#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 0.07 0.05 6.31 1.01 -0.54 -1.41 121.20 126.70 3kbo s ILE 3 Ca 0.00 0.08 0.05 0.00 0.00 0.00 0.00 60.65 60.79 3kbo s ILE 3 Cb 0.00 -0.15 -0.04 0.00 0.01 0.00 0.00 42.46 42.29 3kbo s ILE 3 CO 0.00 0.09 -0.09 0.27 0.00 0.00 0.00 174.94 175.20 3kbo s ILE 4 N 0.68 3.43 -0.02 2.92 -4.36 -0.71 -0.19 121.20 122.96 3kbo s ILE 4 Ca -0.06 -1.03 0.01 0.00 -0.26 0.00 0.00 60.65 59.31 3kbo s ILE 4 Cb -0.09 -2.54 0.01 0.00 1.25 0.00 0.00 42.46 41.10 3kbo s ILE 4 CO -0.02 0.27 -0.02 0.12 0.24 0.00 0.00 174.94 175.53 3kbo s PHE 5 N -1.08 0.37 -0.07 1.37 5.36 -0.51 -1.49 117.98 121.93 3kbo s PHE 5 Ca 0.19 -0.05 -0.03 0.00 -0.96 0.00 0.00 56.93 56.08 3kbo s PHE 5 Cb -0.11 -0.36 0.03 0.00 -0.34 0.00 0.00 43.02 42.25 3kbo s PHE 5 CO 0.10 -0.09 0.15 -0.47 -1.46 0.00 0.00 175.22 173.46 3kbo s TYR 6 N 0.56 -0.18 -0.29 10.12 5.04 -0.89 -1.18 117.35 130.54 3kbo s TYR 6 Ca -0.06 0.49 -0.14 0.00 -2.44 0.00 0.00 57.07 54.93 3kbo s TYR 6 Cb -0.09 -0.05 0.10 0.00 0.35 0.00 0.00 41.96 42.28 3kbo s TYR 6 CO -0.01 -0.15 0.68 -1.58 -1.34 0.00 0.00 175.55 173.15 3kbo s HIS 7 N 0.97 -1.17 -0.43 4.97 2.46 -1.26 -2.67 115.29 118.15 3kbo s HIS 7 Ca -0.07 2.20 0.22 0.00 0.47 0.00 0.00 55.06 57.88 3kbo s HIS 7 Cb -0.09 0.70 1.00 0.00 -0.13 0.00 0.00 32.58 34.06 3kbo s HIS 7 CO -0.05 -0.58 1.67 -0.35 -2.47 0.00 0.00 174.74 172.96 3kbo n PRO 8 N 4.78 0.17 0.00 2.88 -0.04 -1.26 -4.04 135.00 137.48 3kbo n PRO 8 Ca -0.17 0.48 0.00 0.00 -0.04 0.00 0.00 63.50 63.78 3kbo n PRO 8 Cb 0.55 -1.87 0.00 0.00 -0.04 0.00 0.00 33.50 32.13 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 -2.20 0.00 -1.14 0.52 -2.24 -1.26 -5.11 114.28 102.85 3kbo n THR 9 Ca 0.01 0.00 -0.30 0.00 -2.27 0.00 0.00 64.05 61.49 3kbo n THR 9 Cb 0.16 0.01 0.12 0.00 -2.10 0.00 0.00 70.33 68.53 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 -0.72 2.31 -0.69 4.78 0.08 -1.26 -4.93 117.98 117.56 3kbo s PHE 10 Ca 0.00 1.46 -0.26 0.00 0.12 0.00 0.00 56.93 58.24 3kbo s PHE 10 Cb 0.00 -3.13 0.04 0.00 -0.57 0.00 0.00 43.02 39.36 3kbo s PHE 10 CO 0.00 -2.23 1.20 1.21 -0.10 0.00 0.00 175.22 175.30 3kbo s ASN 11 N -3.28 6.22 0.18 1.36 3.04 -1.26 -4.89 114.94 116.30 3kbo s ASN 11 Ca 0.63 -0.42 -0.14 0.00 0.04 0.00 0.00 52.86 52.97 3kbo s ASN 11 Cb -0.18 -2.53 0.15 0.00 -1.54 0.00 0.00 41.25 37.14 3kbo s ASN 11 CO 0.57 -1.68 1.71 0.00 -3.04 0.00 0.00 177.10 174.66 3kbo h ALA 12 N 9.83 0.46 -0.91 1.71 0.00 -1.91 -1.74 119.26 126.70 3kbo h ALA 12 Ca -0.27 0.11 0.11 0.00 0.00 0.00 0.00 54.91 54.85 3kbo h ALA 12 Cb 1.06 0.16 -0.08 0.00 0.00 0.00 0.00 17.79 18.92 3kbo h ALA 12 CO 1.24 -0.34 0.55 0.00 0.00 0.00 0.00 179.25 180.69 3kbo h ALA 13 N 1.36 1.34 -0.47 0.00 0.00 -1.99 0.28 119.26 119.77 3kbo h ALA 13 Ca 0.22 0.03 -0.03 0.00 0.00 0.00 0.00 54.91 55.13 3kbo h ALA 13 Cb 0.30 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 3kbo h ALA 13 CO -0.32 0.16 0.18 2.35 0.00 0.00 0.00 179.25 181.62 3kbo h TRP 14 N 0.88 0.72 -0.36 0.00 7.01 -1.75 -1.78 115.95 120.67 3kbo h TRP 14 Ca 0.45 -0.06 -0.16 0.00 2.11 0.00 0.00 58.89 61.23 3kbo h TRP 14 Cb 0.43 -0.21 -0.01 0.00 -2.10 0.00 0.00 29.16 27.27 3kbo h TRP 14 CO -0.04 0.61 -0.39 -1.49 -2.79 0.00 0.00 178.44 174.35 3kbo h TRP 15 N 0.62 1.05 -0.27 2.65 4.06 -0.59 -0.52 115.95 122.95 3kbo h TRP 15 Ca 0.16 -0.31 -0.00 0.00 2.06 0.00 0.00 58.89 60.79 3kbo h TRP 15 Cb 0.20 -0.22 -0.01 0.00 -1.00 0.00 0.00 29.16 28.13 3kbo h TRP 15 CO 0.00 1.12 0.16 0.28 -3.56 0.00 0.00 178.44 176.44 3kbo h VAL 16 N 0.72 1.11 -0.54 1.49 2.07 -0.38 -1.72 116.25 119.00 3kbo h VAL 16 Ca 0.06 -0.28 -0.11 0.00 0.82 0.00 0.00 66.70 67.19 3kbo h VAL 16 Cb 0.97 0.80 -0.02 0.00 -1.52 0.00 0.00 31.29 31.52 3kbo h VAL 16 CO 0.09 0.11 -0.08 -1.13 0.02 0.00 0.00 177.57 176.58 3kbo h ASN 17 N 0.34 1.02 -0.82 0.57 -1.24 -1.28 -1.79 115.58 112.37 3kbo h ASN 17 Ca 0.10 -0.34 0.00 0.00 0.71 0.00 0.00 56.30 56.77 3kbo h ASN 17 Cb 0.04 -0.28 -0.04 0.00 0.73 0.00 0.00 38.32 38.77 3kbo h ASN 17 CO -0.02 1.12 0.52 0.00 -1.29 0.00 0.00 177.43 177.77 3kbo h ALA 18 N 0.93 1.05 -0.02 1.57 0.00 -0.93 -1.24 119.26 120.62 3kbo h ALA 18 Ca 0.14 -0.07 -0.26 0.00 0.00 0.00 0.00 54.91 54.72 3kbo h ALA 18 Cb 0.65 -0.33 0.02 0.00 0.00 0.00 0.00 17.79 18.12 3kbo h ALA 18 CO 0.04 0.48 -1.00 1.25 0.00 0.00 0.00 179.25 180.03 3kbo h LEU 19 N 1.12 0.88 -1.21 0.00 5.85 -1.25 -2.00 115.31 118.71 3kbo h LEU 19 Ca 0.30 -0.68 -0.03 0.00 0.84 0.00 0.00 57.88 58.30 3kbo h LEU 19 Cb -0.09 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 40.65 3kbo h LEU 19 CO -0.06 1.49 0.19 -0.33 -0.34 0.00 0.00 178.44 179.38 3kbo h GLU 20 N 0.40 0.73 -0.32 1.25 5.08 -1.22 0.70 114.58 121.20 3kbo h GLU 20 Ca -0.11 -0.11 -0.10 0.00 -1.00 0.00 0.00 59.36 58.03 3kbo h GLU 20 Cb 1.64 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 30.75 3kbo h GLU 20 CO 0.19 0.62 -0.23 -0.22 -1.00 0.00 0.00 179.01 178.37 3kbo h LYS 21 N 0.73 0.62 0.00 2.33 3.64 -1.09 -2.99 116.57 119.81 3kbo h LYS 21 Ca 0.17 -0.24 -0.13 0.00 -1.27 0.00 0.00 60.65 59.18 3kbo h LYS 21 Cb 0.17 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 31.94 3kbo h LYS 21 CO -0.01 0.80 -0.67 0.00 -2.27 0.00 0.00 179.45 177.29 3kbo h ALA 22 N 1.20 0.60 -2.88 5.00 0.00 -0.74 -3.38 119.26 119.07 3kbo h ALA 22 Ca 0.08 -0.59 -0.61 0.00 0.00 0.00 0.00 54.91 53.79 3kbo h ALA 22 Cb 0.69 -0.08 -0.41 0.00 0.00 0.00 0.00 17.79 18.00 3kbo h ALA 22 CO 0.05 0.80 -0.71 -0.51 0.00 0.00 0.00 179.25 178.87 3kbo s LEU 23 N -6.48 3.54 0.51 0.00 1.43 0.18 -4.99 118.68 112.87 3kbo s LEU 23 Ca 0.03 -3.44 0.22 0.00 -1.03 0.00 0.00 54.13 49.92 3kbo s LEU 23 Cb 0.08 -1.21 1.32 0.00 0.03 0.00 0.00 46.19 46.41 3kbo s LEU 23 CO 0.77 -0.14 2.01 -0.65 0.23 0.00 0.00 176.35 178.57 3kbo h PRO 24 N 5.68 0.06 0.00 1.29 0.11 -1.72 0.23 132.00 137.65 3kbo h PRO 24 Ca 0.15 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.26 3kbo h PRO 24 Cb 0.83 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 31.92 3kbo h PRO 24 CO 0.59 0.04 0.00 1.58 -0.21 0.00 0.00 178.00 180.00 3kbo n HIS 25 N -4.42 0.00 -3.93 0.65 -0.00 -1.26 -4.89 115.22 101.37 3kbo n HIS 25 Ca 0.08 0.00 -0.32 0.00 0.46 0.00 0.00 57.72 57.94 3kbo n HIS 25 Cb 0.51 0.00 -0.05 0.00 -0.12 0.00 0.00 29.99 30.33 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 -2.00 3.92 -0.50 1.57 0.00 0.79 -4.95 121.76 120.60 3kbo s ALA 26 Ca 0.41 -0.81 -0.03 0.00 0.00 0.00 0.00 51.96 51.54 3kbo s ALA 26 Cb 0.19 -1.82 0.13 0.00 0.00 0.00 0.00 23.12 21.62 3kbo s ALA 26 CO 0.32 0.77 0.30 0.50 0.00 0.00 0.00 175.76 177.64 3kbo s ARG 27 N -2.11 2.22 -0.11 0.00 6.06 -1.26 -4.85 118.95 118.88 3kbo s ARG 27 Ca 0.29 -2.12 -0.06 0.00 -2.50 0.00 0.00 55.73 51.34 3kbo s ARG 27 Cb -0.13 -3.63 -0.04 0.00 0.06 0.00 0.00 34.95 31.21 3kbo s ARG 27 CO 0.21 -1.11 0.12 0.08 -2.50 0.00 0.00 175.30 172.10 3kbo s VAL 28 N 0.63 5.34 0.04 7.11 1.01 -1.26 -1.47 120.40 131.80 3kbo s VAL 28 Ca 0.12 0.14 -0.05 0.00 0.00 0.00 0.00 61.98 62.19 3kbo s VAL 28 Cb -0.22 -3.32 -0.02 0.00 0.00 0.00 0.00 36.38 32.83 3kbo s VAL 28 CO -0.04 0.62 0.08 0.00 0.00 0.00 0.00 175.10 175.76 3kbo s ARG 29 N -1.01 0.60 -0.09 2.72 1.70 0.73 -4.95 118.95 118.66 3kbo s ARG 29 Ca 0.15 -0.84 -0.22 0.00 -0.47 0.00 0.00 55.73 54.36 3kbo s ARG 29 Cb -0.12 0.23 -0.04 0.00 -0.57 0.00 0.00 34.95 34.45 3kbo s ARG 29 CO 0.04 -0.15 0.62 -2.00 -1.08 0.00 0.00 175.30 172.73 3kbo s GLU 30 N -2.87 4.40 0.22 3.89 2.12 -1.26 -1.42 118.70 123.78 3kbo s GLU 30 Ca -0.03 0.72 -0.28 0.00 0.36 0.00 0.00 54.97 55.74 3kbo s GLU 30 Cb 0.00 -3.44 -0.09 0.00 0.26 0.00 0.00 34.13 30.86 3kbo s GLU 30 CO -0.06 0.10 0.89 -0.46 -0.54 0.00 0.00 175.26 175.18 3kbo s TRP 31 N 0.75 3.96 0.02 5.30 -0.00 -0.32 -4.85 118.94 123.79 3kbo s TRP 31 Ca 0.33 1.83 -0.11 0.00 -0.00 0.00 0.00 56.10 58.15 3kbo s TRP 31 Cb -0.17 -2.91 0.01 0.00 -0.00 0.00 0.00 33.47 30.40 3kbo s TRP 31 CO 0.15 0.47 0.22 -1.59 -0.00 0.00 0.00 176.95 176.21 3kbo s LYS 32 N -1.19 0.66 -0.30 5.86 -2.85 -1.26 -4.84 119.74 115.82 3kbo s LYS 32 Ca 0.40 -0.47 -0.41 0.00 -1.00 0.00 0.00 55.97 54.48 3kbo s LYS 32 Cb -0.25 0.28 -0.17 0.00 -2.06 0.00 0.00 37.83 35.63 3kbo s LYS 32 CO 0.30 -0.19 1.67 0.28 0.10 0.00 0.00 175.35 177.52 3kbo n VAL 33 N 0.95 0.22 0.00 1.79 0.31 -1.26 -1.62 118.33 118.71 3kbo n VAL 33 Ca -0.20 -0.04 0.00 0.00 -0.01 0.00 0.00 64.34 64.09 3kbo n VAL 33 Cb 0.58 -1.02 0.00 0.00 -0.91 0.00 0.00 33.84 32.49 3kbo n VAL 33 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3kbo n GLY 34 N 3.99 2.06 3.55 2.92 0.00 -1.26 -5.06 105.19 111.40 3kbo n GLY 34 Ca 0.27 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.92 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 -1.81 5.79 -0.04 1.61 -1.08 -0.64 -4.74 116.67 115.76 3kbo s ASP 35 Ca 0.00 -0.56 0.10 0.00 -0.52 0.00 0.00 52.55 51.57 3kbo s ASP 35 Cb 0.00 -2.55 0.30 0.00 -1.46 0.00 0.00 42.92 39.20 3kbo s ASP 35 CO 0.00 -2.10 1.24 0.59 0.52 0.00 0.00 175.17 175.42 3kbo n ASN 36 N 11.15 2.94 -4.77 -0.34 3.02 -1.26 -4.94 115.26 121.05 3kbo n ASN 36 Ca 0.23 -2.22 -0.32 0.00 -0.03 0.00 0.00 54.58 52.24 3kbo n ASN 36 Cb 0.50 -0.26 0.05 0.00 -0.61 0.00 0.00 39.78 39.46 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 -1.24 5.05 0.98 6.41 -0.87 -1.26 -5.00 114.94 119.02 3kbo s ASN 37 Ca 0.23 1.93 -0.15 0.00 -1.57 0.00 0.00 52.86 53.31 3kbo s ASN 37 Cb 0.15 -2.54 -0.00 0.00 -0.02 0.00 0.00 41.25 38.84 3kbo s ASN 37 CO 0.12 -1.67 0.04 -2.65 -2.57 0.00 0.00 177.10 170.37 3kbo n PRO 38 N -2.63 -0.39 -3.64 -0.60 -0.02 -1.26 -5.05 135.00 121.40 3kbo n PRO 38 Ca 0.10 -0.09 -0.07 0.00 -2.02 0.00 0.00 63.50 61.42 3kbo n PRO 38 Cb 0.52 -1.63 -0.07 0.00 -0.02 0.00 0.00 33.50 32.30 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 -2.28 -2.07 -0.12 3.55 0.00 -1.26 -4.92 121.76 114.66 3kbo s ALA 39 Ca 0.53 1.99 -0.04 0.00 0.00 0.00 0.00 51.96 54.44 3kbo s ALA 39 Cb -0.18 -1.54 -0.25 0.00 0.00 0.00 0.00 23.12 21.15 3kbo s ALA 39 CO 0.70 -0.27 0.38 -0.25 0.00 0.00 0.00 175.76 176.32 3kbo n ASP 40 N 2.72 1.94 -4.06 0.00 8.00 -0.50 -4.53 116.55 120.13 3kbo n ASP 40 Ca -0.14 0.22 -0.10 0.00 0.71 0.00 0.00 54.79 55.47 3kbo n ASP 40 Cb 0.56 -0.73 -0.11 0.00 -0.02 0.00 0.00 41.12 40.83 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 -2.56 0.56 -0.03 1.24 2.02 -0.89 0.44 117.35 118.12 3kbo s TYR 41 Ca -0.20 -0.67 0.01 0.00 -0.37 0.00 0.00 57.07 55.84 3kbo s TYR 41 Cb 0.07 -0.35 0.01 0.00 -0.40 0.00 0.00 41.96 41.29 3kbo s TYR 41 CO 0.77 -0.17 -0.05 0.00 -1.57 0.00 0.00 175.55 174.52 3kbo s ALA 42 N -2.19 0.61 -0.18 3.71 0.00 -0.99 -1.74 121.76 120.98 3kbo s ALA 42 Ca -0.05 -0.13 -0.03 0.00 0.00 0.00 0.00 51.96 51.75 3kbo s ALA 42 Cb -0.05 -0.30 -0.02 0.00 0.00 0.00 0.00 23.12 22.76 3kbo s ALA 42 CO -0.03 0.05 -0.06 -0.51 0.00 0.00 0.00 175.76 175.21 3kbo s LEU 43 N 0.49 2.98 0.12 0.00 1.02 -0.56 -0.18 118.68 122.55 3kbo s LEU 43 Ca -0.06 -0.28 -0.09 0.00 0.02 0.00 0.00 54.13 53.72 3kbo s LEU 43 Cb -0.10 -1.73 -0.00 0.00 0.02 0.00 0.00 46.19 44.38 3kbo s LEU 43 CO 0.00 0.09 0.23 0.68 0.02 0.00 0.00 176.35 177.36 3kbo s VAL 44 N 0.83 0.11 -0.27 -1.59 -7.23 0.85 -2.09 120.40 111.02 3kbo s VAL 44 Ca -0.02 -1.27 -0.13 0.00 -1.81 0.00 0.00 61.98 58.75 3kbo s VAL 44 Cb -0.15 -1.55 0.09 0.00 0.56 0.00 0.00 36.38 35.33 3kbo s VAL 44 CO 0.01 -0.50 0.63 0.86 -0.31 0.00 0.00 175.10 175.79 3kbo s TRP 45 N -3.91 -1.08 -1.53 2.82 -0.11 -1.09 0.30 118.94 114.33 3kbo s TRP 45 Ca 0.10 2.06 -0.07 0.00 1.22 0.00 0.00 56.10 59.42 3kbo s TRP 45 Cb 0.04 0.63 0.06 0.00 -1.50 0.00 0.00 33.47 32.70 3kbo s TRP 45 CO -0.06 -0.55 0.49 1.04 -4.62 0.00 0.00 176.95 173.25 3kbo n GLN 46 N 4.74 -2.92 -2.32 5.86 6.02 -1.26 -4.49 117.38 123.01 3kbo n GLN 46 Ca -0.17 0.35 -0.36 0.00 -0.01 0.00 0.00 57.00 56.80 3kbo n GLN 46 Cb 0.55 -4.61 -0.01 0.00 1.02 0.00 0.00 30.24 27.19 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 -6.80 3.76 0.30 -1.09 0.04 -1.26 -4.92 135.00 125.03 3kbo s PRO 47 Ca 0.27 1.69 -0.28 0.00 0.04 0.00 0.00 61.00 62.72 3kbo s PRO 47 Cb -0.15 -2.35 -0.09 0.00 0.04 0.00 0.00 34.50 31.95 3kbo s PRO 47 CO 0.92 -0.53 0.98 -2.14 0.04 0.00 0.00 177.00 176.27 3kbo s PRO 48 N -2.78 4.63 0.27 0.56 0.02 -1.26 -4.95 135.00 131.49 3kbo s PRO 48 Ca 0.64 1.48 -0.02 0.00 0.02 0.00 0.00 61.00 63.12 3kbo s PRO 48 Cb -0.26 -2.98 0.59 0.00 0.02 0.00 0.00 34.50 31.87 3kbo s PRO 48 CO 0.32 0.29 1.64 0.28 -0.33 0.00 0.00 177.00 179.20 3kbo h VAL 49 N 2.81 0.33 0.00 3.83 2.07 -1.99 -3.34 116.25 119.95 3kbo h VAL 49 Ca -0.46 -0.06 0.00 0.00 0.82 0.00 0.00 66.70 67.00 3kbo h VAL 49 Cb 1.20 0.14 0.00 0.00 -1.52 0.00 0.00 31.29 31.11 3kbo h VAL 49 CO 0.66 0.03 0.00 -1.84 0.02 0.00 0.00 177.57 176.44 3kbo n GLU 50 N -5.27 0.00 0.00 1.57 0.28 -1.26 -0.97 120.64 114.98 3kbo n GLU 50 Ca 0.18 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.18 3kbo n GLU 50 Cb 0.59 -1.11 0.00 0.00 1.43 0.00 0.00 31.44 32.35 3kbo n GLU 50 CO 0.00 0.00 0.00 1.28 -0.16 0.00 0.00 177.13 178.25 3kbo n LEU 52 N 1.17 0.00 -4.67 -1.84 4.77 -1.25 -4.99 117.00 110.18 3kbo n LEU 52 Ca 0.00 0.00 -0.51 0.00 -0.03 0.00 0.00 56.01 55.47 3kbo n LEU 52 Cb 0.00 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.03 3kbo n LEU 52 CO 0.00 0.00 1.48 0.00 -1.33 0.00 0.00 177.39 177.54 3kbo n ALA 53 N -0.34 0.60 -0.90 -1.18 0.00 -0.15 -1.83 120.51 116.72 3kbo n ALA 53 Ca 0.00 0.27 0.00 0.00 0.00 0.00 0.00 53.44 53.71 3kbo n ALA 53 Cb 0.00 -2.43 0.00 0.00 0.00 0.00 0.00 19.45 17.02 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 4.56 1.07 3.80 0.00 0.00 -1.10 -5.02 105.19 108.51 3kbo n GLY 54 Ca 0.26 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.92 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 -0.05 4.41 -0.37 1.61 0.52 -0.76 -5.04 118.95 119.27 3kbo s ARG 55 Ca 0.00 1.20 -0.14 0.00 -0.52 0.00 0.00 55.73 56.27 3kbo s ARG 55 Cb 0.00 -2.55 -0.00 0.00 0.52 0.00 0.00 34.95 32.92 3kbo s ARG 55 CO 0.00 0.16 0.28 1.03 0.02 0.00 0.00 175.30 176.79 3kbo s ARG 56 N -2.51 3.27 0.07 3.54 0.52 -1.26 -4.77 118.95 117.80 3kbo s ARG 56 Ca 0.54 -0.79 0.07 0.00 -0.52 0.00 0.00 55.73 55.04 3kbo s ARG 56 Cb -0.15 -3.89 -0.03 0.00 0.52 0.00 0.00 34.95 31.41 3kbo s ARG 56 CO 0.19 -0.59 -0.19 -0.51 0.02 0.00 0.00 175.30 174.22 3kbo s LEU 57 N 1.74 2.22 0.40 2.53 1.43 -1.26 -4.70 118.68 121.05 3kbo s LEU 57 Ca 0.06 -0.58 0.21 0.00 -1.03 0.00 0.00 54.13 52.80 3kbo s LEU 57 Cb -0.18 -0.83 0.64 0.00 0.03 0.00 0.00 46.19 45.85 3kbo s LEU 57 CO 0.11 0.08 1.70 0.11 0.23 0.00 0.00 176.35 178.58 3kbo h LYS 58 N 4.55 0.00 -1.04 1.70 1.57 -0.31 -3.44 116.57 119.59 3kbo h LYS 58 Ca -0.43 0.00 0.25 0.00 -1.87 0.00 0.00 60.65 58.60 3kbo h LYS 58 Cb 1.17 0.00 -0.27 0.00 0.08 0.00 0.00 32.23 33.21 3kbo h LYS 58 CO 0.42 0.28 0.97 0.00 -0.57 0.00 0.00 179.45 180.55 3kbo s ALA 59 N -3.43 -2.13 -0.10 3.86 0.00 -1.23 -4.50 121.76 114.23 3kbo s ALA 59 Ca 0.02 1.90 0.04 0.00 0.00 0.00 0.00 51.96 53.92 3kbo s ALA 59 Cb 0.09 -1.47 -0.00 0.00 0.00 0.00 0.00 23.12 21.74 3kbo s ALA 59 CO 0.67 -0.26 -0.23 0.08 0.00 0.00 0.00 175.76 176.02 3kbo s VAL 60 N -1.08 2.15 -0.28 0.00 1.01 -0.79 -2.35 120.40 119.06 3kbo s VAL 60 Ca 0.09 -0.99 -0.06 0.00 0.00 0.00 0.00 61.98 61.02 3kbo s VAL 60 Cb -0.01 -1.82 0.01 0.00 0.00 0.00 0.00 36.38 34.56 3kbo s VAL 60 CO -0.08 0.56 0.05 -0.36 0.00 0.00 0.00 175.10 175.27 3kbo s PHE 61 N 0.26 3.12 0.04 5.22 0.08 0.75 -0.02 117.98 127.43 3kbo s PHE 61 Ca -0.16 -1.04 -0.27 0.00 0.12 0.00 0.00 56.93 55.59 3kbo s PHE 61 Cb -0.17 -2.21 -0.05 0.00 -0.57 0.00 0.00 43.02 40.02 3kbo s PHE 61 CO 0.08 -0.59 0.83 0.08 -0.10 0.00 0.00 175.22 175.52 3kbo s VAL 62 N 1.48 4.72 -0.09 -0.44 1.01 -0.14 -0.11 120.40 126.83 3kbo s VAL 62 Ca 0.03 1.77 -0.03 0.00 0.00 0.00 0.00 61.98 63.74 3kbo s VAL 62 Cb -0.17 -4.18 -0.08 0.00 0.00 0.00 0.00 36.38 31.95 3kbo s VAL 62 CO 0.01 0.32 2.74 0.18 0.00 0.00 0.00 175.10 178.35 3kbo n LEU 63 N 3.03 5.57 0.00 3.92 4.77 0.15 -3.63 117.00 130.81 3kbo n LEU 63 Ca -0.00 -3.01 0.01 0.00 -0.03 0.00 0.00 56.01 52.98 3kbo n LEU 63 Cb 0.50 -1.25 0.00 0.00 -2.33 0.00 0.00 43.42 40.35 3kbo n LEU 63 CO 0.49 1.39 0.44 0.61 -1.33 0.00 0.00 177.39 178.99 3kbo n GLY 64 N 1.69 0.37 0.13 -0.72 0.00 -1.26 -4.89 105.19 100.51 3kbo n GLY 64 Ca 0.26 -0.90 -0.20 0.00 0.00 0.00 0.00 46.02 45.18 3kbo n GLY 64 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kbo h ALA 65 N 2.00 0.36 -2.57 4.61 0.00 -1.88 0.45 119.26 122.24 3kbo h ALA 65 Ca -0.08 -1.30 -0.52 0.00 0.00 0.00 0.00 54.91 53.02 3kbo h ALA 65 Cb 0.44 0.57 -0.02 0.00 0.00 0.00 0.00 17.79 18.78 3kbo h ALA 65 CO 0.11 1.24 0.34 0.20 0.00 0.00 0.00 179.25 181.14 3kbo s GLY 66 N -5.34 2.98 -0.06 0.00 0.00 -1.26 -4.76 107.32 98.88 3kbo s GLY 66 Ca -0.18 0.54 0.09 0.00 0.00 0.00 0.00 44.72 45.18 3kbo s GLY 66 CO 0.81 1.43 1.10 3.33 0.00 0.00 0.00 173.10 179.77 3kbo n VAL 67 N 2.83 1.41 0.10 1.40 0.24 -1.26 -4.75 118.33 118.30 3kbo n VAL 67 Ca 0.02 -1.52 0.03 0.00 -2.04 0.00 0.00 64.34 60.83 3kbo n VAL 67 Cb 0.49 0.18 0.42 0.00 -1.47 0.00 0.00 33.84 33.46 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 0.30 0.26 -0.37 -1.34 2.03 -1.91 -1.86 116.42 113.53 3kbo h ASP 68 Ca 0.00 -0.04 -0.03 0.00 -0.73 0.00 0.00 57.03 56.23 3kbo h ASP 68 Cb 0.76 -0.07 -0.02 0.00 -0.83 0.00 0.00 39.33 39.18 3kbo h ASP 68 CO 0.02 0.34 0.10 0.00 -1.03 0.00 0.00 179.24 178.67 3kbo h ALA 69 N 1.69 0.48 -0.03 4.15 0.00 -1.94 -0.37 119.26 123.25 3kbo h ALA 69 Ca 0.06 -0.18 -0.17 0.00 0.00 0.00 0.00 54.91 54.63 3kbo h ALA 69 Cb 0.25 -0.14 0.01 0.00 0.00 0.00 0.00 17.79 17.91 3kbo h ALA 69 CO 0.01 0.15 -0.63 0.97 0.00 0.00 0.00 179.25 179.74 3kbo h ILE 70 N 0.45 1.39 0.00 0.00 2.10 -1.90 -3.01 117.51 116.54 3kbo h ILE 70 Ca 0.12 -2.03 -0.05 0.00 1.08 0.00 0.00 64.86 63.97 3kbo h ILE 70 Cb 0.29 2.47 -0.01 0.00 -1.09 0.00 0.00 36.82 38.48 3kbo h ILE 70 CO -0.00 0.60 -0.26 -0.07 -1.08 0.00 0.00 178.15 177.35 3kbo h LEU 71 N 0.02 0.00 -0.07 2.19 3.38 -1.35 0.27 115.31 119.75 3kbo h LEU 71 Ca -0.07 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.83 3kbo h LEU 71 Cb 1.32 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.07 3kbo h LEU 71 CO 0.13 0.26 -0.21 0.77 0.09 0.00 0.00 178.44 179.47 3kbo h SER 72 N 0.00 0.30 -0.34 -0.43 4.64 -1.12 -2.69 113.55 113.91 3kbo h SER 72 Ca -0.00 -0.61 -0.01 0.00 -0.47 0.00 0.00 61.79 60.69 3kbo h SER 72 Cb 0.55 -0.09 -0.02 0.00 -0.31 0.00 0.00 62.40 62.54 3kbo h SER 72 CO 0.03 0.86 0.16 0.11 -0.87 0.00 0.00 176.83 177.13 3kbo h LYS 73 N -0.24 0.50 -0.91 4.77 1.57 -1.36 -2.30 116.57 118.60 3kbo h LYS 73 Ca -0.01 -0.07 0.18 0.00 -1.87 0.00 0.00 60.65 58.88 3kbo h LYS 73 Cb 0.83 -0.09 -0.07 0.00 0.08 0.00 0.00 32.23 32.98 3kbo h LYS 73 CO 0.04 0.46 0.59 1.25 -0.57 0.00 0.00 179.45 181.22 3kbo h LEU 74 N 0.42 0.56 0.02 2.94 5.85 -0.48 0.32 115.31 124.94 3kbo h LEU 74 Ca 0.12 0.05 -0.24 0.00 0.84 0.00 0.00 57.88 58.65 3kbo h LEU 74 Cb 0.12 -0.06 -0.03 0.00 0.37 0.00 0.00 40.66 41.07 3kbo h LEU 74 CO -0.01 0.24 -1.19 -1.13 -0.34 0.00 0.00 178.44 176.01 3kbo h ASN 75 N 0.57 0.06 1.82 1.25 -0.73 -1.22 -2.15 115.58 115.18 3kbo h ASN 75 Ca 0.48 -0.07 0.00 0.00 1.87 0.00 0.00 56.30 58.57 3kbo h ASN 75 Cb 0.95 -0.02 0.00 0.00 0.27 0.00 0.00 38.32 39.52 3kbo h ASN 75 CO -0.22 1.06 0.00 0.00 -0.37 0.00 0.00 177.43 177.90 3kbo h ALA 76 N 0.93 1.00 -1.96 1.57 0.00 -0.67 -3.37 119.26 116.77 3kbo h ALA 76 Ca -0.09 0.00 -0.51 0.00 0.00 0.00 0.00 54.91 54.32 3kbo h ALA 76 Cb 1.85 0.00 -0.34 0.00 0.00 0.00 0.00 17.79 19.30 3kbo h ALA 76 CO 0.13 0.00 -0.93 0.72 0.00 0.00 0.00 179.25 179.17 3kbo n HIS 77 N -3.03 -1.28 0.21 0.00 8.25 0.10 -5.00 115.22 114.47 3kbo n HIS 77 Ca 0.04 -3.05 0.11 0.00 -0.26 0.00 0.00 57.72 54.56 3kbo n HIS 77 Cb 0.49 0.32 0.59 0.00 1.12 0.00 0.00 29.99 32.52 3kbo n HIS 77 CO 0.00 0.00 0.00 -1.35 0.64 0.00 0.00 176.34 175.63 3kbo h PRO 78 N 5.01 0.00 -2.14 -0.41 0.11 -1.56 -3.41 132.00 129.60 3kbo h PRO 78 Ca 0.17 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 66.26 3kbo h PRO 78 Cb 0.93 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.04 3kbo h PRO 78 CO 0.35 0.00 0.04 -0.85 -0.21 0.00 0.00 178.00 177.32 3kbo n GLU 79 N -2.37 0.49 -1.46 1.05 0.28 -1.26 -4.71 120.64 112.65 3kbo n GLU 79 Ca -0.01 -0.09 -0.40 0.00 -0.16 0.00 0.00 57.16 56.49 3kbo n GLU 79 Cb 0.23 -1.40 0.02 0.00 1.43 0.00 0.00 31.44 31.73 3kbo n