#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kbo s ILE 3 N 0.00 1.68 0.02 -3.67 1.01 -0.02 0.12 121.20 120.34 3kbo s ILE 3 Ca 0.00 -0.85 0.03 0.00 0.00 0.00 0.00 60.65 59.84 3kbo s ILE 3 Cb 0.00 -1.44 -0.04 0.00 0.01 0.00 0.00 42.46 40.99 3kbo s ILE 3 CO 0.00 0.48 -0.05 0.27 0.00 0.00 0.00 174.94 175.64 3kbo s ILE 4 N 0.05 3.77 -0.03 2.92 -4.36 -0.10 -1.25 121.20 122.20 3kbo s ILE 4 Ca -0.06 -0.82 0.03 0.00 -0.26 0.00 0.00 60.65 59.54 3kbo s ILE 4 Cb -0.13 -2.68 0.00 0.00 1.25 0.00 0.00 42.46 40.90 3kbo s ILE 4 CO 0.04 0.33 -0.10 0.12 0.24 0.00 0.00 174.94 175.56 3kbo s PHE 5 N -1.08 1.05 -0.08 1.37 5.36 -0.10 -0.80 117.98 123.70 3kbo s PHE 5 Ca 0.19 -0.27 -0.04 0.00 -0.96 0.00 0.00 56.93 55.85 3kbo s PHE 5 Cb -0.11 -0.74 0.04 0.00 -0.34 0.00 0.00 43.02 41.86 3kbo s PHE 5 CO 0.10 -0.11 0.18 -0.47 -1.46 0.00 0.00 175.22 173.46 3kbo s TYR 6 N 0.19 -0.22 -0.23 10.12 5.04 -0.33 0.27 117.35 132.20 3kbo s TYR 6 Ca -0.03 0.57 -0.17 0.00 -2.44 0.00 0.00 57.07 55.00 3kbo s TYR 6 Cb -0.09 -0.01 0.07 0.00 0.35 0.00 0.00 41.96 42.27 3kbo s TYR 6 CO 0.01 -0.17 0.59 -1.58 -1.34 0.00 0.00 175.55 173.05 3kbo s HIS 7 N 0.96 -0.78 -0.74 4.97 2.46 -1.26 -2.66 115.29 118.24 3kbo s HIS 7 Ca -0.07 1.71 0.25 0.00 0.47 0.00 0.00 55.06 57.41 3kbo s HIS 7 Cb -0.09 0.37 0.92 0.00 -0.13 0.00 0.00 32.58 33.64 3kbo s HIS 7 CO -0.05 -0.39 1.76 -0.35 -2.47 0.00 0.00 174.74 173.23 3kbo n PRO 8 N 3.59 0.17 0.00 2.88 -0.04 -1.26 -4.29 135.00 136.05 3kbo n PRO 8 Ca -0.18 0.23 0.00 0.00 -0.04 0.00 0.00 63.50 63.52 3kbo n PRO 8 Cb 0.57 -1.74 0.00 0.00 -0.04 0.00 0.00 33.50 32.29 3kbo n PRO 8 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 3kbo n THR 9 N -2.04 0.00 -1.53 0.52 -2.24 -1.26 -5.10 114.28 102.63 3kbo n THR 9 Ca 0.05 0.00 -0.34 0.00 -2.27 0.00 0.00 64.05 61.48 3kbo n THR 9 Cb 0.33 -0.23 0.08 0.00 -2.10 0.00 0.00 70.33 68.42 3kbo n THR 9 CO 0.00 0.00 0.00 -0.36 -0.57 0.00 0.00 175.07 174.14 3kbo s PHE 10 N -1.24 2.12 -0.57 4.78 0.40 -1.26 -4.91 117.98 117.30 3kbo s PHE 10 Ca 0.00 1.58 -0.27 0.00 -0.60 0.00 0.00 56.93 57.64 3kbo s PHE 10 Cb 0.00 -3.47 0.00 0.00 0.51 0.00 0.00 43.02 40.07 3kbo s PHE 10 CO 0.00 -2.53 1.56 1.21 0.70 0.00 0.00 175.22 176.17 3kbo s ASN 11 N -1.98 5.86 0.18 1.36 2.47 -1.26 -4.87 114.94 116.69 3kbo s ASN 11 Ca 0.75 0.32 -0.14 0.00 0.42 0.00 0.00 52.86 54.21 3kbo s ASN 11 Cb -0.29 -2.54 0.09 0.00 -1.45 0.00 0.00 41.25 37.06 3kbo s ASN 11 CO 0.43 -1.92 1.82 0.00 -3.72 0.00 0.00 177.10 173.72 3kbo h ALA 12 N 12.24 0.68 -0.53 1.71 0.00 -1.92 -2.63 119.26 128.81 3kbo h ALA 12 Ca -0.27 -0.02 0.08 0.00 0.00 0.00 0.00 54.91 54.69 3kbo h ALA 12 Cb 1.11 -0.17 -0.06 0.00 0.00 0.00 0.00 17.79 18.67 3kbo h ALA 12 CO 1.19 0.06 0.19 0.00 0.00 0.00 0.00 179.25 180.68 3kbo h ALA 13 N 1.22 0.66 -0.21 0.00 0.00 -1.99 0.91 119.26 119.85 3kbo h ALA 13 Ca 0.21 0.07 0.01 0.00 0.00 0.00 0.00 54.91 55.20 3kbo h ALA 13 Cb -0.01 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 3kbo h ALA 13 CO -0.08 -0.21 0.12 2.35 0.00 0.00 0.00 179.25 181.43 3kbo h TRP 14 N 0.36 0.23 -0.46 0.00 7.01 -1.90 -0.89 115.95 120.30 3kbo h TRP 14 Ca 0.26 0.01 -0.05 0.00 2.11 0.00 0.00 58.89 61.22 3kbo h TRP 14 Cb 0.30 -0.07 -0.02 0.00 -2.10 0.00 0.00 29.16 27.27 3kbo h TRP 14 CO -0.17 0.14 0.09 -1.49 -2.79 0.00 0.00 178.44 174.21 3kbo h TRP 15 N 0.25 0.80 -0.20 2.65 4.06 -1.03 0.11 115.95 122.59 3kbo h TRP 15 Ca 0.08 -0.11 0.01 0.00 2.06 0.00 0.00 58.89 60.94 3kbo h TRP 15 Cb -0.00 -0.22 -0.02 0.00 -1.00 0.00 0.00 29.16 27.92 3kbo h TRP 15 CO -0.08 0.75 0.09 0.28 -3.56 0.00 0.00 178.44 175.92 3kbo h VAL 16 N 0.63 0.98 0.12 1.49 2.07 -0.68 -1.15 116.25 119.71 3kbo h VAL 16 Ca 0.14 -0.07 -0.01 0.00 0.82 0.00 0.00 66.70 67.59 3kbo h VAL 16 Cb 0.37 0.77 0.00 0.00 -1.52 0.00 0.00 31.29 30.90 3kbo h VAL 16 CO 0.01 0.04 -0.06 -1.13 0.02 0.00 0.00 177.57 176.45 3kbo h ASN 17 N 0.20 -0.14 -0.94 0.57 -1.24 -0.98 -1.82 115.58 111.23 3kbo h ASN 17 Ca 0.08 -0.11 0.09 0.00 0.71 0.00 0.00 56.30 57.08 3kbo h ASN 17 Cb 0.03 0.04 -0.07 0.00 0.73 0.00 0.00 38.32 39.05 3kbo h ASN 17 CO -0.07 0.03 0.60 0.00 -1.29 0.00 0.00 177.43 176.70 3kbo h ALA 18 N 0.57 1.56 -0.09 1.57 0.00 -0.64 0.15 119.26 122.39 3kbo h ALA 18 Ca -0.02 -0.00 -0.21 0.00 0.00 0.00 0.00 54.91 54.68 3kbo h ALA 18 Cb 0.24 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.80 3kbo h ALA 18 CO 0.03 0.25 -0.79 1.25 0.00 0.00 0.00 179.25 179.99 3kbo h LEU 19 N 0.98 0.66 -0.73 0.00 5.85 -1.12 0.21 115.31 121.15 3kbo h LEU 19 Ca 0.43 -0.45 -0.10 0.00 0.84 0.00 0.00 57.88 58.61 3kbo h LEU 19 Cb 0.37 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 41.18 3kbo h LEU 19 CO -0.19 1.22 -0.09 -0.33 -0.34 0.00 0.00 178.44 178.71 3kbo h GLU 20 N 0.36 0.89 -0.43 1.25 5.08 -0.84 0.16 114.58 121.05 3kbo h GLU 20 Ca -0.05 -0.30 -0.15 0.00 -1.00 0.00 0.00 59.36 57.87 3kbo h GLU 20 Cb 1.40 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 30.56 3kbo h GLU 20 CO 0.15 0.94 -0.30 0.87 -1.00 0.00 0.00 179.01 179.66 3kbo h LYS 21 N 0.80 0.96 -0.17 2.33 1.57 -0.80 -2.95 116.57 118.31 3kbo h LYS 21 Ca 0.13 -0.46 -0.10 0.00 -1.87 0.00 0.00 60.65 58.35 3kbo h LYS 21 Cb 0.60 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.89 3kbo h LYS 21 CO 0.04 1.12 -0.34 0.00 -0.57 0.00 0.00 179.45 179.70 3kbo h ALA 22 N 0.81 1.10 -3.14 3.86 0.00 -0.45 -3.37 119.26 118.08 3kbo h ALA 22 Ca 0.08 -0.38 -0.62 0.00 0.00 0.00 0.00 54.91 53.99 3kbo h ALA 22 Cb 0.89 -0.10 -0.41 0.00 0.00 0.00 0.00 17.79 18.17 3kbo h ALA 22 CO 0.08 0.57 -0.68 -0.51 0.00 0.00 0.00 179.25 178.71 3kbo s LEU 23 N -8.45 3.57 0.59 0.00 1.43 0.55 -5.01 118.68 111.37 3kbo s LEU 23 Ca -0.06 -2.96 0.29 0.00 -1.03 0.00 0.00 54.13 50.37 3kbo s LEU 23 Cb 0.13 -1.34 1.76 0.00 0.03 0.00 0.00 46.19 46.78 3kbo s LEU 23 CO 0.78 -0.23 2.22 -0.65 0.23 0.00 0.00 176.35 178.71 3kbo h PRO 24 N 6.43 0.00 -0.67 1.29 0.11 -1.70 -1.26 132.00 136.19 3kbo h PRO 24 Ca -0.01 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.10 3kbo h PRO 24 Cb 0.89 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.00 3kbo h PRO 24 CO 0.59 0.00 0.00 1.58 -0.21 0.00 0.00 178.00 179.96 3kbo n HIS 25 N -3.88 1.06 -4.51 0.65 -0.00 -1.26 -4.92 115.22 102.36 3kbo n HIS 25 Ca -0.02 -0.39 -0.32 0.00 0.46 0.00 0.00 57.72 57.45 3kbo n HIS 25 Cb 0.13 -0.25 -0.11 0.00 -0.12 0.00 0.00 29.99 29.64 3kbo n HIS 25 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 3kbo s ALA 26 N -1.87 2.89 -0.37 1.57 0.00 -0.48 -4.92 121.76 118.58 3kbo s ALA 26 Ca 0.31 -1.08 -0.08 0.00 0.00 0.00 0.00 51.96 51.11 3kbo s ALA 26 Cb 0.22 -1.00 0.05 0.00 0.00 0.00 0.00 23.12 22.39 3kbo s ALA 26 CO 0.12 0.60 0.18 1.03 0.00 0.00 0.00 175.76 177.69 3kbo s ARG 27 N -1.48 2.64 0.00 0.00 1.81 -1.26 -4.83 118.95 115.84 3kbo s ARG 27 Ca 0.17 -1.26 0.05 0.00 -1.72 0.00 0.00 55.73 52.96 3kbo s ARG 27 Cb -0.11 -3.62 -0.03 0.00 -0.45 0.00 0.00 34.95 30.74 3kbo s ARG 27 CO 0.07 -0.77 -0.12 0.08 -0.68 0.00 0.00 175.30 173.88 3kbo s VAL 28 N 1.43 3.24 -0.01 3.52 1.01 -1.26 -0.84 120.40 127.49 3kbo s VAL 28 Ca 0.01 -0.90 -0.12 0.00 0.00 0.00 0.00 61.98 60.97 3kbo s VAL 28 Cb -0.21 -2.37 0.02 0.00 0.00 0.00 0.00 36.38 33.82 3kbo s VAL 28 CO 0.03 0.42 0.26 0.00 0.00 0.00 0.00 175.10 175.81 3kbo s ARG 29 N -1.28 0.59 0.03 2.72 1.70 -0.38 -4.96 118.95 117.37 3kbo s ARG 29 Ca 0.15 -0.22 -0.30 0.00 -0.47 0.00 0.00 55.73 54.88 3kbo s ARG 29 Cb -0.11 0.26 -0.05 0.00 -0.57 0.00 0.00 34.95 34.48 3kbo s ARG 29 CO 0.05 -0.16 1.18 -2.00 -1.08 0.00 0.00 175.30 173.30 3kbo s GLU 30 N -1.27 4.43 0.18 3.89 2.12 -1.26 -0.92 118.70 125.87 3kbo s GLU 30 Ca -0.13 1.71 -0.30 0.00 0.36 0.00 0.00 54.97 56.61 3kbo s GLU 30 Cb -0.06 -3.40 -0.08 0.00 0.26 0.00 0.00 34.13 30.85 3kbo s GLU 30 CO 0.03 -0.28 1.11 -0.46 -0.54 0.00 0.00 175.26 175.12 3kbo s TRP 31 N 1.30 3.58 0.12 5.30 -0.00 0.14 -4.81 118.94 124.57 3kbo s TRP 31 Ca 0.57 1.59 -0.03 0.00 -0.00 0.00 0.00 56.10 58.24 3kbo s TRP 31 Cb -0.28 -3.29 -0.03 0.00 -0.00 0.00 0.00 33.47 29.87 3kbo s TRP 31 CO 0.28 -0.65 0.08 -1.59 -0.00 0.00 0.00 176.95 175.07 3kbo s LYS 32 N -0.37 0.89 0.15 5.86 -2.85 -1.26 -4.83 119.74 117.32 3kbo s LYS 32 Ca 0.50 -1.33 -0.34 0.00 -1.00 0.00 0.00 55.97 53.80 3kbo s LYS 32 Cb -0.30 0.26 -0.16 0.00 -2.06 0.00 0.00 37.83 35.58 3kbo s LYS 32 CO 0.35 -0.25 1.29 1.33 0.10 0.00 0.00 175.35 178.17 3kbo n VAL 33 N -0.07 0.48 -0.01 1.79 0.24 -1.26 -1.64 118.33 117.86 3kbo n VAL 33 Ca -0.08 -0.12 0.00 0.00 -2.04 0.00 0.00 64.34 62.10 3kbo n VAL 33 Cb 0.63 -0.96 0.00 0.00 -1.47 0.00 0.00 33.84 32.04 3kbo n VAL 33 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3kbo n GLY 34 N 2.34 0.25 3.47 7.63 0.00 -1.26 -5.05 105.19 112.58 3kbo n GLY 34 Ca 0.16 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.75 3kbo n GLY 34 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3kbo s ASP 35 N -2.36 6.23 -0.15 1.61 -1.08 -0.65 -4.82 116.67 115.46 3kbo s ASP 35 Ca 0.00 -0.80 0.15 0.00 -0.52 0.00 0.00 52.55 51.38 3kbo s ASP 35 Cb 0.00 -2.40 0.39 0.00 -1.46 0.00 0.00 42.92 39.44 3kbo s ASP 35 CO 0.00 -1.29 1.19 0.59 0.52 0.00 0.00 175.17 176.18 3kbo n ASN 36 N 7.39 1.58 -4.89 -0.34 3.02 -1.26 -4.92 115.26 115.84 3kbo n ASN 36 Ca -0.03 -3.34 -0.29 0.00 -0.03 0.00 0.00 54.58 50.90 3kbo n ASN 36 Cb 0.46 -0.46 -0.00 0.00 -0.61 0.00 0.00 39.78 39.17 3kbo n ASN 36 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 3kbo s ASN 37 N -2.85 6.28 0.79 6.41 0.02 -1.26 -5.02 114.94 119.30 3kbo s ASN 37 Ca 0.35 1.09 -0.15 0.00 -1.02 0.00 0.00 52.86 53.13 3kbo s ASN 37 Cb 0.35 -2.32 0.02 0.00 0.02 0.00 0.00 41.25 39.31 3kbo s ASN 37 CO -0.07 -0.64 0.77 -2.65 0.02 0.00 0.00 177.10 174.52 3kbo n PRO 38 N -2.30 0.20 -3.63 -0.60 -0.02 -1.26 -5.03 135.00 122.36 3kbo n PRO 38 Ca 0.02 0.12 -0.15 0.00 -2.02 0.00 0.00 63.50 61.48 3kbo n PRO 38 Cb 0.55 -2.07 -0.07 0.00 -0.02 0.00 0.00 33.50 31.88 3kbo n PRO 38 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3kbo s ALA 39 N -2.04 -1.58 -0.23 3.55 0.00 -1.26 -4.88 121.76 115.33 3kbo s ALA 39 Ca 0.67 1.57 0.09 0.00 0.00 0.00 0.00 51.96 54.30 3kbo s ALA 39 Cb -0.31 -0.69 -0.20 0.00 0.00 0.00 0.00 23.12 21.92 3kbo s ALA 39 CO 0.56 -0.32 -0.09 -0.25 0.00 0.00 0.00 175.76 175.66 3kbo n ASP 40 N 2.15 1.13 -4.00 0.00 8.00 0.32 -4.53 116.55 119.62 3kbo n ASP 40 Ca -0.16 -0.08 -0.11 0.00 0.71 0.00 0.00 54.79 