#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hk9 s ILE 3 N 0.00 4.21 -0.14 -1.33 1.01 -1.26 -4.85 121.20 118.84 3hk9 s ILE 3 Ca 0.00 -0.20 0.15 0.00 0.00 0.00 0.00 60.65 60.60 3hk9 s ILE 3 Cb 0.00 -4.73 0.37 0.00 0.01 0.00 0.00 42.46 38.11 3hk9 s ILE 3 CO 0.00 -1.53 1.18 -0.46 0.00 0.00 0.00 174.94 174.13 3hk9 n ASN 4 N 8.02 1.56 -3.48 3.58 6.94 -1.26 -4.69 115.26 125.93 3hk9 n ASN 4 Ca -0.02 -3.22 -0.11 0.00 -0.02 0.00 0.00 54.58 51.20 3hk9 n ASN 4 Cb 0.46 -0.44 -0.03 0.00 -2.36 0.00 0.00 39.78 37.41 3hk9 n ASN 4 CO 0.00 0.00 0.00 -0.94 -1.03 0.00 0.00 177.26 175.29 3hk9 s SER 5 N -2.75 -0.48 0.29 0.53 1.04 -1.26 -5.02 113.70 106.05 3hk9 s SER 5 Ca 0.33 0.14 -0.03 0.00 0.48 0.00 0.00 55.95 56.88 3hk9 s SER 5 Cb 0.33 0.47 0.40 0.00 0.10 0.00 0.00 66.02 67.32 3hk9 s SER 5 CO -0.07 -0.71 1.94 -0.09 0.98 0.00 0.00 173.24 175.29 3hk9 h ARG 6 N 2.20 1.10 -0.05 4.02 2.43 -1.96 0.53 114.38 122.65 3hk9 h ARG 6 Ca -0.27 -0.09 0.02 0.00 -0.81 0.00 0.00 59.98 58.84 3hk9 h ARG 6 Cb 1.24 -0.24 -0.02 0.00 -0.42 0.00 0.00 29.97 30.54 3hk9 h ARG 6 CO 0.34 0.76 -0.07 1.49 -1.51 0.00 0.00 179.97 180.98 3hk9 h GLU 7 N 1.12 -0.10 -0.40 0.20 4.81 -1.99 0.53 114.58 118.75 3hk9 h GLU 7 Ca 0.29 0.01 -0.03 0.00 -0.13 0.00 0.00 59.36 59.50 3hk9 h GLU 7 Cb -0.07 0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.32 3hk9 h GLU 7 CO -0.06 -0.07 0.13 0.28 -0.73 0.00 0.00 179.01 178.56 3hk9 h VAL 8 N -0.10 1.22 -0.25 0.32 2.07 -1.87 -2.81 116.25 114.83 3hk9 h VAL 8 Ca 0.05 -0.71 0.05 0.00 0.82 0.00 0.00 66.70 66.91 3hk9 h VAL 8 Cb 0.16 0.92 -0.05 0.00 -1.52 0.00 0.00 31.29 30.80 3hk9 h VAL 8 CO -0.11 0.25 -0.07 0.25 0.02 0.00 0.00 177.57 177.91 3hk9 h LEU 9 N 0.51 -0.24 -0.71 2.57 5.85 -0.45 -1.61 115.31 121.24 3hk9 h LEU 9 Ca 0.13 0.08 0.12 0.00 0.84 0.00 0.00 57.88 59.05 3hk9 h LEU 9 Cb 0.26 0.16 -0.09 0.00 0.37 0.00 0.00 40.66 41.36 3hk9 h LEU 9 CO -0.00 -0.09 0.28 0.00 -0.34 0.00 0.00 178.44 178.29 3hk9 h ALA 10 N 1.24 0.96 0.35 1.25 0.00 0.22 0.14 119.26 123.42 3hk9 h ALA 10 Ca 0.12 0.10 -0.02 0.00 0.00 0.00 0.00 54.91 55.11 3hk9 h ALA 10 Cb 0.19 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.05 3hk9 h ALA 10 CO -0.26 -0.19 -0.17 1.49 0.00 0.00 0.00 179.25 180.13 3hk9 h GLU 11 N 0.44 -0.45 -0.92 0.00 4.81 -1.16 -1.15 114.58 116.16 3hk9 h GLU 11 Ca 0.38 0.03 0.01 0.00 -0.13 0.00 0.00 59.36 59.65 3hk9 h GLU 11 Cb 0.53 0.10 -0.05 0.00 0.63 0.00 0.00 28.75 29.96 3hk9 h GLU 11 CO -0.37 -0.26 0.61 0.87 -0.73 0.00 0.00 179.01 179.14 3hk9 h LYS 12 N -0.53 1.20 -0.12 1.92 1.79 -0.72 -0.39 116.57 119.71 3hk9 h LYS 12 Ca -0.05 -0.07 -0.04 0.00 -2.18 0.00 0.00 60.65 58.31 3hk9 h LYS 12 Cb 0.40 -0.27 -0.00 0.00 -1.58 0.00 0.00 32.23 30.78 3hk9 h LYS 12 CO 0.08 0.79 -0.09 0.28 -1.08 0.00 0.00 179.45 179.44 3hk9 h VAL 13 N 1.24 1.34 -0.77 0.50 2.07 -0.68 -0.40 116.25 119.54 3hk9 h VAL 13 Ca 0.34 -1.18 0.00 0.00 0.82 0.00 0.00 66.70 66.68 3hk9 h VAL 13 Cb -0.13 1.86 -0.04 0.00 -1.52 0.00 0.00 31.29 31.46 3hk9 h VAL 13 CO -0.08 0.34 0.49 0.11 0.02 0.00 0.00 177.57 178.46 3hk9 h LYS 14 N -0.10 1.03 -0.02 1.57 1.57 -1.07 0.94 116.57 120.49 3hk9 h LYS 14 Ca 0.02 -0.07 -0.00 0.00 -1.87 0.00 0.00 60.65 58.73 3hk9 h LYS 14 Cb 0.58 -0.23 -0.00 0.00 0.08 0.00 0.00 32.23 32.66 3hk9 h LYS 14 CO 0.02 0.70 0.01 -0.91 -0.57 0.00 0.00 179.45 178.70 3hk9 h ASN 15 N 1.05 0.02 -0.05 0.86 2.35 -1.01 -0.62 115.58 118.18 3hk9 h ASN 15 Ca 0.28 -0.04 -0.00 0.00 -0.55 0.00 0.00 56.30 55.98 3hk9 h ASN 15 Cb -0.09 -0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.27 3hk9 h ASN 15 CO -0.06 0.06 0.03 0.00 -1.65 0.00 0.00 177.43 175.81 3hk9 h ALA 16 N 0.96 0.07 -0.60 -0.83 0.00 -0.72 -1.40 119.26 116.74 3hk9 h ALA 16 Ca 0.01 -0.03 0.03 0.00 0.00 0.00 0.00 54.91 54.91 3hk9 h ALA 16 Cb 0.04 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 17.77 3hk9 h ALA 16 CO -0.00 -0.41 0.37 0.28 0.00 0.00 0.00 179.25 179.49 3hk9 h VAL 17 N 0.02 1.06 -0.70 0.00 2.07 -0.76 -0.47 116.25 117.48 3hk9 h VAL 17 Ca 0.02 -0.25 -0.05 0.00 0.82 0.00 0.00 66.70 67.24 3hk9 h VAL 17 Cb 0.05 0.28 -0.03 0.00 -1.52 0.00 0.00 31.29 30.07 3hk9 h VAL 17 CO -0.00 0.13 0.23 0.78 0.02 0.00 0.00 177.57 178.72 3hk9 h ASN 18 N 0.72 0.99 1.45 0.57 -0.26 -0.96 -3.12 115.58 114.98 3hk9 h ASN 18 Ca 0.24 -0.17 0.00 0.00 -0.56 0.00 0.00 56.30 55.81 3hk9 h ASN 18 Cb 0.03 -0.26 0.00 0.00 -1.06 0.00 0.00 38.32 37.03 3hk9 h ASN 18 CO -0.11 0.92 -0.30 0.78 -1.06 0.00 0.00 177.43 177.66 3hk9 h ASN 19 N 1.03 0.00 -2.61 5.81 2.35 -0.85 -3.46 115.58 117.86 3hk9 h ASN 19 Ca 0.23 -0.04 -0.55 0.00 -0.55 0.00 0.00 56.30 55.39 3hk9 h ASN 19 Cb 0.28 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.64 3hk9 h ASN 19 CO -0.01 0.02 1.11 -1.58 -1.65 