GLU 79 CO 0.00 0.00 0.00 -0.11 -0.16 0.00 0.00 177.13 176.86 3kbo n LEU 81 N 2.04 0.27 -4.85 -1.84 7.94 -1.26 -2.71 117.00 116.59 3kbo n LEU 81 Ca 0.04 0.84 -0.37 0.00 -1.11 0.00 0.00 56.01 55.40 3kbo n LEU 81 Cb 0.24 -1.14 -0.06 0.00 0.53 0.00 0.00 43.42 42.99 3kbo n LEU 81 CO 0.05 -2.95 0.05 -1.81 -1.11 0.00 0.00 177.39 171.62 3kbo s ASP 82 N -1.02 6.72 0.62 1.96 1.01 -1.26 -4.98 116.67 119.71 3kbo s ASP 82 Ca 0.65 0.85 0.28 0.00 0.71 0.00 0.00 52.55 55.05 3kbo s ASP 82 Cb -0.53 -2.21 1.48 0.00 1.01 0.00 0.00 42.92 42.66 3kbo s ASP 82 CO 0.57 0.32 1.87 0.00 0.21 0.00 0.00 175.17 178.13 3kbo h ALA 83 N 4.60 1.88 0.00 5.23 0.00 -2.01 -0.11 119.26 128.86 3kbo h ALA 83 Ca -0.52 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.38 3kbo h ALA 83 Cb 1.22 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.03 3kbo h ALA 83 CO 0.62 -0.60 0.00 -1.13 0.00 0.00 0.00 179.25 178.13 3kbo n SER 84 N -3.37 0.76 -4.57 0.00 3.41 -1.26 -4.73 113.62 103.86 3kbo n SER 84 Ca 0.05 0.59 -0.43 0.00 -0.26 0.00 0.00 58.87 58.82 3kbo n SER 84 Cb 0.59 -0.79 -0.04 0.00 -0.26 0.00 0.00 64.21 63.71 3kbo n SER 84 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 3kbo s ILE 85 N -3.14 4.43 0.53 -1.33 1.01 -0.05 -5.03 121.20 117.61 3kbo s ILE 85 Ca 0.09 0.76 -0.21 0.00 0.00 0.00 0.00 60.65 61.30 3kbo s ILE 85 Cb 0.12 -4.47 -0.06 0.00 0.01 0.00 0.00 42.46 38.06 3kbo s ILE 85 CO 0.55 -0.89 1.20 -2.16 0.00 0.00 0.00 174.94 173.64 3kbo s PRO 86 N 3.88 3.36 -0.09 2.79 0.04 -1.26 -4.87 135.00 138.85 3kbo s PRO 86 Ca 0.38 1.82 0.04 0.00 0.04 0.00 0.00 61.00 63.28 3kbo s PRO 86 Cb -0.10 -2.17 -0.01 0.00 0.04 0.00 0.00 34.50 32.27 3kbo s PRO 86 CO 0.26 -0.89 -0.21 -1.17 0.04 0.00 0.00 177.00 175.03 3kbo s LEU 87 N -3.55 2.27 0.37 -3.56 2.96 -1.26 -1.89 118.68 114.02 3kbo s LEU 87 Ca 0.71 -0.47 0.08 0.00 -0.22 0.00 0.00 54.13 54.24 3kbo s LEU 87 Cb -0.30 -1.45 -0.06 0.00 0.50 0.00 0.00 46.19 44.88 3kbo s LEU 87 CO 0.34 0.20 0.00 -0.36 -1.32 0.00 0.00 176.35 175.22 3kbo s PHE 88 N 0.10 2.51 0.29 5.38 0.08 0.97 0.76 117.98 128.07 3kbo s PHE 88 Ca -0.10 -0.52 0.02 0.00 0.12 0.00 0.00 56.93 56.44 3kbo s PHE 88 Cb -0.16 -1.58 -0.03 0.00 -0.57 0.00 0.00 43.02 40.69 3kbo s PHE 88 CO 0.06 0.46 0.28 -0.98 -0.10 0.00 0.00 175.22 174.94 3kbo s ARG 89 N -3.71 1.60 -0.25 0.44 1.70 -0.76 -0.97 118.95 117.00 3kbo s ARG 89 Ca 0.35 -1.81 -0.16 0.00 -0.47 0.00 0.00 55.73 53.64 3kbo s ARG 89 Cb 0.03 0.34 -0.03 0.00 -0.57 0.00 0.00 34.95 34.72 3kbo s ARG 89 CO 0.19 -0.60 0.42 -0.51 -1.08 0.00 0.00 175.30 173.72 3kbo s LEU 90 N -3.26 4.06 -0.39 -1.89 1.43 0.16 -4.82 118.68 113.97 3kbo s LEU 90 Ca 0.37 0.40 -0.09 0.00 -1.03 0.00 0.00 54.13 53.78 3kbo s LEU 90 Cb 0.03 -2.52 0.06 0.00 0.03 0.00 0.00 46.19 43.79 3kbo s LEU 90 CO 0.21 -0.20 0.22 -1.61 0.23 0.00 0.00 176.35 175.20 3kbo s GLU 91 N 2.01 2.66 3.08 1.70 2.02 -1.26 -3.61 118.70 125.30 3kbo s GLU 91 Ca 0.18 -1.31 0.00 0.00 0.02 0.00 0.00 54.97 53.85 3kbo s GLU 91 Cb -0.16 -3.72 0.00 0.00 0.10 0.00 0.00 34.13 30.36 3kbo s GLU 91 CO 0.09 -0.84 0.00 -3.47 0.02 0.00 0.00 175.26 171.06 3kbo n ASP 92 N 4.92 0.00 -3.97 -0.19 -0.08 -1.26 -4.83 116.55 111.14 3kbo n ASP 92 Ca -0.11 0.00 -0.32 0.00 -1.51 0.00 0.00 54.79 52.85 3kbo n ASP 92 Cb 0.44 0.00 0.01 0.00 2.34 0.00 0.00 41.12 43.91 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 -1.68 -0.32 5.18 -2.24 -1.26 -4.43 114.28 109.52 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 -2.47 0.00 0.00 -2.10 0.00 0.00 70.33 65.76 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 -1.59 0.68 4.11 3.38 0.00 -1.26 -2.45 105.19 108.06 3kbo n GLY 94 Ca 0.05 -0.38 0.00 0.00 0.00 0.00 0.00 46.02 45.69 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 -0.23 0.00 0.31 -0.02 0.00 -1.26 -3.48 105.19 100.51 3kbo n GLY 96 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.99 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 0.88 -1.62 0.99 5.85 -1.97 -2.24 115.31 117.20 3kbo h LEU 97 Ca 0.00 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.71 3kbo h LEU 97 Cb 0.00 -0.21 0.00 0.00 0.37 0.00 0.00 40.66 40.82 3kbo h LEU 97 CO 0.00 0.63 0.00 0.00 -0.34 0.00 0.00 178.44 178.73 3kbo n GLN 98 N -4.56 0.26 0.00 1.25 6.02 -1.23 -1.25 117.38 117.88 3kbo n GLN 98 Ca 0.09 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.08 3kbo n GLN 98 Cb 0.05 -1.28 0.00 0.00 1.02 0.00 0.00 30.24 30.03 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 0.68 0.00 -0.09 -1.09 6.02 -0.85 -2.25 117.38 119.80 3kbo n GLN 100 Ca 0.00 0.00 -0.06 0.00 -0.01 0.00 0.00 57.00 56.93 3kbo n GLN 100 Cb 0.11 0.00 0.01 0.00 1.02 0.00 0.00 30.24 31.38 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 0.20 -0.05 -1.09 5.08 -1.46 -0.51 114.58 116.75 3kbo h GLU 101 Ca 0.00 -0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 58.34 3kbo h GLU 101 Cb 0.00 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.20 3kbo h GLU 101 CO 0.00 0.13 0.02 -0.92 -1.00 0.00 0.00 179.01 177.24 3kbo h TYR 102 N 0.21 0.09 -0.11 4.33 -0.00 -1.72 -2.16 116.97 117.60 3kbo h TYR 102 Ca 0.15 -0.01 -0.05 0.00 -0.00 0.00 0.00 58.73 58.82 3kbo h TYR 102 Cb 0.15 -0.03 -0.00 0.00 -0.00 0.00 0.00 36.73 36.86 3kbo h TYR 102 CO -0.17 0.25 -0.13 0.00 -0.00 0.00 0.00 178.16 178.11 3kbo h ALA 103 N 0.83 0.17 -0.42 1.82 0.00 -1.80 -1.56 119.26 118.29 3kbo h ALA 103 Ca 0.02 -0.32 0.01 0.00 0.00 0.00 0.00 54.91 54.62 3kbo h ALA 103 Cb 0.20 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 17.93 3kbo h ALA 103 CO -0.00 0.04 0.26 0.28 0.00 0.00 0.00 179.25 179.83 3kbo h VAL 104 N -0.11 1.07 -0.31 0.00 2.07 -1.16 0.61 116.25 118.42 3kbo h VAL 104 Ca 0.02 -0.18 0.00 0.00 0.82 0.00 0.00 66.70 67.35 3kbo h VAL 104 Cb 0.67 0.49 -0.02 0.00 -1.52 0.00 0.00 31.29 30.91 3kbo h VAL 104 CO 0.03 0.10 0.20 -1.28 0.02 0.00 0.00 177.57 176.64 3kbo h SER 105 N 0.53 0.36 0.36 0.57 0.87 -1.29 -2.38 113.55 112.57 3kbo h SER 105 Ca 0.16 -0.03 -0.23 0.00 -1.23 0.00 0.00 61.79 60.46 3kbo h SER 105 Cb -0.02 -0.09 0.00 0.00 -0.44 0.00 0.00 62.40 61.85 3kbo h SER 105 CO -0.06 0.29 -0.96 -0.61 -0.53 0.00 0.00 176.83 174.95 3kbo h GLN 106 N 0.41 0.40 -0.35 2.24 5.75 -1.19 -0.62 115.11 121.75 3kbo h GLN 106 Ca 0.11 -0.44 -0.01 0.00 -0.15 0.00 0.00 58.65 58.16 3kbo h GLN 106 Cb -0.02 0.13 -0.02 0.00 1.07 0.00 0.00 27.48 28.64 3kbo h GLN 106 CO -0.02 1.11 0.19 0.28 -2.65 0.00 0.00 178.83 177.74 3kbo h VAL 107 N 0.22 1.14 -0.09 2.39 2.07 -0.85 -1.52 116.25 119.60 3kbo h VAL 107 Ca -0.08 -0.38 -0.07 0.00 0.82 0.00 0.00 66.70 66.98 3kbo h VAL 107 Cb 1.61 0.76 -0.01 0.00 -1.52 0.00 0.00 31.29 32.13 3kbo h VAL 107 CO 0.17 0.15 -0.28 -0.07 0.02 0.00 0.00 177.57 177.55 3kbo h LEU 108 N 0.43 0.16 -0.11 2.57 3.38 -1.35 -0.20 115.31 120.20 3kbo h LEU 108 Ca 0.12 -0.05 -0.00 0.00 0.09 0.00 0.00 57.88 58.04 3kbo h LEU 108 Cb 0.07 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 3kbo h LEU 108 CO -0.02 0.45 0.06 -0.74 0.09 0.00 0.00 178.44 178.28 3kbo h HIS 109 N 0.15 0.16 -0.30 1.13 2.76 -0.47 -0.91 115.15 117.66 3kbo h HIS 109 Ca 0.02 -0.00 -0.06 0.00 -2.20 0.00 0.00 60.37 58.13 3kbo h HIS 109 Cb 0.58 -0.05 -0.01 0.00 1.55 0.00 0.00 27.41 29.48 3kbo h HIS 109 CO 0.01 0.19 -0.03 -1.49 -1.30 0.00 0.00 177.93 175.31 3kbo h TRP 110 N 0.08 0.61 -0.80 5.26 6.55 -1.08 -1.28 115.95 125.29 3kbo h TRP 110 Ca 0.04 -0.12 0.04 0.00 0.95 0.00 0.00 58.89 59.80 3kbo h TRP 110 Cb 0.09 -0.15 -0.05 0.00 -0.86 0.00 0.00 29.16 28.18 3kbo h TRP 110 CO -0.04 0.71 0.52 0.35 -1.05 0.00 0.00 178.44 178.94 3kbo h PHE 111 N 0.34 0.93 -0.13 0.49 3.57 -0.96 0.12 116.94 121.29 3kbo h PHE 111 Ca 0.08 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.61 3kbo h PHE 111 Cb 0.49 -0.31 0.00 0.00 2.79 0.00 0.00 35.95 38.92 3kbo h PHE 111 CO 0.04 0.53 0.00 0.54 -2.23 0.00 0.00 178.31 177.19 3kbo n ARG 112 N -4.46 1.69 -2.83 1.11 5.12 -0.35 -4.54 116.66 112.39 3kbo n ARG 112 Ca 0.11 -1.03 -0.20 0.00 -1.93 0.00 0.00 57.85 54.80 3kbo n ARG 112 Cb 0.14 -1.41 0.03 0.00 -1.16 0.00 0.00 32.46 30.05 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 -3.86 0.25 5.56 1.74 0.41 -4.88 116.66 116.12 3kbo n ARG 113 Ca 0.17 0.83 0.10 0.00 -0.77 0.00 0.00 57.85 58.18 3kbo n ARG 113 Cb 0.32 -5.45 0.64 0.00 -1.02 0.00 0.00 32.46 26.95 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 -1.02 0.00 -0.30 -1.55 0.04 -1.49 0.79 116.94 113.41 3kbo h PHE 114 Ca -0.47 0.00 -0.06 0.00 2.80 0.00 0.00 57.97 60.25 3kbo h PHE 114 Cb 1.33 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 39.47 3kbo h PHE 114 CO 0.47 0.16 -0.03 0.38 -0.60 0.00 0.00 178.31 178.69 3kbo h ASP 115 N 0.00 0.54 -0.61 2.17 2.03 -1.90 -0.95 116.42 117.69 3kbo h ASP 115 Ca -0.00 -0.33 -0.08 0.00 -0.73 0.00 0.00 57.03 55.88 3kbo h ASP 115 Cb 0.40 -0.15 -0.02 0.00 -0.83 0.00 0.00 39.33 38.73 3kbo h ASP 115 CO 0.02 0.74 0.06 0.44 -1.03 0.00 0.00 179.24 179.48 3kbo h ASP 116 N 0.32 1.01 0.73 4.15 3.32 -1.61 -2.32 116.42 122.01 3kbo h ASP 116 Ca 0.08 -0.28 -0.05 0.00 0.02 0.00 0.00 57.03 56.80 3kbo h ASP 116 Cb 0.49 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.76 3kbo h ASP 116 CO 0.02 1.03 -0.25 1.88 -1.72 0.00 0.00 179.24 180.21 3kbo h TYR 117 N 0.95 0.00 0.13 4.55 0.05 -0.79 -1.18 116.97 120.67 3kbo h TYR 117 Ca 0.18 0.00 -0.29 0.00 0.05 0.00 0.00 58.73 58.67 3kbo h TYR 117 Cb 0.48 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.22 3kbo h TYR 117 CO 0.04 0.25 -1.36 -0.56 -1.05 0.00 0.00 178.16 175.48 3kbo h GLN 118 N 0.00 0.27 -0.63 4.88 3.07 -1.03 -1.16 115.11 120.51 3kbo h GLN 118 Ca -0.00 -0.47 0.03 0.00 0.09 0.00 0.00 58.65 58.30 3kbo h GLN 118 Cb 0.68 0.17 -0.04 0.00 0.08 0.00 0.00 27.48 28.37 3kbo h GLN 118 CO 0.03 1.19 0.38 0.00 0.09 0.00 0.00 178.83 180.52 3kbo h ALA 119 N 0.53 0.82 -0.46 0.06 0.00 -1.06 -1.55 119.26 117.60 3kbo h ALA 119 Ca -0.18 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.66 3kbo h ALA 119 Cb 2.00 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 19.58 3kbo h ALA 119 CO 0.19 0.12 0.04 -0.07 0.00 0.00 0.00 179.25 179.53 3kbo h LEU 120 N 0.75 0.69 -0.68 0.00 3.38 -1.19 -2.45 115.31 115.81 3kbo h LEU 120 Ca 0.25 -0.14 -0.07 0.00 0.09 0.00 0.00 57.88 58.02 3kbo