55.16 3kbo n ASP 40 Cb 0.56 0.22 -0.11 0.00 -0.02 0.00 0.00 41.12 41.77 3kbo n ASP 40 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 3kbo s TYR 41 N -2.50 0.40 -0.03 1.24 2.02 -0.95 0.24 117.35 117.77 3kbo s TYR 41 Ca -0.23 -0.48 0.02 0.00 -0.37 0.00 0.00 57.07 56.01 3kbo s TYR 41 Cb 0.08 -0.26 0.01 0.00 -0.40 0.00 0.00 41.96 41.38 3kbo s TYR 41 CO 0.69 -0.14 -0.08 0.00 -1.57 0.00 0.00 175.55 174.46 3kbo s ALA 42 N -1.31 0.83 -0.20 3.71 0.00 -1.12 -0.93 121.76 122.74 3kbo s ALA 42 Ca -0.12 -0.26 -0.04 0.00 0.00 0.00 0.00 51.96 51.53 3kbo s ALA 42 Cb -0.09 -0.35 -0.02 0.00 0.00 0.00 0.00 23.12 22.66 3kbo s ALA 42 CO -0.00 0.10 -0.04 -0.51 0.00 0.00 0.00 175.76 175.31 3kbo s LEU 43 N 0.38 3.04 0.10 0.00 1.02 0.02 -0.35 118.68 122.89 3kbo s LEU 43 Ca -0.06 -0.29 -0.06 0.00 0.02 0.00 0.00 54.13 53.74 3kbo s LEU 43 Cb -0.10 -1.76 -0.02 0.00 0.02 0.00 0.00 46.19 44.33 3kbo s LEU 43 CO 0.01 0.05 0.15 0.68 0.02 0.00 0.00 176.35 177.25 3kbo s VAL 44 N 1.09 0.14 -0.25 -1.59 -7.23 -0.24 -1.18 120.40 111.14 3kbo s VAL 44 Ca 0.01 -1.44 -0.09 0.00 -1.81 0.00 0.00 61.98 58.66 3kbo s VAL 44 Cb -0.15 -1.57 0.11 0.00 0.56 0.00 0.00 36.38 35.34 3kbo s VAL 44 CO 0.00 -0.62 0.54 0.86 -0.31 0.00 0.00 175.10 175.57 3kbo s TRP 45 N -3.92 -1.08 -1.33 2.82 -0.11 -1.09 -0.75 118.94 113.48 3kbo s TRP 45 Ca 0.10 1.94 -0.01 0.00 1.22 0.00 0.00 56.10 59.36 3kbo s TRP 45 Cb 0.05 0.57 0.00 0.00 -1.50 0.00 0.00 33.47 32.59 3kbo s TRP 45 CO -0.07 -0.58 0.66 1.04 -4.62 0.00 0.00 176.95 173.39 3kbo n GLN 46 N 5.39 -4.66 -2.40 5.86 6.02 -1.26 -4.42 117.38 121.92 3kbo n GLN 46 Ca -0.11 0.58 -0.40 0.00 -0.01 0.00 0.00 57.00 57.06 3kbo n GLN 46 Cb 0.49 -5.08 -0.04 0.00 1.02 0.00 0.00 30.24 26.64 3kbo n GLN 46 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 177.06 174.80 3kbo s PRO 47 N -6.11 4.58 0.61 -1.09 0.04 -1.26 -4.94 135.00 126.83 3kbo s PRO 47 Ca 0.03 1.89 -0.19 0.00 0.04 0.00 0.00 61.00 62.78 3kbo s PRO 47 Cb -0.02 -3.17 -0.03 0.00 0.04 0.00 0.00 34.50 31.33 3kbo s PRO 47 CO 0.83 0.12 1.24 -2.14 0.04 0.00 0.00 177.00 177.08 3kbo s PRO 48 N -1.48 2.85 0.37 0.56 0.02 -1.26 -4.90 135.00 131.17 3kbo s PRO 48 Ca 0.46 1.90 0.08 0.00 0.02 0.00 0.00 61.00 63.46 3kbo s PRO 48 Cb -0.34 -1.91 0.82 0.00 0.02 0.00 0.00 34.50 33.09 3kbo s PRO 48 CO 0.43 -1.32 1.93 0.28 -0.33 0.00 0.00 177.00 177.99 3kbo h VAL 49 N 0.80 0.93 0.00 3.83 2.07 -2.01 -3.35 116.25 118.52 3kbo h VAL 49 Ca -0.51 -0.23 -0.00 0.00 0.82 0.00 0.00 66.70 66.78 3kbo h VAL 49 Cb 1.31 0.19 -0.00 0.00 -1.52 0.00 0.00 31.29 31.27 3kbo h VAL 49 CO 0.55 0.12 0.05 -1.84 0.02 0.00 0.00 177.57 176.46 3kbo n GLU 50 N -4.50 0.17 0.00 1.57 0.00 -1.26 -1.16 120.64 115.46 3kbo n GLU 50 Ca 0.13 -0.02 0.00 0.00 0.00 0.00 0.00 57.16 57.27 3kbo n GLU 50 Cb 0.34 -1.44 0.00 0.00 0.00 0.00 0.00 31.44 30.34 3kbo n GLU 50 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.13 178.41 3kbo n LEU 52 N 2.05 0.00 -4.69 -1.84 4.77 -1.26 -5.00 117.00 111.04 3kbo n LEU 52 Ca 0.01 0.00 -0.58 0.00 -0.03 0.00 0.00 56.01 55.40 3kbo n LEU 52 Cb 0.09 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.10 3kbo n LEU 52 CO 0.03 0.00 1.20 0.00 -1.33 0.00 0.00 177.39 177.29 3kbo n ALA 53 N -1.04 -0.65 -0.91 -1.18 0.00 -0.31 -0.81 120.51 115.62 3kbo n ALA 53 Ca 0.00 0.43 0.00 0.00 0.00 0.00 0.00 53.44 53.87 3kbo n ALA 53 Cb 0.00 -2.13 0.00 0.00 0.00 0.00 0.00 19.45 17.32 3kbo n ALA 53 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3kbo n GLY 54 N 3.80 0.57 3.78 0.00 0.00 -1.11 -4.99 105.19 107.24 3kbo n GLY 54 Ca 0.26 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.91 3kbo n GLY 54 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3kbo s ARG 55 N -0.41 4.50 -0.65 1.61 0.52 0.01 -5.00 118.95 119.54 3kbo s ARG 55 Ca 0.00 1.41 -0.16 0.00 -0.52 0.00 0.00 55.73 56.46 3kbo s ARG 55 Cb 0.00 -2.79 0.15 0.00 0.52 0.00 0.00 34.95 32.84 3kbo s ARG 55 CO 0.00 0.19 0.63 1.03 0.02 0.00 0.00 175.30 177.17 3kbo s ARG 56 N -2.08 3.21 0.15 3.54 0.52 -1.26 -4.76 118.95 118.27 3kbo s ARG 56 Ca 0.51 -1.90 0.06 0.00 -0.52 0.00 0.00 55.73 53.89 3kbo s ARG 56 Cb -0.21 -4.36 -0.04 0.00 0.52 0.00 0.00 34.95 30.87 3kbo s ARG 56 CO 0.26 -1.36 0.00 -0.51 0.02 0.00 0.00 175.30 173.72 3kbo s LEU 57 N 1.32 3.37 0.17 2.53 1.43 -1.26 -4.71 118.68 121.53 3kbo s LEU 57 Ca 0.10 -0.32 0.18 0.00 -1.03 0.00 0.00 54.13 53.06 3kbo s LEU 57 Cb -0.22 -2.05 -0.02 0.00 0.03 0.00 0.00 46.19 43.92 3kbo s LEU 57 CO -0.01 0.12 1.07 0.11 0.23 0.00 0.00 176.35 177.87 3kbo h LYS 58 N 2.95 0.00 -1.65 1.70 1.57 -0.51 -3.45 116.57 117.17 3kbo h LYS 58 Ca -0.47 0.00 0.18 0.00 -1.87 0.00 0.00 60.65 58.49 3kbo h LYS 58 Cb 1.19 0.00 -0.20 0.00 0.08 0.00 0.00 32.23 33.30 3kbo h LYS 58 CO 0.58 0.24 0.69 0.00 -0.57 0.00 0.00 179.45 180.39 3kbo s ALA 59 N -3.07 -1.98 -0.06 3.86 0.00 -1.22 -4.41 121.76 114.87 3kbo s ALA 59 Ca -0.00 1.49 0.03 0.00 0.00 0.00 0.00 51.96 53.47 3kbo s ALA 59 Cb 0.08 -0.27 0.01 0.00 0.00 0.00 0.00 23.12 22.94 3kbo s ALA 59 CO 0.78 -0.52 -0.15 0.08 0.00 0.00 0.00 175.76 175.96 3kbo s VAL 60 N -2.15 1.32 -0.29 0.00 1.01 -0.76 -2.81 120.40 116.71 3kbo s VAL 60 Ca 0.06 -0.60 -0.05 0.00 0.00 0.00 0.00 61.98 61.38 3kbo s VAL 60 Cb -0.01 -1.17 0.02 0.00 0.00 0.00 0.00 36.38 35.22 3kbo s VAL 60 CO -0.05 0.39 0.05 -0.36 0.00 0.00 0.00 175.10 175.13 3kbo s PHE 61 N 0.47 3.15 -0.02 5.22 0.08 0.53 -0.84 117.98 126.56 3kbo s PHE 61 Ca -0.13 -1.20 -0.30 0.00 0.12 0.00 0.00 56.93 55.42 3kbo s PHE 61 Cb -0.15 -2.20 -0.03 0.00 -0.57 0.00 0.00 43.02 40.07 3kbo s PHE 61 CO 0.04 -0.64 1.00 0.08 -0.10 0.00 0.00 175.22 175.60 3kbo s VAL 62 N 1.44 4.80 -0.59 -0.44 1.01 0.12 -1.08 120.40 125.66 3kbo s VAL 62 Ca 0.01 2.02 -0.06 0.00 0.00 0.00 0.00 61.98 63.96 3kbo s VAL 62 Cb -0.17 -4.30 -0.06 0.00 0.00 0.00 0.00 36.38 31.85 3kbo s VAL 62 CO 0.01 0.12 3.03 0.18 0.00 0.00 0.00 175.10 178.44 3kbo n LEU 63 N 4.19 6.61 -3.68 3.92 4.77 0.07 -3.30 117.00 129.58 3kbo n LEU 63 Ca 0.07 -3.93 -0.03 0.00 -0.03 0.00 0.00 56.01 52.09 3kbo n LEU 63 Cb 0.50 -1.36 -0.01 0.00 -2.33 0.00 0.00 43.42 40.22 3kbo n LEU 63 CO 0.52 1.82 0.83 -0.83 -1.33 0.00 0.00 177.39 178.41 3kbo s GLY 64 N 1.16 -0.32 0.02 -0.72 0.00 -1.26 -4.94 107.32 101.27 3kbo s GLY 64 Ca 0.62 0.48 -0.08 0.00 0.00 0.00 0.00 44.72 45.74 3kbo s GLY 64 CO -0.11 0.11 0.94 0.00 0.00 0.00 0.00 173.10 174.04 3kbo h ALA 65 N 2.00 0.09 -2.73 3.20 0.00 -1.88 0.15 119.26 120.08 3kbo h ALA 65 Ca -0.25 -0.99 -0.49 0.00 0.00 0.00 0.00 54.91 53.18 3kbo h ALA 65 Cb 1.22 0.21 -0.02 0.00 0.00 0.00 0.00 17.79 19.20 3kbo h ALA 65 CO 0.27 0.95 0.36 0.20 0.00 0.00 0.00 179.25 181.03 3kbo s GLY 66 N -4.80 3.11 -0.01 0.00 0.00 -1.26 -4.74 107.32 99.61 3kbo s GLY 66 Ca -0.09 0.62 0.01 0.00 0.00 0.00 0.00 44.72 45.27 3kbo s GLY 66 CO 0.89 1.23 0.76 3.33 0.00 0.00 0.00 173.10 179.31 3kbo n VAL 67 N 1.62 0.43 -0.10 1.40 0.24 -1.26 -4.87 118.33 115.80 3kbo n VAL 67 Ca -0.01 -0.46 -0.12 0.00 -2.04 0.00 0.00 64.34 61.71 3kbo n VAL 67 Cb 0.47 0.69 -0.04 0.00 -1.47 0.00 0.00 33.84 33.50 3kbo n VAL 67 CO 0.00 0.00 0.00 -2.24 -2.14 0.00 0.00 176.83 172.45 3kbo h ASP 68 N 0.00 0.57 0.33 -1.34 2.03 -1.88 -0.67 116.42 115.47 3kbo h ASP 68 Ca 0.00 -0.37 -0.02 0.00 -0.73 0.00 0.00 57.03 55.91 3kbo h ASP 68 Cb 0.92 -0.16 0.00 0.00 -0.83 0.00 0.00 39.33 39.26 3kbo h ASP 68 CO 0.00 0.81 -0.16 0.00 -1.03 0.00 0.00 179.24 178.86 3kbo h ALA 69 N 0.78 -0.45 -0.57 4.15 0.00 -1.94 0.37 119.26 121.60 3kbo h ALA 69 Ca 0.07 -0.10 0.07 0.00 0.00 0.00 0.00 54.91 54.95 3kbo h ALA 69 Cb 0.57 0.17 -0.06 0.00 0.00 0.00 0.00 17.79 18.47 3kbo h ALA 69 CO 0.03 -0.75 0.25 0.97 0.00 0.00 0.00 179.25 179.76 3kbo h ILE 70 N -0.45 0.86 -0.06 0.00 6.09 -1.89 -0.68 117.51 121.37 3kbo h ILE 70 Ca -0.05 -0.16 -0.08 0.00 -1.37 0.00 0.00 64.86 63.20 3kbo h ILE 70 Cb 0.35 0.35 -0.01 0.00 0.47 0.00 0.00 36.82 37.98 3kbo h ILE 70 CO 0.07 0.08 -0.34 -0.07 -3.07 0.00 0.00 178.15 174.83 3kbo h LEU 71 N 0.47 0.11 -0.38 2.19 3.38 -0.95 -0.16 115.31 119.97 3kbo h LEU 71 Ca 0.27 -0.04 -0.18 0.00 0.09 0.00 0.00 57.88 58.02 3kbo h LEU 71 Cb 0.27 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 40.99 3kbo h LEU 71 CO -0.24 0.46 -0.61 -1.28 0.09 0.00 0.00 178.44 176.86 3kbo h SER 72 N 0.10 0.76 -0.38 -0.43 0.87 0.19 0.44 113.55 115.10 3kbo h SER 72 Ca 0.01 -0.43 -0.03 0.00 -1.23 0.00 0.00 61.79 60.10 3kbo h SER 72 Cb 0.66 -0.22 -0.02 0.00 -0.44 0.00 0.00 62.40 62.38 3kbo h SER 72 CO 0.05 1.19 0.10 0.50 -0.53 0.00 0.00 176.83 178.14 3kbo h LYS 73 N 0.50 0.60 -0.95 2.24 3.64 -0.87 -2.40 116.57 119.33 3kbo h LYS 73 Ca -0.00 -0.14 0.04 0.00 -1.27 0.00 0.00 60.65 59.27 3kbo h LYS 73 Cb 1.19 -0.08 -0.05 0.00 -0.41 0.00 0.00 32.23 32.87 3kbo h LYS 73 CO 0.12 0.63 0.62 1.25 -2.27 0.00 0.00 179.45 179.80 3kbo h LEU 74 N 0.46 1.03 0.09 5.20 5.85 -0.68 0.26 115.31 127.52 3kbo h LEU 74 Ca 0.12 -0.01 0.02 0.00 0.84 0.00 0.00 57.88 58.85 3kbo h LEU 74 Cb 0.29 -0.24 -0.04 0.00 0.37 0.00 0.00 40.66 41.04 3kbo h LEU 74 CO -0.00 0.70 -0.31 -1.13 -0.34 0.00 0.00 178.44 177.36 3kbo h ASN 75 N 1.19 -0.91 1.13 1.25 -0.73 -0.44 -1.92 115.58 115.15 3kbo h ASN 75 Ca 0.38 0.11 -0.03 0.00 1.87 0.00 0.00 56.30 58.63 3kbo h ASN 75 Cb 0.01 0.35 -0.00 0.00 0.27 0.00 0.00 38.32 38.95 3kbo h ASN 75 CO -0.12 -0.39 -0.12 0.00 -0.37 0.00 0.00 177.43 176.43 3kbo h ALA 76 N 0.17 0.99 -2.11 1.57 0.00 -1.01 -3.36 119.26 115.51 3kbo h ALA 76 Ca 0.04 -0.11 -0.57 0.00 0.00 0.00 0.00 54.91 54.26 3kbo h ALA 76 Cb 0.56 -0.02 -0.41 0.00 0.00 0.00 0.00 17.79 17.93 3kbo h ALA 76 CO -0.21 0.15 -0.86 0.72 0.00 0.00 0.00 179.25 179.06 3kbo n HIS 77 N -3.23 1.78 0.22 0.00 8.25 0.86 -4.92 115.22 118.17 3kbo n HIS 77 Ca 0.01 -3.87 0.18 0.00 -0.26 0.00 0.00 57.72 53.77 3kbo n HIS 77 Cb 0.41 -0.46 0.84 0.00 1.12 0.00 0.00 29.99 31.91 3kbo n HIS 77 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 3kbo h PRO 78 N 3.89 0.00 -2.33 -0.41 0.13 -1.58 -3.38 132.00 128.32 3kbo h PRO 78 Ca 0.13 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.26 3kbo h PRO 78 Cb 0.76 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.89 3kbo h PRO 78 CO 0.66 0.00 0.15 -0.85 -0.23 0.00 0.00 178.00 177.72 3kbo n GLU 79 N -3.56 0.15 -1.65 0.86 0.00 -1.26 -4.56 120.64 110.62 3kbo n GLU 79 Ca 0.02 -0.04 -0.48 0.00 0.00 0.00 0.00 57.16 56.66 3kbo n GLU 79 Cb 0.38 -1.49 -0.05 0.00 0.00 0.00 0.00 31.44 