -2.10 0.00 0.00 70.33 68.68 2bmg n THR 144 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 2bmg s HIS 145 N -3.21 0.31 0.39 4.78 3.76 -1.26 -4.19 115.29 115.86 2bmg s HIS 145 Ca 0.04 -0.68 0.09 0.00 -0.15 0.00 0.00 55.06 54.35 2bmg s HIS 145 Cb 0.14 -0.22 0.84 0.00 1.11 0.00 0.00 32.58 34.45 2bmg s HIS 145 CO 0.77 -0.35 1.96 1.49 -0.85 0.00 0.00 174.74 177.77 2bmg h GLU 147 N 3.65 0.61 0.00 1.40 4.81 -1.90 -3.04 114.58 120.12 2bmg h GLU 147 Ca -0.33 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 58.86 2bmg h GLU 147 Cb 1.18 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 30.42 2bmg h GLU 147 CO 0.54 0.41 -0.98 1.17 -0.73 0.00 0.00 179.01 179.41 2bmg n LYS 148 N -4.48 1.50 0.00 1.92 3.00 -1.26 -4.97 118.16 113.86 2bmg n LYS 148 Ca 0.11 -0.04 0.00 0.00 -0.00 0.00 0.00 58.31 58.38 2bmg n LYS 148 Cb 0.29 -1.27 0.00 0.00 0.00 0.00 0.00 35.03 34.04 2bmg n LYS 148 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2bmg n GLY 149 N 1.42 -2.30 3.78 3.14 0.00 -1.15 -5.08 105.19 105.00 2bmg n GLY 149 Ca 0.02 -1.40 -0.27 0.00 0.00 0.00 0.00 46.02 44.37 2bmg n GLY 149 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2bmg s ARG 150 N -0.79 2.21 0.51 1.61 1.70 -1.26 -4.90 118.95 118.03 2bmg s ARG 150 Ca 0.00 -2.01 -0.19 0.00 -0.47 0.00 0.00 55.73 53.05 2bmg s ARG 150 Cb 0.00 -1.90 -0.11 0.00 -0.57 0.00 0.00 34.95 32.37 2bmg s ARG 150 CO 0.00 -0.28 0.43 0.94 -1.08 0.00 0.00 175.30 175.31 2bmg n GLN 151 N -1.36 0.46 -3.64 3.89 -0.06 -1.26 -4.12 117.38 111.29 2bmg n GLN 151 Ca -0.05 0.17 -0.38 0.00 -2.00 0.00 0.00 57.00 54.75 2bmg n GLN 151 Cb 0.65 -1.53 -0.06 0.00 -4.06 0.00 0.00 30.24 25.24 2bmg n GLN 151 CO 0.00 0.00 0.00 0.45 -0.20 0.00 0.00 177.06 177.31 2bmg s SER 152 N -1.07 6.64 0.00 1.69 0.15 -0.85 -4.92 113.70 115.35 2bmg s SER 152 Ca 0.65 0.76 0.26 0.00 0.70 0.00 0.00 55.95 58.32 2bmg s SER 152 Cb -0.51 -2.18 0.68 0.00 -1.71 0.00 0.00 66.02 62.30 2bmg s SER 152 CO 0.57 0.34 1.52 0.35 1.20 0.00 0.00 173.24 177.23 2bmg n THR 153 N 1.97 0.00 -5.13 6.45 -2.24 -1.26 -4.75 114.28 109.32 2bmg n THR 153 Ca -0.16 -0.20 -0.32 0.00 -2.27 0.00 0.00 64.05 61.10 2bmg n THR 153 Cb 0.53 0.63 -0.16 0.00 -2.10 0.00 0.00 70.33 69.23 2bmg n THR 153 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 2bmg s ARG 154 N -2.34 2.86 0.15 -0.78 1.81 -1.26 -0.93 118.95 118.46 2bmg s ARG 154 Ca 0.27 -0.84 -0.31 0.00 -1.72 0.00 0.00 55.73 53.13 2bmg s ARG 154 Cb 0.20 -2.31 -0.09 0.00 -0.45 0.00 0.00 34.95 32.29 2bmg s ARG 154 CO 0.47 0.31 1.49 -1.17 -0.68 0.00 0.00 175.30 175.72 2bmg s LEU 155 N 0.04 4.37 0.32 2.53 2.96 -0.35 -4.70 118.68 123.85 2bmg s LEU 155 Ca -0.08 2.51 0.10 0.00 -0.22 0.00 0.00 54.13 56.43 2bmg s LEU 155 Cb -0.15 -3.59 -0.06 0.00 0.50 0.00 0.00 46.19 42.88 2bmg s LEU 155 CO 0.05 -0.75 -0.11 -0.54 -1.32 0.00 0.00 176.35 173.68 2bmg s LYS 156 N 1.02 1.75 0.05 1.98 1.02 -0.73 -0.94 119.74 123.88 2bmg s LYS 156 Ca 0.67 -1.88 0.03 0.00 0.02 0.00 0.00 55.97 54.81 2bmg s LYS 156 Cb -0.41 -1.64 -0.02 0.00 -0.52 0.00 0.00 37.83 35.24 2bmg s LYS 156 CO 0.32 0.17 -0.09 0.00 -0.92 0.00 0.00 175.35 174.83 2bmg s MET 157 N -3.60 0.58 -0.11 1.68 0.23 0.67 -1.64 119.30 117.11 2bmg s MET 157 Ca 0.31 -0.78 -0.05 0.00 -1.03 0.00 0.00 55.69 54.15 2bmg s MET 157 Cb 0.01 -0.39 0.05 0.00 -1.53 0.00 0.00 34.83 32.98 2bmg s MET 157 CO 0.15 0.07 0.25 -1.17 -2.03 0.00 0.00 175.02 172.30 2bmg s LEU 158 N -1.57 0.15 -0.18 0.18 2.96 0.17 -1.89 118.68 118.50 2bmg s LEU 158 Ca -0.08 0.54 -0.29 0.00 -0.22 0.00 0.00 54.13 54.07 2bmg s LEU 158 Cb -0.10 0.70 -0.01 0.00 0.50 0.00 0.00 46.19 47.28 2bmg s LEU 158 CO 0.01 -0.19 1.23 -0.70 -1.32 0.00 0.00 176.35 175.37 2bmg s GLU 159 N 1.69 4.22 -0.24 1.98 2.12 -1.26 -0.94 118.70 126.27 2bmg s GLU 159 Ca -0.05 1.59 0.01 0.00 0.36 0.00 0.00 54.97 56.87 2bmg s GLU 159 Cb -0.11 -3.75 0.04 0.00 0.26 0.00 0.00 34.13 30.57 2bmg s GLU 159 CO -0.08 -0.72 -0.11 0.14 -0.54 0.00 0.00 175.26 173.95 2bmg s VAL 160 N 3.50 2.44 0.39 3.70 -7.23 0.25 -4.94 120.40 118.50 2bmg s VAL 160 Ca 0.53 -1.22 -0.27 0.00 -1.81 0.00 0.00 61.98 59.22 2bmg s VAL 160 Cb -0.20 -2.26 -0.11 0.00 0.56 0.00 0.00 36.38 34.37 2bmg s VAL 160 CO 0.14 0.20 1.29 -2.65 -0.31 0.00 0.00 175.10 173.76 2bmg n PRO 161 N 4.58 2.05 -2.33 4.82 -0.02 -1.26 -2.43 135.00 140.40 2bmg n PRO 161 Ca -0.17 0.72 -0.41 0.00 -2.02 0.00 0.00 63.50 61.63 2bmg n PRO 161 Cb 0.46 -2.38 -0.03 0.00 -0.02 0.00 0.00 33.50 31.53 2bmg n PRO 161 CO 0.00 0.00 0.00 0.71 1.98 0.00 0.00 175.50 178.19 2bmg s TYR 162 N -1.15 3.38 -0.07 6.00 2.02 0.08 -1.89 117.35 125.71 2bmg s TYR 162 Ca 0.58 1.54 -0.02 0.00 -0.37 0.00 0.00 57.07 58.80 2bmg s TYR 162 Cb -0.53 -3.45 -0.03 0.00 -0.40 0.00 0.00 41.96 37.55 2bmg s TYR 162 CO 0.60 -1.13 0.03 0.08 -1.57 0.00 0.00 175.55 173.55 2bmg s VAL 163 N -0.89 4.48 0.18 0.71 1.01 -0.98 -4.93 120.40 119.98 2bmg s VAL 163 Ca 0.48 -0.25 -0.33 0.00 0.00 0.00 0.00 61.98 61.88 2bmg s VAL 163 Cb -0.35 -2.92 -0.14 0.00 0.00 0.00 0.00 36.38 32.97 2bmg s VAL 163 CO 0.44 0.56 1.55 -0.67 0.00 0.00 0.00 175.10 176.98 2bmg n ASP 164 N 1.94 3.11 -0.19 3.32 2.03 -1.26 -4.72 116.55 120.77 2bmg n ASP 164 Ca -0.18 1.10 0.09 0.00 0.52 0.00 0.00 54.79 56.32 2bmg n ASP 164 Cb 0.54 -1.44 0.38 0.00 -0.72 0.00 0.00 41.12 39.88 2bmg n ASP 164 CO 0.00 0.00 0.00 -0.09 -1.92 0.00 0.00 177.20 175.19 2bmg h ARG 165 N 5.59 0.66 0.45 -0.67 2.43 -1.97 -1.25 114.38 119.62 2bmg h ARG 165 Ca -0.45 -0.04 -0.02 0.00 -0.81 0.00 0.00 59.98 58.66 2bmg h ARG 165 Cb 1.25 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 30.66 2bmg h ARG 165 CO 0.86 0.44 -0.22 -0.97 -1.51 0.00 0.00 179.97 178.58 2bmg h ASN 166 N 0.68 -0.51 -1.00 -3.80 -1.24 -2.01 -2.92 115.58 104.78 2bmg h ASN 166 Ca 0.35 -0.09 0.20 0.00 0.71 0.00 0.00 56.30 57.46 2bmg h ASN 166 Cb 0.44 0.13 -0.11 0.00 0.73 0.00 0.00 38.32 39.51 2bmg h ASN 166 CO -0.13 -0.15 0.60 0.28 -1.29 0.00 0.00 177.43 176.74 2bmg h SER 167 N -0.92 0.75 0.25 1.15 0.02 -1.84 -2.25 113.55 110.71 2bmg h SER 167 Ca -0.06 0.10 0.01 0.00 -0.84 0.00 0.00 61.79 61.00 2bmg h SER 167 Cb 0.58 -0.03 -0.04 0.00 0.14 0.00 0.00 62.40 63.05 2bmg h SER 167 CO 0.10 0.24 -0.41 0.00 -1.14 0.00 0.00 176.83 175.62 2bmg h LYS 169 N -0.73 1.08 -0.64 0.00 1.57 -1.22 -2.57 116.57 114.06 2bmg h LYS 169 Ca -0.00 -0.06 0.05 0.00 -1.87 0.00 0.00 60.65 58.76 2bmg h LYS 169 Cb 0.71 -0.24 -0.05 0.00 0.08 0.00 0.00 32.23 32.72 2bmg h LYS 169 CO -0.16 0.71 0.35 -0.07 -0.57 0.00 0.00 179.45 179.71 2bmg h LEU 170 N 1.11 0.52 -0.63 2.94 3.38 -1.22 -2.60 115.31 118.81 2bmg h LEU 170 