#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ksk s HIS 3 N 0.00 3.23 0.46 1.43 5.65 -1.26 -5.00 115.29 119.80 3ksk s HIS 3 Ca 0.00 -3.19 0.13 0.00 0.25 0.00 0.00 55.06 52.25 3ksk s HIS 3 Cb 0.00 -2.68 1.04 0.00 -1.18 0.00 0.00 32.58 29.76 3ksk s HIS 3 CO 0.00 -0.66 2.05 -1.00 -0.65 0.00 0.00 174.74 174.48 3ksk h PRO 4 N 6.03 0.14 -0.07 2.88 0.13 -2.03 -1.52 132.00 137.56 3ksk h PRO 4 Ca 0.02 -0.02 -0.16 0.00 -0.87 0.00 0.00 66.00 64.98 3ksk h PRO 4 Cb 0.84 -0.03 -0.01 0.00 0.13 0.00 0.00 31.00 31.93 3ksk h PRO 4 CO 0.68 0.18 -0.65 -0.44 -0.23 0.00 0.00 178.00 177.54 3ksk h ASP 5 N 0.14 0.32 -0.11 1.44 3.45 -1.99 -1.82 116.42 117.84 3ksk h ASP 5 Ca 0.03 -0.19 -0.18 0.00 0.43 0.00 0.00 57.03 57.12 3ksk h ASP 5 Cb 0.14 -0.09 0.01 0.00 -0.56 0.00 0.00 39.33 38.83 3ksk h ASP 5 CO 0.00 0.88 -0.66 0.25 -1.57 0.00 0.00 179.24 178.15 3ksk h LEU 6 N 0.19 0.76 -1.15 1.55 6.46 -1.79 -2.59 115.31 118.74 3ksk h LEU 6 Ca -0.01 -0.65 0.16 0.00 -0.12 0.00 0.00 57.88 57.25 3ksk h LEU 6 Cb 1.19 -0.23 -0.08 0.00 -0.73 0.00 0.00 40.66 40.81 3ksk h LEU 6 CO 0.10 1.29 0.61 0.78 -0.62 0.00 0.00 178.44 180.61 3ksk h ASN 7 N 0.28 0.75 -0.26 1.25 2.35 -1.24 -2.09 115.58 116.62 3ksk h ASN 7 Ca -0.05 0.06 -0.06 0.00 -0.55 0.00 0.00 56.30 55.70 3ksk h ASN 7 Cb 1.30 -0.08 -0.01 0.00 0.05 0.00 0.00 38.32 39.58 3ksk h ASN 7 CO 0.13 0.34 -0.05 0.50 -1.65 0.00 0.00 177.43 176.71 3ksk h LYS 8 N 0.77 0.50 -0.28 0.81 1.63 -1.19 -1.24 116.57 117.58 3ksk h LYS 8 Ca 0.50 -0.19 0.05 0.00 -0.85 0.00 0.00 60.65 60.17 3ksk h LYS 8 Cb 0.76 -0.03 -0.05 0.00 -0.60 0.00 0.00 32.23 32.30 3ksk h LYS 8 CO -0.27 0.71 -0.04 1.25 -3.45 0.00 0.00 179.45 177.65 3ksk h LEU 9 N 0.26 -0.19 -1.16 5.20 6.46 -1.06 -0.61 115.31 124.21 3ksk h LEU 9 Ca 0.07 0.08 -0.03 0.00 -0.12 0.00 0.00 57.88 57.88 3ksk h LEU 9 Cb 0.51 0.15 -0.03 0.00 -0.73 0.00 0.00 40.66 40.56 3ksk h LEU 9 CO 0.02 -0.06 0.27 -0.07 -0.62 0.00 0.00 178.44 177.98 3ksk h LEU 10 N 0.04 0.78 -0.54 2.25 3.38 -1.30 0.25 115.31 120.17 3ksk h LEU 10 Ca 0.14 -0.09 -0.07 0.00 0.09 0.00 0.00 57.88 57.95 3ksk h LEU 10 Cb 0.20 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 3ksk h LEU 10 CO -0.26 0.68 -0.34 1.05 0.09 0.00 0.00 178.44 179.65 3ksk h GLU 11 N 0.86 0.00 0.00 1.13 4.11 -0.06 -3.19 114.58 117.42 3ksk h GLU 11 Ca 0.21 0.00 -0.10 0.00 0.07 0.00 0.00 59.36 59.54 3ksk h GLU 11 Cb 0.12 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.35 3ksk h GLU 11 CO -0.02 0.34 -1.10 -0.07 0.07 0.00 0.00 179.01 178.23 3ksk h LEU 12 N 0.00 0.00 -0.47 3.06 4.07 -0.35 -3.42 115.31 118.20 3ksk h LEU 12 Ca -0.00 0.00 0.10 0.00 0.08 0.00 0.00 57.88 58.05 3ksk h LEU 12 Cb 1.05 0.00 -0.10 0.00 1.08 0.00 0.00 40.66 42.70 3ksk h LEU 12 CO 0.04 0.35 -0.22 -0.25 -1.08 0.00 0.00 178.44 177.28 3ksk h TRP 13 N 0.00 -0.55 -0.89 1.13 2.91 -0.53 -2.05 115.95 115.98 3ksk h TRP 13 Ca -0.08 0.05 0.20 0.00 1.13 0.00 0.00 58.89 60.19 3ksk h TRP 13 Cb 1.34 0.31 -0.07 0.00 -0.51 0.00 0.00 29.16 30.23 3ksk h TRP 13 CO 0.00 -0.30 0.59 -1.35 -1.03 0.00 0.00 178.44 176.35 3ksk h PRO 14 N -0.12 0.40 0.00 2.65 0.11 -1.81 0.26 132.00 133.49 3ksk h PRO 14 Ca 0.22 -0.02 -0.15 0.00 0.11 0.00 0.00 66.00 66.16 3ksk h PRO 14 Cb 0.46 -0.09 -0.02 0.00 0.11 0.00 0.00 31.00 31.46 3ksk h PRO 14 CO -0.54 0.27 -0.72 0.45 -0.21 0.00 0.00 178.00 177.24 3ksk h HIS 15 N 0.41 0.00 -0.37 0.65 3.86 -1.70 0.07 115.15 118.08 3ksk h HIS 15 Ca 0.46 0.00 -0.05 0.00 -1.16 0.00 0.00 60.37 59.62 3ksk h HIS 15 Cb 1.13 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.59 3ksk h HIS 15 CO -0.00 0.72 0.01 0.82 0.86 0.00 0.00 177.93 180.34 3ksk h ILE 16 N 0.00 1.25 -0.33 2.45 1.08 -0.97 -0.96 117.51 120.03 3ksk h ILE 16 Ca -0.01 -0.95 -0.00 0.00 -0.39 0.00 0.00 64.86 63.51 3ksk h ILE 16 Cb 1.53 1.16 -0.02 0.00 -3.07 0.00 0.00 36.82 36.42 3ksk h ILE 16 CO 0.09 0.32 0.19 -0.61 -0.69 0.00 0.00 178.15 177.46 3ksk h GLN 17 N 0.46 0.45 -0.39 2.37 5.75 -0.93 0.17 115.11 123.00 3ksk h GLN 17 Ca 0.11 -0.04 0.04 0.00 -0.15 0.00 0.00 58.65 58.60 3ksk h GLN 17 Cb 0.44 -0.09 -0.04 0.00 1.07 0.00 0.00 27.48 28.86 3ksk h GLN 17 CO 0.02 0.36 0.17 0.93 -2.65 0.00 0.00 178.83 177.65 3ksk h GLU 18 N 0.42 0.34 -0.74 1.69 5.08 -0.81 -0.74 114.58 119.83 3ksk h GLU 18 Ca 0.12 -0.02 0.08 0.00 -1.00 0.00 0.00 59.36 58.54 3ksk h GLU 18 Cb 0.02 -0.08 -0.06 0.00 0.50 0.00 0.00 28.75 29.13 3ksk h GLU 18 CO -0.02 0.23 0.41 -0.92 -1.00 0.00 0.00 179.01 177.71 3ksk h TYR 19 N 0.35 0.75 0.01 4.33 5.03 -0.79 -0.84 116.97 125.81 3ksk h TYR 19 Ca 0.17 0.03 0.01 0.00 2.58 0.00 0.00 58.73 61.52 3ksk h TYR 19 Cb 0.11 -0.22 -0.02 0.00 1.55 0.00 0.00 36.73 38.15 3ksk h TYR 19 CO -0.12 0.32 -0.08 0.37 -1.32 0.00 0.00 178.16 177.33 3ksk h GLN 20 N 0.72 -0.14 -0.65 1.82 5.75 -0.16 -0.69 115.11 121.76 3ksk h GLN 20 Ca 0.35 0.01 0.13 0.00 -0.15 0.00 0.00 58.65 58.99 3ksk h GLN 20 Cb 0.28 0.03 -0.12 0.00 1.07 0.00 0.00 27.48 28.75 3ksk h GLN 20 CO -0.22 -0.09 -0.08 -0.44 -2.65 0.00 0.00 178.83 175.35 3ksk h ASP 21 N -0.15 -0.44 -0.79 -0.69 3.45 -0.85 -0.34 116.42 116.61 3ksk h ASP 21 Ca 0.03 0.18 -0.04 0.00 0.43 0.00 0.00 57.03 57.63 3ksk h ASP 21 Cb 0.18 0.34 -0.04 0.00 -0.56 0.00 0.00 39.33 39.26 3ksk h ASP 21 CO -0.08 -0.17 0.34 0.25 -1.57 0.00 0.00 179.24 178.01 3ksk h LEU 22 N 0.05 1.08 -0.57 1.55 5.85 -0.84 -1.91 115.31 120.51 3ksk h LEU 22 Ca 0.33 -0.15 -0.05 0.00 0.84 0.00 0.00 57.88 58.84 3ksk h LEU 22 Cb 0.53 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 41.25 3ksk h LEU 22 CO -0.61 0.94 0.16 0.00 -0.34 0.00 0.00 178.44 178.59 3ksk h ALA 23 N 1.21 0.75 -0.68 1.25 0.00 -0.47 -2.84 119.26 118.49 3ksk h ALA 23 Ca 0.27 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.97 3ksk h ALA 23 Cb 0.18 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 3ksk h ALA 23 CO -0.03 0.44 0.43 -0.07 0.00 0.00 0.00 179.25 180.02 3ksk h LEU 24 N 0.81 0.80 -1.69 0.00 3.38 -0.80 -1.09 115.31 116.72 3ksk h LEU 24 Ca 0.18 -0.04 0.07 0.00 0.09 0.00 0.00 57.88 58.18 3ksk h LEU 24 Cb 0.31 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.84 3ksk h LEU 24 CO -0.00 0.60 0.33 0.50 0.09 0.00 0.00 178.44 179.95 3ksk h LYS 25 N 0.92 0.37 -0.62 1.13 3.64 -1.32 -1.89 116.57 118.79 3ksk h LYS 25 Ca 0.25 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.60 3ksk h LYS 25 Cb -0.07 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 31.66 3ksk h LYS 25 CO -0.05 0.24 0.00 0.72 -2.27 0.00 0.00 179.45 178.09 3ksk n HIS 26 N -4.47 1.81 -0.79 1.91 8.25 -0.79 -4.97 115.22 116.17 3ksk n HIS 26 Ca 0.07 -0.66 0.00 0.00 -0.26 0.00 0.00 57.72 56.87 3ksk n HIS 26 Cb 0.28 -0.40 0.00 0.00 1.12 0.00 0.00 29.99 31.00 3ksk n HIS 26 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3ksk n GLY 27 N 0.84 0.57 3.29 -1.41 0.00 -0.71 -4.63 105.19 103.13 3ksk n GLY 27 Ca 0.26 -0.36 -0.36 0.00 0.00 0.00 0.00 46.02 45.57 3ksk n GLY 27 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3ksk s ILE 28 N -2.00 3.49 0.20 -0.61 1.01 -0.48 -4.98 121.20 117.83 3ksk s ILE 28 Ca 0.00 -0.73 0.01 0.00 0.00 0.00 0.00 60.65 59.93 3ksk s ILE 28 Cb 0.00 -2.74 -0.08 0.00 0.01 0.00 0.00 42.46 39.66 3ksk s ILE 28 CO 0.00 0.21 1.49 0.78 0.00 0.00 0.00 174.94 177.42 3ksk h ASN 29 N 8.13 0.38 -3.00 3.58 2.35 -1.91 -3.05 115.58 122.07 3ksk h ASN 29 Ca -0.34 -0.24 -0.36 0.00 -0.55 0.00 0.00 56.30 54.81 3ksk h ASN 29 Cb 1.13 -0.11 -0.38 0.00 0.05 0.00 0.00 38.32 39.01 3ksk h ASN 29 CO 0.59 0.94 -0.68 -0.62 -1.65 0.00 0.00 177.43 176.01 3ksk s ASP 30 N -6.93 1.38 0.50 5.81 -1.08 -1.26 -4.91 116.67 110.17 3ksk s ASP 30 Ca -0.05 -0.08 0.19 0.00 -0.52 0.00 0.00 52.55 52.10 3ksk s ASP 30 Cb 0.11 0.09 1.26 0.00 -1.46 0.00 0.00 42.92 42.92 3ksk s ASP 30 CO 0.82 -0.29 2.08 0.16 0.52 0.00 0.00 175.17 178.46 3ksk h ILE 31 N 6.38 0.91 -0.40 4.11 3.07 -1.87 -3.07 117.51 126.64 3ksk h ILE 31 Ca -0.14 -0.40 -0.02 0.00 1.55 0.00 0.00 64.86 65.86 3ksk h ILE 31 Cb 1.13 1.22 -0.01 0.00 -0.27 0.00 0.00 36.82 38.90 3ksk h ILE 31 CO 0.21 0.11 0.02 0.49 -1.05 0.00 0.00 178.15 177.93 3ksk n PHE 32 N -4.16 1.44 -3.75 0.16 0.99 -1.26 -1.69 117.46 109.19 3ksk n PHE 32 Ca -0.03 -0.53 -0.13 0.00 -0.00 0.00 0.00 57.45 56.76 3ksk n PHE 32 Cb 0.19 -0.40 -0.08 0.00 -1.00 0.00 0.00 39.48 38.19 3ksk n PHE 32 CO 0.00 0.00 0.00 -1.14 -0.00 0.00 0.00 176.76 175.62 3ksk s GLN 33 N -2.19 0.70 -1.62 -1.08 0.74 -1.16 -1.84 119.66 113.22 3ksk s GLN 33 Ca 0.37 -0.21 -0.15 0.00 0.05 0.00 0.00 55.36 55.42 3ksk s GLN 33 Cb 0.28 0.31 0.12 0.00 1.10 0.00 0.00 33.01 34.82 3ksk s GLN 33 CO 0.11 -0.20 0.82 -0.25 -0.55 0.00 0.00 175.29 175.22 3ksk n ASP 34 N 1.18 -3.53 -2.01 6.67 10.43 -1.25 -1.06 116.55 126.98 3ksk n ASP 34 Ca -0.21 -0.93 -0.21 0.00 2.57 0.00 0.00 54.79 56.01 3ksk n ASP 34 Cb 0.56 -3.18 -0.05 0.00 1.84 0.00 0.00 41.12 40.30 3ksk n ASP 34 CO 0.00 0.00 0.00 0.59 -1.07 0.00 0.00 177.20 176.72 3ksk n ASN 35 N -2.75 -5.68 -0.22 -2.24 3.02 -0.70 -4.90 115.26 101.79 3ksk n ASN 35 Ca 0.03 0.24 -0.02 0.00 -0.03 0.00 0.00 54.58 54.80 3ksk n ASN 35 Cb 0.52 -4.86 0.05 0.00 -0.61 0.00 0.00 39.78 34.88 3ksk n ASN 35 CO 0.00 0.00 0.00 1.23 -2.62 0.00 0.00 177.26 175.87 3ksk h GLY 36 N 0.00 0.28 2.00 7.41 0.00 -1.15 0.33 103.07 111.94 3ksk h GLY 36 Ca -0.46 0.30 -0.01 0.00 0.00 0.00 0.00 47.33 47.16 3ksk h GLY 36 CO 0.60 -0.24 -0.06 -1.33 0.00 0.00 0.00 176.54 175.51 3ksk h GLY 37 N -0.06 0.00 0.00 4.60 0.00 -1.57 -2.85 103.07 103.19 3ksk h GLY 37 Ca 0.30 0.00 -0.07 0.00 0.00 0.00 0.00 47.33 47.56 3ksk h GLY 37 CO -0.70 0.00 -0.39 0.50 0.00 0.00 0.00 176.54 175.96 3ksk h LYS 38 N 0.00 0.00 -0.77 4.80 1.57 -1.51 -3.36 116.57 117.30 3ksk h LYS 38 Ca -0.00 0.00 0.17 0.00 -1.87 0.00 0.00 60.65 58.95 3ksk h LYS 38 Cb 0.54 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.80 3ksk h LYS 38 CO 0.01 0.88 0.52 1.25 -0.57 0.00 0.00 179.45 181.54 3ksk h LEU 39 N -1.00 0.34 -0.25 2.94 5.85 -0.38 -1.98 115.31 120.84 3ksk h LEU 39 Ca -0.10 0.02 -0.00 0.00 0.84 0.00 0.00 57.88 58.64 3ksk h LEU 39 Cb 0.99 -0.04 -0.01 0.00 0.37 0.00 0.00 40.66 41.96 3ksk h LEU 39 CO -0.06 0.16 0.15 0.25 -0.34 0.00 0.00 178.44 178.60 3ksk h LEU 40 N 0.35 0.30 -0.09 2.25 5.85 -1.65 -0.73 115.31 121.58 3ksk h LEU 40 Ca 0.38 -0.05 0.03 0.00 0.84 0.00 0.00 57.88 59.08 3ksk h LEU 40 Cb 0.98 -0.08 -0.06 0.00 0.37 0.00 0.00 40.66 41.88 3ksk h LEU 40 CO -0.11 0.26 -0.52 1.56 -0.34 0.00 0.00 178.44 179.29 3ksk h GLN 41 N 0.31 -0.57 -0.72 1.25 4.20 -1.50 -1.34 115.11 116.73 3ksk h GLN 41 Ca 0.09 0.04 0.16 0.00 0.06 0.00 0.00 58.65 58.99 3ksk h GLN 41 Cb 0.02 0.13 -0.11 0.00 0.30 0.00 0.00 27.48 27.82 3ksk h GLN 41 CO -0.02 -0.38 0.16 0.28 -0.67 0.00 0.00 