0.00 0.00 177.43 175.32 3hk9 s GLN 20 N -3.20 4.09 0.28 0.81 2.00 -0.22 -4.96 119.66 118.47 3hk9 s GLN 20 Ca 0.06 2.12 -0.29 0.00 -2.00 0.00 0.00 55.36 55.25 3hk9 s GLN 20 Cb 0.09 -4.01 -0.10 0.00 0.80 0.00 0.00 33.01 29.79 3hk9 s GLN 20 CO 0.68 -0.95 1.40 -2.14 -0.50 0.00 0.00 175.29 173.78 3hk9 s PRO 21 N 4.22 4.28 -0.07 1.67 0.02 -1.26 -4.94 135.00 138.92 3hk9 s PRO 21 Ca 0.74 2.30 -0.11 0.00 0.02 0.00 0.00 61.00 63.94 3hk9 s PRO 21 Cb -0.32 -3.09 -0.05 0.00 0.02 0.00 0.00 34.50 31.06 3hk9 s PRO 21 CO 0.30 -0.36 0.29 0.08 -0.33 0.00 0.00 177.00 176.98 3hk9 s VAL 22 N -0.43 5.26 -0.34 3.83 1.01 -0.03 -4.64 120.40 125.06 3hk9 s VAL 22 Ca 0.56 0.55 -0.08 0.00 0.00 0.00 0.00 61.98 63.01 3hk9 s VAL 22 Cb -0.42 -3.58 0.03 0.00 0.00 0.00 0.00 36.38 32.42 3hk9 s VAL 22 CO 0.48 0.57 0.12 -0.89 0.00 0.00 0.00 175.10 175.38 3hk9 s THR 23 N -0.86 4.02 -0.77 3.92 2.01 -0.55 -0.60 115.64 122.80 3hk9 s THR 23 Ca 0.19 -0.96 -0.20 0.00 0.31 0.00 0.00 61.69 61.03 3hk9 s THR 23 Cb -0.14 -3.22 0.11 0.00 0.01 0.00 0.00 72.50 69.25 3hk9 s THR 23 CO 0.08 -0.13 0.98 -0.62 -0.69 0.00 0.00 174.62 174.24 3hk9 s ASP 24 N 1.46 6.39 0.00 3.53 -1.08 0.53 -4.73 116.67 122.77 3hk9 s ASP 24 Ca 0.00 -1.59 0.10 0.00 -0.52 0.00 0.00 52.55 50.54 3hk9 s ASP 24 Cb -0.19 -2.38 0.59 0.00 -1.46 0.00 0.00 42.92 39.48 3hk9 s ASP 24 CO 0.04 -1.19 1.15 1.15 0.52 0.00 0.00 175.17 176.84 3hk9 n MET 25 N 6.82 0.71 -3.31 4.34 0.00 -1.26 -0.77 117.12 123.64 3hk9 n MET 25 Ca 0.08 0.00 0.02 0.00 0.00 0.00 0.00 57.70 57.80 3hk9 n MET 25 Cb 0.47 -1.22 -0.02 0.00 0.00 0.00 0.00 33.22 32.44 3hk9 n MET 25 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 175.97 174.39 3hk9 s HIS 26 N -2.00 -1.44 0.25 3.17 5.65 -1.26 -4.75 115.29 114.92 3hk9 s HIS 26 Ca 0.15 1.83 -0.08 0.00 0.25 0.00 0.00 55.06 57.21 3hk9 s HIS 26 Cb 0.07 0.62 -0.01 0.00 -1.18 0.00 0.00 32.58 32.07 3hk9 s HIS 26 CO 0.11 -0.77 0.39 0.95 -0.65 0.00 0.00 174.74 174.78 3hk9 s THR 27 N 2.86 0.00 -0.29 0.89 -4.23 -0.47 -0.97 115.64 113.43 3hk9 s THR 27 Ca 0.11 -1.60 0.08 0.00 -1.18 0.00 0.00 61.69 59.10 3hk9 s THR 27 Cb -0.14 -2.36 0.45 0.00 1.34 0.00 0.00 72.50 71.79 3hk9 s THR 27 CO -0.20 0.00 1.26 1.41 -0.54 0.00 0.00 174.62 176.55 3hk9 n HIS 28 N -0.39 1.88 -3.91 3.99 8.25 0.40 -2.80 115.22 122.64 3hk9 n HIS 28 Ca -0.00 -2.01 -0.21 0.00 -0.26 0.00 0.00 57.72 55.24 3hk9 n HIS 28 Cb 0.63 -0.38 -0.03 0.00 1.12 0.00 0.00 29.99 31.33 3hk9 n HIS 28 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 3hk9 s LEU 29 N -3.48 4.03 0.03 2.41 1.43 -1.19 -4.59 118.68 117.32 3hk9 s LEU 29 Ca 0.48 -0.13 0.03 0.00 -1.03 0.00 0.00 54.13 53.47 3hk9 s LEU 29 Cb 0.40 -2.62 -0.02 0.00 0.03 0.00 0.00 46.19 43.99 3hk9 s LEU 29 CO 0.00 -0.15 -0.09 -0.36 0.23 0.00 0.00 176.35 175.98 3hk9 s PHE 30 N -2.10 0.74 0.26 0.29 0.08 -1.26 -4.48 117.98 111.51 3hk9 s PHE 30 Ca 0.36 -0.37 -0.30 0.00 0.12 0.00 0.00 56.93 56.75 3hk9 s PHE 30 Cb -0.08 -0.44 -0.14 0.00 -0.57 0.00 0.00 43.02 41.78 3hk9 s PHE 30 CO 0.28 -0.04 1.20 0.45 -0.10 0.00 0.00 175.22 177.02 3hk9 n SER 31 N 1.91 1.97 -0.28 1.36 2.88 -1.26 -4.77 113.62 115.43 3hk9 n SER 31 Ca -0.19 1.16 0.26 0.00 -1.33 0.00 0.00 58.87 58.77 3hk9 n SER 31 Cb 0.56 -1.34 0.61 0.00 -0.75 0.00 0.00 64.21 63.28 3hk9 n SER 31 CO 0.00 0.00 0.00 1.55 -1.23 0.00 0.00 175.04 175.36 3hk9 h PRO 32 N 3.03 0.22 0.00 -1.46 0.13 -1.95 -1.09 132.00 130.89 3hk9 h PRO 32 Ca -0.43 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 3hk9 h PRO 32 Cb 1.31 -0.05 0.00 0.00 0.13 0.00 0.00 31.00 32.39 3hk9 h PRO 32 CO 0.67 0.15 0.00 0.27 -0.23 0.00 0.00 178.00 178.86 3hk9 n ASN 33 N -4.43 0.00 -0.05 1.44 6.94 -1.26 -1.34 115.26 116.56 3hk9 n ASN 33 Ca 0.23 0.02 0.13 0.00 -0.02 0.00 0.00 54.58 54.94 3hk9 n ASN 33 Cb 0.94 -0.21 0.48 0.00 -2.36 0.00 0.00 39.78 38.62 3hk9 n ASN 33 CO 0.00 0.00 0.00 0.49 -1.03 0.00 0.00 177.26 176.72 3hk9 n PHE 34 N -1.21 0.00 -2.48 -2.53 3.01 -0.41 -5.00 117.46 108.83 3hk9 n PHE 34 Ca 0.05 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.51 3hk9 n PHE 34 Cb 0.07 -0.30 0.00 0.00 -0.01 0.00 0.00 39.48 39.24 3hk9 n PHE 34 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3hk9 n GLY 35 N 1.43 -1.41 0.58 1.37 0.00 -0.45 -4.38 105.19 102.32 3hk9 n GLY 35 Ca 0.09 -1.54 0.35 0.00 0.00 0.00 0.00 46.02 44.92 3hk9 n GLY 35 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3hk9 n GLU 36 N 0.00 0.01 0.21 1.61 -0.58 -1.26 -0.73 120.64 119.91 3hk9 n GLU 36 Ca 0.00 1.03 0.16 0.00 -0.42 0.00 0.00 57.16 57.92 3hk9 n GLU 36 Cb 0.00 -2.49 0.81 0.00 -0.57 0.00 0.00 31.44 29.18 3hk9 n GLU 36 CO 0.00 0.00 0.00 0.97 -0.48 0.00 0.00 177.13 177.62 3hk9 h ILE 37 N 0.00 0.59 -3.57 -3.67 2.10 -1.96 -3.37 117.51 107.62 3hk9 h ILE 37 Ca 