#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hka n ASN 4 N 0.00 1.01 -3.60 4.38 6.94 -1.26 -4.70 115.26 118.03 3hka n ASN 4 Ca 0.00 -2.02 -0.13 0.00 -0.02 0.00 0.00 54.58 52.41 3hka n ASN 4 Cb 0.00 -0.30 -0.06 0.00 -2.36 0.00 0.00 39.78 37.05 3hka n ASN 4 CO 0.00 0.00 0.00 -0.55 -1.03 0.00 0.00 177.26 175.68 3hka s SER 5 N -2.03 -0.59 0.15 0.53 0.15 -1.26 -5.04 113.70 105.62 3hka s SER 5 Ca 0.34 0.94 -0.16 0.00 0.70 0.00 0.00 55.95 57.77 3hka s SER 5 Cb 0.39 0.89 0.03 0.00 -1.71 0.00 0.00 66.02 65.62 3hka s SER 5 CO -0.17 -0.33 1.79 -0.09 1.20 0.00 0.00 173.24 175.64 3hka h ARG 6 N 3.88 0.40 -0.44 5.44 2.43 -1.98 0.30 114.38 124.42 3hka h ARG 6 Ca -0.26 -0.02 0.07 0.00 -0.81 0.00 0.00 59.98 58.95 3hka h ARG 6 Cb 1.16 -0.09 -0.06 0.00 -0.42 0.00 0.00 29.97 30.56 3hka h ARG 6 CO 0.19 0.27 0.10 0.93 -1.51 0.00 0.00 179.97 179.95 3hka h GLU 7 N 0.41 0.24 -0.33 0.20 3.07 -1.99 0.78 114.58 116.96 3hka h GLU 7 Ca 0.15 -0.01 -0.02 0.00 -0.50 0.00 0.00 59.36 58.98 3hka h GLU 7 Cb 0.03 -0.05 -0.01 0.00 -0.84 0.00 0.00 28.75 27.87 3hka h GLU 7 CO -0.09 0.16 0.13 0.28 -1.40 0.00 0.00 179.01 178.09 3hka h VAL 8 N 0.25 1.18 -0.19 3.13 2.07 -1.84 -2.49 116.25 118.36 3hka h VAL 8 Ca 0.21 -0.56 0.02 0.00 0.82 0.00 0.00 66.70 67.19 3hka h VAL 8 Cb 0.25 0.94 -0.02 0.00 -1.52 0.00 0.00 31.29 30.94 3hka h VAL 8 CO -0.26 0.20 0.07 0.25 0.02 0.00 0.00 177.57 177.84 3hka h LEU 9 N 0.39 0.08 -0.47 2.57 5.85 0.57 -2.35 115.31 121.95 3hka h LEU 9 Ca 0.11 0.02 0.08 0.00 0.84 0.00 0.00 57.88 58.93 3hka h LEU 9 Cb 0.18 0.01 -0.07 0.00 0.37 0.00 0.00 40.66 41.15 3hka h LEU 9 CO -0.01 0.07 0.07 0.00 -0.34 0.00 0.00 178.44 178.24 3hka h ALA 10 N 1.11 0.50 -0.77 1.25 0.00 0.68 0.14 119.26 122.17 3hka h ALA 10 Ca 0.08 0.11 -0.05 0.00 0.00 0.00 0.00 54.91 55.05 3hka h ALA 10 Cb 0.05 0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.95 3hka h ALA 10 CO -0.08 -0.33 0.30 1.49 0.00 0.00 0.00 179.25 180.64 3hka h GLU 11 N 0.20 1.16 -0.06 0.00 4.81 -1.23 -0.45 114.58 119.00 3hka h GLU 11 Ca 0.23 -0.21 -0.16 0.00 -0.13 0.00 0.00 59.36 59.09 3hka h GLU 11 Cb 0.31 -0.19 -0.01 0.00 0.63 0.00 0.00 28.75 29.49 3hka h GLU 11 CO -0.32 0.94 -0.67 0.87 -0.73 0.00 0.00 179.01 179.09 3hka h LYS 12 N 1.13 0.28 -0.03 1.92 1.79 -0.83 -1.87 116.57 118.95 3hka h LYS 12 Ca 0.26 -0.22 -0.02 0.00 -2.18 0.00 0.00 60.65 58.49 3hka h LYS 12 Cb 0.22 0.04 -0.00 0.00 -1.58 0.00 0.00 32.23 30.91 3hka h LYS 12 CO -0.02 0.85 -0.05 0.28 -1.08 0.00 0.00 179.45 179.43 3hka h VAL 13 N 0.20 1.41 -0.65 0.50 2.07 -0.49 -1.88 116.25 117.41 3hka h VAL 13 Ca -0.02 -1.30 -0.02 0.00 0.82 0.00 0.00 66.70 66.18 3hka h VAL 13 Cb 1.22 2.22 -0.03 0.00 -1.52 0.00 0.00 31.29 33.17 3hka h VAL 13 CO 0.11 0.35 0.31 0.11 0.02 0.00 0.00 177.57 178.47 3hka h LYS 14 N -0.42 0.91 -0.39 1.57 1.57 -1.12 0.19 116.57 118.89 3hka h LYS 14 Ca 0.00 -0.12 -0.07 0.00 -1.87 0.00 0.00 60.65 58.59 3hka h LYS 14 Cb 0.59 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.71 3hka h LYS 14 CO 0.01 0.71 -0.04 -0.91 -0.57 0.00 0.00 179.45 178.64 3hka h ASN 15 N 0.91 0.71 -0.66 0.86 -0.26 -1.35 -0.33 115.58 115.48 3hka h ASN 15 Ca 0.23 -0.33 -0.05 0.00 -0.56 0.00 0.00 56.30 55.58 3hka h ASN 15 Cb 0.09 -0.19 -0.03 0.00 -1.06 0.00 0.00 38.32 37.13 3hka h ASN 15 CO -0.03 0.88 0.21 0.00 -1.06 0.00 0.00 177.43 177.43 3hka h ALA 16 N 0.86 0.86 -0.31 -0.83 0.00 -0.85 -1.49 119.26 117.50 3hka h ALA 16 Ca 0.11 -0.21 -0.09 0.00 0.00 0.00 0.00 54.91 54.71 3hka h ALA 16 Cb 0.54 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 3hka h ALA 16 CO 0.03 0.52 -0.17 0.28 0.00 0.00 0.00 179.25 179.91 3hka h VAL 17 N 0.95 1.29 -0.41 0.00 2.07 -0.83 -2.13 116.25 117.19 3hka h VAL 17 Ca 0.21 -1.29 -0.11 0.00 0.82 0.00 0.00 66.70 66.33 3hka h VAL 17 Cb 0.28 1.47 -0.01 0.00 -1.52 0.00 0.00 31.29 31.51 3hka h VAL 17 CO -0.01 0.41 -0.20 0.78 0.02 0.00 0.00 177.57 178.57 3hka h ASN 18 N 0.42 0.81 1.89 0.57 2.35 -0.95 -3.17 115.58 117.50 3hka h ASN 18 Ca 0.07 -0.29 -0.01 0.00 -0.55 0.00 0.00 56.30 55.52 3hka h ASN 18 Cb 0.71 -0.22 -0.00 0.00 0.05 0.00 0.00 38.32 38.85 3hka h ASN 18 CO 0.05 1.00 -0.11 0.78 -1.65 0.00 0.00 177.43 177.50 3hka h ASN 19 N 0.70 0.00 -2.55 5.81 2.35 -1.29 -3.46 115.58 117.14 3hka h ASN 19 Ca 0.10 0.00 -0.55 0.00 -0.55 0.00 0.00 56.30 55.30 3hka h ASN 19 Cb 0.72 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 39.09 3hka h ASN 19 CO 0.06 0.06 1.13 -1.58 -1.65 0.00 0.00 177.43 175.45 3hka s GLN 20 N -3.19 4.12 0.22 0.81 2.00 -0.80 -4.95 119.66 117.87 3hka s GLN 20 Ca 0.06 2.24 -0.31 0.00 -2.00 0.00 0.00 55.36 55.36 3hka s GLN 20 Cb 0.05 -4.04 -0.11 0.00 0.80 0.00 0.00 33.01 29.72 3hka s GLN 20 CO 0.68 -0.93 1.57 -2.14 -0.50 0.00 0.00 175.29 173.98 3hka s PRO 21 N 4.22 4.19 -0.09 1.67 0.02 -1.26 -4.93 135.00 138.82 3hka s PRO 21 Ca 0.77 2.44 -0.10 0.00 0.02 0.00 0.00 61.00 64.13 3hka s PRO 21 Cb -0.35 -3.10 -0.05 0.00 0.02 0.00 0.00 34.50 31.03 3hka s PRO 21 CO 0.32 -0.60 0.22 0.08 -0.33 0.00 0.00 177.00 176.70 3hka s VAL 22 N 0.65 5.36 -0.36 3.83 1.01 0.09 -4.65 120.40 126.33 3hka s VAL 22 Ca 0.67 0.40 -0.08 0.00 0.00 0.00 0.00 61.98 62.98 3hka s VAL 22 Cb -0.45 -3.51 0.04 0.00 0.00 0.00 0.00 36.38 32.46 3hka s VAL 22 CO 0.38 0.58 0.15 -0.89 0.00 0.00 0.00 175.10 175.32 3hka s THR 23 N -0.86 4.03 -0.76 3.92 2.01 -0.72 -0.35 115.64 122.92 3hka s THR 23 Ca 0.17 -1.11 -0.23 0.00 0.31 0.00 0.00 61.69 60.83 3hka s THR 23 Cb -0.13 -3.30 0.07 0.00 0.01 0.00 0.00 72.50 69.14 3hka s THR 23 CO 0.06 -0.24 1.12 -0.62 -0.69 0.00 0.00 174.62 174.25 3hka s ASP 24 N 1.53 6.27 0.00 3.53 -1.08 0.46 -4.77 116.67 122.61 3hka s ASP 24 Ca -0.00 -1.07 0.18 0.00 -0.52 0.00 0.00 52.55 51.14 3hka s ASP 24 Cb -0.20 -2.47 1.06 0.00 -1.46 0.00 0.00 42.92 39.86 3hka s ASP 24 CO 0.04 -1.49 1.51 1.15 0.52 0.00 0.00 175.17 176.90 3hka n MET 25 N 8.08 0.72 -3.39 4.34 0.00 -1.26 -0.57 117.12 125.04 3hka n MET 25 Ca 0.06 0.00 0.01 0.00 0.00 0.00 0.00 57.70 57.77 3hka n MET 25 Cb 0.47 -1.39 -0.03 0.00 0.00 0.00 0.00 33.22 32.28 3hka n MET 25 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 175.97 174.39 3hka s HIS 26 N -2.00 -1.44 0.29 3.17 5.65 -1.26 -4.72 115.29 114.99 3hka s HIS 26 Ca 0.27 1.95 -0.07 0.00 0.25 0.00 0.00 55.06 57.46 3hka s HIS 26 Cb 0.12 0.65 -0.00 0.00 -1.18 0.00 0.00 32.58 32.16 3hka s HIS 26 CO 0.21 -0.77 0.44 0.95 -0.65 0.00 0.00 174.74 174.92 3hka s THR 27 N 2.86 0.00 -0.27 0.89 -4.23 -0.82 -1.15 115.64 112.92 3hka s THR 27 Ca 0.08 -1.56 0.08 0.00 -1.18 0.00 0.00 61.69 59.12 3hka s THR 27 Cb -0.14 -2.47 0.45 0.00 1.34 0.00 0.00 72.50 71.69 3hka s THR 27 CO -0.20 0.00 1.20 1.41 -0.54 0.00 0.00 174.62 176.49 3hka n HIS 28 N -0.46 1.92 -3.93 3.99 8.25 0.17 -2.93 115.22 122.23 3hka n HIS 28 Ca -0.00 -2.00 -0.21 0.00 -0.26 0.00 0.00 57.72 55.25 3hka n HIS 28 Cb 0.62 -0.32 -0.03 0.00 1.12 0.00 0.00 29.99 31.39 3hka n HIS 28 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 3hka s LEU 29 N -3.49 4.08 0.07 2.41 1.43 -1.19 -4.56 118.68 117.44 3hka s LEU 29 Ca 0.47 -0.09 0.04 0.00 -1.03 0.00 0.00 54.13 53.51 3hka s LEU 29 Cb 0.40 -2.66 -0.03 0.00 0.03 0.00 0.00 46.19 43.93 3hka s LEU 29 CO 0.01 -0.13 -0.11 -0.36 0.23 0.00 0.00 176.35 175.99 3hka s PHE 30 N -2.07 0.99 0.27 0.29 0.08 -1.26 -4.42 117.98 111.85 3hka s PHE 30 Ca 0.36 -0.55 -0.30 0.00 0.12 0.00 0.00 56.93 56.56 3hka s PHE 30 Cb -0.09 -0.56 -0.13 0.00 -0.57 0.00 0.00 43.02 41.68 3hka s PHE 30 CO 0.28 -0.01 1.35 0.45 -0.10 0.00 0.00 175.22 177.19 3hka n SER 31 N 1.07 2.67 -0.20 1.36 2.88 -1.26 -4.77 113.62 115.36 3hka n SER 31 Ca -0.20 1.16 0.26 0.00 -1.33 0.00 0.00 58.87 58.76 3hka n SER 31 Cb 0.56 -1.44 0.66 0.00 -0.75 0.00 0.00 64.21 63.24 3hka n SER 31 CO 0.00 0.00 0.00 1.55 -1.23 0.00 0.00 175.04 175.36 3hka h PRO 32 N 3.57 0.12 0.00 -1.46 0.13 -1.94 0.85 132.00 133.26 3hka h PRO 32 Ca -0.45 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 3hka h PRO 32 Cb 1.28 -0.03 0.00 0.00 0.13 0.00 0.00 31.00 32.39 3hka h PRO 32 CO 0.71 0.08 0.00 0.27 -0.23 0.00 0.00 178.00 178.82 3hka n ASN 33 N -4.35 0.00 0.17 1.44 6.94 -1.26 -2.86 115.26 115.34 3hka n ASN 33 Ca 0.19 -0.60 0.12 0.00 -0.02 0.00 0.00 54.58 54.28 3hka n ASN 33 Cb 0.89 -0.07 0.25 0.00 -2.36 0.00 0.00 39.78 38.49 3hka n ASN 33 CO 0.00 0.00 0.00 -0.26 -1.03 0.00 0.00 177.26 175.97 3hka h PHE 34 N 0.00 0.00 0.00 -2.53 -1.00 -1.16 -3.50 116.94 108.75 3hka h PHE 34 Ca 0.00 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.78 3hka h PHE 34 Cb 0.05 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.61 3hka h PHE 34 CO 0.00 0.00 0.00 0.41 -1.61 0.00 0.00 178.31 177.11 3hka n GLY 35 N 1.18 -0.05 0.07 -1.45 0.00 -1.14 -4.65 105.19 99.15 3hka n GLY 35 Ca 0.04 -2.09 0.08 0.00 0.00 0.00 0.00 46.02 44.06 3hka n GLY 35 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3hka n GLU 36 N 0.00 0.08 0.22 1.61 -0.58 -1.26 -2.75 120.64 117.97 3hka n GLU 36 Ca 0.00 0.41 0.15 0.00 -0.42 0.00 0.00 57.16 57.30 3hka n GLU 36 Cb 0.00 -1.69 0.76 0.00 -0.57 0.00 0.00 31.44 29.94 3hka n GLU 36 CO 0.00 0.00 0.00 -0.84 -0.48 0.00 0.00 177.13 175.81 3hka h ILE 37 N 0.00 0.00 -3.25 -3.67 3.07 -1.97 -3.36 117.51 108.33 3hka h ILE 37 Ca 0.00 -0.10 -0.61 0.00 1.55 0.00 0.00 64.86 65.70 3hka h ILE 37 Cb 0.21 0.83 -0.12 0.00 -0.27 0.00 0.00 36.82 37.47 3hka h ILE 37 CO 0.00 0.00 0.58 -0.22 -1.05 0.00 0.00 178.15 177.46 3hka s LEU 38 N -5.15 4.07 0.06 0.16 2.96 -1.11 -4.71 118.68 114.97 3hka s LEU 38 Ca -0.02 -0.29 -0.20 0.00 -0.22 0.00 0.00 54.13 53.41 3hka s LEU 38 Cb 0.09 -2.88 -0.07 0.00 0.50 0.00 0.00 46.19 43.83 3hka s LEU 38 CO 0.33 -1.21 0.57 -0.76 -1.32 0.00 0.00 176.35 173.96 3hka s LEU 39 N 3.95 4.52 0.03 -0.68 1.43 -1.26 -5.01 118.68 121.67 3hka s LEU 39 Ca 0.31 1.25 -0.27 0.00 -1.03 0.00 0.00 54.13 54.40 3hka s LEU 39 Cb -0.12 -2.90 0.09 0.00 0.03 0.00 0.00 46.19 43.29 3hka s LEU 39 CO 0.20 0.26 0.77 -1.66 0.23 0.00 0.00 176.35 176.15 3hka s TRP 40 N -1.00 -0.46 0.00 0.29 1.48 -1.26 -0.93 118.94 117.06 3hka s TRP 40 Ca 0.29 0.41 0.00 0.00 -1.06 0.00 0.00 56.10 55.74 3hka s TRP 40 Cb -0.19 0.52 0.00 0.00 -1.16 0.00 0.00 33.47 32.64 3hka s TRP 40 CO 0.19 -0.64 0.00 -0.40 -4.06 0.00 0.00 176.95 172.03 3hka n ASP 41 N -0.06 0.00 -0.26 -2.66 5.68 -1.26 -4.56 116.55 113.43 3hka n ASP 41 Ca -0.13 0.00 0.19 0.00 -0.50 0.00 0.00 54.79 54.34 3hka n ASP 41 Cb 0.62 0.00 0.49 0.00 -1.14 0.00 0.00 41.12 41.09 3hka n ASP 41 CO 0.00 0.00 0.00 -0.29 -1.33 0.00 0.00 177.20 175.58 3hka h ILE 42 N 0.00 0.68 -0.23 2.12 6.09 -1.96 -0.52 117.51 123.69 3hka h ILE 42 Ca 0.00 -0.15 -0.14 0.00 -1.37 0.00 0.00 64.86 63.19 3hka h ILE 42 Cb 0.00 0.20 -0.01 0.00 0.47 0.00 0.00 36.82 37.48 3hka h ILE 42 CO 0.00 0.08 -0.45 0.44 -3.07 0.00 0.00 178.15 175.15 3hka h ASP 43 N 0.44 0.64 -0.02 2.19 3.32 -1.96 -1.40 116.42 119.63 3hka h ASP 43 Ca 0.48 -0.30 -0.14 0.00 0.02 0.00 0.00 57.03 57.09 3hka h ASP 43 Cb 1.15 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 40.51 3hka h ASP 43 CO -0.20 1.00 -0.43 -0.33 -1.72 0.00 0.00 179.24 177.57 3hka h GLU 44 N 0.47 0.55 -0.35 3.56 4.39 -1.38 -2.15 114.58 119.67 3hka h GLU 44 Ca 0.03 -0.29 -0.06 0.00 0.34 0.00 0.00 59.36 59.39 3hka h GLU 44 Cb 0.98 0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 29.62 3hka h GLU 44 CO 0.09 0.87 -0.00 -0.07 -1.16 0.00 0.00 179.01 178.74 3hka h LEU 45 N 0.45 0.61 -1.40 1.33 3.38 -1.13 -2.75 115.31 115.79 3hka h LEU 45 Ca 0.03 -0.31 -0.04 0.00 0.09 0.00 0.00 57.88 57.65 3hka h LEU 45 Cb 0.93 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.51 3hka h LEU 45 CO 0.08 0.77 -0.20 -0.07 0.09 0.00 0.00 178.44 179.11 3hka h LEU 46 N 0.44 0.00 -3.12 1.67 3.38 -1.17 -2.94 115.31 113.56 3hka h LEU 46 Ca 0.10 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.07 3hka h LEU 46 Cb 0.46 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.21 3hka h LEU 46 CO 0.02 0.20 0.00 0.35 0.09 0.00 0.00 178.44 179.10 3hka n THR 47 N -3.50 1.79 -1.73 0.22 -2.24 -0.82 -4.72 114.28 103.29 3hka n THR 47 Ca -0.01 -1.23 -0.42 0.00 -2.27 0.00 0.00 64.05 60.12 3hka n THR 47 Cb 0.36 0.14 -0.01 0.00 -2.10 0.00 0.00 70.33 68.72 3hka n THR 47 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3hka n TYR 48 N 0.97 2.63 0.19 4.78 9.36 -1.05 -4.76 117.16 129.28 3hka n TYR 48 Ca 0.24 0.45 0.18 0.00 3.32 0.00 0.00 57.90 62.09 3hka n TYR 48 Cb 0.85 -2.50 0.82 0.00 -0.63 0.00 0.00 39.34 37.88 3hka n TYR 48 CO 0.00 0.00 0.00 1.12 0.22 0.00 0.00 176.86 178.20 3hka h HIS 49 N 3.30 0.00 -0.85 2.98 2.07 -1.92 -0.20 115.15 120.54 3hka h HIS 49 Ca -0.48 0.00 0.06 0.00 -2.85 0.00 0.00 60.37 57.10 3hka h HIS 49 Cb 1.26 0.00 -0.06 0.00 2.57 0.00 0.00 27.41 31.18 3hka h HIS 49 CO 0.54 0.00 0.53 1.88 -3.07 0.00 0.00 177.93 177.81 3hka h TYR 50 N 0.00 0.99 0.00 6.12 -1.99 -1.93 -1.71 116.97 118.45 3hka h TYR 50 Ca 0.11 0.03 -0.06 0.00 2.00 0.00 0.00 58.73 60.80 3hka h TYR 50 Cb 0.69 -0.32 -0.01 0.00 2.00 0.00 0.00 36.73 39.09 3hka h TYR 50 CO 0.00 0.51 -0.30 -0.07 -0.00 0.00 0.00 178.16 178.30 3hka h LEU 51 N 0.98 0.00 -0.44 3.88 4.07 -1.33 -2.88 115.31 119.59 3hka h LEU 51 Ca 0.36 0.00 -0.07 0.00 0.08 0.00 0.00 57.88 58.25 3hka h LEU 51 Cb 0.13 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 41.86 3hka h LEU 51 CO -0.16 0.30 0.00 0.58 -1.08 0.00 0.00 178.44 178.09 3hka h VAL 52 N 0.00 1.26 -0.58 1.22 2.07 -1.10 0.76 116.25 119.88 3hka h VAL 52 Ca -0.00 -1.03 -0.04 0.00 0.82 0.00 0.00 66.70 66.44 3hka h VAL 52 Cb 1.20 1.06 -0.02 0.00 -1.52 0.00 0.00 31.29 32.01 3hka h VAL 52 CO 0.04 0.36 0.19 0.00 0.02 0.00 0.00 177.57 178.17 3hka h ALA 53 N 0.91 0.76 -0.43 1.67 0.00 -1.37 -2.37 119.26 118.43 3hka h ALA 53 Ca 0.12 -0.19 -0.14 0.00 0.00 0.00 0.00 54.91 54.70 3hka h ALA 53 Cb 0.49 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 3hka h ALA 53 CO 0.02 0.42 -0.30 0.93 0.00 0.00 0.00 179.25 180.32 3hka h GLU 54 N 0.81 0.95 -0.17 0.00 5.08 -1.27 -3.08 114.58 116.90 3hka h GLU 54 Ca 0.19 -0.46 -0.10 0.00 -1.00 0.00 0.00 59.36 57.99 3hka h GLU 54 Cb 0.27 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.51 