178.83 178.20 3ksk h VAL 42 N -0.60 0.52 -0.47 -0.54 2.07 -1.41 0.08 116.25 115.90 3ksk h VAL 42 Ca 0.04 -0.09 -0.08 0.00 0.82 0.00 0.00 66.70 67.39 3ksk h VAL 42 Cb 0.69 0.24 -0.02 0.00 -1.52 0.00 0.00 31.29 30.67 3ksk h VAL 42 CO -0.41 0.05 -0.03 -0.07 0.02 0.00 0.00 177.57 177.13 3ksk h LEU 43 N 0.26 0.77 -0.14 2.57 3.38 -0.59 -1.39 115.31 120.17 3ksk h LEU 43 Ca 0.40 -0.20 -0.23 0.00 0.09 0.00 0.00 57.88 57.94 3ksk h LEU 43 Cb 0.68 -0.21 0.01 0.00 0.09 0.00 0.00 40.66 41.24 3ksk h LEU 43 CO -0.51 0.85 -0.93 -0.07 0.09 0.00 0.00 178.44 177.88 3ksk h LEU 44 N 0.74 0.70 0.01 1.67 3.38 -0.11 -1.54 115.31 120.16 3ksk h LEU 44 Ca 0.14 -0.54 -0.00 0.00 0.09 0.00 0.00 57.88 57.57 3ksk h LEU 44 Cb 0.49 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.02 3ksk h LEU 44 CO 0.02 1.33 -0.00 0.40 0.09 0.00 0.00 178.44 180.28 3ksk h ILE 45 N 0.33 1.25 0.00 1.22 2.04 -0.85 0.28 117.51 121.78 3ksk h ILE 45 Ca -0.09 -0.76 -0.05 0.00 1.00 0.00 0.00 64.86 64.96 3ksk h ILE 45 Cb 1.56 1.76 -0.01 0.00 -0.74 0.00 0.00 36.82 39.40 3ksk h ILE 45 CO 0.17 0.20 -0.26 0.71 0.00 0.00 0.00 178.15 178.97 3ksk h THR 46 N -0.33 0.55 0.00 -0.27 1.35 -1.34 -3.17 112.91 109.70 3ksk h THR 46 Ca -0.00 -1.33 0.00 0.00 -0.55 0.00 0.00 66.41 64.53 3ksk h THR 46 Cb 0.33 1.92 0.00 0.00 -1.73 0.00 0.00 68.15 68.67 3ksk h THR 46 CO 0.00 0.25 0.00 0.61 -0.25 0.00 0.00 175.52 176.13 3ksk n GLY 47 N 0.47 0.46 3.85 5.82 0.00 -0.63 -4.64 105.19 110.52 3ksk n GLY 47 Ca 0.01 -0.97 -0.34 0.00 0.00 0.00 0.00 46.02 44.73 3ksk n GLY 47 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3ksk s LEU 48 N 0.00 4.23 -0.23 0.99 1.43 -0.91 -4.58 118.68 119.60 3ksk s LEU 48 Ca 0.00 1.07 -0.08 0.00 -1.03 0.00 0.00 54.13 54.09 3ksk s LEU 48 Cb 0.00 -3.57 -0.04 0.00 0.03 0.00 0.00 46.19 42.61 3ksk s LEU 48 CO 0.00 -0.01 0.10 -0.89 0.23 0.00 0.00 176.35 175.78 3ksk s THR 49 N -1.68 4.80 0.33 5.49 2.01 -0.06 -4.77 115.64 121.76 3ksk s THR 49 Ca 0.44 -0.01 -0.27 0.00 0.31 0.00 0.00 61.69 62.16 3ksk s THR 49 Cb -0.13 -3.23 -0.09 0.00 0.01 0.00 0.00 72.50 69.06 3ksk s THR 49 CO 0.20 0.36 1.02 0.54 -0.69 0.00 0.00 174.62 176.05 3ksk s VAL 50 N 1.14 3.84 -0.17 3.82 0.11 -1.26 -0.44 120.40 127.44 3ksk s VAL 50 Ca 0.05 1.61 -0.08 0.00 -2.93 0.00 0.00 61.98 60.63 3ksk s VAL 50 Cb -0.14 -3.93 -0.04 0.00 -1.53 0.00 0.00 36.38 30.73 3ksk s VAL 50 CO 0.04 0.20 0.09 -0.76 -3.33 0.00 0.00 175.10 171.35 3ksk s LEU 51 N -1.97 4.01 0.59 2.54 1.02 0.11 -4.87 118.68 120.11 3ksk s LEU 51 Ca 0.50 0.19 0.29 0.00 0.02 0.00 0.00 54.13 55.13 3ksk s LEU 51 Cb -0.24 -2.01 1.73 0.00 0.02 0.00 0.00 46.19 45.68 3ksk s LEU 51 CO 0.31 0.22 2.15 1.55 0.02 0.00 0.00 176.35 180.60 3ksk h PRO 52 N 6.37 0.00 0.00 1.29 0.13 -1.94 -3.45 132.00 134.41 3ksk h PRO 52 Ca -0.41 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.72 3ksk h PRO 52 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 3ksk h PRO 52 CO 0.70 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 178.88 3ksk n GLY 56 N -1.37 0.50 3.94 1.56 0.00 -1.26 -5.01 105.19 103.55 3ksk n GLY 56 Ca -0.00 0.63 -0.24 0.00 0.00 0.00 0.00 46.02 46.40 3ksk n GLY 56 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3ksk s ASN 57 N -3.14 5.88 0.18 1.61 0.02 -1.26 -5.06 114.94 113.17 3ksk s ASN 57 Ca 0.00 0.47 0.17 0.00 -1.02 0.00 0.00 52.86 52.48 3ksk s ASN 57 Cb 0.00 -1.71 -0.02 0.00 0.02 0.00 0.00 41.25 39.54 3ksk s ASN 57 CO 0.00 -0.72 1.13 0.44 0.02 0.00 0.00 177.10 177.97 3ksk h ASP 58 N 0.29 0.00 -5.04 -1.22 3.45 -1.15 -3.41 116.42 109.35 3ksk h ASP 58 Ca -0.46 0.00 0.01 0.00 0.43 0.00 0.00 57.03 57.01 3ksk h ASP 58 Cb 1.24 0.00 -0.09 0.00 -0.56 0.00 0.00 39.33 39.93 3ksk h ASP 58 CO 0.59 0.47 0.14 0.00 -1.57 0.00 0.00 179.24 178.87 3ksk s ALA 59 N -2.99 -1.18 -0.05 3.45 0.00 -1.08 0.05 121.76 119.96 3ksk s ALA 59 Ca 0.01 -0.10 -0.04 0.00 0.00 0.00 0.00 51.96 51.82 3ksk s ALA 59 Cb 0.08 0.87 0.01 0.00 0.00 0.00 0.00 23.12 24.09 3ksk s ALA 59 CO 0.78 -0.89 0.13 0.54 0.00 0.00 0.00 175.76 176.32 3ksk s VAL 60 N -3.87 -0.00 0.77 0.00 0.11 0.42 -0.90 120.40 116.94 3ksk s VAL 60 Ca 0.08 0.02 -0.04 0.00 -2.93 0.00 0.00 61.98 59.11 3ksk s VAL 60 Cb -0.03 -0.19 0.15 0.00 -1.53 0.00 0.00 36.38 34.78 3ksk s VAL 60 CO -0.01 0.01 1.06 1.51 -3.33 0.00 0.00 175.10 174.34 3ksk s ASP 61 N 0.17 4.07 0.00 3.54 1.47 -0.36 -0.88 116.67 124.68 3ksk s ASP 61 Ca -0.01 -0.28 0.21 0.00 1.18 0.00 0.00 52.55 53.65 3ksk s ASP 61 Cb -0.02 -0.01 1.01 0.00 -0.34 0.00 0.00 42.92 43.56 3ksk s ASP 61 CO -0.00 -2.06 1.67 0.59 0.68 0.00 0.00 175.17 176.04 3ksk n ASN 62 N -3.03 0.00 -0.60 2.11 3.02 -1.26 -1.70 115.26 113.80 3ksk n ASN 62 Ca 0.15 0.16 0.13 0.00 -0.03 0.00 0.00 54.58 54.99 3ksk n ASN 62 Cb 0.60 -0.36 0.24 0.00 -0.61 0.00 0.00 39.78 39.66 3ksk n ASN 62 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3ksk n ALA 63 N -1.36 2.85 -0.04 5.41 0.00 -1.26 -4.97 120.51 121.14 3ksk n ALA 63 Ca 0.08 -0.56 0.00 0.00 0.00 0.00 0.00 53.44 52.96 3ksk n ALA 63 Cb 0.19 -0.96 0.00 0.00 0.00 0.00 0.00 19.45 18.68 3ksk n ALA 63 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3ksk n GLY 64 N 1.32 0.63 3.76 0.00 0.00 -0.69 -5.06 105.19 105.15 3ksk n GLY 64 Ca 0.14 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.75 3ksk n GLY 64 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3ksk s GLN 65 N -0.79 4.45 0.25 1.61 2.00 -1.26 -4.79 119.66 121.13 3ksk s GLN 65 Ca 0.00 2.06 0.07 0.00 -2.00 0.00 0.00 55.36 55.49 3ksk s GLN 65 Cb 0.00 -3.13 -0.04 0.00 0.80 0.00 0.00 33.01 30.65 3ksk s GLN 65 CO 0.00 -0.06 0.16 -1.21 -0.50 0.00 0.00 175.29 173.68 3ksk s GLU 66 N -1.47 2.83 0.04 1.67 2.02 -1.26 -1.22 118.70 121.31 3ksk s GLU 66 Ca 0.48 -1.10 -0.03 0.00 0.02 0.00 0.00 54.97 54.34 3ksk s GLU 66 Cb -0.37 -2.51 -0.02 0.00 0.10 0.00 0.00 34.13 31.34 3ksk s GLU 66 CO 0.47 0.40 0.04 0.71 0.02 0.00 0.00 175.26 176.90 3ksk s TYR 67 N -2.15 0.29 0.12 1.61 2.02 -0.07 -4.18 117.35 114.99 3ksk s TYR 67 Ca 0.33 -0.65 -0.12 0.00 -0.37 0.00 0.00 57.07 56.25 3ksk s TYR 67 Cb -0.08 -0.21 -0.06 0.00 -0.40 0.00 0.00 41.96 41.21 3ksk s TYR 67 CO 0.24 -0.34 0.49 -2.00 -1.57 0.00 0.00 175.55 172.38 3ksk s GLU 68 N -2.73 3.89 -0.05 -0.62 2.56 -0.85 -0.57 118.70 120.33 3ksk s GLU 68 Ca -0.04 0.36 0.02 0.00 0.00 0.00 0.00 54.97 55.31 3ksk s GLU 68 Cb -0.01 -2.94 0.01 0.00 2.00 0.00 0.00 34.13 33.20 3ksk s GLU 68 CO -0.05 0.50 -0.08 -1.17 -0.56 0.00 0.00 175.26 173.89 3ksk s LEU 69 N -1.98 1.57 0.07 2.70 0.20 -1.26 -0.32 118.68 119.66 3ksk s LEU 69 Ca 0.36 -0.20 0.01 0.00 0.69 0.00 0.00 54.13 54.99 3ksk s LEU 69 Cb -0.14 -0.61 -0.03 0.00 -0.43 0.00 0.00 46.19 44.97 3ksk s LEU 69 CO 0.19 0.01 -0.06 -0.54 -0.29 0.00 0.00 176.35 175.66 3ksk s LYS 70 N 0.63 0.66 0.05 1.98 -0.14 0.29 -4.95 119.74 118.26 3ksk s LYS 70 Ca -0.11 -1.07 -0.16 0.00 -1.36 0.00 0.00 55.97 53.27 3ksk s LYS 70 Cb -0.13 -0.16 0.03 0.00 -1.68 0.00 0.00 37.83 35.89 3ksk s LYS 70 CO 0.02 -0.01 0.38 -1.54 -0.76 0.00 0.00 175.35 173.43 3ksk s SER 71 N -2.42 -0.23 0.05 2.83 1.04 -1.26 -0.82 113.70 112.89 3ksk s SER 71 Ca 0.02 -0.10 -0.02 0.00 0.48 0.00 0.00 55.95 56.33 3ksk s SER 71 Cb -0.01 0.41 -0.03 0.00 0.10 0.00 0.00 66.02 66.49 3ksk s SER 71 CO -0.03 -0.67 -0.00 0.27 0.98 0.00 0.00 173.24 173.78 3ksk s ILE 72 N -2.68 0.19 -0.41 -1.02 -4.36 -0.56 -4.81 121.20 107.54 3ksk s ILE 72 Ca -0.04 -1.55 -0.12 0.00 -0.26 0.00 0.00 60.65 58.68 3ksk s ILE 72 Cb -0.00 -1.25 0.05 0.00 1.25 0.00 0.00 42.46 42.51 3ksk s ILE 72 CO -0.04 -0.86 0.27 0.21 0.24 0.00 0.00 174.94 174.77 3ksk s ASN 73 N -2.61 5.84 0.66 4.36 3.04 -1.26 -0.73 114.94 124.24 3ksk s ASN 73 Ca 0.02 -1.20 0.29 0.00 0.04 0.00 0.00 52.86 52.00 3ksk s ASN 73 Cb 0.04 -2.06 1.56 0.00 -1.54 0.00 0.00 41.25 39.25 3ksk s ASN 73 CO -0.08 -0.49 1.89 -0.29 -3.04 0.00 0.00 177.10 175.08 3ksk h ILE 74 N 5.88 0.03 0.00 -5.21 6.09 -1.31 0.12 117.51 123.12 3ksk h ILE 74 Ca -0.25 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.24 3ksk h ILE 74 Cb 1.10 0.64 0.00 0.00 0.47 0.00 0.00 36.82 39.03 3ksk h ILE 74 CO 0.75 0.00 0.00 0.44 -3.07 0.00 0.00 178.15 176.27 3ksk h ASP 75 N 0.00 0.00 0.00 2.19 3.32 -1.93 -3.35 116.42 116.65 3ksk h ASP 75 Ca 0.02 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.07 3ksk h ASP 75 Cb 0.75 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.30 3ksk h ASP 75 CO -0.00 0.00 -0.89 0.18 -1.72 0.00 0.00 179.24 176.81 3ksk n LEU 76 N -2.33 0.15 -3.63 1.55 4.77 0.34 -5.11 117.00 112.75 3ksk n LEU 76 Ca 0.04 0.00 -0.10 0.00 -0.03 0.00 0.00 56.01 55.92 3ksk n LEU 76 Cb 0.34 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.40 3ksk n LEU 76 CO 0.26 0.03 0.39 0.28 -1.33 0.00 0.00 177.39 177.01 3ksk s THR 77 N -1.89 0.01 -0.01 -5.08 -1.32 -0.78 -5.06 115.64 101.50 3ksk s THR 77 Ca 0.00 -0.49 0.01 0.00 -1.21 0.00 0.00 61.69 60.00 3ksk s THR 77 Cb 0.00 -1.44 0.02 0.00 -1.51 0.00 0.00 72.50 69.56 3ksk s THR 77 CO 0.00 -0.03 0.94 0.29 -2.21 0.00 0.00 174.62 173.61 3ksk n LYS 78 N -0.39 2.42 -4.95 7.08 4.76 -1.26 -4.12 118.16 121.70 3ksk n LYS 78 Ca -0.11 -1.42 -0.27 0.00 -2.87 0.00 0.00 58.31 53.64 3ksk n LYS 78 Cb 0.63 -0.95 -0.16 0.00 -1.84 0.00 0.00 35.03 32.70 3ksk n LYS 78 CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 3ksk s GLY 79 N -0.97 1.00 -0.08 0.72 0.00 -1.26 -0.40 107.32 106.33 3ksk s GLY 79 Ca 0.02 -0.80 -0.24 0.00 0.00 0.00 0.00 44.72 43.70 3ksk s GLY 79 CO 0.00 -0.51 0.72 -1.36 0.00 0.00 0.00 173.10 171.95 3ksk s PHE 80 N -0.14 3.56 1.03 1.90 0.08 0.52 -4.88 117.98 120.05 3ksk s PHE 80 Ca -0.00 1.25 -0.17 0.00 0.12 0.00 0.00 56.93 58.13 3ksk s PHE 80 Cb -0.11 -2.83 0.23 0.00 -0.57 0.00 0.00 43.02 39.74 3ksk s PHE 80 CO 0.02 0.05 1.26 -1.54 -0.10 0.00 0.00 175.22 174.91 3ksk s SER 81 N 0.84 2.48 0.00 1.36 1.04 -1.26 -1.63 113.70 116.53 3ksk s SER 81 Ca 0.38 0.37 0.00 0.00 0.48 0.00 0.00 55.95 57.18 3ksk s SER 81 Cb -0.18 -0.46 0.00 0.00 0.10 0.00 0.00 66.02 65.48 3ksk s SER 81 CO 0.18 -3.14 0.00 0.41 0.98 0.00 0.00 173.24 171.67 3ksk n THR 82 N -4.06 0.00 -3.71 2.02 -1.04 -1.25 -4.84 114.28 101.40 3ksk n THR 82 Ca 0.15 0.00 -0.14 0.00 -2.04 0.00 0.00 64.05 62.02 3ksk n THR 82 Cb 0.59 0.00 -0.14 0.00 -1.82 0.00 0.00 70.33 68.97 3ksk n THR 82 CO 0.00 0.00 0.00 -2.28 -0.64 0.00 0.00 175.07 172.15 3ksk s HIS 83 N 0.00 -0.28 0.33 -1.42 2.46 -1.26 -5.05 115.29 110.06 3ksk s HIS 83 Ca 0.00 0.72 0.06 0.00 0.47 0.00 0.00 55.06 56.30 3ksk s HIS 83 Cb 0.00 -0.06 0.57 0.00 -0.13 0.00 0.00 32.58 32.96 3ksk s HIS 83 CO 0.00 -0.25 1.81 1.12 -2.47 0.00 0.00 174.74 174.95 3ksk h HIS 84 N 7.66 0.42 -2.27 3.88 2.07 -1.93 -2.35 115.15 122.63 3ksk h HIS 84 Ca -0.31 -0.07 -0.71 0.00 -2.85 0.00 0.00 60.37 56.43 3ksk h HIS 84 Cb 1.14 -0.11 -0.34 0.00 2.57 0.00 0.00 27.41 30.67 3ksk h HIS 84 CO 0.39 0.55 0.30 0.72 -3.07 0.00 0.00 177.93 176.82 3ksk n HIS 85 N -4.19 3.34 -1.58 6.12 8.25 -1.25 -3.48 115.22 122.43 3ksk n HIS 85 Ca -0.00 -3.19 -0.38 0.00 -0.26 0.00 0.00 57.72 53.89 3ksk n HIS 85 Cb 0.34 -0.89 -0.03 0.00 1.12 0.00 0.00 29.99 30.53 3ksk n HIS 85 CO 0.00 0.00 0.00 1.41 0.64 0.00 0.00 176.34 178.39 3ksk s MET 86 N -3.95 2.34 0.40 -0.41 1.75 -0.25 -4.78 119.30 114.39 3ksk s MET 86 Ca 0.43 1.53 0.05 0.00 -1.25 0.00 0.00 55.69 56.45 3ksk s MET 86 Cb 0.23 -4.53 -0.06 0.00 2.84 0.00 0.00 34.83 33.30 3ksk s MET 86 CO -0.13 -3.01 0.03 0.54 -0.65 0.00 0.00 175.02 171.80 3ksk s ASN 87 N 11.23 3.48 0.01 1.11 2.20 -1.26 -2.10 114.94 129.60 3ksk s ASN 87 Ca 0.97 -1.43 0.14 0.00 -0.94 0.00 0.00 52.86 51.60 3ksk s ASN 87 Cb -0.20 -0.13 0.60 0.00 -2.00 0.00 0.00 41.25 39.52 3ksk s ASN 87 CO 0.28 -0.58 1.45 -2.65 -2.94 0.00 0.00 177.10 172.66 3ksk n PRO 88 N -0.94 0.00 0.07 3.55 -0.02 -1.26 -0.89 135.00 135.52 3ksk n PRO 88 Ca -0.07 0.26 -0.13 0.00 -2.02 0.00 0.00 63.50 61.55 3ksk n PRO 88 Cb 0.67 -1.51 -0.14 0.00 -0.02 0.00 0.00 33.50 32.51 3ksk n PRO 88 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 3ksk h VAL 89 N 0.00 1.41 -0.07 -1.45 2.07 -1.98 -2.42 116.25 113.82 3ksk h VAL 89 Ca 0.00 -3.06 -0.03 0.00 0.82 0.00 0.00 66.70 64.43 3ksk h VAL 89 Cb 0.24 2.83 -0.00 0.00 -1.52 0.00 0.00 31.29 32.84 3ksk h VAL 89 CO 0.00 0.87 -0.08 0.40 0.02 0.00 0.00 177.57 178.78 3ksk h ILE 90 N 0.05 1.38 -0.64 4.57 1.08 -1.64 -3.22 117.51 119.09 3ksk h ILE 90 Ca -0.14 -1.25 -0.04 0.00 -0.39 0.00 0.00 64.86 63.04 3ksk h ILE 90 Cb 1.94 2.06 -0.03 0.00 -3.07 0.00 0.00 36.82 37.71 3ksk h ILE 90 CO 0.16 0.35 0.24 0.40 -0.69 0.00 0.00 178.15 178.61 3ksk h ILE 91 N -0.27 1.24 0.00 -0.67 2.04 -1.07 -1.65 117.51 117.12 3ksk h ILE 91 Ca 0.01 -0.76 -0.03 0.00 1.00 0.00 0.00 64.86 65.09 3ksk h ILE 91 Cb 0.59 0.54 -0.00 0.00 -0.74 0.00 0.00 36.82 37.21 3ksk h ILE 91 CO 0.02 0.30 -0.13 0.00 0.00 0.00 0.00 178.15 178.34 3ksk h ALA 92 N 1.10 1.10 0.20 1.87 0.00 -1.55 -1.75 119.26 120.22 3ksk h ALA 92 Ca 0.21 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 3ksk h ALA 92 Cb 0.22 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.00 3ksk h ALA 92 CO -0.02 0.16 -0.10 -0.22 0.00 0.00 0.00 179.25 179.07 3ksk h LYS 93 N 0.00 -0.26 -0.98 0.00 3.64 -1.45 -3.27 116.57 114.25 3ksk h LYS 93 Ca -0.00 0.02 0.25 0.00 -1.27 0.00 0.00 60.65 59.65 3ksk h LYS 93 Cb 0.51 0.06 -0.13 0.00 -0.41 0.00 0.00 32.23 32.26 3ksk h LYS 93 CO 0.02 0.13 0.54 1.88 -2.27 0.00 0.00 179.45 179.75 3ksk h TYR 94 N -0.86 0.91 0.00 1.91 0.05 -0.91 -1.46 116.97 116.60 3ksk h TYR 94 Ca -0.03 0.04 0.00 0.00 0.05 0.00 0.00 58.73 58.79 3ksk h TYR 94 Cb 0.51 -0.25 0.00 0.00 1.01 0.00 0.00 36.73 38.00 3ksk h TYR 94 CO 0.07 -0.00 0.00 0.54 -1.05 0.00 0.00 178.16 177.71 3ksk n ARG 95 N -4.95 0.06 0.17 4.88 1.74 -0.69 -3.39 116.66 114.47 3ksk n ARG 95 Ca 0.27 0.30 0.11 0.00 -0.77 0.00 0.00 57.85 57.75 3ksk n ARG 95 Cb 0.76 -1.61 0.09 0.00 -1.02 0.00 0.00 32.46 30.68 3ksk n ARG 95 CO 0.00 0.00 0.00 1.96 -1.52 0.00 0.00 177.63 178.07 3ksk h GLN 96 N 0.00 0.00 -5.17 5.56 4.20 -1.36 -3.44 115.11 114.89 3ksk h GLN 96 Ca 0.00 0.00 -0.38 0.00 0.06 0.00 0.00 58.65 58.33 3ksk h GLN 96 Cb 0.29 0.00 -0.21 0.00 0.30 0.00 0.00 27.48 27.86 3ksk h GLN 96 CO 0.00 0.02 -0.77 0.14 -0.67 0.00 0.00 178.83 177.56 3ksk s VAL 97 N -3.26 1.00 0.77 -0.54 -7.23 -1.22 -5.01 120.40 104.91 3ksk s VAL 97 Ca 0.04 -1.28 -0.13 0.00 -1.81 0.00 0.00 61.98 58.79 3ksk s VAL 97 Cb 0.07 -1.00 0.06 0.00 0.56 0.00 0.00 36.38 36.07 3ksk s VAL 97 CO 0.73 -0.28 1.15 -2.84 -0.31 0.00 0.00 175.10 173.55 3ksk s PRO 98 N -1.77 2.02 0.02 4.82 0.02 -1.26 -4.37 135.00 134.47 3ksk s PRO 98 Ca -0.03 1.50 0.07 0.00 0.02 0.00 0.00 61.00 62.56 3ksk s PRO 98 Cb -0.10 -1.85 -0.03 0.00 0.02 0.00 0.00 34.50 32.55 3ksk s PRO 98 CO 0.02 -1.87 -0.21 -1.58 -0.33 0.00 0.00 177.00 173.02 3ksk s TRP 99 N -2.43 2.47 -0.20 6.54 0.52 -0.34 -2.01 118.94 123.49 3ksk s TRP 99 Ca 0.68 -0.32 -0.02 0.00 0.02 0.00 0.00 56.10 56.46 3ksk s TRP 99 Cb -0.23 -1.47 -0.00 0.00 -1.15 0.00 0.00 33.47 30.61 3ksk s TRP 99 CO 0.50 0.16 -0.09 0.42 0.02 0.00 0.00 176.95 177.95 3ksk s ILE 100 N -0.81 2.99 -0.12 2.03 -1.09 0.57 -1.24 121.20 123.53 3ksk s ILE 100 Ca 0.13 -0.63 -0.04 0.00 -2.23 0.00 0.00 60.65 57.88 3ksk s ILE 100 Cb -0.10 -2.33 -0.03 0.00 -1.58 0.00 0.00 42.46 38.41 3ksk s ILE 100 CO 0.03 0.46 0.01 -0.36 -1.23 0.00 0.00 174.94 173.85 3ksk s PHE 101 N 1.33 3.18 -0.09 3.97 0.08 -0.24 -0.55 117.98 125.66 3ksk s PHE 101 Ca 0.04 0.08 0.03 0.00 0.12 0.00 0.00 56.93 57.20 3ksk s PHE 101 Cb -0.14 -1.90 -0.01 0.00 -0.57 0.00 0.00 43.02 40.40 3ksk s PHE 101 CO -0.05 0.31 -0.19 0.00 -0.10 0.00 0.00 175.22 175.19 3ksk s ALA 102 N -0.34 2.41 -0.24 5.36 0.00 -0.00 -1.76 121.76 127.18 3ksk s ALA 102 Ca 0.07 -0.97 0.02 0.00 0.00 0.00 0.00 51.96 51.08 3ksk s ALA 102 Cb -0.12 -0.93 0.05 0.00 0.00 0.00 0.00 23.12 22.12 3ksk s ALA 102 CO 0.02 0.37 -0.12 0.42 0.00 0.00 0.00 175.76 176.45 3ksk s ILE 103 N -0.03 2.24 0.16 0.00 1.01 0.38 -1.50 121.20 123.46 3ksk s ILE 103 Ca -0.05 -1.44 0.03 0.00 0.00 0.00 0.00 60.65 59.19 3ksk s ILE 103 Cb -0.15 -2.23 -0.03 0.00 0.01 0.00 0.00 42.46 40.06 3ksk s ILE 103 CO 0.05 0.10 0.30 -0.31 0.00 0.00 0.00 174.94 175.08 3ksk s TYR 104 N 1.16 3.48 -0.27 3.97 2.02 0.09 -0.20 117.35 127.61 3ksk s TYR 104 Ca -0.05 0.11 0.01 0.00 -0.37 0.00 0.00 57.07 56.76 3ksk s TYR 104 Cb -0.18 -1.66 0.08 0.00 -0.40 0.00 0.00 41.96 39.79 3ksk s TYR 104 CO -0.06 0.50 0.01 0.50 -1.57 0.00 0.00 175.55 174.93 3ksk s ARG 105 N -3.34 1.27 7.49 -0.62 3.52 -0.13 -1.19 118.95 125.95 3ksk s ARG 105 Ca 0.35 -1.13 0.00 0.00 -0.13 0.00 0.00 55.73 54.82 3ksk s ARG 105 Cb -0.11 -2.50 0.00 0.00 -1.56 0.00 0.00 34.95 30.78 3ksk s ARG 105 CO 0.29 -0.77 0.00 0.41 -0.81 0.00 0.00 175.30 174.42 3ksk n GLY 106 N 4.67 2.71 0.63 8.12 0.00 -1.26 -2.20 105.19 117.86 3ksk n GLY 106 Ca -0.06 -0.26 0.13 0.00 0.00 0.00 0.00 46.02 45.83 3ksk n GLY 106 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 3ksk n ILE 107 N 0.00 0.00 -3.87 -0.61 -5.35 -1.26 -4.96 119.36 103.31 3ksk n ILE 107 Ca 0.00 -0.33 -0.37 0.00 -0.27 0.00 0.00 62.75 61.79 3ksk n ILE 107 Cb 0.00 0.86 -0.06 0.00 -1.74 0.00 0.00 39.64 38.70 3ksk n ILE 107 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3ksk s ALA 108 N -2.05 3.88 0.06 -1.28 0.00 -0.93 -4.69 121.76 116.75 3ksk s ALA 108 Ca 0.33 -0.64 -0.31 0.00 0.00 0.00 0.00 51.96 51.35 3ksk s ALA 108 Cb 0.20 -1.98 -0.06 0.00 0.00 0.00 0.00 23.12 21.28 3ksk s ALA 108 CO 0.35 0.63 1.30 -1.50 0.00 0.00 0.00 175.76 176.53 3ksk s ILE 109 N -1.07 3.74 -0.20 0.00 1.10 -1.26 -0.95 121.20 122.56 3ksk s ILE 109 Ca 0.17 1.23 0.03 0.00 -0.51 0.00 0.00 60.65 61.56 3ksk s ILE 109 Cb -0.12 -3.79 -0.14 0.00 0.15 0.00 0.00 42.46 38.56 3ksk s ILE 109 CO 0.06 0.08 -0.16 1.21 -2.11 0.00 0.00 174.94 174.02 3ksk n GLU 110 N 4.22 0.58 -3.58 3.50 2.13 0.73 -4.85 120.64 123.38 3ksk n GLU 110 Ca 0.11 0.11 -0.16 0.00 0.66 0.00 0.00 57.16 57.87 3ksk n GLU 110 Cb 0.44 -1.41 -0.06 0.00 0.27 0.00 0.00 31.44 30.68 3ksk n GLU 110 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 3ksk s ALA 111 N -2.41 -1.48 -0.07 4.31 0.00 -0.94 -4.99 121.76 116.19 3ksk s ALA 111 Ca -0.26 0.95 0.02 0.00 0.00 0.00 0.00 51.96 52.66 3ksk s ALA 111 Cb 0.07 0.12 0.02 0.00 0.00 0.00 0.00 23.12 23.33 3ksk s ALA 111 CO 0.48 -0.39 -0.10 0.42 0.00 0.00 0.00 175.76 176.18 3ksk s ILE 112 N -1.55 1.00 0.01 0.00 1.01 -1.26 -0.47 121.20 119.94 3ksk s ILE 112 Ca -0.10 -0.38 0.06 0.00 0.00 0.00 0.00 60.65 60.24 3ksk s ILE 112 Cb -0.01 -0.95 -0.02 0.00 0.01 0.00 0.00 42.46 41.49 3ksk s ILE 112 CO 0.06 0.33 -0.20 -0.31 0.00 0.00 0.00 174.94 174.82 3ksk s TYR 113 N 0.89 1.74 -0.08 3.97 2.02 -0.72 1.00 117.35 126.16 3ksk s TYR 113 Ca -0.11 -0.34 0.02 0.00 -0.37 0.00 0.00 57.07 56.27 3ksk s TYR 113 Cb -0.15 -1.09 -0.02 0.00 -0.40 0.00 0.00 41.96 40.30 3ksk s TYR 113 CO 0.01 0.01 -0.14 0.50 -1.57 0.00 0.00 175.55 174.36 3ksk s ARG 114 N -0.72 2.84 -0.06 -0.62 3.52 -0.34 -1.08 118.95 122.49 3ksk s ARG 114 Ca 0.07 -0.70 0.03 0.00 -0.13 0.00 0.00 55.73 54.99 3ksk s ARG 114 Cb -0.08 -2.46 0.01 0.00 -1.56 0.00 0.00 34.95 30.86 3ksk s ARG 114 CO 0.00 0.45 -0.14 -0.51 -0.81 0.00 0.00 175.30 174.30 3ksk s LEU 115 N -0.29 1.74 0.59 -0.88 1.02 -0.37 -1.10 118.68 119.39 3ksk s LEU 115 Ca 0.02 -0.33 -0.13 0.00 0.02 0.00 0.00 54.13 53.71 3ksk s LEU 115 Cb -0.13 -0.90 -0.05 0.00 0.02 0.00 0.00 46.19 45.14 3ksk s LEU 115 CO 0.03 0.06 1.02 -1.61 0.02 0.00 0.00 176.35 175.87 3ksk s GLU 116 N 0.52 3.64 0.58 1.70 0.41 -1.26 -1.20 118.70 123.08 3ksk s GLU 116 Ca -0.13 0.87 0.31 0.00 -0.41 0.00 0.00 54.97 55.61 3ksk s GLU 116 Cb -0.15 -2.09 1.41 0.00 -1.78 0.00 0.00 34.13 31.52 3ksk s GLU 116 CO 0.04 -0.53 1.78 -1.35 -0.49 0.00 0.00 175.26 174.71 3ksk h PRO 117 N 0.12 0.00 0.00 0.39 0.11 -1.86 -0.91 132.00 129.85 3ksk h PRO 117 Ca -0.45 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 65.60 3ksk h PRO 117 Cb 1.19 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.29 3ksk h PRO 117 CO 0.61 0.00 -0.28 1.57 -0.21 0.00 0.00 178.00 179.69 3ksk h LYS 118 N 0.00 0.00 0.00 1.05 -0.00 -1.92 -3.05 116.57 112.65 3ksk h LYS 118 Ca 0.36 0.00 0.00 0.00 -0.00 0.00 0.00 60.65 61.01 3ksk h LYS 118 Cb 1.75 0.00 0.00 0.00 -0.00 0.00 0.00 32.23 33.98 3ksk h LYS 118 CO -0.00 0.28 0.00 -0.25 -0.00 0.00 0.00 179.45 179.48 3ksk n ASP 119 N -3.28 0.00 -0.00 7.07 10.43 -0.35 -3.32 116.55 127.11 3ksk n ASP 119 Ca 0.01 0.38 0.04 0.00 2.57 0.00 0.00 54.79 57.79 3ksk n ASP 119 Cb 0.55 -0.46 -0.05 0.00 1.84 0.00 0.00 41.12 43.01 3ksk n ASP 119 CO 0.00 0.00 0.00 0.18 -1.07 0.00 0.00 177.20 176.31 3ksk n LEU 120 N -1.46 0.13 -0.33 0.64 4.77 -1.16 -4.70 117.00 114.89 3ksk n LEU 120 Ca 0.07 -0.19 0.25 0.00 -0.03 0.00 0.00 56.01 56.11 3ksk n LEU 120 Cb 0.26 0.00 0.48 0.00 -2.33 0.00 0.00 43.42 41.84 3ksk n LEU 120 CO 0.21 0.03 1.06 -0.08 -1.33 0.00 0.00 177.39 177.28 3ksk h GLU 121 N 0.00 0.17 -0.91 3.23 4.57 -1.53 0.31 114.58 120.43 3ksk h GLU 121 Ca 0.00 -0.01 0.20 0.00 -1.18 0.00 0.00 59.36 58.37 3ksk h GLU 121 Cb 0.27 -0.04 -0.07 0.00 -0.16 0.00 0.00 28.75 28.75 3ksk h GLU 121 CO 0.00 0.11 0.60 0.35 -1.18 0.00 0.00 179.01 178.89 3ksk h PHE 122 N 0.18 0.59 0.00 0.92 3.04 -1.84 0.16 116.94 120.00 3ksk h PHE 122 Ca 0.75 0.02 -0.10 0.00 3.98 0.00 0.00 57.97 62.61 3ksk h PHE 122 Cb 1.79 -0.18 -0.02 0.00 2.56 0.00 0.00 35.95 40.10 3ksk h PHE 122 CO -0.07 0.16 -0.89 1.88 -2.02 0.00 0.00 178.31 177.38 3ksk h TYR 123 N 0.45 0.00 0.00 0.41 0.05 -0.74 -2.84 116.97 114.30 3ksk h TYR 123 Ca 0.48 0.00 -0.19 0.00 0.05 0.00 0.00 58.73 59.07 3ksk h TYR 123 Cb 1.13 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 38.85 3ksk h TYR 123 CO -0.00 0.40 -0.86 1.88 -1.05 0.00 0.00 178.16 178.54 3ksk h TYR 124 N 0.00 0.17 0.11 4.88 0.05 -0.53 -2.48 116.97 119.18 3ksk h TYR 124 Ca -0.06 -0.10 -0.01 0.00 0.05 0.00 0.00 58.73 58.62 3ksk h TYR 124 Cb 1.36 -0.02 0.00 0.00 1.01 0.00 0.00 36.73 39.09 3ksk h TYR 124 CO 0.00 0.91 -0.05 0.22 -1.05 0.00 0.00 178.16 178.19 3ksk h ASP 125 N 0.06 -0.12 0.39 3.88 3.58 -0.88 -2.20 116.42 121.13 3ksk h ASP 125 Ca -0.03 -0.43 0.00 0.00 0.42 0.00 0.00 57.03 56.99 3ksk h ASP 125 Cb 1.49 0.03 0.00 0.00 1.72 0.00 0.00 39.33 42.57 3ksk h ASP 125 CO 0.12 0.50 0.00 2.29 -2.88 0.00 0.00 179.24 179.27 3ksk n LYS 126 N -4.85 0.17 0.00 0.28 2.85 -1.07 -0.26 118.16 115.28 3ksk n LYS 126 Ca -0.07 0.53 -0.22 0.00 -1.05 0.00 0.00 58.31 57.50 3ksk n LYS 126 Cb 0.27 -1.92 -0.14 0.00 -0.65 0.00 0.00 35.03 32.59 3ksk n LYS 126 CO 0.00 0.00 0.00 -1.49 -0.05 0.00 0.00 177.40 175.86 3ksk h TRP 127 N 0.00 0.43 0.00 5.58 6.55 -1.42 -3.24 115.95 123.85 3ksk h TRP 127 Ca 0.00 -0.31 -0.03 0.00 0.95 0.00 0.00 58.89 59.50 3ksk h TRP 127 Cb 0.20 -0.02 -0.00 0.00 -0.86 0.00 0.00 29.16 28.47 3ksk h TRP 127 CO 0.00 1.62 -0.46 1.05 -1.05 0.00 0.00 178.44 179.60 3ksk h GLU 128 N -0.25 0.00 0.07 0.49 4.11 -0.95 -1.75 114.58 116.30 3ksk h GLU 128 Ca -0.34 0.00 -0.24 0.00 0.07 0.00 0.00 59.36 58.84 3ksk h GLU 128 Cb 1.81 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 31.05 3ksk h GLU 128 CO 0.05 0.10 -1.10 0.00 0.07 0.00 0.00 179.01 178.12 3ksk h ARG 129 N 0.00 0.21 0.00 1.06 3.08 -0.81 -3.14 114.38 114.78 3ksk h ARG 129 Ca -0.01 -0.32 0.00 0.00 0.07 0.00 0.00 59.98 59.72 3ksk h ARG 129 Cb 1.10 0.11 0.00 0.00 0.08 0.00 0.00 29.97 31.27 3ksk h ARG 129 CO 0.01 1.12 -0.39 0.36 -1.07 0.00 0.00 179.97 180.00 3ksk n LYS 130 N -3.53 0.07 0.04 0.04 -0.00 -1.22 -1.43 118.16 112.12 3ksk n LYS 130 Ca -0.06 0.03 -0.13 0.00 -0.00 0.00 0.00 58.31 58.15 3ksk n LYS 130 Cb 0.95 -1.55 -0.09 0.00 -0.00 0.00 0.00 35.03 34.35 3ksk n LYS 130 CO 0.00 0.00 0.00 2.35 0.00 0.00 0.00 177.40 179.75 3ksk h TRP 131 N 0.00 -0.07 -0.22 5.58 7.01 -1.32 -3.10 115.95 123.83 3ksk h TRP 131 Ca 0.00 -0.00 -0.17 0.00 2.11 0.00 0.00 58.89 60.83 3ksk h TRP 131 Cb 0.56 0.02 -0.00 0.00 -2.10 0.00 0.00 29.16 27.64 3ksk h TRP 131 CO 0.00 0.23 -0.54 1.88 -2.79 0.00 0.00 178.44 177.22 3ksk h TYR 132 N -0.38 0.82 -0.96 2.65 0.05 -1.56 -2.21 116.97 115.39 3ksk h TYR 132 Ca -0.01 -0.29 0.19 0.00 0.05 0.00 0.00 58.73 58.67 3ksk h TYR 132 Cb 0.34 -0.16 -0.08 0.00 1.01 0.00 0.00 36.73 37.84 3ksk h TYR 132 CO 0.03 1.05 0.61 1.03 -1.05 0.00 0.00 178.16 179.83 3ksk h SER 133 N 0.51 0.61 -0.29 3.88 0.87 -1.31 0.23 113.55 118.04 3ksk h SER 133 Ca 0.01 0.07 0.00 0.00 -1.23 0.00 0.00 61.79 60.64 3ksk h SER 133 Cb 1.10 -0.05 0.00 0.00 -0.44 0.00 0.00 62.40 63.02 3ksk h SER 133 CO 0.11 0.24 0.00 0.47 -0.53 0.00 0.00 176.83 177.12 3ksk n ASP 134 N -4.62 3.12 -2.41 6.23 9.92 -1.16 -5.05 116.55 122.58 3ksk n ASP 134 Ca 0.21 -1.95 -0.01 0.00 -0.53 0.00 0.00 54.79 52.51 3ksk n ASP 134 Cb 0.62 -0.18 -0.01 0.00 -0.64 0.00 0.00 41.12 40.90 3ksk n ASP 134 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 3ksk n GLY 135 N 1.43 -5.16 1.44 0.44 0.00 0.79 -4.34 105.19 99.79 3ksk n GLY 135 Ca 0.18 0.49 -0.04 0.00 0.00 0.00 0.00 46.02 46.65 3ksk n GLY 135 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3ksk n HIS 136 N 1.86 -0.93 -3.38 1.61 8.25 -1.22 -4.94 115.22 116.48 3ksk n HIS 136 Ca -0.10 0.00 -0.39 0.00 -0.26 0.00 0.00 57.72 56.97 3ksk n HIS 136 Cb 0.15 -1.48 -0.08 0.00 1.12 0.00 0.00 29.99 29.71 3ksk n HIS 136 CO 0.00 0.00 0.00 0.21 0.64 0.00 0.00 176.34 177.19 3ksk s LYS 137 N -2.65 4.09 0.12 -0.41 2.36 -1.25 -5.07 119.74 116.93 3ksk s LYS 137 Ca 0.00 0.13 -0.31 0.00 -2.55 0.00 0.00 55.97 53.24 3ksk s LYS 137 Cb 0.00 -3.60 -0.08 0.00 -1.05 0.00 0.00 37.83 33.10 3ksk s LYS 137 CO 0.00 -0.18 1.41 -0.51 1.55 0.00 0.00 175.35 177.62 3ksk s ASP 138 N 1.36 6.80 0.32 1.43 -0.00 -1.26 -4.68 116.67 120.64 3ksk s ASP 138 Ca 0.17 2.35 -0.27 0.00 -0.00 0.00 0.00 52.55 54.80 3ksk s ASP 138 Cb -0.15 -2.59 -0.09 0.00 -0.00 0.00 0.00 42.92 40.09 3ksk s ASP 138 CO 0.09 -0.67 1.00 -0.63 -0.00 0.00 0.00 175.17 174.96 3ksk s ILE 139 N 1.16 3.91 -0.50 0.77 1.09 -0.89 -4.69 121.20 122.04 3ksk s ILE 139 Ca 0.65 1.66 -0.17 0.00 -1.10 0.00 0.00 60.65 61.69 3ksk s ILE 139 Cb -0.37 -3.95 0.07 0.00 -1.06 0.00 0.00 42.46 37.15 3ksk s ILE 139 CO 0.30 0.20 0.52 0.21 -0.10 0.00 0.00 174.94 176.07 3ksk s ASN 140 N -1.39 6.18 -1.28 3.58 3.04 -1.23 -1.09 114.94 122.75 3ksk s ASN 140 Ca 0.50 -1.22 -0.18 0.00 0.04 0.00 0.00 52.86 52.00 3ksk s ASN 140 Cb -0.23 -2.24 0.01 0.00 -1.54 0.00 0.00 41.25 37.25 3ksk s ASN 140 CO 0.29 -0.80 0.57 -3.20 -3.04 0.00 0.00 177.10 170.92 3ksk n ASN 141 N 5.69 -3.01 -4.77 -4.21 4.05 -0.89 -4.91 115.26 107.22 3ksk n ASN 141 Ca -0.10 -1.14 -0.39 0.00 0.45 0.00 0.00 54.58 53.40 3ksk n ASN 141 Cb 0.44 -2.51 -0.00 0.00 1.23 0.00 0.00 39.78 38.93 3ksk n ASN 141 CO 0.00 0.00 0.00 -2.16 -3.05 0.00 0.00 177.26 172.05 3ksk s PRO 142 N -6.77 3.90 0.01 1.20 0.04 -1.26 -4.64 135.00 127.47 3ksk s PRO 142 Ca 0.32 2.05 -0.16 0.00 0.04 0.00 0.00 61.00 63.25 3ksk s PRO 142 Cb -0.14 -2.66 -0.06 0.00 0.04 0.00 0.00 34.50 31.67 3ksk s PRO 142 CO 0.92 -0.52 0.44 0.15 0.04 0.00 0.00 177.00 178.04 3ksk s LYS 143 N -2.35 3.99 -0.28 4.56 3.01 -1.26 -3.93 119.74 123.48 3ksk s LYS 143 Ca 0.59 0.48 -0.08 0.00 -1.01 0.00 0.00 55.97 55.94 3ksk s LYS 143 Cb -0.36 -3.23 -0.02 0.00 -1.01 0.00 0.00 37.83 33.21 3ksk s LYS 143 CO 0.45 0.66 0.11 0.42 0.51 0.00 0.00 175.35 177.50 3ksk s ILE 144 N -1.02 4.48 0.45 2.17 1.01 -0.64 -4.92 121.20 122.72 3ksk s ILE 144 Ca 0.25 -0.28 -0.25 0.00 0.00 0.00 0.00 60.65 60.37 3ksk s ILE 144 Cb -0.17 -3.19 -0.08 0.00 0.01 0.00 0.00 42.46 39.03 3ksk s ILE 144 CO 0.14 0.21 1.33 -2.84 0.00 0.00 0.00 174.94 173.78 3ksk s PRO 145 N 1.62 3.74 0.25 2.79 0.02 -1.26 -0.36 135.00 141.80 3ksk s PRO 145 Ca 0.05 2.20 -0.05 0.00 0.02 0.00 0.00 61.00 63.23 3ksk s PRO 145 Cb -0.16 -2.62 0.32 0.00 0.02 0.00 0.00 34.50 32.07 3ksk s PRO 145 CO 0.05 -0.70 1.89 -0.24 -0.33 0.00 0.00 177.00 177.68 3ksk h VAL 146 N 2.20 1.15 -0.72 3.83 3.04 -1.10 -2.22 116.25 122.44 3ksk h VAL 146 Ca -0.50 -0.41 0.11 0.00 -1.01 0.00 0.00 66.70 64.88 3ksk h VAL 146 Cb 1.26 -0.15 -0.08 0.00 -2.01 0.00 0.00 31.29 30.31 3ksk h VAL 146 CO 0.61 0.22 0.34 0.11 -1.01 0.00 0.00 177.57 177.84 3ksk h LYS 147 N 1.20 0.54 -0.66 4.17 6.56 -1.92 0.17 116.57 126.63 3ksk h LYS 147 Ca 0.39 -0.03 -0.05 0.00 -1.06 0.00 0.00 60.65 59.90 3ksk h LYS 147 Cb 0.03 -0.12 -0.03 0.00 -0.57 0.00 0.00 32.23 31.54 3ksk h LYS 147 CO -0.13 0.36 0.24 -0.92 -2.06 0.00 0.00 179.45 176.93 3ksk h TYR 148 N 0.55 1.04 -0.39 -1.35 3.20 -1.78 -1.72 116.97 116.52 3ksk h TYR 148 Ca 0.37 -0.09 -0.08 0.00 3.14 0.00 0.00 58.73 62.07 3ksk h TYR 148 Cb 0.44 -0.30 -0.01 0.00 1.54 0.00 0.00 36.73 38.39 3ksk h TYR 148 CO -0.12 0.82 -0.05 0.28 -1.64 0.00 0.00 178.16 177.45 3ksk h VAL 149 N 0.95 1.27 -0.78 1.81 2.07 -0.95 -2.03 116.25 118.58 3ksk h VAL 149 Ca 0.22 -1.10 -0.03 0.00 0.82 0.00 0.00 66.70 66.61 3ksk h VAL 149 Cb 0.25 1.19 -0.04 0.00 -1.52 0.00 0.00 31.29 31.18 3ksk h VAL 149 CO -0.01 0.37 0.37 0.24 0.02 0.00 0.00 177.57 178.55 3ksk h MET 150 N 0.54 1.12 -0.17 1.57 2.86 -0.96 -0.12 114.93 119.76 3ksk h MET 150 Ca 0.10 -0.16 -0.06 0.00 -2.06 0.00 0.00 59.70 57.52 3ksk h MET 150 Cb 0.55 -0.20 -0.00 0.00 0.06 0.00 0.00 31.60 32.00 3ksk h MET 150 CO 0.03 0.87 -0.13 1.05 1.06 0.00 0.00 176.91 179.79 3ksk h GLU 151 N 1.11 0.39 -0.03 1.72 4.11 -1.11 -3.36 114.58 117.41 3ksk h GLU 151 Ca 0.27 -0.19 0.00 0.00 0.07 0.00 0.00 59.36 59.51 3ksk h GLU 151 Cb 0.12 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.37 3ksk h GLU 151 CO -0.03 0.73 -0.06 0.72 0.07 0.00 0.00 179.01 180.44 3ksk n HIS 152 N -4.55 0.00 -2.94 2.06 8.25 -0.78 -4.99 115.22 112.27 3ksk n HIS 152 Ca -0.06 0.00 -0.19 0.00 -0.26 0.00 0.00 57.72 57.22 3ksk n HIS 152 Cb 0.35 0.00 0.02 0.00 1.12 0.00 0.00 29.99 31.48 3ksk n HIS 152 CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 3ksk s GLY 153 N -1.90 1.87 -0.21 -1.41 0.00 -0.06 -4.90 107.32 100.71 3ksk s GLY 153 Ca 0.24 -1.53 -0.03 0.00 0.00 0.00 0.00 44.72 43.40 3ksk s GLY 153 CO 0.31 -1.32 -0.05 -0.51 0.00 0.00 0.00 173.10 171.52 3ksk s THR 154 N -2.47 3.33 0.35 0.90 -4.23 -0.26 -4.88 115.64 108.39 3ksk s THR 154 Ca 0.55 -0.51 -0.28 0.00 -1.18 0.00 0.00 61.69 60.27 3ksk s THR 154 Cb -0.10 -2.50 -0.10 0.00 1.34 0.00 0.00 72.50 71.14 3ksk s THR 154 CO 0.35 0.44 1.25 -0.75 -0.54 0.00 0.00 174.62 175.36 3ksk s LYS 155 N 1.31 4.27 -0.16 3.99 2.20 -1.26 -1.20 119.74 128.90 3ksk s LYS 155 Ca 0.04 2.07 -0.04 0.00 -0.36 0.00 0.00 55.97 57.68 3ksk s LYS 155 Cb -0.14 -2.96 -0.03 0.00 -1.51 0.00 0.00 37.83 33.19 3ksk s LYS 155 CO -0.02 -0.21 -0.03 0.42 -0.36 0.00 0.00 175.35 175.15 3ksk s ILE 156 N -1.22 3.98 0.28 5.43 1.01 0.28 -4.93 121.20 126.03 3ksk s ILE 156 Ca 0.51 -0.33 0.09 0.00 0.00 0.00 0.00 60.65 60.92 3ksk s ILE 156 Cb -0.37 -2.75 -0.04 0.00 0.01 0.00 0.00 42.46 39.31 3ksk s ILE 156 CO 0.48 0.49 0.08 -0.31 0.00 0.00 0.00 174.94 175.67 3ksk s TYR 157 N 0.39 2.80 0.37 3.97 2.02 -1.26 -4.38 117.35 121.27 3ksk s TYR 157 Ca -0.03 -0.23 -0.26 0.00 -0.37 0.00 0.00 57.07 56.18 3ksk s TYR 157 Cb -0.14 -1.34 -0.12 0.00 -0.40 0.00 0.00 41.96 39.96 3ksk s TYR 157 CO 0.03 0.53 1.13 0.41 -1.57 0.00 0.00 175.55 176.08 3ksk n GLY 158 N -1.02 0.12 0.00 0.71 0.00 -1.26 -4.92 105.19 98.81 3ksk n GLY 158 Ca -0.06 0.23 0.00 0.00 0.00 0.00 0.00 46.02 46.19 3ksk n GLY 158 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3ksk n SER 159 N 0.67 0.00 0.08 1.61 3.41 -1.26 -5.00 113.62 113.13 3ksk n SER 159 Ca 0.08 -0.49 0.11 0.00 -0.26 0.00 0.00 58.87 58.30 3ksk n SER 159 Cb 0.37 0.00 0.44 0.00 -0.26 0.00 0.00 64.21 64.76 3ksk n SER 159 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3ksk n GLY 160 N 0.00 -1.25 0.15 5.00 0.00 -1.26 -2.65 105.19 105.17 3ksk n GLY 160 Ca 0.00 0.02 0.12 0.00 0.00 0.00 0.00 46.02 46.16 3ksk n GLY 160 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3ksk h GLY 161 N 2.73 0.00 -2.37 -0.02 0.00 -1.93 -3.47 103.07 98.01 3ksk h GLY 161 Ca 0.00 0.00 -0.56 0.00 0.00 0.00 0.00 47.33 46.77 3ksk h GLY 161 CO 0.00 0.00 0.55 -0.56 0.00 0.00 0.00 176.54 176.53 3ksk s SER 162 N -5.63 4.86 0.27 0.19 0.01 -1.09 -3.83 113.70 108.48 3ksk s SER 162 Ca 0.02 2.69 -0.29 0.00 1.31 0.00 0.00 55.95 59.67 3ksk s SER 162 Cb 0.08 -2.63 -0.09 0.00 0.21 0.00 0.00 66.02 63.59 3ksk s SER 162 CO 0.75 -1.84 1.17 -2.28 0.41 0.00 0.00 173.24 171.46 3ksk s HIS 163 N -1.36 3.41 0.41 2.43 5.65 0.09 -4.88 115.29 121.04 3ksk s HIS 163 Ca 0.78 1.56 0.14 0.00 0.25 0.00 0.00 55.06 57.79 3ksk s HIS 163 Cb -0.39 -3.42 0.99 0.00 -1.18 0.00 0.00 32.58 28.58 3ksk s HIS 163 CO 0.43 -1.03 1.91 -1.00 -0.65 0.00 0.00 174.74 174.40 3ksk h PRO 164 N 4.05 0.48 0.00 2.88 0.13 -1.94 0.57 132.00 138.17 3ksk h PRO 164 Ca -0.47 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 3ksk h PRO 164 Cb 1.22 -0.11 0.00 0.00 0.13 0.00 0.00 31.00 32.24 3ksk h PRO 164 CO 0.68 0.32 0.06 -0.25 -0.23 0.00 0.00 178.00 178.58 3ksk n ASP 165 N -4.50 0.09 -0.31 1.44 10.43 -1.26 -1.51 116.55 120.93 3ksk n ASP 165 Ca 0.15 0.49 0.09 0.00 2.57 0.00 0.00 54.79 58.09 3ksk n ASP 165 Cb 0.51 -0.50 0.30 0.00 1.84 0.00 0.00 41.12 43.28 3ksk n ASP 165 CO 0.00 0.00 0.00 0.25 -1.07 0.00 0.00 177.20 176.38 3ksk h LEU 166 N 0.00 0.80 -0.94 0.64 5.85 -0.14 -0.86 115.31 120.65 3ksk h LEU 166 Ca 0.00 0.04 -0.10 0.00 0.84 0.00 0.00 57.88 58.66 3ksk h LEU 166 Cb 0.13 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.02 3ksk h LEU 166 CO 0.00 0.43 -0.47 -0.55 -0.34 0.00 0.00 178.44 177.51 3ksk h ASN 167 N 0.86 0.00 -0.15 1.25 7.08 -1.48 -0.51 115.58 122.62 3ksk h ASN 167 Ca 0.46 0.00 -0.04 0.00 -3.08 0.00 0.00 56.30 53.64 3ksk h ASN 167 Cb 0.56 0.00 -0.00 0.00 -2.08 0.00 0.00 38.32 36.79 3ksk h ASN 167 CO -0.22 0.47 -0.07 0.50 -2.08 0.00 0.00 177.43 176.03 3ksk h LYS 168 N 0.00 0.31 -0.79 4.14 3.11 -1.60 -1.49 116.57 120.24 3ksk h LYS 168 Ca -0.00 -0.13 0.10 0.00 -2.81 0.00 0.00 60.65 57.81 3ksk h LYS 168 Cb 0.93 -0.01 -0.08 0.00 -1.00 0.00 0.00 32.23 32.08 3ksk h LYS 168 CO 0.06 0.63 0.42 1.25 -2.81 0.00 0.00 179.45 179.00 3ksk h LEU 169 N -0.03 0.58 -1.18 5.20 6.46 -0.73 -1.76 115.31 123.85 3ksk h LEU 169 Ca 0.03 0.06 -0.02 0.00 -0.12 0.00 0.00 57.88 57.83 3ksk h LEU 169 Cb 0.53 -0.04 -0.03 0.00 -0.73 0.00 0.00 40.66 40.39 3ksk h LEU 169 CO 0.02 0.32 0.30 -0.07 -0.62 0.00 0.00 178.44 178.39 3ksk h LEU 170 N 0.70 0.78 -0.84 2.25 4.07 -0.88 0.31 115.31 121.70 3ksk h LEU 170 Ca 0.39 -0.08 -0.12 0.00 0.08 0.00 0.00 57.88 58.16 3ksk h LEU 170 Cb 0.41 -0.20 -0.01 0.00 1.08 0.00 0.00 40.66 41.94 3ksk h LEU 170 CO -0.27 0.66 -0.40 -0.33 -1.08 0.00 0.00 178.44 177.02 3ksk h GLU 171 N 0.87 0.37 0.00 1.13 5.08 -0.70 -3.01 114.58 118.32 3ksk h GLU 171 Ca 0.22 -0.18 -0.19 0.00 -1.00 0.00 0.00 59.36 58.21 3ksk h GLU 171 Cb 0.09 -0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.31 3ksk h GLU 171 CO -0.03 0.72 -0.89 -0.07 -1.00 0.00 0.00 179.01 177.73 3ksk h LEU 172 N 0.31 0.00 -0.83 1.33 3.38 -0.91 -3.39 115.31 115.19 3ksk h LEU 172 Ca 0.03 0.00 0.18 0.00 0.09 0.00 0.00 57.88 58.18 3ksk h LEU 172 Cb 0.85 0.00 -0.16 0.00 0.09 0.00 0.00 40.66 41.44 3ksk h LEU 172 CO 0.07 0.89 -0.14 -0.25 0.09 0.00 0.00 178.44 179.10 3ksk h TRP 173 N 0.00 -0.32 -0.09 1.13 2.91 -0.80 -1.34 115.95 117.43 3ksk h TRP 173 Ca -0.01 0.07 0.03 0.00 1.13 0.00 0.00 58.89 60.11 3ksk h TRP 173 Cb 1.68 0.27 -0.00 0.00 -0.51 0.00 0.00 29.16 30.60 3ksk h TRP 173 CO 0.00 -0.34 0.08 -1.35 -1.03 0.00 0.00 178.44 175.80 3ksk h PRO 174 N 0.02 0.00 0.14 2.65 0.11 -1.76 0.72 132.00 133.88 3ksk h PRO 174 Ca 0.42 0.00 -0.29 0.00 0.11 0.00 0.00 66.00 66.25 3ksk h PRO 174 Cb 0.69 0.00 0.01 0.00 0.11 0.00 0.00 31.00 31.81 3ksk h PRO 174 CO -0.83 0.00 -1.31 0.45 -0.21 0.00 0.00 178.00 176.11 3ksk h HIS 175 N 0.00 0.55 -0.39 0.65 3.86 -1.54 -2.86 115.15 115.43 3ksk h HIS 175 Ca 0.04 -0.40 -0.04 0.00 -1.16 0.00 0.00 60.37 58.81 3ksk h HIS 175 Cb 0.21 -0.02 -0.02 0.00 1.06 0.00 0.00 27.41 28.65 3ksk h HIS 175 CO 0.00 1.33 0.09 0.82 0.86 0.00 0.00 177.93 181.03 3ksk h ILE 176 N 0.08 1.23 -0.39 2.45 1.08 -1.21 -1.88 117.51 118.87 3ksk h ILE 176 Ca -0.16 -0.78 0.08 0.00 -0.39 0.00 0.00 64.86 63.60 3ksk h ILE 176 Cb 2.00 1.00 -0.07 0.00 -3.07 0.00 0.00 36.82 36.68 3ksk h ILE 176 CO 0.21 0.27 -0.07 1.56 -0.69 0.00 0.00 178.15 179.43 3ksk h GLN 177 N 0.48 0.03 -0.01 2.37 4.20 -0.95 -0.99 115.11 120.23 3ksk h GLN 177 Ca 0.12 -0.00 -0.10 0.00 0.06 0.00 0.00 58.65 58.73 3ksk h GLN 177 Cb 0.31 -0.01 -0.01 0.00 0.30 0.00 0.00 27.48 28.07 3ksk h GLN 177 CO 0.00 0.02 -0.47 1.49 -0.67 0.00 0.00 178.83 179.20 3ksk h GLU 178 N 0.03 0.03 -0.20 1.46 4.81 -1.41 -1.99 114.58 117.30 3ksk h GLU 178 Ca 0.19 -0.01 -0.06 0.00 -0.13 0.00 0.00 59.36 59.35 3ksk h GLU 178 Cb 0.28 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.66 3ksk h GLU 178 CO -0.38 0.49 -0.10 -0.92 -0.73 0.00 0.00 179.01 177.38 3ksk h TYR 179 N 0.02 0.49 -0.88 0.92 5.03 -0.94 -1.45 116.97 120.17 3ksk h TYR 179 Ca -0.00 -0.12 0.04 0.00 2.58 0.00 0.00 58.73 61.23 3ksk h TYR 179 Cb 0.84 -0.11 -0.05 0.00 1.55 0.00 0.00 36.73 38.95 3ksk h TYR 179 CO 0.00 0.71 0.58 0.37 -1.32 0.00 0.00 178.16 178.50 3ksk h GLN 180 N 0.13 1.04 -0.56 1.82 5.75 -0.99 -0.95 115.11 121.34 3ksk h GLN 180 Ca 0.05 -0.06 -0.11 0.00 -0.15 0.00 0.00 58.65 58.37 3ksk h GLN 180 Cb 0.58 -0.23 -0.02 0.00 1.07 0.00 0.00 27.48 28.88 3ksk h GLN 180 CO 0.03 0.68 -0.10 -0.44 -2.65 0.00 0.00 178.83 176.36 3ksk h ASP 181 N 1.07 1.05 -0.66 -0.69 3.45 -1.04 -1.98 116.42 117.61 3ksk h ASP 181 Ca 0.36 -0.35 0.04 0.00 0.43 0.00 0.00 57.03 57.51 3ksk h ASP 181 Cb 0.08 -0.29 -0.05 0.00 -0.56 0.00 0.00 39.33 38.52 3ksk h ASP 181 CO -0.12 1.15 0.40 0.25 -1.57 0.00 0.00 179.24 179.35 3ksk h LEU 182 N 0.94 0.63 -0.23 1.55 5.85 -0.64 -0.85 115.31 122.56 3ksk h LEU 182 Ca 0.15 0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.87 3ksk h LEU 182 Cb 0.67 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.57 3ksk h LEU 182 CO 0.05 0.43 0.12 0.00 -0.34 0.00 0.00 178.44 178.69 3ksk h ALA 183 N 1.31 0.30 -0.41 1.25 0.00 -0.85 -2.77 119.26 118.09 3ksk h ALA 183 Ca 0.28 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.11 3ksk h ALA 183 Cb 0.08 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 3ksk h ALA 183 CO -0.13 -0.16 0.22 -0.07 0.00 0.00 0.00 179.25 179.11 3ksk h LEU 184 N 0.25 0.49 -1.90 0.00 3.38 -1.15 -0.59 115.31 115.78 3ksk h LEU 184 Ca 0.08 -0.03 -0.02 0.00 0.09 0.00 0.00 57.88 58.00 3ksk h LEU 184 Cb 0.09 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 40.71 3ksk h LEU 184 CO -0.01 0.40 -0.10 0.50 0.09 0.00 0.00 178.44 179.32 3ksk h LYS 185 N 0.56 0.00 -0.36 1.13 3.64 -0.88 -2.73 116.57 117.93 3ksk h LYS 185 Ca 0.15 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.53 3ksk h LYS 185 Cb 0.02 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.84 3ksk h LYS 185 CO -0.02 0.10 0.00 0.72 -2.27 0.00 0.00 179.45 177.97 3ksk n HIS 186 N -3.46 1.20 -1.02 1.91 8.25 -0.35 -4.99 115.22 116.77 3ksk n HIS 186 Ca -0.01 -0.79 -0.01 0.00 -0.26 0.00 0.00 57.72 56.65 3ksk n HIS 186 Cb 0.25 -0.33 -0.00 0.00 1.12 0.00 0.00 29.99 31.02 3ksk n HIS 186 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3ksk n GLY 187 N -0.06 0.45 3.42 -1.41 0.00 -0.95 -4.55 105.19 102.09 3ksk n GLY 187 Ca 0.22 -0.82 -0.38 0.00 0.00 0.00 0.00 46.02 45.05 3ksk n GLY 187 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3ksk s ILE 188 N -2.01 4.36 0.26 -0.61 1.01 -0.52 -4.98 121.20 118.71 3ksk s ILE 188 Ca 0.00 -0.40 0.02 0.00 0.00 0.00 0.00 60.65 60.27 3ksk s ILE 188 Cb 0.00 -3.17 0.04 0.00 0.01 0.00 0.00 42.46 39.34 3ksk s ILE 188 CO 0.00 0.16 1.68 0.78 0.00 0.00 0.00 174.94 177.56 3ksk h ASN 189 N 8.29 0.48 -2.43 3.58 4.21 -1.94 -3.08 115.58 124.69 3ksk h ASN 189 Ca -0.34 -0.19 -0.19 0.00 1.21 0.00 0.00 56.30 56.80 3ksk h ASN 189 Cb 1.15 -0.13 -0.31 0.00 -1.12 0.00 0.00 38.32 37.91 3ksk h ASN 189 CO 0.60 0.78 -0.50 -0.62 -1.29 0.00 0.00 177.43 176.40 3ksk s ASP 190 N -6.83 0.37 0.57 5.81 3.68 -1.26 -4.89 116.67 114.12 3ksk s ASP 190 Ca -0.07 0.42 0.35 0.00 2.13 0.00 0.00 52.55 55.39 3ksk s ASP 190 Cb 0.13 0.91 1.68 0.00 -1.45 0.00 0.00 42.92 44.20 3ksk s ASP 190 CO 0.80 -0.27 2.11 0.16 0.13 0.00 0.00 175.17 178.10 3ksk h ILE 191 N 6.24 0.15 -0.38 4.11 3.07 -1.87 -3.15 117.51 125.68 3ksk h ILE 191 Ca -0.17 -0.40 0.00 0.00 1.55 0.00 0.00 64.86 65.85 3ksk h ILE 191 Cb 1.13 1.34 0.00 0.00 -0.27 0.00 0.00 36.82 39.02 3ksk h ILE 191 CO 0.20 0.04 0.00 0.49 -1.05 0.00 0.00 178.15 177.83 3ksk n PHE 192 N -3.22 0.49 -4.23 0.16 3.72 -1.26 -1.53 117.46 111.60 3ksk n PHE 192 Ca -0.01 -0.25 -0.20 0.00 -0.05 0.00 0.00 57.45 56.94 3ksk n PHE 192 Cb 0.23 0.00 -0.12 0.00 -0.94 0.00 0.00 39.48 38.65 3ksk n PHE 192 CO 0.00 0.00 0.00 -0.65 -0.05 0.00 0.00 176.76 176.06 3ksk s GLN 193 N -1.51 0.97 -1.55 -1.08 -1.52 -1.19 -1.72 119.66 112.06 3ksk s GLN 193 Ca 0.39 -1.10 -0.13 0.00 -1.95 0.00 0.00 55.36 52.56 3ksk s GLN 193 Cb 0.23 -1.03 0.09 0.00 -0.22 0.00 0.00 33.01 32.08 3ksk s GLN 193 CO 0.32 0.22 0.91 -0.25 -0.25 0.00 0.00 175.29 176.24 3ksk n ASP 194 N 1.01 -4.10 -2.17 5.90 8.00 -1.26 -1.17 116.55 122.76 3ksk n ASP 194 Ca -0.19 -0.84 -0.17 0.00 0.71 0.00 0.00 54.79 54.30 3ksk n ASP 194 Cb 0.55 -3.63 -0.03 0.00 -0.02 0.00 0.00 41.12 37.99 3ksk n ASP 194 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 3ksk n ASN 195 N -2.82 -4.86 -0.30 -2.24 3.02 -0.76 -4.88 115.26 102.42 3ksk n ASN 195 Ca 0.01 0.17 0.09 0.00 -0.03 0.00 0.00 54.58 54.83 3ksk n ASN 195 Cb 0.53 -4.15 0.25 0.00 -0.61 0.00 0.00 39.78 35.80 3ksk n ASN 195 CO 0.00 0.00 0.00 1.23 -2.62 0.00 0.00 177.26 175.87 3ksk h GLY 196 N 0.00 1.42 2.00 7.41 0.00 -1.18 -0.02 103.07 112.71 3ksk h GLY 196 Ca -0.39 -0.21 -0.00 0.00 0.00 0.00 0.00 47.33 46.72 3ksk h GLY 196 CO 0.48 -0.13 -0.02 -1.33 0.00 0.00 0.00 176.54 175.55 3ksk h GLY 197 N 0.53 0.00 0.00 4.60 0.00 -1.53 -2.36 103.07 104.31 3ksk h GLY 197 Ca 0.50 0.00 -0.14 0.00 0.00 0.00 0.00 47.33 47.69 3ksk h GLY 197 CO -0.43 0.00 -0.76 0.50 0.00 0.00 0.00 176.54 175.85 3ksk h LYS 198 N 0.00 0.00 -0.78 4.80 1.57 -1.38 -3.33 116.57 117.46 3ksk h LYS 198 Ca -0.00 -0.00 0.16 0.00 -1.87 0.00 0.00 60.65 58.94 3ksk h LYS 198 Cb 0.60 0.00 -0.11 0.00 0.08 0.00 0.00 32.23 32.81 3ksk h LYS 198 CO 0.00 1.00 0.28 1.25 -0.57 0.00 0.00 179.45 181.41 3ksk h LEU 199 N -1.00 0.21 -0.67 2.94 5.85 -1.04 0.16 115.31 121.75 3ksk h LEU 199 Ca -0.21 0.13 0.10 0.00 0.84 0.00 0.00 57.88 58.74 3ksk h LEU 199 Cb 1.18 0.13 -0.07 0.00 0.37 0.00 0.00 40.66 42.27 3ksk h LEU 199 CO -0.13 0.04 0.30 0.25 -0.34 0.00 0.00 178.44 178.57 3ksk h LEU 200 N 0.38 0.36 -0.65 2.25 5.85 -1.57 0.41 115.31 122.34 3ksk h LEU 200 Ca 0.44 0.07 0.05 0.00 0.84 0.00 0.00 57.88 59.29 3ksk h LEU 200 Cb 0.73 0.02 -0.05 0.00 