0.62 0.00 -0.59 0.00 1.08 0.00 0.00 64.86 65.97 3hk9 h ILE 37 Cb 3.15 0.89 -0.09 0.00 -1.09 0.00 0.00 36.82 39.68 3hk9 h ILE 37 CO -0.01 0.00 0.68 -0.22 -1.08 0.00 0.00 178.15 177.52 3hk9 s LEU 38 N -7.96 3.92 0.17 2.19 2.96 0.10 -4.83 118.68 115.24 3hk9 s LEU 38 Ca -0.05 0.45 -0.17 0.00 -0.22 0.00 0.00 54.13 54.14 3hk9 s LEU 38 Cb 0.16 -3.32 -0.08 0.00 0.50 0.00 0.00 46.19 43.46 3hk9 s LEU 38 CO 0.58 -0.99 0.64 -0.76 -1.32 0.00 0.00 176.35 174.50 3hk9 s LEU 39 N 3.76 4.37 0.01 -0.68 1.43 -1.26 -5.01 118.68 121.30 3hk9 s LEU 39 Ca 0.40 1.27 -0.29 0.00 -1.03 0.00 0.00 54.13 54.48 3hk9 s LEU 39 Cb -0.10 -3.38 0.10 0.00 0.03 0.00 0.00 46.19 42.84 3hk9 s LEU 39 CO 0.23 0.09 0.90 -1.66 0.23 0.00 0.00 176.35 176.14 3hk9 s TRP 40 N -1.45 -0.33 0.00 0.29 1.48 -1.26 -1.12 118.94 116.55 3hk9 s TRP 40 Ca 0.39 0.18 0.00 0.00 -1.06 0.00 0.00 56.10 55.61 3hk9 s TRP 40 Cb -0.16 0.55 0.00 0.00 -1.16 0.00 0.00 33.47 32.69 3hk9 s TRP 40 CO 0.20 -0.56 0.00 -0.40 -4.06 0.00 0.00 176.95 172.13 3hk9 n ASP 41 N -0.26 0.00 -0.19 -2.66 5.68 -1.26 -4.51 116.55 113.35 3hk9 n ASP 41 Ca -0.09 0.00 0.19 0.00 -0.50 0.00 0.00 54.79 54.39 3hk9 n ASP 41 Cb 0.62 0.00 0.55 0.00 -1.14 0.00 0.00 41.12 41.14 3hk9 n ASP 41 CO 0.00 0.00 0.00 -0.29 -1.33 0.00 0.00 177.20 175.58 3hk9 h ILE 42 N 0.00 0.71 -0.51 2.12 6.09 -1.96 -1.21 117.51 122.74 3hk9 h ILE 42 Ca 0.00 -0.11 -0.10 0.00 -1.37 0.00 0.00 64.86 63.27 3hk9 h ILE 42 Cb 0.00 0.35 -0.02 0.00 0.47 0.00 0.00 36.82 37.62 3hk9 h ILE 42 CO 0.00 0.06 -0.09 0.44 -3.07 0.00 0.00 178.15 175.49 3hk9 h ASP 43 N 0.33 0.97 -0.48 2.19 3.32 -1.96 -1.02 116.42 119.76 3hk9 h ASP 43 Ca 0.41 -0.35 -0.10 0.00 0.02 0.00 0.00 57.03 57.02 3hk9 h ASP 43 Cb 1.11 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 40.38 3hk9 h ASP 43 CO -0.12 1.08 -0.09 -0.33 -1.72 0.00 0.00 179.24 178.06 3hk9 h GLU 44 N 0.83 0.92 -0.23 3.56 4.39 -1.49 -2.33 114.58 120.22 3hk9 h GLU 44 Ca 0.13 -0.34 0.03 0.00 0.34 0.00 0.00 59.36 59.53 3hk9 h GLU 44 Cb 0.64 -0.06 -0.03 0.00 -0.10 0.00 0.00 28.75 29.20 3hk9 h GLU 44 CO 0.04 0.99 0.02 -0.07 -1.16 0.00 0.00 179.01 178.84 3hk9 h LEU 45 N 0.77 -0.04 -1.79 1.33 3.38 -1.08 -2.04 115.31 115.84 3hk9 h LEU 45 Ca 0.13 0.04 -0.03 0.00 0.09 0.00 0.00 57.88 58.11 3hk9 h LEU 45 Cb 0.64 0.07 -0.00 0.00 0.09 0.00 0.00 40.66 41.46 3hk9 h LEU 45 CO 0.04 0.01 -0.15 -0.07 0.09 0.00 0.00 178.44 178.37 3hk9 h LEU 46 N 0.10 0.00 -3.11 1.67 3.38 -1.08 -2.73 115.31 113.55 3hk9 h LEU 46 Ca 0.11 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.08 3hk9 h LEU 46 Cb 0.12 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.87 3hk9 h LEU 46 CO -0.16 0.15 0.00 0.35 0.09 0.00 0.00 178.44 178.86 3hk9 n THR 47 N -3.69 1.79 -1.68 0.22 -2.24 -0.82 -4.73 114.28 103.13 3hk9 n THR 47 Ca -0.02 -1.18 -0.42 0.00 -2.27 0.00 0.00 64.05 60.17 3hk9 n THR 47 Cb 0.26 0.15 0.00 0.00 -2.10 0.00 0.00 70.33 68.65 3hk9 n THR 47 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3hk9 n TYR 48 N 1.21 2.01 0.32 4.78 9.36 -0.90 -4.76 117.16 129.18 3hk9 n TYR 48 Ca 0.26 0.54 0.20 0.00 3.32 0.00 0.00 57.90 62.22 3hk9 n TYR 48 Cb 0.88 -2.36 1.10 0.00 -0.63 0.00 0.00 39.34 38.33 3hk9 n TYR 48 CO 0.00 0.00 0.00 1.12 0.22 0.00 0.00 176.86 178.20 3hk9 h HIS 49 N 2.17 0.00 -0.85 2.98 2.07 -1.91 -0.93 115.15 118.68 3hk9 h HIS 49 Ca -0.46 0.00 -0.02 0.00 -2.85 0.00 0.00 60.37 57.04 3hk9 h HIS 49 Cb 1.30 0.00 -0.04 0.00 2.57 0.00 0.00 27.41 31.24 3hk9 h HIS 49 CO 0.48 0.01 0.46 1.88 -3.07 0.00 0.00 177.93 177.69 3hk9 h TYR 50 N 0.00 1.16 0.00 6.12 -1.99 -1.94 -1.47 116.97 118.86 3hk9 h TYR 50 Ca -0.00 -0.03 -0.00 0.00 2.00 0.00 0.00 58.73 60.70 3hk9 h TYR 50 Cb 0.05 -0.37 -0.00 0.00 2.00 0.00 0.00 36.73 38.41 3hk9 h TYR 50 CO 0.00 0.81 -0.01 -0.07 -0.00 0.00 0.00 178.16 178.89 3hk9 h LEU 51 N 1.19 0.00 -0.04 3.88 4.07 -1.47 -2.55 115.31 120.38 3hk9 h LEU 51 Ca 0.30 0.00 -0.02 0.00 0.08 0.00 0.00 57.88 58.24 3hk9 h LEU 51 Cb 0.03 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 41.77 3hk9 h LEU 51 CO -0.05 0.01 -0.05 0.58 -1.08 0.00 0.00 178.44 177.85 3hk9 h VAL 52 N 0.00 1.39 -0.63 1.22 2.07 -1.11 0.48 116.25 119.66 3hk9 h VAL 52 Ca -0.00 -1.25 0.05 0.00 0.82 0.00 0.00 66.70 66.31 3hk9 h VAL 52 Cb 0.97 2.13 -0.05 0.00 -1.52 0.00 0.00 31.29 32.83 3hk9 h VAL 52 CO 0.00 0.34 0.36 0.00 0.02 0.00 0.00 177.57 178.29 3hk9 h ALA 53 N 0.52 0.84 -0.48 1.67 0.00 -1.29 -2.42 119.26 118.10 3hk9 h ALA 53 Ca 0.01 0.01 -0.11 0.00 0.00 0.00 0.00 54.91 54.82 3hk9 h ALA 53 Cb 0.58 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 3hk9 h ALA 53 CO 0.01 0.05 -0.12 0.93 0.00 0.00 0.00 179.25 180.13 3hk9 h GLU 54 N 0.68 0.93 -0.09 0.00 5.08 -1.36 -3.12 114.58 116.71 3hk9 h GLU 54 Ca 0.28 -0.36 -0.08 0.00 -1.00 0.00 0.00 59.36 58.19 3hk9 h GLU 54 Cb 0.13 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.32 3hk9 h GLU 54 CO -0.16 1.02 -0.32 -0.24 -1.00 0.00 0.00 179.01 178.31 3hk9 h VAL 55 N 0.78 1.26 0.00 3.13 3.04 -0.69 -2.69 116.25 121.09 3hk9 h VAL 55 Ca 0.12 -1.25 0.00 0.00 -1.01 0.00 0.00 66.70 64.56 3hk9 h VAL 55 Cb 0.68 1.56 0.00 0.00 -2.01 0.00 0.00 31.29 31.51 3hk9 h VAL 55 CO 0.05 0.37 0.00 0.23 -1.01 0.00 0.00 177.57 177.21 3hk9 n MET 56 N -4.11 0.18 0.06 4.17 2.81 -0.93 -0.81 117.12 118.48 3hk9 n MET 56 Ca -0.01 0.49 0.13 0.00 -1.81 0.00 0.00 57.70 56.49 3hk9 n MET 56 Cb 0.40 -1.89 0.33 0.00 -0.71 0.00 0.00 33.22 31.35 3hk9 n MET 56 CO 0.00 0.00 0.00 0.54 1.51 0.00 0.00 175.97 178.02 3hk9 n ARG 57 N -2.23 0.20 -0.04 0.03 1.74 -1.01 -4.43 116.66 110.91 3hk9 n ARG 57 Ca 0.01 0.11 -0.09 0.00 -0.77 0.00 0.00 57.85 57.11 3hk9 n ARG 57 Cb 0.17 -1.68 -0.03 0.00 -1.02 0.00 0.00 32.46 29.90 3hk9 n ARG 57 CO 0.00 0.00 0.00 0.91 -1.52 0.00 0.00 177.63 177.02 3hk9 n TRP 58 N -2.01 0.00 -2.24 -1.55 5.03 -0.46 -5.07 117.44 111.15 3hk9 n TRP 58 Ca 0.05 0.00 -0.37 0.00 3.03 0.00 0.00 57.50 60.21 3hk9 n TRP 58 Cb 0.41 -0.32 -0.01 0.00 -1.03 0.00 0.00 31.31 30.36 3hk9 n TRP 58 CO 0.00 0.00 0.00 -0.08 -0.03 0.00 0.00 177.69 177.58 3hk9 s THR 59 N -2.17 3.07 -2.35 -0.99 -1.32 0.01 -4.94 115.64 106.95 3hk9 s THR 59 Ca -0.12 0.80 0.26 0.00 -1.21 0.00 0.00 61.69 61.42 3hk9 s THR 59 Cb 0.05 -3.40 0.36 0.00 -1.51 0.00 0.00 72.50 68.00 3hk9 s THR 59 CO 0.16 -0.01 1.55 -0.90 -2.21 0.00 0.00 174.62 173.21 3hk9 n ASP 60 N -0.53 1.68 -4.71 8.08 3.85 -1.26 -4.86 116.55 118.81 3hk9 n ASP 60 Ca 0.07 -1.43 -0.42 0.00 -0.71 0.00 0.00 54.79 52.31 3hk9 n ASP 60 Cb 0.48 0.08 -0.03 0.00 -1.35 0.00 0.00 41.12 40.30 3hk9 n ASP 60 CO 0.00 0.00 0.00 -0.69 -1.01 0.00 0.00 177.20 175.50 3hk9 s VAL 61 N -2.18 3.58 0.66 2.12 1.01 -1.26 -4.98 120.40 119.35 3hk9 s VAL 61 Ca 0.31 1.09 -0.16 0.00 0.00 0.00 0.00 61.98 63.22 3hk9 s VAL 61 Cb 0.20 -3.70 0.00 0.00 0.00 0.00 0.00 36.38 32.88 3hk9 s VAL 61 CO 0.40 0.06 1.18 -0.94 0.00 0.00 0.00 175.10 175.80 3hk9 s SER 62 N 1.31 4.79 0.27 3.32 1.04 -1.26 -4.82 113.70 118.34 3hk9 s SER 62 Ca 0.63 2.26 -0.03 0.00 0.48 0.00 0.00 55.95 59.28 3hk9 s SER 62 Cb -0.34 -2.58 0.34 0.00 0.10 0.00 0.00 66.02 63.55 3hk9 s SER 62 CO 0.29 -1.86 1.85 -0.29 0.98 0.00 0.00 173.24 174.21 3hk9 h ILE 63 N 0.18 1.23 -0.54 -1.02 6.09 -1.97 0.11 117.51 121.60 3hk9 h ILE 63 Ca -0.48 -0.70 -0.04 0.00 -1.37 0.00 0.00 64.86 62.26 3hk9 h ILE 63 Cb 1.28 0.39 -0.02 0.00 0.47 0.00 0.00 36.82 38.94 3hk9 h ILE 63 CO 0.53 0.29 0.19 -0.33 -3.07 0.00 0.00 178.15 175.75 3hk9 h GLU 64 N 0.99 0.83 -0.37 2.19 3.07 -1.93 -2.25 114.58 117.11 3hk9 h GLU 64 Ca 0.23 -0.17 -0.06 0.00 -0.50 0.00 0.00 59.36 58.86 3hk9 h GLU 64 Cb 0.16 -0.12 -0.02 0.00 -0.84 0.00 0.00 28.75 27.93 3hk9 h GLU 64 CO -0.02 0.74 -0.04 0.00 -1.40 0.00 0.00 179.01 178.29 3hk9 h ALA 65 N 1.04 1.24 -0.11 3.43 0.00 -1.75 -2.74 119.26 120.37 3hk9 h ALA 65 Ca 0.18 -0.24 -0.00 0.00 0.00 0.00 0.00 54.91 54.84 3hk9 h ALA 65 Cb 0.25 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 3hk9 h ALA 65 CO -0.01 0.50 0.07 0.35 0.00 0.00 0.00 179.25 180.16 3hk9 h PHE 66 N 0.56 0.15 0.00 0.00 3.57 -0.23 -2.52 116.94 118.47 3hk9 h PHE 66 Ca 0.11 -0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.58 3hk9 h PHE 66 Cb 0.42 -0.05 -0.00 0.00 2.79 0.00 0.00 35.95 39.11 3hk9 h PHE 66 CO 0.02 0.14 -0.15 -1.49 -2.23 0.00 0.00 178.31 174.60 3hk9 h TRP 67 N 0.11 0.00 0.00 0.41 -0.00 -1.32 -2.16 115.95 113.00 3hk9 h TRP 67 Ca 0.04 0.00 -0.13 0.00 -0.00 0.00 0.00 58.89 58.80 3hk9 h TRP 67 Cb 0.04 0.00 -0.02 0.00 -0.00 0.00 0.00 29.16 29.18 3hk9 h TRP 67 CO -0.05 0.15 -0.63 0.00 -0.00 0.00 0.00 178.44 177.91 3hk9 h ALA 68 N 1.85 0.94 -2.28 1.49 0.00 -1.16 -3.45 119.26 116.65 3hk9 h ALA 68 Ca -0.00 -0.57 -0.51 0.00 0.00 0.00 0.00 54.91 53.83 3hk9 h ALA 68 Cb 0.37 -0.10 0.18 0.00 0.00 0.00 0.00 17.79 18.24 3hk9 h ALA 68 CO 0.02 0.78 0.23 -1.64 0.00 0.00 0.00 179.25 178.64 3hk9 s MET 69 N -3.55 1.16 0.73 0.00 -1.94 -0.81 -5.02 119.30 109.87 3hk9 s MET 69 Ca -0.01 1.33 -0.10 0.00 -1.71 0.00 0.00 55.69 55.20 3hk9 s MET 69 Cb 0.12 -1.76 0.05 0.00 2.01 0.00 0.00 34.83 35.25 3hk9 s MET 69 CO 0.76 -2.46 1.09 -1.54 -0.01 0.00 0.00 175.02 172.86 3hk9 s SER 70 N -2.90 4.95 0.21 3.03 1.04 -1.26 -4.82 113.70 113.95 3hk9 s SER 70 Ca 0.65 0.79 -0.09 0.00 0.48 0.00 0.00 55.95 57.78 3hk9 s SER 70 Cb -0.21 -1.45 0.24 0.00 0.10 0.00 0.00 66.02 64.70 3hk9 s SER 70 CO 0.58 -1.59 1.82 0.50 0.98 0.00 0.00 173.24 175.53 3hk9 h LYS 71 N -0.74 0.73 -0.69 4.02 1.63 -1.96 -0.28 116.57 119.28 3hk9 h LYS 71 Ca -0.45 -0.04 -0.02 0.00 -0.85 0.00 0.00 60.65 59.29 3hk9 h