3hka h GLU 54 CO -0.01 1.12 -0.32 -0.24 -1.00 0.00 0.00 179.01 178.56 3hka h VAL 55 N 0.79 1.28 0.00 3.13 3.04 -0.79 -2.59 116.25 121.11 3hka h VAL 55 Ca 0.08 -1.34 0.00 0.00 -1.01 0.00 0.00 66.70 64.43 3hka h VAL 55 Cb 0.89 1.50 0.00 0.00 -2.01 0.00 0.00 31.29 31.67 3hka h VAL 55 CO 0.08 0.41 0.00 0.23 -1.01 0.00 0.00 177.57 177.28 3hka n MET 56 N -4.09 0.10 0.02 4.17 2.81 -0.90 -0.99 117.12 118.25 3hka n MET 56 Ca -0.01 0.45 0.13 0.00 -1.81 0.00 0.00 57.70 56.46 3hka n MET 56 Cb 0.43 -1.74 0.37 0.00 -0.71 0.00 0.00 33.22 31.56 3hka n MET 56 CO 0.00 0.00 0.00 0.54 1.51 0.00 0.00 175.97 178.02 3hka n ARG 57 N -1.95 0.08 -0.02 0.03 1.74 -0.97 -4.47 116.66 111.10 3hka n ARG 57 Ca 0.01 0.03 -0.04 0.00 -0.77 0.00 0.00 57.85 57.08 3hka n ARG 57 Cb 0.13 -1.56 -0.02 0.00 -1.02 0.00 0.00 32.46 29.99 3hka n ARG 57 CO 0.00 0.00 0.00 0.91 -1.52 0.00 0.00 177.63 177.02 3hka n TRP 58 N -1.68 0.00 -1.93 -1.55 7.02 -0.34 -5.09 117.44 113.88 3hka n TRP 58 Ca 0.06 0.00 -0.37 0.00 -1.02 0.00 0.00 57.50 56.17 3hka n TRP 58 Cb 0.36 -0.15 0.04 0.00 -2.42 0.00 0.00 31.31 29.14 3hka n TRP 58 CO 0.00 0.00 0.00 -0.08 -2.02 0.00 0.00 177.69 175.59 3hka s THR 59 N -2.08 2.42 -1.51 -0.99 -1.32 -0.16 -4.94 115.64 107.06 3hka s THR 59 Ca -0.06 0.27 0.26 0.00 -1.21 0.00 0.00 61.69 60.95 3hka s THR 59 Cb 0.02 -3.12 0.18 0.00 -1.51 0.00 0.00 72.50 68.08 3hka s THR 59 CO 0.08 -0.04 1.51 0.47 -2.21 0.00 0.00 174.62 174.43 3hka n ASP 60 N -1.49 0.86 -4.71 8.08 9.92 -1.26 -4.88 116.55 123.07 3hka n ASP 60 Ca 0.13 -0.69 -0.42 0.00 -0.53 0.00 0.00 54.79 53.28 3hka n ASP 60 Cb 0.48 0.18 -0.03 0.00 -0.64 0.00 0.00 41.12 41.11 3hka n ASP 60 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 3hka s VAL 61 N -2.66 3.67 0.64 2.53 1.01 -1.26 -4.99 120.40 119.34 3hka s VAL 61 Ca 0.20 1.18 -0.17 0.00 0.00 0.00 0.00 61.98 63.20 3hka s VAL 61 Cb 0.19 -3.76 -0.01 0.00 0.00 0.00 0.00 36.38 32.80 3hka s VAL 61 CO 0.58 0.08 1.17 -0.94 0.00 0.00 0.00 175.10 175.99 3hka s SER 62 N 1.15 4.94 0.33 3.32 1.04 -1.26 -4.82 113.70 118.40 3hka s SER 62 Ca 0.62 2.25 0.01 0.00 0.48 0.00 0.00 55.95 59.31 3hka s SER 62 Cb -0.33 -2.58 0.57 0.00 0.10 0.00 0.00 66.02 63.78 3hka s SER 62 CO 0.29 -1.76 2.00 -0.29 0.98 0.00 0.00 173.24 174.46 3hka h ILE 63 N 0.35 1.18 0.07 -1.02 6.09 -1.97 0.34 117.51 122.56 3hka h ILE 63 Ca -0.49 -0.33 -0.00 0.00 -1.37 0.00 0.00 64.86 62.67 3hka h ILE 63 Cb 1.28 0.16 0.00 0.00 0.47 0.00 0.00 36.82 38.73 3hka h ILE 63 CO 0.53 0.17 -0.03 -0.33 -3.07 0.00 0.00 178.15 175.42 3hka h GLU 64 N 0.94 -0.09 -0.91 2.19 3.07 -1.93 -1.68 114.58 116.16 3hka h GLU 64 Ca 0.25 0.01 0.05 0.00 -0.50 0.00 0.00 59.36 59.17 3hka h GLU 64 Cb -0.10 0.02 -0.06 0.00 -0.84 0.00 0.00 28.75 27.77 3hka h GLU 64 CO -0.05 0.04 0.60 0.00 -1.40 0.00 0.00 179.01 178.19 3hka h ALA 65 N 0.72 1.47 -0.08 3.43 0.00 -1.77 -1.73 119.26 121.30 3hka h ALA 65 Ca -0.01 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.87 3hka h ALA 65 Cb 0.17 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 17.67 3hka h ALA 65 CO 0.02 0.42 0.05 0.35 0.00 0.00 0.00 179.25 180.08 3hka h PHE 66 N 1.09 0.10 0.00 0.00 3.57 -0.52 -2.07 116.94 119.11 3hka h PHE 66 Ca 0.38 0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.86 3hka h PHE 66 Cb 0.12 -0.03 -0.00 0.00 2.79 0.00 0.00 35.95 38.82 3hka h PHE 66 CO -0.00 0.07 -0.11 -1.49 -2.23 0.00 0.00 178.31 174.55 3hka h TRP 67 N 0.10 0.00 0.00 0.41 -0.00 -0.86 -1.86 115.95 113.74 3hka h TRP 67 Ca 0.03 0.00 0.00 0.00 -0.00 0.00 0.00 58.89 58.92 3hka h TRP 67 Cb -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 29.16 29.16 3hka h TRP 67 CO -0.07 0.11 0.00 0.00 -0.00 0.00 0.00 178.44 178.48 3hka h ALA 68 N 1.89 1.00 -2.35 1.49 0.00 -0.70 -3.46 119.26 117.14 3hka h ALA 68 Ca -0.00 0.00 -0.51 0.00 0.00 0.00 0.00 54.91 54.40 3hka h ALA 68 Cb 0.40 0.00 0.11 0.00 0.00 0.00 0.00 17.79 18.30 3hka h ALA 68 CO 0.01 0.00 0.35 -1.64 0.00 0.00 0.00 179.25 177.97 3hka s MET 69 N -3.23 2.67 0.75 0.00 -1.94 -0.70 -5.03 119.30 111.82 3hka s MET 69 Ca 0.07 1.16 -0.12 0.00 -1.71 0.00 0.00 55.69 55.10 3hka s MET 69 Cb 0.06 -1.95 0.04 0.00 2.01 0.00 0.00 34.83 35.00 3hka s MET 69 CO 0.65 -1.33 1.12 -1.54 -0.01 0.00 0.00 175.02 173.91 3hka s SER 70 N -3.25 5.01 0.17 3.03 1.04 -1.26 -4.79 113.70 113.64 3hka s SER 70 Ca 0.62 1.08 -0.15 0.00 0.48 0.00 0.00 55.95 57.98 3hka s SER 70 Cb -0.17 -1.80 0.12 0.00 0.10 0.00 0.00 66.02 64.27 3hka s SER 70 CO 0.50 -1.62 1.72 0.50 0.98 0.00 0.00 173.24 175.33 3hka h LYS 71 N -0.85 0.20 -0.70 4.02 1.63 -1.96 0.69 116.57 119.61 3hka h LYS 71 Ca -0.46 -0.01 -0.03 0.00 -0.85 0.00 0.00 60.65 59.30 3hka h LYS 71 Cb 1.27 -0.05 -0.03 0.00 -0.60 0.00 0.00 32.23 32.83 3hka h LYS 71 CO 0.63 0.13 0.33 -0.09 -3.45 0.00 0.00 179.45 177.00 3hka h ARG 72 N 0.21 1.00 -0.44 1.90 2.43 -1.94 0.17 114.38 117.71 3hka h ARG 72 Ca 0.20 -0.14 -0.06 0.00 -0.81 0.00 0.00 59.98 59.17 3hka h ARG 72 Cb 0.24 -0.18 -0.02 0.00 -0.42 0.00 0.00 29.97 29.59 3hka h ARG 72 CO -0.26 0.78 0.04 0.93 -1.51 0.00 0.00 179.97 179.94 3hka h GLU 73 N 0.99 0.75 -0.35 0.20 5.08 -1.65 0.52 114.58 120.11 3hka h GLU 73 Ca 0.24 -0.22 -0.01 0.00 -1.00 0.00 0.00 59.36 58.37 3hka h GLU 73 Cb 0.12 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.27 3hka h GLU 73 CO -0.03 0.80 0.17 1.96 -1.00 0.00 0.00 179.01 180.90 3hka h GLN 74 N 0.60 0.51 -0.80 2.33 4.20 -0.48 -0.96 115.11 120.51 3hka h GLN 74 Ca 0.13 -0.08 0.03 0.00 0.06 0.00 0.00 58.65 58.79 3hka h GLN 74 Cb 0.43 -0.09 -0.05 0.00 0.30 0.00 0.00 27.48 28.08 3hka h GLN 74 CO 0.02 0.47 0.51 0.00 -0.67 0.00 0.00 178.83 179.15 3hka h ALA 75 N 1.02 1.05 -0.07 3.87 0.00 -0.80 -0.54 119.26 123.79 3hka h ALA 75 Ca 0.12 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.00 3hka h ALA 75 Cb 0.13 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 17.64 3hka h ALA 75 CO -0.01 0.34 0.04 -0.44 0.00 0.00 0.00 179.25 179.18 3hka h ASP 76 N 1.01 0.08 0.01 0.00 3.45 -0.47 -0.23 116.42 120.27 3hka h ASP 76 Ca 0.32 -0.02 0.01 0.00 0.43 0.00 0.00 57.03 57.77 3hka h ASP 76 Cb -0.00 -0.02 -0.01 0.00 -0.56 0.00 0.00 39.33 38.73 3hka h ASP 76 CO -0.11 0.07 -0.07 0.25 -1.57 0.00 0.00 179.24 177.82 3hka h LEU 77 N 0.08 -0.19 -0.97 1.55 5.85 -0.68 -0.98 115.31 119.97 3hka h LEU 77 Ca 0.03 0.03 0.01 0.00 0.84 0.00 0.00 57.88 58.79 3hka h LEU 77 Cb 0.01 0.08 -0.05 0.00 0.37 0.00 0.00 40.66 41.07 3hka h LEU 77 CO -0.01 -0.10 0.64 0.40 -0.34 0.00 0.00 178.44 179.03 3hka h ILE 78 N -0.12 1.24 0.01 4.05 2.04 -0.99 0.23 117.51 123.97 3hka h ILE 78 Ca 0.03 -0.45 -0.00 0.00 1.00 0.00 0.00 64.86 65.44 3hka h ILE 78 Cb 0.15 -0.18 0.00 0.00 -0.74 0.00 0.00 36.82 36.06 3hka h ILE 78 CO -0.06 0.24 -0.00 -0.25 0.00 0.00 0.00 178.15 178.07 3hka h TRP 79 N 1.30 -0.01 -0.40 1.37 2.91 -0.71 0.10 115.95 120.51 3hka h TRP 79 Ca 0.36 -0.00 -0.02 0.00 1.13 0.00 0.00 58.89 60.36 3hka h TRP 79 Cb -0.14 0.00 -0.02 0.00 -0.51 0.00 0.00 29.16 28.50 3hka h TRP 79 CO -0.00 0.09 0.18 1.49 -1.03 0.00 0.00 178.44 179.17 3hka h GLU 80 N -0.10 0.59 -0.10 2.65 4.57 -0.76 -0.46 114.58 120.98 3hka h GLU 80 Ca -0.00 -0.09 -0.08 0.00 -1.18 0.00 0.00 59.36 58.00 3hka h GLU 80 Cb 0.10 -0.10 0.00 0.00 -0.16 0.00 0.00 28.75 28.59 3hka h GLU 80 CO 0.00 0.53 -0.27 0.93 -1.18 0.00 0.00 179.01 179.02 3hka h GLU 81 N 0.51 0.35 0.00 1.92 4.39 -0.47 -0.72 114.58 120.55 3hka h GLU 81 Ca 0.14 -0.25 0.00 0.00 0.34 0.00 0.00 59.36 59.59 3hka h GLU 81 Cb 0.15 0.04 0.00 0.00 -0.10 0.00 0.00 28.75 28.84 3hka h GLU 81 CO -0.01 0.87 -1.17 1.28 -1.16 0.00 0.00 179.01 178.81 3hka n LEU 82 N -4.46 0.57 -0.04 1.33 4.77 0.34 -3.89 117.00 115.62 3hka n LEU 82 Ca -0.08 0.06 -0.05 0.00 -0.03 0.00 0.00 56.01 55.92 3hka n LEU 82 Cb 0.46 -0.07 -0.05 0.00 -2.33 0.00 0.00 43.42 41.43 3hka n LEU 82 CO 0.41 -0.02 -0.77 0.49 -1.33 0.00 0.00 177.39 176.18 3hka n PHE 83 N -2.17 0.00 -0.12 -1.77 3.72 -0.21 -3.43 117.46 113.48 3hka n PHE 83 Ca 0.01 0.00 -0.25 0.00 -0.05 0.00 0.00 57.45 57.16 3hka n PHE 83 Cb 0.48 -0.35 -0.11 0.00 -0.94 0.00 0.00 39.48 38.57 3hka n PHE 83 CO 0.00 0.00 0.00 -0.89 -0.05 0.00 0.00 176.76 175.82 3hka n ILE 84 N -2.53 1.53 0.26 4.37 2.08 -1.03 -4.38 119.36 119.67 3hka n ILE 84 Ca -0.14 -0.17 0.15 0.00 0.56 0.00 0.00 62.75 63.15 3hka n ILE 84 Cb 0.70 -1.98 0.60 0.00 -0.75 0.00 0.00 39.64 38.21 3hka n ILE 84 CO 0.00 0.00 0.00 0.11 0.56 0.00 0.00 176.55 177.22 3hka h LYS 85 N -1.00 0.00 -3.30 0.38 1.57 -1.29 -3.44 116.57 109.49 3hka h LYS 85 Ca -0.49 0.00 -0.12 0.00 -1.87 0.00 0.00 60.65 58.16 3hka h LYS 85 Cb 1.43 0.00 -0.19 0.00 0.08 0.00 0.00 32.23 33.54 3hka h LYS 85 CO -0.30 0.07 -0.36 1.03 -0.57 0.00 0.00 179.45 179.33 3hka s ARG 86 N -3.67 0.63 0.32 3.15 3.00 -1.25 -5.06 118.95 116.07 3hka s ARG 86 Ca 0.01 -0.37 -0.29 0.00 0.00 0.00 0.00 55.73 55.08 3hka s ARG 86 Cb 0.09 0.27 -0.10 0.00 0.00 0.00 0.00 34.95 35.21 3hka s ARG 86 CO 0.58 -0.17 1.29 -1.12 0.00 0.00 0.00 175.30 175.88 3hka s SER 87 N -1.57 6.81 -1.32 0.23 0.01 -1.26 -3.59 113.70 113.02 3hka s SER 87 Ca -0.11 2.65 -0.11 0.00 1.31 0.00 0.00 55.95 59.68 3hka s SER 87 Cb -0.05 -2.65 -0.06 0.00 0.21 0.00 0.00 66.02 63.48 3hka s SER 87 CO 0.01 -0.51 2.48 -0.81 0.41 0.00 0.00 173.24 174.82 3hka n PRO 88 N 0.92 2.87 0.11 12.44 -0.04 -1.22 -4.64 135.00 145.44 3hka n PRO 88 Ca 0.00 -2.07 0.12 0.00 -0.04 0.00 0.00 63.50 61.51 3hka n PRO 88 Cb 0.42 -2.84 0.19 0.00 -0.04 0.00 0.00 33.50 31.23 3hka n PRO 88 CO 0.00 0.00 0.00 -0.39 -0.04 0.00 0.00 175.50 175.07 3hka h VAL 89 N 3.50 0.00 -4.22 0.52 -1.51 -1.90 -3.28 116.25 109.36 3hka h VAL 89 Ca 0.67 -0.67 -0.52 0.00 -1.23 0.00 0.00 66.70 64.94 3hka h VAL 89 Cb 0.38 1.41 0.15 0.00 -2.13 0.00 0.00 31.29 31.10 3hka h VAL 89 CO 1.75 0.00 0.34 -0.94 -1.23 0.00 0.00 177.57 177.49 3hka s SER 90 N -4.85 4.11 0.19 4.19 1.04 -1.26 -4.73 113.70 112.39 3hka s SER 90 Ca 0.06 2.18 -0.12 0.00 0.48 0.00 0.00 55.95 58.55 3hka s SER 90 Cb 0.11 -2.57 0.15 0.00 0.10 0.00 0.00 66.02 63.81 3hka s SER 90 CO 0.70 -2.31 1.82 -0.08 0.98 0.00 0.00 173.24 174.35 3hka h GLU 91 N -0.71 0.68 -0.66 4.02 4.57 -1.97 0.17 114.58 120.68 3hka h GLU 91 Ca -0.46 -0.04 -0.06 0.00 -1.18 0.00 0.00 59.36 57.62 3hka h GLU 91 Cb 1.27 -0.15 -0.03 0.00 -0.16 0.00 0.00 28.75 29.68 3hka h GLU 91 CO 0.49 0.45 0.18 0.00 -1.18 0.00 0.00 179.01 178.94 3hka h ALA 92 N 1.27 1.07 -0.18 2.92 0.00 -1.95 0.02 119.26 122.42 3hka h ALA 92 Ca 0.25 -0.22 -0.18 0.00 0.00 0.00 0.00 54.91 54.75 3hka h ALA 92 Cb 0.05 -0.26 0.01 0.00 0.00 0.00 0.00 17.79 17.59 3hka h ALA 92 CO -0.12 0.62 -0.58 0.00 0.00 0.00 0.00 179.25 179.17 3hka h ARG 94 N 0.41 0.97 -0.92 0.00 2.43 -0.48 -2.28 114.38 114.51 3hka h ARG 94 Ca -0.02 -0.06 0.03 0.00 -0.81 0.00 0.00 59.98 59.12 3hka h ARG 94 Cb 1.20 -0.22 -0.05 0.00 -0.42 0.00 0.00 29.97 30.48 3hka h ARG 94 CO 0.12 0.64 0.61 0.78 -1.51 0.00 0.00 179.97 180.62 3hka h GLY 95 N 1.00 1.33 0.98 2.80 0.00 -0.86 -1.15 103.07 107.17 3hka h GLY 95 Ca 0.34 -0.46 -0.00 0.00 0.00 0.00 0.00 47.33 47.21 3hka h GLY 95 CO -0.13 0.40 0.17 -2.08 0.00 0.00 0.00 176.54 174.90 3hka h VAL 96 N 1.17 1.09 -0.72 4.60 2.07 -1.15 -1.78 116.25 121.52 3hka h VAL 96 Ca 0.36 -0.20 -0.00 0.00 0.82 0.00 0.00 66.70 67.68 3hka h VAL 96 Cb 0.00 0.73 -0.03 0.00 -1.52 0.00 0.00 31.29 30.47 3hka h VAL 96 CO -0.11 0.09 0.44 -0.07 0.02 0.00 0.00 177.57 177.94 3hka h LEU 97 N 0.35 0.87 -1.35 2.57 3.38 -1.27 -2.05 115.31 117.80 3hka h LEU 97 Ca 0.10 -0.06 0.03 0.00 0.09 0.00 0.00 57.88 58.04 3hka h LEU 97 Cb -0.00 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 40.49 3hka h LEU 97 CO -0.02 0.67 0.46 0.74 0.09 0.00 0.00 178.44 180.38 3hka h THR 98 N 0.98 1.12 -0.09 0.22 2.02 -0.88 -1.15 112.91 115.13 3hka h THR 98 Ca 0.26 -0.29 -0.02 0.00 0.77 0.00 0.00 66.41 67.13 3hka h THR 98 Cb -0.03 0.19 -0.00 0.00 -1.74 0.00 0.00 68.15 66.56 3hka h THR 98 CO -0.05 0.16 -0.02 0.00 0.37 0.00 0.00 175.52 175.98 3hka h LEU 100 N -0.15 -0.23 -0.42 0.00 3.38 -0.91 -1.67 115.31 115.31 3hka h LEU 100 Ca 0.02 0.07 0.03 0.00 0.09 0.00 0.00 57.88 58.09 3hka h LEU 100 Cb 0.43 0.15 -0.03 0.00 0.09 0.00 0.00 40.66 41.30 3hka h LEU 100 CO 0.01 -0.08 0.23 -0.61 0.09 0.00 0.00 178.44 178.08 3hka h GLN 101 N -0.00 0.45 -0.08 1.13 4.15 -1.22 -1.17 115.11 118.36 3hka h GLN 101 Ca 0.12 -0.03 0.01 0.00 0.77 0.00 0.00 58.65 59.52 3hka h GLN 101 Cb 0.18 -0.10 -0.00 0.00 0.21 0.00 0.00 27.48 27.76 3hka h GLN 101 CO -0.25 0.30 0.05 0.78 -1.93 0.00 0.00 178.83 177.78 3hka h GLY 102 N 0.46 0.05 1.01 2.39 0.00 -0.81 -1.13 103.07 105.05 3hka h GLY 102 Ca 0.17 -0.02 0.00 0.00 0.00 0.00 0.00 47.33 47.49 3hka h GLY 102 CO -0.10 0.02 -0.05 1.04 0.00 0.00 0.00 176.54 177.44 3hka n LEU 103 N -4.52 0.31 0.00 3.11 4.77 -0.68 -4.89 117.00 115.10 3hka n LEU 103 Ca -0.01 0.05 0.00 0.00 -0.03 0.00 0.00 56.01 56.01 3hka n LEU 103 Cb 0.13 -0.16 0.00 0.00 -2.33 0.00 0.00 43.42 41.06 3hka n LEU 103 CO 0.34 0.06 0.00 0.61 -1.33 0.00 0.00 177.39 177.07 3hka n GLY 104 N 1.22 0.35 3.88 -0.72 0.00 -0.43 -5.07 105.19 104.42 3hka n GLY 104 Ca 0.17 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.88 3hka n GLY 104 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3hka s LEU 105 N 0.00 3.28 -0.29 0.99 1.43 -0.51 -4.99 118.68 118.59 3hka s LEU 105 Ca 0.00 1.33 0.02 0.00 -1.03 0.00 0.00 54.13 54.44 3hka s LEU 105 Cb 0.00 -4.35 0.07 0.00 0.03 0.00 0.00 46.19 41.94 3hka s LEU 105 CO 0.00 -0.84 -0.03 -0.62 0.23 0.00 0.00 176.35 175.08 3hka s ASP 106 N -4.18 4.66 0.61 2.29 2.15 -1.26 -3.71 116.67 117.23 3hka s ASP 106 Ca 0.54 -1.56 0.32 0.00 0.43 0.00 0.00 52.55 52.28 3hka s ASP 106 Cb -0.11 -1.62 1.82 0.00 -0.30 0.00 0.00 42.92 42.72 3hka s ASP 106 CO 0.52 -0.26 2.15 -0.65 -0.17 0.00 0.00 175.17 176.76 3hka h PRO 107 N 7.80 0.00 -0.80 4.34 0.11 -1.91 -2.30 132.00 139.24 3hka h PRO 107 Ca -0.16 0.00 0.10 0.00 0.11 0.00 0.00 66.00 66.05 3hka h PRO 107 Cb 1.04 0.00 -0.06 0.00 0.11 0.00 0.00 31.00 32.10 3hka h PRO 107 CO 0.50 0.00 0.52 0.00 -0.21 0.00 0.00 178.00 178.82 3hka h ALA 108 N 1.78 1.76 0.00 -0.75 0.00 -2.01 -1.88 119.26 118.17 3hka