0.37 0.00 0.00 40.66 41.73 3ksk h LEU 200 CO -0.46 0.20 0.36 1.56 -0.34 0.00 0.00 178.44 179.76 3ksk h GLN 201 N 0.52 0.66 -0.72 1.25 4.20 -0.81 -0.24 115.11 119.97 3ksk h GLN 201 Ca 0.34 -0.04 -0.02 0.00 0.06 0.00 0.00 58.65 58.99 3ksk h GLN 201 Cb 0.39 -0.15 -0.03 0.00 0.30 0.00 0.00 27.48 27.99 3ksk h GLN 201 CO -0.29 0.43 0.37 0.28 -0.67 0.00 0.00 178.83 178.95 3ksk h VAL 202 N 0.68 1.22 -0.10 -0.54 2.07 -0.42 -0.75 116.25 118.40 3ksk h VAL 202 Ca 0.29 -0.58 -0.22 0.00 0.82 0.00 0.00 66.70 67.00 3ksk h VAL 202 Cb 0.16 0.28 0.01 0.00 -1.52 0.00 0.00 31.29 30.22 3ksk h VAL 202 CO -0.17 0.25 -0.81 -0.07 0.02 0.00 0.00 177.57 176.80 3ksk h LEU 203 N 1.01 0.89 -0.45 2.57 3.38 -0.74 -0.69 115.31 121.27 3ksk h LEU 203 Ca 0.25 -0.66 -0.04 0.00 0.09 0.00 0.00 57.88 57.51 3ksk h LEU 203 Cb 0.06 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.53 3ksk h LEU 203 CO -0.04 1.42 0.11 -0.07 0.09 0.00 0.00 178.44 179.95 3ksk h LEU 204 N 0.43 0.69 0.25 1.67 3.38 -0.80 -0.14 115.31 120.79 3ksk h LEU 204 Ca -0.07 -0.23 -0.01 0.00 0.09 0.00 0.00 57.88 57.65 3ksk h LEU 204 Cb 1.45 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 42.02 3ksk h LEU 204 CO 0.16 0.75 -0.12 0.40 0.09 0.00 0.00 178.44 179.72 3ksk h ILE 205 N 0.60 0.78 0.00 1.22 2.04 -1.14 -3.28 117.51 117.73 3ksk h ILE 205 Ca 0.14 -0.15 -0.07 0.00 1.00 0.00 0.00 64.86 65.78 3ksk h ILE 205 Cb 0.33 0.87 -0.01 0.00 -0.74 0.00 0.00 36.82 37.26 3ksk h ILE 205 CO 0.00 0.03 -0.34 0.71 0.00 0.00 0.00 178.15 178.56 3ksk h THR 206 N -0.41 0.63 0.00 -0.27 1.35 -1.14 -3.47 112.91 109.60 3ksk h THR 206 Ca -0.03 -1.69 0.00 0.00 -0.55 0.00 0.00 66.41 64.14 3ksk h THR 206 Cb 0.31 2.16 0.00 0.00 -1.73 0.00 0.00 68.15 68.89 3ksk h THR 206 CO 0.06 0.33 0.00 0.61 -0.25 0.00 0.00 175.52 176.27 3ksk n GLY 207 N 0.88 0.49 3.81 5.82 0.00 -0.08 -5.04 105.19 111.08 3ksk n GLY 207 Ca 0.02 -0.54 -0.34 0.00 0.00 0.00 0.00 46.02 45.16 3ksk n GLY 207 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3ksk s LEU 208 N 0.00 3.94 -0.12 0.99 1.43 -1.16 -4.53 118.68 119.24 3ksk s LEU 208 Ca 0.00 1.80 0.02 0.00 -1.03 0.00 0.00 54.13 54.92 3ksk s LEU 208 Cb 0.00 -4.50 -0.01 0.00 0.03 0.00 0.00 46.19 41.72 3ksk s LEU 208 CO 0.00 -0.50 -0.18 -0.89 0.23 0.00 0.00 176.35 175.01 3ksk s THR 209 N -2.05 2.59 0.50 5.49 2.01 -0.26 -4.82 115.64 119.11 3ksk s THR 209 Ca 0.63 -0.83 -0.21 0.00 0.31 0.00 0.00 61.69 61.59 3ksk s THR 209 Cb -0.13 -2.05 -0.07 0.00 0.01 0.00 0.00 72.50 70.26 3ksk s THR 209 CO 0.17 0.54 1.13 0.54 -0.69 0.00 0.00 174.62 176.31 3ksk s VAL 210 N 0.36 3.24 -0.26 3.82 0.11 -1.26 -0.28 120.40 126.12 3ksk s VAL 210 Ca -0.14 0.83 -0.08 0.00 -2.93 0.00 0.00 61.98 59.66 3ksk s VAL 210 Cb -0.17 -3.37 -0.02 0.00 -1.53 0.00 0.00 36.38 31.29 3ksk s VAL 210 CO 0.07 -0.11 0.09 -0.76 -3.33 0.00 0.00 175.10 171.06 3ksk s LEU 211 N -3.46 3.61 0.18 2.54 1.43 -0.73 -4.86 118.68 117.39 3ksk s LEU 211 Ca 0.69 -0.29 -0.33 0.00 -1.03 0.00 0.00 54.13 53.16 3ksk s LEU 211 Cb -0.24 -1.94 -0.14 0.00 0.03 0.00 0.00 46.19 43.90 3ksk s LEU 211 CO 0.29 -0.08 1.55 -2.65 0.23 0.00 0.00 176.35 175.69 3ksk n PRO 212 N 4.94 2.15 -4.25 1.29 -0.02 -1.26 -4.83 135.00 133.02 3ksk n PRO 212 Ca -0.16 0.77 -0.27 0.00 -2.02 0.00 0.00 63.50 61.83 3ksk n PRO 212 Cb 0.51 -2.52 -0.09 0.00 -0.02 0.00 0.00 33.50 31.38 3ksk n PRO 212 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 3ksk s GLY 213 N 0.78 1.74 0.00 -1.23 0.00 -1.26 -5.05 107.32 102.30 3ksk s GLY 213 Ca 0.76 -1.40 0.00 0.00 0.00 0.00 0.00 44.72 44.08 3ksk s GLY 213 CO 0.40 -1.42 0.00 0.61 0.00 0.00 0.00 173.10 172.69 3ksk n GLY 216 N 0.05 -1.79 3.85 0.20 0.00 -1.26 -5.28 105.19 100.95 3ksk n GLY 216 Ca -0.11 -1.35 -0.29 0.00 0.00 0.00 0.00 46.02 44.27 3ksk n GLY 216 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3ksk s ASN 217 N -4.00 4.36 0.07 1.61 0.02 -1.26 -5.01 114.94 110.72 3ksk s ASN 217 Ca 0.00 0.99 0.02 0.00 -1.02 0.00 0.00 52.86 52.85 3ksk s ASN 217 Cb 0.00 -1.61 -0.25 0.00 0.02 0.00 0.00 41.25 39.41 3ksk s ASN 217 CO 0.00 -2.02 1.09 0.44 0.02 0.00 0.00 177.10 176.64 3ksk h ASP 218 N -1.13 0.22 -5.11 -1.22 3.32 -1.05 -3.42 116.42 108.03 3ksk h ASP 218 Ca -0.47 -0.26 -0.02 0.00 0.02 0.00 0.00 57.03 56.30 3ksk h ASP 218 Cb 1.31 -0.07 -0.10 0.00 0.22 0.00 0.00 39.33 40.69 3ksk h ASP 218 CO 0.63 1.21 0.01 0.00 -1.72 0.00 0.00 179.24 179.37 3ksk s ALA 219 N -2.66 -0.81 -0.01 3.45 0.00 -1.00 -1.77 121.76 118.95 3ksk s ALA 219 Ca -0.03 -0.36 -0.03 0.00 0.00 0.00 0.00 51.96 51.54 3ksk s ALA 219 Cb 0.08 0.89 -0.00 0.00 0.00 0.00 0.00 23.12 24.09 3ksk s ALA 219 CO 0.85 -0.83 0.06 0.54 0.00 0.00 0.00 175.76 176.38 3ksk s VAL 220 N -3.90 0.04 0.38 0.00 0.11 0.61 -0.44 120.40 117.20 3ksk s VAL 220 Ca 0.12 -0.32 0.00 0.00 -2.93 0.00 0.00 61.98 58.85 3ksk s VAL 220 Cb -0.01 -0.19 0.08 0.00 -1.53 0.00 0.00 36.38 34.72 3ksk s VAL 220 CO 0.00 -0.18 0.52 -0.90 -3.33 0.00 0.00 175.10 171.22 3ksk n ASP 221 N 2.46 0.73 -0.19 3.54 3.85 0.27 -1.10 116.55 126.10 3ksk n ASP 221 Ca -0.17 -1.61 -0.08 0.00 -0.71 0.00 0.00 54.79 52.22 3ksk n ASP 221 Cb 0.58 -0.34 0.02 0.00 -1.35 0.00 0.00 41.12 40.03 3ksk n ASP 221 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 177.20 176.97 3ksk h ASN 222 N -0.30 0.78 0.12 -1.12 -0.26 -1.90 -2.70 115.58 110.19 3ksk h ASN 222 Ca -0.17 -0.19 0.00 0.00 -0.56 0.00 0.00 56.30 55.38 3ksk h ASN 222 Cb 0.65 -0.20 0.00 0.00 -1.06 0.00 0.00 38.32 37.70 3ksk h ASN 222 CO 0.19 0.76 0.00 0.00 -1.06 0.00 0.00 177.43 177.32 3ksk n ALA 223 N -2.37 1.14 0.00 -0.83 0.00 -1.26 -4.85 120.51 112.34 3ksk n ALA 223 Ca 0.03 0.18 0.00 0.00 0.00 0.00 0.00 53.44 53.64 3ksk n ALA 223 Cb 0.18 -1.32 0.00 0.00 0.00 0.00 0.00 19.45 18.31 3ksk n ALA 223 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3ksk n GLY 224 N -1.10 0.63 3.74 0.00 0.00 -1.02 -5.08 105.19 102.36 3ksk n GLY 224 Ca -0.01 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.60 3ksk n GLY 224 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3ksk s GLN 225 N -0.95 4.57 0.29 1.61 2.00 -1.26 -4.80 119.66 121.12 3ksk s GLN 225 Ca 0.00 1.76 0.07 0.00 -2.00 0.00 0.00 55.36 55.19 3ksk s GLN 225 Cb 0.00 -3.27 -0.03 0.00 0.80 0.00 0.00 33.01 30.51 3ksk s GLN 225 CO 0.00 0.04 0.28 -1.21 -0.50 0.00 0.00 175.29 173.89 3ksk s GLU 226 N -0.37 2.93 0.04 1.67 2.02 -1.26 -0.57 118.70 123.17 3ksk s GLU 226 Ca 0.50 -1.10 -0.13 0.00 0.02 0.00 0.00 54.97 54.26 3ksk s GLU 226 Cb -0.30 -2.60 0.02 0.00 0.10 0.00 0.00 34.13 31.35 3ksk s GLU 226 CO 0.35 0.27 0.28 0.71 0.02 0.00 0.00 175.26 176.89 3ksk s TYR 227 N -2.18 -0.07 0.06 1.61 2.02 0.41 -4.19 117.35 115.01 3ksk s TYR 227 Ca 0.37 -0.08 -0.14 0.00 -0.37 0.00 0.00 57.07 56.85 3ksk s TYR 227 Cb -0.07 0.07 -0.06 0.00 -0.40 0.00 0.00 41.96 41.50 3ksk s TYR 227 CO 0.27 -0.49 0.46 -1.21 -1.57 0.00 0.00 175.55 173.00 3ksk s GLU 228 N -2.55 3.92 -0.17 -0.62 0.41 -1.07 -0.39 118.70 118.24 3ksk s GLU 228 Ca -0.05 0.41 -0.01 0.00 -0.41 0.00 0.00 54.97 54.90 3ksk s GLU 228 Cb -0.01 -3.10 0.05 0.00 -1.78 0.00 0.00 34.13 29.29 3ksk s GLU 228 CO -0.03 0.61 -0.02 -1.17 -0.49 0.00 0.00 175.26 174.15 3ksk s LEU 229 N -1.49 1.44 0.21 1.80 2.96 -1.26 0.32 118.68 122.65 3ksk s LEU 229 Ca 0.30 -0.68 0.11 0.00 -0.22 0.00 0.00 54.13 53.64 3ksk s LEU 229 Cb -0.16 -0.78 -0.05 0.00 0.50 0.00 0.00 46.19 45.70 3ksk s LEU 229 CO 0.16 -0.23 -0.23 -0.54 -1.32 0.00 0.00 176.35 174.20 3ksk s LYS 230 N 1.72 1.54 0.07 1.98 -0.14 0.47 -4.96 119.74 120.41 3ksk s LYS 230 Ca 0.00 -1.56 -0.09 0.00 -1.36 0.00 0.00 55.97 52.96 3ksk s LYS 230 Cb -0.16 -1.81 0.00 0.00 -1.68 0.00 0.00 37.83 34.18 3ksk s LYS 230 CO -0.07 0.38 0.19 -1.54 -0.76 0.00 0.00 175.35 173.55 3ksk s SER 231 N -2.82 0.09 0.06 2.83 1.04 -1.26 -0.17 113.70 113.47 3ksk s SER 231 Ca 0.22 -0.54 -0.06 0.00 0.48 0.00 0.00 55.95 56.06 3ksk s SER 231 Cb -0.07 0.32 -0.01 0.00 0.10 0.00 0.00 66.02 66.35 3ksk s SER 231 CO 0.11 -0.66 0.10 0.27 0.98 0.00 0.00 173.24 174.04 3ksk s ILE 232 N -3.32 0.16 -0.51 -1.02 -4.36 -0.41 -4.69 121.20 107.05 3ksk s ILE 232 Ca 0.01 -1.30 -0.18 0.00 -0.26 0.00 0.00 60.65 58.92 3ksk s ILE 232 Cb 0.02 -1.21 0.07 0.00 1.25 0.00 0.00 42.46 42.60 3ksk s ILE 232 CO -0.08 -0.72 0.56 0.20 0.24 0.00 0.00 174.94 175.14 3ksk s ASN 233 N -2.58 6.20 0.53 4.36 -0.87 -1.26 -0.64 114.94 120.68 3ksk s ASN 233 Ca 0.01 -1.12 0.19 0.00 -1.57 0.00 0.00 52.86 50.37 3ksk s ASN 233 Cb 0.03 -2.26 1.32 0.00 -0.02 0.00 0.00 41.25 40.33 3ksk s ASN 233 CO -0.08 -0.84 2.11 -0.29 -2.57 0.00 0.00 177.10 175.43 3ksk h ILE 234 N 5.84 0.91 0.00 0.60 2.10 -1.23 0.33 117.51 126.06 3ksk h ILE 234 Ca -0.28 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.66 3ksk h ILE 234 Cb 1.10 0.93 0.00 0.00 -1.09 0.00 0.00 36.82 37.76 3ksk h ILE 234 CO 0.96 0.00 0.00 -0.90 -1.08 0.00 0.00 178.15 177.13 3ksk n ASP 235 N -4.47 0.00 -0.01 2.19 5.68 -1.26 -3.26 116.55 115.42 3ksk n ASP 235 Ca 0.00 -0.46 -0.01 0.00 -0.50 0.00 0.00 54.79 53.82 3ksk n ASP 235 Cb 0.22 -0.15 -0.02 0.00 -1.14 0.00 0.00 41.12 40.03 3ksk n ASP 235 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 3ksk n LEU 236 N -1.15 0.34 -3.79 -2.12 4.32 0.96 -5.09 117.00 110.47 3ksk n LEU 236 Ca 0.16 -0.00 -0.10 0.00 -0.02 0.00 0.00 56.01 56.06 3ksk n LEU 236 Cb 0.15 0.04 -0.06 0.00 -1.62 0.00 0.00 43.42 41.94 3ksk n LEU 236 CO 0.18 0.12 0.06 0.28 -1.22 0.00 0.00 177.39 176.80 3ksk s THR 237 N -2.06 0.09 -0.01 -5.08 -1.32 -0.03 -5.05 115.64 102.17 3ksk s THR 237 Ca -0.02 -0.97 0.01 0.00 -1.21 0.00 0.00 61.69 59.51 3ksk s THR 237 Cb 0.01 -1.42 0.02 0.00 -1.51 0.00 0.00 72.50 69.59 3ksk s THR 237 CO 0.10 -0.39 0.95 0.29 -2.21 0.00 0.00 174.62 173.36 3ksk n LYS 238 N -0.19 2.49 -4.53 7.08 4.76 -1.26 -4.15 118.16 122.35 3ksk n LYS 238 Ca -0.13 -1.45 -0.22 0.00 -2.87 0.00 0.00 58.31 53.64 3ksk n LYS 238 Cb 0.63 -0.97 -0.16 0.00 -1.84 0.00 0.00 35.03 32.70 3ksk n LYS 238 CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 3ksk s GLY 239 N -1.01 0.65 0.20 0.72 0.00 -1.26 -0.81 107.32 105.81 3ksk s GLY 239 Ca 0.02 -0.46 -0.29 0.00 0.00 0.00 0.00 44.72 43.99 3ksk s GLY 239 CO 0.00 -0.20 0.93 -1.36 0.00 0.00 0.00 173.10 172.46 3ksk s PHE 240 N 0.09 3.94 0.55 1.90 0.08 0.69 -4.86 117.98 120.38 3ksk s PHE 240 Ca -0.02 1.86 -0.15 0.00 0.12 0.00 0.00 56.93 58.74 3ksk s PHE 240 Cb -0.09 -2.97 -0.06 0.00 -0.57 0.00 0.00 43.02 39.33 3ksk s PHE 240 CO 0.01 0.41 1.01 -1.12 -0.10 0.00 0.00 175.22 175.43 3ksk s SER 241 N -0.91 6.36 0.00 1.36 0.01 -1.26 -1.98 113.70 117.28 3ksk s SER 241 Ca 0.42 1.59 0.00 0.00 1.31 0.00 0.00 55.95 59.26 3ksk s SER 241 Cb -0.25 -2.51 0.00 0.00 0.21 0.00 0.00 66.02 63.47 3ksk s