Ca 0.38 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.38 2bmg h LEU 170 Cb 0.09 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 40.76 2bmg h LEU 170 CO -0.15 0.34 0.00 0.77 0.09 0.00 0.00 178.44 179.50 2bmg h SER 171 N 0.66 0.00 -3.36 -0.43 4.64 -1.07 -3.45 113.55 110.54 2bmg h SER 171 Ca 0.28 0.00 -0.56 0.00 -0.47 0.00 0.00 61.79 61.04 2bmg h SER 171 Cb 0.16 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.20 2bmg h SER 171 CO -0.17 0.00 0.21 -0.55 -0.87 0.00 0.00 176.83 175.45 2bmg s SER 172 N -5.45 7.03 0.00 4.97 0.15 -0.98 -4.81 113.70 114.61 2bmg s SER 172 Ca 0.05 1.25 0.23 0.00 0.70 0.00 0.00 55.95 58.18 2bmg s SER 172 Cb 0.08 -2.45 1.05 0.00 -1.71 0.00 0.00 66.02 63.00 2bmg s SER 172 CO 0.57 -0.21 1.74 -1.20 1.20 0.00 0.00 173.24 175.34 2bmg n SER 173 N 4.20 0.00 -4.42 5.45 7.64 -1.26 -4.74 113.62 120.50 2bmg n SER 173 Ca 0.01 0.26 -0.23 0.00 1.01 0.00 0.00 58.87 59.92 2bmg n SER 173 Cb 0.51 -0.41 -0.11 0.00 -1.01 0.00 0.00 64.21 63.19 2bmg n SER 173 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 2bmg s PHE 174 N -2.81 2.12 -0.08 1.43 0.08 -1.26 -5.10 117.98 112.36 2bmg s PHE 174 Ca 0.16 -0.40 -0.30 0.00 0.12 0.00 0.00 56.93 56.51 2bmg s PHE 174 Cb 0.15 -0.98 -0.04 0.00 -0.57 0.00 0.00 43.02 41.58 2bmg s PHE 174 CO 0.39 0.54 1.42 -1.50 -0.10 0.00 0.00 175.22 175.97 2bmg s ILE 175 N -2.30 3.89 -0.43 0.64 -1.16 -1.26 -4.97 121.20 115.62 2bmg s ILE 175 Ca 0.24 1.15 -0.24 0.00 -0.51 0.00 0.00 60.65 61.29 2bmg s ILE 175 Cb -0.05 -3.74 0.02 0.00 0.61 0.00 0.00 42.46 39.30 2bmg s ILE 175 CO 0.11 -0.07 0.84 -0.63 -2.81 0.00 0.00 174.94 172.39 2bmg s ILE 176 N 3.26 4.61 0.84 2.00 -1.09 -1.26 -5.04 121.20 124.52 2bmg s ILE 176 Ca 0.63 0.71 -0.13 0.00 -2.23 0.00 0.00 60.65 59.63 2bmg s ILE 176 Cb -0.28 -4.33 0.10 0.00 -1.58 0.00 0.00 42.46 36.37 2bmg s ILE 176 CO 0.23 -0.67 1.19 0.42 -1.23 0.00 0.00 174.94 174.88 2bmg s THR 177 N 3.41 2.00 -0.94 2.92 -4.23 -1.26 -4.93 115.64 112.60 2bmg s THR 177 Ca 0.33 0.00 0.14 0.00 -1.18 0.00 0.00 61.69 60.98 2bmg s THR 177 Cb -0.12 -2.96 0.12 0.00 1.34 0.00 0.00 72.50 70.88 2bmg s THR 177 CO 0.22 0.00 1.44 1.67 -0.54 0.00 0.00 174.62 177.41 2bmg n GLN 178 N -3.44 0.02 -0.19 3.99 7.27 -1.26 -2.03 117.38 121.74 2bmg n GLN 178 Ca 0.09 0.29 0.09 0.00 0.07 0.00 0.00 57.00 57.54 2bmg n GLN 178 Cb 0.61 -1.54 0.25 0.00 2.41 0.00 0.00 30.24 31.97 2bmg n GLN 178 CO 0.00 0.00 0.00 0.09 0.07 0.00 0.00 177.06 177.22 2bmg n ASN 179 N -1.58 2.42 -4.10 1.69 3.02 -1.26 -4.89 115.26 110.56 2bmg n ASN 179 Ca 0.03 -1.92 -0.27 0.00 -0.03 0.00 0.00 54.58 52.38 2bmg n ASN 179 Cb 0.16 -0.25 -0.07 0.00 -0.61 0.00 0.00 39.78 39.00 2bmg n ASN 179 CO 0.00 0.00 0.00 0.23 -2.62 0.00 0.00 177.26 174.87 2bmg n MET 180 N 0.82 0.62 -3.60 3.52 0.00 -0.86 0.34 117.12 117.95 2bmg n MET 180 Ca 0.16 -3.56 -0.08 0.00 0.00 0.00 0.00 57.70 54.22 2bmg n MET 180 Cb 0.41 1.69 -0.05 0.00 0.00 0.00 0.00 33.22 35.27 2bmg n MET 180 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 175.97 175.38 2bmg s PHE 181 N -3.05 -0.26 0.10 2.03 -0.12 -0.76 -4.62 117.98 111.30 2bmg s PHE 181 Ca 0.16 0.47 -0.14 0.00 -0.05 0.00 0.00 56.93 57.37 2bmg s PHE 181 Cb 0.01 0.46 -0.06 0.00 -0.63 0.00 0.00 43.02 42.79 2bmg s PHE 181 CO 0.11 -0.23 0.49 0.00 -0.05 0.00 