30.28 3kbo n GLU 79 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.13 177.02 3kbo n LEU 81 N 2.31 2.72 -4.77 -1.84 7.94 -1.26 -2.73 117.00 119.37 3kbo n LEU 81 Ca 0.02 1.08 -0.38 0.00 -1.11 0.00 0.00 56.01 55.62 3kbo n LEU 81 Cb 0.07 -1.35 -0.02 0.00 0.53 0.00 0.00 43.42 42.65 3kbo n LEU 81 CO 0.09 -0.47 0.83 -0.62 -1.11 0.00 0.00 177.39 176.10 3kbo s ASP 82 N 1.11 6.52 0.51 1.96 2.15 -1.26 -4.88 116.67 122.78 3kbo s ASP 82 Ca 0.82 2.32 0.34 0.00 0.43 0.00 0.00 52.55 56.46 3kbo s ASP 82 Cb -0.76 -2.61 1.75 0.00 -0.30 0.00 0.00 42.92 40.99 3kbo s ASP 82 CO 0.42 -0.67 2.05 0.00 -0.17 0.00 0.00 175.17 176.79 3kbo h ALA 83 N 2.60 1.00 0.00 3.66 0.00 -2.00 -0.93 119.26 123.59 3kbo h ALA 83 Ca -0.49 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.42 3kbo h ALA 83 Cb 1.23 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.02 3kbo h ALA 83 CO 0.62 0.00 0.00 1.03 0.00 0.00 0.00 179.25 180.90 3kbo h SER 84 N 0.00 0.00 -3.41 0.00 0.87 -2.00 -3.44 113.55 105.56 3kbo h SER 84 Ca 0.00 0.00 -0.60 0.00 -1.23 0.00 0.00 61.79 59.96 3kbo h SER 84 Cb 0.15 0.00 -0.10 0.00 -0.44 0.00 0.00 62.40 62.00 3kbo h SER 84 CO 0.00 0.00 0.23 -0.63 -0.53 0.00 0.00 176.83 175.90 3kbo s ILE 85 N -3.12 4.95 0.51 2.23 1.01 -0.36 -5.02 121.20 121.40 3kbo s ILE 85 Ca 0.10 1.26 -0.21 0.00 0.00 0.00 0.00 60.65 61.81 3kbo s ILE 85 Cb 0.11 -3.99 -0.07 0.00 0.01 0.00 0.00 42.46 38.53 3kbo s ILE 85 CO 0.59 0.02 1.13 -2.16 0.00 0.00 0.00 174.94 174.53 3kbo s PRO 86 N 2.45 3.54 -0.13 2.79 0.04 -1.26 -4.88 135.00 137.54 3kbo s PRO 86 Ca 0.29 1.65 0.02 0.00 0.04 0.00 0.00 61.00 63.00 3kbo s PRO 86 Cb -0.16 -2.16 0.01 0.00 0.04 0.00 0.00 34.50 32.24 3kbo s PRO 86 CO 0.09 -0.71 -0.21 -1.17 0.04 0.00 0.00 177.00 175.04 3kbo s LEU 87 N -3.50 2.04 0.30 -3.56 2.96 -1.26 -1.83 118.68 113.83 3kbo s LEU 87 Ca 0.69 -0.57 0.10 0.00 -0.22 0.00 0.00 54.13 54.12 3kbo s LEU 87 Cb -0.25 -1.39 -0.05 0.00 0.50 0.00 0.00 46.19 45.01 3kbo s LEU 87 CO 0.29 0.07 -0.02 -0.36 -1.32 0.00 0.00 176.35 175.01 3kbo s PHE 88 N 0.84 2.59 0.40 5.38 0.08 -0.02 -0.02 117.98 127.22 3kbo s PHE 88 Ca -0.07 -0.31 0.04 0.00 0.12 0.00 0.00 56.93 56.71 3kbo s PHE 88 Cb -0.15 -1.29 -0.02 0.00 -0.57 0.00 0.00 43.02 40.99 3kbo s PHE 88 CO -0.02 0.57 0.15 2.89 -0.10 0.00 0.00 175.22 178.72 3kbo n ARG 89 N -0.89 0.57 -3.20 0.44 1.85 -1.26 0.14 116.66 114.30 3kbo n ARG 89 Ca -0.05 -3.42 -0.44 0.00 -1.00 0.00 0.00 57.85 52.94 3kbo n ARG 89 Cb 0.60 1.92 -0.06 0.00 -1.05 0.00 0.00 32.46 33.87 3kbo n ARG 89 CO 0.00 0.00 0.00 -0.51 -0.01 0.00 0.00 177.63 177.11 3kbo s LEU 90 N 0.00 5.11 -0.43 2.89 1.43 0.54 -4.84 118.68 123.38 3kbo s LEU 90 Ca 0.22 -1.00 -0.19 0.00 -1.03 0.00 0.00 54.13 52.13 3kbo s LEU 90 Cb 0.01 -2.39 0.02 0.00 0.03 0.00 0.00 46.19 43.86 3kbo s LEU 90 CO 0.15 -0.85 0.52 -1.83 0.23 0.00 0.00 176.35 174.58 3kbo s GLU 91 N 2.43 3.17 3.30 1.70 -1.05 -1.26 -3.84 118.70 123.16 3kbo s GLU 91 Ca 0.13 -0.61 0.00 0.00 -0.15 0.00 0.00 54.97 54.34 3kbo s GLU 91 Cb -0.20 -3.97 0.00 0.00 -0.44 0.00 0.00 34.13 29.52 3kbo s GLU 91 CO 0.11 -0.93 0.00 -3.47 0.95 0.00 0.00 175.26 171.92 3kbo n ASP 92 N 5.88 0.00 -3.75 0.83 -0.08 -1.26 -4.84 116.55 113.33 3kbo n ASP 92 Ca -0.05 0.00 -0.29 0.00 -1.51 0.00 0.00 54.79 52.94 3kbo n ASP 92 Cb 0.47 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.94 3kbo n ASP 92 CO 0.00 0.00 0.00 0.35 0.12 0.00 0.00 177.20 177.67 3kbo n THR 93 N 0.00 -1.36 -0.81 5.18 -2.24 -1.26 -4.43 114.28 109.36 3kbo n THR 93 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 3kbo n THR 93 Cb 0.00 -2.18 0.00 0.00 -2.10 0.00 0.00 70.33 66.05 3kbo n THR 93 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3kbo n GLY 94 N -1.41 0.69 3.83 3.38 0.00 -1.26 -2.37 105.19 108.05 3kbo n GLY 94 Ca 0.03 -0.51 0.00 0.00 0.00 0.00 0.00 46.02 45.54 3kbo n GLY 94 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3kbo n GLY 96 N -0.72 0.00 0.27 -0.02 0.00 -1.26 -3.44 105.19 100.02 3kbo n GLY 96 Ca 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.98 3kbo n GLY 96 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3kbo h LEU 97 N 0.00 0.72 -1.83 0.99 5.85 -1.97 0.93 115.31 120.01 3kbo h LEU 97 Ca 0.00 -0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 3kbo h LEU 97 Cb 0.00 -0.16 0.00 0.00 0.37 0.00 0.00 40.66 40.87 3kbo h LEU 97 CO 0.00 0.51 0.00 0.00 -0.34 0.00 0.00 178.44 178.61 3kbo n GLN 98 N -4.66 0.18 0.00 1.25 6.02 -1.22 -1.04 117.38 117.91 3kbo n GLN 98 Ca 0.07 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.06 3kbo n GLN 98 Cb 0.07 -1.36 0.00 0.00 1.02 0.00 0.00 30.24 29.98 3kbo n GLN 98 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 3kbo n GLN 100 N 0.82 0.00 -0.17 -1.09 6.02 0.32 -2.18 117.38 121.10 3kbo n GLN 100 Ca 0.00 0.00 -0.03 0.00 -0.01 0.00 0.00 57.00 56.96 3kbo n GLN 100 Cb 0.08 0.00 0.03 0.00 1.02 0.00 0.00 30.24 31.37 3kbo n GLN 100 CO 0.00 0.00 0.00 0.93 -1.01 0.00 0.00 177.06 176.98 3kbo h GLU 101 N 0.00 -0.07 -0.12 -1.09 5.08 -1.35 0.03 114.58 117.07 3kbo h GLU 101 Ca 0.00 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.36 3kbo h GLU 101 Cb 0.00 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.26 3kbo h GLU 101 CO 0.00 -0.04 0.05 -0.92 -1.00 0.00 0.00 179.01 177.10 3kbo h TYR 102 N -0.07 0.17 -0.22 4.33 -0.00 -1.70 -2.08 116.97 117.41 3kbo h TYR 102 Ca 0.25 -0.01 -0.06 0.00 -0.00 0.00 0.00 58.73 58.91 3kbo h TYR 102 Cb 0.45 -0.05 -0.01 0.00 -0.00 0.00 0.00 36.73 37.12 3kbo h TYR 102 CO -0.49 0.24 -0.09 0.00 -0.00 0.00 0.00 178.16 177.83 3kbo h ALA 103 N 0.91 0.30 0.06 1.82 0.00 -1.75 -1.82 119.26 118.78 3kbo h ALA 103 Ca 0.04 -0.28 -0.00 0.00 0.00 0.00 0.00 54.91 54.66 3kbo h ALA 103 Cb 0.14 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.86 3kbo h ALA 103 CO -0.00 0.13 -0.03 0.28 0.00 0.00 0.00 179.25 179.62 3kbo h VAL 104 N 0.15 1.04 -0.57 0.00 2.07 -1.05 0.44 116.25 118.33 3kbo h VAL 104 Ca 0.05 -0.31 0.10 0.00 0.82 0.00 0.00 66.70 67.36 3kbo h VAL 104 Cb 0.57 1.24 -0.08 0.00 -1.52 0.00 0.00 31.29 31.50 3kbo h VAL 104 CO 0.03 0.08 0.13 -1.28 0.02 0.00 0.00 177.57 176.55 3kbo h SER 105 N -0.22 0.03 0.60 0.57 0.87 -1.38 -1.93 113.55 112.09 3kbo h SER 105 Ca -0.01 0.10 -0.26 0.00 -1.23 0.00 0.00 61.79 60.39 3kbo h SER 105 Cb 0.19 0.13 0.00 0.00 -0.44 0.00 0.00 62.40 62.28 3kbo h SER 105 CO 0.01 0.03 -1.16 -0.61 -0.53 0.00 0.00 176.83 174.58 3kbo h GLN 106 N 0.27 0.28 -0.68 2.24 5.75 -0.93 -1.33 115.11 120.71 3kbo h GLN 106 Ca 0.29 -0.43 -0.05 0.00 -0.15 0.00 0.00 58.65 58.32 3kbo h GLN 106 Cb 0.41 0.15 -0.03 0.00 1.07 0.00 0.00 27.48 29.08 3kbo h GLN 106 CO -0.37 1.18 0.23 0.28 -2.65 0.00 0.00 178.83 177.50 3kbo h VAL 107 N 0.10 1.24 -0.18 2.39 2.07 0.05 -2.05 116.25 119.86 3kbo h VAL 107 Ca -0.11 -0.82 -0.19 0.00 0.82 0.00 0.00 66.70 66.40 3kbo h VAL 107 Cb 1.87 0.47 0.00 0.00 -1.52 0.00 0.00 31.29 32.11 3kbo h VAL 107 CO 0.19 0.32 -0.64 -0.07 0.02 0.00 0.00 177.57 177.39 3kbo h LEU 108 N 1.00 0.77 -0.34 2.57 3.38 -1.26 0.23 115.31 121.67 3kbo h LEU 108 Ca 0.22 -0.45 0.07 0.00 0.09 0.00 0.00 57.88 57.81 3kbo h LEU 108 Cb 0.25 -0.22 -0.06 0.00 0.09 0.00 0.00 40.66 40.72 3kbo h LEU 108 CO -0.01 1.22 -0.05 -0.74 0.09 0.00 0.00 178.44 178.95 3kbo h HIS 109 N 0.49 -0.12 -0.11 1.13 2.76 -1.10 0.15 115.15 118.35 3kbo h HIS 109 Ca -0.01 0.03 -0.10 0.00 -2.20 0.00 0.00 60.37 58.08 3kbo h HIS 109 Cb 1.23 0.10 0.00 0.00 1.55 0.00 0.00 27.41 30.30 3kbo h HIS 109 CO 0.06 -0.11 -0.33 -1.49 -1.30 0.00 0.00 177.93 174.76 3kbo h TRP 110 N 0.04 0.56 -0.70 5.26 6.55 -1.13 -0.03 115.95 126.49 3kbo h TRP 110 Ca 0.16 -0.22 0.08 0.00 0.95 0.00 0.00 58.89 59.86 3kbo h TRP 110 Cb 0.24 -0.10 -0.06 0.00 -0.86 0.00 0.00 29.16 28.38 3kbo h TRP 110 CO -0.28 0.95 0.38 0.35 -1.05 0.00 0.00 178.44 178.78 3kbo h PHE 111 N 0.01 0.68 -0.08 0.49 3.57 -0.29 -0.56 116.94 120.77 3kbo h PHE 111 Ca -0.01 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.52 3kbo h PHE 111 Cb 0.95 -0.20 0.00 0.00 2.79 0.00 0.00 35.95 39.49 3kbo h PHE 111 CO 0.11 0.29 0.00 0.54 -2.23 0.00 0.00 178.31 177.02 3kbo n ARG 112 N -4.81 1.35 -2.24 1.11 5.12 0.49 -4.48 116.66 113.20 3kbo n ARG 112 Ca 0.10 -0.53 -0.16 0.00 -1.93 0.00 0.00 57.85 55.33 3kbo n ARG 112 Cb 0.22 -1.34 -0.01 0.00 -1.16 0.00 0.00 32.46 30.17 3kbo n ARG 112 CO 0.00 0.00 0.00 0.54 -1.93 0.00 0.00 177.63 176.24 3kbo n ARG 113 N -0.25 -1.23 0.29 5.56 1.74 -0.22 -4.90 116.66 117.65 3kbo n ARG 113 Ca 0.15 0.78 0.16 0.00 -0.77 0.00 0.00 57.85 58.16 3kbo n ARG 113 Cb 0.19 -5.13 0.91 0.00 -1.02 0.00 0.00 32.46 27.41 3kbo n ARG 113 CO 0.00 0.00 0.00 0.74 -1.52 0.00 0.00 177.63 176.85 3kbo h PHE 114 N 0.00 0.00 0.06 -1.55 -1.00 -1.26 0.94 116.94 114.13 3kbo h PHE 114 Ca -0.37 0.00 -0.00 0.00 2.81 0.00 0.00 57.97 60.41 3kbo h PHE 114 Cb 1.26 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.82 3kbo h PHE 114 CO 0.42 0.03 -0.03 0.38 -1.61 0.00 0.00 178.31 177.49 3kbo h ASP 115 N 0.00 -0.07 -0.29 2.17 2.03 -1.90 -0.76 116.42 117.60 3kbo h ASP 115 Ca -0.00 -0.47 0.06 0.00 -0.73 0.00 0.00 57.03 55.89 3kbo h ASP 115 Cb 0.08 0.02 -0.06 0.00 -0.83 0.00 0.00 39.33 38.55 3kbo h ASP 115 CO 0.00 0.46 -0.08 0.44 -1.03 0.00 0.00 179.24 179.03 3kbo h ASP 116 N -0.64 -0.30 -0.99 4.15 3.32 -1.67 -1.53 116.42 118.76 3kbo h ASP 116 Ca -0.01 0.09 0.04 0.00 0.02 0.00 0.00 57.03 57.18 3kbo h ASP 116 Cb 0.54 0.19 -0.06 0.00 0.22 0.00 0.00 39.33 40.22 3kbo h ASP 116 CO 0.01 -0.11 0.65 1.88 -1.72 0.00 0.00 179.24 179.95 3kbo h TYR 117 N -0.01 1.21 -0.77 4.55 0.05 -0.86 0.25 116.97 121.39 3kbo h TYR 117 Ca 0.14 0.03 -0.03 0.00 0.05 0.00 0.00 58.73 58.92 3kbo h TYR 117 Cb 0.23 -0.40 -0.03 0.00 1.01 0.00 0.00 36.73 37.53 3kbo h TYR 117 CO -0.29 0.68 0.34 0.37 -1.05 0.00 0.00 178.16 178.21 3kbo h GLN 118 N 1.23 1.12 -0.11 4.88 4.15 -0.61 0.17 115.11 125.94 3kbo h GLN 118 Ca 0.40 -0.18 -0.00 0.00 0.77 0.00 0.00 58.65 59.64 3kbo h GLN 118 Cb 0.05 -0.19 -0.01 0.00 0.21 0.00 0.00 27.48 27.54 3kbo h GLN 118 CO -0.13 0.89 0.06 0.00 -1.93 0.00 0.00 178.83 177.72 3kbo h ALA 119 N 1.18 0.13 -0.93 3.38 0.00 -0.17 -1.99 119.26 120.86 3kbo h ALA 119 Ca 0.26 -0.03 0.03 0.00 0.00 0.00 0.00 54.91 55.17 3kbo h ALA 119 Cb 0.16 -0.04 -0.05 0.00 0.00 0.00 0.00 17.79 17.85 3kbo h ALA 119 CO -0.03 -0.35 0.61 -0.07 0.00 0.00 0.00 179.25 179.40 3kbo h LEU 120 N 0.11 1.01 -0.79 0.00 3.38 -0.73 -1.88 