SER 241 CO 0.31 -0.77 0.00 0.35 0.41 0.00 0.00 173.24 173.54 3ksk n THR 242 N -1.93 0.00 -3.64 1.44 -2.24 -1.25 -4.89 114.28 101.77 3ksk n THR 242 Ca 0.07 0.00 -0.09 0.00 -2.27 0.00 0.00 64.05 61.76 3ksk n THR 242 Cb 0.54 -0.46 -0.07 0.00 -2.10 0.00 0.00 70.33 68.24 3ksk n THR 242 CO 0.00 0.00 0.00 -2.28 -0.57 0.00 0.00 175.07 172.22 3ksk s HIS 243 N -0.50 -0.96 0.25 4.78 2.46 -1.26 -5.03 115.29 115.02 3ksk s HIS 243 Ca 0.00 2.03 0.32 0.00 0.47 0.00 0.00 55.06 57.88 3ksk s HIS 243 Cb 0.00 0.51 1.44 0.00 -0.13 0.00 0.00 32.58 34.40 3ksk s HIS 243 CO 0.00 -0.48 2.02 0.45 -2.47 0.00 0.00 174.74 174.27 3ksk h HIS 244 N 6.41 0.00 -2.13 3.88 3.86 -1.91 0.96 115.15 126.23 3ksk h HIS 244 Ca -0.30 0.00 -0.56 0.00 -1.16 0.00 0.00 60.37 58.35 3ksk h HIS 244 Cb 1.21 0.00 -0.41 0.00 1.06 0.00 0.00 27.41 29.27 3ksk h HIS 244 CO 0.16 0.07 -0.87 0.72 0.86 0.00 0.00 177.93 178.87 3ksk n HIS 245 N -3.26 2.01 -2.08 2.45 8.25 -1.23 -3.78 115.22 117.58 3ksk n HIS 245 Ca -0.00 -3.90 -0.42 0.00 -0.26 0.00 0.00 57.72 53.14 3ksk n HIS 245 Cb 0.29 -0.46 -0.03 0.00 1.12 0.00 0.00 29.99 30.91 3ksk n HIS 245 CO 0.00 0.00 0.00 1.41 0.64 0.00 0.00 176.34 178.39 3ksk s MET 246 N -2.43 4.29 0.26 -0.41 0.00 0.23 -4.72 119.30 116.52 3ksk s MET 246 Ca 0.41 2.18 -0.21 0.00 0.00 0.00 0.00 55.69 58.08 3ksk s MET 246 Cb 0.24 -3.20 0.04 0.00 0.00 0.00 0.00 34.83 31.91 3ksk s MET 246 CO -0.08 -0.48 0.82 0.54 0.00 0.00 0.00 175.02 175.82 3ksk s ASN 247 N 1.01 -0.16 0.60 1.11 6.03 -1.26 -0.32 114.94 121.94 3ksk s ASN 247 Ca 0.65 -0.69 0.29 0.00 -1.03 0.00 0.00 52.86 52.09 3ksk s ASN 247 Cb -0.39 0.68 1.50 0.00 -3.03 0.00 0.00 41.25 40.01 3ksk s ASN 247 CO 0.32 -1.29 1.91 -0.65 -2.03 0.00 0.00 177.10 175.37 3ksk h PRO 248 N 2.00 0.00 -0.02 3.55 0.11 -1.94 -2.43 132.00 133.27 3ksk h PRO 248 Ca -0.24 0.00 -0.14 0.00 0.11 0.00 0.00 66.00 65.73 3ksk h PRO 248 Cb 1.24 0.00 0.01 0.00 0.11 0.00 0.00 31.00 32.36 3ksk h PRO 248 CO 0.29 0.00 -0.53 0.28 -0.21 0.00 0.00 178.00 177.83 3ksk h VAL 249 N 0.00 1.44 -0.99 3.15 2.07 -1.96 -2.38 116.25 117.58 3ksk h VAL 249 Ca 0.18 -2.01 0.01 0.00 0.82 0.00 0.00 66.70 65.70 3ksk h VAL 249 Cb 1.07 2.56 -0.05 0.00 -1.52 0.00 0.00 31.29 33.34 3ksk h VAL 249 CO -0.00 0.58 0.65 0.40 0.02 0.00 0.00 177.57 179.22 3ksk h ILE 250 N -0.13 1.25 -0.50 4.57 2.04 -1.83 -2.86 117.51 120.05 3ksk h ILE 250 Ca -0.06 -0.46 -0.04 0.00 1.00 0.00 0.00 64.86 65.30 3ksk h ILE 250 Cb 1.23 -0.20 -0.02 0.00 -0.74 0.00 0.00 36.82 37.09 3ksk h ILE 250 CO 0.10 0.24 0.17 0.40 0.00 0.00 0.00 178.15 179.07 3ksk h ILE 251 N 1.34 1.22 -0.19 -0.67 2.04 -1.47 -1.67 117.51 118.11 3ksk h ILE 251 Ca 0.36 -0.73 -0.02 0.00 1.00 0.00 0.00 64.86 65.46 3ksk h ILE 251 Cb -0.16 0.76 -0.01 0.00 -0.74 0.00 0.00 36.82 36.68 3ksk h ILE 251 CO -0.08 0.27 0.00 0.00 0.00 0.00 0.00 178.15 178.35 3ksk h ALA 252 N 1.02 1.66 0.12 1.87 0.00 -1.20 -0.71 119.26 122.03 3ksk h ALA 252 Ca 0.16 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 3ksk h ALA 252 Cb 0.25 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.95 3ksk h ALA 252 CO -0.01 0.26 -0.06 0.87 0.00 0.00 0.00 179.25 180.31 3ksk h LYS 253 N 0.27 -0.15 -0.56 0.00 6.56 -1.37 -3.36 116.57 117.95 3ksk h LYS 253 Ca 0.06 0.01 0.11 0.00 -1.06 0.00 0.00 60.65 59.78 3ksk h LYS 253 Cb 0.18 0.04 -0.09 0.00 -0.57 0.00 0.00 32.23 31.78 3ksk h LYS 253 CO 0.00 0.28 0.04 1.88 -2.06 0.00 0.00 179.45 179.59 3ksk h TYR 254 N -0.65 0.04 0.00 -1.35 0.99 -0.97 -2.68 116.97 112.34 3ksk h TYR 254 Ca -0.02 0.04 0.00 0.00 2.00 0.00 0.00 58.73 60.75 3ksk h TYR 254 Cb 0.50 0.07 0.00 0.00 1.00 0.00 0.00 36.73 38.30 3ksk h TYR 254 CO 0.08 -0.10 0.00 -2.13 -0.00 0.00 0.00 178.16 176.00 3ksk n ARG 255 N -5.21 0.01 0.00 4.88 0.63 -0.30 -2.20 116.66 114.46 3ksk n ARG 255 Ca 0.07 0.41 0.11 0.00 -0.92 0.00 0.00 57.85 57.53 3ksk n ARG 255 Cb 0.31 -1.50 0.07 0.00 0.45 0.00 0.00 32.46 31.79 3ksk n ARG 255 CO 0.00 0.00 0.00 1.04 -2.51 0.00 0.00 177.63 176.16 3ksk n GLN 256 N -1.43 0.17 -4.23 -0.14 6.02 -1.01 -4.80 117.38 111.96 3ksk n GLN 256 Ca 0.00 -0.13 -0.17 0.00 -0.01 0.00 0.00 57.00 56.70 3ksk n GLN 256 Cb 0.01 -1.50 -0.11 0.00 1.02 0.00 0.00 30.24 29.67 3ksk n GLN 256 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 177.06 176.19 3ksk s VAL 257 N -2.91 1.25 0.60 5.09 -7.23 -0.94 -5.02 120.40 111.24 3ksk s VAL 257 Ca 0.11 -1.77 -0.17 0.00 -1.81 0.00 0.00 61.98 58.34 3ksk s VAL 257 Cb 0.17 -1.56 -0.03 0.00 0.56 0.00 0.00 36.38 35.52 3ksk s VAL 257 CO 0.75 -0.50 1.10 -2.84 -0.31 0.00 0.00 175.10 173.30 3ksk s PRO 258 N -2.89 3.11 -0.09 4.82 0.02 -1.26 -4.23 135.00 134.48 3ksk s PRO 258 Ca 0.10 1.42 -0.04 0.00 0.02 0.00 0.00 61.00 62.50 3ksk s PRO 258 Cb -0.03 -1.99 -0.04 0.00 0.02 0.00 0.00 34.50 32.46 3ksk s PRO 258 CO 0.02 -1.01 0.08 -1.58 -0.33 0.00 0.00 177.00 174.18 3ksk s TRP 259 N -2.17 3.38 -0.13 6.54 0.52 -0.16 -2.59 118.94 124.33 3ksk s TRP 259 Ca 0.68 0.35 -0.03 0.00 0.02 0.00 0.00 56.10 57.12 3ksk s TRP 259 Cb -0.21 -1.85 -0.03 0.00 -1.15 0.00 0.00 33.47 30.23 3ksk s TRP 259 CO 0.35 0.61 -0.02 0.42 0.02 0.00 0.00 176.95 178.33 3ksk s ILE 260 N -1.00 4.11 -0.24 2.03 -1.09 0.15 -2.20 121.20 122.95 3ksk s ILE 260 Ca 0.16 -0.30 0.01 0.00 -2.23 0.00 0.00 60.65 58.29 3ksk s ILE 260 Cb -0.12 -2.77 0.06 0.00 -1.58 0.00 0.00 42.46 38.05 3ksk s ILE 260 CO 0.05 0.53 -0.07 -0.36 -1.23 0.00 0.00 174.94 173.87 3ksk s PHE 261 N -0.11 2.56 -0.18 3.97 0.40 -0.20 -0.40 117.98 124.02 3ksk s PHE 261 Ca 0.03 -1.85 -0.09 0.00 -0.60 0.00 0.00 56.93 54.42 3ksk s PHE 261 Cb -0.13 -1.64 -0.05 0.00 0.51 0.00 0.00 43.02 41.71 3ksk s PHE 261 CO 0.02 -0.79 0.12 0.00 0.70 0.00 0.00 175.22 175.27 3ksk s ALA 262 N 1.34 3.70 -0.26 5.36 0.00 0.76 -1.85 121.76 130.80 3ksk s ALA 262 Ca -0.06 -0.69 0.01 0.00 0.00 0.00 0.00 51.96 51.22 3ksk s ALA 262 Cb -0.19 -2.09 0.05 0.00 0.00 0.00 0.00 23.12 20.89 3ksk s ALA 262 CO -0.06 0.27 -0.08 0.42 0.00 0.00 0.00 175.76 176.31 3ksk s ILE 263 N 0.02 2.46 -0.02 0.00 1.01 0.70 -1.28 121.20 124.08 3ksk s ILE 263 Ca 0.09 -1.45 -0.04 0.00 0.00 0.00 0.00 60.65 59.24 3ksk s ILE 263 Cb -0.11 -2.39 -0.04 0.00 0.01 0.00 0.00 42.46 39.93 3ksk s ILE 263 CO -0.00 0.02 0.20 -0.31 0.00 0.00 0.00 174.94 174.84 3ksk s TYR 264 N 1.18 3.57 -0.12 3.97 2.02 0.19 -0.06 117.35 128.09 3ksk s TYR 264 Ca -0.06 0.45 -0.01 0.00 -0.37 0.00 0.00 57.07 57.07 3ksk s TYR 264 Cb -0.19 -1.89 0.04 0.00 -0.40 0.00 0.00 41.96 39.51 3ksk s TYR 264 CO -0.04 0.65 -0.01 0.50 -1.57 0.00 0.00 175.55 175.07 3ksk s ARG 265 N -1.75 0.93 6.47 -0.62 3.52 -0.07 -1.01 118.95 126.42 3ksk s ARG 265 Ca 0.25 -0.19 0.00 0.00 -0.13 0.00 0.00 55.73 55.66 3ksk s ARG 265 Cb -0.13 -1.53 0.00 0.00 -1.56 0.00 0.00 34.95 31.73 3ksk s ARG 265 CO 0.16 -0.40 0.00 0.41 -0.81 0.00 0.00 175.30 174.66 3ksk n GLY 266 N 5.04 2.27 0.67 8.12 0.00 -1.26 -2.66 105.19 117.37 3ksk n GLY 266 Ca -0.09 -0.42 0.13 0.00 0.00 0.00 0.00 46.02 45.64 3ksk n GLY 266 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 3ksk n ILE 267 N 0.00 0.00 -3.96 -0.61 -5.35 -1.26 -4.95 119.36 103.23 3ksk n ILE 267 Ca 0.00 -0.35 -0.29 0.00 -0.27 0.00 0.00 62.75 61.84 3ksk n ILE 267 Cb 0.00 1.01 -0.04 0.00 -1.74 0.00 0.00 39.64 38.87 3ksk n ILE 267 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3ksk s ALA 268 N -2.11 3.90 -0.23 -1.28 0.00 -1.09 -4.56 121.76 116.40 3ksk s ALA 268 Ca 0.30 -0.96 -0.26 0.00 0.00 0.00 0.00 51.96 51.04 3ksk s ALA 268 Cb 0.20 -1.73 -0.00 0.00 0.00 0.00 0.00 23.12 21.59 3ksk s ALA 268 CO 0.37 0.69 0.89 -1.50 0.00 0.00 0.00 175.76 176.21 3ksk s ILE 269 N -1.60 4.79 -0.09 0.00 1.10 -1.26 -0.89 121.20 123.25 3ksk s ILE 269 Ca 0.34 1.71 -0.07 0.00 -0.51 0.00 0.00 60.65 62.12 3ksk s ILE 269 Cb -0.12 -4.18 -0.28 0.00 0.15 0.00 0.00 42.46 38.04 3ksk s ILE 269 CO 0.27 -0.09 0.50 -0.08 -2.11 0.00 0.00 174.94 173.42 3ksk h GLU 270 N 7.57 0.30 -1.73 3.50 4.81 -0.79 -3.47 114.58 124.78 3ksk h GLU 270 Ca -0.23 -0.51 0.04 0.00 -0.13 0.00 0.00 59.36 58.53 3ksk h GLU 270 Cb 1.09 0.19 -0.21 0.00 0.63 0.00 0.00 28.75 30.44 3ksk h GLU 270 CO 0.90 1.22 0.44 0.00 -0.73 0.00 0.00 179.01 180.84 3ksk s ALA 271 N -2.57 -1.88 -0.04 2.92 0.00 -0.94 -4.31 121.76 114.95 3ksk s ALA 271 Ca -0.19 1.48 0.02 0.00 0.00 0.00 0.00 51.96 53.27 3ksk s ALA 271 Cb 0.06 -0.45 0.01 0.00 0.00 0.00 0.00 23.12 22.74 3ksk s ALA 271 CO 0.80 -0.35 -0.10 0.42 0.00 0.00 0.00 175.76 176.53 3ksk s ILE 272 N -1.23 0.93 0.14 0.00 1.01 -0.19 -0.22 121.20 121.64 3ksk s ILE 272 Ca -0.04 -0.41 0.06 0.00 0.00 0.00 0.00 60.65 60.26 3ksk s ILE 272 Cb -0.00 -0.84 -0.04 0.00 0.01 0.00 0.00 42.46 41.59 3ksk s ILE 272 CO 0.03 0.29 -0.14 -0.31 0.00 0.00 0.00 174.94 174.82 3ksk s TYR 273 N 0.39 1.46 -0.05 3.97 1.51 -0.77 -0.59 117.35 123.27 3ksk s TYR 273 Ca -0.07 -0.57 0.02 0.00 -1.01 0.00 0.00 57.07 55.44 3ksk s TYR 273 Cb -0.12 -0.75 0.01 0.00 -0.11 0.00 0.00 41.96 41.00 3ksk s TYR 273 CO 0.02 0.18 -0.09 0.50 -1.11 0.00 0.00 175.55 175.04 3ksk s ARG 274 N -2.88 1.32 -0.03 -0.62 3.52 0.42 -1.04 118.95 119.64 3ksk s ARG 274 Ca 0.12 -0.30 0.06 0.00 -0.13 0.00 0.00 55.73 55.47 3ksk s ARG 274 Cb -0.04 -1.15 -0.01 0.00 -1.56 0.00 0.00 34.95 32.19 3ksk s ARG 274 CO 0.04 0.01 -0.20 -0.51 -0.81 0.00 0.00 175.30 173.83 3ksk s LEU 275 N 0.65 2.00 0.55 -0.88 1.02 -0.94 -0.32 118.68 120.76 3ksk s LEU 275 Ca -0.12 -0.38 -0.07 0.00 0.02 0.00 0.00 54.13 53.58 3ksk s LEU 275 Cb -0.14 -1.07 -0.02 0.00 0.02 0.00 0.00 46.19 44.97 3ksk s LEU 275 CO 0.02 0.21 0.89 -1.61 0.02 0.00 0.00 176.35 175.88 3ksk s GLU 276 N -0.24 3.38 0.30 1.70 0.41 -1.26 -0.99 118.70 121.99 3ksk s GLU 276 Ca 0.02 0.30 0.04 0.00 -0.41 0.00 0.00 54.97 54.92 3ksk s GLU 276 Cb -0.10 -2.26 0.78 0.00 -1.78 0.00 0.00 34.13 30.77 3ksk s GLU 276 CO 0.01 -0.45 1.65 -1.35 -0.49 0.00 0.00 175.26 174.64 3ksk h PRO 277 N -0.04 0.24 -0.11 0.39 0.11 -1.87 -0.39 132.00 130.32 3ksk h PRO 277 Ca -0.46 -0.01 0.01 0.00 0.11 0.00 0.00 66.00 65.65 3ksk h PRO 277 Cb 1.22 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 32.27 3ksk h PRO 277 CO 0.62 0.16 0.08 1.57 -0.21 0.00 0.00 178.00 180.21 3ksk h LYS 278 N 0.25 0.10 0.00 1.05 2.10 -1.94 -1.69 116.57 116.44 3ksk h LYS 278 Ca 0.59 -0.01 0.00 0.00 -2.00 0.00 0.00 60.65 59.23 3ksk h LYS 278 Cb 1.21 -0.02 0.00 0.00 -0.90 0.00 0.00 32.23 32.51 3ksk h LYS 278 CO -0.64 0.06 0.00 -0.25 -2.00 0.00 0.00 179.45 176.63 3ksk n ASP 279 N -4.52 0.52 -0.23 7.07 8.00 -0.16 -3.38 116.55 123.85 3ksk n ASP 279 Ca -0.01 0.58 0.05 0.00 0.71 0.00 0.00 54.79 56.12 3ksk n ASP 279 Cb 0.12 -0.71 -0.00 0.00 -0.02 0.00 0.00 41.12 40.51 3ksk n ASP 279 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 3ksk