LYS 71 Cb 1.30 -0.17 -0.03 0.00 -0.60 0.00 0.00 32.23 32.73 3hk9 h LYS 71 CO 0.63 0.48 0.37 -0.09 -3.45 0.00 0.00 179.45 177.40 3hk9 h ARG 72 N 0.75 0.96 -0.49 1.90 9.65 -1.95 -1.77 114.38 123.44 3hk9 h ARG 72 Ca 0.30 -0.12 -0.11 0.00 -1.10 0.00 0.00 59.98 58.96 3hk9 h ARG 72 Cb 0.15 -0.19 -0.02 0.00 -1.39 0.00 0.00 29.97 28.53 3hk9 h ARG 72 CO -0.17 0.73 -0.10 0.93 2.80 0.00 0.00 179.97 184.16 3hk9 h GLU 73 N 0.94 0.94 -0.61 0.20 5.08 -1.73 -1.66 114.58 117.74 3hk9 h GLU 73 Ca 0.24 -0.35 -0.04 0.00 -1.00 0.00 0.00 59.36 58.21 3hk9 h GLU 73 Cb 0.05 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.22 3hk9 h GLU 73 CO -0.04 1.01 0.23 1.96 -1.00 0.00 0.00 179.01 181.18 3hk9 h GLN 74 N 0.80 0.93 -0.65 2.33 4.20 -0.90 -1.45 115.11 120.36 3hk9 h GLN 74 Ca 0.13 -0.17 -0.08 0.00 0.06 0.00 0.00 58.65 58.58 3hk9 h GLN 74 Cb 0.66 -0.15 -0.03 0.00 0.30 0.00 0.00 27.48 28.27 3hk9 h GLN 74 CO 0.05 0.79 0.10 0.00 -0.67 0.00 0.00 178.83 179.10 3hk9 h ALA 75 N 1.09 0.86 -0.51 3.87 0.00 -1.23 -1.43 119.26 121.91 3hk9 h ALA 75 Ca 0.20 -0.27 -0.05 0.00 0.00 0.00 0.00 54.91 54.79 3hk9 h ALA 75 Cb 0.22 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 3hk9 h ALA 75 CO -0.01 0.63 0.13 -0.44 0.00 0.00 0.00 179.25 179.55 3hk9 h ASP 76 N 1.00 0.78 0.05 0.00 3.32 -1.06 -1.26 116.42 119.24 3hk9 h ASP 76 Ca 0.20 -0.23 -0.00 0.00 0.02 0.00 0.00 57.03 57.01 3hk9 h ASP 76 Cb 0.45 -0.20 0.00 0.00 0.22 0.00 0.00 39.33 39.79 3hk9 h ASP 76 CO 0.01 0.81 -0.02 0.25 -1.72 0.00 0.00 179.24 178.57 3hk9 h LEU 77 N 0.71 -0.05 -0.84 1.55 5.85 -1.05 -1.32 115.31 120.15 3hk9 h LEU 77 Ca 0.16 -0.02 -0.02 0.00 0.84 0.00 0.00 57.88 58.84 3hk9 h LEU 77 Cb 0.33 0.01 -0.04 0.00 0.37 0.00 0.00 40.66 41.34 3hk9 h LEU 77 CO 0.00 -0.02 0.43 0.40 -0.34 0.00 0.00 178.44 178.91 3hk9 h ILE 78 N -0.09 1.25 -0.64 4.05 2.04 -1.18 0.14 117.51 123.08 3hk9 h ILE 78 Ca -0.01 -0.67 -0.01 0.00 1.00 0.00 0.00 64.86 65.17 3hk9 h ILE 78 Cb 0.07 0.16 -0.03 0.00 -0.74 0.00 0.00 36.82 36.28 3hk9 h ILE 78 CO 0.01 0.29 0.38 -0.25 0.00 0.00 0.00 178.15 178.58 3hk9 h TRP 79 N 1.18 0.85 -0.11 1.37 2.91 -1.08 0.31 115.95 121.37 3hk9 h TRP 79 Ca 0.29 -0.01 -0.03 0.00 1.13 0.00 0.00 58.89 60.27 3hk9 h TRP 79 Cb 0.08 -0.28 -0.00 0.00 -0.51 0.00 0.00 29.16 28.45 3hk9 h TRP 79 CO 0.01 0.59 -0.05 1.49 -1.03 0.00 0.00 178.44 179.45 3hk9 h GLU 80 N 0.87 0.23 -0.07 2.65 4.57 -0.75 -0.94 114.58 121.14 3hk9 h GLU 80 Ca 0.23 -0.10 -0.16 0.00 -1.18 0.00 0.00 59.36 58.15 3hk9 h GLU 80 Cb -0.01 -0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 28.56 3hk9 h GLU 80 CO -0.04 0.56 -0.67 0.93 -1.18 0.00 0.00 179.01 178.61 3hk9 h GLU 81 N -0.11 0.30 0.00 1.92 4.39 -0.63 -0.51 114.58 119.95 3hk9 h GLU 81 Ca 0.03 -0.23 0.00 0.00 0.34 0.00 0.00 59.36 59.49 3hk9 h GLU 81 Cb 0.49 0.04 0.00 0.00 -0.10 0.00 0.00 28.75 29.18 3hk9 h GLU 81 CO 0.01 0.87 -0.92 1.28 -1.16 0.00 0.00 179.01 179.09 3hk9 n LEU 82 N -3.84 0.38 -0.03 1.33 4.77 0.09 -4.00 117.00 115.70 3hk9 n LEU 82 Ca -0.03 -0.33 -0.04 0.00 -0.03 0.00 0.00 56.01 55.58 3hk9 n LEU 82 Cb 0.67 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.72 3hk9 n LEU 82 CO 0.46 0.10 -0.70 0.49 -1.33 0.00 0.00 177.39 176.40 3hk9 n PHE 83 N -1.51 0.00 -0.11 -1.77 3.72 -0.39 -2.91 117.46 114.48 3hk9 n PHE 83 Ca 0.01 0.00 -0.21 0.00 -0.05 0.00 0.00 57.45 57.20 3hk9 n PHE 83 Cb 0.24 -0.28 -0.08 0.00 -0.94 0.00 0.00 39.48 38.42 3hk9 n PHE 83 CO 0.00 0.00 0.00 -0.89 -0.05 0.00 0.00 176.76 175.82 3hk9 n ILE 84 N -2.38 1.51 0.19 4.37 2.08 -0.99 -4.38 119.36 119.76 3hk9 n ILE 84 Ca -0.10 -0.13 0.04 0.00 0.56 0.00 0.00 62.75 63.11 3hk9 n ILE 84 Cb 0.67 -2.07 0.37 0.00 -0.75 0.00 0.00 39.64 37.86 3hk9 n ILE 84 CO 0.00 0.00 0.00 0.11 0.56 0.00 0.00 176.55 177.22 3hk9 h LYS 85 N -1.00 0.00 -3.76 0.38 1.57 -1.29 -3.43 116.57 109.03 3hk9 h LYS 85 Ca -0.41 0.00 -0.19 0.00 -1.87 0.00 0.00 60.65 58.19 3hk9 h LYS 85 Cb 1.30 0.00 -0.24 0.00 0.08 0.00 0.00 32.23 33.38 3hk9 h LYS 85 CO -0.25 0.37 -0.66 1.03 -0.57 0.00 0.00 179.45 179.38 3hk9 s ARG 86 N -3.99 0.23 0.29 3.15 3.00 -1.26 -5.05 118.95 115.32 3hk9 s ARG 86 Ca -0.02 -0.29 -0.29 0.00 0.00 0.00 0.00 55.73 55.12 3hk9 s ARG 86 Cb 0.13 0.09 -0.11 0.00 0.00 0.00 0.00 34.95 35.06 3hk9 s ARG 86 CO 0.70 -0.04 1.47 -1.12 0.00 0.00 0.00 175.30 176.31 3hk9 s SER 87 N -0.82 6.55 -0.92 0.23 0.01 -1.26 -3.29 113.70 114.20 3hk9 s SER 87 Ca -0.09 2.81 -0.07 0.00 1.31 0.00 0.00 55.95 59.91 3hk9 s SER 87 Cb -0.06 -2.64 -0.09 0.00 0.21 0.00 0.00 66.02 63.45 3hk9 s SER 87 CO -0.00 -0.76 2.48 -0.81 0.41 0.00 0.00 173.24 174.55 3hk9 n PRO 88 N 1.78 2.39 0.15 12.44 -0.04 -1.15 -4.66 135.00 145.92 3hk9 n PRO 88 Ca 0.05 -1.50 0.13 0.00 -0.04 0.00 0.00 63.50 62.14 3hk9 n PRO 88 Cb 0.40 -2.42 0.31 0.00 -0.04 0.00 0.00 33.50 31.74 3hk9 n PRO 88 CO 0.00 0.00 0.00 -0.39 -0.04 0.00 0.00 175.50 175.07 3hk9 h VAL 89 N 3.07 0.00 -4.19 0.52 -1.51 -1.89 -3.21 116.25 109.04 3hk9 h VAL 89 Ca 0.52 -0.70 -0.51 0.00 -1.23 0.00 0.00 66.70 64.79 3hk9 h VAL 89 Cb 0.39 1.69 0.20 0.00 -2.13 0.00 0.00 31.29 31.44 3hk9 h VAL 89 CO 1.30 0.00 0.21 -0.94 -1.23 0.00 0.00 177.57 176.91 3hk9 s SER 90 N -5.24 2.82 0.21 4.19 1.04 -1.26 -4.71 113.70 110.75 3hk9 s SER 90 Ca 0.09 2.12 -0.10 0.00 0.48 0.00 0.00 55.95 58.54 3hk9 s SER 90 Cb 0.09 -2.54 0.15 0.00 0.10 0.00 0.00 66.02 63.82 3hk9 s SER 90 CO 0.63 -3.15 1.85 -0.08 0.98 0.00 0.00 173.24 173.47 3hk9 h GLU 91 N -1.90 1.01 -0.41 4.02 4.57 -1.97 -0.10 114.58 119.79 3hk9 h GLU 91 Ca -0.45 -0.09 -0.11 0.00 -1.18 0.00 0.00 59.36 57.54 3hk9 h GLU 91 Cb 1.27 -0.21 -0.02 0.00 -0.16 0.00 0.00 28.75 29.63 3hk9 h GLU 91 CO 0.43 0.71 -0.19 0.00 -1.18 0.00 0.00 179.01 178.77 3hk9 h ALA 92 N 1.25 0.89 -0.17 2.92 0.00 -1.95 -1.05 119.26 121.14 3hk9 h ALA 92 Ca 0.27 -0.36 -0.16 0.00 0.00 0.00 0.00 54.91 54.66 3hk9 h ALA 92 Cb -0.05 -0.16 0.01 0.00 0.00 0.00 0.00 17.79 17.59 3hk9 h ALA 92 CO -0.05 0.63 -0.53 0.00 0.00 0.00 0.00 179.25 179.29 3hk9 h ARG 94 N 0.33 0.68 -0.86 0.00 2.43 -0.94 -2.25 114.38 113.78 3hk9 h ARG 94 Ca -0.02 -0.04 0.09 0.00 -0.81 0.00 0.00 59.98 59.20 3hk9 h ARG 94 Cb 1.16 -0.15 -0.07 0.00 -0.42 0.00 0.00 29.97 30.48 3hk9 h ARG 94 CO 0.11 0.45 0.51 0.78 -1.51 0.00 0.00 179.97 180.32 3hk9 h GLY 95 N 0.70 1.33 0.93 2.80 0.00 -1.08 -1.09 103.07 106.67 3hk9 h GLY 95 Ca 0.31 -0.35 0.01 0.00 0.00 0.00 0.00 47.33 47.30 3hk9 h GLY 95 CO -0.19 0.18 0.24 -2.08 0.00 0.00 0.00 176.54 174.69 3hk9 h VAL 96 N 0.88 1.05 -0.75 4.60 2.07 -1.23 -1.84 116.25 121.03 3hk9 h VAL 96 Ca 0.40 -0.17 0.02 0.00 0.82 0.00 0.00 66.70 67.78 3hk9 h VAL 96 Cb 0.31 0.53 -0.04 0.00 -1.52 0.00 0.00 31.29 30.57 3hk9 h VAL 96 CO -0.22 0.09 0.48 -0.07 0.02 0.00 0.00 177.57 177.87 3hk9 h LEU 97 N 0.48 0.81 -0.79 2.57 3.38 -1.13 -1.99 115.31 118.65 3hk9 h LEU 97 Ca 0.15 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.11 3hk9 h LEU 97 Cb -0.01 -0.18 -0.04 0.00 0.09 0.00 0.00 40.66 40.52 3hk9 h LEU 97 CO -0.06 0.57 0.47 0.74 0.09 0.00 0.00 178.44 180.24 3hk9 h THR 98 N 0.96 1.22 -0.18 0.22 2.02 -0.70 -1.33 112.91 115.12 3hk9 h THR 98 Ca 0.29 -0.50 -0.01 0.00 0.77 0.00 0.00 66.41 66.97 3hk9 h THR 98 Cb -0.02 0.13 -0.01 0.00 -1.74 0.00 0.00 68.15 66.51 3hk9 h THR 98 CO -0.10 0.23 0.09 0.00 0.37 0.00 0.00 175.52 176.12 3hk9 h LEU 100 N 0.17 -0.71 -0.42 0.00 3.38 -1.07 -1.44 115.31 115.22 3hk9 h LEU 100 Ca 0.06 0.09 0.05 0.00 0.09 0.00 0.00 57.88 58.17 3hk9 h LEU 100 Cb 0.10 0.28 -0.05 0.00 0.09 0.00 0.00 40.66 41.08 3hk9 h LEU 100 CO -0.01 -0.32 0.14 -0.61 0.09 0.00 0.00 178.44 177.73 3hk9 h GLN 101 N -0.42 0.29 -0.18 1.13 4.15 -1.14 -0.99 115.11 117.95 3hk9 h GLN 101 Ca 0.05 -0.02 0.05 0.00 0.77 0.00 0.00 58.65 59.50 3hk9 h GLN 101 Cb 0.47 -0.07 -0.01 0.00 0.21 0.00 0.00 27.48 28.09 3hk9 h GLN 101 CO -0.18 0.19 0.15 0.78 -1.93 0.00 0.00 178.83 177.85 3hk9 h GLY 102 N 0.30 0.00 -0.45 2.39 0.00 -0.48 -0.66 103.07 104.18 3hk9 h GLY 102 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.52 3hk9 h GLY 102 CO -0.20 0.00 0.00 1.04 0.00 0.00 0.00 176.54 177.38 3hk9 n LEU 103 N -4.21 1.33 0.00 3.11 4.77 -0.59 -4.89 117.00 116.52 3hk9 n LEU 103 Ca 0.01 -0.52 0.00 0.00 -0.03 0.00 0.00 56.01 55.48 3hk9 n LEU 103 Cb 0.29 -0.06 0.00 0.00 -2.33 0.00 0.00 43.42 41.32 3hk9 n LEU 103 CO 0.32 0.26 0.00 0.61 -1.33 0.00 0.00 177.39 177.25 3hk9 n GLY 104 N 1.10 0.63 3.88 -0.72 0.00 -0.25 -5.07 105.19 104.76 3hk9 n GLY 104 Ca 0.17 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.89 3hk9 n GLY 104 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3hk9 s LEU 105 N 0.00 3.93 -0.31 0.99 1.43 -0.46 -4.99 118.68 119.26 3hk9 s LEU 105 Ca 0.00 1.05 -0.00 0.00 -1.03 0.00 0.00 54.13 54.15 3hk9 s LEU 105 Cb 0.00 -3.90 0.07 0.00 0.03 0.00 0.00 46.19 42.39 3hk9 s LEU 105 CO 0.00 -0.31 0.01 -0.62 0.23 0.00 0.00 176.35 175.66 3hk9 s ASP 106 N -3.00 4.83 0.43 2.29 2.15 -1.26 -3.28 116.67 118.83 3hk9 s ASP 106 Ca 0.50 -1.53 0.29 0.00 0.43 0.00 0.00 52.55 52.23 3hk9 s ASP 106 Cb -0.10 -1.68 1.58 0.00 -0.30 0.00 0.00 42.92 42.41 3hk9 s ASP 106 CO 0.29 -0.30 1.89 -0.65 -0.17 0.00 0.00 175.17 176.22 3hk9 h PRO 107 N 7.90 0.00 -0.25 4.34 0.11 -1.92 -2.33 132.00 139.86 3hk9 h PRO 107 Ca -0.17 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.91 3hk9 h PRO 107 Cb 1.05 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.14 3hk9 h PRO 107 CO 0.54 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 178.33 3hk9 h ALA 108 N 2.00 1.55 0.00 -0.75 0.00 -2.00 -2.54 119.26 117.52 