115.31 116.41 3kbo h LEU 120 Ca 0.04 -0.01 0.07 0.00 0.09 0.00 0.00 57.88 58.06 3kbo h LEU 120 Cb 0.03 -0.23 -0.06 0.00 0.09 0.00 0.00 40.66 40.48 3kbo h LEU 120 CO -0.01 0.70 0.47 0.50 0.09 0.00 0.00 178.44 180.19 3kbo h LYS 121 N 1.18 0.82 0.00 1.13 3.64 -0.11 -1.46 116.57 121.77 3kbo h LYS 121 Ca 0.37 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.70 3kbo h LYS 121 Cb -0.02 -0.19 0.00 0.00 -0.41 0.00 0.00 32.23 31.61 3kbo h LYS 121 CO -0.11 0.54 0.00 0.09 -2.27 0.00 0.00 179.45 177.70 3kbo n ASN 122 N -4.70 0.00 -0.00 4.20 3.02 -0.72 -1.54 115.26 115.52 3kbo n ASN 122 Ca 0.11 -0.69 0.04 0.00 -0.03 0.00 0.00 54.58 54.02 3kbo n ASN 122 Cb 0.19 0.00 -0.05 0.00 -0.61 0.00 0.00 39.78 39.31 3kbo n ASN 122 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3kbo n GLN 123 N -0.97 4.01 -2.90 3.52 6.02 -0.63 -5.00 117.38 121.43 3kbo n GLN 123 Ca 0.15 -0.01 -0.13 0.00 -0.01 0.00 0.00 57.00 57.00 3kbo n GLN 123 Cb 0.07 -0.92 0.03 0.00 1.02 0.00 0.00 30.24 30.44 3kbo n GLN 123 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3kbo n ALA 124 N -1.20 -0.64 -3.83 -1.58 0.00 -0.59 -5.02 120.51 107.66 3kbo n ALA 124 Ca 0.02 0.20 -0.34 0.00 0.00 0.00 0.00 53.44 53.32 3kbo n ALA 124 Cb 0.14 -2.87 -0.14 0.00 0.00 0.00 0.00 19.45 16.57 3kbo n ALA 124 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 3kbo s LEU 125 N -4.25 3.66 -0.54 0.00 2.96 -0.75 -5.05 118.68 114.70 3kbo s LEU 125 Ca 0.25 -1.30 -0.28 0.00 -0.22 0.00 0.00 54.13 52.59 3kbo s LEU 125 Cb -0.11 -1.64 0.03 0.00 0.50 0.00 0.00 46.19 44.97 3kbo s LEU 125 CO 0.31 -0.22 1.13 0.86 -1.32 0.00 0.00 176.35 177.10 3kbo s TRP 126 N 1.20 2.71 -0.31 5.38 -0.11 -1.26 -4.55 118.94 122.00 3kbo s TRP 126 Ca -0.06 0.44 0.01 0.00 1.22 0.00 0.00 56.10 57.71 3kbo s TRP 126 Cb -0.20 -4.40 0.14 0.00 -1.50 0.00 0.00 33.47 27.52 3kbo s TRP 126 CO -0.03 -1.43 0.32 0.21 -4.62 0.00 0.00 176.95 171.40 3kbo s LYS 127 N 4.60 0.42 0.36 5.86 2.20 -1.26 -5.13 119.74 126.78 3kbo s LYS 127 Ca 0.42 -0.37 -0.28 0.00 -0.36 0.00 0.00 55.97 55.39 3kbo s LYS 127 Cb -0.08 -0.68 -0.12 0.00 -1.51 0.00 0.00 37.83 35.44 3kbo s LYS 127 CO 0.27 -1.08 1.38 -2.30 -0.36 0.00 0.00 175.35 173.26 3kbo n PRO 128 N 4.98 2.38 -4.24 4.03 -0.02 -1.26 -4.98 135.00 135.88 3kbo n PRO 128 Ca 0.02 0.83 -0.24 0.00 -2.02 0.00 0.00 63.50 62.09 3kbo n PRO 128 Cb 0.46 -2.48 -0.07 0.00 -0.02 0.00 0.00 33.50 31.38 3kbo n PRO 128 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3kbo s LEU 129 N -1.49 3.30 0.41 2.45 1.43 -1.26 -5.09 118.68 118.43 3kbo s LEU 129 Ca 0.54 -0.51 -0.26 0.00 -1.03 0.00 0.00 54.13 52.87 3kbo s LEU 129 Cb -0.53 -1.87 -0.09 0.00 0.03 0.00 0.00 46.19 43.74 3kbo s LEU 129 CO 0.63 0.03 1.29 -2.84 0.23 0.00 0.00 176.35 175.69 3kbo s PRO 130 N -3.43 3.94 0.33 1.29 0.02 -1.26 -4.97 135.00 130.91 3kbo s PRO 130 Ca 0.30 2.13 -0.27 0.00 0.02 0.00 0.00 61.00 63.19 3kbo s PRO 130 Cb -0.08 -2.73 -0.09 0.00 0.02 0.00 0.00 34.50 31.62 3kbo s PRO 130 CO 0.20 -0.51 1.00 -1.21 -0.33 0.00 0.00 177.00 176.15 3kbo s GLU 131 N -2.27 4.51 0.43 5.54 2.02 -1.26 -5.05 118.70 122.61 3kbo s GLU 131 Ca 0.57 1.48 -0.07 0.00 0.02 0.00 0.00 54.97 56.97 3kbo s GLU 131 Cb -0.37 -2.85 -0.05 0.00 0.10 0.00 0.00 34.13 30.96 3kbo s GLU 131 CO 0.48 0.18 0.75 0.71 0.02 0.00 0.00 175.26 177.40 3kbo s TYR 132 N -1.50 3.51 0.17 1.61 2.02 -1.26 -5.08 117.35 116.82 3kbo s TYR 132 Ca 0.50 0.89 0.06 0.00 -0.37 0.00 0.00 57.07 58.15 3kbo s TYR 132 Cb -0.23 -2.34 -0.04 0.00 -0.40 0.00 0.00 41.96 38.95 3kbo s TYR 132 CO 0.29 -0.15 0.09 0.95 -1.57 0.00 0.00 175.55 175.16 3kbo s THR 133 N -2.50 4.21 0.50 -0.71 -4.23 -1.26 -5.02 115.64 106.63 3kbo s THR 133 Ca 0.49 -1.22 0.16 0.00 -1.18 0.00 0.00 61.69 59.93 3kbo s THR 133 Cb -0.10 -3.15 0.25 0.00 1.34 0.00 0.00 72.50 70.84 3kbo s THR 133 CO 0.37 -0.12 2.11 0.03 -0.54 0.00 0.00 174.62 176.47 3kbo h ARG 134 N 2.46 0.00 0.00 3.99 3.08 -1.93 -2.70 114.38 119.29 3kbo h ARG 134 Ca -0.47 0.00 -0.07 0.00 0.07 0.00 0.00 59.98 59.51 3kbo h ARG 134 Cb 1.20 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.24 3kbo h ARG 134 CO 0.61 0.05 -0.31 0.93 -1.07 0.00 0.00 179.97 180.18 3kbo h GLU 135 N 0.00 0.00 -0.36 0.04 3.07 -1.95 -1.42 114.58 113.95 3kbo h GLU 135 Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 3kbo h GLU 135 Cb 0.09 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.00 3kbo h GLU 135 CO 0.01 0.31 0.00 -0.85 -1.40 0.00 0.00 179.01 177.08 3kbo n GLU 136 N -3.72 2.17 -2.83 2.33 0.28 -1.02 -4.52 120.64 113.32 3kbo n GLU 136 Ca -0.01 -1.78 -0.25 0.00 -0.16 0.00 0.00 57.16 54.96 3kbo n GLU 136 Cb 0.41 -1.44 -0.03 0.00 1.43 0.00 0.00 31.44 31.82 3kbo n GLU 136 CO 0.00 0.00 0.00 0.34 -0.16 0.00 0.00 177.13 177.31 3kbo n PHE 137 N 0.97 3.39 -2.34 -1.84 7.35 -0.53 -4.76 117.46 119.70 3kbo n PHE 137 Ca 0.18 -3.69 -0.41 0.00 -0.76 0.00 0.00 57.45 52.77 3kbo n PHE 137 Cb 0.47 -0.37 -0.03 0.00 0.35 0.00 0.00 39.48 39.89 3kbo n PHE 137 CO 0.00 0.00 0.00 -1.12 -0.76 0.00 0.00 176.76 174.88 3kbo s SER 138 N -3.38 7.07 -0.17 -2.13 0.01 -1.26 -4.44 113.70 109.40 3kbo s SER 138 Ca 0.47 2.38 -0.07 0.00 1.31 0.00 0.00 55.95 60.04 3kbo s SER 138 Cb 0.33 -2.63 -0.04 0.00 0.21 0.00 0.00 66.02 63.89 3kbo s SER 138 CO -0.14 -0.33 0.05 -0.69 0.41 0.00 0.00 173.24 172.54 3kbo s VAL 139 N -0.77 4.66 -0.17 3.43 1.01 -0.52 -0.39 120.40 127.66 3kbo s VAL 139 Ca 0.49 -0.08 -0.01 0.00 0.00 0.00 0.00 61.98 62.37 3kbo s VAL 139 Cb -0.34 -3.09 -0.01 0.00 0.00 0.00 0.00 36.38 32.94 3kbo s VAL 139 CO 0.43 0.47 -0.11 -0.83 0.00 0.00 0.00 175.10 175.06 3kbo s GLY 140 N 0.30 1.54 0.01 4.51 0.00 0.58 -1.25 107.32 113.00 3kbo s GLY 140 Ca 0.02 -1.05 0.00 0.00 0.00 0.00 0.00 44.72 43.69 3kbo s GLY 140 CO 0.01 0.13 0.01 1.39 0.00 0.00 0.00 173.10 174.64 3kbo n ILE 141 N 4.21 0.00 -2.07 0.90 5.41 -0.05 -0.06 119.36 127.71 3kbo n ILE 141 Ca -0.19 -0.03 -0.00 0.00 1.00 0.00 0.00 62.75 63.53 3kbo n ILE 141 Cb 0.52 -0.54 0.00 0.00 -0.71 0.00 0.00 39.64 38.90 3kbo n ILE 141 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3kbo n GLY 143 N 4.90 0.00 2.70 7.39 0.00 -0.10 -1.44 105.19 118.64 3kbo n GLY 143 Ca -0.00 0.01 -0.40 0.00 0.00 0.00 0.00 46.02 45.64 3kbo n GLY 143 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kbo n ALA 144 N 0.94 6.06 -2.29 4.61 0.00 -1.13 -4.09 120.51 124.60 3kbo n ALA 144 Ca -0.00 -4.53 0.00 0.00 0.00 0.00 0.00 53.44 48.90 3kbo n ALA 144 Cb 0.29 -2.06 0.00 0.00 0.00 0.00 0.00 19.45 17.68 3kbo n ALA 144 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3kbo n GLY 145 N -0.15 2.86 0.11 0.00 0.00 -1.26 -4.57 105.19 102.18 3kbo n GLY 145 Ca 0.47 -1.77 -0.11 0.00 0.00 0.00 0.00 46.02 44.61 3kbo n GLY 145 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3kbo h VAL 146 N 0.00 0.82 0.06 1.61 2.07 -1.97 0.15 116.25 119.00 3kbo h VAL 146 Ca 0.00 0.00 -0.28 0.00 0.82 0.00 0.00 66.70 67.24 3kbo h VAL 146 Cb 0.00 0.82 0.02 0.00 -1.52 0.00 0.00 31.29 30.62 3kbo h VAL 146 CO 0.00 0.00 -1.14 -0.07 0.02 0.00 0.00 177.57 176.38 3kbo h LEU 147 N -0.11 0.88 -1.07 2.57 3.38 -1.94 -3.15 115.31 115.87 3kbo h LEU 147 Ca 0.03 -0.76 0.02 0.00 0.09 0.00 0.00 57.88 57.26 3kbo h LEU 147 Cb 0.15 -0.27 -0.05 0.00 0.09 0.00 0.00 40.66 40.58 3kbo h LEU 147 CO -0.08 1.56 0.63 1.23 0.09 0.00 0.00 178.44 181.87 3kbo h GLY 148 N 0.40 1.35 0.99 0.83 0.00 -1.69 -1.75 103.07 103.20 3kbo h GLY 148 Ca -0.16 -0.49 -0.01 0.00 0.00 0.00 0.00 47.33 46.68 3kbo h GLY 148 CO 0.22 0.45 0.32 0.00 0.00 0.00 0.00 176.54 177.53 3kbo h ALA 149 N 1.43 0.76 -0.34 3.60 0.00 -0.72 -1.25 119.26 122.73 3kbo h ALA 149 Ca 0.36 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 55.14 3kbo h ALA 149 Cb -0.07 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.46 3kbo h ALA 149 CO -0.09 0.28 0.12 0.87 0.00 0.00 0.00 179.25 180.42 3kbo h LYS 150 N 0.80 0.53 -0.62 0.00 1.79 -1.39 -1.75 116.57 115.94 3kbo h LYS 150 Ca 0.21 -0.11 -0.01 0.00 -2.18 0.00 0.00 60.65 58.56 3kbo h LYS 150 Cb 0.05 -0.08 -0.03 0.00 -1.58 0.00 0.00 32.23 30.59 3kbo h LYS 150 CO -0.03 0.55 0.33 0.28 -1.08 0.00 0.00 179.45 179.50 3kbo h VAL 151 N 0.40 1.20 -0.02 0.50 2.07 -1.16 -1.02 116.25 118.22 3kbo h VAL 151 Ca 0.11 -0.52 0.00 0.00 0.82 0.00 0.00 66.70 67.12 3kbo h VAL 151 Cb 0.23 0.41 -0.00 0.00 -1.52 0.00 0.00 31.29 30.41 3kbo h VAL 151 CO -0.01 0.22 0.00 0.00 0.02 0.00 0.00 177.57 177.81 3kbo h ALA 152 N 1.16 0.02 -0.14 1.67 0.00 -1.05 -1.73 119.26 119.18 3kbo h ALA 152 Ca 0.22 0.00 0.05 0.00 0.00 0.00 0.00 54.91 55.18 3kbo h ALA 152 Cb 0.05 0.01 -0.06 0.00 0.00 0.00 0.00 17.79 17.79 3kbo h ALA 152 CO -0.03 -0.49 -0.23 1.49 0.00 0.00 0.00 179.25 179.99 3kbo h GLU 153 N 0.01 -0.27 0.00 0.00 4.57 -1.04 -0.34 114.58 117.51 3kbo h GLU 153 Ca 0.01 0.02 -0.01 0.00 -1.18 0.00 0.00 59.36 58.20 3kbo h GLU 153 Cb 0.01 0.06 -0.00 0.00 -0.16 0.00 0.00 28.75 28.66 3kbo h GLU 153 CO -0.01 -0.18 -0.05 0.66 -1.18 0.00 0.00 179.01 178.25 3kbo h SER 154 N -0.28 0.00 0.07 1.04 4.64 -0.99 -3.15 113.55 114.88 3kbo h SER 154 Ca 0.11 0.00 -0.25 0.00 -0.47 0.00 0.00 61.79 61.18 3kbo h SER 154 Cb 0.44 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.51 3kbo h SER 154 CO -0.31 0.05 -1.32 -0.07 -0.87 0.00 0.00 176.83 174.31 3kbo h LEU 155 N 0.00 0.22 -2.62 5.97 3.38 -0.34 -3.34 115.31 118.59 3kbo h LEU 155 Ca -0.00 -0.76 0.01 0.00 0.09 0.00 0.00 57.88 57.22 3kbo h LEU 155 Cb 0.10 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 40.78 3kbo h LEU 155 CO 0.01 1.56 0.10 -0.61 0.09 0.00 0.00 178.44 179.58 3kbo h GLN 156 N -0.56 0.00 0.00 1.13 -0.00 -1.15 0.33 115.11 114.86 3kbo h GLN 156 Ca -0.31 0.00 -0.01 0.00 -0.00 0.00 0.00 58.65 58.32 3kbo h GLN 156 Cb 1.57 0.00 -0.00 0.00 0.00 0.00 0.00 27.48 29.05 3kbo h GLN 156 CO -0.04 0.00 -0.07 0.00 0.00 0.00 0.00 178.83 178.73 3kbo h ALA 157 N 1.83 1.16 -0.41 3.38 0.00 -1.66 -2.24 119.26 121.32 3kbo h ALA 157 Ca 0.01 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.86 3kbo h ALA 157 Cb 0.21 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.99 3kbo h ALA 157 CO -0.00 0.08 0.00 0.91 0.00 0.00 0.00 179.25 180.24 3kbo n TRP 158 N -3.40 0.55 -0.93 0.00 7.02 0.12 -4.96 117.44 115.84 3kbo n TRP 158 Ca -0.02 -0.27 0.00 0.00 -1.02 0.00 0.00 57.50 56.19 3kbo n TRP 158 Cb 0.21 0.00 0.00 0.00 -2.42 0.00 0.00 31.31 29.10 3kbo n TRP 158 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 