0.00 175.22 175.54 2bmg s ALA 183 N -1.35 -0.56 0.00 0.00 0.00 -0.88 -2.33 121.76 116.65 2bmg s ALA 183 Ca 0.33 0.40 0.00 0.00 0.00 0.00 0.00 51.96 52.69 2bmg s ALA 183 Cb -0.16 -0.17 0.00 0.00 0.00 0.00 0.00 23.12 22.79 2bmg s ALA 183 CO 0.18 -0.17 0.00 0.41 0.00 0.00 0.00 175.76 176.18 2bmg n GLY 184 N 2.22 0.63 3.32 0.00 0.00 -0.79 -1.78 105.19 108.80 2bmg n GLY 184 Ca -0.17 -1.91 -0.20 0.00 0.00 0.00 0.00 46.02 43.74 2bmg n GLY 184 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2bmg s TYR 185 N -1.98 1.72 0.04 1.61 2.02 -1.26 -4.02 117.35 115.47 2bmg s TYR 185 Ca 0.00 -0.52 -0.11 0.00 -0.37 0.00 0.00 57.07 56.07 2bmg s TYR 185 Cb 0.00 -0.84 -0.33 0.00 -0.40 0.00 0.00 41.96 40.39 2bmg s TYR 185 CO 0.00 0.31 1.01 0.22 -1.57 0.00 0.00 175.55 175.53 2bmg h ASP 185 N 3.04 0.68 0.00 2.29 3.58 -1.92 -3.42 116.42 120.66 2bmg h ASP 185 Ca -0.40 -0.75 0.00 0.00 0.42 0.00 0.00 57.03 56.30 2bmg h ASP 185 Cb 1.21 -0.22 0.00 0.00 1.72 0.00 0.00 39.33 42.04 2bmg h ASP 185 CO 0.55 1.59 -0.55 0.35 -2.88 0.00 0.00 179.24 178.30 2bmg n THR 185 N -3.64 0.00 -1.72 2.25 -2.24 -1.26 0.16 114.28 107.84 2bmg n THR 185 Ca -0.15 0.00 -0.43 0.00 -2.27 0.00 0.00 64.05 61.20 2bmg n THR 185 Cb 1.08 -0.50 -0.02 0.00 -2.10 0.00 0.00 70.33 68.78 2bmg n THR 185 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 2bmg n LYS 186 N -1.44 2.45 -1.09 -0.78 4.81 -1.26 -4.78 118.16 116.08 2bmg n LYS 186 Ca 0.00 0.87 -0.32 0.00 -0.87 0.00 0.00 58.31 57.99 2bmg n LYS 186 Cb 0.27 -2.62 -0.03 0.00 0.02 0.00 0.00 35.03 32.68 2bmg n LYS 186 CO 0.00 0.00 0.00 1.04 1.17 0.00 0.00 177.40 179.61 2bmg n GLN 187 N 2.24 3.06 -3.83 1.64 1.13 -1.26 -4.70 117.38 115.66 2bmg n GLN 187 Ca 0.10 -1.89 -0.14 0.00 -1.94 0.00 0.00 57.00 53.12 2bmg n GLN 187 Cb 0.35 -2.65 -0.15 0.00 0.11 0.00 0.00 30.24 27.89 2bmg n GLN 187 CO 0.00 0.00 0.00 -1.21 -1.44 0.00 0.00 177.06 174.41 2bmg s GLU 188 N 2.62 0.02 0.00 -1.09 2.02 -1.25 -4.16 118.70 116.86 2bmg s GLU 188 Ca 0.58 0.11 0.00 0.00 0.02 0.00 0.00 54.97 55.68 2bmg s GLU 188 Cb 0.15 -0.20 0.00 0.00 0.10 0.00 0.00 34.13 34.18 2bmg s GLU 188 CO -0.05 -0.11 0.00 -3.47 0.02 0.00 0.00 175.26 171.65 2bmg n ASP 189 N 3.81 0.00 -4.93 -0.19 2.03 -0.90 -4.34 116.55 112.03 2bmg n ASP 189 Ca -0.23 0.00 -0.25 0.00 0.52 0.00 0.00 54.79 54.83 2bmg n ASP 189 Cb 0.53 0.00 0.07 0.00 -0.72 0.00 0.00 41.12 41.00 2bmg n ASP 189 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2bmg s ALA 190 N -2.00 3.20 0.31 -1.67 0.00 -1.26 -0.72 121.76 119.62 2bmg s ALA 190 Ca 0.00 -0.95 0.01 0.00 0.00 0.00 0.00 51.96 51.02 2bmg s ALA 190 Cb 0.00 -2.57 -0.02 0.00 0.00 0.00 0.00 23.12 20.53 2bmg s ALA 190 CO 0.00 -1.27 0.34 0.00 0.00 0.00 0.00 175.76 174.83 2bmg s GLN 192 N -3.46 4.16 0.00 0.00 -2.07 -1.26 -2.22 119.66 114.81 2bmg s GLN 192 Ca 0.36 2.51 0.00 0.00 -1.82 0.00 0.00 55.36 56.41 2bmg s GLN 192 Cb 0.02 -3.06 0.00 0.00 -1.09 0.00 0.00 33.01 28.88 2bmg s GLN 192 CO 0.21 -0.61 0.00 0.41 -1.32 0.00 0.00 175.29 173.98 2bmg n GLY 193 N 2.69 0.94 0.00 2.60 0.00 -1.26 -2.08 105.19 108.08 2bmg n GLY 193 Ca 0.10 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.22 2bmg n GLY 193 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2bmg n ASP 194 N 0.00 0.86 -4.53 1.61 8.00 -0.94 -3.65 116.55 