n LEU 280 N -2.02 1.23 -0.14 0.64 4.77 -0.68 -4.56 117.00 116.24 3ksk n LEU 280 Ca 0.04 -0.77 0.11 0.00 -0.03 0.00 0.00 56.01 55.37 3ksk n LEU 280 Cb 0.31 0.00 0.45 0.00 -2.33 0.00 0.00 43.42 41.86 3ksk n LEU 280 CO 0.24 0.25 1.20 -0.08 -1.33 0.00 0.00 177.39 177.67 3ksk h GLU 281 N 1.14 0.50 -0.99 3.23 4.57 -1.46 0.50 114.58 122.07 3ksk h GLU 281 Ca 0.00 -0.03 0.10 0.00 -1.18 0.00 0.00 59.36 58.25 3ksk h GLU 281 Cb 0.35 -0.11 -0.08 0.00 -0.16 0.00 0.00 28.75 28.75 3ksk h GLU 281 CO 0.00 0.33 0.63 0.35 -1.18 0.00 0.00 179.01 179.15 3ksk h PHE 282 N 0.52 1.14 -0.02 0.92 3.57 -1.81 -1.52 116.94 119.75 3ksk h PHE 282 Ca 0.32 0.03 -0.12 0.00 3.53 0.00 0.00 57.97 61.72 3ksk h PHE 282 Cb 0.54 -0.37 0.01 0.00 2.79 0.00 0.00 35.95 38.92 3ksk h PHE 282 CO -0.00 0.50 -0.47 1.88 -2.23 0.00 0.00 178.31 177.99 3ksk h TYR 283 N 1.04 0.52 -0.03 0.41 -1.99 -0.34 -1.78 116.97 114.79 3ksk h TYR 283 Ca 0.47 -0.27 0.04 0.00 2.00 0.00 0.00 58.73 60.97 3ksk h TYR 283 Cb 0.39 -0.07 -0.05 0.00 2.00 0.00 0.00 36.73 39.00 3ksk h TYR 283 CO -0.00 1.06 -0.28 1.88 -0.00 0.00 0.00 178.16 180.82 3ksk h TYR 284 N -0.17 -0.77 -0.30 4.88 0.99 -1.18 0.23 116.97 120.65 3ksk h TYR 284 Ca -0.05 0.03 0.06 0.00 2.00 0.00 0.00 58.73 60.77 3ksk h TYR 284 Cb 1.17 0.35 -0.06 0.00 1.00 0.00 0.00 36.73 39.19 3ksk h TYR 284 CO 0.15 -0.37 -0.06 0.22 -0.00 0.00 0.00 178.16 178.09 3ksk h ASP 285 N -0.41 -0.26 -0.89 3.88 3.58 -1.41 0.21 116.42 121.12 3ksk h ASP 285 Ca 0.07 0.09 0.05 0.00 0.42 0.00 0.00 57.03 57.66 3ksk h ASP 285 Cb 0.51 0.18 -0.06 0.00 1.72 0.00 0.00 39.33 41.68 3ksk h ASP 285 CO -0.27 -0.09 0.56 0.50 -2.88 0.00 0.00 179.24 177.07 3ksk h LYS 286 N 0.01 1.02 0.07 0.28 3.64 -0.72 -2.39 116.57 118.48 3ksk h LYS 286 Ca 0.15 -0.06 -0.26 0.00 -1.27 0.00 0.00 60.65 59.20 3ksk h LYS 286 Cb 0.22 -0.23 0.01 0.00 -0.41 0.00 0.00 32.23 31.82 3ksk h LYS 286 CO -0.30 0.67 -1.11 -1.49 -2.27 0.00 0.00 179.45 174.95 3ksk h TRP 287 N 1.05 0.75 0.13 1.91 6.55 0.12 -2.55 115.95 123.90 3ksk h TRP 287 Ca 0.38 -0.46 -0.01 0.00 0.95 0.00 0.00 58.89 59.75 3ksk h TRP 287 Cb 0.12 -0.07 0.00 0.00 -0.86 0.00 0.00 29.16 28.35 3ksk h TRP 287 CO -0.02 1.30 -0.06 0.93 -1.05 0.00 0.00 178.44 179.54 3ksk h GLU 288 N 0.23 -0.16 -0.93 0.49 5.08 -0.54 -0.79 114.58 117.96 3ksk h GLU 288 Ca -0.13 0.01 0.05 0.00 -1.00 0.00 0.00 59.36 58.29 3ksk h GLU 288 Cb 1.78 0.04 -0.06 0.00 0.50 0.00 0.00 28.75 31.01 3ksk h GLU 288 CO 0.20 -0.05 0.60 0.00 -1.00 0.00 0.00 179.01 178.76 3ksk h ARG 289 N -0.24 1.09 -0.72 2.33 3.08 -1.48 -1.70 114.38 116.72 3ksk h ARG 289 Ca -0.02 -0.07 -0.06 0.00 0.07 0.00 0.00 59.98 59.90 3ksk h ARG 289 Cb 0.19 -0.24 -0.03 0.00 0.08 0.00 0.00 29.97 29.97 3ksk h ARG 289 CO 0.03 0.72 0.21 -0.22 -1.07 0.00 0.00 179.97 179.63 3ksk h LYS 290 N 1.12 1.14 -0.13 0.04 1.63 -1.27 0.11 116.57 119.21 3ksk h LYS 290 Ca 0.39 -0.26 0.03 0.00 -0.85 0.00 0.00 60.65 59.96 3ksk h LYS 290 Cb 0.09 -0.16 -0.03 0.00 -0.60 0.00 0.00 32.23 31.53 3ksk h LYS 290 CO -0.15 0.99 -0.07 2.35 -3.45 0.00 0.00 179.45 179.12 3ksk h TRP 291 N 1.08 -0.16 -0.21 1.91 7.01 -0.28 -1.76 115.95 123.55 3ksk h TRP 291 Ca 0.23 0.01 -0.06 0.00 2.11 0.00 0.00 58.89 61.19 3ksk h TRP 291 Cb 0.34 0.09 -0.01 0.00 -2.10 0.00 0.00 29.16 27.48 3ksk h TRP 291 CO 0.03 -0.11 -0.10 1.88 -2.79 0.00 0.00 178.44 177.35 3ksk h TYR 292 N -0.06 0.50 -0.89 2.65 -1.99 -1.11 -0.13 116.97 115.94 3ksk h TYR 292 Ca 0.08 -0.12 0.22 0.00 2.00 0.00 0.00 58.73 60.90 3ksk h TYR 292 Cb 0.17 -0.11 -0.06 0.00 2.00 0.00 0.00 36.73 38.73 3ksk h TYR 292 CO -0.20 0.72 0.60 1.03 -0.00 0.00 0.00 178.16 180.31 3ksk h SER 293 N 0.13 0.30 -0.24 3.88 0.87 -0.72 0.82 113.55 118.59 3ksk h SER 293 Ca 0.05 0.03 0.00 0.00 -1.23 0.00 0.00 61.79 60.64 3ksk h SER 293 Cb 0.59 -0.02 0.00 0.00 -0.44 0.00 0.00 62.40 62.53 3ksk h SER 293 CO 0.03 0.11 0.00 0.47 -0.53 0.00 0.00 176.83 176.91 3ksk n ASP 294 N -4.45 2.08 -0.13 6.23 10.43 -0.67 -4.91 116.55 125.13 3ksk n ASP 294 Ca 0.19 -1.80 0.00 0.00 2.57 0.00 0.00 54.79 55.75 3ksk n ASP 294 Cb 0.77 -0.15 0.00 0.00 1.84 0.00 0.00 41.12 43.57 3ksk n ASP 294 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 3ksk n GLY 295 N 1.21 1.11 2.41 0.44 0.00 0.28 -4.23 105.19 106.41 3ksk n GLY 295 Ca 0.16 -0.33 -0.11 0.00 0.00 0.00 0.00 46.02 45.75 3ksk n GLY 295 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3ksk n HIS 296 N -1.58 -1.31 -3.98 1.61 8.25 -0.12 -5.00 115.22 113.09 3ksk n HIS 296 Ca 0.00 0.50 -0.35 0.00 -0.26 0.00 0.00 57.72 57.61 3ksk n HIS 296 Cb 0.22 -3.29 -0.13 0.00 1.12 0.00 0.00 29.99 27.91 3ksk n HIS 296 CO 0.00 0.00 0.00 0.21 0.64 0.00 0.00 176.34 177.19 3ksk s LYS 297 N -5.23 3.57 0.33 -0.41 2.20 -0.83 -4.99 119.74 114.38 3ksk s LYS 297 Ca 0.16 -0.54 -0.27 0.00 -0.36 0.00 0.00 55.97 54.97 3ksk s LYS 297 Cb -0.07 -3.11 -0.13 0.00 -1.51 0.00 0.00 37.83 33.01 3ksk s LYS 297 CO 0.37 -0.07 1.01 -0.25 -0.36 0.00 0.00 175.35 176.04 3ksk n ASP 298 N 4.50 1.30 -4.86 1.43 10.43 -1.26 -4.56 116.55 123.54 3ksk n ASP 298 Ca -0.17 1.14 -0.37 0.00 2.57 0.00 0.00 54.79 57.96 3ksk n ASP 298 Cb 0.51 -1.31 -0.06 0.00 1.84 0.00 0.00 41.12 42.10 3ksk n ASP 298 CO 0.00 0.00 0.00 -0.63 -1.07 0.00 0.00 177.20 175.50 3ksk s ILE 299 N -1.13 5.47 -0.88 0.53 1.01 0.56 -4.80 121.20 121.96 3ksk s ILE 299 Ca 0.59 0.24 -0.20 0.00 0.00 0.00 0.00 60.65 61.28 3ksk s ILE 299 Cb -0.65 -3.42 0.11 0.00 0.01 0.00 0.00 42.46 38.50 3ksk s ILE 299 CO 0.59 0.59 1.14 0.21 0.00 0.00 0.00 174.94 177.48 3ksk s ASN 300 N -0.84 6.51 -0.97 3.58 3.04 -1.25 0.77 114.94 125.78 3ksk s ASN 300 Ca 0.15 -1.72 -0.11 0.00 0.04 0.00 0.00 52.86 51.21 3ksk s ASN 300 Cb -0.12 -2.43 -0.00 0.00 -1.54 0.00 0.00 41.25 37.16 3ksk s ASN 300 CO 0.04 -1.21 0.72 -3.20 -3.04 0.00 0.00 177.10 170.41 3ksk n ASN 301 N 7.15 -5.77 -4.77 -4.21 4.05 0.33 -4.90 115.26 107.13 3ksk n ASN 301 Ca 0.19 -0.79 -0.37 0.00 0.45 0.00 0.00 54.58 54.06 3ksk n ASN 301 Cb 0.49 -3.36 -0.02 0.00 1.23 0.00 0.00 39.78 38.11 3ksk n ASN 301 CO 0.00 0.00 0.00 -2.16 -3.05 0.00 0.00 177.26 172.05 3ksk s PRO 302 N -5.05 3.95 0.03 1.20 0.04 -1.26 -4.78 135.00 129.13 3ksk s PRO 302 Ca 0.25 1.72 -0.01 0.00 0.04 0.00 0.00 61.00 62.99 3ksk s PRO 302 Cb -0.09 -2.52 -0.04 0.00 0.04 0.00 0.00 34.50 31.89 3ksk s PRO 302 CO 0.85 -0.37 0.20 0.15 0.04 0.00 0.00 177.00 177.86 3ksk s LYS 303 N -2.53 3.44 -0.31 4.56 -0.14 -1.26 -3.76 119.74 119.74 3ksk s LYS 303 Ca 0.60 -0.38 -0.10 0.00 -1.36 0.00 0.00 55.97 54.73 3ksk s LYS 303 Cb -0.27 -3.07 -0.02 0.00 -1.68 0.00 0.00 37.83 32.79 3ksk s LYS 303 CO 0.34 0.64 0.17 0.42 -0.76 0.00 0.00 175.35 176.16 3ksk s ILE 304 N -1.42 4.86 0.32 2.17 1.01 -0.84 -4.88 121.20 122.42 3ksk s ILE 304 Ca 0.31 -0.25 -0.29 0.00 0.00 0.00 0.00 60.65 60.43 3ksk s ILE 304 Cb -0.13 -3.44 -0.11 0.00 0.01 0.00 0.00 42.46 38.80 3ksk s ILE 304 CO 0.24 0.10 1.45 -2.84 0.00 0.00 0.00 174.94 173.89 3ksk s PRO 305 N 1.67 4.22 0.40 2.79 0.02 -1.26 -0.22 135.00 142.61 3ksk s PRO 305 Ca 0.06 2.41 0.13 0.00 0.02 0.00 0.00 61.00 63.61 3ksk s PRO 305 Cb -0.17 -3.04 0.96 0.00 0.02 0.00 0.00 34.50 32.27 3ksk s PRO 305 CO 0.08 -0.43 1.92 -0.24 -0.33 0.00 0.00 177.00 177.99 3ksk h VAL 306 N 3.20 0.84 -0.71 3.83 3.04 -1.34 -1.54 116.25 123.58 3ksk h VAL 306 Ca -0.48 -0.18 -0.03 0.00 -1.01 0.00 0.00 66.70 65.00 3ksk h VAL 306 Cb 1.23 0.27 -0.03 0.00 -2.01 0.00 0.00 31.29 30.75 3ksk h VAL 306 CO 0.70 0.10 0.34 0.07 -1.01 0.00 0.00 177.57 177.77 3ksk h LYS 307 N 0.52 1.01 -0.06 4.17 2.10 -1.91 0.50 116.57 122.91 3ksk h LYS 307 Ca 0.37 -0.14 0.00 0.00 -2.00 0.00 0.00 60.65 58.89 3ksk h LYS 307 Cb 0.72 -0.19 -0.00 0.00 -0.90 0.00 0.00 32.23 31.85 3ksk h LYS 307 CO -0.13 0.78 0.03 -0.92 -2.00 0.00 0.00 179.45 177.21 3ksk h TYR 308 N 1.01 0.06 -0.49 0.07 5.03 -1.67 -0.20 116.97 120.77 3ksk h TYR 308 Ca 0.25 0.00 0.06 0.00 2.58 0.00 0.00 58.73 61.62 3ksk h TYR 308 Cb 0.11 -0.02 -0.05 0.00 1.55 0.00 0.00 36.73 38.32 3ksk h TYR 308 CO 0.01 0.04 0.18 0.28 -1.32 0.00 0.00 178.16 177.35 3ksk h VAL 309 N 0.07 0.85 -0.27 1.81 2.07 -0.92 0.16 116.25 120.01 3ksk h VAL 309 Ca 0.02 -0.12 -0.09 0.00 0.82 0.00 0.00 66.70 67.32 3ksk h VAL 309 Cb -0.00 0.45 -0.01 0.00 -1.52 0.00 0.00 31.29 30.21 3ksk h VAL 309 CO -0.01 0.07 -0.23 0.24 0.02 0.00 0.00 177.57 177.65 3ksk h MET 310 N 0.36 0.51 -0.00 1.57 2.86 -0.74 0.21 114.93 119.70 3ksk h MET 310 Ca 0.23 -0.18 -0.24 0.00 -2.06 0.00 0.00 59.70 57.45 3ksk h MET 310 Cb 0.23 -0.03 0.01 0.00 0.06 0.00 0.00 31.60 31.87 3ksk h MET 310 CO -0.23 0.70 -0.97 1.49 1.06 0.00 0.00 176.91 178.97 3ksk h GLU 311 N 0.45 0.50 0.00 1.72 4.81 -0.51 -3.37 114.58 118.19 3ksk h GLU 311 Ca 0.07 -0.54 0.00 0.00 -0.13 0.00 0.00 59.36 58.76 3ksk h GLU 311 Cb 0.65 0.15 0.00 0.00 0.63 0.00 0.00 28.75 30.18 3ksk h GLU 311 CO 0.05 1.17 -1.05 0.72 -0.73 0.00 0.00 179.01 179.17 3ksk n HIS 312 N -3.78 0.00 -2.80 0.92 8.25 -0.00 -5.02 115.22 112.78 3ksk n HIS 312 Ca -0.08 0.00 -0.20 0.00 -0.26 0.00 0.00 57.72 57.18 3ksk n HIS 312 Cb 0.85 -0.11 0.03 0.00 1.12 0.00 0.00 29.99 31.87 3ksk n HIS 312 CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 3ksk s GLY 313 N -2.92 1.80 -0.21 -1.41 0.00 0.06 -4.92 107.32 99.71 3ksk s GLY 313 Ca 0.03 -1.36 -0.12 0.00 0.00 0.00 0.00 44.72 43.26 3ksk s GLY 313 CO 0.67 -1.12 0.24 -0.51 0.00 0.00 0.00 173.10 172.38 3ksk s THR 314 N -2.62 5.31 -0.16 0.90 -4.23 0.56 -4.86 115.64 110.54 3ksk s THR 314 Ca 0.55 0.38 -0.29 0.00 -1.18 0.00 0.00 61.69 61.15 3ksk s THR 314 Cb -0.10 -3.58 -0.03 0.00 1.34 0.00 0.00 72.50 70.13 3ksk s THR 314 CO 0.37 0.34 1.47 -0.75 -0.54 0.00 0.00 174.62 175.50 3ksk s LYS 315 N 0.96 4.08 0.03 3.99 2.20 -1.26 -0.43 119.74 129.31 3ksk s LYS 315 Ca 0.12 1.78 0.22 0.00 -0.36 0.00 0.00 55.97 57.73 3ksk s LYS 315 Cb -0.13 -3.91 -0.19 0.00 -1.51 0.00 0.00 37.83 32.09 3ksk s LYS 315 CO 0.05 -0.93 0.74 0.44 -0.36 0.00 0.00 175.35 175.29 3ksk n ILE 316 N 5.73 0.15 -3.64 5.43 -5.35 0.24 -4.97 119.36 116.96 3ksk n ILE 316 Ca 0.16 -0.40 -0.13 0.00 -0.27 0.00 0.00 62.75 62.11 3ksk n ILE 316 Cb 0.44 0.09 -0.07 0.00 -1.74 0.00 0.00 39.64 38.36 3ksk n ILE 316 CO 0.00 0.00 0.00 -0.47 -1.76 0.00 0.00 176.55 174.32 3ksk s TYR 317 N -3.37 -0.80 0.00 4.28 5.04 -0.91 -4.95 117.35 116.63 3ksk s TYR 317 Ca -0.02 1.90 0.00 0.00 -2.44 0.00 0.00 57.07 56.51 3ksk s TYR 317 Cb 0.13 0.31 0.00 0.00 0.35 0.00 0.00 41.96 42.75 3ksk s TYR 317 CO 0.86 -0.39 0.00 0.41 -1.34 0.00 0.00 175.55 175.09 3ksk n GLY 318 N 2.91 3.48 0.00 8.97 0.00 -1.26 -1.02 105.19 118.27 3ksk n GLY 318 Ca -0.15 -1.82 0.00 0.00 0.00 0.00 0.00 46.02 44.05 3ksk n GLY 318 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18