h LEU 120 Cb 0.04 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.58 3kbo h LEU 120 CO -0.11 0.73 0.17 0.50 0.09 0.00 0.00 178.44 179.82 3kbo h LYS 121 N 0.69 1.09 0.00 1.13 3.64 -0.56 -1.48 116.57 121.08 3kbo h LYS 121 Ca 0.14 -0.26 0.00 0.00 -1.27 0.00 0.00 60.65 59.26 3kbo h LYS 121 Cb 0.37 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 32.05 3kbo h LYS 121 CO 0.01 0.96 0.00 0.09 -2.27 0.00 0.00 179.45 178.25 3kbo n ASN 122 N -4.27 0.07 -0.52 4.20 3.02 -0.64 -1.56 115.26 115.55 3kbo n ASN 122 Ca 0.05 0.52 0.08 0.00 -0.03 0.00 0.00 54.58 55.20 3kbo n ASN 122 Cb 0.25 -0.53 0.03 0.00 -0.61 0.00 0.00 39.78 38.92 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 -1.57 1.54 -3.49 3.52 6.02 -0.98 -4.99 117.38 117.42 3kbo n GLN 123 Ca 0.03 -1.15 -0.21 0.00 -0.01 0.00 0.00 57.00 55.67 3kbo n GLN 123 Cb 0.16 -1.30 0.08 0.00 1.02 0.00 0.00 30.24 30.20 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 0.39 -1.50 -3.75 -1.58 0.00 -0.60 -4.99 120.51 108.48 3kbo n ALA 124 Ca 0.08 0.24 -0.34 0.00 0.00 0.00 0.00 53.44 53.42 3kbo n ALA 124 Cb 0.38 -4.31 -0.15 0.00 0.00 0.00 0.00 19.45 15.37 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 -6.77 2.68 -0.55 0.00 2.96 -0.59 -5.05 118.68 111.36 3kbo s LEU 125 Ca 0.37 -0.56 -0.24 0.00 -0.22 0.00 0.00 54.13 53.48 3kbo s LEU 125 Cb -0.16 -1.64 0.04 0.00 0.50 0.00 0.00 46.19 44.93 3kbo s LEU 125 CO 0.70 -0.03 0.95 0.86 -1.32 0.00 0.00 176.35 177.51 3kbo s TRP 126 N 1.39 2.79 -0.27 5.38 -0.11 -1.26 -4.49 118.94 122.36 3kbo s TRP 126 Ca 0.05 -0.01 -0.00 0.00 1.22 0.00 0.00 56.10 57.35 3kbo s TRP 126 Cb -0.14 -4.09 0.14 0.00 -1.50 0.00 0.00 33.47 27.88 3kbo s TRP 126 CO -0.07 -1.36 0.34 0.21 -4.62 0.00 0.00 176.95 171.45 3kbo s LYS 127 N 3.97 0.34 0.19 5.86 2.20 -1.26 -5.12 119.74 125.93 3kbo s LYS 127 Ca 0.31 0.10 -0.31 0.00 -0.36 0.00 0.00 55.97 55.70 3kbo s LYS 127 Cb -0.12 -0.57 -0.10 0.00 -1.51 0.00 0.00 37.83 35.52 3kbo s LYS 127 CO 0.19 -0.92 1.54 -2.14 -0.36 0.00 0.00 175.35 173.66 3kbo s PRO 128 N 2.45 4.22 0.15 4.03 0.02 -1.26 -5.01 135.00 139.60 3kbo s PRO 128 Ca 0.10 2.36 0.05 0.00 0.02 0.00 0.00 61.00 63.53 3kbo s PRO 128 Cb -0.14 -3.13 -0.04 0.00 0.02 0.00 0.00 34.50 31.21 3kbo s PRO 128 CO -0.27 -0.56 0.13 -0.51 -0.33 0.00 0.00 177.00 175.46 3kbo s LEU 129 N 0.66 3.83 0.62 -5.54 1.43 -1.26 -5.10 118.68 113.32 3kbo s LEU 129 Ca 0.67 -0.10 -0.19 0.00 -1.03 0.00 0.00 54.13 53.48 3kbo s LEU 129 Cb -0.44 -2.45 -0.02 0.00 0.03 0.00 0.00 46.19 43.32 3kbo s LEU 129 CO 0.35 0.08 1.31 -2.84 0.23 0.00 0.00 176.35 175.49 3kbo s PRO 130 N -2.99 2.70 0.35 1.29 0.02 -1.26 -4.99 135.00 130.13 3kbo s PRO 130 Ca 0.31 2.11 -0.16 0.00 0.02 0.00 0.00 61.00 63.28 3kbo s PRO 130 Cb -0.10 -1.95 -0.09 0.00 0.02 0.00 0.00 34.50 32.37 3kbo s PRO 130 CO 0.23 -1.50 0.79 -1.21 -0.33 0.00 0.00 177.00 174.99 3kbo s GLU 131 N -3.26 4.04 0.37 5.54 2.02 -1.26 -5.05 118.70 121.10 3kbo s GLU 131 Ca 0.80 0.76 -0.07 0.00 0.02 0.00 0.00 54.97 56.48 3kbo s GLU 131 Cb -0.38 -2.37 -0.05 0.00 0.10 0.00 0.00 34.13 31.43 3kbo s GLU 131 CO 0.42 0.10 0.68 0.71 0.02 0.00 0.00 175.26 177.18 3kbo s TYR 132 N -2.06 3.49 0.35 1.61 2.02 -1.26 -5.08 117.35 116.41 3kbo s TYR 132 Ca 0.56 0.81 -0.01 0.00 -0.37 0.00 0.00 57.07 58.06 3kbo s TYR 132 Cb -0.10 -2.26 -0.04 0.00 -0.40 0.00 0.00 41.96 39.17 3kbo s TYR 132 CO 0.17 -0.01 0.57 0.95 -1.57 0.00 0.00 175.55 175.66 3kbo s THR 133 N -2.32 5.08 0.33 -0.71 -4.23 -1.26 -5.00 115.64 107.52 3kbo s THR 133 Ca 0.47 -0.31 0.05 0.00 -1.18 0.00 0.00 61.69 60.72 3kbo s THR 133 Cb -0.10 -3.84 0.13 0.00 1.34 0.00 0.00 72.50 70.03 3kbo s THR 133 CO 0.33 -0.54 1.83 0.03 -0.54 0.00 0.00 174.62 175.73 3kbo h ARG 134 N 0.89 0.46 -0.13 3.99 3.08 -1.93 -3.02 114.38 117.71 3kbo h ARG 134 Ca -0.49 -0.12 -0.08 0.00 0.07 0.00 0.00 59.98 59.36 3kbo h ARG 134 Cb 1.21 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 31.20 3kbo h ARG 134 CO 0.62 0.57 -0.26 0.93 -1.07 0.00 0.00 179.97 180.77 3kbo h GLU 135 N 0.43 0.24 -0.05 0.04 3.07 -1.94 -2.11 114.58 114.26 3kbo h GLU 135 Ca 0.08 -0.08 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 3kbo h GLU 135 Cb 0.45 -0.02 0.00 0.00 -0.84 0.00 0.00 28.75 28.34 3kbo h GLU 135 CO 0.03 0.49 0.00 -0.85 -1.40 0.00 0.00 179.01 177.27 3kbo n GLU 136 N -4.16 1.53 -2.64 2.33 0.28 -1.15 -4.25 120.64 112.60 3kbo n GLU 136 Ca -0.01 -0.78 -0.26 0.00 -0.16 0.00 0.00 57.16 55.94 3kbo n GLU 136 Cb 0.36 -1.45 -0.01 0.00 1.43 0.00 0.00 31.44 31.77 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 -0.03 3.52 -2.00 -1.84 7.35 -0.79 -4.72 117.46 118.94 3kbo n PHE 137 Ca 0.19 -3.39 -0.37 0.00 -0.76 0.00 0.00 57.45 53.12 3kbo n PHE 137 Cb 0.29 -0.22 0.03 0.00 0.35 0.00 0.00 39.48 39.93 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 -3.50 5.46 -0.19 -2.13 0.01 -1.26 -4.60 113.70 107.49 3kbo s SER 138 Ca 0.48 2.48 -0.04 0.00 1.31 0.00 0.00 55.95 60.18 3kbo s SER 138 Cb 0.36 -2.61 -0.02 0.00 0.21 0.00 0.00 66.02 63.96 3kbo s SER 138 CO -0.17 -1.42 -0.03 -0.69 0.41 0.00 0.00 173.24 171.34 3kbo s VAL 139 N -1.49 3.68 -0.26 3.43 1.01 -0.06 -0.62 120.40 126.09 3kbo s VAL 139 Ca 0.72 -0.41 -0.02 0.00 0.00 0.00 0.00 61.98 62.27 3kbo s VAL 139 Cb -0.33 -2.65 0.03 0.00 0.00 0.00 0.00 36.38 33.43 3kbo s VAL 139 CO 0.38 0.45 -0.03 -0.83 0.00 0.00 0.00 175.10 175.06 3kbo s GLY 140 N 0.96 1.67 0.00 4.51 0.00 0.20 -1.37 107.32 113.29 3kbo s GLY 140 Ca 0.00 -1.53 0.00 0.00 0.00 0.00 0.00 44.72 43.20 3kbo s GLY 140 CO 0.01 0.57 0.00 1.39 0.00 0.00 0.00 173.10 175.07 3kbo n ILE 141 N 4.68 0.00 -2.78 0.90 5.41 -0.21 0.57 119.36 127.94 3kbo n ILE 141 Ca -0.15 0.00 -0.10 0.00 1.00 0.00 0.00 62.75 63.49 3kbo n ILE 141 Cb 0.46 -0.86 0.01 0.00 -0.71 0.00 0.00 39.64 38.55 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 5.00 0.05 2.74 7.39 0.00 -0.37 -1.14 105.19 118.86 3kbo n GLY 143 Ca 0.00 0.30 -0.41 0.00 0.00 0.00 0.00 46.02 45.92 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 0.72 6.25 -2.35 4.61 0.00 -1.20 -3.79 120.51 124.76 3kbo n ALA 144 Ca -0.02 -4.42 0.00 0.00 0.00 0.00 0.00 53.44 49.00 3kbo n ALA 144 Cb 0.45 -2.13 0.00 0.00 0.00 0.00 0.00 19.45 17.77 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 -0.21 3.05 0.31 0.00 0.00 -1.26 -4.60 105.19 102.48 3kbo n GLY 145 Ca 0.50 -1.73 -0.13 0.00 0.00 0.00 0.00 46.02 44.65 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 0.39 -0.13 1.61 2.07 -1.97 0.24 116.25 118.46 3kbo h VAL 146 Ca 0.00 0.00 -0.23 0.00 0.82 0.00 0.00 66.70 67.29 3kbo h VAL 146 Cb 0.00 0.39 0.01 0.00 -1.52 0.00 0.00 31.29 30.17 3kbo h VAL 146 CO 0.00 0.00 -0.81 -0.07 0.02 0.00 0.00 177.57 176.71 3kbo h LEU 147 N -0.51 0.93 -0.86 2.57 3.38 -1.94 -3.09 115.31 115.80 3kbo h LEU 147 Ca 0.03 -0.65 -0.03 0.00 0.09 0.00 0.00 57.88 57.32 3kbo h LEU 147 Cb 0.53 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 40.96 3kbo h LEU 147 CO -0.15 1.44 0.42 1.23 0.09 0.00 0.00 178.44 181.47 3kbo h GLY 148 N 0.50 1.32 0.96 0.83 0.00 -1.65 -2.10 103.07 102.93 3kbo h GLY 148 Ca -0.07 -0.65 -0.02 0.00 0.00 0.00 0.00 47.33 46.60 3kbo h GLY 148 CO 0.17 0.62 0.19 0.00 0.00 0.00 0.00 176.54 177.52 3kbo h ALA 149 N 1.23 0.53 -0.46 3.60 0.00 -1.01 -0.50 119.26 122.65 3kbo h ALA 149 Ca 0.30 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 55.09 3kbo h ALA 149 Cb 0.11 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 3kbo h ALA 149 CO -0.04 0.10 0.26 0.87 0.00 0.00 0.00 179.25 180.44 3kbo h LYS 150 N 0.53 0.63 -0.48 0.00 1.79 -1.41 -1.92 116.57 115.71 3kbo h LYS 150 Ca 0.14 -0.07 -0.03 0.00 -2.18 0.00 0.00 60.65 58.51 3kbo h LYS 150 Cb 0.13 -0.13 -0.02 0.00 -1.58 0.00 0.00 32.23 30.63 3kbo h LYS 150 CO -0.02 0.49 0.18 0.28 -1.08 0.00 0.00 179.45 179.30 3kbo h VAL 151 N 0.60 1.21 -0.86 0.50 2.07 -1.28 -2.27 116.25 116.23 3kbo h VAL 151 Ca 0.16 -0.68 0.01 0.00 0.82 0.00 0.00 66.70 67.01 3kbo h VAL 151 Cb 0.03 0.76 -0.04 0.00 -1.52 0.00 0.00 31.29 30.52 3kbo h VAL 151 CO -0.03 0.25 0.56 0.00 0.02 0.00 0.00 177.57 178.38 3kbo h ALA 152 N 1.03 1.09 -0.67 1.67 0.00 -0.89 -1.38 119.26 120.11 3kbo h ALA 152 Ca 0.16 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 3kbo h ALA 152 Cb 0.22 -0.35 -0.03 0.00 0.00 0.00 0.00 17.79 17.63 3kbo h ALA 152 CO -0.01 0.51 0.39 1.49 0.00 0.00 0.00 179.25 181.63 3kbo h GLU 153 N 1.17 0.91 -0.30 0.00 4.81 -1.19 0.88 114.58 120.86 3kbo h GLU 153 Ca 0.31 -0.09 -0.12 0.00 -0.13 0.00 0.00 59.36 59.34 3kbo h GLU 153 Cb -0.12 -0.19 -0.01 0.00 0.63 0.00 0.00 28.75 29.06 3kbo h GLU 153 CO -0.07 0.66 -0.30 0.77 -0.73 0.00 0.00 179.01 179.35 3kbo h SER 154 N 0.91 0.63 0.32 1.04 0.02 -0.78 -3.21 113.55 112.49 3kbo h SER 154 Ca 0.24 -0.24 -0.29 0.00 -0.84 0.00 0.00 61.79 60.65 3kbo h SER 154 Cb -0.00 -0.17 0.02 0.00 0.14 0.00 0.00 62.40 62.38 3kbo h SER 154 CO -0.04 0.90 -1.26 -0.07 -1.14 0.00 0.00 176.83 175.21 3kbo h LEU 155 N 0.53 0.71 -0.95 5.07 3.38 -0.96 -3.27 115.31 119.81 3kbo h LEU 155 Ca 0.07 -0.69 0.17 0.00 0.09 0.00 0.00 57.88 57.52 3kbo h LEU 155 Cb 0.78 -0.23 -0.10 0.00 0.09 0.00 0.00 40.66 41.20 3kbo h LEU 155 CO 0.06 1.52 0.55 -0.61 0.09 0.00 0.00 178.44 180.05 3kbo h GLN 156 N 0.19 0.70 -0.31 1.13 4.15 -0.88 0.53 115.11 120.62 3kbo h GLN 156 Ca -0.18 -0.04 0.09 0.00 0.77 0.00 0.00 58.65 59.29 3kbo h GLN 156 Cb 1.95 -0.16 -0.01 0.00 0.21 0.00 0.00 27.48 29.46 3kbo h GLN 156 CO 0.23 0.47 0.24 0.00 -1.93 0.00 0.00 178.83 177.83 3kbo h ALA 157 N 1.62 2.23 -0.05 3.38 0.00 -1.60 -0.69 119.26 124.15 3kbo h ALA 157 Ca 0.54 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.44 3kbo h ALA 157 Cb 0.81 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.62 3kbo h ALA 157 CO -0.38 -0.40 0.00 0.91 0.00 0.00 0.00 179.25 179.39 3kbo n TRP 158 N -4.33 0.06 -0.97 0.00 7.02 0.17 -4.95 117.44 114.44 3kbo n TRP 158 Ca 0.05 -0.03 0.00 0.00 -1.02 0.00 0.00 57.50 56.50 3kbo n TRP 158 Cb 0.40 0.00 0.00 0.00 -2.42 0.00 0.00 31.31 29.29 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 1.08 0.41 3.75 6.99 0.00 -0.27 -5.04 105.19 112.12 3kbo n GLY 159 Ca 0.19 -0.94 -0.39 0.00 0.00 0.00 0.00 46.02 44.87 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 -2.00 3.65 0.11 1.61 0.08 -1.25 -4.87 117.98 115.31 3kbo s PHE 160 Ca 0.00 1.17 -0.33 0.00 0.12 0.00 0.00 56.93 57.89 3kbo s PHE 160 Cb 0.00 -2.63 -0.13 0.00 -0.57 0.00 0.00 43.02 39.69 3kbo s PHE 160 CO 0.00 0.29 1.69 -2.30 -0.10 0.00 0.00 175.22 174.79 3kbo n PRO 161 N 3.00 2.29 -4.95 0.24 -0.02 -1.26 -4.67 135.00 129.63 3kbo n PRO 161 Ca -0.06 0.83 -0.32 0.00 -2.02 0.00 0.00 63.50 61.93 3kbo n PRO 161 Cb 0.51 -2.64 -0.14 0.00 -0.02 0.00 0.00 33.50 31.22 3kbo n PRO 161 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3kbo s LEU 162 N 1.83 2.55 0.05 2.45 1.43 -1.26 -0.88 118.68 124.84 3kbo s LEU 162 Ca 0.82 -0.30 -0.02 0.00 -1.03 0.00 0.00 54.13 53.59 3kbo s LEU 162 Cb -0.64 -1.50 -0.03 0.00 0.03 0.00 0.00 46.19 44.05 3kbo s LEU 162 CO 0.40 0.32 -0.00 0.00 0.23 0.00 0.00 176.35 177.30 3kbo s ARG 163 N -0.84 0.59 0.04 1.70 1.70 -0.47 -1.58 118.95 120.08 3kbo s ARG 163 Ca 0.12 -1.08 -0.02 0.00 -0.47 0.00 0.00 55.73 54.28 3kbo s ARG 163 Cb -0.10 0.21 -0.02 0.00 -0.57 0.00 0.00 34.95 34.46 3kbo s ARG 163 CO 0.01 -0.12 0.02 0.00 -1.08 0.00 0.00 175.30 174.13 3kbo s TRP 165 N -2.77 1.89 0.27 0.00 -0.00 -0.30 0.49 118.94 118.53 3kbo s TRP 165 Ca -0.04 -0.36 -0.15 0.00 -0.00 0.00 0.00 56.10 55.55 3kbo s TRP 165 Cb -0.00 -1.20 0.06 0.00 -0.00 0.00 0.00 33.47 32.32 3kbo s TRP 165 CO -0.06 -0.01 0.75 -1.13 -0.00 0.00 0.00 176.95 176.50 3kbo n SER 166 N 2.42 -1.78 0.14 5.86 3.41 -0.74 -1.24 113.62 121.69 3kbo n SER 166 Ca -0.16 -2.14 0.10 0.00 -0.26 0.00 0.00 58.87 56.42 3kbo n SER 166 Cb 0.53 2.93 0.05 0.00 -0.26 0.00 0.00 64.21 67.46 3kbo n SER 166 CO 0.00 0.00 0.00 0.03 -0.16 0.00 0.00 175.04 174.91 3kbo h ARG 167 N 0.00 0.00 -5.85 4.33 3.08 -1.96 -1.78 114.38 112.21 3kbo h ARG 167 Ca -0.26 0.00 -0.58 0.00 0.07 0.00 0.00 59.98 59.20 3kbo h ARG 167 Cb 1.04 0.00 -0.30 0.00 0.08 0.00 0.00 29.97 30.79 3kbo h ARG 167 CO 0.34 0.07 -0.85 -1.54 -1.07 0.00 0.00 179.97 176.92 3kbo s SER 168 N -5.77 2.28 0.20 7.04 1.04 -1.26 -4.64 113.70 112.59 3kbo s SER 168 Ca 0.02 -0.35 -0.32 0.00 0.48 0.00 0.00 55.95 55.77 3kbo s SER 168 Cb 0.08 -0.28 -0.13 0.00 0.10 0.00 0.00 66.02 65.79 3kbo s SER 168 CO 0.75 0.23 1.59 -1.14 0.98 0.00 0.00 173.24 175.65 3kbo n ARG 169 N 2.64 2.35 -4.23 4.02 3.00 -1.26 -4.95 116.66 118.23 3kbo n ARG 169 Ca -0.15 0.85 -0.30 0.00 -0.00 0.00 0.00 57.85 58.24 3kbo n ARG 169 Cb 0.53 -2.62 -0.09 0.00 0.00 0.00 0.00 32.46 30.28 3kbo n ARG 169 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.63 177.78 3kbo s LYS 170 N 0.56 2.37 -0.60 -0.14 -0.14 -1.26 -5.06 119.74 115.47 3kbo s LYS 170 Ca 0.74 -0.90 0.06 0.00 -1.36 0.00 0.00 55.97 54.52 3kbo s LYS 170 Cb -0.61 -2.43 0.24 0.00 -1.68 0.00 0.00 37.83 33.35 3kbo s LYS 170 CO 0.40 0.54 0.69 0.45 -0.76 0.00 0.00 175.35 176.66 3kbo n SER 171 N 0.81 3.03 -4.60 2.83 2.88 -1.26 -4.55 113.62 112.76 3kbo n SER 171 Ca -0.13 -3.28 -0.36 0.00 -1.33 0.00 0.00 58.87 53.76 3kbo n SER 171 Cb 0.52 -0.67 -0.10 0.00 -0.75 0.00 0.00 64.21 63.21 3kbo n SER 171 CO 0.00 0.00 0.00 0.26 -1.23 0.00 0.00 175.04 174.07 3kbo s TRP 172 N -2.15 3.24 0.20 0.66 0.51 -1.26 -5.06 118.94 115.07 3kbo s TRP 172 Ca 0.38 0.05 -0.31 0.00 -2.12 0.00 0.00 56.10 54.10 3kbo s TRP 172 Cb 0.14 -2.25 -0.10 0.00 -0.81 0.00 0.00 33.47 30.44 3kbo s TRP 172 CO -0.04 -0.05 1.53 -1.25 -0.51 0.00 0.00 176.95 176.63 3kbo s PRO 173 N 1.20 4.23 0.00 4.98 0.04 -1.26 -1.44 135.00 142.74 3kbo s PRO 173 Ca 0.06 2.35 0.00 0.00 0.04 0.00 0.00 61.00 63.45 3kbo s PRO 173 Cb -0.14 -3.14 0.00 0.00 0.04 0.00 0.00 34.50 31.26 3kbo s PRO 173 CO 0.05 -0.55 0.00 0.41 0.04 0.00 0.00 177.00 176.95 3kbo n GLY 174 N 3.21 0.76 3.00 0.56 0.00 -1.26 -5.04 105.19 106.42 3kbo n GLY 174 Ca 0.11 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.91 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 -2.72 0.90 -0.38 1.61 1.01 -0.52 -4.27 120.40 116.03 3kbo s VAL 175 Ca 0.00 -0.38 -0.16 0.00 0.00 0.00 0.00 61.98 61.44 3kbo s VAL 175 Cb 0.00 -0.82 0.00 0.00 0.00 0.00 0.00 36.38 35.56 3kbo s VAL 175 CO 0.00 0.29 0.38 -0.70 0.00 0.00 0.00 175.10 175.07 3kbo s GLU 176 N 0.48 3.35 -0.18 2.72 2.56 -0.61 -4.52 118.70 122.49 3kbo s GLU 176 Ca -0.09 -0.59 -0.23 0.00 0.00 0.00 0.00 54.97 54.06 3kbo s GLU 176 Cb -0.12 -3.88 -0.02 0.00 2.00 0.00 0.00 34.13 32.11 3kbo s GLU 176 CO 0.02 -0.66 0.75 0.45 -0.56 0.00 0.00 175.26 175.26 3kbo s SER 177 N 1.76 6.84 -0.02 -1.70 0.15 -1.26 -1.58 113.70 117.88 3kbo s SER 177 Ca 0.11 1.03 0.01 0.00 0.70 0.00 0.00 55.95 57.80 3kbo s SER 177 Cb -0.17 -2.41 -0.04 0.00 -1.71 0.00 0.00 66.02 61.70 3kbo s SER 177 CO 0.12 -0.35 0.00 -0.31 1.20 0.00 0.00 173.24 173.90 3kbo s TYR 178 N 2.09 3.10 -0.05 3.44 2.02 0.18 -4.87 117.35 123.26 3kbo s TYR 178 Ca 0.34 0.11 0.01 0.00 -0.37 0.00 0.00 57.07 57.16 3kbo s TYR 178 Cb -0.16 -1.70 0.02 0.00 -0.40 0.00 0.00 41.96 39.72 3kbo s TYR 178 CO 0.11 0.46 -0.06 0.08 -1.57 0.00 0.00 175.55 174.58 3kbo s VAL 179 N -1.04 0.64 0.17 0.71 1.01 -1.26 -1.80 120.40 118.83 3kbo s VAL 179 Ca 0.18 -0.18 0.00 0.00 0.00 0.00 0.00 61.98 61.98 3kbo s VAL 179 Cb -0.11 -0.65 0.00 0.00 0.00 0.00 0.00 36.38 35.62 3kbo s VAL 179 CO 0.09 0.25 0.00 0.61 0.00 0.00 0.00 175.10 176.04 3kbo n GLY 180 N 4.04 -2.07 0.00 4.51 0.00 -0.67 -3.59 105.19 107.41 3kbo n GLY 180 Ca -0.24 -1.36 0.08 0.00 0.00 0.00 0.00 46.02 44.49 3kbo n GLY 180 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3kbo n ARG 181 N -2.98 0.05 0.10 1.61 1.74 -1.26 -1.97 116.66 113.94 3kbo n ARG 181 Ca -0.01 0.21 0.13 0.00 -0.77 0.00 0.00 57.85 57.41 3kbo n ARG 181 Cb 0.25 -1.50 0.38 0.00 -1.02 0.00 0.00 32.46 30.57 3kbo n ARG 181 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 3kbo n GLU 182 N -1.46 0.26 0.00 5.56 4.71 -1.26 -3.41 120.64 125.05 3kbo n GLU 182 Ca 0.04 0.20 0.01 0.00 -0.01 0.00 0.00 57.16 57.40 3kbo n GLU 182 Cb 0.17 -1.79 0.01 0.00 -1.01 0.00 0.00 31.44 28.82 3kbo n GLU 182 CO 0.00 0.00 0.00 0.39 0.09 0.00 0.00 177.13 177.61 3kbo n GLU 183 N -2.24 -0.53 -0.06 3.49 1.02 -0.83 -4.74 120.64 116.75 3kbo n GLU 183 Ca 0.05 -0.57 -0.08 0.00 -0.02 0.00 0.00 57.16 56.55 3kbo n GLU 183 Cb 0.43 -1.01 -0.02 0.00 -0.02 0.00 0.00 31.44 30.82 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 0.28 -0.18 -0.90 -4.62 5.85 -1.48 -1.50 115.31 112.77 3kbo h LEU 184 Ca 0.00 0.07 -0.01 0.00 0.84 0.00 0.00 57.88 58.77 3kbo h LEU 184 Cb 0.06 0.13 -0.04 0.00 0.37 0.00 0.00 40.66 41.18 3kbo h LEU 184 CO 0.00 -0.06 0.50 -0.09 -0.34 0.00 0.00 178.44 178.46 3kbo h ARG 185 N 0.03 1.25 0.10 1.25 2.43 -1.85 0.11 114.38 117.69 3kbo h ARG 185 Ca 0.12 -0.14 0.01 0.00 -0.81 0.00 0.00 59.98 59.15 3kbo h ARG 185 Cb 0.17 -0.25 -0.01 0.00 -0.42 0.00 0.00 29.97 29.46 3kbo h ARG 185 CO -0.23 0.90 -0.11 0.00 -1.51 0.00 0.00 179.97 179.02 3kbo h ALA 186 N 1.28 -0.21 -0.52 2.80 0.00 -1.79 0.02 119.26 120.84 3kbo h ALA 186 Ca 0.32 -0.03 0.10 0.00 0.00 0.00 0.00 54.91 55.30 3kbo h ALA 186 Cb 0.01 0.16 -0.08 0.00 0.00 0.00 0.00 17.79 17.88 3kbo h ALA 186 CO -0.05 -0.63 0.03 0.35 0.00 0.00 0.00 179.25 178.94 3kbo h PHE 187 N -0.24 0.02 -0.27 0.00 3.57 -0.22 -2.26 116.94 117.54 3kbo h PHE 187 Ca 0.01 0.04 -0.06 0.00 3.53 0.00 0.00 57.97 61.49 3kbo h PHE 187 Cb 0.24 0.07 -0.01 0.00 2.79 0.00 0.00 35.95 39.04 3kbo h PHE 187 CO -0.12 -0.10 -0.06 -0.07 -2.23 0.00 0.00 178.31 175.73 3kbo h LEU 188 N 0.15 0.53 -0.57 0.59 3.38 -0.64 -3.27 115.31 115.48 3kbo h LEU 188 Ca 0.27 -0.36 0.06 0.00 0.09 0.00 0.00 57.88 57.93 3kbo h LEU 188 Cb 0.40 -0.14 -0.07 0.00 0.09 0.00 0.00 40.66 40.93 3kbo h LEU 188 CO -0.42 0.77 -0.31 -3.20 0.09 0.00 0.00 178.44 175.37 3kbo n ASN 189 N -4.52 -0.56 -1.48 -0.43 5.15 -0.02 -1.33 115.26 112.08 3kbo n ASN 189 Ca -0.03 1.00 -0.05 0.00 -0.60 0.00 0.00 54.58 54.90 3kbo n ASN 189 Cb 0.31 -0.15 0.23 0.00 -0.53 0.00 0.00 39.78 39.64 3kbo n ASN 189 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3kbo n GLN 190 N -4.73 2.58 -3.51 1.20 1.13 -1.24 -4.05 117.38 108.76 3kbo n GLN 190 Ca 0.02 -3.06 -0.41 0.00 -1.94 0.00 0.00 57.00 51.61 3kbo n GLN 190 Cb 0.16 -1.98 -0.10 0.00 0.11 0.00 0.00 30.24 28.43 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 -3.11 5.22 -0.08 5.09 2.01 -0.44 -4.57 115.64 119.76 3kbo s THR 191 Ca 0.49 -0.40 -0.23 0.00 0.31 0.00 0.00 61.69 61.86 3kbo s THR 191 Cb 0.41 -3.77 -0.29 0.00 0.01 0.00 0.00 72.50 68.86 3kbo s THR 191 CO 0.07 -0.12 0.81 -0.09 -0.69 0.00 0.00 174.62 174.59 3kbo h ARG 192 N 8.53 0.22 -4.79 4.92 9.65 -1.66 -3.39 114.38 127.86 3kbo h ARG 192 Ca -0.30 -0.38 -0.68 0.00 -1.10 0.00 0.00 59.98 57.52 3kbo h ARG 192 Cb 1.14 0.14 -0.32 0.00 -1.39 0.00 0.00 29.97 29.54 3kbo h ARG 192 CO 0.67 1.18 -0.70 0.08 2.80 0.00 0.00 179.97 184.00 3kbo s VAL 193 N -2.39 3.07 -0.34 0.20 1.01 0.21 -0.92 120.40 121.24 3kbo s VAL 193 Ca -0.16 -1.27 -0.17 0.00 0.00 0.00 0.00 61.98 60.38 3kbo s VAL 193 Cb 0.01 -2.72 -0.01 0.00 0.00 0.00 0.00 36.38 33.66 3kbo s VAL 193 CO 0.79 -0.05 0.46 -0.22 0.00 0.00 0.00 175.10 176.08 3kbo s LEU 194 N 1.29 4.35 -0.17 3.92 2.96 -0.49 0.59 118.68 131.13 3kbo s LEU 194 Ca -0.04 -0.05 -0.04 0.00 -0.22 0.00 0.00 54.13 53.78 3kbo s LEU 194 Cb -0.19 -2.51 -0.02 0.00 0.50 0.00 0.00 46.19 43.97 3kbo s LEU 194 CO -0.01 -0.42 -0.03 -0.63 -1.32 0.00 0.00 176.35 173.94 3kbo s ILE 195 N 2.27 3.83 -0.33 6.68 1.01 0.19 -1.36 121.20 133.49 3kbo s ILE 195 Ca 0.17 -0.37 -0.09 0.00 0.00 0.00 0.00 60.65 60.35 3kbo s ILE 195 Cb -0.16 -2.69 0.01 0.00 0.01 0.00 0.00 42.46 39.63 3kbo s ILE 195 CO 0.12 0.47 0.15 0.21 0.00 0.00 0.00 174.94 175.90 3kbo s ASN 196 N 0.61 5.53 -0.30 3.58 2.47 -0.70 -4.21 114.94 121.91 3kbo s ASN 196 Ca -0.02 -0.72 0.12 0.00 0.42 0.00 0.00 52.86 52.66 3kbo s ASN 196 Cb -0.14 -1.98 0.47 0.00 -1.45 0.00 0.00 41.25 38.14 3kbo s ASN 196 CO 0.02 -0.26 1.14 0.18 -3.72 0.00 0.00 177.10 174.47 3kbo n LEU 197 N 4.96 3.63 -4.86 3.21 4.77 -1.26 -2.45 117.00 124.99 3kbo n LEU 197 Ca -0.13 -4.20 -0.31 0.00 -0.03 0.00 0.00 56.01 51.34 3kbo n LEU 197 Cb 0.48 -0.05 -0.05 0.00 -2.33 0.00 0.00 43.42 41.47 3kbo n LEU 197 CO 0.34 1.75 0.40 -0.76 -1.33 0.00 0.00 177.39 177.80 3kbo s LEU 198 N -3.63 3.97 0.48 2.23 1.43 -1.26 -4.39 118.68 117.51 3kbo s LEU 198 Ca 0.42 1.17 -0.14 0.00 -1.03 0.00 0.00 54.13 54.54 