117.89 2bmg n ASP 194 Ca 0.00 -0.86 -0.47 0.00 0.71 0.00 0.00 54.79 54.18 2bmg n ASP 194 Cb 0.00 1.14 -0.03 0.00 -0.02 0.00 0.00 41.12 42.21 2bmg n ASP 194 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 2bmg n SER 195 N -1.60 0.56 0.00 -2.24 7.64 -1.26 -0.43 113.62 116.28 2bmg n SER 195 Ca 0.03 1.16 0.00 0.00 1.01 0.00 0.00 58.87 61.07 2bmg n SER 195 Cb 0.36 -1.17 0.00 0.00 -1.01 0.00 0.00 64.21 62.39 2bmg n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2bmg n GLY 196 N 1.59 0.95 3.83 0.23 0.00 0.82 0.59 105.19 113.19 2bmg n GLY 196 Ca 0.13 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.86 2bmg n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2bmg s GLY 197 N -2.00 1.66 0.28 -0.02 0.00 0.42 -2.35 107.32 105.32 2bmg s GLY 197 Ca 0.00 -0.90 -0.29 0.00 0.00 0.00 0.00 44.72 43.52 2bmg s GLY 197 CO 0.00 -0.21 1.08 -4.14 0.00 0.00 0.00 173.10 169.83 2bmg s PRO 198 N -5.60 4.63 -0.27 2.90 0.02 -1.26 -2.22 135.00 133.19 2bmg s PRO 198 Ca 0.69 1.76 -0.01 0.00 0.02 0.00 0.00 61.00 63.46 2bmg s PRO 198 Cb -0.09 -3.15 0.09 0.00 0.02 0.00 0.00 34.50 31.37 2bmg s PRO 198 CO 0.53 0.21 0.07 -1.58 -0.33 0.00 0.00 177.00 175.90 2bmg s HIS 199 N -1.20 1.58 0.15 6.54 2.46 -0.90 -2.53 115.29 121.40 2bmg s HIS 199 Ca 0.45 -1.50 0.09 0.00 0.47 0.00 0.00 55.06 54.58 2bmg s HIS 199 Cb -0.31 -1.51 -0.04 0.00 -0.13 0.00 0.00 32.58 30.59 2bmg s HIS 199 CO 0.39 -0.80 -0.17 0.14 -2.47 0.00 0.00 174.74 171.84 2bmg s VAL 200 N 1.66 2.86 -0.09 0.89 -7.23 -0.06 0.01 120.40 118.44 2bmg s VAL 200 Ca 0.05 -1.64 0.03 0.00 -1.81 0.00 0.00 61.98 58.62 2bmg s VAL 200 Cb -0.17 -2.36 -0.01 0.00 0.56 0.00 0.00 36.38 34.40 2bmg s VAL 200 CO -0.19 -0.00 -0.21 -0.89 -0.31 0.00 0.00 175.10 173.50 2bmg s THR 201 N -1.40 2.40 0.06 5.32 2.01 -0.35 0.52 115.64 124.19 2bmg s THR 201 Ca 0.20 -0.91 -0.20 0.00 0.31 0.00 0.00 61.69 61.09 2bmg s THR 201 Cb -0.10 -1.94 -0.06 0.00 0.01 0.00 0.00 72.50 70.41 2bmg s THR 201 CO 0.12 0.56 0.58 -0.60 -0.69 0.00 0.00 174.62 174.59 2bmg s ARG 202 N 0.14 4.25 -0.12 4.92 3.52 -1.26 -1.85 118.95 128.54 2bmg s ARG 202 Ca -0.11 0.75 -0.04 0.00 -0.13 0.00 0.00 55.73 56.21 2bmg s ARG 202 Cb -0.16 -3.27 0.06 0.00 -1.56 0.00 0.00 34.95 30.03 2bmg s ARG 202 CO 0.06 0.56 0.21 0.12 -0.81 0.00 0.00 175.30 175.45 2bmg s PHE 203 N -0.86 -0.29 -1.44 5.12 5.36 0.26 -4.91 117.98 121.21 2bmg s PHE 203 Ca 0.30 0.68 -0.00 0.00 -0.96 0.00 0.00 56.93 56.95 2bmg s PHE 203 Cb -0.19 -0.19 0.00 0.00 -0.34 0.00 0.00 43.02 42.30 2bmg s PHE 203 CO 0.19 -0.37 0.31 1.63 -1.46 0.00 0.00 175.22 175.52 2bmg n LYS 204 N 5.33 -2.69 -1.34 10.12 5.02 -1.26 -0.84 118.16 132.51 2bmg n LYS 204 Ca -0.05 0.32 -0.12 0.00 -2.02 0.00 0.00 58.31 56.44 2bmg n LYS 204 Cb 0.50 -4.28 -0.05 0.00 -0.02 0.00 0.00 35.03 31.17 2bmg n LYS 204 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 2bmg n ASP 205 N -2.96 -4.60 -4.15 4.39 8.00 -1.26 -5.00 116.55 110.97 2bmg n ASP 205 Ca -0.32 0.29 -0.26 0.00 0.71 0.00 0.00 54.79 55.21 2bmg n ASP 205 Cb 0.69 -3.12 -0.16 0.00 -0.02 0.00 0.00 41.12 38.51 2bmg n ASP 205 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2bmg s THR 206 N -2.36 1.44 -0.19 -3.53 2.01 -0.02 -5.13 115.64 107.86 2bmg s THR 206 Ca 0.00 -0.73 -0.06 0.00 0.31 0.00 0.00 61.69 61.21 2bmg s THR 