h ALA 108 Ca 0.05 -0.01 -0.13 0.00 0.00 0.00 0.00 54.91 54.82 3hka h ALA 108 Cb 0.36 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 3hka h ALA 108 CO -0.00 0.07 -0.63 1.79 0.00 0.00 0.00 179.25 180.48 3hka h THR 109 N 0.73 1.20 -2.84 0.00 1.35 -1.85 -3.47 112.91 108.03 3hka h THR 109 Ca 0.37 -2.36 -0.41 0.00 -0.55 0.00 0.00 66.41 63.46 3hka h THR 109 Cb 0.46 2.37 -0.03 0.00 -1.73 0.00 0.00 68.15 69.22 3hka h THR 109 CO -0.14 0.61 -0.51 0.54 -0.25 0.00 0.00 175.52 175.77 3hka n ARG 110 N -3.43 -1.68 -2.99 4.72 1.74 -0.71 -4.89 116.66 109.42 3hka n ARG 110 Ca 0.00 1.02 -0.44 0.00 -0.77 0.00 0.00 57.85 57.66 3hka n ARG 110 Cb 0.71 -5.66 -0.01 0.00 -1.02 0.00 0.00 32.46 26.49 3hka n ARG 110 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 3hka s ASP 111 N -2.12 7.01 0.27 0.55 3.68 -1.26 -4.85 116.67 119.95 3hka s ASP 111 Ca 0.00 -2.87 -0.01 0.00 2.13 0.00 0.00 52.55 51.80 3hka s ASP 111 Cb 0.00 -2.38 0.50 0.00 -1.45 0.00 0.00 42.92 39.59 3hka s ASP 111 CO 0.00 -0.76 1.81 0.25 0.13 0.00 0.00 175.17 176.60 3hka h LEU 112 N 9.52 0.75 -0.53 -1.34 5.85 -1.99 -1.48 115.31 126.09 3hka h LEU 112 Ca 0.27 0.06 0.03 0.00 0.84 0.00 0.00 57.88 59.08 3hka h LEU 112 Cb 0.90 -0.08 -0.04 0.00 0.37 0.00 0.00 40.66 41.81 3hka h LEU 112 CO 1.19 0.39 0.31 1.56 -0.34 0.00 0.00 178.44 181.55 3hka h GLN 113 N 0.84 0.60 -0.45 1.25 1.08 -2.00 -1.19 115.11 115.24 3hka h GLN 113 Ca 0.46 -0.04 -0.10 0.00 -1.45 0.00 0.00 58.65 57.52 3hka h GLN 113 Cb 0.50 -0.14 -0.02 0.00 -0.05 0.00 0.00 27.48 27.78 3hka h GLN 113 CO -0.28 0.40 -0.14 0.28 -0.95 0.00 0.00 178.83 178.14 3hka h VAL 114 N 0.62 1.26 -0.70 -0.54 2.07 -1.79 -2.57 116.25 114.61 3hka h VAL 114 Ca 0.22 -1.23 0.01 0.00 0.82 0.00 0.00 66.70 66.51 3hka h VAL 114 Cb 0.04 1.07 -0.03 0.00 -1.52 0.00 0.00 31.29 30.84 3hka h VAL 114 CO -0.10 0.42 0.46 1.88 0.02 0.00 0.00 177.57 180.25 3hka h TYR 115 N 0.74 0.88 -0.56 1.57 0.05 -0.72 -2.33 116.97 116.60 3hka h TYR 115 Ca 0.12 0.02 -0.02 0.00 0.05 0.00 0.00 58.73 58.90 3hka h TYR 115 Cb 0.64 -0.30 -0.03 0.00 1.01 0.00 0.00 36.73 38.06 3hka h TYR 115 CO 0.04 0.55 0.27 0.00 -1.05 0.00 0.00 178.16 177.97 3hka h ARG 116 N 0.95 0.79 0.00 4.88 3.08 -0.98 -2.21 114.38 120.88 3hka h ARG 116 Ca 0.26 -0.10 -0.01 0.00 0.07 0.00 0.00 59.98 60.20 3hka h ARG 116 Cb -0.11 -0.15 -0.00 0.00 0.08 0.00 0.00 29.97 29.79 3hka h ARG 116 CO -0.05 0.62 -0.03 0.93 -1.07 0.00 0.00 179.97 180.36 3hka h GLU 117 N 0.79 0.00 -0.11 0.04 5.08 -1.03 -2.74 114.58 116.62 3hka h GLU 117 Ca 0.20 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.56 3hka h GLU 117 Cb 0.09 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.34 3hka h GLU 117 CO -0.03 0.03 0.07 -0.92 -1.00 0.00 0.00 179.01 177.17 3hka h TYR 118 N 0.00 0.14 -0.02 4.33 3.20 -1.31 -3.15 116.97 120.15 3hka h TYR 118 Ca -0.00 0.00 -0.15 0.00 3.14 0.00 0.00 58.73 61.72 3hka h TYR 118 Cb 0.06 -0.05 -0.02 0.00 1.54 0.00 0.00 36.73 38.27 3hka h TYR 118 CO 0.00 0.09 -0.69 0.74 -1.64 0.00 0.00 178.16 176.66 3hka h PHE 119 N 0.14 0.16 0.00 -3.82 0.04 -1.58 -3.21 116.94 108.67 3hka h PHE 119 Ca 0.04 -0.07 -0.01 0.00 2.80 0.00 0.00 57.97 60.72 3hka h PHE 119 Cb -0.01 -0.03 -0.00 0.00 2.20 0.00 0.00 35.95 38.11 3hka h PHE 119 CO -0.07 0.77 -0.07 0.00 -0.60 0.00 0.00 178.31 178.34 3hka h ALA 120 N 1.21 1.26 -0.93 2.45 0.00 -1.47 -2.57 119.26 119.21 3hka h ALA 120 Ca -0.01 -0.06 -0.50 0.00 0.00 0.00 0.00 54.91 54.34 3hka h ALA 120 Cb 1.22 -0.01 -0.29 0.00 0.00 0.00 0.00 17.79 18.71 3hka h ALA 120 CO 0.10 0.09 0.63 1.63 0.00 0.00 0.00 179.25 181.70 3hka n LYS 121 N -3.55 2.19 -3.88 0.00 5.02 -1.21 -4.94 118.16 111.79 3hka n LYS 121 Ca -0.02 -2.83 -0.10 0.00 -2.02 0.00 0.00 58.31 53.35 3hka n LYS 121 Cb 0.19 -2.11 -0.08 0.00 -0.02 0.00 0.00 35.03 33.01 3hka n LYS 121 CO 0.00 0.00 0.00 0.21 -0.52 0.00 0.00 177.40 177.09 3hka s LYS 122 N -3.11 0.69 0.34 1.97 2.20 -0.97 -5.11 119.74 115.74 3hka s LYS 122 Ca 0.54 -0.75 0.07 0.00 -0.36 0.00 0.00 55.97 55.46 3hka s LYS 122 Cb 0.45 0.28 -0.01 0.00 -1.51 0.00 0.00 37.83 37.04 3hka s LYS 122 CO 0.10 -0.19 0.47 0.95 -0.36 0.00 0.00 175.35 176.31 3hka s THR 123 N -2.87 4.01 0.15 3.43 -4.23 -1.26 -4.98 115.64 109.89 3hka s THR 123 Ca -0.03 -1.00 -0.14 0.00 -1.18 0.00 0.00 61.69 59.34 3hka s THR 123 Cb 0.00 -3.38 0.03 0.00 1.34 0.00 0.00 72.50 70.49 3hka s THR 123 CO -0.06 -0.15 1.72 0.77 -0.54 0.00 0.00 174.62 176.37 3hka h SER 124 N 0.89 0.65 -0.78 3.99 4.64 -1.97 -1.75 113.55 119.22 3hka h SER 124 Ca -0.45 -0.14 -0.02 0.00 -0.47 0.00 0.00 61.79 60.71 3hka h SER 124 Cb 1.26 -0.17 -0.04 0.00 -0.31 0.00 0.00 62.40 63.14 3hka h SER 124 CO 0.52 0.61 0.42 1.05 -0.87 0.00 0.00 176.83 178.56 3hka h GLU 125 N 0.64 1.10 -0.12 4.77 9.09 -1.96 -0.49 114.58 127.62 3hka h GLU 125 Ca 0.17 -0.13 -0.00 0.00 0.05 0.00 0.00 59.36 59.44 3hka h GLU 125 Cb 0.14 -0.22 -0.01 0.00 -1.65 0.00 0.00 28.75 27.02 3hka h GLU 125 CO -0.02 0.81 0.06 0.93 0.05 0.00 0.00 179.01 180.84 3hka h GLU 126 N 1.10 0.17 -0.75 1.06 5.08 -1.89 -2.19 114.58 117.16 3hka h GLU 126 Ca 0.28 -0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 58.60 3hka h GLU 126 Cb 0.04 -0.03 -0.04 0.00 0.50 0.00 0.00 28.75 29.22 3hka h GLU 126 CO -0.04 0.23 0.40 0.37 -1.00 0.00 0.00 179.01 178.97 3hka h GLN 127 N 0.07 1.04 -0.46 2.33 5.75 -0.95 -1.20 115.11 121.70 3hka h GLN 127 Ca 0.04 -0.12 0.03 0.00 -0.15 0.00 0.00 58.65 58.45 3hka h GLN 127 Cb 0.12 -0.21 -0.04 0.00 1.07 0.00 0.00 27.48 28.42 3hka h GLN 127 CO -0.01 0.77 0.24 0.28 -2.65 0.00 0.00 178.83 177.47 3hka h VAL 128 N 1.05 0.99 -0.59 2.39 2.07 -0.81 0.36 116.25 121.72 3hka h VAL 128 Ca 0.26 -0.17 -0.06 0.00 0.82 0.00 0.00 66.70 67.56 3hka h VAL 128 Cb 0.04 0.47 -0.02 0.00 -1.52 0.00 0.00 31.29 30.25 3hka h VAL 128 CO -0.04 0.09 0.13 0.44 0.02 0.00 0.00 177.57 178.20 3hka h ASP 129 N 0.48 0.92 0.68 0.57 3.32 -0.93 -0.45 116.42 121.02 3hka h ASP 129 Ca 0.19 -0.24 -0.03 0.00 0.02 0.00 0.00 57.03 56.97 3hka h ASP 129 Cb 0.08 -0.24 0.01 0.00 0.22 0.00 0.00 39.33 39.39 3hka h ASP 129 CO -0.12 0.92 -0.33 0.74 -1.72 0.00 0.00 179.24 178.74 3hka h THR 130 N 0.87 0.31 -0.03 0.35 2.02 -0.51 -2.09 112.91 113.83 3hka h THR 130 Ca 0.18 -0.05 -0.00 0.00 0.77 0.00 0.00 66.41 67.31 3hka h THR 130 Cb 0.38 0.33 -0.00 0.00 -1.74 0.00 0.00 68.15 67.12 3hka h THR 130 CO 0.01 0.01 0.02 0.58 0.37 0.00 0.00 175.52 176.50 3hka h VAL 131 N -0.95 1.10 -0.50 3.16 2.07 -0.29 -1.03 116.25 119.80 3hka h VAL 131 Ca -0.09 -0.28 0.07 0.00 0.82 0.00 0.00 66.70 67.22 3hka h VAL 131 Cb 0.71 1.22 -0.03 0.00 -1.52 0.00 0.00 31.29 31.68 3hka h VAL 131 CO 0.15 0.08 0.33 -0.07 0.02 0.00 0.00 177.57 178.08 3hka h LEU 132 N -0.06 0.33 0.03 2.57 3.38 -1.13 0.12 115.31 120.55 3hka h LEU 132 Ca 0.01 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.98 3hka h LEU 132 Cb 0.11 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 40.79 3hka h LEU 132 CO -0.00 0.21 -0.01 -0.61 0.09 0.00 0.00 178.44 178.12 3hka h GLN 133 N 0.37 -0.04 -0.65 1.13 4.15 -1.02 -0.71 115.11 118.35 3hka h GLN 133 Ca 0.22 0.00 -0.01 0.00 0.77 0.00 0.00 58.65 59.63 3hka h GLN 133 Cb 0.39 0.01 -0.03 0.00 0.21 0.00 0.00 27.48 28.06 3hka h GLN 133 CO -0.05 0.43 0.36 -0.07 -1.93 0.00 0.00 178.83 177.56 3hka h LEU 134 N -0.52 0.81 -0.05 -2.39 3.38 -0.44 -2.21 115.31 113.89 3hka h LEU 134 Ca -0.00 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.87 3hka h LEU 134 Cb 0.49 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.03 3hka h LEU 134 CO 0.01 0.68 -0.06 0.00 0.09 0.00 0.00 178.44 179.15 3hka n ALA 135 N -2.33 2.58 -3.78 1.53 0.00 0.36 -4.92 120.51 113.95 3hka n ALA 135 Ca 0.05 -0.17 -0.26 0.00 0.00 0.00 0.00 53.44 53.06 3hka n ALA 135 Cb 0.09 -1.43 0.04 0.00 0.00 0.00 0.00 19.45 18.15 3hka n ALA 135 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 3hka n ASN 136 N -1.28 -3.71 -4.52 0.00 4.05 -0.39 -4.80 115.26 104.60 3hka n ASN 136 Ca 0.12 -0.75 -0.38 0.00 0.45 0.00 0.00 54.58 54.01 3hka n ASN 136 Cb 0.28 -4.15 -0.11 0.00 1.23 0.00 0.00 39.78 37.03 3hka n ASN 136 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 177.26 173.52 3hka s VAL 137 N -3.43 4.98 -0.03 3.44 1.01 -0.50 -0.73 120.40 125.15 3hka s VAL 137 Ca 0.41 -0.06 0.04 0.00 0.00 0.00 0.00 61.98 62.37 3hka s VAL 137 Cb -0.20 -3.42 -0.25 0.00 0.00 0.00 0.00 36.38 32.51 3hka s VAL 137 CO 0.81 0.20 0.73 0.77 0.00 0.00 0.00 175.10 177.60 3hka h SER 138 N 8.36 0.19 -3.75 3.32 4.64 -0.99 -3.44 113.55 121.87 3hka h SER 138 Ca -0.35 -0.33 -0.29 0.00 -0.47 0.00 0.00 61.79 60.36 3hka h SER 138 Cb 1.17 -0.06 -0.29 0.00 -0.31 0.00 0.00 62.40 62.91 3hka h SER 138 CO 0.58 1.29 -0.74 -1.81 -0.87 0.00 0.00 176.83 175.28 3hka s ASP 139 N -6.58 0.31 -0.12 4.97 1.01 -1.10 -4.81 116.67 110.35 3hka s ASP 139 Ca -0.09 -0.04 0.02 0.00 0.71 0.00 0.00 52.55 53.16 3hka s ASP 139 Cb 0.08 -0.07 0.01 0.00 1.01 0.00 0.00 42.92 43.95 3hka s ASP 139 CO 0.82 0.00 -0.19 -0.69 0.21 0.00 0.00 175.17 175.32 3hka s VAL 140 N 0.16 1.81 -0.17 -1.27 1.01 -0.00 -0.40 120.40 121.54 3hka s VAL 140 Ca -0.01 -0.83 -0.15 0.00 0.00 0.00 0.00 61.98 60.98 3hka s VAL 140 Cb -0.04 -1.62 -0.04 0.00 0.00 0.00 0.00 36.38 34.68 3hka s VAL 140 CO -0.00 0.50 0.36 -0.69 0.00 0.00 0.00 175.10 175.27 3hka s VAL 141 N 0.85 5.25 0.70 2.92 1.01 0.26 0.30 120.40 131.70 3hka s VAL 141 Ca -0.08 0.67 0.00 0.00 0.00 0.00 0.00 61.98 62.57 3hka s VAL 141 Cb -0.15 -3.70 0.12 0.00 0.00 0.00 0.00 36.38 32.65 3hka s VAL 141 CO -0.01 0.33 0.97 -0.04 0.00 0.00 0.00 175.10 176.35 3hka s MET 142 N 0.80 1.77 -0.30 2.72 -1.94 0.19 -1.95 119.30 120.58 3hka s MET 142 Ca 0.19 -1.13 0.03 0.00 -1.71 0.00 0.00 55.69 53.07 3hka s MET 142 Cb -0.14 -2.36 0.08 0.00 2.01 0.00 0.00 34.83 34.42 3hka s MET 142 CO 0.06 -1.36 -0.01 0.99 -0.01 0.00 0.00 175.02 174.69 3hka s THR 143 N -3.09 2.12 -0.28 2.05 2.01 -1.15 -3.47 115.64 113.83 3hka s THR 143 Ca 0.65 -1.97 -0.06 0.00 0.31 0.00 0.00 61.69 60.63 3hka s THR 143 Cb -0.06 -2.43 0.01 0.00 0.01 0.00 0.00 72.50 70.03 3hka s THR 143 CO 0.44 -0.36 0.04 0.20 -0.69 0.00 0.00 174.62 174.24 3hka s ASN 144 N 1.04 4.91 -0.45 3.53 -0.87 -0.41 -4.96 114.94 117.74 3hka s ASN 144 Ca 0.03 -0.66 -0.09 0.00 -1.57 0.00 0.00 52.86 50.56 3hka s ASN 144 Cb -0.19 -1.83 0.10 0.00 -0.02 0.00 0.00 41.25 39.30 3hka s ASN 144 CO -0.08 -0.15 0.31 -0.62 -2.57 0.00 0.00 177.10 173.99 3hka s ASP 145 N 1.48 5.69 0.00 -1.22 2.15 -1.26 -1.28 116.67 122.23 3hka s ASP 145 Ca 0.03 -1.69 0.07 0.00 0.43 0.00 0.00 52.55 51.39 3hka s ASP 145 Cb -0.17 -2.01 0.44 0.00 -0.30 0.00 0.00 42.92 40.88 3hka s ASP 145 CO 0.01 -0.62 0.86 -0.81 -0.17 0.00 0.00 175.17 174.44 3hka n PRO 146 N 4.93 0.41 0.00 4.34 -0.04 -1.26 -1.79 135.00 141.59 3hka n PRO 146 Ca -0.09 0.00 0.10 0.00 -0.04 0.00 0.00 63.50 63.47 3hka n PRO 146 Cb 0.42 -1.28 0.07 0.00 -0.04 0.00 0.00 33.50 32.67 3hka n PRO 146 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 3hka n PHE 147 N -0.78 0.00 -3.68 0.54 3.72 -1.26 -4.83 117.46 111.17 3hka n PHE 147 Ca 0.05 0.00 -0.37 0.00 -0.05 0.00 0.00 57.45 57.08 3hka n PHE 147 Cb 0.03 0.00 -0.11 0.00 -0.94 0.00 0.00 39.48 38.45 3hka n PHE 147 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 3hka s ASP 148 N -1.82 5.70 0.21 4.37 -1.08 -0.74 -5.00 116.67 118.31 3hka s ASP 148 Ca 0.23 -0.06 -0.11 0.00 -0.52 0.00 0.00 52.55 52.09 3hka s ASP 148 Cb 0.17 -2.04 0.29 0.00 -1.46 0.00 0.00 42.92 39.88 3hka s ASP 148 CO 0.30 -0.02 1.65 0.44 0.52 0.00 0.00 175.17 178.07 3hka h ASP 149 N 8.12 -0.35 0.25 -0.34 3.32 -1.89 0.97 116.42 126.50 3hka h ASP 149 Ca -0.37 0.16 -0.01 0.00 0.02 0.00 0.00 57.03 56.84 3hka h ASP 149 Cb 1.18 0.30 -0.00 0.00 0.22 0.00 0.00 39.33 41.03 3hka h ASP 149 CO 0.58 -0.14 -0.14 0.78 -1.72 0.00 0.00 179.24 178.60 3hka h ASN 150 N 0.09 -0.34 0.01 6.45 4.21 -1.95 -2.55 115.58 121.50 3hka h ASN 150 Ca 0.32 0.02 -0.06 0.00 1.21 0.00 0.00 56.30 57.79 3hka h ASN 150 Cb 0.52 0.10 -0.01 0.00 -1.12 0.00 0.00 38.32 37.80 3hka h ASN 150 CO -0.56 -0.23 -0.16 -0.33 -1.29 0.00 0.00 177.43 174.86 3hka h GLU 151 N -0.37 0.30 -0.50 0.81 5.08 -1.77 -2.53 114.58 115.61 3hka h GLU 151 Ca -0.03 -0.08 0.02 0.00 -1.00 0.00 0.00 59.36 58.27 3hka h GLU 151 Cb 0.30 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.49 3hka h GLU 151 CO 0.04 0.47 0.33 -0.09 -1.00 0.00 0.00 179.01 178.76 3hka h ARG 152 N 0.28 0.58 0.28 2.33 2.43 -0.49 -3.03 114.38 116.77 3hka h ARG 152 Ca 0.05 -0.04 -0.01 0.00 -0.81 0.00 0.00 59.98 59.18 3hka h ARG 152 Cb 0.46 -0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 29.86 3hka h ARG 152 CO 0.03 0.39 -0.35 0.82 -1.51 0.00 0.00 179.97 179.34 3hka h ILE 153 N 0.60 0.00 -0.88 1.20 2.04 -1.05 -1.60 117.51 117.82 3hka h ILE 153 Ca 0.20 0.00 0.16 0.00 1.00 0.00 0.00 64.86 66.21 3hka h ILE 153 Cb 0.04 0.00 -0.16 0.00 -0.74 0.00 0.00 36.82 35.97 3hka h ILE 153 CO -0.05 0.00 -0.30 -1.28 0.00 0.00 0.00 178.15 176.53 3hka h SER 154 N -0.65 -1.09 -0.28 1.72 0.87 -1.65 -0.46 113.55 112.01 3hka h SER 154 Ca -0.03 0.28 -0.15 0.00 -1.23 0.00 0.00 61.79 60.65 3hka h SER 154 Cb 0.58 0.63 -0.01 0.00 -0.44 0.00 0.00 62.40 63.16 3hka h SER 154 CO -0.08 -0.30 -0.38 -0.50 -0.53 0.00 0.00 176.83 175.04 3hka h TRP 155 N -0.03 0.99 0.00 2.24 4.06 -1.56 -2.06 115.95 119.59 3hka h TRP 155 Ca 0.37 -0.29 -0.08 0.00 2.06 0.00 0.00 58.89 60.95 3hka h TRP 155 Cb 0.62 -0.21 -0.01 0.00 -1.00 0.00 0.00 29.16 28.56 3hka h TRP 155 CO -0.75 1.08 -0.36 -0.07 -3.56 0.00 0.00 178.44 174.78 3hka h LEU 156 N 0.68 0.00 -0.19 -4.49 3.38 -0.47 -2.45 115.31 111.77 3hka h LEU 156 Ca 0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.03 3hka h LEU 156 Cb 0.95 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.70 3hka h LEU 156 CO 0.09 0.36 0.00 -0.62 0.09 0.00 0.00 178.44 178.36 3hka n GLU 157 N -3.56 1.13 -0.98 1.13 1.02 -0.26 -4.89 120.64 114.24 3hka n GLU 157 Ca -0.00 -0.19 0.00 0.00 -0.02 0.00 0.00 57.16 56.95 3hka n GLU 157 Cb 0.49 -1.45 0.00 0.00 -0.02 0.00 0.00 31.44 30.46 3hka n GLU 157 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3hka n GLY 158 N 0.99 0.43 3.68 0.62 