3kbo n GLY 159 N 1.22 0.89 3.76 6.99 0.00 -0.84 -5.03 105.19 112.18 3kbo n GLY 159 Ca 0.15 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.77 3kbo n GLY 159 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3kbo s PHE 160 N -3.52 3.37 0.31 1.61 0.08 -1.26 -4.91 117.98 113.66 3kbo s PHE 160 Ca 0.00 1.53 -0.29 0.00 0.12 0.00 0.00 56.93 58.29 3kbo s PHE 160 Cb 0.00 -3.45 -0.10 0.00 -0.57 0.00 0.00 43.02 38.89 3kbo s PHE 160 CO 0.00 -1.15 1.37 -2.14 -0.10 0.00 0.00 175.22 173.20 3kbo s PRO 161 N -1.27 4.30 0.05 0.24 0.02 -1.26 -4.61 135.00 132.47 3kbo s PRO 161 Ca 0.48 2.29 0.08 0.00 0.02 0.00 0.00 61.00 63.86 3kbo s PRO 161 Cb -0.35 -3.07 -0.03 0.00 0.02 0.00 0.00 34.50 31.08 3kbo s PRO 161 CO 0.44 -0.30 -0.21 -0.51 -0.33 0.00 0.00 177.00 176.08 3kbo s LEU 162 N -1.41 2.18 0.02 -5.54 1.43 -1.25 -1.43 118.68 112.67 3kbo s LEU 162 Ca 0.52 -0.54 -0.00 0.00 -1.03 0.00 0.00 54.13 53.08 3kbo s LEU 162 Cb -0.41 -0.99 -0.02 0.00 0.03 0.00 0.00 46.19 44.80 3kbo s LEU 162 CO 0.51 0.16 -0.02 0.00 0.23 0.00 0.00 176.35 177.23 3kbo s ARG 163 N -1.25 0.28 0.07 1.70 1.70 -0.38 -0.39 118.95 120.68 3kbo s ARG 163 Ca 0.08 -0.55 0.02 0.00 -0.47 0.00 0.00 55.73 54.81 3kbo s ARG 163 Cb -0.09 0.10 -0.03 0.00 -0.57 0.00 0.00 34.95 34.36 3kbo s ARG 163 CO 0.02 -0.05 -0.08 0.00 -1.08 0.00 0.00 175.30 174.12 3kbo s TRP 165 N -2.18 1.41 0.34 0.00 -0.00 -0.52 -0.15 118.94 117.84 3kbo s TRP 165 Ca -0.02 -0.54 -0.13 0.00 -0.00 0.00 0.00 56.10 55.42 3kbo s TRP 165 Cb -0.05 -1.06 0.03 0.00 -0.00 0.00 0.00 33.47 32.39 3kbo s TRP 165 CO -0.01 -0.30 0.66 -1.54 -0.00 0.00 0.00 176.95 175.75 3kbo s SER 166 N 0.82 0.18 0.24 5.86 1.04 -0.87 -0.92 113.70 120.05 3kbo s SER 166 Ca -0.12 -1.12 0.26 0.00 0.48 0.00 0.00 55.95 55.45 3kbo s SER 166 Cb -0.15 0.75 0.77 0.00 0.10 0.00 0.00 66.02 67.49 3kbo s SER 166 CO 0.02 -1.47 1.76 0.03 0.98 0.00 0.00 173.24 174.56 3kbo h ARG 167 N 2.06 0.00 -4.46 4.02 3.08 -1.95 -0.75 114.38 116.38 3kbo h ARG 167 Ca -0.28 0.00 -0.24 0.00 0.07 0.00 0.00 59.98 59.52 3kbo h ARG 167 Cb 1.25 0.00 -0.20 0.00 0.08 0.00 0.00 29.97 31.10 3kbo h ARG 167 CO 0.37 0.00 -0.72 -1.54 -1.07 0.00 0.00 179.97 177.01 3kbo s SER 168 N -4.70 0.78 0.35 7.04 1.04 -1.26 -4.57 113.70 112.38 3kbo s SER 168 Ca 0.10 -0.63 -0.28 0.00 0.48 0.00 0.00 55.95 55.62 3kbo s SER 168 Cb 0.12 0.06 -0.11 0.00 0.10 0.00 0.00 66.02 66.19 3kbo s SER 168 CO 0.60 -0.28 1.44 -0.60 0.98 0.00 0.00 173.24 175.38 3kbo s ARG 169 N -1.99 4.19 0.12 4.02 6.06 -1.26 -4.90 118.95 125.19 3kbo s ARG 169 Ca -0.07 2.46 0.10 0.00 -2.50 0.00 0.00 55.73 55.72 3kbo s ARG 169 Cb -0.07 -3.01 -0.04 0.00 0.06 0.00 0.00 34.95 31.90 3kbo s ARG 169 CO -0.01 -0.43 -0.24 0.15 -2.50 0.00 0.00 175.30 172.26 3kbo s LYS 170 N -1.87 1.28 -0.50 5.12 -0.14 -1.26 -5.10 119.74 117.28 3kbo s LYS 170 Ca 0.52 -1.27 0.03 0.00 -1.36 0.00 0.00 55.97 53.90 3kbo s LYS 170 Cb -0.44 -1.69 0.15 0.00 -1.68 0.00 0.00 37.83 34.17 3kbo s LYS 170 CO 0.59 0.40 0.33 0.45 -0.76 0.00 0.00 175.35 176.36 3kbo s SER 171 N -1.99 3.30 -0.05 2.83 0.15 -1.26 -4.57 113.70 112.11 3kbo s SER 171 Ca 0.11 -3.06 0.03 0.00 0.70 0.00 0.00 55.95 53.73 3kbo s SER 171 Cb -0.10 -1.00 -0.03 0.00 -1.71 0.00 0.00 66.02 63.18 3kbo s SER 171 CO 0.05 -0.19 -0.12 0.26 1.20 0.00 0.00 173.24 174.44 3kbo s TRP 172 N -0.18 2.78 0.33 3.44 0.51 -1.26 -5.09 118.94 119.46 3kbo s TRP 172 Ca 0.24 -0.09 -0.29 0.00 -2.12 0.00 0.00 56.10 53.84 3kbo s TRP 172 Cb -0.11 -1.65 -0.10 0.00 -0.81 0.00 0.00 33.47 30.80 3kbo s TRP 172 CO -0.10 0.25 1.28 -1.25 -0.51 0.00 0.00 176.95 176.62 3kbo s PRO 173 N -0.84 4.39 0.00 4.98 0.04 -1.26 -2.41 135.00 139.90 3kbo s PRO 173 Ca 0.12 2.17 0.00 0.00 0.04 0.00 0.00 61.00 63.33 3kbo s PRO 173 Cb -0.11 -3.08 0.00 0.00 0.04 0.00 0.00 34.50 31.35 3kbo s PRO 173 CO 0.02 -0.14 0.00 0.41 0.04 0.00 0.00 177.00 177.32 3kbo n GLY 174 N 0.84 1.70 3.33 0.56 0.00 -1.26 -5.00 105.19 105.36 3kbo n GLY 174 Ca -0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 3kbo n GLY 174 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3kbo s VAL 175 N -3.28 2.53 -0.15 1.61 1.01 -1.01 -3.77 120.40 117.34 3kbo s VAL 175 Ca 0.00 -0.88 -0.16 0.00 0.00 0.00 0.00 61.98 60.94 3kbo s VAL 175 Cb 0.00 -1.99 -0.04 0.00 0.00 0.00 0.00 36.38 34.35 3kbo s VAL 175 CO 0.00 0.56 0.40 -0.70 0.00 0.00 0.00 175.10 175.36 3kbo s GLU 176 N -0.01 4.29 -0.20 2.72 2.56 0.47 -4.48 118.70 124.05 3kbo s GLU 176 Ca -0.06 0.29 -0.07 0.00 0.00 0.00 0.00 54.97 55.13 3kbo s GLU 176 Cb -0.15 -3.45 -0.04 0.00 2.00 0.00 0.00 34.13 32.50 3kbo s GLU 176 CO 0.05 0.16 0.07 0.45 -0.56 0.00 0.00 175.26 175.42 3kbo s SER 177 N 0.63 5.48 -0.09 -1.70 0.15 -1.26 -0.57 113.70 116.35 3kbo s SER 177 Ca 0.22 -0.00 0.00 0.00 0.70 0.00 0.00 55.95 56.87 3kbo s SER 177 Cb -0.14 -1.95 -0.03 0.00 -1.71 0.00 0.00 66.02 62.19 3kbo s SER 177 CO 0.08 0.11 -0.09 -0.31 1.20 0.00 0.00 173.24 174.23 3kbo s TYR 178 N 0.74 2.88 -0.12 3.44 2.02 0.79 -4.90 117.35 122.21 3kbo s TYR 178 Ca 0.03 -0.19 0.02 0.00 -0.37 0.00 0.00 57.07 56.56 3kbo s TYR 178 Cb -0.13 -1.76 0.01 0.00 -0.40 0.00 0.00 41.96 39.68 3kbo s TYR 178 CO 0.02 0.14 -0.18 0.08 -1.57 0.00 0.00 175.55 174.04 3kbo s VAL 179 N -0.38 1.71 0.16 0.71 1.01 -1.26 -2.04 120.40 120.31 3kbo s VAL 179 Ca 0.05 -0.78 0.00 0.00 0.00 0.00 0.00 61.98 61.25 3kbo s VAL 179 Cb -0.12 -1.54 0.00 0.00 0.00 0.00 0.00 36.38 34.72 3kbo s VAL 179 CO 0.02 0.48 0.00 0.61 0.00 0.00 0.00 175.10 176.22 3kbo n GLY 180 N 4.10 -2.08 0.29 4.51 0.00 -0.29 -3.65 105.19 108.08 3kbo n GLY 180 Ca -0.19 -1.37 0.15 0.00 0.00 0.00 0.00 46.02 44.60 3kbo n GLY 180 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3kbo h ARG 181 N -0.48 0.00 0.00 1.61 2.47 -1.98 -1.48 114.38 114.52 3kbo h ARG 181 Ca -0.02 0.00 -0.02 0.00 -1.26 0.00 0.00 59.98 58.67 3kbo h ARG 181 Cb 0.47 0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 28.79 3kbo h ARG 181 CO 0.01 0.00 -0.11 0.93 0.56 0.00 0.00 179.97 181.37 3kbo h GLU 182 N 0.00 0.00 -0.12 0.04 3.07 -2.01 -2.94 114.58 112.62 3kbo h GLU 182 Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 3kbo h GLU 182 Cb 0.01 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.92 3kbo h GLU 182 CO 0.00 0.11 0.00 0.39 -1.40 0.00 0.00 179.01 178.11 3kbo n GLU 183 N -3.85 2.34 -0.04 2.33 1.02 -0.57 -4.72 120.64 117.15 3kbo n GLU 183 Ca -0.02 -2.30 -0.15 0.00 -0.02 0.00 0.00 57.16 54.66 3kbo n GLU 183 Cb 0.21 -1.43 -0.08 0.00 -0.02 0.00 0.00 31.44 30.12 3kbo n GLU 183 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 3kbo h LEU 184 N 0.74 0.56 -0.84 -4.62 5.85 -1.38 -1.63 115.31 113.99 3kbo h LEU 184 Ca 0.00 -0.61 0.06 0.00 0.84 0.00 0.00 57.88 58.17 3kbo h LEU 184 Cb 0.95 -0.16 -0.06 0.00 0.37 0.00 0.00 40.66 41.75 3kbo h LEU 184 CO 0.05 1.07 0.52 -0.09 -0.34 0.00 0.00 178.44 179.66 3kbo h ARG 185 N 0.08 0.94 -0.05 1.25 2.43 -1.84 -0.60 114.38 116.59 3kbo h ARG 185 Ca -0.02 -0.06 -0.01 0.00 -0.81 0.00 0.00 59.98 59.09 3kbo h ARG 185 Cb 1.03 -0.21 -0.00 0.00 -0.42 0.00 0.00 29.97 30.36 3kbo h ARG 185 CO 0.09 0.62 0.00 0.00 -1.51 0.00 0.00 179.97 179.17 3kbo h ALA 186 N 1.39 0.07 -0.69 2.80 0.00 -1.88 -1.48 119.26 119.47 3kbo h ALA 186 Ca 0.36 -0.16 0.15 0.00 0.00 0.00 0.00 54.91 55.26 3kbo h ALA 186 Cb 0.14 -0.02 -0.11 0.00 0.00 0.00 0.00 17.79 17.80 3kbo h ALA 186 CO -0.16 -0.27 0.11 0.35 0.00 0.00 0.00 179.25 179.28 3kbo h PHE 187 N -0.20 0.16 0.01 0.00 3.57 -0.93 -2.97 116.94 116.58 3kbo h PHE 187 Ca 0.01 0.04 -0.19 0.00 3.53 0.00 0.00 57.97 61.36 3kbo h PHE 187 Cb 0.32 0.04 -0.02 0.00 2.79 0.00 0.00 35.95 39.08 3kbo h PHE 187 CO 0.03 -0.11 -0.89 -0.07 -2.23 0.00 0.00 178.31 175.04 3kbo h LEU 188 N 0.22 0.14 -0.91 0.59 3.38 -0.97 -3.37 115.31 114.39 3kbo h LEU 188 Ca 0.38 -0.12 0.21 0.00 0.09 0.00 0.00 57.88 58.44 3kbo h LEU 188 Cb 0.63 -0.04 -0.17 0.00 0.09 0.00 0.00 40.66 41.16 3kbo h LEU 188 CO -0.51 0.95 -0.11 -1.13 0.09 0.00 0.00 178.44 177.73 3kbo h ASN 189 N 0.05 -0.66 -0.13 -0.43 -0.73 -1.10 -1.43 115.58 111.16 3kbo h ASN 189 Ca -0.03 0.26 -0.02 0.00 1.87 0.00 0.00 56.30 58.38 3kbo h ASN 189 Cb 1.54 0.51 -0.01 0.00 0.27 0.00 0.00 38.32 40.62 3kbo h ASN 189 CO 0.13 -0.30 -0.05 0.00 -0.37 0.00 0.00 177.43 176.84 3kbo n GLN 190 N -5.52 1.96 -2.69 6.67 1.13 -1.26 -3.46 117.38 114.21 3kbo n GLN 190 Ca 0.17 -2.81 -0.43 0.00 -1.94 0.00 0.00 57.00 51.99 3kbo n GLN 190 Cb 0.55 -1.67 -0.02 0.00 0.11 0.00 0.00 30.24 29.21 3kbo n GLN 190 CO 0.00 0.00 0.00 0.99 -1.44 0.00 0.00 177.06 176.61 3kbo s THR 191 N -2.94 4.60 -0.15 5.09 2.01 -0.54 -4.47 115.64 119.25 3kbo s THR 191 Ca 0.38 1.75 -0.23 0.00 0.31 0.00 0.00 61.69 63.90 3kbo s THR 191 Cb 0.32 -4.34 -0.24 0.00 0.01 0.00 0.00 72.50 68.25 3kbo s THR 191 CO 0.04 -0.35 0.52 -0.09 -0.69 0.00 0.00 174.62 174.05 3kbo h ARG 192 N 7.90 0.08 -4.91 4.92 9.65 -1.02 -3.38 114.38 127.63 3kbo h ARG 192 Ca -0.21 -0.14 -0.67 0.00 -1.10 0.00 0.00 59.98 57.87 3kbo h ARG 192 Cb 1.07 0.05 -0.32 0.00 -1.39 0.00 0.00 29.97 29.37 3kbo h ARG 192 CO 0.99 1.07 -0.75 0.08 2.80 0.00 0.00 179.97 184.15 3kbo s VAL 193 N -2.35 2.78 -0.34 0.20 1.01 -0.63 -0.73 120.40 120.33 3kbo s VAL 193 Ca -0.22 -1.08 -0.15 0.00 0.00 0.00 0.00 61.98 60.53 3kbo s VAL 193 Cb 0.02 -2.42 -0.01 0.00 0.00 0.00 0.00 36.38 33.97 3kbo s VAL 193 CO 0.68 0.19 0.33 -0.22 0.00 0.00 0.00 175.10 176.08 3kbo s LEU 194 N 1.30 4.48 -0.23 3.92 2.96 0.02 -0.31 118.68 130.82 3kbo s LEU 194 Ca -0.00 -0.30 -0.07 0.00 -0.22 0.00 0.00 54.13 53.54 3kbo s LEU 194 Cb -0.17 -2.28 -0.03 0.00 0.50 0.00 0.00 46.19 44.21 3kbo s LEU 194 CO -0.05 -0.32 0.05 -0.63 -1.32 0.00 0.00 176.35 174.08 3kbo s ILE 195 N 1.94 4.27 -0.31 6.68 1.01 0.92 -1.06 121.20 134.64 3kbo s ILE 195 Ca 0.10 -0.19 -0.12 0.00 0.00 0.00 0.00 60.65 60.44 3kbo s ILE 195 Cb -0.17 -2.97 -0.03 0.00 0.01 0.00 0.00 42.46 39.31 3kbo s ILE 195 CO 0.11 0.38 0.20 0.21 0.00 0.00 0.00 174.94 175.85 3kbo s ASN 196 N 1.26 5.95 -0.18 3.58 2.47 -0.34 -4.31 114.94 123.37 3kbo s ASN 196 Ca 0.04 -0.27 0.18 0.00 0.42 0.00 0.00 52.86 53.23 3kbo s ASN 196 Cb -0.15 -2.11 0.46 0.00 -1.45 0.00 0.00 41.25 38.01 3kbo s ASN 196 CO 0.03 -0.15 1.16 0.18 -3.72 0.00 0.00 177.10 174.60 3kbo n LEU 197 N 5.07 2.34 -4.89 3.21 4.77 -1.26 -1.53 117.00 124.71 3kbo n LEU 197 Ca -0.13 -3.27 -0.29 0.00 -0.03 0.00 0.00 56.01 52.28 3kbo n LEU 197 Cb 0.51 -0.02 0.02 0.00 -2.33 0.00 0.00 43.42 