3hk9 h ALA 108 Ca 0.00 -0.15 -0.08 0.00 0.00 0.00 0.00 54.91 54.68 3hk9 h ALA 108 Cb 0.00 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 3hk9 h ALA 108 CO 0.00 0.33 -0.38 1.79 0.00 0.00 0.00 179.25 181.00 3hk9 h THR 109 N 0.36 0.64 -1.91 0.00 1.35 -1.86 -3.47 112.91 108.02 3hk9 h THR 109 Ca 0.08 -1.90 -0.35 0.00 -0.55 0.00 0.00 66.41 63.69 3hk9 h THR 109 Cb 0.24 2.31 -0.10 0.00 -1.73 0.00 0.00 68.15 68.87 3hk9 h THR 109 CO 0.01 0.36 -0.36 0.54 -0.25 0.00 0.00 175.52 175.82 3hk9 n ARG 110 N -3.19 -1.56 -2.81 4.72 1.74 -0.96 -4.87 116.66 109.73 3hk9 n ARG 110 Ca 0.02 0.96 -0.44 0.00 -0.77 0.00 0.00 57.85 57.63 3hk9 n ARG 110 Cb 0.68 -5.39 -0.00 0.00 -1.02 0.00 0.00 32.46 26.73 3hk9 n ARG 110 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 3hk9 s ASP 111 N -2.32 6.96 0.28 0.55 -1.08 -1.26 -4.83 116.67 114.96 3hk9 s ASP 111 Ca 0.00 -2.73 -0.01 0.00 -0.52 0.00 0.00 52.55 49.30 3hk9 s ASP 111 Cb 0.00 -2.47 0.48 0.00 -1.46 0.00 0.00 42.92 39.47 3hk9 s ASP 111 CO 0.00 -0.93 1.88 0.25 0.52 0.00 0.00 175.17 176.89 3hk9 h LEU 112 N 10.81 0.98 -0.82 -1.34 5.85 -1.98 -1.65 115.31 127.15 3hk9 h LEU 112 Ca 0.35 0.02 0.02 0.00 0.84 0.00 0.00 57.88 59.11 3hk9 h LEU 112 Cb 0.88 -0.19 -0.04 0.00 0.37 0.00 0.00 40.66 41.68 3hk9 h LEU 112 CO 1.32 0.60 0.54 1.56 -0.34 0.00 0.00 178.44 182.12 3hk9 h GLN 113 N 1.10 1.05 -0.43 1.25 1.08 -2.00 -1.13 115.11 116.03 3hk9 h GLN 113 Ca 0.44 -0.06 -0.07 0.00 -1.45 0.00 0.00 58.65 57.51 3hk9 h GLN 113 Cb 0.27 -0.24 -0.02 0.00 -0.05 0.00 0.00 27.48 27.45 3hk9 h GLN 113 CO -0.19 0.69 0.01 0.28 -0.95 0.00 0.00 178.83 178.67 3hk9 h VAL 114 N 1.08 1.26 -0.65 -0.54 2.07 -1.75 -2.60 116.25 115.12 3hk9 h VAL 114 Ca 0.31 -1.01 0.07 0.00 0.82 0.00 0.00 66.70 66.89 3hk9 h VAL 114 Cb -0.07 1.07 -0.06 0.00 -1.52 0.00 0.00 31.29 30.71 3hk9 h VAL 114 CO -0.09 0.34 0.35 1.88 0.02 0.00 0.00 177.57 180.07 3hk9 h TYR 115 N 0.58 0.63 -0.58 1.57 0.05 -0.76 -1.86 116.97 116.61 3hk9 h TYR 115 Ca 0.12 0.03 -0.01 0.00 0.05 0.00 0.00 58.73 58.91 3hk9 h TYR 115 Cb 0.47 -0.19 -0.03 0.00 1.01 0.00 0.00 36.73 38.00 3hk9 h TYR 115 CO 0.04 0.28 0.31 0.00 -1.05 0.00 0.00 178.16 177.73 3hk9 h ARG 116 N 0.63 0.80 -0.14 4.88 3.08 -1.04 -2.40 114.38 120.19 3hk9 h ARG 116 Ca 0.30 -0.09 0.03 0.00 0.07 0.00 0.00 59.98 60.29 3hk9 h ARG 116 Cb 0.23 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 30.11 3hk9 h ARG 116 CO -0.20 0.60 0.09 0.93 -1.07 0.00 0.00 179.97 180.32 3hk9 h GLU 117 N 0.81 0.06 -0.11 0.04 5.08 -0.95 -2.32 114.58 117.20 3hk9 h GLU 117 Ca 0.21 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.56 3hk9 h GLU 117 Cb 0.04 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.27 3hk9 h GLU 117 CO -0.03 0.04 0.07 -0.92 -1.00 0.00 0.00 179.01 177.17 3hk9 h TYR 118 N 0.07 0.14 -0.18 4.33 3.20 -1.37 -3.10 116.97 120.05 3hk9 h TYR 118 Ca 0.06 0.00 -0.12 0.00 3.14 0.00 0.00 58.73 61.81 3hk9 h TYR 118 Cb 0.16 -0.05 -0.01 0.00 1.54 0.00 0.00 36.73 38.37 3hk9 h TYR 118 CO -0.00 0.12 -0.42 0.74 -1.64 0.00 0.00 178.16 176.95 3hk9 h PHE 119 N 0.12 0.50 -0.48 -3.82 0.04 -1.52 -3.22 116.94 108.56 3hk9 h PHE 119 Ca 0.04 -0.14 0.08 0.00 2.80 0.00 0.00 57.97 60.75 3hk9 h PHE 119 Cb 0.01 -0.11 -0.03 0.00 2.20 0.00 0.00 35.95 38.03 3hk9 h PHE 119 CO -0.06 0.77 0.32 0.00 -0.60 0.00 0.00 178.31 178.75 3hk9 h ALA 120 N 1.21 2.05 -0.79 2.45 0.00 -1.38 -2.78 119.26 120.02 3hk9 h ALA 120 Ca 0.03 -0.01 -0.36 0.00 0.00 0.00 0.00 54.91 54.57 3hk9 h ALA 120 Cb 0.89 -0.06 -0.21 0.00 0.00 0.00 0.00 17.79 18.40 3hk9 h ALA 120 CO 0.07 -0.16 0.46 0.36 0.00 0.00 0.00 179.25 179.99 3hk9 n LYS 121 N -4.47 2.50 -4.06 0.00 2.85 -1.22 -4.93 118.16 108.83 3hk9 n LYS 121 Ca 0.07 -2.59 -0.09 0.00 -1.05 0.00 0.00 58.31 54.65 3hk9 n LYS 121 Cb 0.33 -2.04 -0.10 0.00 -0.65 0.00 0.00 35.03 32.57 3hk9 n LYS 121 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 177.40 177.50 3hk9 s LYS 122 N -2.76 0.54 0.54 -1.58 1.02 -1.05 -5.13 119.74 111.32 3hk9 s LYS 122 Ca 0.48 -0.99 0.02 0.00 0.02 0.00 0.00 55.97 55.50 3hk9 s LYS 122 Cb 0.40 0.05 0.03 0.00 -0.52 0.00 0.00 37.83 37.79 3hk9 s LYS 122 CO 0.10 -0.06 0.76 0.95 -0.92 0.00 0.00 175.35 176.18 3hk9 s THR 123 N -2.79 2.70 0.12 2.17 -4.23 -1.26 -4.96 115.64 107.39 3hk9 s THR 123 Ca -0.02 -0.70 -0.18 0.00 -1.18 0.00 0.00 61.69 59.61 3hk9 s THR 123 Cb -0.00 -3.00 -0.05 0.00 1.34 0.00 0.00 72.50 70.79 3hk9 s THR 123 CO -0.05 -0.00 1.70 0.28 -0.54 0.00 0.00 174.62 176.01 3hk9 h SER 124 N 0.12 0.36 -0.96 3.99 0.02 -1.98 -1.93 113.55 113.17 3hk9 h SER 124 Ca -0.42 -0.11 0.07 0.00 -0.84 0.00 0.00 61.79 60.49 3hk9 h SER 124 Cb 1.30 -0.09 -0.07 0.00 0.14 0.00 0.00 62.40 63.68 3hk9 h SER 124 CO 0.51 0.37 0.62 -0.33 -1.14 0.00 0.00 176.83 176.87 3hk9 