0.00 -0.92 -4.97 105.19 105.01 3hka n GLY 158 Ca 0.21 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.81 3hka n GLY 158 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3hka s LYS 159 N -0.48 4.21 0.12 1.61 2.20 -0.78 -4.99 119.74 121.63 3hka s LYS 159 Ca 0.00 2.18 -0.13 0.00 -0.36 0.00 0.00 55.97 57.66 3hka s LYS 159 Cb 0.00 -3.77 -0.07 0.00 -1.51 0.00 0.00 37.83 32.49 3hka s LYS 159 CO 0.00 -0.75 0.50 -0.65 -0.36 0.00 0.00 175.35 174.09 3hka s GLN 160 N 3.22 3.92 0.54 4.03 -1.52 -1.26 -4.60 119.66 123.99 3hka s GLN 160 Ca 0.71 0.40 -0.09 0.00 -1.95 0.00 0.00 55.36 54.43 3hka s GLN 160 Cb -0.35 -2.96 -0.04 0.00 -0.22 0.00 0.00 33.01 29.44 3hka s GLN 160 CO 0.30 0.51 0.91 -1.25 -0.25 0.00 0.00 175.29 175.50 3hka s PRO 161 N -1.92 3.62 0.30 2.91 0.04 -1.26 -4.99 135.00 133.70 3hka s PRO 161 Ca 0.36 0.52 -0.27 0.00 0.04 0.00 0.00 61.00 61.65 3hka s PRO 161 Cb -0.15 -2.23 -0.14 0.00 0.04 0.00 0.00 34.50 32.03 3hka s PRO 161 CO 0.19 -0.36 0.96 -3.47 0.04 0.00 0.00 177.00 174.35 3hka n ASP 162 N -2.35 1.04 0.14 6.66 -0.08 -1.26 -4.79 116.55 115.90 3hka n ASP 162 Ca 0.04 1.15 0.08 0.00 -1.51 0.00 0.00 54.79 54.55 3hka n ASP 162 Cb 0.54 -1.27 0.43 0.00 2.34 0.00 0.00 41.12 43.17 3hka n ASP 162 CO 0.00 0.00 0.00 -1.54 0.12 0.00 0.00 177.20 175.78 3hka n SER 163 N 1.20 0.41 0.03 1.67 3.41 -1.26 -0.58 113.62 118.50 3hka n SER 163 Ca 0.10 0.65 0.12 0.00 -0.26 0.00 0.00 58.87 59.49 3hka n SER 163 Cb 0.33 -0.68 0.30 0.00 -0.26 0.00 0.00 64.21 63.90 3hka n SER 163 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 3hka n ARG 164 N -2.07 0.12 -4.45 4.33 1.74 -1.26 -4.83 116.66 110.25 3hka n ARG 164 Ca -0.01 0.05 -0.34 0.00 -0.77 0.00 0.00 57.85 56.78 3hka n ARG 164 Cb 0.12 -1.59 -0.11 0.00 -1.02 0.00 0.00 32.46 29.86 3hka n ARG 164 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 3hka s PHE 165 N -3.06 3.03 0.06 -1.55 0.08 0.25 -0.82 117.98 115.97 3hka s PHE 165 Ca 0.10 -0.11 0.09 0.00 0.12 0.00 0.00 56.93 57.12 3hka s PHE 165 Cb 0.16 -1.87 -0.03 0.00 -0.57 0.00 0.00 43.02 40.71 3hka s PHE 165 CO 0.67 0.16 -0.22 -1.01 -0.10 0.00 0.00 175.22 174.71 3hka s HIS 166 N -0.18 2.43 0.33 0.36 3.76 0.15 -4.70 115.29 117.44 3hka s HIS 166 Ca 0.03 -0.33 -0.10 0.00 -0.15 0.00 0.00 55.06 54.51 3hka s HIS 166 Cb -0.13 -1.39 -0.07 0.00 1.11 0.00 0.00 32.58 32.10 3hka s HIS 166 CO 0.02 0.24 0.68 0.00 -0.85 0.00 0.00 174.74 174.83 3hka s ALA 167 N -0.93 3.44 -0.04 -1.40 0.00 -1.26 0.54 121.76 122.10 3hka s ALA 167 Ca 0.14 -0.22 -0.02 0.00 0.00 0.00 0.00 51.96 51.86 3hka s ALA 167 Cb -0.10 -2.59 0.03 0.00 0.00 0.00 0.00 23.12 20.46 3hka s ALA 167 CO 0.05 0.23 0.06 0.00 0.00 0.00 0.00 175.76 176.09 3hka s ALA 168 N -2.11 0.24 -0.60 0.00 0.00 -1.23 -1.27 121.76 116.79 3hka s ALA 168 Ca 0.50 0.19 -0.27 0.00 0.00 0.00 0.00 51.96 52.37 3hka s ALA 168 Cb -0.11 -0.61 0.01 0.00 0.00 0.00 0.00 23.12 22.41 3hka s ALA 168 CO 0.26 -0.48 1.52 -1.17 0.00 0.00 0.00 175.76 175.88 3hka s LEU 169 N 2.13 3.33 -0.09 0.00 2.96 -0.79 -1.29 118.68 124.94 3hka s LEU 169 Ca 0.05 0.20 -0.25 0.00 -0.22 0.00 0.00 54.13 53.90 3hka s LEU 169 Cb -0.12 -2.85 -0.03 0.00 0.50 0.00 0.00 46.19 43.69 3hka s LEU 169 CO -0.03 -1.90 0.81 -0.60 -1.32 0.00 0.00 176.35 173.30 3hka s ARG 170 N 5.94 4.41 -0.13 1.98 6.06 -0.40 -0.64 118.95 136.17 3hka s ARG 170 Ca 0.54 1.04 0.18 0.00 -2.50 0.00 0.00 55.73 54.99 3hka s ARG 170 Cb -0.11 -3.50 0.29 0.00 0.06 0.00 0.00 34.95 31.69 3hka s ARG 170 CO 0.22 -0.10 1.15 1.28 -2.50 0.00 0.00 175.30 175.35 3hka n LEU 171 N 4.32 2.29 -0.21 -0.88 4.77 0.34 -4.45 117.00 123.18 3hka n LEU 171 Ca 0.02 -3.06 0.01 0.00 -0.03 0.00 0.00 56.01 52.96 3hka n LEU 171 Cb 0.50 -0.42 0.10 0.00 -2.33 0.00 0.00 43.42 41.27 3hka n LEU 171 CO 0.48 0.72 0.81 0.44 -1.33 0.00 0.00 177.39 178.51 3hka h ASP 172 N 0.04 -0.36 -0.93 -1.43 5.19 -1.93 -1.29 116.42 115.70 3hka h ASP 172 Ca -0.00 0.17 0.06 0.00 -0.62 0.00 0.00 57.03 56.64 3hka h ASP 172 Cb 1.01 0.31 -0.06 0.00 0.18 0.00 0.00 39.33 40.77 3hka h ASP 172 CO 0.00 -0.15 0.61 -0.65 -3.12 0.00 0.00 179.24 175.93 3hka h PRO 173 N 0.08 1.06 -0.04 3.56 0.11 -1.94 0.18 132.00 135.01 3hka h PRO 173 Ca 0.33 -0.06 -0.02 0.00 0.11 0.00 0.00 66.00 66.36 3hka h PRO 173 Cb 0.54 -0.24 -0.00 0.00 0.11 0.00 0.00 31.00 31.41 3hka h PRO 173 CO -0.58 0.70 -0.05 1.25 -0.21 0.00 0.00 178.00 179.11 3hka h LEU 174 N 1.09 0.12 0.16 2.35 5.85 -1.57 -1.43 115.31 121.88 3hka h LEU 174 Ca 0.39 -0.51 -0.31 0.00 0.84 0.00 0.00 57.88 58.29 3hka h LEU 174 Cb 0.15 -0.03 0.03 0.00 0.37 0.00 0.00 40.66 41.17 3hka h LEU 174 CO -0.14 0.61 -1.32 -0.07 -0.34 0.00 0.00 178.44 177.18 3hka h LEU 175 N -0.37 0.74 0.00 2.25 4.07 -1.26 -3.21 115.31 117.54 3hka h LEU 175 Ca 0.01 -0.75 0.00 0.00 0.08 0.00 0.00 57.88 57.22 3hka h LEU 175 Cb 0.58 -0.24 0.00 0.00 1.08 0.00 0.00 40.66 42.08 3hka h LEU 175 CO 0.01 1.57 -1.39 0.59 -1.08 0.00 0.00 178.44 178.15 3hka n ASN 176 N -3.70 0.50 -2.59 -0.43 3.02 0.60 -3.56 115.26 109.11 3hka n ASN 176 Ca -0.13 -0.35 -0.05 0.00 -0.03 0.00 0.00 54.58 54.03 3hka n ASN 176 Cb 1.03 1.30 0.04 0.00 -0.61 0.00 0.00 39.78 41.55 3hka n ASN 176 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3hka n GLU 177 N -1.96 2.03 -0.24 3.52 1.02 -0.55 -4.92 120.64 119.53 3hka n GLU 177 Ca 0.00 -3.58 0.04 0.00 -0.02 0.00 0.00 57.16 53.61 3hka n GLU 177 Cb 0.46 -1.68 0.17 0.00 -0.02 0.00 0.00 31.44 30.37 3hka n GLU 177 CO 0.00 0.00 0.00 -0.92 1.18 0.00 0.00 177.13 177.39 3hka h TYR 178 N 2.44 0.44 -0.97 -0.32 3.20 -1.53 0.52 116.97 120.75 3hka h TYR 178 Ca -0.04 0.04 0.22 0.00 3.14 0.00 0.00 58.73 62.09 3hka h TYR 178 Cb 1.35 -0.08 -0.08 0.00 1.54 0.00 0.00 36.73 39.45 3hka h TYR 178 CO 0.56 0.04 0.63 1.49 -1.64 0.00 0.00 178.16 179.23 3hka h GLU 179 N 0.40 0.46 0.00 1.82 4.57 -1.90 0.19 114.58 120.12 3hka h GLU 179 Ca 0.39 -0.03 -0.12 0.00 -1.18 0.00 0.00 59.36 58.43 3hka h GLU 179 Cb 0.60 -0.10 -0.02 0.00 -0.16 0.00 0.00 28.75 29.06 3hka h GLU 179 CO -0.41 0.30 -1.94 0.00 -1.18 0.00 0.00 179.01 175.79 3hka n GLN 180 N -4.59 0.66 0.07 1.92 0.00 -0.69 -4.38 117.38 110.38 3hka n GLN 180 Ca 0.22 -0.07 -0.06 0.00 0.00 0.00 0.00 57.00 57.10 3hka n GLN 180 Cb 0.73 -1.59 -0.08 0.00 0.00 0.00 0.00 30.24 29.31 3hka n GLN 180 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.06 178.21 3hka h THR 181 N 0.00 1.62 -0.27 -0.39 2.02 0.14 -3.29 112.91 112.74 3hka h THR 181 Ca -0.17 -3.20 0.08 0.00 0.77 0.00 0.00 66.41 63.89 3hka h THR 181 Cb 1.41 2.74 -0.01 0.00 -1.74 0.00 0.00 68.15 70.55 3hka h THR 181 CO 0.01 0.90 0.20 0.07 0.37 0.00 0.00 175.52 177.07 3hka h LYS 182 N 0.00 0.00 -0.07 6.66 2.10 -0.87 0.36 116.57 124.76 3hka h LYS 182 Ca -0.01 0.00 -0.07 0.00 -2.00 0.00 0.00 60.65 58.57 3hka h LYS 182 Cb 1.67 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.99 3hka h LYS 182 CO 0.12 0.00 -0.28 0.45 -2.00 0.00 0.00 179.45 177.74 3hka h HIS 183 N 0.00 0.13 0.07 0.07 3.86 -1.82 -2.25 115.15 115.22 3hka h HIS 183 Ca 0.13 -0.02 -0.27 0.00 -1.16 0.00 0.00 60.37 59.04 3hka h HIS 183 Cb 0.52 -0.03 -0.02 0.00 1.06 0.00 0.00 27.41 28.94 3hka h HIS 183 CO 0.00 0.39 -1.36 0.00 0.86 0.00 0.00 177.93 177.83 3hka h ARG 184 N 0.11 0.15 -0.87 2.45 3.08 -1.15 -2.98 114.38 115.17 3hka h ARG 184 Ca 0.02 -0.25 -0.02 0.00 0.07 0.00 0.00 59.98 59.80 3hka h ARG 184 Cb 0.56 0.09 -0.04 0.00 0.08 0.00 0.00 29.97 30.66 3hka h ARG 184 CO 0.04 1.02 0.48 -0.07 -1.07 0.00 0.00 179.97 180.37 3hka h LEU 185 N 0.04 1.08 -0.30 3.04 3.38 -1.07 -1.26 115.31 120.22 3hka h LEU 185 Ca -0.16 -0.09 -0.03 0.00 0.09 0.00 0.00 57.88 57.68 3hka h LEU 185 Cb 1.94 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 42.40 3hka h LEU 185 CO 0.15 0.86 0.06 0.03 0.09 0.00 0.00 178.44 179.62 3hka h ARG 186 N 1.21 0.49 0.00 1.13 3.08 -1.22 0.16 114.38 119.23 3hka h ARG 186 Ca 0.31 -0.13 0.00 0.00 0.07 0.00 0.00 59.98 60.23 3hka h ARG 186 Cb 0.02 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.01 3hka h ARG 186 CO -0.05 0.58 0.00 -0.44 -1.07 0.00 0.00 179.97 178.99 3hka h ASP 187 N 0.32 0.00 -0.33 7.04 3.45 -1.26 -1.18 116.42 124.46 3hka h ASP 187 Ca 0.09 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.55 3hka h ASP 187 Cb 0.33 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.10 3hka h ASP 187 CO 0.00 0.00 0.00 0.79 -1.57 0.00 0.00 179.24 178.46 3hka n TRP 188 N -2.52 0.41 0.00 4.55 8.01 -0.52 -4.94 117.44 122.42 3hka n TRP 188 Ca -0.01 -0.21 0.00 0.00 -1.31 0.00 0.00 57.50 55.98 3hka n TRP 188 Cb 0.12 0.00 0.00 0.00 -2.01 0.00 0.00 31.31 29.42 3hka n TRP 188 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 3hka n GLY 189 N 1.49 0.32 3.41 6.99 0.00 -0.44 -5.03 105.19 111.92 3hka n GLY 189 Ca 0.19 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.77 3hka n GLY 189 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3hka s TYR 190 N -2.00 2.92 -1.08 1.61 2.02 0.49 -4.96 117.35 116.35 3hka s TYR 190 Ca 0.00 -0.91 -0.20 0.00 -0.37 0.00 0.00 57.07 55.59 3hka s TYR 190 Cb 0.00 -4.16 -0.07 0.00 -0.40 0.00 0.00 41.96 37.33 3hka s TYR 190 CO 0.00 -1.45 1.98 1.63 -1.57 0.00 0.00 175.55 176.13 3hka n LYS 191 N 6.81 2.06 -3.12 -0.62 4.01 -1.26 -2.75 118.16 123.28 3hka n LYS 191 Ca -0.01 -2.33 -0.37 0.00 -0.51 0.00 0.00 58.31 55.09 3hka n LYS 191 Cb 0.45 -3.24 -0.06 0.00 -0.51 0.00 0.00 35.03 31.67 3hka n LYS 191 CO 0.00 0.00 0.00 0.14 -1.11 0.00 0.00 177.40 176.43 3hka s VAL 192 N 5.66 4.58 0.75 -0.18 -7.23 -1.26 -4.54 120.40 118.18 3hka s VAL 192 Ca 0.57 1.29 -0.03 0.00 -1.81 0.00 0.00 61.98 62.00 3hka s VAL 192 Cb 0.10 -3.89 0.15 0.00 0.56 0.00 0.00 36.38 33.31 3hka s VAL 192 CO 0.07 0.29 1.03 -3.20 -0.31 0.00 0.00 175.10 172.98 3hka n ASN 193 N 0.95 1.08 -0.47 4.85 4.05 -1.26 -4.93 115.26 119.53 3hka n ASN 193 Ca -0.04 -1.98 0.12 0.00 0.45 0.00 0.00 54.58 53.13 3hka n ASN 193 Cb 0.51 -0.69 0.48 0.00 1.23 0.00 0.00 39.78 41.30 3hka n ASN 193 CO 0.00 0.00 0.00 0.47 -3.05 0.00 0.00 177.26 174.68 3hka n ASP 194 N -3.08 1.44 -4.52 1.20 8.00 -1.26 -4.84 116.55 113.49 3hka n ASP 194 Ca 0.16 -1.57 -0.25 0.00 0.71 0.00 0.00 54.79 53.84 3hka n ASP 194 Cb 0.57 -0.05 -0.10 0.00 -0.02 0.00 0.00 41.12 41.52 3hka n ASP 194 CO 0.00 0.00 0.00 -1.83 -0.39 0.00 0.00 177.20 174.98 3hka s GLU 195 N -1.90 1.77 -1.13 -1.24 -1.05 -1.26 -5.06 118.70 108.83 3hka s GLU 195 Ca 0.35 -1.90 -0.05 0.00 -0.15 0.00 0.00 54.97 53.22 3hka s GLU 195 Cb 0.19 -1.63 0.27 0.00 -0.44 0.00 0.00 34.13 32.52 3hka s GLU 195 CO 0.30 0.14 1.59 1.87 0.95 0.00 0.00 175.26 180.11 3hka n TRP 196 N -0.75 2.39 -2.94 4.83 -0.00 -1.26 -4.73 117.44 114.98 3hka n TRP 196 Ca -0.05 -2.61 -0.20 0.00 -0.00 0.00 0.00 57.50 54.64 3hka n TRP 196 Cb 0.63 -1.42 0.06 0.00 -0.00 0.00 0.00 31.31 30.58 3hka n TRP 196 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 177.69 178.23 3hka s ASN 197 N -1.17 5.05 0.31 5.87 4.22 -1.26 -4.92 114.94 123.04 3hka s ASN 197 Ca 0.33 -0.68 0.04 0.00 -2.14 0.00 0.00 52.86 50.40 3hka s ASN 197 Cb 0.06 0.08 0.63 0.00 1.28 0.00 0.00 41.25 43.31 3hka s ASN 197 CO 0.08 -1.35 1.86 -0.08 -2.04 0.00 0.00 177.10 175.58 3hka h GLU 198 N 0.11 0.88 -0.09 3.55 4.57 -1.99 -1.85 114.58 119.76 3hka h GLU 198 Ca -0.33 -0.05 0.01 0.00 -1.18 0.00 0.00 59.36 57.82 3hka h GLU 198 Cb 1.28 -0.20 -0.01 0.00 -0.16 0.00 0.00 28.75 29.66 3hka h GLU 198 CO 0.41 0.58 0.00 0.78 -1.18 0.00 0.00 179.01 179.61 3hka h GLY 199 N 0.91 0.09 0.97 1.92 0.00 -1.94 -0.55 103.07 104.46 3hka h GLY 199 Ca 0.46 0.01 -0.02 0.00 0.00 0.00 0.00 47.33 47.78 3hka h GLY 199 CO -0.22 -0.01 0.23 1.76 0.00 0.00 0.00 176.54 178.29 3hka h SER 200 N 0.03 0.60 -0.29 0.19 0.02 -1.65 -1.55 113.55 110.91 3hka h SER 200 Ca 0.04 -0.12 0.04 0.00 -0.84 0.00 0.00 61.79 60.91 3hka h SER 200 Cb 0.05 -0.15 -0.04 0.00 0.14 0.00 0.00 62.40 62.40 3hka h SER 200 CO -0.07 0.55 0.05 0.40 -1.14 0.00 0.00 176.83 176.62 3hka h ILE 201 N 0.60 0.85 -0.66 3.27 2.04 -1.12 -1.64 117.51 120.85 3hka h ILE 201 Ca 0.16 -0.05 -0.02 0.00 1.00 0.00 0.00 64.86 65.94 3hka h ILE 201 Cb 0.11 0.69 -0.03 0.00 -0.74 0.00 0.00 36.82 36.85 3hka h ILE 201 CO -0.02 0.03 0.32 1.56 0.00 0.00 0.00 178.15 180.03 3hka h GLN 202 N 0.15 0.96 -0.46 2.37 1.08 -0.89 -2.42 115.11 115.89 3hka h GLN 202 Ca 0.13 -0.14 -0.09 0.00 -1.45 0.00 0.00 58.65 57.11 3hka h GLN 202 Cb 0.15 -0.17 -0.02 0.00 -0.05 0.00 0.00 27.48 27.39 3hka h GLN 202 CO -0.19 0.76 -0.06 0.93 -0.95 0.00 0.00 178.83 179.32 3hka h GLU 203 N 0.92 0.80 -0.52 1.46 4.39 -0.93 -0.89 114.58 119.81 3hka h GLU 203 Ca 0.23 -0.24 -0.07 0.00 0.34 0.00 0.00 59.36 59.61 3hka h GLU 203 Cb 0.12 -0.08 -0.02 0.00 -0.10 0.00 0.00 28.75 28.67 3hka h GLU 203 CO -0.03 0.84 0.04 0.28 -1.16 0.00 0.00 179.01 178.99 3hka h VAL 204 N 0.73 1.26 -0.62 3.13 2.07 -1.16 -0.27 116.25 121.39 3hka h VAL 204 Ca 0.13 -1.02 0.03 0.00 0.82 0.00 0.00 66.70 66.66 3hka h VAL 204 Cb 0.53 0.90 -0.04 0.00 -1.52 0.00 0.00 31.29 31.16 3hka h VAL 204 CO 0.03 0.36 0.37 0.11 0.02 0.00 0.00 177.57 178.47 3hka h LYS 205 N 0.76 0.71 -0.63 1.57 1.57 -1.13 -0.88 116.57 118.54 3hka h LYS 205 Ca 0.15 -0.04 0.02 0.00 -1.87 0.00 0.00 60.65 58.91 3hka h LYS 205 Cb 0.47 -0.16 -0.04 0.00 0.08 0.00 0.00 32.23 32.58 3hka h LYS 205 CO 0.02 0.47 0.39 -0.09 -0.57 0.00 0.00 179.45 179.67 3hka h ARG 206 N 0.73 0.76 0.12 3.15 2.43 -0.66 0.36 114.38 121.27 3hka h ARG 206 Ca 0.25 -0.05 0.01 0.00 -0.81 0.00 0.00 59.98 59.39 3hka h ARG 206 Cb 0.05 -0.17 -0.02 0.00 -0.42 0.00 0.00 29.97 29.41 3hka h ARG 206 CO -0.11 0.50 -0.16 0.35 -1.51 0.00 0.00 179.97 179.04 3hka h PHE 207 N 0.78 -0.42 -0.14 2.20 3.57 -0.31 0.30 116.94 122.91 3hka h PHE 207 Ca 0.25 0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.77 3hka h PHE 207 Cb -0.01 0.17 -0.01 0.00 2.79 0.00 0.00 35.95 38.89 3hka h PHE 207 CO -0.05 -0.24 0.05 -0.07 -2.23 0.00 0.00 178.31 175.77 3hka h LEU 208 N -0.33 0.06 -0.37 0.59 3.38 -0.68 -1.44 115.31 116.53 3hka h LEU 208 Ca 0.01 0.01 0.03 0.00 0.09 0.00 0.00 57.88 58.03 3hka h LEU 208 Cb 0.33 0.01 -0.03 0.00 0.09 0.00 0.00 40.66 41.06 3hka h LEU 208 CO -0.07 0.06 0.17 0.74 0.09 0.00 0.00 178.44 179.43 3hka h THR 