206 Cb 0.00 -1.23 -0.03 0.00 0.01 0.00 0.00 72.50 71.25 2bmg s THR 206 CO 0.00 0.41 0.03 -0.31 -0.69 0.00 0.00 174.62 174.06 2bmg s TYR 207 N -0.06 3.13 -0.02 4.92 1.51 -1.26 -0.58 117.35 124.99 2bmg s TYR 207 Ca -0.01 -0.18 0.03 0.00 -1.01 0.00 0.00 57.07 55.90 2bmg s TYR 207 Cb -0.11 -2.07 -0.03 0.00 -0.11 0.00 0.00 41.96 39.64 2bmg s TYR 207 CO 0.02 -0.04 -0.10 -0.06 -1.11 0.00 0.00 175.55 174.26 2bmg s PHE 208 N 0.66 2.82 -0.14 2.71 0.08 -0.77 -2.08 117.98 121.25 2bmg s PHE 208 Ca 0.01 -0.08 -0.29 0.00 0.12 0.00 0.00 56.93 56.69 2bmg s PHE 208 Cb -0.14 -1.62 -0.03 0.00 -0.57 0.00 0.00 43.02 40.67 2bmg s PHE 208 CO 0.02 0.31 1.52 0.08 -0.10 0.00 0.00 175.22 177.05 2bmg s VAL 209 N -0.90 3.83 -0.02 -0.44 1.01 0.97 -1.22 120.40 123.64 2bmg s VAL 209 Ca 0.15 0.98 0.04 0.00 0.00 0.00 0.00 61.98 63.14 2bmg s VAL 209 Cb -0.11 -3.70 -0.06 0.00 0.00 0.00 0.00 36.38 32.51 2bmg s VAL 209 CO 0.05 -0.17 0.09 0.35 0.00 0.00 0.00 175.10 175.42 2bmg n THR 210 N 5.76 0.00 -3.81 3.92 -2.24 0.10 -4.59 114.28 113.42 2bmg n THR 210 Ca 0.17 -0.12 -0.08 0.00 -2.27 0.00 0.00 64.05 61.75 2bmg n THR 210 Cb 0.44 0.47 -0.03 0.00 -2.10 0.00 0.00 70.33 69.11 2bmg n THR 210 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2bmg s GLY 211 N -2.34 -0.07 -0.13 3.38 0.00 -0.00 -2.65 107.32 105.51 2bmg s GLY 211 Ca -0.01 -0.28 0.01 0.00 0.00 0.00 0.00 44.72 44.45 2bmg s GLY 211 CO 0.16 -0.16 -0.16 -0.42 0.00 0.00 0.00 173.10 172.52 2bmg s ILE 212 N -3.91 1.63 -0.27 0.90 1.01 -0.93 -2.11 121.20 117.53 2bmg s ILE 212 Ca 0.11 -0.70 -0.31 0.00 0.00 0.00 0.00 60.65 59.76 2bmg s ILE 212 Cb -0.04 -1.49 -0.07 0.00 0.01 0.00 0.00 42.46 40.87 2bmg s ILE 212 CO 0.03 0.47 2.22 0.52 0.00 0.00 0.00 174.94 178.18 2bmg n VAL 213 N 4.44 0.28 -0.01 2.92 0.31 -0.94 0.12 118.33 125.45 2bmg n VAL 213 Ca -0.18 -0.40 -0.01 0.00 -0.01 0.00 0.00 64.34 63.74 2bmg n VAL 213 Cb 0.51 -2.25 -0.00 0.00 -0.91 0.00 0.00 33.84 31.19 2bmg n VAL 213 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 2bmg n SER 214 N 11.13 0.14 -3.47 4.52 2.88 -0.70 -0.13 113.62 127.99 2bmg n SER 214 Ca 0.34 0.02 -0.09 0.00 -1.33 0.00 0.00 58.87 57.81 2bmg n SER 214 Cb 0.37 -0.49 -0.02 0.00 -0.75 0.00 0.00 64.21 63.33 2bmg n SER 214 CO 0.00 0.00 0.00 -1.66 -1.23 0.00 0.00 175.04 172.15 2bmg s TRP 215 N -1.13 0.24 -0.05 0.66 1.48 -0.18 -4.84 118.94 115.12 2bmg s TRP 215 Ca -0.02 -0.72 -0.30 0.00 -1.06 0.00 0.00 56.10 54.00 2bmg s TRP 215 Cb 0.00 0.51 0.11 0.00 -1.16 0.00 0.00 33.47 32.94 2bmg s TRP 215 CO 0.03 -1.28 1.00 0.20 -4.06 0.00 0.00 176.95 172.83 2bmg s GLY 216 N -3.05 -0.40 -1.14 3.67 0.00 -1.26 0.68 107.32 105.82 2bmg s GLY 216 Ca 0.18 1.11 -0.10 0.00 0.00 0.00 0.00 44.72 45.92 2bmg s GLY 216 CO 0.11 0.36 1.21 1.18 0.00 0.00 0.00 173.10 175.96 2bmg n GLU 217 N -0.22 3.54 0.00 2.90 1.02 -1.26 -4.93 120.64 121.68 2bmg n GLU 217 Ca -0.06 -4.32 0.00 0.00 -0.02 0.00 0.00 57.16 52.76 2bmg n GLU 217 Cb 0.61 -2.66 0.00 0.00 -0.02 0.00 0.00 31.44 29.36 2bmg n GLU 217 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2bmg n GLY 219 N 2.95 -1.79 2.96 0.62 0.00 -1.26 -4.66 105.19 104.00 2bmg n GLY 219 Ca 0.27 -1.79 -0.29 0.00 0.00 0.00 0.00 46.02 44.22 2bmg n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bmg n ALA 221 N 4.83 -0.10 -1.63 