41.59 3kbo n LEU 197 CO 0.35 1.18 0.64 -0.76 -1.33 0.00 0.00 177.39 177.47 3kbo s LEU 198 N -2.58 3.26 0.40 2.23 1.43 -1.26 -4.55 118.68 117.61 3kbo s LEU 198 Ca 0.36 1.16 -0.02 0.00 -1.03 0.00 0.00 54.13 54.60 3kbo s LEU 198 Cb 0.37 -4.11 -0.03 0.00 0.03 0.00 0.00 46.19 42.44 3kbo s LEU 198 CO -0.07 -0.91 0.65 -2.16 0.23 0.00 0.00 176.35 174.09 3kbo s PRO 199 N -5.09 3.49 -0.31 1.29 0.04 -1.26 -4.53 135.00 128.63 3kbo s PRO 199 Ca 0.54 -0.13 -0.29 0.00 0.04 0.00 0.00 61.00 61.15 3kbo s PRO 199 Cb -0.11 -2.54 0.01 0.00 0.04 0.00 0.00 34.50 31.90 3kbo s PRO 199 CO 0.50 -0.01 1.12 1.21 0.04 0.00 0.00 177.00 179.86 3kbo s ASN 200 N -4.07 6.89 0.18 6.66 2.47 -1.26 -4.85 114.94 120.97 3kbo s ASN 200 Ca 0.43 1.10 -0.07 0.00 0.42 0.00 0.00 52.86 54.74 3kbo s ASN 200 Cb -0.10 -2.54 -0.02 0.00 -1.45 0.00 0.00 41.25 37.14 3kbo s ASN 200 CO 0.40 -0.91 0.26 0.42 -3.72 0.00 0.00 177.10 173.55 3kbo s THR 201 N 3.76 0.05 0.24 -5.21 -4.23 -1.26 -4.67 115.64 104.32 3kbo s THR 201 Ca 0.47 -1.58 -0.04 0.00 -1.18 0.00 0.00 61.69 59.36 3kbo s THR 201 Cb -0.13 -2.06 0.21 0.00 1.34 0.00 0.00 72.50 71.86 3kbo s THR 201 CO 0.17 -0.21 1.79 0.00 -0.54 0.00 0.00 174.62 175.82 3kbo h ALA 202 N 2.55 1.14 0.00 3.99 0.00 -1.94 -1.74 119.26 123.25 3kbo h ALA 202 Ca -0.32 0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.62 3kbo h ALA 202 Cb 1.23 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.95 3kbo h ALA 202 CO 0.48 -0.01 -0.12 1.96 0.00 0.00 0.00 179.25 181.57 3kbo h GLN 203 N 0.68 0.00 0.00 0.00 7.50 -1.96 -3.24 115.11 118.08 3kbo h GLN 203 Ca 0.40 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.55 3kbo h GLN 203 Cb 0.45 0.00 0.00 0.00 0.05 0.00 0.00 27.48 27.98 3kbo h GLN 203 CO -0.29 0.12 -0.96 0.25 -1.50 0.00 0.00 178.83 176.45 3kbo n THR 204 N -3.66 0.00 -1.64 -0.54 -2.24 -0.80 -4.92 114.28 100.48 3kbo n THR 204 Ca -0.02 -0.24 -0.50 0.00 -2.27 0.00 0.00 64.05 61.02 3kbo n THR 204 Cb 0.24 0.69 -0.05 0.00 -2.10 0.00 0.00 70.33 69.11 3kbo n THR 204 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 3kbo n VAL 205 N -1.54 0.10 -1.09 2.28 0.31 -0.72 -1.27 118.33 116.40 3kbo n VAL 205 Ca 0.01 -0.02 -0.03 0.00 -0.01 0.00 0.00 64.34 64.29 3kbo n VAL 205 Cb 0.24 -1.24 -0.01 0.00 -0.91 0.00 0.00 33.84 31.92 3kbo n VAL 205 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3kbo n GLY 206 N 3.25 0.56 0.31 2.92 0.00 0.10 -4.92 105.19 107.41 3kbo n GLY 206 Ca 0.19 -0.21 0.05 0.00 0.00 0.00 0.00 46.02 46.05 3kbo n GLY 206 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 3kbo h ILE 207 N 0.00 1.07 -2.17 -0.61 2.10 -1.11 -3.26 117.51 113.54 3kbo h ILE 207 Ca -0.06 -0.17 -0.71 0.00 1.08 0.00 0.00 64.86 65.00 3kbo h ILE 207 Cb 0.49 0.53 -0.17 0.00 -1.09 0.00 0.00 36.82 36.57 3kbo h ILE 207 CO 0.09 0.09 1.18 -0.63 -1.08 0.00 0.00 178.15 177.80 3kbo s ILE 208 N -5.45 4.81 0.22 2.19 1.01 0.06 -4.57 121.20 119.47 3kbo s ILE 208 Ca -0.08 -2.07 0.00 0.00 0.00 0.00 0.00 60.65 58.51 3kbo s ILE 208 Cb 0.18 -4.87 0.00 0.00 0.01 0.00 0.00 42.46 37.78 3kbo s ILE 208 CO 0.73 -1.60 0.03 -0.46 0.00 0.00 0.00 174.94 173.64 3kbo n ASN 209 N 6.30 2.44 0.21 3.58 0.23 -1.23 -1.20 115.26 125.60 3kbo n ASN 209 Ca 0.32 -1.91 0.05 0.00 -0.53 0.00 0.00 54.58 52.50 3kbo n ASN 209 Cb 0.46 0.12 0.47 0.00 -2.08 0.00 0.00 39.78 38.75 3kbo n ASN 209 CO 0.00 0.00 0.00 0.77 -0.93 0.00 0.00 177.26 177.10 3kbo h SER 210 N 0.47 0.00 -0.44 0.53 4.64 -1.91 -0.93 113.55 115.91 3kbo h SER 210 Ca -0.17 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 61.02 3kbo h SER 210 Cb 0.54 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.61 3kbo h SER 210 CO 0.28 0.24 -0.23 -0.08 -0.87 0.00 0.00 176.83 176.17 3kbo h GLU 211 N 0.00 0.96 -0.21 4.77 4.81 -1.96 -1.12 114.58 121.84 3kbo h GLU 211 Ca -0.00 -0.42 -0.21 0.00 -0.13 0.00 0.00 59.36 58.60 3kbo h GLU 211 Cb 0.42 -0.03 0.01 0.00 0.63 0.00 0.00 28.75 29.78 3kbo h GLU 211 CO 0.03 1.08 -0.69 1.25 -0.73 0.00 0.00 179.01 179.96 3kbo h LEU 212 N 0.83 0.95 -1.31 1.64 6.46 -1.70 -3.17 115.31 119.01 3kbo h LEU 212 Ca 0.10 -0.58 -0.03 0.00 -0.12 0.00 0.00 57.88 57.25 3kbo h LEU 212 Cb 0.80 -0.28 -0.02 0.00 -0.73 0.00 0.00 40.66 40.43 3kbo h LEU 212 CO 0.07 1.38 0.11 -0.07 -0.62 0.00 0.00 178.44 179.30 3kbo h LEU 213 N 0.59 0.52 -1.81 2.25 3.38 -1.13 -1.40 115.31 117.71 3kbo h LEU 213 Ca -0.03 -0.07 -0.01 0.00 0.09 0.00 0.00 57.88 57.86 3kbo h LEU 213 Cb 1.31 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 41.92 3kbo h LEU 213 CO 0.15 0.52 -0.06 0.44 0.09 0.00 0.00 178.44 179.58 3kbo h ASP 214 N 0.56 0.00 1.25 -0.43 3.32 -1.17 -2.70 116.42 117.26 3kbo h ASP 214 Ca 0.13 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.18 3kbo h ASP 214 Cb 0.20 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.75 3kbo h ASP 214 CO -0.01 0.06 -0.15 0.00 -1.72 0.00 0.00 179.24 177.42 3kbo n GLN 215 N -3.26 0.22 -1.76 3.56 6.02 -0.53 -4.85 117.38 116.79 3kbo n GLN 215 Ca -0.01 0.15 -0.31 0.00 -0.01 0.00 0.00 57.00 56.83 3kbo n GLN 215 Cb 0.26 -1.73 0.03 0.00 1.02 0.00 0.00 30.24 29.82 3kbo n GLN 215 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 3kbo s LEU 216 N -4.21 3.17 0.80 1.08 1.43 -1.02 -3.19 118.68 116.74 3kbo s LEU 216 Ca 0.10 1.47 -0.12 0.00 -1.03 0.00 0.00 54.13 54.56 3kbo s LEU 216 Cb 0.14 -4.45 0.07 0.00 0.03 0.00 0.00 46.19 41.98 3kbo s LEU 216 CO 0.62 -1.11 1.10 -2.16 0.23 0.00 0.00 176.35 175.03 3kbo s PRO 217 N -5.14 2.05 0.49 1.29 0.04 -1.22 -4.96 135.00 127.55 3kbo s PRO 217 Ca 0.56 0.59 -0.22 0.00 0.04 0.00 0.00 61.00 61.97 3kbo s PRO 217 Cb -0.12 -1.92 -0.07 0.00 0.04 0.00 0.00 34.50 32.43 3kbo s PRO 217 CO 0.54 -1.63 1.17 -0.51 0.04 0.00 0.00 177.00 176.61 3kbo s ASP 218 N -3.96 5.99 -0.13 6.66 1.01 -1.26 -3.43 116.67 121.55 3kbo s ASP 218 Ca 0.61 2.31 0.00 0.00 0.71 0.00 0.00 52.55 56.18 3kbo s ASP 218 Cb -0.14 -2.60 0.00 0.00 1.01 0.00 0.00 42.92 41.19 3kbo s ASP 218 CO 0.54 -1.04 0.00 0.61 0.21 0.00 0.00 175.17 175.48 3kbo n GLY 219 N 0.40 0.47 3.93 0.21 0.00 -0.14 -5.00 105.19 105.07 3kbo n GLY 219 Ca 0.09 -1.03 -0.29 0.00 0.00 0.00 0.00 46.02 44.78 3kbo n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kbo s ALA 220 N -2.05 2.37 0.03 4.61 0.00 -1.02 -4.34 121.76 121.36 3kbo s ALA 220 Ca 0.00 -1.16 -0.00 0.00 0.00 0.00 0.00 51.96 50.79 3kbo s ALA 220 Cb 0.00 -2.75 -0.03 0.00 0.00 0.00 0.00 23.12 20.34 3kbo s ALA 220 CO 0.00 -2.29 -0.03 0.71 0.00 0.00 0.00 175.76 174.15 3kbo s TYR 221 N -3.81 0.33 -0.09 0.00 2.02 0.09 0.48 117.35 116.37 3kbo s TYR 221 Ca 0.72 -0.68 0.02 0.00 -0.37 0.00 0.00 57.07 56.75 3kbo s TYR 221 Cb -0.05 -0.25 0.01 0.00 -0.40 0.00 0.00 41.96 41.28 3kbo s TYR 221 CO 0.52 -0.25 -0.14 0.08 -1.57 0.00 0.00 175.55 174.19 3kbo s VAL 222 N -2.21 1.33 -0.35 0.71 1.01 -0.80 -0.80 120.40 119.29 3kbo s VAL 222 Ca -0.09 -0.56 0.01 0.00 0.00 0.00 0.00 61.98 61.34 3kbo s VAL 222 Cb -0.04 -1.22 0.09 0.00 0.00 0.00 0.00 36.38 35.20 3kbo s VAL 222 CO -0.04 0.40 0.08 -0.22 0.00 0.00 0.00 175.10 175.32 3kbo s LEU 223 N 0.89 4.64 -0.40 3.92 2.96 -0.22 -4.11 118.68 126.36 3kbo s LEU 223 Ca -0.10 -1.88 -0.16 0.00 -0.22 0.00 0.00 54.13 51.78 3kbo s LEU 223 Cb -0.15 -1.70 0.01 0.00 0.50 0.00 0.00 46.19 44.85 3kbo s LEU 223 CO 0.01 -0.39 0.37 0.21 -1.32 0.00 0.00 176.35 175.22 3kbo s ASN 224 N 1.30 6.16 0.00 3.68 2.47 -1.26 -1.20 114.94 126.09 3kbo s ASN 224 Ca 0.05 -0.63 0.04 0.00 0.42 0.00 0.00 52.86 52.74 3kbo s ASN 224 Cb -0.21 -2.20 0.09 0.00 -1.45 0.00 0.00 41.25 37.49 3kbo s ASN 224 CO -0.05 -0.47 0.97 0.18 -3.72 0.00 0.00 177.10 174.00 3kbo n LEU 225 N 5.41 2.07 0.00 3.21 4.77 -0.58 -1.84 117.00 130.03 3kbo n LEU 225 Ca -0.09 -1.75 0.00 0.00 -0.03 0.00 0.00 56.01 54.14 3kbo n LEU 225 Cb 0.48 -0.06 0.00 0.00 -2.33 0.00 0.00 43.42 41.51 3kbo n LEU 225 CO 0.43 0.51 0.00 0.00 -1.33 0.00 0.00 177.39 177.00 3kbo n ALA 226 N -0.06 0.00 -2.85 -1.18 0.00 -0.94 -4.85 120.51 110.63 3kbo n ALA 226 Ca 0.04 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.36 3kbo n ALA 226 Cb 0.26 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.59 3kbo n ALA 226 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 3kbo s ARG 227 N 0.38 0.46 0.41 0.00 1.81 -1.26 -4.91 118.95 115.84 3kbo s ARG 227 Ca 0.00 -0.74 0.09 0.00 -1.72 0.00 0.00 55.73 53.36 3kbo s ARG 227 Cb 0.00 -0.12 0.88 0.00 -0.45 0.00 0.00 34.95 35.26 3kbo s ARG 227 CO 0.00 0.00 2.02 0.78 -0.68 0.00 0.00 175.30 177.42 3kbo h GLY 228 N 4.45 0.41 2.00 -3.53 0.00 -1.80 -1.99 103.07 102.60 3kbo h GLY 228 Ca -0.34 -0.18 0.00 0.00 0.00 0.00 0.00 47.33 46.81 3kbo h GLY 228 CO 0.43 0.17 0.00 3.33 0.00 0.00 0.00 176.54 180.47 3kbo n VAL 229 N -4.42 1.50 0.18 4.60 0.24 -1.26 -2.30 118.33 116.88 3kbo n VAL 229 Ca 0.01 0.47 0.06 0.00 -2.04 0.00 0.00 64.34 62.85 3kbo n VAL 229 Cb 0.13 -1.42 0.20 0.00 -1.47 0.00 0.00 33.84 31.29 3kbo n VAL 229 CO 0.00 0.00 0.00 0.45 -2.14 0.00 0.00 176.83 175.14 3kbo h HIS 230 N 0.00 0.00 -3.34 6.34 3.86 -1.65 0.29 115.15 120.65 3kbo h HIS 230 Ca 0.00 0.00 -0.65 0.00 -1.16 0.00 0.00 60.37 58.56 3kbo h HIS 230 Cb 0.08 0.00 -0.26 0.00 1.06 0.00 0.00 27.41 28.30 3kbo h HIS 230 CO 0.00 0.34 -0.72 0.08 0.86 0.00 0.00 177.93 178.49 3kbo s VAL 231 N -3.25 3.38 -0.69 2.45 1.01 -0.97 -0.76 120.40 121.57 3kbo s VAL 231 Ca 0.03 -0.52 -0.27 0.00 0.00 0.00 0.00 61.98 61.22 3kbo s VAL 231 Cb 0.08 -2.48 0.02 0.00 0.00 0.00 0.00 36.38 34.00 3kbo s VAL 231 CO 0.70 0.48 1.39 -1.58 0.00 0.00 0.00 175.10 176.08 3kbo s GLN 232 N 0.75 3.12 0.39 2.72 2.00 -0.34 -4.89 119.66 123.40 3kbo s GLN 232 Ca -0.03 -0.00 0.07 0.00 -2.00 0.00 0.00 55.36 53.40 3kbo s GLN 232 Cb -0.15 -4.20 0.82 0.00 0.80 0.00 0.00 33.01 30.28 3kbo s GLN 232 CO 0.02 -2.20 1.99 0.93 -0.50 0.00 0.00 175.29 175.52 3kbo h GLU 233 N 10.93 0.63 -0.07 1.67 5.08 -1.92 -1.94 114.58 128.96 3kbo h GLU 233 Ca -0.27 -0.04 -0.17 0.00 -1.00 0.00 0.00 59.36 57.88 3kbo h GLU 233 Cb 1.07 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 30.17 3kbo h GLU 233 CO 1.25 0.42 -0.68 0.00 -1.00 0.00 0.00 179.01 179.00 3kbo h ALA 234 N 1.65 0.71 -0.47 3.43 0.00 -1.98 -2.46 119.26 120.14 3kbo h ALA 234 Ca 0.27 -0.59 -0.08 0.00 0.00 0.00 0.00 54.91 54.51 3kbo h ALA 234 Cb 0.23 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 3kbo h ALA 234 CO -0.08 0.76 -0.04 -0.44 0.00 0.00 0.00 179.25 179.45 3kbo h ASP 235 N 0.22 0.77 0.01 0.00 3.32 -1.78 -2.12 116.42 116.84 3kbo h ASP 235 Ca -0.02 -0.21 -0.00 0.00 0.02 0.00 0.00 57.03 56.83 3kbo h ASP 235 Cb 1.23 -0.21 0.00 0.00 0.22 0.00 0.00 39.33 40.57 3kbo h ASP 235 CO 0.11 0.87 -0.01 0.25 -1.72 0.00 0.00 179.24 178.74 3kbo h LEU 236 N 0.74 -0.01 -0.69 1.55 5.85 -1.20 -2.69 115.31 118.85 3kbo h LEU 236 Ca 0.14 -0.26 0.09 0.00 0.84 0.00 0.00 57.88 58.68 3kbo h LEU 236 Cb 0.51 0.00 -0.07 0.00 0.37 0.00 0.00 40.66 41.47 3kbo h LEU 236 CO 0.03 0.26 0.34 -0.07 -0.34 0.00 0.00 178.44 178.65 3kbo h LEU 237 N -0.28 0.44 -1.29 2.25 3.38 -1.37 -0.54 115.31 117.89 3kbo h LEU 237 Ca -0.00 0.06 -0.04 0.00 0.09 0.00 0.00 57.88 57.98 3kbo h LEU 237 Cb 0.27 -0.01 -0.02 0.00 0.09 0.00 0.00 40.66 40.99 3kbo h LEU 237 CO 0.00 0.25 0.00 0.00 0.09 0.00 0.00 178.44 178.79 3kbo h ALA 238 N 1.42 1.42 -0.06 1.53 0.00 -1.37 -1.51 119.26 120.69 3kbo h ALA 238 Ca 0.34 -0.19 -0.20 0.00 0.00 0.00 0.00 54.91 54.86 3kbo h ALA 238 Cb 0.35 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.00 3kbo h ALA 238 CO -0.26 0.41 -0.80 0.00 0.00 0.00 0.00 179.25 178.60 3kbo h ALA 239 N 1.55 0.51 -0.48 0.00 0.00 -0.90 -1.26 119.26 118.67 3kbo h ALA 239 Ca 0.10 -0.64 -0.07 0.00 0.00 0.00 0.00 54.91 54.31 3kbo h ALA 239 Cb 0.30 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 3kbo h ALA 239 CO 0.01 0.78 0.03 -0.07 0.00 0.00 0.00 179.25 179.99 3kbo h LEU 240 N 0.28 0.75 0.00 0.00 3.38 -0.83 -0.92 115.31 117.97 3kbo h LEU 240 Ca -0.05 -0.17 0.00 0.00 0.09 0.00 0.00 57.88 57.76 3kbo h LEU 240 Cb 1.40 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 41.95 3kbo h LEU 240 CO 0.14 0.80 -0.35 0.47 0.09 0.00 0.00 178.44 179.59 3kbo n ASP 241 N -4.23 0.70 0.01 -0.43 8.00 -0.60 -3.58 116.55 116.43 3kbo n ASP 241 Ca 0.03 0.29 0.11 0.00 0.71 0.00 0.00 54.79 55.94 3kbo n ASP 241 Cb 0.28 -0.24 0.13 0.00 -0.02 0.00 0.00 41.12 41.27 3kbo n ASP 241 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 3kbo n SER 242 N -2.10 0.63 0.00 -2.24 3.41 -0.50 -4.94 113.62 107.87 3kbo n SER 242 Ca 0.04 -0.33 0.00 0.00 -0.26 0.00 0.00 58.87 58.33 3kbo n SER 242 Cb 0.43 0.50 0.00 0.00 -0.26 0.00 0.00 64.21 64.88 3kbo n SER 242 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3kbo n GLY 243 N 1.45 2.17 0.24 5.00 0.00 -1.12 -4.94 105.19 107.99 3kbo n GLY 243 Ca 0.04 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.07 3kbo n GLY 243 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 3kbo h LYS 244 N 3.28 0.09 -5.90 1.61 1.63 -1.68 -3.06 116.57 112.54 3kbo h LYS 244 Ca 0.00 -0.01 -0.67 0.00 -0.85 0.00 0.00 60.65 59.12 3kbo h LYS 244 Cb 0.00 -0.02 -0.18 0.00 -0.60 0.00 0.00 32.23 31.43 3kbo h LYS 244 CO 0.00 0.06 -0.66 -0.51 -3.45 0.00 0.00 179.45 174.89 3kbo s LEU 245 N -10.72 3.34 -0.03 5.20 1.43 -0.41 -0.96 118.68 116.52 3kbo s LEU 245 Ca -0.14 0.01 -0.03 0.00 -1.03 0.00 0.00 54.13 52.95 3kbo s LEU 245 Cb 0.19 -1.76 -0.27 0.00 0.03 0.00 0.00 46.19 44.38 3kbo s LEU 245 CO 0.74 0.33 0.73 0.50 0.23 0.00 0.00 176.35 178.87 3kbo h LYS 246 N 5.54 0.25 -2.41 1.70 1.63 -0.17 -3.38 116.57 119.73 3kbo h LYS 246 Ca -0.46 -0.42 0.17 0.00 -0.85 0.00 0.00 60.65 59.09 3kbo h LYS 246 Cb 1.18 0.16 -0.07 0.00 -0.60 0.00 0.00 32.23 32.90 3kbo h LYS 246 CO 0.55 1.10 0.49 0.20 -3.45 0.00 0.00 179.45 178.34 3kbo s GLY 247 N -5.10 -0.15 0.00 5.01 0.00 -1.21 -4.92 107.32 100.95 3kbo s GLY 247 Ca -0.12 0.01 0.00 0.00 0.00 0.00 0.00 44.72 44.61 3kbo s GLY 247 CO 0.84 0.34 0.00 0.00 0.00 0.00 0.00 173.10 174.28 3kbo n ALA 248 N -0.51 0.00 0.00 3.20 0.00 -0.47 -1.91 120.51 120.83 3kbo n ALA 248 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.38 3kbo n ALA 248 Cb 0.60 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.05 3kbo n ALA 248 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3kbo n LEU 250 N 0.00 0.00 -0.14 0.00 4.77 -0.26 -1.54 117.00 119.83 3kbo n LEU 250 Ca 0.00 0.00 0.02 0.00 -0.03 0.00 0.00 56.01 56.00 3kbo n LEU 250 Cb 0.00 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.11 3kbo n LEU 250 CO 0.00 0.00 0.31 -0.67 -1.33 0.00 0.00 177.39 175.70 3kbo n ASP 251 N 0.00 1.32 -3.96 -1.43 2.03 -0.76 -1.37 116.55 112.38 3kbo n ASP 251 Ca 0.00 -1.17 -0.09 0.00 0.52 0.00 0.00 54.79 54.05 3kbo n ASP 251 Cb 0.00 -0.00 -0.10 0.00 -0.72 0.00 0.00 41.12 40.30 3kbo n ASP 251 CO 0.00 0.00 0.00 0.68 -1.92 0.00 0.00 177.20 175.96 3kbo s VAL 252 N -0.31 0.13 0.23 5.18 -7.23 -1.26 -1.68 120.40 115.47 3kbo s VAL 252 Ca 0.04 -1.09 -0.06 0.00 -1.81 0.00 0.00 61.98 59.06 3kbo s VAL 252 Cb 0.03 -0.73 -0.02 0.00 0.56 0.00 0.00 36.38 36.22 3kbo s VAL 252 CO 0.04 -0.60 0.29 -0.36 -0.31 0.00 0.00 175.10 174.16 3kbo s PHE 253 N -2.29 0.84 0.30 2.82 0.08 -1.26 -4.54 117.98 113.92 3kbo s PHE 253 Ca -0.08 -1.11 0.04 0.00 0.12 0.00 0.00 56.93 55.90 3kbo s PHE 253 Cb -0.03 -0.23 0.65 0.00 -0.57 0.00 0.00 43.02 42.83 3kbo s PHE 253 CO -0.03 -0.81 1.82 0.66 -0.10 0.00 0.00 175.22 176.75 3kbo h SER 254 N 2.44 0.85 -3.58 1.36 4.64 -1.91 -3.34 113.55 114.02 3kbo h SER 254 Ca -0.31 0.06 -0.27 0.00 -0.47 0.00 0.00 61.79 60.80 3kbo h SER 254 Cb 1.25 -0.10 -0.32 0.00 -0.31 0.00 0.00 62.40 62.92 3kbo h SER 254 CO 0.45 0.40 -0.71 -1.10 -0.87 0.00 0.00 176.83 175.00 3kbo s GLN 255 N -5.89 -0.01 -0.14 4.77 -0.21 -1.26 -4.89 119.66 112.03 3kbo s GLN 255 Ca -0.11 0.15 0.01 0.00 0.02 0.00 0.00 55.36 55.43 3kbo s GLN 255 Cb 0.23 -0.16 0.02 0.00 1.00 0.00 0.00 33.01 34.10 3kbo s GLN 255 CO 0.80 -0.12 -0.15 -1.21 -2.12 0.00 0.00 175.29 172.50 3kbo s GLU 256 N 0.75 2.31 0.36 2.91 2.02 -1.26 -1.82 118.70 123.96 3kbo s GLU 256 Ca -0.06 -0.57 -0.28 0.00 0.02 0.00 0.00 54.97 54.07 3kbo s GLU 256 Cb -0.09 -2.06 -0.11 0.00 0.10 0.00 0.00 34.13 31.98 3kbo s GLU 256 CO -0.02 -0.18 1.41 -2.14 0.02 0.00 0.00 175.26 174.36 3kbo s PRO 257 N 1.31 4.20 0.19 0.39 0.02 -1.26 -5.09 135.00 134.75 3kbo s PRO 257 Ca 0.01 2.43 -0.32 0.00 0.02 0.00 0.00 61.00 63.14 3kbo s PRO 257 Cb -0.14 -3.00 -0.11 0.00 0.02 0.00 0.00 34.50 31.27 3kbo s PRO 257 CO -0.08 -0.40 1.65 -1.17 -0.33 0.00 0.00 177.00 176.68 3kbo s LEU 258 N -1.99 4.37 0.64 -5.54 2.96 -0.76 -4.94 118.68 113.42 3kbo s LEU 258 Ca 0.51 2.75 -0.17 0.00 -0.22 0.00 0.00 54.13 57.00 3kbo s LEU 258 Cb -0.44 -3.60 -0.01 0.00 0.50 0.00 0.00 46.19 42.65 3kbo s LEU 258 CO 0.59 -0.90 1.22 -2.84 -1.32 0.00 0.00 176.35 173.10 3kbo s PRO 259 N 1.20 2.66 0.36 0.98 0.02 -1.26 -4.94 135.00 134.02 3kbo s PRO 259 Ca 0.73 1.84 0.09 0.00 0.02 0.00 0.00 61.00 63.68 3kbo s PRO 259 Cb -0.47 -1.89 0.82 0.00 0.02 0.00 0.00 34.50 32.99 3kbo s PRO 259 CO 0.32 -1.45 1.89 1.96 -0.33 0.00 0.00 177.00 179.39 3kbo h GLN 260 N 0.47 0.66 0.00 5.54 1.08 -2.02 -2.53 115.11 118.32 3kbo h GLN 260 Ca -0.50 -0.04 0.00 0.00 -1.45 0.00 0.00 58.65 56.66 3kbo h GLN 260 Cb 1.30 -0.15 0.00 0.00 -0.05 0.00 0.00 27.48 28.58 3kbo h GLN 260 CO 0.53 0.44 0.00 0.93 -0.95 0.00 0.00 178.83 179.78 3kbo h GLU 261 N 0.68 0.00 -6.52 1.46 3.07 -2.03 -3.45 114.58 107.79 3kbo h GLU 261 Ca 0.41 0.00 -0.57 0.00 -0.50 0.00 0.00 59.36 58.70 3kbo h GLU 261 Cb 0.63 0.00 0.05 0.00 -0.84 0.00 0.00 28.75 28.60 3kbo h GLU 261 CO -0.17 0.00 0.87 0.45 -1.40 0.00 0.00 179.01 178.76 3kbo n SER 262 N -3.07 3.33 0.00 1.42 2.88 -0.95 -4.87 113.62 112.36 3kbo n SER 262 Ca -0.00 1.07 0.11 0.00 -1.33 0.00 0.00 58.87 58.71 3kbo n SER 262 Cb 0.25 -1.46 0.63 0.00 -0.75 0.00 0.00 64.21 62.89 3kbo n SER 262 CO 0.00 0.00 0.00 -2.65 -1.23 0.00 0.00 175.04 171.16 3kbo n PRO 263 N 3.86 0.64 -0.12 -1.46 -0.02 -1.26 -3.08 135.00 133.56 3kbo n PRO 263 Ca 0.17 0.01 -0.11 0.00 -2.02 0.00 0.00 63.50 61.55 3kbo n PRO 263 Cb 0.30 -1.50 0.02 0.00 -0.02 0.00 0.00 33.50 32.31 3kbo n PRO 263 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 3kbo h LEU 264 N 0.00 0.93 -0.72 2.45 3.38 -1.94 -2.46 115.31 116.96 3kbo h LEU 264 Ca 0.00 -0.38 0.15 0.00 0.09 0.00 0.00 57.88 57.74 3kbo h LEU 264 Cb 0.02 -0.26 -0.11 0.00 0.09 0.00 0.00 40.66 40.40 3kbo h LEU 264 CO 0.00 1.15 0.17 -0.50 0.09 0.00 0.00 178.44 179.35 3kbo h TRP 265 N 0.76 0.26 0.00 1.13 4.06 -1.89 -2.83 115.95 117.45 3kbo h TRP 265 Ca 0.09 0.04 0.00 0.00 2.06 0.00 0.00 58.89 61.08 3kbo h TRP 265 Cb 0.85 -0.01 0.00 0.00 -1.00 0.00 0.00 29.16 29.00 3kbo h TRP 265 CO 0.05 -0.07 -0.72 0.54 -3.56 0.00 0.00 178.44 174.68 3kbo n ARG 266 N -5.15 0.29 -2.17 0.49 1.74 -1.15 -4.85 116.66 105.86 3kbo n ARG 266 Ca 0.13 0.06 -0.42 0.00 -0.77 0.00 0.00 57.85 56.85 3kbo n ARG 266 Cb 0.43 -1.66 -0.03 0.00 -1.02 0.00 0.00 32.46 30.19 3kbo n ARG 266 CO 0.00 0.00 0.00 -1.58 -1.52 0.00 0.00 177.63 174.53 3kbo s HIS 267 N -3.17 2.49 -1.30 -1.55 2.46 -0.94 -4.88 115.29 108.40 3kbo s HIS 267 Ca 0.06 0.59 0.27 0.00 0.47 0.00 0.00 55.06 56.44 3kbo s HIS 267 Cb 0.14 -3.74 1.28 0.00 -0.13 0.00 0.00 32.58 30.12 3kbo s HIS 267 CO 0.74 -2.91 1.89 -0.35 -2.47 0.00 0.00 174.74 171.64 3kbo n PRO 268 N 6.31 0.27 -0.36 2.88 -0.04 -1.26 -2.73 135.00 140.08 3kbo n PRO 268 Ca 0.15 0.04 0.07 0.00 -0.04 0.00 0.00 63.50 63.72 3kbo n PRO 268 Cb 0.43 -1.50 0.23 0.00 -0.04 0.00 0.00 33.50 32.63 3kbo n PRO 268 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 3kbo n ARG 269 N -1.35 3.07 -3.96 0.54 1.74 -1.26 -4.79 116.66 110.65 3kbo n ARG 269 Ca 0.11 -2.49 -0.31 0.00 -0.77 0.00 0.00 57.85 54.38 3kbo n ARG 269 Cb 0.24 -1.59 -0.14 0.00 -1.02 0.00 0.00 32.46 29.95 3kbo n ARG 269 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 3kbo s VAL 270 N -1.75 2.52 0.93 1.55 1.01 -1.10 -1.36 120.40 122.20 3kbo s VAL 270 Ca 0.36 -2.65 -0.13 0.00 0.00 0.00 0.00 61.98 59.55 3kbo s VAL 270 Cb 0.24 -2.80 0.20 0.00 0.00 0.00 0.00 36.38 34.01 3kbo s VAL 270 CO 0.16 -0.68 1.28 0.00 0.00 0.00 0.00 175.10 175.85 3kbo s ALA 271 N 0.51 2.48 -0.28 5.51 0.00 -0.59 -4.84 121.76 124.55 3kbo s ALA 271 Ca 0.13 -1.34 -0.26 0.00 0.00 0.00 0.00 51.96 50.49 3kbo s ALA 271 Cb -0.22 -2.62 0.16 0.00 0.00 0.00 0.00 23.12 20.44 3kbo s ALA 271 CO -0.05 -2.32 1.23 0.95 0.00 0.00 0.00 175.76 175.58 3kbo s THR 273 N -3.78 0.00 -1.33 0.00 -4.23 -0.47 -1.10 115.64 104.73 3kbo s THR 273 Ca 0.73 0.00 -0.16 0.00 -1.18 0.00 0.00 61.69 61.09 3kbo s THR 273 Cb -0.04 -1.00 0.01 0.00 1.34 0.00 0.00 72.50 72.81 3kbo s THR 273 CO 0.52 0.00 2.15 -0.81 -0.54 0.00 0.00 174.62 175.94 3kbo n PRO 274 N 1.64 2.62 -3.86 3.99 -0.04 -1.26 -4.18 135.00 133.91 3kbo n PRO 274 Ca -0.10 -2.49 -0.33 0.00 -0.04 0.00 0.00 63.50 60.54 3kbo n PRO 274 Cb 0.57 -3.24 0.01 0.00 -0.04 0.00 0.00 33.50 30.80 3kbo n PRO 274 CO 0.00 0.00 0.00 1.58 -0.04 0.00 0.00 175.50 177.04 3kbo n HIS 275 N 6.51 -1.82 -1.62 0.54 -0.00 -0.67 -4.93 115.22 113.22 3kbo n HIS 275 Ca 0.51 0.51 0.02 0.00 -0.00 0.00 0.00 57.72 58.77 3kbo n HIS 275 Cb 0.40 -2.91 0.03 0.00 -0.00 0.00 0.00 29.99 27.50 3kbo n HIS 275 CO 0.00 0.00 0.00 0.44 -0.00 0.00 0.00 176.34 176.78 3kbo n ILE 276 N -3.69 0.44 -0.27 3.57 -6.64 -1.26 -4.93 119.36 106.58 3kbo n ILE 276 Ca -0.20 -0.52 -0.04 0.00 -1.77 0.00 0.00 62.75 60.22 3kbo n ILE 276 Cb 0.62 0.40 0.07 0.00 -1.44 0.00 0.00 39.64 39.29 3kbo n ILE 276 CO 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 176.55 174.78 3kbo h ALA 277 N 0.00 0.94 -1.91 -1.28 0.00 -1.91 -3.42 119.26 111.67 3kbo h ALA 277 Ca 0.00 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 3kbo h ALA 277 Cb 1.24 -0.29 -0.25 0.00 0.00 0.00 0.00 17.79 18.50 3kbo h ALA 277 CO 0.00 0.33 -0.31 0.00 0.00 0.00 0.00 179.25 179.28 3kbo s ALA 278 N -6.13 -1.63 0.03 0.00 0.00 -1.26 -4.80 121.76 107.98 3kbo s ALA 278 Ca -0.13 1.68 0.05 0.00 0.00 0.00 0.00 51.96 53.56 3kbo s ALA 278 Cb 0.15 -1.71 -0.03 0.00 0.00 0.00 0.00 23.12 21.53 3kbo s ALA 278 CO 0.78 -1.04 -0.09 0.14 0.00 0.00 0.00 175.76 175.55 3kbo s VAL 279 N 2.73 3.43 0.53 0.00 -7.23 -1.26 -5.05 120.40 113.54 3kbo s VAL 279 Ca 0.05 -0.96 -0.22 0.00 -1.81 0.00 0.00 61.98 59.04 3kbo s VAL 279 Cb -0.13 -2.51 -0.05 0.00 0.56 0.00 0.00 36.38 34.24 3kbo s VAL 279 CO -0.17 0.32 1.29 0.28 -0.31 0.00 0.00 175.10 176.51 3kbo s THR 280 N -1.03 2.40 -0.37 5.32 -1.32 -1.26 -4.94 115.64 114.44 3kbo s THR 280 Ca 0.18 0.30 -0.17 0.00 -1.21 0.00 0.00 61.69 60.78 3kbo s THR 280 Cb -0.11 -3.15 0.00 0.00 -1.51 0.00 0.00 72.50 67.74 3kbo s THR 280 CO 0.09 -0.01 0.47 -0.13 -2.21 0.00 0.00 174.62 172.83 3kbo s ARG 281 N -2.89 3.46 0.25 7.08 1.81 -1.00 -4.97 118.95 122.68 3kbo s ARG 281 Ca 0.70 -0.38 -0.06 0.00 -1.72 0.00 0.00 55.73 54.26 3kbo s ARG 281 Cb -0.36 -3.86 0.45 0.00 -0.45 0.00 0.00 34.95 30.73 3kbo s ARG 281 CO 0.43 -0.69 1.64 -1.35 -0.68 0.00 0.00 175.30 174.65 3kbo h PRO 282 N 8.56 0.13 -0.84 3.54 0.11 -1.93 0.21 132.00 141.78 3kbo h PRO 282 Ca -0.28 -0.01 0.02 0.00 0.11 0.00 0.00 66.00 65.85 3kbo h PRO 282 Cb 1.12 -0.03 -0.05 0.00 0.11 0.00 0.00 31.00 32.16 3kbo h PRO 282 CO 0.77 0.09 0.56 0.00 -0.21 0.00 0.00 178.00 179.20 3kbo h ALA 283 N 1.69 1.44 -0.07 -0.75 0.00 -1.96 0.45 119.26 120.06 3kbo h ALA 283 Ca 0.42 -0.05 -0.20 0.00 0.00 0.00 0.00 54.91 55.08 3kbo h ALA 283 Cb 0.74 -0.32 -0.00 0.00 0.00 0.00 0.00 17.79 18.21 3kbo h ALA 283 CO -0.63 0.50 -0.78 0.93 0.00 0.00 0.00 179.25 179.26 3kbo h GLU 284 N 1.09 0.45 -0.73 0.00 5.08 -0.98 -2.49 114.58 117.01 3kbo h GLU 284 Ca 0.32 -0.39 -0.07 0.00 -1.00 0.00 0.00 59.36 58.23 3kbo h GLU 284 Cb -0.05 0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.26 3kbo h GLU 284 CO -0.08 1.03 0.20 0.00 -1.00 0.00 0.00 179.01 179.15 3kbo h ALA 285 N 0.85 0.95 -0.61 3.43 0.00 -0.14 -2.32 119.26 121.43 3kbo h ALA 285 Ca -0.04 -0.24 -0.08 0.00 0.00 0.00 0.00 54.91 54.55 3kbo h ALA 285 Cb 1.38 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.86 3kbo h ALA 285 CO 0.14 0.66 0.07 0.82 0.00 0.00 0.00 179.25 180.94 3kbo h ILE 286 N 1.09 1.26 -0.19 0.00 1.08 -0.88 -1.16 117.51 118.71 3kbo h ILE 286 Ca 0.23 -1.04 -0.01 0.00 -0.39 0.00 0.00 64.86 63.65 3kbo h ILE 286 Cb 0.35 0.72 -0.01 0.00 -3.07 0.00 0.00 36.82 34.81 3kbo h ILE 286 CO -0.00 0.38 0.07 -0.78 -0.69 0.00 0.00 178.15 177.13 3kbo h ASP 287 N 0.94 0.27 0.14 1.72 3.58 -1.17 0.20 116.42 122.10 3kbo h ASP 287 Ca 0.18 -0.19 -0.01 0.00 0.42 0.00 0.00 57.03 57.44 3kbo h ASP 287 Cb 0.45 -0.07 0.00 0.00 1.72 0.00 0.00 39.33 41.43 3kbo h ASP 287 CO 0.02 0.39 -0.07 0.22 -2.88 0.00 0.00 179.24 176.92 3kbo h TYR 288 N 0.15 -0.17 0.10 0.28 3.20 -1.26 -0.45 116.97 118.82 3kbo h TYR 288 Ca 0.06 -0.00 0.01 0.00 3.14 0.00 0.00 58.73 61.94 3kbo h TYR 288 Cb 0.20 0.06 -0.02 0.00 1.54 0.00 0.00 36.73 38.51 3kbo h TYR 288 CO -0.00 0.00 -0.15 0.82 -1.64 0.00 0.00 178.16 177.19 3kbo h ILE 289 N -0.31 0.66 -0.16 1.81 2.04 -1.19 0.18 117.51 120.53 3kbo h ILE 289 Ca -0.02 0.00 0.02 0.00 1.00 0.00 0.00 64.86 65.86 3kbo h ILE 289 Cb 0.25 0.66 -0.04 0.00 -0.74 0.00 0.00 36.82 36.95 3kbo h ILE 289 CO 0.03 0.00 -0.28 -1.28 0.00 0.00 0.00 178.15 176.62 3kbo h SER 290 N -0.30 -0.92 -0.92 1.72 0.87 -0.59 0.80 113.55 114.21 3kbo h SER 290 Ca 0.02 0.12 0.08 0.00 -1.23 0.00 0.00 61.79 60.77 3kbo h SER 290 Cb 0.30 0.37 -0.07 0.00 -0.44 0.00 0.00 62.40 62.57 3kbo h SER 290 CO -0.07 -0.22 0.57 0.03 -0.53 0.00 0.00 176.83 176.62 3kbo h ARG 291 N -0.23 0.98 -0.40 2.24 3.08 -0.95 -0.69 114.38 118.41 3kbo h ARG 291 Ca 0.03 -0.06 -0.01 0.00 0.07 0.00 0.00 59.98 60.01 3kbo h ARG 291 Cb 0.31 -0.22 -0.02 0.00 0.08 0.00 0.00 29.97 30.12 3kbo h ARG 291 CO -0.27 0.65 0.19 1.15 -1.07 0.00 0.00 179.97 180.62 3kbo h THR 292 N 1.01 1.17 -0.49 2.04 2.02 -0.36 -1.22 112.91 117.08 3kbo h THR 292 Ca 0.41 -0.48 -0.01 0.00 0.77 0.00 0.00 66.41 67.11 3kbo h THR 292 Cb 0.25 0.76 -0.02 0.00 -1.74 0.00 0.00 68.15 67.39 3kbo h THR 292 CO -0.20 0.18 0.28 0.40 0.37 0.00 0.00 175.52 176.56 3kbo h ILE 293 N 0.50 1.16 -0.53 3.11 2.04 -0.15 -1.29 117.51 122.34 3kbo h ILE 293 Ca 0.14 -0.38 -0.03 0.00 1.00 0.00 0.00 64.86 65.59 3kbo h ILE 293 Cb 0.11 0.53 -0.03 0.00 -0.74 0.00 0.00 36.82 36.69 3kbo h ILE 293 CO -0.02 0.16 0.22 0.71 0.00 0.00 0.00 178.15 179.23 3kbo h THR 294 N 0.65 1.19 -0.39 -0.27 1.35 -0.78 -0.48 112.91 114.17 3kbo h THR 294 Ca 0.17 -0.58 -0.14 0.00 -0.55 0.00 0.00 66.41 65.31 3kbo h THR 294 Cb 0.02 0.54 -0.01 0.00 -1.73 0.00 0.00 68.15 66.97 3kbo h THR 294 CO -0.03 0.23 -0.29 1.56 -0.25 0.00 0.00 175.52 176.74 3kbo h GLN 295 N 0.76 0.90 -0.46 4.72 4.20 -0.74 -2.57 115.11 121.92 3kbo h GLN 295 Ca 0.18 -0.44 -0.06 0.00 0.06 0.00 0.00 58.65 58.40 3kbo h GLN 295 Cb 0.13 -0.00 -0.02 0.00 0.30 0.00 0.00 27.48 27.89 3kbo h GLN 295 CO -0.02 1.09 0.04 -0.07 -0.67 0.00 0.00 178.83 179.20 3kbo h LEU 296 N 0.71 0.68 -1.31 1.46 3.38 -0.75 -0.18 115.31 119.29 3kbo h LEU 296 Ca 0.07 -0.14 -0.07 0.00 0.09 0.00 0.00 57.88 57.84 3kbo h LEU 296 Cb 0.88 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.44 3kbo h LEU 296 CO 0.08 0.72 -0.32 -0.33 0.09 0.00 0.00 178.44 178.68 3kbo h GLU 297 N 0.69 0.04 0.00 1.13 4.39 -0.94 -2.00 114.58 117.89 3kbo h GLU 297 Ca 0.14 -0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.83 3kbo h GLU 297 Cb 0.36 -0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.01 3kbo h GLU 297 CO 0.01 0.36 -0.28 1.63 -1.16 0.00 0.00 179.01 179.57 3kbo n LYS 298 N -4.15 0.08 -0.56 2.33 5.02 -0.96 -4.94 118.16 114.98 3kbo n LYS 298 Ca -0.02 0.04 0.00 0.00 -2.02 0.00 0.00 58.31 56.31 3kbo n LYS 298 Cb 0.37 -1.57 0.00 0.00 -0.02 0.00 0.00 35.03 33.81 3kbo n LYS 298 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3kbo n GLY 299 N 1.45 0.70 3.82 0.72 0.00 -0.72 -5.06 105.19 106.10 3kbo n GLY 299 Ca 0.06 -0.16 -0.34 0.00 0.00 0.00 0.00 46.02 45.58 3kbo n GLY 299 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3kbo s GLU 300 N -0.61 4.23 0.63 1.61 0.41 -0.16 -4.99 118.70 119.82 3kbo s GLU 300 Ca 0.00 0.96 -0.16 0.00 -0.41 0.00 0.00 54.97 55.35 3kbo s GLU 300 Cb 0.00 -2.54 -0.02 0.00 -1.78 0.00 0.00 34.13 29.80 3kbo s GLU 300 CO 0.00 0.19 1.12 -2.14 -0.49 0.00 0.00 175.26 173.94 3kbo s PRO 301 N -2.63 2.92 0.23 0.39 0.02 -1.26 -4.26 135.00 130.42 3kbo s PRO 301 Ca 0.53 1.48 -0.11 0.00 0.02 0.00 0.00 61.00 62.93 3kbo s PRO 301 Cb -0.13 -1.96 -0.01 0.00 0.02 0.00 0.00 34.50 32.42 3kbo s PRO 301 CO 0.18 -1.17 0.41 0.14 -0.33 0.00 0.00 177.00 176.23 3kbo s VAL 302 N -2.14 0.00 0.31 3.83 -7.23 -1.26 -4.98 120.40 108.93 3kbo s VAL 302 Ca 0.69 -1.51 0.06 0.00 -1.81 0.00 0.00 61.98 59.41 3kbo s VAL 302 Cb -0.22 -2.24 -0.02 0.00 0.56 0.00 0.00 36.38 34.46 3kbo s VAL 302 CO 0.37 -0.01 0.21 0.35 -0.31 0.00 0.00 175.10 175.71 3kbo n THR 303 N -0.35 0.00 -3.82 5.32 -2.24 -1.26 -4.83 114.28 107.10 3kbo n THR 303 Ca -0.01 -2.12 -0.36 0.00 -2.27 0.00 0.00 64.05 59.28 3kbo n THR 303 Cb 0.63 0.96 -0.13 0.00 -2.10 0.00 0.00 70.33 69.69 3kbo n THR 303 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 3kbo s GLY 304 N -3.09 1.75 0.37 3.38 0.00 -1.26 -5.09 107.32 103.37 3kbo s GLY 304 Ca 0.29 -1.50 -0.19 0.00 0.00 0.00 0.00 44.72 43.32 3kbo s GLY 304 CO 0.21 0.63 0.86 1.20 0.00 0.00 0.00 173.10 176.00 3kbo s GLN 305 N 1.43 4.20 0.57 2.90 -0.21 -1.26 -4.24 119.66 123.05 3kbo s GLN 305 Ca 0.01 0.97 -0.19 0.00 0.02 0.00 0.00 55.36 56.17 3kbo s GLN 305 Cb -0.17 -2.39 -0.04 0.00 1.00 0.00 0.00 33.01 31.40 3kbo s GLN 305 CO 0.01 0.10 1.19 0.08 -2.12 0.00 0.00 175.29 174.55 3kbo s VAL 306 N -2.00 2.74 -0.56 1.09 1.01 0.97 -4.97 120.40 118.68 3kbo s VAL 306 Ca 0.57 0.47 -0.15 0.00 0.00 0.00 0.00 61.98 62.87 3kbo s VAL 306 Cb -0.11 -3.19 0.14 0.00 0.00 0.00 0.00 36.38 33.21 3kbo s VAL 306 CO 0.16 -0.09 0.50 -0.62 0.00 0.00 0.00 175.10 175.05 3kbo s ASP 307 N -1.59 6.16 0.44 3.32 -1.08 -1.16 -4.76 116.67 118.00 3kbo s ASP 307 Ca 0.76 -1.91 0.11 0.00 -0.52 0.00 0.00 52.55 50.98 3kbo s ASP 307 Cb -0.29 -2.17 1.00 0.00 -1.46 0.00 0.00 42.92 39.99 3kbo s ASP 307 CO 0.32 -0.80 2.07 0.03 0.52 0.00 0.00 175.17 177.31 3kbo h ARG 308 N 8.69 0.37 0.22 4.34 3.08 -1.93 -0.06 114.38 129.09 3kbo h ARG 308 Ca -0.24 -0.02 -0.01 0.00 0.07 0.00 0.00 59.98 59.77 3kbo h ARG 308 Cb 1.09 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 31.06 3kbo h ARG 308 CO 0.98 0.25 -0.11 0.00 -1.07 0.00 0.00 179.97 180.02 3kbo h ALA 309 N 1.80 -0.30 0.00 0.04 0.00 -1.95 -3.11 119.26 115.75 3kbo h ALA 309 Ca 0.13 -0.10 -0.10 0.00 0.00 0.00 0.00 54.91 54.85 3kbo h ALA 309 Cb 0.05 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 3kbo h ALA 309 CO -0.03 -0.62 -0.46 0.07 0.00 0.00 0.00 179.25 178.21 3kbo h ARG 310 N -0.38 0.00 0.00 0.00 0.11 -1.92 -3.48 114.38 108.72 3kbo h ARG 310 Ca -0.03 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.05 3kbo h ARG 310 Cb 0.29 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.37 3kbo h ARG 310 CO 0.05 0.46 0.00 0.41 0.10 0.00 0.00 179.97 180.99 3kbo n GLY 311 N 0.63 0.81 0.00 0.08 0.00 -0.06 -4.96 105.19 101.68 3kbo n GLY 311 Ca 0.00 -0.44 0.00 0.00 0.00 0.00 0.00 46.02 45.58 3kbo n GLY 311 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90