209 N 0.12 0.96 -0.37 0.22 2.02 -0.03 -0.42 112.91 115.40 3hka h THR 209 Ca 0.06 -0.12 0.02 0.00 0.77 0.00 0.00 66.41 67.14 3hka h THR 209 Cb 0.03 0.58 -0.03 0.00 -1.74 0.00 0.00 68.15 67.00 3hka h THR 209 CO -0.06 0.06 0.21 0.44 0.37 0.00 0.00 175.52 176.55 3hka h ASP 210 N 0.35 0.34 0.99 4.18 3.32 -0.15 -1.84 116.42 123.60 3hka h ASP 210 Ca 0.16 0.01 -0.02 0.00 0.02 0.00 0.00 57.03 57.19 3hka h ASP 210 Cb 0.09 -0.07 -0.00 0.00 0.22 0.00 0.00 39.33 39.57 3hka h ASP 210 CO -0.12 0.25 -0.10 -0.50 -1.72 0.00 0.00 179.24 177.04 3hka h TRP 211 N 0.44 0.00 -0.10 4.55 4.06 -0.93 -0.89 115.95 123.08 3hka h TRP 211 Ca 0.15 0.00 -0.18 0.00 2.06 0.00 0.00 58.89 60.92 3hka h TRP 211 Cb 0.01 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 28.17 3hka h TRP 211 CO -0.08 0.10 -0.71 0.82 -3.56 0.00 0.00 178.44 175.02 3hka h ILE 212 N 0.00 1.36 -0.15 1.49 2.04 -0.61 -0.67 117.51 120.97 3hka h ILE 212 Ca -0.00 -2.08 -0.05 0.00 1.00 0.00 0.00 64.86 63.73 3hka h ILE 212 Cb 0.62 2.05 -0.00 0.00 -0.74 0.00 0.00 36.82 38.75 3hka h ILE 212 CO 0.01 0.63 -0.09 -0.33 0.00 0.00 0.00 178.15 178.37 3hka h GLU 213 N 0.32 0.34 -0.45 2.37 5.08 -0.64 0.53 114.58 122.12 3hka h GLU 213 Ca -0.03 -0.15 -0.13 0.00 -1.00 0.00 0.00 59.36 58.05 3hka h GLU 213 Cb 1.28 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 30.51 3hka h GLU 213 CO 0.12 0.67 -0.24 -0.09 -1.00 0.00 0.00 179.01 178.47 3hka h ARG 214 N -0.00 0.93 0.02 2.33 2.43 -1.18 -3.34 114.38 115.58 3hka h ARG 214 Ca 0.03 -0.41 -0.33 0.00 -0.81 0.00 0.00 59.98 58.46 3hka h ARG 214 Cb 0.58 -0.03 -0.05 0.00 -0.42 0.00 0.00 29.97 30.05 3hka h ARG 214 CO 0.03 1.07 -2.01 -1.33 -1.51 0.00 0.00 179.97 176.21 3hka n MET 215 N -4.10 0.67 -3.62 0.20 2.81 -0.26 -5.01 117.12 107.81 3hka n MET 215 Ca -0.00 0.20 -0.27 0.00 -1.81 0.00 0.00 57.70 55.82 3hka n MET 215 Cb 0.47 -1.68 0.04 0.00 -0.71 0.00 0.00 33.22 31.34 3hka n MET 215 CO 0.00 0.00 0.00 -3.47 1.51 0.00 0.00 175.97 174.01 3hka n ASP 216 N -3.06 -4.70 -4.79 7.83 2.03 0.18 -4.67 116.55 109.38 3hka n ASP 216 Ca -0.26 -0.93 -0.34 0.00 0.52 0.00 0.00 54.79 53.78 3hka n ASP 216 Cb 1.07 -3.80 -0.00 0.00 -0.72 0.00 0.00 41.12 37.67 3hka n ASP 216 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 3hka s PRO 217 N -5.72 3.40 0.46 -0.67 0.04 -1.26 -4.66 135.00 126.59 3hka s PRO 217 Ca 0.38 1.40 0.26 0.00 0.04 0.00 0.00 61.00 63.08 3hka s PRO 217 Cb -0.12 -2.03 0.69 0.00 0.04 0.00 0.00 34.50 33.08 3hka s PRO 217 CO 0.83 -0.77 1.73 -0.39 0.04 0.00 0.00 177.00 178.45 3hka h VAL 218 N 0.95 0.00 -1.59 -0.36 -1.51 -1.54 -3.47 116.25 108.73 3hka h VAL 218 Ca -0.49 -0.81 0.25 0.00 -1.23 0.00 0.00 66.70 64.43 3hka h VAL 218 Cb 1.24 1.80 -0.17 0.00 -2.13 0.00 0.00 31.29 32.03 3hka h VAL 218 CO 0.57 0.00 0.77 -0.72 -1.23 0.00 0.00 177.57 176.96 3hka s TYR 219 N -3.34 -0.14 -0.04 5.19 -0.85 -1.26 -4.25 117.35 112.66 3hka s TYR 219 Ca 0.05 0.06 -0.03 0.00 -0.52 0.00 0.00 57.07 56.63 3hka s TYR 219 Cb 0.07 0.53 -0.04 0.00 0.38 0.00 0.00 41.96 42.90 3hka s TYR 219 CO 0.62 -0.28 0.12 -1.64 -1.52 0.00 0.00 175.55 172.85 3hka s MET 220 N -2.53 3.25 0.11 -3.49 -1.94 -0.78 -1.89 119.30 112.04 3hka s MET 220 Ca 0.10 -0.35 0.00 0.00 -1.71 0.00 0.00 55.69 53.73 3hka s MET 220 Cb 0.00 -3.00 -0.04 0.00 2.01 0.00 0.00 34.83 33.80 3hka s MET 220 CO -0.05 0.69 -0.01 0.00 -0.01 0.00 0.00 175.02 175.64 3hka s ALA 221 N -1.17 0.88 -0.10 3.03 0.00 0.18 0.16 121.76 124.74 3hka s ALA 221 Ca 0.22 -1.38 -0.27 0.00 0.00 0.00 0.00 51.96 50.53 3hka s ALA 221 Cb -0.12 0.43 0.06 0.00 0.00 0.00 0.00 23.12 23.49 3hka s ALA 221 CO 0.12 -0.35 0.62 0.54 0.00 0.00 0.00 175.76 176.69 3hka s VAL 222 N -3.82 0.01 -0.11 0.00 0.11 -0.72 -0.50 120.40 115.37 3hka s VAL 222 Ca 0.16 -0.06 -0.03 0.00 -2.93 0.00 0.00 61.98 59.11 3hka s VAL 222 Cb 0.07 -0.93 -0.03 0.00 -1.53 0.00 0.00 36.38 33.96 3hka s VAL 222 CO -0.03 -0.03 0.02 -0.94 -3.33 0.00 0.00 175.10 170.78 3hka s SER 223 N -0.79 5.32 0.16 3.54 1.04 -1.26 -1.62 113.70 120.10 3hka s SER 223 Ca -0.08 0.13 0.08 0.00 0.48 0.00 0.00 55.95 56.56 3hka s SER 223 Cb -0.02 -1.61 -0.04 0.00 0.10 0.00 0.00 66.02 64.45 3hka s SER 223 CO 0.07 0.33 -0.17 -0.76 0.98 0.00 0.00 173.24 173.69 3hka s LEU 224 N -0.60 2.44 0.74 2.42 1.43 0.48 -4.93 118.68 120.66 3hka s LEU 224 Ca 0.10 -0.87 -0.12 0.00 -1.03 0.00 0.00 54.13 52.22 3hka s LEU 224 Cb -0.12 -0.79 0.04 0.00 0.03 0.00 0.00 46.19 45.35 3hka s LEU 224 CO 0.02 -0.06 1.11 -2.16 0.23 0.00 0.00 176.35 175.49 3hka s PRO 225 N -2.83 2.55 0.58 1.29 0.04 -1.25 -0.46 135.00 134.91 3hka s PRO 225 Ca 0.15 0.47 0.27 0.00 0.04 0.00 0.00 61.00 61.93 3hka s PRO 225 Cb -0.05 -1.99 1.65 0.00 0.04 0.00 0.00 34.50 34.15 3hka s PRO 225 CO 0.06 -1.26 2.14 -1.35 0.04 0.00 0.00 177.00 176.63 3hka h PRO 226 N -0.82 0.00 -0.14 0.56 0.11 -1.76 -1.00 132.00 128.96 3hka h PRO 226 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 3hka h PRO 226 Cb 1.27 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.38 3hka h PRO 226 CO 0.63 0.00 0.00 0.25 -0.21 0.00 0.00 178.00 178.67 3hka n THR 227 N -3.92 0.18 -1.65 -1.15 -2.24 -1.26 -3.97 114.28 100.27 3hka n THR 227 Ca 0.00 -0.21 -0.48 0.00 -2.27 0.00 0.00 64.05 61.10 3hka n THR 227 Cb 0.25 0.08 -0.05 0.00 -2.10 0.00 0.00 70.33 68.52 3hka n THR 227 CO 0.00 0.00 0.00 0.33 -0.57 0.00 0.00 175.07 174.83 3hka n PHE 228 N -0.09 2.09 -4.06 4.78 7.35 -0.38 -4.98 117.46 122.18 3hka n PHE 228 Ca 0.10 0.35 -0.10 0.00 -0.76 0.00 0.00 57.45 57.03 3hka n PHE 228 Cb 0.17 -2.50 -0.11 0.00 0.35 0.00 0.00 39.48 37.39 3hka n PHE 228 CO 0.00 0.00 0.00 -1.12 -0.76 0.00 0.00 176.76 174.88 3hka s SER 229 N 0.92 0.63 -0.28 -2.13 0.01 -1.26 -4.65 113.70 106.95 3hka s SER 229 Ca 0.81 -0.68 -0.19 0.00 1.31 0.00 0.00 55.95 57.19 3hka s SER 229 Cb -0.75 0.09 0.10 0.00 0.21 0.00 0.00 66.02 65.68 3hka s SER 229 CO 0.41 -0.34 0.81 0.12 0.41 0.00 0.00 173.24 174.65 3hka s PHE 230 N -2.19 -0.80 0.86 2.43 2.19 -1.26 -4.46 117.98 114.75 3hka s PHE 230 Ca -0.06 1.71 -0.10 0.00 0.33 0.00 0.00 56.93 58.81 3hka s PHE 230 Cb -0.05 0.45 0.11 0.00 -1.31 0.00 0.00 43.02 42.23 3hka s PHE 230 CO -0.03 -0.40 1.12 -2.14 1.83 0.00 0.00 175.22 175.60 3hka s PRO 231 N 1.09 1.47 -0.22 10.12 0.02 -1.26 -4.15 135.00 142.07 3hka s PRO 231 Ca -0.06 1.33 -0.16 0.00 0.02 0.00 0.00 61.00 62.13 3hka s PRO 231 Cb -0.05 -1.80 0.06 0.00 0.02 0.00 0.00 34.50 32.74 3hka s PRO 231 CO -0.12 -2.25 0.55 -2.00 -0.33 0.00 0.00 177.00 172.86 3hka s GLU 232 N -4.76 0.59 -1.32 5.54 2.12 -1.26 -5.07 118.70 114.55 3hka s GLU 232 Ca 0.64 0.91 -0.13 0.00 0.36 0.00 0.00 54.97 56.75 3hka s GLU 232 Cb -0.20 0.17 0.12 0.00 0.26 0.00 0.00 34.13 34.48 3hka s GLU 232 CO 0.57 -0.12 1.86 0.39 -0.54 0.00 0.00 175.26 177.42 3hka n GLU 233 N 3.64 3.31 -4.14 4.30 -0.58 -1.26 -3.75 120.64 122.15 3hka n GLU 233 Ca -0.18 -3.31 -0.13 0.00 -0.42 0.00 0.00 57.16 53.12 3hka n GLU 233 Cb 0.57 -3.13 -0.07 0.00 -0.57 0.00 0.00 31.44 28.23 3hka n GLU 233 CO 0.00 0.00 0.00 -1.54 -0.48 0.00 0.00 177.13 175.11 3hka s SER 234 N 2.37 0.43 0.14 1.62 1.04 -1.26 -5.00 113.70 113.03 3hka s SER 234 Ca 0.44 -1.34 -0.17 0.00 0.48 0.00 0.00 55.95 55.36 3hka s SER 234 Cb 0.07 0.51 -0.00 0.00 0.10 0.00 0.00 66.02 66.70 3hka s SER 234 CO -0.01 -1.03 1.79 0.78 0.98 0.00 0.00 173.24 175.75 3hka h ASN 235 N 2.37 0.33 -0.55 7.02 2.35 -1.90 -0.63 115.58 124.56 3hka h ASN 235 Ca -0.31 -0.00 0.02 0.00 -0.55 0.00 0.00 56.30 55.47 3hka h ASN 235 Cb 1.25 -0.07 -0.03 0.00 0.05 0.00 0.00 38.32 39.51 3hka h ASN 235 CO 0.44 0.24 0.34 -0.09 -1.65 0.00 0.00 177.43 176.70 3hka h ARG 236 N 0.41 0.65 -0.68 0.81 2.43 -1.89 0.80 114.38 116.91 3hka h ARG 236 Ca 0.13 -0.04 -0.05 0.00 -0.81 0.00 0.00 59.98 59.21 3hka h ARG 236 Cb -0.01 -0.15 -0.03 0.00 -0.42 0.00 0.00 29.97 29.36 3hka h ARG 236 CO -0.05 0.43 0.24 0.78 -1.51 0.00 0.00 179.97 179.86 3hka h GLY 237 N 0.67 1.11 1.25 2.80 0.00 -1.59 -1.56 103.07 105.75 3hka h GLY 237 Ca 0.22 -0.64 -0.21 0.00 0.00 0.00 0.00 47.33 46.70 3hka h GLY 237 CO -0.09 0.60 -0.71 3.21 0.00 0.00 0.00 176.54 179.55 3hka h ARG 238 N 0.98 0.75 -0.46 4.80 3.08 -0.83 -2.44 114.38 120.26 3hka h ARG 238 Ca 0.22 -0.58 -0.04 0.00 0.07 0.00 0.00 59.98 59.65 3hka h ARG 238 Cb 0.26 0.11 -0.02 0.00 0.08 0.00 0.00 29.97 30.40 3hka h ARG 238 CO -0.01 1.19 0.13 0.82 -1.07 0.00 0.00 179.97 181.03 3hka h ILE 239 N 0.53 1.23 -0.16 2.04 2.04 -0.74 0.13 117.51 122.59 3hka h ILE 239 Ca -0.03 -0.79 -0.01 0.00 1.00 0.00 0.00 64.86 65.03 3hka h ILE 239 Cb 1.32 0.87 -0.01 0.00 -0.74 0.00 0.00 36.82 38.27 3hka h ILE 239 CO 0.15 0.28 0.08 0.40 0.00 0.00 0.00 178.15 179.05 3hka h ILE 240 N 0.61 1.12 0.37 -0.67 2.04 -1.31 0.19 117.51 119.86 3hka h ILE 240 Ca 0.15 -0.35 -0.02 0.00 1.00 0.00 0.00 64.86 65.64 3hka h ILE 240 Cb 0.30 1.07 0.00 0.00 -0.74 0.00 0.00 36.82 37.46 3hka h ILE 240 CO -0.00 0.11 -0.18 -0.09 0.00 0.00 0.00 178.15 178.00 3hka h ARG 241 N 0.13 -0.48 0.00 2.37 2.43 -1.32 -1.15 114.38 116.36 3hka h ARG 241 Ca 0.05 0.03 -0.03 0.00 -0.81 0.00 0.00 59.98 59.23 3hka h ARG 241 Cb 0.11 0.11 -0.00 0.00 -0.42 0.00 0.00 29.97 29.77 3hka h ARG 241 CO -0.01 -0.17 -0.13 -0.44 -1.51 0.00 0.00 179.97 177.72 3hka h ASP 242 N -0.81 0.00 0.00 -3.80 3.32 -0.80 -3.40 116.42 110.92 3hka h ASP 242 Ca -0.05 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.00 3hka h ASP 242 Cb 0.53 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.08 3hka h ASP 242 CO 0.08 0.13 0.00 0.00 -1.72 0.00 0.00 179.24 177.73 3hka h LEU 244 N 0.00 -0.21 -0.30 0.00 5.85 -1.24 -2.29 115.31 117.12 3hka h LEU 244 Ca 0.00 0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.73 3hka h LEU 244 Cb 0.00 0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.08 3hka h LEU 244 CO 0.00 -0.13 0.16 -0.07 -0.34 0.00 0.00 178.44 178.06 3hka h LEU 245 N -0.19 0.38 -0.51 2.25 3.38 -1.44 0.96 115.31 120.13 3hka h LEU 245 Ca -0.00 -0.10 0.02 0.00 0.09 0.00 0.00 57.88 57.88 3hka h LEU 245 Cb 0.17 -0.10 -0.03 0.00 0.09 0.00 0.00 40.66 40.80 3hka h LEU 245 CO -0.01 0.37 0.31 -0.65 0.09 0.00 0.00 178.44 178.55 3hka h PRO 246 N 0.36 0.60 -0.45 1.13 0.11 -1.77 -0.35 132.00 131.63 3hka h PRO 246 Ca 0.10 -0.04 -0.11 0.00 0.11 0.00 0.00 66.00 66.07 3hka h PRO 246 Cb 0.08 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 31.04 3hka h PRO 246 CO -0.02 0.40 -0.15 0.28 -0.21 0.00 0.00 178.00 178.31 3hka h VAL 247 N 0.62 1.27 -0.83 3.15 2.07 -1.31 -1.55 116.25 119.68 3hka h VAL 247 Ca 0.20 -1.28 -0.01 0.00 0.82 0.00 0.00 66.70 66.42 3hka h VAL 247 Cb -0.00 1.15 -0.04 0.00 -1.52 0.00 0.00 31.29 30.88 3hka h VAL 247 CO -0.08 0.44 0.46 0.00 0.02 0.00 0.00 177.57 178.42 3hka h ALA 248 N 0.86 1.06 -0.40 1.67 0.00 -0.49 -1.54 119.26 120.42 3hka h ALA 248 Ca 0.11 -0.12 -0.11 0.00 0.00 0.00 0.00 54.91 54.79 3hka h ALA 248 Cb 0.70 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 3hka h ALA 248 CO 0.05 0.56 -0.17 1.49 0.00 0.00 0.00 179.25 181.18 3hka h GLU 249 N 1.15 0.83 -0.82 0.00 4.81 -0.91 0.12 114.58 119.75 3hka h GLU 249 Ca 0.29 -0.35 -0.03 0.00 -0.13 0.00 0.00 59.36 59.14 3hka h GLU 249 Cb 0.01 -0.03 -0.04 0.00 0.63 0.00 0.00 28.75 29.33 3hka h GLU 249 CO -0.05 0.99 0.38 -0.22 -0.73 0.00 0.00 179.01 179.38 3hka h LYS 250 N 0.64 1.19 -0.11 1.92 3.64 -0.97 -2.37 116.57 120.52 3hka h LYS 250 Ca 0.09 -0.18 0.00 0.00 -1.27 0.00 0.00 60.65 59.29 3hka h LYS 250 Cb 0.73 -0.21 0.00 0.00 -0.41 0.00 0.00 32.23 32.33 3hka h LYS 250 CO 0.05 0.92 0.00 0.72 -2.27 0.00 0.00 179.45 178.88 3hka n HIS 251 N -4.30 0.12 -3.96 1.91 8.25 -0.61 -4.96 115.22 111.68 3hka n HIS 251 Ca 0.08 -0.06 -0.29 0.00 -0.26 0.00 0.00 57.72 57.19 3hka n HIS 251 Cb 0.15 0.00 0.01 0.00 1.12 0.00 0.00 29.99 31.26 3hka n HIS 251 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 3hka n ASN 252 N 0.79 -3.11 -4.50 0.41 5.15 0.27 -4.97 115.26 109.30 3hka n ASN 252 Ca 0.17 -0.88 -0.33 0.00 -0.60 0.00 0.00 54.58 52.94 3hka n ASN 252 Cb 0.47 -3.52 -0.12 0.00 -0.53 0.00 0.00 39.78 36.08 3hka n ASN 252 CO 0.00 0.00 0.00 0.27 1.40 0.00 0.00 177.26 178.93 3hka s ILE 253 N -3.47 3.57 0.84 -1.44 -4.36 -0.31 -4.88 121.20 111.15 3hka s ILE 253 Ca 0.46 -0.50 -0.12 0.00 -0.26 0.00 0.00 60.65 60.23 3hka s ILE 253 Cb -0.24 -2.50 0.10 0.00 1.25 0.00 0.00 42.46 41.08 3hka s ILE 253 CO 0.86 0.55 1.17 -2.84 0.24 0.00 0.00 174.94 174.92 3hka s PRO 254 N -0.20 1.50 -0.25 0.37 0.02 -1.26 -4.65 135.00 130.53 3hka s PRO 254 Ca 0.02 1.62 -0.01 0.00 0.02 0.00 0.00 61.00 62.65 3hka s PRO 254 Cb -0.13 -1.77 0.03 0.00 0.02 0.00 0.00 34.50 32.65 3hka s PRO 254 CO 0.03 -2.29 -0.07 0.12 -0.33 0.00 0.00 177.00 174.45 3hka s PHE 255 N -2.41 3.07 -0.19 6.54 5.36 -0.22 -1.87 117.98 128.27 3hka s PHE 255 Ca 0.69 -1.65 -0.15 0.00 -0.96 0.00 0.00 56.93 54.86 3hka s PHE 255 Cb -0.25 -2.04 -0.04 0.00 -0.34 0.00 0.00 43.02 40.35 3hka s PHE 255 CO 0.53 -0.75 0.35 0.00 -1.46 0.00 0.00 175.22 173.89 3hka s ALA 256 N 1.30 3.56 -0.16 11.12 0.00 0.12 -1.06 121.76 136.65 3hka s ALA 256 Ca -0.01 -0.52 0.01 0.00 0.00 0.00 0.00 51.96 51.45 3hka s ALA 256 Cb -0.17 -2.54 0.02 0.00 0.00 0.00 0.00 23.12 20.42 3hka s ALA 256 CO -0.05 -0.17 -0.19 -1.64 0.00 0.00 0.00 175.76 173.70 3hka s MET 257 N 1.04 2.84 -0.46 0.00 1.00 0.84 -1.75 119.30 122.81 3hka s MET 257 Ca 0.18 -0.78 -0.03 0.00 0.00 0.00 0.00 55.69 55.06 3hka s MET 257 Cb -0.14 -2.40 0.12 0.00 0.00 0.00 0.00 34.83 32.40 3hka s MET 257 CO 0.07 -0.14 0.25 -1.64 0.00 0.00 0.00 175.02 173.56 3hka s MET 258 N 1.14 2.12 -0.10 2.03 -1.94 -0.64 -2.37 119.30 119.54 3hka s MET 258 Ca 0.00 -1.98 -0.11 0.00 -1.71 0.00 0.00 55.69 51.89 3hka s MET 258 Cb -0.14 -3.61 -0.05 0.00 2.01 0.00 0.00 34.83 33.04 3hka s MET 258 CO -0.08 -1.10 0.24 0.42 -0.01 0.00 0.00 175.02 174.49 3hka s ILE 259 N 0.87 5.33 0.00 2.53 1.01 -0.82 -0.39 121.20 129.73 3hka s ILE 259 Ca 0.10 0.45 0.00 0.00 0.00 0.00 0.00 60.65 61.20 3hka s ILE 259 Cb -0.22 -3.54 0.00 0.00 0.01 0.00 0.00 42.46 38.71 3hka s ILE 259 CO -0.04 0.55 0.00 0.61 0.00 0.00 0.00 174.94 176.06 3hka n GLY 260 N 2.31 0.92 3.72 6.18 0.00 0.39 -0.58 105.19 118.14 3hka n GLY 260 Ca -0.17 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.46 3hka n GLY 260 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hka s VAL 261 N -1.68 5.09 -0.50 1.61 0.11 -0.89 -2.05 120.40 122.09 3hka s VAL 261 Ca 0.00 1.27 -0.11 0.00 -2.93 0.00 0.00 61.98 60.21 3hka s VAL 261 Cb 0.00 -3.96 0.13 0.00 -1.53 0.00 0.00 36.38 31.01 3hka s VAL 261 CO 0.00 0.27 0.40 -0.75 -3.33 0.00 0.00 175.10 171.69 3hka s LYS 262 N 0.79 2.64 0.34 1.54 2.20 -0.20 -3.81 119.74 123.24 3hka s LYS 262 Ca 0.33 -1.78 -0.29 0.00 -0.36 0.00 0.00 55.97 53.88 3hka s LYS 262 Cb -0.17 -4.04 -0.11 0.00 -1.51 0.00 0.00 37.83 32.01 3hka s LYS 262 CO 0.15 -1.24 1.39 0.15 -0.36 0.00 0.00 175.35 175.45 3hka s LYS 263 N 1.38 4.25 -1.30 4.03 -0.14 -1.26 -0.66 119.74 126.05 3hka s LYS 263 Ca 0.05 2.36 -0.12 0.00 -1.36 0.00 0.00 55.97 56.91 3hka s LYS 263 Cb -0.27 -3.04 0.00 0.00 -1.68 0.00 0.00 37.83 32.85 3hka s LYS 263 CO 0.00 -0.35 0.56 0.54 -0.76 0.00 0.00 175.35 175.34 3hka n ARG 264 N 0.84 -2.06 0.17 1.68 1.74 -1.22 -4.86 116.66 112.95 3hka n ARG 264 Ca 0.01 0.36 0.13 0.00 -0.77 0.00 0.00 57.85 57.59 3hka n ARG 264 Cb 0.41 -4.08 0.43 0.00 -1.02 0.00 0.00 32.46 28.20 3hka n ARG 264 CO 0.00 0.00 0.00 -0.39 -1.52 0.00 0.00 177.63 175.72 3hka h VAL 265 N -1.96 0.00 -2.55 1.55 -1.51 -0.80 -3.32 116.25 107.67 3hka h VAL 265 Ca -0.66 -0.54 -0.59 0.00 -1.23 0.00 0.00 66.70 63.68 3hka h VAL 265 Cb 1.38 1.47 -0.39 0.00 -2.13 0.00 0.00 31.29 31.61 3hka h VAL 265 CO 0.57 0.00 -0.88 -2.28 -1.23 0.00 0.00 177.57 173.74 3hka s HIS 266 N -3.29 1.43 0.24 5.19 5.65 -0.95 -5.03 115.29 118.53 3hka s HIS 266 Ca 0.06 -2.35 -0.10 0.00 0.25 0.00 0.00 55.06 52.92 3hka s HIS 266 Cb 0.09 -1.23 0.37 0.00 -1.18 0.00 0.00 32.58 30.63 3hka s HIS 266 CO 0.55 -0.79 1.61 -1.35 -0.65 0.00 0.00 174.74 174.11 3hka h PRO 267 N 5.93 0.02 -0.12 2.88 0.11 -1.83 -1.77 132.00 137.22 3hka h PRO 267 Ca 0.19 -0.00 0.03 0.00 0.11 0.00 0.00 66.00 66.34 3hka h PRO 267 Cb 0.90 -0.01 -0.00 0.00 0.11 0.00 0.00 31.00 32.00 3hka h PRO 267 CO 0.41 0.02 0.21 0.00 -0.21 0.00 0.00 178.00 178.42 3hka h ALA 268 N 1.76 1.56 -0.00 -0.75 0.00 -1.95 -0.97 119.26 118.90 3hka h ALA 268 Ca 0.39 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.30 3hka h ALA 268 Cb 0.64 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.44 3hka h ALA 268 CO -0.77 -0.27 -0.06 1.28 0.00 0.00 0.00 179.25 179.44 3hka n LEU 269 N -3.44 0.26 0.00 0.00 4.77 -0.67 -4.97 117.00 112.95 3hka n LEU 269 Ca 0.00 0.10 0.00 0.00 -0.03 0.00 0.00 56.01 56.08 3hka n LEU 269 Cb 0.31 -0.20 0.00 0.00 -2.33 0.00 0.00 43.42 41.20 3hka n LEU 269 CO 0.23 0.05 0.00 0.61 -1.33 0.00 0.00 177.39 176.94 3hka n GLY 270 N 1.25 3.59 0.15 -0.72 0.00 -0.37 -1.66 105.19 107.43 3hka n GLY 270 Ca 0.16 -0.11 0.11 0.00 0.00 0.00 0.00 46.02 46.18 3hka n GLY 270 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3hka n ASP 271 N 4.99 0.55 -0.98 1.61 8.00 -1.26 -1.14 116.55 128.32 3hka n ASP 271 Ca 0.00 0.74 0.11 0.00 0.71 0.00 0.00 54.79 56.35 3hka n ASP 271 Cb 0.00 -0.82 0.27 0.00 -0.02 0.00 0.00 41.12 40.55 3hka n ASP 271 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3hka n ALA 272 N -1.76 2.44 -0.97 2.24 0.00 -0.66 -4.38 120.51 117.42 3hka n ALA 272 Ca -0.01 -0.87 0.05 0.00 0.00 0.00 0.00 53.44 52.61 3hka n ALA 272 Cb 0.06 -0.95 0.35 0.00 0.00 0.00 0.00 19.45 18.92 3hka n ALA 272 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hka n GLY 273 N 1.39 3.40 3.87 0.00 0.00 -0.29 -4.83 105.19 108.74 3hka n GLY 273 Ca 0.18 -0.98 -0.34 0.00 0.00 0.00 0.00 46.02 44.88 3hka n GLY 273 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3hka s ASP 274 N -1.14 6.62 0.15 1.61 1.01 -1.26 -0.26 116.67 123.40 3hka s ASP 274 Ca 0.52 0.76 0.00 0.00 0.71 0.00 0.00 52.55 54.55 3hka s ASP 274 Cb 0.41 -2.17 0.00 0.00 1.01 0.00 0.00 42.92 42.17 3hka s ASP 274 CO 0.14 0.17 0.04 0.33 0.21 0.00 0.00 175.17 176.05 3hka n PHE 275 N 0.85 -0.20 -4.21 4.23 7.35 0.17 -4.91 117.46 120.74 3hka n PHE 275 Ca -0.08 -0.72 -0.13 0.00 -0.76 0.00 0.00 57.45 55.76 3hka n PHE 275 Cb 0.52 -0.11 -0.10 0.00 0.35 0.00 0.00 39.48 40.14 3hka n PHE 275 CO 0.00 0.00 0.00 0.54 -0.76 0.00 0.00 176.76 176.54 3hka s VAL 276 N -1.28 0.96 -0.03 -2.13 0.11 -1.26 -1.03 120.40 115.74 3hka s VAL 276 Ca 0.03 -1.95 -0.27 0.00 -2.93 0.00 0.00 61.98 56.87 3hka s VAL 276 Cb -0.00 -1.71 0.06 0.00 -1.53 0.00 0.00 36.38 33.20 3hka s VAL 276 CO 0.02 -0.76 0.59 -0.83 -3.33 0.00 0.00 175.10 170.79 3hka s GLY 277 N -3.00 -0.48 0.23 6.54 0.00 -0.87 -4.85 107.32 104.88 3hka s GLY 277 Ca 0.13 1.04 -0.30 0.00 0.00 0.00 0.00 44.72 45.59 3hka s GLY 277 CO -0.01 0.72 1.10 1.25 0.00 0.00 0.00 173.10 176.15 3hka s LYS 278 N -1.40 4.62 0.32 2.90 2.20 -1.26 -4.42 119.74 122.70 3hka s LYS 278 Ca -0.11 1.76 0.08 0.00 -0.36 0.00 0.00 55.97 57.34 3hka s LYS 278 Cb -0.01 -3.23 -0.03 0.00 -1.51 0.00 0.00 37.83 33.04 3hka s LYS 278 CO 0.07 0.15 0.21 0.00 -0.36 0.00 0.00 175.35 175.42 3hka s ALA 279 N -0.70 3.65 0.37 3.13 0.00 -1.26 -4.76 121.76 122.20 3hka s ALA 279 Ca 0.47 -1.68 -0.20 0.00 0.00 0.00 0.00 51.96 50.54 3hka s ALA 279 Cb -0.31 -1.01 -0.10 0.00 0.00 0.00 0.00 23.12 21.70 3hka s ALA 279 CO 0.38 0.06 0.88 0.45 0.00 0.00 0.00 175.76 177.53 3hka s SER 280 N -3.91 6.96 0.00 0.00 0.15 -1.25 -4.95 113.70 110.70 3hka s SER 280 Ca 0.38 1.58 0.27 0.00 0.70 0.00 0.00 55.95 58.89 3hka s SER 280 Cb -0.05 -2.49 0.89 0.00 -1.71 0.00 0.00 66.02 62.66 3hka s SER 280 CO 0.25 -0.25 1.65 0.23 1.20 0.00 0.00 173.24 176.31 3hka n MET 281 N -0.30 0.90 -0.16 5.44 2.81 -1.26 -4.43 117.12 120.12 3hka n MET 281 Ca 0.05 -0.49 -0.03 0.00 -1.81 0.00 0.00 57.70 55.42 3hka n MET 281 Cb 0.53 -1.49 0.07 0.00 -0.71 0.00 0.00 33.22 31.62 3hka n MET 281 CO 0.00 0.00 0.00 -0.44 1.51 0.00 0.00 175.97 177.04 3hka h ASP 282 N 1.20 0.13 -0.64 7.83 5.19 -1.93 0.59 116.42 128.79 3hka h ASP 282 Ca 0.00 0.07 -0.09 0.00 -0.62 0.00 0.00 57.03 56.39 3hka h ASP 282 Cb 0.47 0.07 -0.02 0.00 0.18 0.00 0.00 39.33 40.03 3hka h ASP 282 CO 0.00 0.10 0.05 1.23 -3.12 0.00 0.00 179.24 177.50 3hka h GLY 283 N 0.32 1.19 0.90 2.75 0.00 -1.77 -0.26 103.07 106.20 3hka h GLY 283 Ca 0.25 -0.84 -0.09 0.00 0.00 0.00 0.00 47.33 46.65 3hka h GLY 283 CO -0.27 0.78 -0.16 -2.08 0.00 0.00 0.00 176.54 174.80 3hka h VAL 284 N 1.02 1.30 -0.80 4.60 2.07 -1.76 -2.07 116.25 120.61 3hka h VAL 284 Ca 0.19 -1.27 0.03 0.00 0.82 0.00 0.00 66.70 66.47 3hka h VAL 284 Cb 0.51 1.53 -0.05 0.00 -1.52 0.00 0.00 31.29 31.76 3hka h VAL 284 CO 0.02 0.40 0.51 -0.08 0.02 0.00 0.00 177.57 178.44 3hka h GLU 285 N 0.33 0.96 -0.12 1.57 4.81 -0.74 -1.54 114.58 119.86 3hka h GLU 285 Ca 0.06 -0.06 -0.01 0.00 -0.13 0.00 0.00 59.36 59.22 3hka h GLU 285 Cb 0.69 -0.22 -0.01 0.00 0.63 0.00 0.00 28.75 29.84 3hka h GLU 285 CO 0.05 0.64 0.05 1.25 -0.73 0.00 0.00 179.01 180.26 3hka h HIS 286 N 0.99 0.18 -0.52 0.92 2.76 -0.93 -2.06 115.15 116.50 3hka h HIS 286 Ca 0.32 -0.01 0.02 0.00 -2.20 0.00 0.00 60.37 58.50 3hka h HIS 286 Cb 0.01 -0.06 -0.03 0.00 1.55 0.00 0.00 27.41 28.88 3hka h HIS 286 CO -0.03 0.27 0.31 -0.07 -1.30 0.00 0.00 177.93 177.11 3hka h LEU 287 N 0.05 0.51 -0.08 0.26 3.38 -1.12 0.57 115.31 118.88 3hka h LEU 287 Ca 0.04 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.01 3hka h LEU 287 Cb 0.16 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 40.80 3hka h LEU 287 CO -0.00 0.36 0.04 -0.07 0.09 0.00 0.00 178.44 178.86 3hka h LEU 288 N 0.63 0.11 -0.18 1.67 3.38 -1.22 -1.92 115.31 117.78 3hka h LEU 288 Ca 0.21 -0.11 -0.08 0.00 0.09 0.00 0.00 57.88 57.99 3hka h LEU 288 Cb 0.01 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 40.73 3hka h LEU 288 CO -0.09 0.19 -0.19 -0.09 0.09 0.00 0.00 178.44 178.35 3hka h ARG 289 N 0.02 0.44 0.00 1.13 2.43 -1.21 -3.32 114.38 113.86 3hka h ARG 289 Ca 0.03 -0.24 0.00 0.00 -0.81 0.00 0.00 59.98 58.96 3hka h ARG 289 Cb 0.11 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.67 3hka h ARG 289 CO -0.00 0.81 -0.12 0.39 -1.51 0.00 0.00 179.97 179.54 3hka n GLU 290 N -4.48 0.11 -3.16 0.20 -0.58 0.18 -4.17 120.64 108.74 3hka n GLU 290 Ca -0.06 0.07 -0.24 0.00 -0.42 0.00 0.00 57.16 56.52 3hka n GLU 290 Cb 0.40 -1.61 -0.05 0.00 -0.57 0.00 0.00 31.44 29.61 3hka n GLU 290 CO 0.00 0.00 0.00 0.66 -0.48 0.00 0.00 177.13 177.31 3hka n TYR 291 N -1.79 2.07 0.33 -0.32 4.01 -0.72 -4.93 117.16 115.81 3hka n TYR 291 Ca 0.06 -3.90 0.22 0.00 -0.16 0.00 0.00 57.90 54.12 3hka n TYR 291 Cb 0.38 -0.46 1.16 0.00 -0.31 0.00 0.00 39.34 40.11 3hka n TYR 291 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 3hka h PRO 292 N 3.45 0.00 -0.05 -0.72 0.13 -1.72 -1.67 132.00 131.42 3hka h PRO 292 Ca 0.13 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.26 3hka h PRO 292 Cb 0.74 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.87 3hka h PRO 292 CO 0.67 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.53 3hka n ASN 293 N -3.03 1.65 -4.71 1.44 5.03 -1.26 -4.86 115.26 109.53 3hka n ASN 293 Ca -0.03 -1.58 -0.30 0.00 0.87 0.00 0.00 54.58 53.55 3hka n ASN 293 Cb 0.08 -0.02 -0.08 0.00 -1.02 0.00 0.00 39.78 38.74 3hka n ASN 293 CO 0.00 0.00 0.00 0.20 -1.83 0.00 0.00 177.26 175.63 3hka s ASN 294 N -1.91 5.13 -0.05 6.41 -0.87 -0.63 -4.75 114.94 118.27 3hka s ASN 294 Ca 0.36 -0.15 -0.00 0.00 -1.57 0.00 0.00 52.86 51.50 3hka s ASN 294 Cb 0.20 -1.25 -0.03 0.00 -0.02 0.00 0.00 41.25 40.15 3hka s ASN 294 CO 0.32 0.17 -0.01 -0.54 -2.57 0.00 0.00 177.10 174.47 3hka s LYS 295 N -2.37 2.88 -0.07 -0.60 1.02 -1.26 -4.86 119.74 114.47 3hka s LYS 295 Ca 0.27 -0.50 0.02 0.00 0.02 0.00 0.00 55.97 55.77 3hka s LYS 295 Cb -0.12 -2.72 0.02 0.00 -0.52 0.00 0.00 37.83 34.49 3hka s LYS 295 CO 0.19 0.67 -0.11 -0.06 -0.92 0.00 0.00 175.35 175.12 3hka s PHE 296 N -0.96 1.37 -0.19 3.18 0.08 -0.21 -1.05 117.98 120.20 3hka s PHE 296 Ca 0.16 -0.51 -0.05 0.00 0.12 0.00 0.00 56.93 56.64 3hka s PHE 296 Cb -0.11 -1.03 -0.03 0.00 -0.57 0.00 0.00 43.02 41.27 3hka s PHE 296 CO 0.05 -0.29 0.01 -0.51 -0.10 0.00 0.00 175.22 174.39 3hka s LEU 297 N 0.78 3.38 0.00 -0.37 1.43 -0.22 -0.92 118.68 122.77 3hka s LEU 297 Ca -0.13 -0.12 0.02 0.00 -1.03 0.00 0.00 54.13 52.87 3hka s LEU 297 Cb -0.15 -1.85 -0.01 0.00 0.03 0.00 0.00 46.19 44.21 3hka s LEU 297 CO 0.02 0.11 -0.06 -0.69 0.23 0.00 0.00 176.35 175.96 3hka s VAL 298 N 0.74 0.44 -0.04 -1.59 1.01 -0.63 -0.11 120.40 120.22 3hka s VAL 298 Ca 0.01 -0.38 -0.04 0.00 0.00 0.00 0.00 61.98 61.57 3hka s VAL 298 Cb -0.14 -0.40 0.01 0.00 0.00 0.00 0.00 36.38 35.85 3hka s VAL 298 CO 0.02 0.03 0.11 0.28 0.00 0.00 0.00 175.10 175.54 3hka s THR 299 N -0.35 -0.00 0.11 3.92 -1.32 -1.00 -1.59 115.64 115.41 3hka s THR 299 Ca -0.00 0.01 0.10 0.00 -1.21 0.00 0.00 61.69 60.59 3hka s THR 299 Cb -0.03 -0.17 -0.04 0.00 -1.51 0.00 0.00 72.50 70.75 3hka s THR 299 CO -0.00 0.00 -0.26 -0.04 -2.21 0.00 0.00 174.62 172.12 3hka s MET 300 N 0.13 1.38 0.07 7.08 -1.94 -1.26 -1.94 119.30 122.82 3hka s MET 300 Ca -0.01 -1.28 0.06 0.00 -1.71 0.00 0.00 55.69 52.76 3hka s MET 300 Cb -0.01 -1.80 -0.23 0.00 2.01 0.00 0.00 34.83 34.80 3hka s MET 300 CO -0.00 0.43 1.11 1.25 -0.01 0.00 0.00 175.02 177.80 3hka h LEU 301 N 4.03 0.07 -9.64 -0.03 5.85 -1.15 -3.42 115.31 111.03 3hka h LEU 301 Ca -0.49 -0.09 -0.51 0.00 0.84 0.00 0.00 57.88 57.62 3hka h LEU 301 Cb 1.17 -0.02 -0.02 0.00 0.37 0.00 0.00 40.66 42.15 3hka h LEU 301 CO 0.40 1.07 0.33 -0.55 -0.34 0.00 0.00 178.44 179.35 3hka s SER 302 N -6.66 7.52 0.31 1.25 0.15 -1.26 -4.52 113.70 110.50 3hka s SER 302 Ca -0.01 1.81 -0.00 0.00 0.70 0.00 0.00 55.95 58.44 3hka s SER 302 Cb 0.09 -2.58 0.50 0.00 -1.71 0.00 0.00 66.02 62.32 3hka s SER 302 CO 0.83 0.03 1.96 -0.09 1.20 0.00 0.00 173.24 177.17 3hka h ARG 303 N 5.03 0.95 0.00 5.44 2.43 -1.95 -2.39 114.38 123.90 3hka h ARG 303 Ca -0.44 -0.08 0.00 0.00 -0.81 0.00 0.00 59.98 58.65 3hka h ARG 303 Cb 1.21 -0.20 0.00 0.00 -0.42 0.00 0.00 29.97 30.55 3hka h ARG 303 CO 0.70 0.67 0.00 0.39 -1.51 0.00 0.00 179.97 180.22 3hka n GLU 304 N -4.39 0.44 -0.01 0.20 4.71 -1.26 -2.67 120.64 117.66 3hka n GLU 304 Ca 0.07 0.06 0.10 0.00 -0.01 0.00 0.00 57.16 57.38 3hka n GLU 304 Cb 0.07 -1.50 -0.15 0.00 -1.01 0.00 0.00 31.44 28.85 3hka n GLU 304 CO 0.00 0.00 0.00 0.09 0.09 0.00 0.00 177.13 177.31 3hka n ASN 305 N -1.17 0.43 0.07 1.62 5.03 -0.90 -4.70 115.26 115.64 3hka n ASN 305 Ca 0.12 -0.30 -0.12 0.00 0.87 0.00 0.00 54.58 55.16 3hka n ASN 305 Cb 0.13 1.67 -0.05 0.00 -1.02 0.00 0.00 39.78 40.51 3hka n ASN 305 CO 0.00 0.00 0.00 1.56 -1.83 0.00 0.00 177.26 176.99 3hka h GLN 306 N 0.00 -0.31 -0.15 3.52 1.08 -1.56 -1.51 115.11 116.19 3hka h GLN 306 Ca 0.00 0.02 -0.00 0.00 -1.45 0.00 0.00 58.65 57.22 3hka h GLN 306 Cb 0.81 0.07 -0.01 0.00 -0.05 0.00 0.00 27.48 28.31 3hka h GLN 306 CO 0.00 -0.21 0.09 1.25 -0.95 0.00 0.00 178.83 179.01 3hka h HIS 307 N -0.32 0.20 0.00 2.96 2.76 -1.84 -2.18 115.15 116.73 3hka h HIS 307 Ca 0.04 -0.00 -0.04 0.00 -2.20 0.00 0.00 60.37 58.18 3hka h HIS 307 Cb 0.38 -0.06 -0.01 0.00 1.55 0.00 0.00 27.41 29.27 3hka h HIS 307 CO -0.22 0.18 -0.17 1.05 -1.30 0.00 0.00 177.93 177.48 3hka h GLU 308 N 0.16 0.00 -0.53 5.26 4.11 -1.84 -1.51 114.58 120.23 3hka h GLU 308 Ca 0.05 0.00 -0.12 0.00 0.07 0.00 0.00 59.36 59.36 3hka h GLU 308 Cb 0.04 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.28 3hka h GLU 308 CO -0.01 0.17 -0.14 1.25 0.07 0.00 0.00 179.01 180.35 3hka h LEU 309 N 0.00 1.03 -0.25 3.06 5.85 -0.86 -0.83 115.31 123.32 3hka h LEU 309 Ca -0.00 -0.36 -0.01 0.00 0.84 0.00 0.00 57.88 58.35 3hka h LEU 309 Cb 0.40 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 41.14 3hka h LEU 309 CO 0.02 1.16 0.11 0.58 -0.34 0.00 0.00 178.44 179.97 3hka h VAL 310 N 0.90 1.15 -0.93 1.05 2.07 -0.68 -1.52 116.25 118.29 3hka h VAL 310 Ca 0.13 -0.43 0.03 0.00 0.82 0.00 0.00 66.70 67.25 3hka h VAL 310 Cb 0.72 0.98 -0.05 0.00 -1.52 0.00 0.00 31.29 31.42 3hka h VAL 310 CO 0.05 0.15 0.61 0.58 0.02 0.00 0.00 177.57 178.98 3hka h VAL 311 N 0.26 1.16 -0.70 2.57 2.07 -1.18 -1.34 116.25 119.09 3hka h VAL 311 Ca 0.08 -0.40 -0.04 0.00 0.82 0.00 0.00 66.70 67.17 3hka h VAL 