3kbo s LEU 198 Cb 0.38 -4.00 -0.07 0.00 0.03 0.00 0.00 46.19 42.53 3kbo s LEU 198 CO -0.01 -0.28 0.91 -2.16 0.23 0.00 0.00 176.35 175.04 3kbo s PRO 199 N -3.35 3.88 -0.49 1.29 0.04 -1.26 -4.56 135.00 130.55 3kbo s PRO 199 Ca 0.52 0.78 -0.25 0.00 0.04 0.00 0.00 61.00 62.09 3kbo s PRO 199 Cb -0.10 -2.23 0.03 0.00 0.04 0.00 0.00 34.50 32.24 3kbo s PRO 199 CO 0.24 -0.19 0.94 1.21 0.04 0.00 0.00 177.00 179.24 3kbo s ASN 200 N -3.12 6.45 0.28 6.66 2.47 -1.26 -4.79 114.94 121.63 3kbo s ASN 200 Ca 0.56 -0.02 0.03 0.00 0.42 0.00 0.00 52.86 53.85 3kbo s ASN 200 Cb -0.10 -2.45 -0.06 0.00 -1.45 0.00 0.00 41.25 37.19 3kbo s ASN 200 CO 0.32 -1.12 0.06 0.42 -3.72 0.00 0.00 177.10 173.05 3kbo s THR 201 N 3.86 0.96 0.45 -5.21 -4.23 -1.26 -4.60 115.64 105.61 3kbo s THR 201 Ca 0.35 -2.01 0.15 0.00 -1.18 0.00 0.00 61.69 59.01 3kbo s THR 201 Cb -0.11 -2.65 0.33 0.00 1.34 0.00 0.00 72.50 71.42 3kbo s THR 201 CO 0.24 -0.07 1.98 0.00 -0.54 0.00 0.00 174.62 176.24 3kbo h ALA 202 N 2.27 2.07 0.00 3.99 0.00 -1.95 -2.22 119.26 123.42 3kbo h ALA 202 Ca -0.39 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.43 3kbo h ALA 202 Cb 1.24 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.95 3kbo h ALA 202 CO 0.66 -0.20 -0.35 1.96 0.00 0.00 0.00 179.25 181.31 3kbo h GLN 203 N 0.35 0.00 -0.00 0.00 7.50 -1.97 -3.33 115.11 117.67 3kbo h GLN 203 Ca 0.27 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.42 3kbo h GLN 203 Cb 0.58 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.11 3kbo h GLN 203 CO -0.07 0.35 -0.72 0.25 -1.50 0.00 0.00 178.83 177.15 3kbo n THR 204 N -3.27 0.00 -1.67 -0.54 -2.24 -0.87 -4.92 114.28 100.76 3kbo n THR 204 Ca 0.02 -0.14 -0.44 0.00 -2.27 0.00 0.00 64.05 61.21 3kbo n THR 204 Cb 0.61 1.05 -0.02 0.00 -2.10 0.00 0.00 70.33 69.87 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 -1.10 1.23 -1.45 2.28 0.31 -0.99 -1.99 118.33 116.62 3kbo n VAL 205 Ca 0.04 -0.31 -0.16 0.00 -0.01 0.00 0.00 64.34 63.91 3kbo n VAL 205 Cb 0.30 -1.45 -0.07 0.00 -0.91 0.00 0.00 33.84 31.71 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 1.80 1.51 0.37 2.92 0.00 -0.27 -4.85 105.19 106.67 3kbo n GLY 206 Ca 0.10 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.15 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 1.11 -0.98 -0.61 2.10 -1.08 -3.25 117.51 114.80 3kbo h ILE 207 Ca -0.32 -0.39 -0.61 0.00 1.08 0.00 0.00 64.86 64.62 3kbo h ILE 207 Cb 1.05 -0.12 -0.09 0.00 -1.09 0.00 0.00 36.82 36.58 3kbo h ILE 207 CO 0.48 0.21 1.71 -0.63 -1.08 0.00 0.00 178.15 178.83 3kbo s ILE 208 N -5.98 3.96 0.47 2.19 1.01 0.39 -4.53 121.20 118.71 3kbo s ILE 208 Ca -0.12 -1.17 0.02 0.00 0.00 0.00 0.00 60.65 59.39 3kbo s ILE 208 Cb 0.20 -5.05 -0.01 0.00 0.01 0.00 0.00 42.46 37.61 3kbo s ILE 208 CO 0.81 -1.90 0.09 0.54 0.00 0.00 0.00 174.94 174.48 3kbo s ASN 209 N 4.90 3.45 0.38 3.58 2.20 -1.23 0.14 114.94 128.35 3kbo s ASN 209 Ca 0.51 -1.73 0.08 0.00 -0.94 0.00 0.00 52.86 50.78 3kbo s ASN 209 Cb 0.01 0.65 0.83 0.00 -2.00 0.00 0.00 41.25 40.74 3kbo s ASN 209 CO -0.02 -0.97 1.95 0.77 -2.94 0.00 0.00 177.10 175.89 3kbo h SER 210 N 1.53 0.58 -0.20 3.54 4.64 -1.90 0.64 113.55 122.38 3kbo h SER 210 Ca -0.38 0.01 0.03 0.00 -0.47 0.00 0.00 61.79 60.98 3kbo h SER 210 Cb 1.30 -0.11 -0.03 0.00 -0.31 0.00 0.00 62.40 63.25 3kbo h SER 210 CO 0.62 0.36 0.03 -0.08 -0.87 0.00 0.00 176.83 176.88 3kbo h GLU 211 N 0.65 0.10 -0.04 4.77 4.81 -1.96 -1.98 114.58 120.93 3kbo h GLU 211 Ca 0.32 -0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 59.53 3kbo h GLU 211 Cb 0.40 -0.02 -0.00 0.00 0.63 0.00 0.00 28.75 29.76 3kbo h GLU 211 CO -0.11 0.07 -0.05 1.25 -0.73 0.00 0.00 179.01 179.44 3kbo h LEU 212 N 0.11 0.11 -1.40 1.64 6.46 -1.53 -3.24 115.31 117.46 3kbo h LEU 212 Ca 0.09 -0.51 0.16 0.00 -0.12 0.00 0.00 57.88 57.50 3kbo h LEU 212 Cb 0.09 -0.03 -0.07 0.00 -0.73 0.00 0.00 40.66 39.93 3kbo h LEU 212 CO -0.13 0.59 0.56 -0.07 -0.62 0.00 0.00 178.44 178.78 3kbo h LEU 213 N -0.37 0.54 -1.31 2.25 3.38 -0.84 -0.13 115.31 118.83 3kbo h LEU 213 Ca 0.01 0.04 0.01 0.00 0.09 0.00 0.00 57.88 58.02 3kbo h LEU 213 Cb 0.57 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 41.21 3kbo h LEU 213 CO 0.01 0.26 0.45 0.44 0.09 0.00 0.00 178.44 179.70 3kbo h ASP 214 N 0.57 0.80 0.00 -0.43 3.32 -1.38 -2.16 116.42 117.13 3kbo h ASP 214 Ca 0.43 -0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.46 3kbo h ASP 214 Cb 0.84 -0.20 0.00 0.00 0.22 0.00 0.00 39.33 40.19 3kbo h ASP 214 CO -0.18 0.58 0.00 0.00 -1.72 0.00 0.00 179.24 177.92 3kbo n GLN 215 N -4.43 0.84 -3.33 3.56 1.13 -0.06 -4.73 117.38 110.36 3kbo n GLN 215 Ca 0.07 0.00 -0.32 0.00 -1.94 0.00 0.00 57.00 54.81 3kbo n GLN 215 Cb 0.04 -1.42 -0.05 0.00 0.11 0.00 0.00 30.24 28.91 3kbo n GLN 215 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 3kbo s LEU 216 N -1.85 4.13 0.76 1.08 1.43 -0.82 -2.39 118.68 121.02 3kbo s LEU 216 Ca 0.34 1.00 -0.11 0.00 -1.03 0.00 0.00 54.13 54.33 3kbo s LEU 216 Cb 0.16 -3.78 0.05 0.00 0.03 0.00 0.00 46.19 42.64 3kbo s LEU 216 CO 0.26 -0.12 1.08 -2.16 0.23 0.00 0.00 176.35 175.65 3kbo s PRO 217 N -2.91 2.41 0.57 1.29 0.04 -1.26 -4.98 135.00 130.17 3kbo s PRO 217 Ca 0.49 0.84 -0.20 0.00 0.04 0.00 0.00 61.00 62.17 3kbo s PRO 217 Cb -0.11 -1.94 -0.04 0.00 0.04 0.00 0.00 34.50 32.45 3kbo s PRO 217 CO 0.21 -1.44 1.29 -0.51 0.04 0.00 0.00 177.00 176.59 3kbo s ASP 218 N -3.77 5.18 -0.06 6.66 1.01 -1.26 -2.84 116.67 121.58 3kbo s ASP 218 Ca 0.60 2.61 0.00 0.00 0.71 0.00 0.00 52.55 56.47 3kbo s ASP 218 Cb -0.15 -2.62 0.00 0.00 1.01 0.00 0.00 42.92 41.16 3kbo s ASP 218 CO 0.55 -1.61 0.00 0.61 0.21 0.00 0.00 175.17 174.92 3kbo n GLY 219 N 0.70 0.48 3.57 0.21 0.00 0.71 -4.97 105.19 105.89 3kbo n GLY 219 Ca 0.12 -0.36 -0.30 0.00 0.00 0.00 0.00 46.02 45.47 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 -1.97 0.52 0.02 4.61 0.00 -0.49 -3.78 121.76 120.67 3kbo s ALA 220 Ca 0.00 -1.00 -0.02 0.00 0.00 0.00 0.00 51.96 50.95 3kbo s ALA 220 Cb 0.00 -2.87 -0.02 0.00 0.00 0.00 0.00 23.12 20.24 3kbo s ALA 220 CO 0.00 -3.70 0.00 0.71 0.00 0.00 0.00 175.76 172.77 3kbo s TYR 221 N -2.98 0.25 -0.11 0.00 2.02 -0.09 0.11 117.35 116.55 3kbo s TYR 221 Ca 0.71 -0.53 0.01 0.00 -0.37 0.00 0.00 57.07 56.89 3kbo s TYR 221 Cb -0.09 -0.19 0.02 0.00 -0.40 0.00 0.00 41.96 41.30 3kbo s TYR 221 CO 0.56 -0.24 -0.13 0.08 -1.57 0.00 0.00 175.55 174.26 3kbo s VAL 222 N -1.79 1.36 -0.35 0.71 1.01 -0.91 -1.39 120.40 119.03 3kbo s VAL 222 Ca -0.13 -0.53 0.02 0.00 0.00 0.00 0.00 61.98 61.34 3kbo s VAL 222 Cb -0.07 -1.27 0.09 0.00 0.00 0.00 0.00 36.38 35.13 3kbo s VAL 222 CO -0.02 0.42 0.07 -0.22 0.00 0.00 0.00 175.10 175.35 3kbo s LEU 223 N 1.23 4.69 -0.50 3.92 2.96 -0.46 -4.30 118.68 126.22 3kbo s LEU 223 Ca -0.02 -1.99 -0.16 0.00 -0.22 0.00 0.00 54.13 51.74 3kbo s LEU 223 Cb -0.14 -1.68 0.10 0.00 0.50 0.00 0.00 46.19 44.97 3kbo s LEU 223 CO -0.05 -0.39 0.44 0.21 -1.32 0.00 0.00 176.35 175.25 3kbo s ASN 224 N 1.17 6.17 0.00 3.68 2.47 -1.26 -1.72 114.94 125.45 3kbo s ASN 224 Ca 0.07 -1.54 0.17 0.00 0.42 0.00 0.00 52.86 51.98 3kbo s ASN 224 Cb -0.20 -2.20 -0.10 0.00 -1.45 0.00 0.00 41.25 37.30 3kbo s ASN 224 CO -0.06 -0.75 0.79 0.18 -3.72 0.00 0.00 177.10 173.54 3kbo n LEU 225 N 5.22 1.21 0.00 3.21 4.77 -1.12 -1.83 117.00 128.46 3kbo n LEU 225 Ca -0.13 -0.62 0.00 0.00 -0.03 0.00 0.00 56.01 55.23 3kbo n LEU 225 Cb 0.42 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.51 3kbo n LEU 225 CO 0.50 0.25 0.00 0.00 -1.33 0.00 0.00 177.39 176.82 3kbo n ALA 226 N -0.79 0.00 -2.84 -1.18 0.00 -1.03 -4.94 120.51 109.73 3kbo n ALA 226 Ca 0.05 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.36 3kbo n ALA 226 Cb 0.31 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 19.63 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 0.06 0.31 0.25 0.00 1.81 -1.26 -4.93 118.95 115.20 3kbo s ARG 227 Ca 0.00 -0.32 -0.03 0.00 -1.72 0.00 0.00 55.73 53.66 3kbo s ARG 227 Cb 0.00 -0.20 0.45 0.00 -0.45 0.00 0.00 34.95 34.75 3kbo s ARG 227 CO 0.00 0.04 1.77 0.78 -0.68 0.00 0.00 175.30 177.22 3kbo h GLY 228 N 5.53 1.26 1.86 -3.53 0.00 -1.79 -1.64 103.07 104.76 3kbo h GLY 228 Ca -0.29 -0.25 0.00 0.00 0.00 0.00 0.00 47.33 46.80 3kbo h GLY 228 CO 0.47 0.01 0.07 -0.39 0.00 0.00 0.00 176.54 176.70 3kbo h VAL 229 N 0.63 0.07 0.00 4.60 -1.51 -1.90 -2.18 116.25 115.97 3kbo h VAL 229 Ca 0.42 0.00 -0.01 0.00 -1.23 0.00 0.00 66.70 65.88 3kbo h VAL 229 Cb 0.52 0.94 -0.00 0.00 -2.13 0.00 0.00 31.29 30.61 3kbo h VAL 229 CO -0.32 0.00 -0.04 0.45 -1.23 0.00 0.00 177.57 176.43 3kbo h HIS 230 N 0.00 0.00 -3.61 5.19 3.86 -1.59 -0.70 115.15 118.31 3kbo h HIS 230 Ca 0.00 0.00 -0.67 0.00 -1.16 0.00 0.00 60.37 58.54 3kbo h HIS 230 Cb 0.14 0.00 -0.21 0.00 1.06 0.00 0.00 27.41 28.39 3kbo h HIS 230 CO 0.00 0.04 -0.71 0.08 0.86 0.00 0.00 177.93 178.20 3kbo s VAL 231 N -4.15 3.53 -0.78 2.45 1.01 -0.82 -0.46 120.40 121.18 3kbo s VAL 231 Ca -0.03 -0.53 -0.20 0.00 0.00 0.00 0.00 61.98 61.22 3kbo s VAL 231 Cb 0.13 -2.46 0.11 0.00 0.00 0.00 0.00 36.38 34.16 3kbo s VAL 231 CO 0.51 0.57 1.00 -1.58 0.00 0.00 0.00 175.10 175.59 3kbo s GLN 232 N -0.40 3.35 0.20 2.72 -0.44 0.12 -4.90 119.66 120.30 3kbo s GLN 232 Ca 0.05 -1.41 -0.20 0.00 -2.50 0.00 0.00 55.36 51.31 3kbo s GLN 232 Cb -0.12 -4.57 0.15 0.00 -1.64 0.00 0.00 33.01 26.82 3kbo s GLN 232 CO 0.02 -1.74 1.58 0.93 0.50 0.00 0.00 175.29 176.58 3kbo h GLU 233 N 9.10 -0.12 -0.91 1.67 5.08 -1.93 0.23 114.58 127.71 3kbo h GLU 233 Ca -0.06 0.01 0.06 0.00 -1.00 0.00 0.00 59.36 58.36 3kbo h GLU 233 Cb 1.05 0.03 -0.06 0.00 0.50 0.00 0.00 28.75 30.27 3kbo h GLU 233 CO 1.12 -0.08 0.59 0.00 -1.00 0.00 0.00 179.01 179.65 3kbo h ALA 234 N 1.07 1.48 -0.50 3.43 0.00 -1.99 -0.74 119.26 122.01 3kbo h ALA 234 Ca 0.26 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 55.05 3kbo h ALA 234 Cb 0.56 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 3kbo h ALA 234 CO -0.76 0.40 -0.03 -0.44 0.00 0.00 0.00 179.25 178.42 3kbo h ASP 235 N 1.07 0.83 0.24 0.00 3.32 -1.56 -1.18 116.42 119.14 3kbo h ASP 235 Ca 0.38 -0.22 -0.01 0.00 0.02 0.00 0.00 57.03 57.20 3kbo h ASP 235 Cb 0.14 -0.22 0.00 0.00 0.22 0.00 0.00 39.33 39.47 3kbo h ASP 