0.00 0.00 -1.26 -4.75 120.51 117.60 2bmg n ALA 221 Ca -0.14 0.10 -0.40 0.00 0.00 0.00 0.00 53.44 53.00 2bmg n ALA 221 Cb 0.49 -1.59 0.02 0.00 0.00 0.00 0.00 19.45 18.37 2bmg n ALA 221 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2bmg n ARG 222 N -0.11 1.39 -1.99 0.00 1.74 -1.26 -4.70 116.66 111.72 2bmg n ARG 222 Ca -0.06 0.50 -0.41 0.00 -0.77 0.00 0.00 57.85 57.10 2bmg n ARG 222 Cb 0.53 -2.15 -0.02 0.00 -1.02 0.00 0.00 32.46 29.79 2bmg n ARG 222 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 2bmg s LYS 223 N -2.22 4.25 0.00 5.56 1.02 -1.26 -2.17 119.74 124.92 2bmg s LYS 223 Ca 0.65 2.33 0.00 0.00 0.02 0.00 0.00 55.97 58.97 2bmg s LYS 223 Cb -0.51 -3.11 0.00 0.00 -0.52 0.00 0.00 37.83 33.69 2bmg s LYS 223 CO 0.55 -0.46 0.00 0.41 -0.92 0.00 0.00 175.35 174.93 2bmg n GLY 223 N 2.40 0.75 3.39 -3.33 0.00 0.44 -4.99 105.19 103.84 2bmg n GLY 223 Ca 0.08 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.89 2bmg n GLY 223 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2bmg s LYS 224 N -0.14 1.46 0.29 1.61 -0.14 -0.92 -4.75 119.74 117.16 2bmg s LYS 224 Ca 0.00 -1.65 0.03 0.00 -1.36 0.00 0.00 55.97 52.99 2bmg s LYS 224 Cb 0.00 -1.39 -0.06 0.00 -1.68 0.00 0.00 37.83 34.71 2bmg s LYS 224 CO 0.00 0.25 0.08 0.71 -0.76 0.00 0.00 175.35 175.62 2bmg s TYR 225 N -2.74 1.76 0.15 3.18 2.02 -1.26 -4.53 117.35 115.93 2bmg s TYR 225 Ca 0.25 -1.07 -0.22 0.00 -0.37 0.00 0.00 57.07 55.66 2bmg s TYR 225 Cb -0.03 -1.10 -0.08 0.00 -0.40 0.00 0.00 41.96 40.36 2bmg s TYR 225 CO 0.10 -0.16 0.69 0.20 -1.57 0.00 0.00 175.55 174.81 2bmg s GLY 226 N -3.41 2.77 -0.30 0.71 0.00 -0.73 -4.48 107.32 101.88 2bmg s GLY 226 Ca 0.37 0.21 -0.07 0.00 0.00 0.00 0.00 44.72 45.23 2bmg s GLY 226 CO 0.15 0.65 0.09 -0.42 0.00 0.00 0.00 173.10 173.57 2bmg s ILE 227 N -1.22 4.05 0.22 0.90 -1.09 0.21 -2.07 121.20 122.20 2bmg s ILE 227 Ca 0.35 -0.68 0.06 0.00 -2.23 0.00 0.00 60.65 58.15 2bmg s ILE 227 Cb -0.21 -3.09 -0.04 0.00 -1.58 0.00 0.00 42.46 37.54 2bmg s ILE 227 CO 0.23 0.06 0.16 -0.31 -1.23 0.00 0.00 174.94 173.85 2bmg s TYR 228 N 1.51 3.10 0.05 3.97 1.51 -0.13 -1.01 117.35 126.35 2bmg s TYR 228 Ca 0.03 -0.08 -0.28 0.00 -1.01 0.00 0.00 57.07 55.73 2bmg s TYR 228 Cb -0.17 -1.43 -0.05 0.00 -0.11 0.00 0.00 41.96 40.19 2bmg s TYR 228 CO 0.03 0.52 0.88 0.99 -1.11 0.00 0.00 175.55 176.87 2bmg s THR 229 N -1.98 4.70 -0.52 -0.71 2.01 0.12 -1.82 115.64 117.43 2bmg s THR 229 Ca 0.32 1.88 -0.28 0.00 0.31 0.00 0.00 61.69 63.92 2bmg s THR 229 Cb -0.09 -4.23 0.01 0.00 0.01 0.00 0.00 72.50 68.20 2bmg s THR 229 CO 0.24 0.29 1.43 -0.75 -0.69 0.00 0.00 174.62 175.14 2bmg s LYS 230 N 0.26 3.35 0.18 4.92 2.20 0.15 -2.19 119.74 128.62 2bmg s LYS 230 Ca 0.45 0.58 -0.10 0.00 -0.36 0.00 0.00 55.97 56.54 2bmg s LYS 230 Cb -0.21 -4.11 0.07 0.00 -1.51 0.00 0.00 37.83 32.07 2bmg s LYS 230 CO 0.26 -1.87 1.66 0.28 -0.36 0.00 0.00 175.35 175.32 2bmg h VAL 231 N 6.42 1.26 -0.03 4.02 2.07 -1.81 -2.91 116.25 125.27 2bmg h VAL 231 Ca -0.27 -1.06 0.01 0.00 0.82 0.00 0.00 66.70 66.20 2bmg h VAL 231 Cb 1.10 0.75 -0.00 0.00 -1.52 0.00 0.00 31.29 31.62 2bmg h VAL 231 CO 1.16 0.39 0.16 0.71 0.02 0.00 0.00 177.57 180.00 2bmg h THR 232 N 0.94 0.09 -0.01 2.57 1.35 -1.89 -0.08 112.91 115.88 2bmg h THR 232 Ca 0.18 