311 Cb 0.13 -0.11 -0.03 0.00 -1.52 0.00 0.00 31.29 29.76 3hka h VAL 311 CO -0.01 0.21 0.28 0.25 0.02 0.00 0.00 177.57 178.33 3hka h LEU 312 N 1.17 0.95 -1.78 2.57 5.85 -0.64 -1.23 115.31 122.19 3hka h LEU 312 Ca 0.37 -0.13 -0.03 0.00 0.84 0.00 0.00 57.88 58.92 3hka h LEU 312 Cb 0.01 -0.25 -0.00 0.00 0.37 0.00 0.00 40.66 40.79 3hka h LEU 312 CO -0.11 0.84 -0.15 0.00 -0.34 0.00 0.00 178.44 178.69 3hka h ALA 313 N 1.29 1.59 0.00 1.25 0.00 -0.24 -0.57 119.26 122.58 3hka h ALA 313 Ca 0.24 -0.13 -0.05 0.00 0.00 0.00 0.00 54.91 54.96 3hka h ALA 313 Cb 0.19 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 3hka h ALA 313 CO -0.02 0.18 -0.26 0.00 0.00 0.00 0.00 179.25 179.15 3hka h ARG 314 N 0.00 0.00 0.10 0.00 3.08 -0.70 -3.20 114.38 113.66 3hka h ARG 314 Ca -0.00 0.00 -0.31 0.00 0.07 0.00 0.00 59.98 59.74 3hka h ARG 314 Cb 0.29 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.32 3hka h ARG 314 CO 0.02 0.26 -1.60 0.87 -1.07 0.00 0.00 179.97 178.45 3hka h LYS 315 N 0.00 0.21 -4.54 0.04 1.79 -0.91 -3.46 116.57 109.70 3hka h LYS 315 Ca -0.00 -0.36 -0.58 0.00 -2.18 0.00 0.00 60.65 57.53 3hka h LYS 315 Cb 0.66 0.13 -0.36 0.00 -1.58 0.00 0.00 32.23 31.08 3hka h LYS 315 CO 0.03 1.04 -0.82 -0.06 -1.08 0.00 0.00 179.45 178.56 3hka s PHE 316 N -2.61 2.00 -0.50 -1.35 0.08 -0.88 -4.98 117.98 109.73 3hka s PHE 316 Ca -0.10 -1.11 0.25 0.00 0.12 0.00 0.00 56.93 56.09 3hka s PHE 316 Cb 0.07 -1.50 0.94 0.00 -0.57 0.00 0.00 43.02 41.96 3hka s PHE 316 CO 0.84 -0.63 1.75 0.66 -0.10 0.00 0.00 175.22 177.74 3hka h SER 317 N 8.08 0.00 -0.28 1.36 4.64 -1.90 -2.49 113.55 122.97 3hka h SER 317 Ca -0.35 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.97 3hka h SER 317 Cb 1.13 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.22 3hka h SER 317 CO 0.49 0.00 0.00 -0.46 -0.87 0.00 0.00 176.83 175.99 3hka n ASN 318 N -2.35 2.16 -4.28 4.97 6.94 -1.26 -4.72 115.26 116.71 3hka n ASN 318 Ca 0.03 -2.16 -0.33 0.00 -0.02 0.00 0.00 54.58 52.10 3hka n ASN 318 Cb 0.31 -0.36 -0.15 0.00 -2.36 0.00 0.00 39.78 37.22 3hka n ASN 318 CO 0.00 0.00 0.00 -0.22 -1.03 0.00 0.00 177.26 176.01 3hka s LEU 319 N -1.05 2.50 -0.19 -4.53 2.96 -0.94 -1.04 118.68 116.38 3hka s LEU 319 Ca 0.21 -0.45 0.01 0.00 -0.22 0.00 0.00 54.13 53.68 3hka s LEU 319 Cb 0.13 -1.56 0.04 0.00 0.50 0.00 0.00 46.19 45.30 3hka s LEU 319 CO 0.11 0.11 -0.10 -0.32 -1.32 0.00 0.00 176.35 174.82 3hka s MET 320 N 0.69 1.98 0.20 1.98 -2.45 -0.10 -4.93 119.30 116.68 3hka s MET 320 Ca -0.07 -0.80 -0.12 0.00 -1.25 0.00 0.00 55.69 53.44 3hka s MET 320 Cb -0.16 -2.37 -0.07 0.00 1.25 0.00 0.00 34.83 33.48 3hka s MET 320 CO 0.02 -0.42 0.57 0.96 1.05 0.00 0.00 175.02 177.19 3hka s ILE 321 N 1.42 4.87 0.00 10.11 -4.36 -1.26 -1.60 121.20 130.38 3hka s ILE 321 Ca -0.01 0.68 -0.07 0.00 -0.26 0.00 0.00 60.65 60.99 3hka s ILE 321 Cb -0.16 -3.67 0.00 0.00 1.25 0.00 0.00 42.46 39.88 3hka s ILE 321 CO -0.08 0.06 0.13 0.72 0.24 0.00 0.00 174.94 176.01 3hka s PHE 322 N -1.67 0.05 0.33 1.37 -0.12 -0.62 -2.36 117.98 114.94 3hka s PHE 322 Ca 0.44 -0.14 0.00 0.00 -0.05 0.00 0.00 56.93 57.18 3hka s PHE 322 Cb -0.13 -0.05 0.00 0.00 -0.63 0.00 0.00 43.02 42.21 3hka s PHE 322 CO 0.20 -0.27 0.00 0.41 -0.05 0.00 0.00 175.22 175.50 3hka n GLY 323 N 1.51 -1.77 2.88 1.99 0.00 -0.24 -4.39 105.19 105.18 3hka n GLY 323 Ca -0.22 -0.86 -0.30 0.00 0.00 0.00 0.00 46.02 44.64 3hka n GLY 323 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hka s TRP 325 N -0.33 3.02 0.00 0.00 -0.00 -1.26 -3.01 118.94 117.35 3hka s TRP 325 Ca 0.19 0.99 0.00 0.00 -0.00 0.00 0.00 56.10 57.28 3hka s TRP 325 Cb -0.22 -3.56 0.00 0.00 -0.00 0.00 0.00 33.47 29.69 3hka s TRP 325 CO -0.03 -1.96 0.00 1.87 -0.00 0.00 0.00 176.95 176.83 3hka n TRP 326 N 5.22 0.00 0.47 5.86 -0.00 -1.26 -0.67 117.44 127.05 3hka n TRP 326 Ca 0.12 0.00 0.06 0.00 -0.00 0.00 0.00 57.50 57.68 3hka n TRP 326 Cb 0.45 0.00 0.27 0.00 -0.00 0.00 0.00 31.31 32.03 3hka n TRP 326 CO 0.00 0.00 0.00 1.19 -0.00 0.00 0.00 177.69 178.88 3hka n PHE 327 N 0.00 0.00 0.50 5.87 3.72 -1.26 -0.74 117.46 125.55 3hka n PHE 327 Ca 0.00 0.00 0.11 0.00 -0.05 0.00 0.00 57.45 57.51 3hka n PHE 327 Cb 0.00 -0.41 -0.01 0.00 -0.94 0.00 0.00 39.48 38.12 3hka n PHE 327 CO 0.00 0.00 0.00 -1.33 -0.05 0.00 0.00 176.76 175.38 3hka n MET 328 N -1.41 0.33 -1.18 -1.08 2.81 0.15 -4.58 117.12 112.16 3hka n MET 328 Ca 0.04 -0.02 -0.27 0.00 -1.81 0.00 0.00 57.70 55.65 3hka n MET 328 Cb 0.12 -1.60 -0.09 0.00 -0.71 0.00 0.00 33.22 30.94 3hka n MET 328 CO 0.00 0.00 0.00 -1.71 1.51 0.00 0.00 175.97 175.77 3hka n ASN 329 N -2.02 7.18 -4.06 7.83 5.15 0.08 -3.64 115.26 125.78 3hka n ASN 329 Ca 0.01 -2.54 -0.20 0.00 -0.60 0.00 0.00 54.58 51.26 3hka n ASN 329 Cb 0.45 -1.49 -0.14 0.00 -0.53 0.00 0.00 39.78 38.06 3hka n ASN 329 CO 0.00 0.00 0.00 0.20 1.40 0.00 0.00 177.26 178.86 3hka s ASN 330 N 2.06 1.29 0.22 1.20 0.01 -1.26 -4.97 114.94 113.49 3hka s ASN 330 Ca 0.68 -0.24 -0.14 0.00 -0.71 0.00 0.00 52.86 52.45 3hka s ASN 330 Cb 0.24 -0.13 0.27 0.00 0.41 0.00 0.00 41.25 42.05 3hka s ASN 330 CO -0.03 0.10 1.44 -2.65 -1.51 0.00 0.00 177.10 174.45 3hka n PRO 331 N 2.64 -0.19 -0.32 -0.60 -0.02 -1.26 -0.17 135.00 135.08 3hka n PRO 331 Ca -0.15 1.43 0.05 0.00 -2.02 0.00 0.00 63.50 62.81 3hka n PRO 331 Cb 0.56 -2.13 0.24 0.00 -0.02 0.00 0.00 33.50 32.15 3hka n PRO 331 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 3hka h GLU 332 N 0.00 1.00 0.18 -0.52 4.57 -1.97 -1.09 114.58 116.75 3hka h GLU 332 Ca 0.35 -0.06 -0.30 0.00 -1.18 0.00 0.00 59.36 58.17 3hka h GLU 332 Cb 0.58 -0.23 0.02 0.00 -0.16 0.00 0.00 28.75 28.96 3hka h GLU 332 CO -0.93 0.66 -1.45 0.82 -1.18 0.00 0.00 179.01 176.94 3hka h ILE 333 N 1.03 1.14 -0.85 2.32 1.08 -1.19 -3.10 117.51 117.93 3hka h ILE 333 Ca 0.42 -2.53 0.09 0.00 -0.39 0.00 0.00 64.86 62.44 3hka h ILE 333 Cb 0.27 2.89 -0.07 0.00 -3.07 0.00 0.00 36.82 36.84 3hka h ILE 333 CO -0.17 0.79 0.51 0.40 -0.69 0.00 0.00 178.15 178.98 3hka h ILE 334 N -0.07 0.95 0.45 -0.67 2.04 -0.38 0.45 117.51 120.28 3hka h ILE 334 Ca -0.28 -0.30 -0.02 0.00 1.00 0.00 0.00 64.86 65.26 3hka h ILE 334 Cb 1.96 0.01 0.00 0.00 -0.74 0.00 0.00 36.82 38.05 3hka h ILE 334 CO 0.17 0.16 -0.22 -1.13 0.00 0.00 0.00 178.15 177.13 3hka h ASN 335 N 0.87 -0.51 -0.77 1.72 -1.24 -1.30 -0.82 115.58 113.53 3hka h ASN 335 Ca 0.40 -0.05 -0.04 0.00 0.71 0.00 0.00 56.30 57.32 3hka h ASN 335 Cb 0.32 0.13 -0.04 0.00 0.73 0.00 0.00 38.32 39.46 3hka h ASN 335 CO -0.23 -0.26 0.33 1.05 -1.29 0.00 0.00 177.43 177.04 3hka h GLU 336 N -0.75 1.14 -0.09 6.67 4.11 -1.41 -1.83 114.58 122.41 3hka h GLU 336 Ca -0.06 -0.19 -0.01 0.00 0.07 0.00 0.00 59.36 59.17 3hka h GLU 336 Cb 0.53 -0.19 -0.00 0.00 0.50 0.00 0.00 28.75 29.59 3hka h GLU 336 CO 0.10 0.91 0.03 0.52 0.07 0.00 0.00 179.01 180.64 3hka h MET 337 N 1.12 0.15 -0.91 1.06 2.86 -0.89 -1.77 114.93 116.54 3hka h MET 337 Ca 0.26 -0.03 -0.02 0.00 -2.06 0.00 0.00 59.70 57.85 3hka h MET 337 Cb 0.18 -0.02 -0.04 0.00 0.06 0.00 0.00 31.60 31.77 3hka h MET 337 CO -0.03 0.32 0.51 1.15 1.06 0.00 0.00 176.91 179.92 3hka h THR 338 N -0.05 1.26 -0.27 2.22 2.02 -1.01 -0.66 112.91 116.42 3hka h THR 338 Ca 0.03 -0.63 -0.06 0.00 0.77 0.00 0.00 66.41 66.52 3hka h THR 338 Cb 0.23 0.02 -0.01 0.00 -1.74 0.00 0.00 68.15 66.65 3hka h THR 338 CO -0.00 0.29 -0.05 0.03 0.37 0.00 0.00 175.52 176.16 3hka h ARG 339 N 1.28 0.52 -0.84 6.66 3.08 -1.28 -0.94 114.38 122.85 3hka h ARG 339 Ca 0.32 -0.19 -0.00 0.00 0.07 0.00 0.00 59.98 60.18 3hka h ARG 339 Cb 0.01 -0.03 -0.04 0.00 0.08 0.00 0.00 29.97 29.99 3hka h ARG 339 CO -0.05 0.72 0.51 0.52 -1.07 0.00 0.00 179.97 180.60 3hka h MET 340 N 0.28 1.13 -0.12 0.04 2.86 -1.10 -0.88 114.93 117.13 3hka h MET 340 Ca 0.07 -0.10 -0.01 0.00 -2.06 0.00 0.00 59.70 57.60 3hka h MET 340 Cb 0.52 -0.24 -0.01 0.00 0.06 0.00 0.00 31.60 31.94 3hka h MET 340 CO 0.02 0.79 0.04 0.00 1.06 0.00 0.00 176.91 178.82 3hka h ARG 341 N 1.15 0.20 -0.45 1.72 3.08 -0.98 -2.51 114.38 116.57 3hka h ARG 341 Ca 0.30 -0.04 -0.12 0.00 0.07 0.00 0.00 59.98 60.18 3hka h ARG 341 Cb -0.06 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 29.95 3hka h ARG 341 CO -0.06 0.34 -0.21 1.98 -1.07 0.00 0.00 179.97 180.95 3hka h MET 342 N 0.01 0.92 -0.07 0.04 4.05 -1.03 0.44 114.93 119.29 3hka h MET 342 Ca 0.04 -0.38 -0.04 0.00 -0.28 0.00 0.00 59.70 59.04 3hka h MET 342 Cb 0.23 -0.04 -0.01 0.00 -0.80 0.00 0.00 31.60 30.98 3hka h MET 342 CO -0.00 1.04 -0.14 0.93 0.23 0.00 0.00 176.91 178.96 3hka h GLU 343 N 0.80 0.11 0.00 0.39 5.08 -1.13 0.19 114.58 120.01 3hka h GLU 343 Ca 0.11 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.45 3hka h GLU 343 Cb 0.77 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.00 3hka h GLU 343 CO 0.06 0.26 -1.11 -1.33 -1.00 0.00 0.00 179.01 175.89 3hka n MET 344 N -4.31 1.45 0.00 2.33 2.81 -0.95 -4.64 117.12 113.80 3hka n MET 344 Ca -0.02 -0.06 0.00 0.00 -1.81 0.00 0.00 57.70 55.82 3hka n MET 344 Cb 0.24 -1.26 0.00 0.00 -0.71 0.00 0.00 33.22 31.49 3hka n MET 344 CO 0.00 0.00 0.00 1.28 1.51 0.00 0.00 175.97 178.76 3hka n LEU 345 N -1.63 0.57 0.00 4.03 4.77 0.15 -4.90 117.00 119.99 3hka n LEU 345 Ca 0.00 -0.66 0.00 0.00 -0.03 0.00 0.00 56.01 55.32 3hka n LEU 345 Cb 0.30 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.39 3hka n LEU 345 CO 0.31 0.14 0.00 0.61 -1.33 0.00 0.00 177.39 177.12 3hka n GLY 346 N 0.18 3.80 0.53 -0.72 0.00 0.66 -1.58 105.19 108.06 3hka n GLY 346 Ca 0.00 0.01 0.05 0.00 0.00 0.00 0.00 46.02 46.08 3hka n GLY 346 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3hka n THR 347 N 0.00 1.30 -1.29 2.61 -2.24 -1.26 -4.29 114.28 109.11 3hka n THR 347 Ca 0.00 -1.24 -0.24 0.00 -2.27 0.00 0.00 64.05 60.30 3hka n THR 347 Cb 0.00 0.31 -0.10 0.00 -2.10 0.00 0.00 70.33 68.45 3hka n THR 347 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 3hka n SER 348 N 0.01 6.53 -3.67 3.42 3.41 -0.62 -4.68 113.62 118.03 3hka n SER 348 Ca 0.12 -2.75 -0.08 0.00 -0.26 0.00 0.00 58.87 55.89 3hka n SER 348 Cb 0.49 -1.39 -0.02 0.00 -0.26 0.00 0.00 64.21 63.03 3hka n SER 348 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 3hka s PHE 349 N 0.29 -0.31 -0.47 7.33 -0.12 -1.26 -4.84 117.98 118.60 3hka s PHE 349 Ca 0.64 -0.02 -0.10 0.00 -0.05 0.00 0.00 56.93 57.40 3hka s PHE 349 Cb 0.30 0.64 0.11 0.00 -0.63 0.00 0.00 43.02 43.43 3hka s PHE 349 CO -0.08 -1.00 0.34 0.42 -0.05 0.00 0.00 175.22 174.85 3hka s ILE 350 N -3.72 4.28 0.34 -4.49 1.01 -1.00 -4.64 121.20 112.98 3hka s ILE 350 Ca 0.07 -1.69 0.07 0.00 0.00 0.00 0.00 60.65 59.10 3hka s ILE 350 Cb -0.03 -3.78 0.31 0.00 0.01 0.00 0.00 42.46 38.97 3hka s ILE 350 CO -0.02 -0.73 1.85 1.55 0.00 0.00 0.00 174.94 177.60 3hka h PRO 351 N 8.47 0.73 -3.32 2.79 0.13 -1.86 -0.62 132.00 138.33 3hka h PRO 351 Ca -0.22 -0.04 -0.02 0.00 -0.87 0.00 0.00 66.00 64.84 3hka h PRO 351 Cb 1.08 -0.16 -0.10 0.00 0.13 0.00 0.00 31.00 31.94 3hka h PRO 351 CO 0.85 0.48 0.02 -1.14 -0.23 0.00 0.00 178.00 177.99 3hka s GLN 352 N -5.74 1.39 0.09 0.86 2.00 -1.26 -3.51 119.66 113.49 3hka s GLN 352 Ca -0.10 -0.89 -0.10 0.00 -2.00 0.00 0.00 55.36 52.27 3hka s GLN 352 Cb 0.22 0.52 0.00 0.00 0.80 0.00 0.00 33.01 34.55 3hka s GLN 352 CO 0.79 -0.59 0.21 -3.38 -0.50 0.00 0.00 175.29 171.83 3hka s HIS 353 N -3.88 0.11 -0.09 1.67 -3.43 -1.26 -4.58 115.29 103.82 3hka s HIS 353 Ca 0.10 -0.51 -0.11 0.00 -0.80 0.00 0.00 55.06 53.74 3hka s HIS 353 Cb -0.01 -0.02 -0.28 0.00 -1.43 0.00 0.00 32.58 30.84 3hka s HIS 353 CO -0.02 -0.55 0.52 0.66 -2.00 0.00 0.00 174.74 173.35 3hka h SER 354 N 2.76 0.49 -0.55 7.38 4.64 -1.93 -3.45 113.55 122.88 3hka h SER 354 Ca -0.34 -0.92 -0.24 0.00 -0.47 0.00 0.00 61.79 59.83 3hka h SER 354 Cb 1.20 -0.16 -0.09 0.00 -0.31 0.00 0.00 62.40 63.04 3hka h SER 354 CO 0.55 1.78 -0.21 -0.67 -0.87 0.00 0.00 176.83 177.40 3hka n ASP 355 N -3.64 -4.49 -4.67 4.97 -0.08 -0.30 -4.91 116.55 103.42 3hka n ASP 355 Ca -0.28 0.29 -0.46 0.00 -1.51 0.00 0.00 54.79 52.83 3hka n ASP 355 Cb 1.02 -3.01 -0.04 0.00 2.34 0.00 0.00 41.12 41.43 3hka n ASP 355 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3hka n ALA 356 N 1.21 1.33 -0.01 -1.67 0.00 -1.26 -4.34 120.51 115.78 3hka n ALA 356 Ca -0.12 0.45 0.08 0.00 0.00 0.00 0.00 53.44 53.85 3hka n ALA 356 Cb 0.40 -2.35 -0.12 0.00 0.00 0.00 0.00 19.45 17.38 3hka n ALA 356 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3hka n ARG 357 N 3.41 0.50 -4.44 0.00 1.74 -1.26 0.45 116.66 117.06 3hka n ARG 357 Ca 0.17 -0.14 -0.29 0.00 -0.77 0.00 0.00 57.85 56.82 3hka n ARG 357 Cb 0.29 -1.37 -0.17 0.00 -1.02 0.00 0.00 32.46 30.19 3hka n ARG 357 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 3hka s VAL 358 N -3.08 1.58 0.11 1.55 1.01 -1.26 -4.34 120.40 115.97 3hka s VAL 358 Ca -0.06 -0.69 -0.20 0.00 0.00 0.00 0.00 61.98 61.03 3hka s VAL 358 Cb 0.10 -1.44 -0.04 0.00 0.00 0.00 0.00 36.38 35.00 3hka s VAL 358 CO 0.65 0.46 1.01 -0.11 0.00 0.00 0.00 175.10 177.12 3hka n LEU 359 N 4.25 -0.69 -0.09 3.92 7.94 -0.11 -0.74 117.00 131.48 3hka n LEU 359 Ca -0.19 1.17 0.24 0.00 -1.11 0.00 0.00 56.01 56.12 3hka n LEU 359 Cb 0.51 -0.16 0.71 0.00 0.53 0.00 0.00 43.42 45.01 3hka n LEU 359 CO 0.24 -0.96 1.22 -0.33 -1.11 0.00 0.00 177.39 176.46 3hka h GLU 360 N 0.00 0.00 -0.49 1.96 3.07 -1.95 -2.18 114.58 115.00 3hka h GLU 360 Ca 0.11 -0.00 0.14 0.00 -0.50 0.00 0.00 59.36 59.11 3hka h GLU 360 Cb 0.27 -0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 28.16 3hka h GLU 360 CO -0.62 0.00 0.46 1.96 -1.40 0.00 0.00 179.01 179.41 3hka h GLN 361 N 0.00 0.00 -0.50 2.33 4.20 -1.34 0.21 115.11 120.01 3hka h GLN 361 Ca 0.34 0.00 0.13 0.00 0.06 0.00 0.00 58.65 59.17 3hka h GLN 361 Cb 1.36 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 29.11 3hka h GLN 361 CO -0.00 0.00 0.35 -0.07 -0.67 0.00 0.00 178.83 178.44 3hka h LEU 362 N 0.00 0.10 0.57 1.46 3.38 -1.56 0.99 115.31 120.25 3hka h LEU 362 Ca 0.23 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.18 3hka h LEU 362 Cb 1.15 -0.02 0.01 0.00 0.09 0.00 0.00 40.66 41.88 3hka h LEU 362 CO -0.00 0.06 -0.27 0.40 0.09 0.00 0.00 178.44 178.71 