235 CO -0.14 0.91 -0.12 0.25 -1.72 0.00 0.00 179.24 178.42 3kbo h LEU 236 N 0.79 -0.28 -0.77 1.55 5.85 0.02 -2.49 115.31 119.97 3kbo h LEU 236 Ca 0.15 -0.10 0.12 0.00 0.84 0.00 0.00 57.88 58.88 3kbo h LEU 236 Cb 0.51 0.07 -0.09 0.00 0.37 0.00 0.00 40.66 41.53 3kbo h LEU 236 CO 0.03 -0.06 0.37 -0.07 -0.34 0.00 0.00 178.44 178.37 3kbo h LEU 237 N -0.49 0.44 -1.04 2.25 3.38 -1.00 -1.68 115.31 117.19 3kbo h LEU 237 Ca -0.03 0.08 -0.03 0.00 0.09 0.00 0.00 57.88 57.99 3kbo h LEU 237 Cb 0.36 0.02 -0.03 0.00 0.09 0.00 0.00 40.66 41.10 3kbo h LEU 237 CO 0.05 0.21 0.31 0.00 0.09 0.00 0.00 178.44 179.10 3kbo h ALA 238 N 1.51 1.25 -0.31 1.53 0.00 -1.07 -2.45 119.26 119.72 3kbo h ALA 238 Ca 0.41 -0.15 -0.12 0.00 0.00 0.00 0.00 54.91 55.04 3kbo h ALA 238 Cb 0.53 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 3kbo h ALA 238 CO -0.34 0.57 -0.31 0.00 0.00 0.00 0.00 179.25 179.17 3kbo h ALA 239 N 1.36 0.88 -0.21 0.00 0.00 -0.85 -1.83 119.26 118.60 3kbo h ALA 239 Ca 0.24 -0.40 -0.10 0.00 0.00 0.00 0.00 54.91 54.64 3kbo h ALA 239 Cb 0.14 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 3kbo h ALA 239 CO -0.03 0.63 -0.30 -0.07 0.00 0.00 0.00 179.25 179.48 3kbo h LEU 240 N 0.55 0.42 0.00 0.00 3.38 -1.13 -2.08 115.31 116.45 3kbo h LEU 240 Ca 0.06 -0.15 0.00 0.00 0.09 0.00 0.00 57.88 57.88 3kbo h LEU 240 Cb 0.81 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.44 3kbo h LEU 240 CO 0.07 0.71 -0.21 0.44 0.09 0.00 0.00 178.44 179.54 3kbo h ASP 241 N 0.36 0.00 0.39 -0.43 3.32 -1.24 -3.31 116.42 115.52 3kbo h ASP 241 Ca 0.05 -0.06 -0.19 0.00 0.02 0.00 0.00 57.03 56.84 3kbo h ASP 241 Cb 0.71 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.23 3kbo h ASP 241 CO 0.05 0.03 -1.77 -1.54 -1.72 0.00 0.00 179.24 174.29 3kbo n SER 242 N -2.30 0.49 0.00 6.45 3.41 -0.71 -4.99 113.62 115.97 3kbo n SER 242 Ca 0.05 0.22 0.00 0.00 -0.26 0.00 0.00 58.87 58.87 3kbo n SER 242 Cb 0.44 0.70 0.00 0.00 -0.26 0.00 0.00 64.21 65.09 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 1.46 0.78 0.08 5.00 0.00 -0.94 -4.98 105.19 106.59 3kbo n GLY 243 Ca -0.15 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.77 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 1.95 0.07 -5.72 1.61 1.63 -1.71 -2.51 116.57 111.89 3kbo h LYS 244 Ca 0.00 -0.00 -0.66 0.00 -0.85 0.00 0.00 60.65 59.13 3kbo h LYS 244 Cb 0.00 -0.02 -0.13 0.00 -0.60 0.00 0.00 32.23 31.49 3kbo h LYS 244 CO 0.00 0.05 -0.56 -0.51 -3.45 0.00 0.00 179.45 174.97 3kbo s LEU 245 N -10.24 3.89 -0.04 5.20 1.43 -0.87 -0.21 118.68 117.84 3kbo s LEU 245 Ca -0.13 0.24 -0.06 0.00 -1.03 0.00 0.00 54.13 53.15 3kbo s LEU 245 Cb 0.08 -1.93 -0.28 0.00 0.03 0.00 0.00 46.19 44.08 3kbo s LEU 245 CO 0.68 0.35 0.70 0.50 0.23 0.00 0.00 176.35 178.81 3kbo h LYS 246 N 5.42 0.30 -2.23 1.70 1.63 0.75 -3.39 116.57 120.75 3kbo h LYS 246 Ca -0.49 -0.51 0.16 0.00 -0.85 0.00 0.00 60.65 58.96 3kbo h LYS 246 Cb 1.20 0.19 -0.12 0.00 -0.60 0.00 0.00 32.23 32.90 3kbo h LYS 246 CO 0.59 1.17 0.52 0.20 -3.45 0.00 0.00 179.45 178.48 3kbo s GLY 247 N -5.11 -0.35 0.00 5.01 0.00 -1.20 -4.95 107.32 100.72 3kbo s GLY 247 Ca -0.13 0.62 0.00 0.00 0.00 0.00 0.00 44.72 45.20 3kbo s GLY 247 CO 0.84 0.18 0.00 0.00 0.00 0.00 0.00 173.10 174.12 3kbo n ALA 248 N -0.36 0.00 -3.65 3.20 0.00 -0.66 -2.15 120.51 116.90 3kbo n ALA 248 Ca -0.07 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.35 3kbo n ALA 248 Cb 0.61 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.99 3kbo n ALA 248 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3kbo s LEU 250 N 0.00 -0.02 0.00 0.00 1.43 -0.61 -1.11 118.68 118.38 3kbo s LEU 250 Ca 0.00 0.03 0.05 0.00 -1.03 0.00 0.00 54.13 53.18 3kbo s LEU 250 Cb 0.00 1.03 -0.02 0.00 0.03 0.00 0.00 46.19 47.23 3kbo s LEU 250 CO 0.00 -0.00 0.40 -0.67 0.23 0.00 0.00 176.35 176.31 3kbo n ASP 251 N 1.74 0.72 -4.13 2.29 2.03 -0.76 -1.56 116.55 116.88 3kbo n ASP 251 Ca -0.11 -0.86 -0.11 0.00 0.52 0.00 0.00 54.79 54.23 3kbo n ASP 251 Cb 0.57 0.62 -0.10 0.00 -0.72 0.00 0.00 41.12 41.48 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 -1.11 0.59 0.09 5.18 -7.23 -1.25 -1.11 120.40 115.55 3kbo s VAL 252 Ca 0.04 -1.72 -0.11 0.00 -1.81 0.00 0.00 61.98 58.37 3kbo s VAL 252 Cb 0.04 -1.41 0.01 0.00 0.56 0.00 0.00 36.38 35.58 3kbo s VAL 252 CO 0.16 -0.78 0.26 -0.36 -0.31 0.00 0.00 175.10 174.07 3kbo s PHE 253 N -3.16 0.03 0.48 2.82 0.08 -1.26 -4.49 117.98 112.47 3kbo s PHE 253 Ca 0.06 -0.40 0.26 0.00 0.12 0.00 0.00 56.93 56.98 3kbo s PHE 253 Cb 0.02 0.04 1.31 0.00 -0.57 0.00 0.00 43.02 43.82 3kbo s PHE 253 CO -0.04 -0.58 1.84 0.66 -0.10 0.00 0.00 175.22 176.99 3kbo h SER 254 N 2.70 0.21 -3.71 1.36 4.64 -1.92 -3.38 113.55 113.45 3kbo h SER 254 Ca -0.34 0.03 -0.24 0.00 -0.47 0.00 0.00 61.79 60.78 3kbo h SER 254 Cb 1.21 -0.00 -0.29 0.00 -0.31 0.00 0.00 62.40 63.01 3kbo h SER 254 CO 0.53 0.06 -0.72 -1.10 -0.87 0.00 0.00 176.83 174.72 3kbo s GLN 255 N -5.21 0.01 -0.07 4.77 -0.21 -1.26 -4.87 119.66 112.82 3kbo s GLN 255 Ca -0.07 0.01 -0.02 0.00 0.02 0.00 0.00 55.36 55.30 3kbo s GLN 255 Cb 0.23 -0.03 0.03 0.00 1.00 0.00 0.00 33.01 34.24 3kbo s GLN 255 CO 0.79 -0.01 0.05 -1.21 -2.12 0.00 0.00 175.29 172.78 3kbo s GLU 256 N 0.09 0.15 0.63 2.91 2.02 -1.26 -2.56 118.70 120.68 3kbo s GLU 256 Ca -0.01 0.22 -0.18 0.00 0.02 0.00 0.00 54.97 55.02 3kbo s GLU 256 Cb -0.01 -0.85 -0.02 0.00 0.10 0.00 0.00 34.13 33.35 3kbo s GLU 256 CO -0.00 -0.37 1.27 -2.14 0.02 0.00 0.00 175.26 174.04 3kbo s PRO 257 N 2.10 2.65 -0.18 0.39 0.02 -1.26 -5.09 135.00 133.64 3kbo s PRO 257 Ca 0.04 2.00 -0.29 0.00 0.02 0.00 0.00 61.00 62.78 3kbo s PRO 257 Cb -0.13 -1.87 -0.03 0.00 0.02 0.00 0.00 34.50 32.50 3kbo s PRO 257 CO -0.04 -1.50 1.56 -1.17 -0.33 0.00 0.00 177.00 175.52 3kbo s LEU 258 N -4.30 4.03 0.76 -5.54 2.96 -1.06 -4.96 118.68 110.58 3kbo s LEU 258 Ca 0.81 1.76 -0.15 0.00 -0.22 0.00 0.00 54.13 56.33 3kbo s LEU 258 Cb -0.36 -3.53 0.01 0.00 0.50 0.00 0.00 46.19 42.81 3kbo s LEU 258 CO 0.38 -1.11 0.80 -0.81 -1.32 0.00 0.00 176.35 174.30 3kbo n PRO 259 N 7.38 0.28 0.03 0.98 -0.04 -1.26 -4.86 135.00 137.52 3kbo n PRO 259 Ca 0.18 0.15 0.21 0.00 -0.04 0.00 0.00 63.50 63.99 3kbo n PRO 259 Cb 0.45 -2.09 0.73 0.00 -0.04 0.00 0.00 33.50 32.54 3kbo n PRO 259 CO 0.00 0.00 0.00 1.96 -0.04 0.00 0.00 175.50 177.42 3kbo h GLN 260 N -0.57 0.00 -0.20 0.54 1.08 -2.02 -2.81 115.11 111.13 3kbo h GLN 260 Ca -0.46 0.00 -0.04 0.00 -1.45 0.00 0.00 58.65 56.70 3kbo h GLN 260 Cb 1.33 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 28.75 3kbo h GLN 260 CO 0.44 0.00 -0.05 1.49 -0.95 0.00 0.00 178.83 179.76 3kbo h GLU 261 N 0.00 0.38 -4.30 1.46 4.81 -2.03 -3.46 114.58 111.44 3kbo h GLU 261 Ca 0.23 -0.14 -0.56 0.00 -0.13 0.00 0.00 59.36 58.76 3kbo h GLU 261 Cb 1.04 -0.02 0.04 0.00 0.63 0.00 0.00 28.75 30.44 3kbo h GLU 261 CO -0.00 0.63 -0.00 0.45 -0.73 0.00 0.00 179.01 179.36 3kbo n SER 262 N -4.63 -0.10 0.00 1.04 2.88 -1.06 -4.80 113.62 106.95 3kbo n SER 262 Ca -0.05 0.83 0.12 0.00 -1.33 0.00 0.00 58.87 58.45 3kbo n SER 262 Cb 0.28 -0.66 0.62 0.00 -0.75 0.00 0.00 64.21 63.69 3kbo n SER 262 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 3kbo n PRO 263 N 1.04 0.31 -0.24 -1.46 -0.04 -1.26 -3.32 135.00 130.03 3kbo n PRO 263 Ca 0.14 0.05 -0.05 0.00 -0.04 0.00 0.00 63.50 63.60 3kbo n PRO 263 Cb 0.07 -1.50 0.05 0.00 -0.04 0.00 0.00 33.50 32.08 3kbo n PRO 263 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 3kbo h LEU 264 N 0.00 0.79 -0.81 1.53 4.07 -1.95 -1.91 115.31 117.03 3kbo h LEU 264 Ca 0.00 -0.04 0.16 0.00 0.08 0.00 0.00 57.88 58.08 3kbo h LEU 264 Cb 0.26 -0.20 -0.10 0.00 1.08 0.00 0.00 40.66 41.70 3kbo h LEU 264 CO 0.00 0.59 0.36 -0.50 -1.08 0.00 0.00 178.44 177.81 3kbo h TRP 265 N 0.92 0.61 0.00 1.13 4.06 -1.92 -2.55 115.95 118.20 3kbo h TRP 265 Ca 0.24 0.04 -0.00 0.00 2.06 0.00 0.00 58.89 61.23 3kbo h TRP 265 Cb -0.07 -0.15 -0.00 0.00 -1.00 0.00 0.00 29.16 27.94 3kbo h TRP 265 CO -0.02 0.08 -0.45 0.00 -3.56 0.00 0.00 178.44 174.48 3kbo h ARG 266 N 0.49 0.00 -6.36 0.49 3.08 -1.66 -3.46 114.38 106.95 3kbo h ARG 266 Ca 0.46 0.00 -0.54 0.00 0.07 0.00 0.00 59.98 59.96 3kbo h ARG 266 Cb 0.71 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.76 3kbo h ARG 266 CO -0.42 0.01 0.90 -1.58 -1.07 0.00 0.00 179.97 177.81 3kbo s HIS 267 N -3.27 2.67 0.54 3.04 2.46 -0.76 -4.89 115.29 115.08 3kbo s HIS 267 Ca 0.04 0.66 0.39 0.00 0.47 0.00 0.00 55.06 56.62 3kbo s HIS 267 Cb 0.07 -3.74 2.08 0.00 -0.13 0.00 0.00 32.58 30.86 3kbo s HIS 267 CO 0.72 -2.84 2.27 -1.35 -2.47 0.00 0.00 174.74 171.07 3kbo h PRO 268 N 8.15 0.00 -0.25 2.88 0.11 -1.89 -3.01 132.00 137.99 3kbo h PRO 268 Ca -0.38 0.00 -0.10 0.00 0.11 0.00 0.00 66.00 65.62 3kbo h PRO 268 Cb 1.18 0.00 -0.06 0.00 0.11 0.00 0.00 31.00 32.23 3kbo h PRO 268 CO 0.92 0.01 -0.13 0.54 -0.21 0.00 0.00 178.00 179.13 3kbo n ARG 269 N -3.26 1.92 -3.85 1.05 1.74 -1.26 -4.85 116.66 108.15 3kbo n ARG 269 Ca -0.02 -3.09 -0.30 0.00 -0.77 0.00 0.00 57.85 53.67 3kbo n ARG 269 Cb 0.13 -1.76 -0.14 0.00 -1.02 0.00 0.00 32.46 29.66 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 -3.14 1.74 0.31 1.55 1.01 -1.14 -1.65 120.40 119.08 3kbo s VAL 270 Ca 0.42 -2.33 -0.05 0.00 0.00 0.00 0.00 61.98 60.02 3kbo s VAL 270 Cb 0.38 -2.26 0.08 0.00 0.00 0.00 0.00 36.38 34.58 3kbo s VAL 270 CO 0.00 -0.73 0.30 0.00 0.00 0.00 0.00 175.10 174.67 3kbo n ALA 271 N 4.02 -0.82 -3.61 5.51 0.00 -0.26 -4.90 120.51 120.45 3kbo n ALA 271 Ca 0.04 -0.44 -0.09 0.00 0.00 0.00 0.00 53.44 52.95 3kbo n ALA 271 Cb 0.38 -0.03 -0.06 0.00 0.00 0.00 0.00 19.45 19.74 3kbo n ALA 271 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 3kbo s THR 273 N -1.57 0.00 -1.49 0.00 -4.23 -0.60 -1.58 115.64 106.18 3kbo s THR 273 Ca 0.19 0.00 -0.10 0.00 -1.18 0.00 0.00 61.69 60.60 3kbo s THR 273 Cb -0.02 -1.00 0.01 0.00 1.34 0.00 0.00 72.50 72.84 3kbo s THR 273 CO 0.14 0.00 2.53 -0.81 -0.54 0.00 0.00 174.62 175.95 3kbo n PRO 274 N 1.55 3.60 -3.53 3.99 -0.04 -1.26 -4.21 135.00 135.10 3kbo n PRO 274 Ca -0.11 -2.68 -0.25 0.00 -0.04 0.00 0.00 63.50 60.42 3kbo n PRO 274 Cb 0.57 -2.93 0.05 0.00 -0.04 0.00 0.00 33.50 31.15 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 