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 66.04 2bmg h THR 232 Cb 0.48 0.85 0.00 0.00 -1.73 0.00 0.00 68.15 67.75 2bmg h THR 232 CO 0.02 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 175.29 2bmg n ALA 233 N -2.05 2.65 -1.75 6.62 0.00 -1.10 -3.75 120.51 121.12 2bmg n ALA 233 Ca -0.02 -0.25 0.00 0.00 0.00 0.00 0.00 53.44 53.18 2bmg n ALA 233 Cb 0.23 -1.39 0.00 0.00 0.00 0.00 0.00 19.45 18.28 2bmg n ALA 233 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 2bmg n PHE 234 N -0.68 0.00 -0.09 0.00 3.72 -0.06 -4.89 117.46 115.46 2bmg n PHE 234 Ca 0.21 0.00 -0.08 0.00 -0.05 0.00 0.00 57.45 57.53 2bmg n PHE 234 Cb 0.16 -0.03 -0.00 0.00 -0.94 0.00 0.00 39.48 38.66 2bmg n PHE 234 CO 0.00 0.00 0.00 -0.07 -0.05 0.00 0.00 176.76 176.64 2bmg h LEU 235 N 0.00 0.25 -1.12 4.37 3.38 -1.60 0.34 115.31 120.93 2bmg h LEU 235 Ca 0.00 0.01 -0.04 0.00 0.09 0.00 0.00 57.88 57.94 2bmg h LEU 235 Cb 1.29 -0.04 -0.03 0.00 0.09 0.00 0.00 40.66 41.97 2bmg h LEU 235 CO 0.00 0.18 0.18 0.07 0.09 0.00 0.00 178.44 178.96 2bmg h LYS 236 N 0.34 0.80 -0.60 1.13 -0.00 -1.90 0.62 116.57 116.96 2bmg h LYS 236 Ca 0.13 -0.14 -0.08 0.00 -0.00 0.00 0.00 60.65 60.56 2bmg h LYS 236 Cb 0.03 -0.13 -0.02 0.00 -0.00 0.00 0.00 32.23 32.10 2bmg h LYS 236 CO -0.08 0.69 0.06 2.35 -0.00 0.00 0.00 179.45 182.47 2bmg h TRP 237 N 0.79 1.08 -0.09 0.07 7.01 -1.65 -1.17 115.95 121.98 2bmg h TRP 237 Ca 0.18 -0.15 -0.02 0.00 2.11 0.00 0.00 58.89 61.01 2bmg h TRP 237 Cb 0.21 -0.29 -0.00 0.00 -2.10 0.00 0.00 29.16 26.98 2bmg h TRP 237 CO 0.01 0.93 -0.01 0.82 -2.79 0.00 0.00 178.44 177.40 2bmg h ILE 238 N 0.94 1.28 -0.09 2.65 2.04 0.54 0.10 117.51 124.97 2bmg h ILE 238 Ca 0.18 -0.88 0.04 0.00 1.00 0.00 0.00 64.86 65.20 2bmg h ILE 238 Cb 0.46 1.68 -0.04 0.00 -0.74 0.00 0.00 36.82 38.19 2bmg h ILE 238 CO 0.02 0.25 -0.15 0.44 0.00 0.00 0.00 178.15 178.71 2bmg h ASP 239 N -0.14 -0.46 -0.69 1.72 3.32 -0.78 -0.61 116.42 118.78 2bmg h ASP 239 Ca 0.02 0.08 0.09 0.00 0.02 0.00 0.00 57.03 57.25 2bmg h ASP 239 Cb 0.39 0.21 -0.07 0.00 0.22 0.00 0.00 39.33 40.08 2bmg h ASP 239 CO 0.01 -0.20 0.33 0.03 -1.72 0.00 0.00 179.24 177.69 2bmg h ARG 240 N -0.21 0.55 0.00 3.56 3.08 -1.14 0.21 114.38 120.43 2bmg h ARG 240 Ca 0.08 -0.03 -0.02 0.00 0.07 0.00 0.00 59.98 60.08 2bmg h ARG 240 Cb 0.32 -0.12 -0.00 0.00 0.08 0.00 0.00 29.97 30.24 2bmg h ARG 240 CO -0.21 0.37 -0.10 0.77 -1.07 0.00 0.00 179.97 179.73 2bmg h SER 241 N 0.57 0.00 0.14 7.04 0.02 0.11 -3.01 113.55 118.43 2bmg h SER 241 Ca 0.34 0.00 -0.36 0.00 -0.84 0.00 0.00 61.79 60.93 2bmg h SER 241 Cb 0.37 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.91 2bmg h SER 241 CO -0.28 0.10 -1.93 0.24 -1.14 0.00 0.00 176.83 173.83 2bmg h MET 242 N 0.00 0.30 -0.53 3.45 2.86 0.29 -3.33 114.93 117.98 2bmg h MET 242 Ca -0.00 -0.52 0.15 0.00 -2.06 0.00 0.00 59.70 57.27 2bmg h MET 242 Cb 0.19 0.19 -0.02 0.00 0.06 0.00 0.00 31.60 32.02 2bmg h MET 242 CO 0.01 1.25 0.54 0.87 1.06 0.00 0.00 176.91 180.65 2bmg h LYS 243 N 0.08 0.00 0.00 1.72 6.56 -0.52 -3.52 116.57 120.89 2bmg h LYS 243 Ca -0.40 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.19 2bmg h LYS 243 Cb 2.05 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 33.71 2bmg h LYS 243 CO 0.11 0.00 0.00 0.25 -2.06 0.00 0.00 179.45 177.75