3hka h ILE 363 N 0.11 0.36 0.02 1.22 2.04 -0.81 -2.92 117.51 117.53 3hka h ILE 363 Ca 0.24 -0.27 -0.26 0.00 1.00 0.00 0.00 64.86 65.56 3hka h ILE 363 Cb 0.80 0.46 0.02 0.00 -0.74 0.00 0.00 36.82 37.35 3hka h ILE 363 CO -0.03 0.04 -1.05 0.10 0.00 0.00 0.00 178.15 177.21 3hka h TYR 364 N -0.95 0.92 -0.31 1.37 -0.00 -1.58 -2.00 116.97 114.41 3hka h TYR 364 Ca -0.08 -0.51 0.07 0.00 0.00 0.00 0.00 58.73 58.21 3hka h TYR 364 Cb 0.64 -0.10 -0.07 0.00 0.00 0.00 0.00 36.73 37.21 3hka h TYR 364 CO -0.00 1.35 -0.12 0.87 -0.00 0.00 0.00 178.16 180.25 3hka h LYS 365 N 0.33 -0.06 0.02 0.10 1.79 -0.92 0.23 116.57 118.05 3hka h LYS 365 Ca -0.12 0.00 -0.21 0.00 -2.18 0.00 0.00 60.65 58.14 3hka h LYS 365 Cb 1.70 0.01 -0.01 0.00 -1.58 0.00 0.00 32.23 32.36 3hka h LYS 365 CO 0.20 -0.04 -0.94 -1.49 -1.08 0.00 0.00 179.45 176.10 3hka h TRP 366 N -0.06 0.29 0.23 -1.35 4.06 -1.60 -2.50 115.95 115.01 3hka h TRP 366 Ca 0.16 -0.17 -0.01 0.00 2.06 0.00 0.00 58.89 60.93 3hka h TRP 366 Cb 0.30 -0.03 0.00 0.00 -1.00 0.00 0.00 29.16 28.43 3hka h TRP 366 CO -0.33 1.02 -0.11 1.25 -3.56 0.00 0.00 178.44 176.71 3hka h HIS 367 N 0.09 -0.29 -0.63 0.49 2.76 -0.90 0.14 115.15 116.82 3hka h HIS 367 Ca -0.05 -0.01 -0.01 0.00 -2.20 0.00 0.00 60.37 58.10 3hka h HIS 367 Cb 1.59 0.10 -0.03 0.00 1.55 0.00 0.00 27.41 30.62 3hka h HIS 367 CO 0.03 -0.03 0.36 0.45 -1.30 0.00 0.00 177.93 177.43 3hka h HIS 368 N -0.51 0.83 0.17 5.26 3.86 -0.64 -2.76 115.15 121.35 3hka h HIS 368 Ca -0.03 -0.00 -0.30 0.00 -1.16 0.00 0.00 60.37 58.87 3hka h HIS 368 Cb 0.38 -0.27 0.03 0.00 1.06 0.00 0.00 27.41 28.61 3hka h HIS 368 CO -0.00 0.57 -1.32 0.77 0.86 0.00 0.00 177.93 178.81 3hka h SER 369 N 0.86 0.74 -0.79 2.45 0.02 -1.34 -3.28 113.55 112.22 3hka h SER 369 Ca 0.22 -0.74 -0.04 0.00 -0.84 0.00 0.00 61.79 60.39 3hka h SER 369 Cb -0.00 -0.24 -0.04 0.00 0.14 0.00 0.00 62.40 62.27 3hka h SER 369 CO -0.04 1.57 0.33 0.11 -1.14 0.00 0.00 176.83 177.65 3hka h LYS 370 N 0.18 1.18 -0.81 3.45 1.57 -0.62 -0.49 116.57 121.03 3hka h LYS 370 Ca -0.20 -0.21 0.04 0.00 -1.87 0.00 0.00 60.65 58.42 3hka h LYS 370 Cb 2.01 -0.20 -0.05 0.00 0.08 0.00 0.00 32.23 34.07 3hka h LYS 370 CO 0.24 0.94 0.52 0.66 -0.57 0.00 0.00 179.45 181.24 3hka h SER 371 N 1.15 0.85 -0.15 0.86 4.64 -1.60 0.20 113.55 119.50 3hka h SER 371 Ca 0.27 -0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 61.50 3hka h SER 371 Cb 0.20 -0.18 -0.00 0.00 -0.31 0.00 0.00 62.40 62.11 3hka h SER 371 CO -0.02 0.58 -0.22 0.40 -0.87 0.00 0.00 176.83 176.69 3hka h ILE 372 N 0.99 1.36 -0.95 0.95 2.04 -1.53 -2.43 117.51 117.94 3hka h ILE 372 Ca 0.33 -1.45 -0.01 0.00 1.00 0.00 0.00 64.86 64.74 3hka h ILE 372 Cb 0.04 1.95 -0.05 0.00 -0.74 0.00 0.00 36.82 38.02 3hka h ILE 372 CO -0.12 0.43 0.57 0.40 0.00 0.00 0.00 178.15 179.42 3hka h ILE 373 N 0.03 1.26 -0.55 -0.67 2.04 -0.79 -1.87 117.51 116.96 3hka h ILE 373 Ca 0.01 -0.57 -0.00 0.00 1.00 0.00 0.00 64.86 65.30 3hka h ILE 373 Cb 0.79 -0.07 -0.03 0.00 -0.74 0.00 0.00 36.82 36.77 3hka h ILE 373 CO 0.05 0.28 0.32 0.00 0.00 0.00 0.00 178.15 178.80 3hka h ALA 374 N 1.31 0.70 -0.54 1.87 0.00 -0.59 -0.98 119.26 121.02 3hka h ALA 374 Ca 0.34 -0.07 0.04 0.00 0.00 0.00 0.00 54.91 55.21 3hka h ALA 374 Cb -0.05 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 17.48 3hka h ALA 374 CO -0.06 0.19 0.30 0.93 0.00 0.00 0.00 179.25 180.61 3hka h GLU 375 N 0.74 0.57 -0.13 0.00 5.08 -0.89 0.15 114.58 120.10 3hka h GLU 375 Ca 0.20 -0.03 -0.00 0.00 -1.00 0.00 0.00 59.36 58.52 3hka h GLU 375 Cb -0.00 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.11 3hka h GLU 375 CO -0.04 0.38 0.07 0.28 -1.00 0.00 0.00 179.01 178.70 3hka h VAL 376 N 0.59 1.11 -0.71 3.13 2.07 -0.96 -1.99 116.25 119.49 3hka h VAL 376 Ca 0.23 -0.32 0.05 0.00 0.82 0.00 0.00 66.70 67.48 3hka h VAL 376 Cb 0.09 1.08 -0.05 0.00 -1.52 0.00 0.00 31.29 30.89 3hka h VAL 376 CO -0.13 0.10 0.42 -0.07 0.02 0.00 0.00 177.57 177.91 3hka h LEU 377 N 0.10 0.66 -0.34 2.57 3.38 -0.84 -0.31 115.31 120.53 3hka h LEU 377 Ca 0.05 0.02 0.04 0.00 0.09 0.00 0.00 57.88 58.07 3hka h LEU 377 Cb 0.10 -0.12 -0.04 0.00 0.09 0.00 0.00 40.66 40.69 3hka h LEU 377 CO -0.01 0.44 0.11 0.40 0.09 0.00 0.00 178.44 179.48 3hka h ILE 378 N 0.80 0.89 -0.20 1.22 2.04 -0.71 0.12 117.51 121.67 3hka h ILE 378 Ca 0.30 -0.09 -0.00 0.00 1.00 0.00 0.00 64.86 66.07 3hka h ILE 378 Cb 0.12 0.62 -0.01 0.00 -0.74 0.00 0.00 36.82 36.80 3hka h ILE 378 CO -0.15 0.05 0.11 0.44 0.00 0.00 0.00 178.15 178.60 3hka h ASP 379 N 0.25 0.25 -0.63 1.72 3.32 -0.60 -0.66 116.42 120.07 3hka h ASP 379 Ca 0.16 -0.08 -0.07 0.00 0.02 0.00 0.00 57.03 57.06 3hka h ASP 379 Cb 0.14 -0.06 -0.03 0.00 0.22 0.00 0.00 39.33 39.60 3hka h ASP 379 CO -0.17 0.25 0.13 0.11 -1.72 0.00 0.00 179.24 177.85 3hka h LYS 380 N 0.22 1.05 -0.36 3.56 6.56 -0.75 -1.80 116.57 125.05 3hka h LYS 380 Ca 0.07 -0.26 -0.10 0.00 -1.06 0.00 0.00 60.65 59.30 3hka h LYS 380 Cb 0.06 -0.13 -0.01 0.00 -0.57 0.00 0.00 32.23 31.58 3hka h LYS 380 CO -0.01 0.95 -0.15 1.88 -2.06 0.00 0.00 179.45 180.05 3hka h TYR 381 N 0.99 0.85 -0.10 -1.35 0.05 -0.68 -3.02 116.97 113.71 3hka h TYR 381 Ca 0.20 -0.20 -0.03 0.00 0.05 0.00 0.00 58.73 58.74 3hka h TYR 381 Cb 0.39 -0.20 -0.01 0.00 1.01 0.00 0.00 36.73 37.92 3hka h TYR 381 CO 0.03 0.93 -0.10 0.22 -1.05 0.00 0.00 178.16 178.18 3hka h ASP 382 N 0.54 0.14 -0.39 3.88 3.58 -0.92 0.31 116.42 123.55 3hka h ASP 382 Ca 0.08 -0.02 -0.10 0.00 0.42 0.00 0.00 57.03 57.42 3hka h ASP 382 Cb 0.69 -0.04 -0.01 0.00 1.72 0.00 0.00 39.33 41.69 3hka h ASP 382 CO 0.05 0.26 -0.13 0.44 -2.88 0.00 0.00 179.24 176.98 3hka h ASP 383 N 0.15 0.79 1.47 2.28 3.32 -1.21 0.64 116.42 123.86 3hka h ASP 383 Ca 0.03 -0.38 -0.09 0.00 0.02 0.00 0.00 57.03 56.61 3hka h ASP 383 Cb 0.27 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.59 3hka h ASP 383 CO 0.02 0.99 -0.41 0.16 -1.72 0.00 0.00 179.24 178.27 3hka h ILE 384 N 0.59 0.74 -0.41 0.35 3.07 -1.39 -2.66 117.51 117.79 3hka h ILE 384 Ca 0.09 -1.95 -0.08 0.00 1.55 0.00 0.00 64.86 64.47 3hka h ILE 384 Cb 0.67 2.30 -0.01 0.00 -0.27 0.00 0.00 36.82 39.50 3hka h ILE 384 CO 0.05 0.41 -0.06 0.25 -1.05 0.00 0.00 178.15 177.74 3hka h LEU 385 N 0.00 0.77 -1.86 0.16 5.85 -0.74 -0.63 115.31 118.85 3hka h LEU 385 Ca -0.00 -0.34 -0.00 0.00 0.84 0.00 0.00 57.88 58.37 3hka h LEU 385 Cb 1.26 -0.21 -0.00 0.00 0.37 0.00 0.00 40.66 42.08 3hka h LEU 385 CO 0.05 0.93 -0.02 1.56 -0.34 0.00 0.00 178.44 180.62 3hka h GLN 386 N 0.59 0.00 -0.24 1.25 1.08 -0.73 -1.39 115.11 115.67 3hka h GLN 386 Ca 0.11 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.31 3hka h GLN 386 Cb 0.57 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.00 3hka h GLN 386 CO 0.03 0.02 0.00 0.00 -0.95 0.00 0.00 178.83 177.93 3hka n ALA 387 N -2.11 2.49 -0.40 3.87 0.00 -0.76 -4.89 120.51 118.70 3hka n ALA 387 Ca -0.01 -0.52 0.00 0.00 0.00 0.00 0.00 53.44 52.92 3hka n ALA 387 Cb 0.25 -1.04 0.00 0.00 0.00 0.00 0.00 19.45 18.66 3hka n ALA 387 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hka n GLY 388 N 1.05 0.77 3.83 0.00 0.00 -0.52 -5.06 105.19 105.25 3hka n GLY 388 Ca 0.13 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.81 3hka n GLY 388 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 3hka s TRP 389 N -2.24 3.53 -0.22 1.61 -0.11 -0.32 -5.01 118.94 116.18 3hka s TRP 389 Ca 0.00 1.27 -0.01 0.00 1.22 0.00 0.00 56.10 58.58 3hka s TRP 389 Cb 0.00 -2.55 0.02 0.00 -1.50 0.00 0.00 33.47 29.44 3hka s TRP 389 CO 0.00 0.25 -0.11 -1.21 -4.62 0.00 0.00 176.95 171.26 3hka s GLU 390 N -2.38 2.94 -0.21 5.86 2.02 -1.26 -4.14 118.70 121.52 3hka s GLU 390 Ca 0.47 -0.89 -0.11 0.00 0.02 0.00 0.00 54.97 54.46 3hka s GLU 390 Cb -0.14 -2.84 -0.05 0.00 0.10 0.00 0.00 34.13 31.20 3hka s GLU 390 CO 0.19 -0.31 0.17 0.14 0.02 0.00 0.00 175.26 175.48 3hka s VAL 391 N 1.32 5.37 0.40 2.63 -7.23 -1.26 -5.06 120.40 116.56 3hka s VAL 391 Ca 0.02 0.26 -0.13 0.00 -1.81 0.00 0.00 61.98 60.32 3hka s VAL 391 Cb -0.15 -3.51 -0.08 0.00 0.56 0.00 0.00 36.38 33.20 3hka s VAL 391 CO -0.07 0.39 0.80 0.42 -0.31 0.00 0.00 175.10 176.33 3hka s THR 392 N 0.66 4.70 0.46 5.32 -4.23 -1.26 -3.90 115.64 117.39 3hka s THR 392 Ca 0.09 0.84 0.24 0.00 -1.18 0.00 0.00 61.69 61.68 3hka s THR 392 Cb -0.12 -3.69 0.27 0.00 1.34 0.00 0.00 72.50 70.30 3hka s THR 392 CO 0.01 -0.44 2.08 -0.08 -0.54 0.00 0.00 174.62 175.66 3hka h GLU 393 N 1.53 0.00 -0.14 3.99 4.81 -1.99 -1.48 114.58 121.30 3hka h GLU 393 Ca -0.47 0.00 -0.14 0.00 -0.13 0.00 0.00 59.36 58.62 3hka h GLU 393 Cb 1.18 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.55 3hka h GLU 393 CO 0.64 0.11 -0.50 1.49 -0.73 0.00 0.00 179.01 180.02 3hka h GLU 394 N 0.00 0.36 -0.06 1.92 4.57 -1.99 -2.00 114.58 117.38 3hka h GLU 394 Ca -0.00 -0.21 -0.15 0.00 -1.18 0.00 0.00 59.36 57.82 3hka h GLU 394 Cb 0.26 0.02 -0.01 0.00 -0.16 0.00 0.00 28.75 28.86 3hka h GLU 394 CO 0.01 0.78 -0.63 0.93 -1.18 0.00 0.00 179.01 178.93 3hka h GLU 395 N 0.29 0.21 -0.34 1.92 5.08 -1.67 -2.00 114.58 118.07 3hka h GLU 395 Ca 0.01 -0.15 -0.05 0.00 -1.00 0.00 0.00 59.36 58.17 3hka h GLU 395 Cb 0.98 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.24 3hka h GLU 395 CO 0.08 0.77 0.01 0.82 -1.00 0.00 0.00 179.01 179.69 3hka h ILE 396 N 0.15 1.26 -0.20 3.13 2.04 -1.16 0.12 117.51 122.84 3hka h ILE 396 Ca -0.01 -0.95 -0.05 0.00 1.00 0.00 0.00 64.86 64.86 3hka h ILE 396 Cb 1.14 1.20 -0.01 0.00 -0.74 0.00 0.00 36.82 38.40 3hka h ILE 396 CO 0.10 0.31 -0.09 0.11 0.00 0.00 0.00 178.15 178.58 3hka h LYS 397 N 0.41 0.31 0.04 2.37 1.57 -1.28 -0.26 116.57 119.73 3hka h LYS 397 Ca 0.10 -0.07 -0.00 0.00 -1.87 0.00 0.00 60.65 58.81 3hka h LYS 397 Cb 0.44 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.70 3hka h LYS 397 CO 0.02 0.42 -0.02 -0.09 -0.57 0.00 0.00 179.45 179.20 3hka h ARG 398 N 0.30 -0.05 -0.66 3.15 2.43 -0.86 -0.88 114.38 117.80 3hka h ARG 398 Ca 0.06 0.00 -0.04 0.00 -0.81 0.00 0.00 59.98 59.19 3hka h ARG 398 Cb 0.35 0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 29.88 3hka h ARG 398 CO 0.02 0.32 0.24 -0.44 -1.51 0.00 0.00 179.97 178.60 3hka h ASP 399 N -0.42 0.93 -0.53 -3.80 3.32 -0.74 -1.49 116.42 113.68 3hka h ASP 399 Ca -0.00 -0.19 -0.05 0.00 0.02 0.00 0.00 57.03 56.81 3hka h ASP 399 Cb 0.39 -0.24 -0.03 0.00 0.22 0.00 0.00 39.33 39.67 3hka h ASP 399 CO 0.01 0.87 0.15 0.58 -1.72 0.00 0.00 179.24 179.13 3hka h VAL 400 N 0.95 1.23 -0.46 -1.35 2.07 -1.05 -1.93 116.25 115.70 3hka h VAL 400 Ca 0.22 -0.82 -0.03 0.00 0.82 0.00 0.00 66.70 66.89 3hka h VAL 400 Cb 0.25 0.62 -0.02 0.00 -1.52 0.00 0.00 31.29 30.62 3hka h VAL 400 CO -0.01 0.31 0.18 0.00 0.02 0.00 0.00 177.57 178.07 3hka h ALA 401 N 1.31 0.59 0.30 1.67 0.00 -0.64 -1.74 119.26 120.75 3hka h ALA 401 Ca 0.19 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 3hka h ALA 401 Cb 0.29 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 3hka h ALA 401 CO -0.00 0.21 -0.22 -0.44 0.00 0.00 0.00 179.25 178.79 3hka h ASP 402 N 0.60 -0.57 -0.41 0.00 3.32 -0.84 0.26 116.42 118.77 3hka h ASP 402 Ca 0.15 0.04 0.05 0.00 0.02 0.00 0.00 57.03 57.29 3hka h ASP 402 Cb 0.20 0.18 -0.04 0.00 0.22 0.00 0.00 39.33 39.89 3hka h ASP 402 CO -0.01 -0.34 0.15 -0.07 -1.72 0.00 0.00 179.24 177.25 3hka h LEU 403 N -0.52 0.16 -0.25 1.55 3.38 -1.28 0.33 115.31 118.68 3hka h LEU 403 Ca -0.02 0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.99 3hka h LEU 403 Cb 0.45 0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.23 3hka h LEU 403 CO -0.00 0.13 -0.36 0.49 0.09 0.00 0.00 178.44 178.79 3hka n PHE 404 N -5.00 0.00 0.11 1.13 3.72 -0.66 -4.26 117.46 112.49 3hka n PHE 404 Ca 0.03 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.43 3hka n PHE 404 Cb 0.15 -0.19 0.00 0.00 -0.94 0.00 0.00 39.48 38.50 3hka n PHE 404 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 3hka n SER 405 N -1.06 -1.82 -0.16 4.37 2.88 -0.11 -1.75 113.62 115.97 3hka n SER 405 Ca 0.09 0.40 -0.05 0.00 -1.33 0.00 0.00 58.87 57.99 3hka n SER 405 Cb 0.34 1.95 0.04 0.00 -0.75 0.00 0.00 64.21 65.80 3hka n SER 405 CO 0.00 0.00 0.00 0.03 -1.23 0.00 0.00 175.04 173.84 3hka h ARG 406 N 0.00 0.49 -1.00 -1.46 3.08 -1.01 -2.88 114.38 111.59 3hka h ARG 406 Ca 0.00 -0.03 0.12 0.00 0.07 0.00 0.00 59.98 60.14 3hka h ARG 406 Cb 0.00 -0.11 -0.08 0.00 0.08 0.00 0.00 29.97 29.86 3hka h ARG 406 CO 0.00 0.32 0.63 -0.91 -1.07 0.00 0.00 179.97 178.94 3hka h ASN 407 N 0.50 0.93 0.73 7.04 2.35 -1.14 0.13 115.58 126.12 3hka h ASN 407 Ca 0.21 0.05 -0.04 0.00 -0.55 0.00 0.00 56.30 55.97 3hka h ASN 407 Cb 0.11 -0.14 0.01 0.00 0.05 0.00 0.00 38.32 38.34 3hka h ASN 407 CO -0.14 0.50 -0.35 0.15 -1.65 0.00 0.00 177.43 175.94 3hka h PHE 408 N 1.00 -0.91 -0.83 1.19 3.57 -1.73 -1.39 116.94 117.83 3hka h PHE 408 Ca 0.49 -0.02 0.11 0.00 3.53 0.00 0.00 57.97 62.08 3hka h PHE 408 Cb 0.48 0.30 -0.06 0.00 2.79 0.00 0.00 35.95 39.46 3hka h PHE 408 CO -0.00 -0.57 0.54 -1.49 -2.23 0.00 0.00 178.31 174.56 3hka h TRP 409 N -1.21 0.80 -0.23 0.41 4.06 -1.41 0.77 115.95 119.14 3hka h TRP 409 Ca -0.10 0.02 -0.01 0.00 2.06 0.00 0.00 58.89 60.86 3hka h TRP 409 Cb 0.75 -0.26 -0.01 0.00 -1.00 0.00 0.00 29.16 28.64 3hka h TRP 409 CO 0.01 0.35 0.11 -0.09 -3.56 0.00 0.00 178.44 175.26 3hka h ARG 410 N 0.73 0.33 -0.22 0.49 2.43 -0.95 -0.85 114.38 116.34 3hka h ARG 410 Ca 0.39 -0.05 -0.03 0.00 -0.81 0.00 0.00 59.98 59.49 3hka h ARG 410 Cb 0.53 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 30.01 3hka h ARG 410 CO -0.16 0.35 0.03 0.35 -1.51 0.00 0.00 179.97 179.02 3hka h PHE 411 N 0.24 0.40 0.00 2.20 3.57 0.08 -2.35 116.94 121.08 3hka h PHE 411 Ca 0.08 -0.06 0.00 0.00 3.53 0.00 0.00 57.97 61.52 3hka h PHE 411 Cb 0.12 -0.11 0.00 0.00 2.79 0.00 0.00 35.95 38.76 3hka h PHE 411 CO -0.02 0.52 0.00 1.33 -2.23 0.00 0.00 178.31 177.91 3hka n VAL 412 N -4.70 0.89 -0.30 1.41 0.24 0.09 -4.89 118.33 111.06 3hka n VAL 412 Ca -0.04 0.26 0.00 0.00 -2.04 0.00 0.00 64.34 62.53 3hka n VAL 412 Cb 0.21 -1.17 0.00 0.00 -1.47 0.00 0.00 33.84 31.41 3hka n VAL 412 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30