4.02 -2.11 -0.55 0.54 -0.00 -0.27 -4.95 115.22 111.90 3kbo n HIS 275 Ca 0.64 0.63 0.00 0.00 0.46 0.00 0.00 57.72 59.45 3kbo n HIS 275 Cb 0.29 -3.77 0.01 0.00 -0.12 0.00 0.00 29.99 26.40 3kbo n HIS 275 CO 0.00 0.00 0.00 0.44 0.46 0.00 0.00 176.34 177.24 3kbo n ILE 276 N -3.85 0.55 -0.13 3.57 -5.35 -1.26 -4.90 119.36 108.00 3kbo n ILE 276 Ca -0.10 -0.57 -0.14 0.00 -0.27 0.00 0.00 62.75 61.67 3kbo n ILE 276 Cb 0.61 0.70 -0.10 0.00 -1.74 0.00 0.00 39.64 39.11 3kbo n ILE 276 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3kbo h ALA 277 N 0.00 -0.79 -2.80 -1.28 0.00 -1.92 -3.42 119.26 109.05 3kbo h ALA 277 Ca 0.00 -0.01 -0.15 0.00 0.00 0.00 0.00 54.91 54.75 3kbo h ALA 277 Cb 0.77 1.11 -0.28 0.00 0.00 0.00 0.00 17.79 19.39 3kbo h ALA 277 CO 0.00 -1.04 -0.40 0.00 0.00 0.00 0.00 179.25 177.81 3kbo s ALA 278 N -5.61 -0.82 0.08 0.00 0.00 -1.26 -4.84 121.76 109.31 3kbo s ALA 278 Ca -0.14 1.27 0.09 0.00 0.00 0.00 0.00 51.96 53.18 3kbo s ALA 278 Cb 0.08 -0.86 -0.03 0.00 0.00 0.00 0.00 23.12 22.31 3kbo s ALA 278 CO 0.60 -0.32 -0.25 0.14 0.00 0.00 0.00 175.76 175.94 3kbo s VAL 279 N 1.54 2.04 0.57 0.00 -7.23 -1.26 -5.07 120.40 110.99 3kbo s VAL 279 Ca -0.08 -1.48 -0.19 0.00 -1.81 0.00 0.00 61.98 58.42 3kbo s VAL 279 Cb -0.10 -1.78 -0.05 0.00 0.56 0.00 0.00 36.38 35.01 3kbo s VAL 279 CO -0.11 0.21 1.18 0.28 -0.31 0.00 0.00 175.10 176.36 3kbo s THR 280 N -0.92 2.81 -0.39 5.32 -1.32 -1.26 -4.92 115.64 114.96 3kbo s THR 280 Ca 0.11 0.51 -0.20 0.00 -1.21 0.00 0.00 61.69 60.90 3kbo s THR 280 Cb -0.10 -3.21 0.01 0.00 -1.51 0.00 0.00 72.50 67.69 3kbo s THR 280 CO 0.03 -0.10 0.62 -0.13 -2.21 0.00 0.00 174.62 172.84 3kbo s ARG 281 N -3.27 3.51 0.30 7.08 1.81 -1.03 -4.99 118.95 122.36 3kbo s ARG 281 Ca 0.75 -0.15 0.03 0.00 -1.72 0.00 0.00 55.73 54.64 3kbo s ARG 281 Cb -0.28 -3.87 0.75 0.00 -0.45 0.00 0.00 34.95 31.10 3kbo s ARG 281 CO 0.31 -0.84 1.62 -1.35 -0.68 0.00 0.00 175.30 174.37 3kbo h PRO 282 N 8.63 0.13 0.00 3.54 0.11 -1.94 -0.33 132.00 142.15 3kbo h PRO 282 Ca -0.26 -0.01 -0.08 0.00 0.11 0.00 0.00 66.00 65.76 3kbo h PRO 282 Cb 1.11 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 32.17 3kbo h PRO 282 CO 0.85 0.09 -0.36 0.00 -0.21 0.00 0.00 178.00 178.36 3kbo h ALA 283 N 1.84 1.10 0.15 -0.75 0.00 -1.97 0.64 119.26 120.27 3kbo h ALA 283 Ca 0.58 -0.33 -0.30 0.00 0.00 0.00 0.00 54.91 54.86 3kbo h ALA 283 Cb 1.20 -0.06 0.02 0.00 0.00 0.00 0.00 17.79 18.96 3kbo h ALA 283 CO -0.73 0.46 -1.28 0.93 0.00 0.00 0.00 179.25 178.63 3kbo h GLU 284 N 0.00 0.50 -0.08 0.00 5.08 -1.44 -1.55 114.58 117.09 3kbo h GLU 284 Ca -0.00 -0.74 -0.00 0.00 -1.00 0.00 0.00 59.36 57.61 3kbo h GLU 284 Cb 0.80 0.26 -0.00 0.00 0.50 0.00 0.00 28.75 30.31 3kbo h GLU 284 CO 0.05 1.34 0.04 0.00 -1.00 0.00 0.00 179.01 179.43 3kbo h ALA 285 N 0.37 0.10 -0.57 3.43 0.00 -0.66 -0.84 119.26 121.09 3kbo h ALA 285 Ca -0.18 -0.07 0.01 0.00 0.00 0.00 0.00 54.91 54.66 3kbo h ALA 285 Cb 1.97 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 19.69 3kbo h ALA 285 CO 0.23 -0.33 0.36 0.82 0.00 0.00 0.00 179.25 180.34 3kbo h ILE 286 N -0.00 1.11 0.08 0.00 1.08 0.21 -0.29 117.51 119.71 3kbo h ILE 286 Ca 0.03 -0.25 0.01 0.00 -0.39 0.00 0.00 64.86 64.26 3kbo h ILE 286 Cb 0.13 0.32 -0.02 0.00 -3.07 0.00 0.00 36.82 34.18 3kbo h ILE 286 CO -0.00 0.13 -0.13 -0.78 -0.69 0.00 0.00 178.15 176.68 3kbo h ASP 287 N 0.73 -0.35 -0.21 1.72 3.58 -1.12 -0.88 116.42 119.89 3kbo h ASP 287 Ca 0.22 0.04 0.01 0.00 0.42 0.00 0.00 57.03 57.72 3kbo h ASP 287 Cb -0.04 0.13 -0.01 0.00 1.72 0.00 0.00 39.33 41.12 3kbo h ASP 287 CO -0.07 -0.19 0.11 0.22 -2.88 0.00 0.00 179.24 176.44 3kbo h TYR 288 N -0.26 0.21 -0.35 0.28 3.20 -0.89 -1.28 116.97 117.89 3kbo h TYR 288 Ca 0.02 0.01 -0.02 0.00 3.14 0.00 0.00 58.73 61.87 3kbo h TYR 288 Cb 0.27 -0.07 -0.01 0.00 1.54 0.00 0.00 36.73 38.46 3kbo h TYR 288 CO -0.15 0.13 0.12 0.82 -1.64 0.00 0.00 178.16 177.44 3kbo h ILE 289 N 0.24 1.20 -0.54 1.81 2.04 -0.90 -1.27 117.51 120.08 3kbo h ILE 289 Ca 0.08 -0.63 -0.01 0.00 1.00 0.00 0.00 64.86 65.30 3kbo h ILE 289 Cb 0.00 0.96 -0.03 0.00 -0.74 0.00 0.00 36.82 37.02 3kbo h ILE 289 CO -0.04 0.22 0.30 -1.28 0.00 0.00 0.00 178.15 177.35 3kbo h SER 290 N 0.41 0.68 -0.55 1.72 0.87 -1.16 -1.16 113.55 114.36 3kbo h SER 290 Ca 0.11 -0.09 -0.11 0.00 -1.23 0.00 0.00 61.79 60.48 3kbo h SER 290 Cb 0.22 -0.17 -0.02 0.00 -0.44 0.00 0.00 62.40 61.99 3kbo h SER 290 CO -0.01 0.57 -0.08 -0.09 -0.53 0.00 0.00 176.83 176.69 3kbo h ARG 291 N 0.73 1.04 -0.38 2.24 2.43 -1.14 -2.61 114.38 116.68 3kbo h ARG 291 Ca 0.19 -0.37 -0.15 0.00 -0.81 0.00 0.00 59.98 58.85 3kbo h ARG 291 Cb 0.04 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 29.51 3kbo h ARG 291 CO -0.03 1.06 -0.35 1.15 -1.51 0.00 0.00 179.97 180.29 3kbo h THR 292 N 0.93 1.28 -0.28 0.20 2.02 -0.98 -2.45 112.91 113.63 3kbo h THR 292 Ca 0.15 -1.51 -0.01 0.00 0.77 0.00 0.00 66.41 65.81 3kbo h THR 292 Cb 0.64 1.35 -0.01 0.00 -1.74 0.00 0.00 68.15 68.38 3kbo h THR 292 CO 0.04 0.51 0.13 0.40 0.37 0.00 0.00 175.52 176.97 3kbo h ILE 293 N 0.73 1.15 -0.53 3.11 2.04 -1.20 -1.23 117.51 121.58 3kbo h ILE 293 Ca 0.07 -0.43 0.10 0.00 1.00 0.00 0.00 64.86 65.60 3kbo h ILE 293 Cb 0.92 0.93 -0.09 0.00 -0.74 0.00 0.00 36.82 37.84 3kbo h ILE 293 CO 0.08 0.15 -0.01 0.74 0.00 0.00 0.00 178.15 179.12 3kbo h THR 294 N 0.31 0.57 -0.31 -0.27 2.02 -1.33 -0.27 112.91 113.63 3kbo h THR 294 Ca 0.09 -0.04 -0.10 0.00 0.77 0.00 0.00 66.41 67.13 3kbo h THR 294 Cb 0.12 0.45 -0.01 0.00 -1.74 0.00 0.00 68.15 66.97 3kbo h THR 294 CO -0.01 0.02 -0.24 1.56 0.37 0.00 0.00 175.52 177.22 3kbo h GLN 295 N 0.11 0.61 0.00 6.66 1.08 -1.27 -2.63 115.11 119.67 3kbo h GLN 295 Ca 0.27 -0.24 -0.06 0.00 -1.45 0.00 0.00 58.65 57.17 3kbo h GLN 295 Cb 0.41 -0.03 -0.01 0.00 -0.05 0.00 0.00 27.48 27.80 3kbo h GLN 295 CO -0.45 0.80 -0.29 -0.07 -0.95 0.00 0.00 178.83 177.87 3kbo h LEU 296 N 0.53 0.00 -0.19 1.46 3.38 0.06 0.12 115.31 120.68 3kbo h LEU 296 Ca 0.08 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.88 3kbo h LEU 296 Cb 0.70 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.46 3kbo h LEU 296 CO 0.05 0.29 -0.53 -0.33 0.09 0.00 0.00 178.44 178.01 3kbo h GLU 297 N 0.00 0.69 -0.98 1.13 4.39 -0.76 -3.20 114.58 115.85 3kbo h GLU 297 Ca -0.00 -0.49 -0.43 0.00 0.34 0.00 0.00 59.36 58.77 3kbo h GLU 297 Cb 0.58 0.08 -0.26 0.00 -0.10 0.00 0.00 28.75 29.05 3kbo h GLU 297 CO 0.04 1.11 0.55 0.36 -1.16 0.00 0.00 179.01 179.91 3kbo n LYS 298 N -4.13 2.21 -4.14 2.33 2.85 -1.05 -4.96 118.16 111.27 3kbo n LYS 298 Ca -0.06 -2.64 -0.38 0.00 -1.05 0.00 0.00 58.31 54.17 3kbo n LYS 298 Cb 0.61 -2.04 -0.03 0.00 -0.65 0.00 0.00 35.03 32.92 3kbo n LYS 298 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 3kbo n GLY 299 N -0.87 -0.52 3.72 2.58 0.00 -0.72 -4.99 105.19 104.40 3kbo n GLY 299 Ca 0.51 0.27 -0.28 0.00 0.00 0.00 0.00 46.02 46.52 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 -7.27 2.13 0.42 1.61 2.02 0.35 -5.02 118.70 112.94 3kbo s GLU 300 Ca 0.26 -2.10 -0.26 0.00 0.02 0.00 0.00 54.97 52.89 3kbo s GLU 300 Cb -0.14 -1.76 -0.09 0.00 0.10 0.00 0.00 34.13 32.24 3kbo s GLU 300 CO 0.97 -0.21 1.44 -2.14 0.02 0.00 0.00 175.26 175.33 3kbo s PRO 301 N -3.87 3.84 0.03 0.39 0.02 -1.26 -4.57 135.00 129.58 3kbo s PRO 301 Ca 0.29 2.45 0.02 0.00 0.02 0.00 0.00 61.00 63.78 3kbo s PRO 301 Cb 0.05 -2.76 -0.02 0.00 0.02 0.00 0.00 34.50 31.78 3kbo s PRO 301 CO 0.16 -0.70 -0.07 0.14 -0.33 0.00 0.00 177.00 176.19 3kbo s VAL 302 N -1.18 0.53 0.33 3.83 -7.23 -1.26 -4.93 120.40 110.49 3kbo s VAL 302 Ca 0.58 -0.92 0.08 0.00 -1.81 0.00 0.00 61.98 59.91 3kbo s VAL 302 Cb -0.44 -0.57 -0.04 0.00 0.56 0.00 0.00 36.38 35.89 3kbo s VAL 302 CO 0.58 -0.28 0.13 0.42 -0.31 0.00 0.00 175.10 175.63 3kbo s THR 303 N -1.13 3.11 0.00 5.32 -4.23 -1.26 -4.72 115.64 112.73 3kbo s THR 303 Ca -0.07 -1.71 0.00 0.00 -1.18 0.00 0.00 61.69 58.72 3kbo s THR 303 Cb -0.08 -2.97 0.00 0.00 1.34 0.00 0.00 72.50 70.78 3kbo s THR 303 CO 0.00 -0.21 0.00 0.61 -0.54 0.00 0.00 174.62 174.48 3kbo n GLY 304 N -1.12 0.62 3.78 3.99 0.00 -1.26 -4.92 105.19 106.28 3kbo n GLY 304 Ca -0.04 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.62 3kbo n GLY 304 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3kbo s GLN 305 N -0.10 3.79 -0.20 1.61 0.74 -1.26 -1.83 119.66 122.41 3kbo s GLN 305 Ca 0.00 1.65 -0.13 0.00 0.05 0.00 0.00 55.36 56.92 3kbo s GLN 305 Cb 0.00 -2.34 -0.04 0.00 1.10 0.00 0.00 33.01 31.72 3kbo s GLN 305 CO 0.00 -0.50 0.29 0.08 -0.55 0.00 0.00 175.29 174.61 3kbo s VAL 306 N -1.65 5.28 -0.68 1.34 1.01 0.23 -4.89 120.40 121.04 3kbo s VAL 306 Ca 0.64 0.48 -0.22 0.00 0.00 0.00 0.00 61.98 62.88 3kbo s VAL 306 Cb -0.25 -3.62 0.08 0.00 0.00 0.00 0.00 36.38 32.58 3kbo s VAL 306 CO 0.30 0.32 0.98 -0.62 0.00 0.00 0.00 175.10 176.08 3kbo s ASP 307 N 0.88 6.21 0.00 3.32 -1.08 -1.22 -4.54 116.67 120.23 3kbo s ASP 307 Ca 0.14 -1.09 0.31 0.00 -0.52 0.00 0.00 52.55 51.40 3kbo s ASP 307 Cb -0.14 -2.42 1.67 0.00 -1.46 0.00 0.00 42.92 40.58 3kbo s ASP 307 CO 0.05 -1.41 2.11 -2.11 0.52 0.00 0.00 175.17 174.33 3kbo n ARG 308 N 7.61 0.89 -0.04 4.34 1.85 -1.26 -1.76 116.66 128.29 3kbo n ARG 308 Ca -0.01 -0.11 -0.13 0.00 -1.00 0.00 0.00 57.85 56.59 3kbo n ARG 308 Cb 0.46 -1.50 -0.09 0.00 -1.05 0.00 0.00 32.46 30.28 3kbo n ARG 308 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 3kbo h ALA 309 N 3.86 0.12 0.00 2.89 0.00 -1.94 -3.12 119.26 121.07 3kbo h ALA 309 Ca 0.00 -0.33 -0.09 0.00 0.00 0.00 0.00 54.91 54.50 3kbo h ALA 309 Cb 0.15 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 3kbo h ALA 309 CO 0.00 -0.00 -0.41 0.07 0.00 0.00 0.00 179.25 178.90 3kbo h ARG 310 N -0.23 0.00 0.00 0.00 0.11 -1.94 -3.48 114.38 108.84 3kbo h ARG 310 Ca 0.01 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.09 3kbo h ARG 310 Cb 0.68 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.76 3kbo h ARG 310 CO 0.03 0.41 0.00 0.41 0.10 0.00 0.00 179.97 180.92 3kbo n GLY 311 N 0.74 0.83 0.00 0.08 0.00 -0.72 -5.03 105.19 101.09 3kbo n GLY 311 Ca 0.01 -0.15 0.00 0.00 0.00 0.00 0.00 46.02 45.88 3kbo n GLY 311 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90