h GLU 125 N 0.32 1.06 -0.30 3.45 3.07 -1.94 -0.78 114.58 119.46 3hk9 h GLU 125 Ca 0.10 -0.06 -0.17 0.00 -0.50 0.00 0.00 59.36 58.73 3hk9 h GLU 125 Cb 0.10 -0.24 -0.00 0.00 -0.84 0.00 0.00 28.75 27.77 3hk9 h GLU 125 CO -0.01 0.70 -0.48 0.93 -1.40 0.00 0.00 179.01 178.75 3hk9 h GLU 126 N 1.09 0.81 -0.25 2.33 5.08 -1.87 -2.49 114.58 119.29 3hk9 h GLU 126 Ca 0.42 -0.47 -0.12 0.00 -1.00 0.00 0.00 59.36 58.19 3hk9 h GLU 126 Cb 0.22 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.50 3hk9 h GLU 126 CO -0.17 1.11 -0.35 0.37 -1.00 0.00 0.00 179.01 178.96 3hk9 h GLN 127 N 0.64 0.55 -0.12 2.33 5.75 -0.83 -1.21 115.11 122.23 3hk9 h GLN 127 Ca 0.03 -0.26 -0.00 0.00 -0.15 0.00 0.00 58.65 58.27 3hk9 h GLN 127 Cb 1.06 -0.01 -0.01 0.00 1.07 0.00 0.00 27.48 29.60 3hk9 h GLN 127 CO 0.11 0.83 0.06 0.28 -2.65 0.00 0.00 178.83 177.45 3hk9 h VAL 128 N 0.46 1.10 -0.22 2.39 2.07 -1.09 0.26 116.25 121.22 3hk9 h VAL 128 Ca 0.05 -0.28 0.03 0.00 0.82 0.00 0.00 66.70 67.32 3hk9 h VAL 128 Cb 0.83 1.08 -0.03 0.00 -1.52 0.00 0.00 31.29 31.65 3hk9 h VAL 128 CO 0.07 0.09 0.02 0.44 0.02 0.00 0.00 177.57 178.21 3hk9 h ASP 129 N 0.08 -0.03 0.33 0.57 5.19 -1.26 -1.31 116.42 119.99 3hk9 h ASP 129 Ca 0.04 0.04 -0.00 0.00 -0.62 0.00 0.00 57.03 56.49 3hk9 h ASP 129 Cb 0.09 0.06 -0.02 0.00 0.18 0.00 0.00 39.33 39.64 3hk9 h ASP 129 CO -0.01 0.01 -0.29 0.74 -3.12 0.00 0.00 179.24 176.58 3hk9 h THR 130 N 0.10 0.40 -0.12 0.35 2.02 -1.00 -2.67 112.91 111.99 3hk9 h THR 130 Ca 0.10 0.00 0.01 0.00 0.77 0.00 0.00 66.41 67.29 3hk9 h THR 130 Cb 0.11 0.40 -0.01 0.00 -1.74 0.00 0.00 68.15 66.91 3hk9 h THR 130 CO -0.15 0.00 0.04 0.58 0.37 0.00 0.00 175.52 176.36 3hk9 h VAL 131 N -0.63 0.97 -0.10 3.16 2.07 -0.78 0.32 116.25 121.26 3hk9 h VAL 131 Ca -0.02 -0.03 -0.01 0.00 0.82 0.00 0.00 66.70 67.45 3hk9 h VAL 131 Cb 0.56 0.86 -0.01 0.00 -1.52 0.00 0.00 31.29 31.18 3hk9 h VAL 131 CO -0.03 0.02 0.00 -0.07 0.02 0.00 0.00 177.57 177.51 3hk9 h LEU 132 N 0.10 0.13 0.02 2.57 3.38 -1.28 0.20 115.31 120.43 3hk9 h LEU 132 Ca 0.05 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.01 3hk9 h LEU 132 Cb 0.03 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 40.75 3hk9 h LEU 132 CO -0.06 0.16 -0.01 -0.61 0.09 0.00 0.00 178.44 178.01 3hk9 h GLN 133 N 0.15 -0.02 -0.77 1.13 -0.00 -1.08 -1.01 115.11 113.51 3hk9 h GLN 133 Ca 0.04 0.00 -0.03 0.00 -0.00 0.00 0.00 58.65 58.66 3hk9 h GLN 133 Cb 0.10 0.00 -0.04 0.00 0.00 0.00 0.00 27.48 27.55 3hk9 h GLN 133 CO 0.00 0.62 0.36 -0.07 0.00 0.00 0.00 178.83 179.74 3hk9 h LEU 134 N -0.69 1.02 -1.18 -2.39 3.38 -0.51 -2.35 115.31 112.58 3hk9 h LEU 134 Ca -0.00 -0.13 0.00 0.00 0.09 0.00 0.00 57.88 57.84 3hk9 h LEU 134 Cb 0.65 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 41.14 3hk9 h LEU 134 CO 0.00 0.87 0.00 0.00 0.09 0.00 0.00 178.44 179.40 3hk9 n ALA 135 N -2.43 2.52 -4.09 1.53 0.00 0.68 -4.95 120.51 113.78 3hk9 n ALA 135 Ca 0.07 -0.54 -0.32 0.00 0.00 0.00 0.00 53.44 52.65 3hk9 n ALA 135 Cb 0.15 -1.08 -0.02 0.00 0.00 0.00 0.00 19.45 18.50 3hk9 n ALA 135 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 3hk9 n ASN 136 N 0.40 -2.68 -4.57 0.00 5.15 -0.61 -4.82 115.26 108.12 3hk9 n ASN 136 Ca 0.17 -0.97 -0.36 0.00 -0.60 0.00 0.00 54.58 52.82 3hk9 n ASN 136 Cb 0.36 -3.05 -0.11 0.00 -0.53 0.00 0.00 39.78 36.46 3hk9 n ASN 136 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 3hk9 s VAL 137 N -3.49 4.80 -0.13 3.44 1.01 -0.48 -0.85 120.40 124.70 3hk9 s VAL 137 Ca 0.51 -0.02 0.14 0.00 0.00 0.00 0.00 61.98 62.61 3hk9 s VAL 137 Cb -0.27 -3.22 -0.24 0.00 0.00 0.00 0.00 36.38 32.65 3hk9 s VAL 137 CO 0.90 0.37 0.33 -1.54 0.00 0.00 0.00 175.10 175.16 3hk9 n SER 138 N 4.35 0.55 -3.88 3.32 3.41 0.23 -4.72 113.62 116.88 3hk9 n SER 138 Ca -0.16 0.19 -0.17 0.00 -0.26 0.00 0.00 58.87 58.47 3hk9 n SER 138 Cb 0.52 0.40 -0.16 0.00 -0.26 0.00 0.00 64.21 64.71 3hk9 n SER 138 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 3hk9 s ASP 139 N -5.86 0.59 -0.17 4.04 1.01 -1.06 -4.71 116.67 110.50 3hk9 s ASP 139 Ca -0.09 -0.07 0.01 0.00 0.71 0.00 0.00 52.55 53.11 3hk9 s ASP 139 Cb 0.07 -0.24 0.01 0.00 1.01 0.00 0.00 42.92 43.77 3hk9 s ASP 139 CO 0.82 -0.04 -0.19 -0.69 0.21 0.00 0.00 175.17 175.28 3hk9 s VAL 140 N 0.67 2.25 -0.16 -1.27 1.01 0.21 -0.35 120.40 122.76 3hk9 s VAL 140 Ca -0.07 -0.89 -0.16 0.00 0.00 0.00 0.00 61.98 60.85 3hk9 s VAL 140 Cb -0.11 -1.94 -0.04 0.00 0.00 0.00 0.00 36.38 34.29 3hk9 s VAL 140 CO -0.01 0.53 0.40 -0.69 0.00 0.00 0.00 175.10 175.33 3hk9 s VAL 141 N 1.12 5.22 0.66 2.92 1.01 0.05 -0.43 120.40 130.95 3hk9 s VAL 141 Ca 0.01 0.75 0.02 0.00 0.00 0.00 0.00 61.98 62.76 3hk9 s VAL 141 Cb -0.14 -3.73 0.11 0.00 0.00 0.00 0.00 36.38 32.61 3hk9 s VAL 141 CO -0.08 0.31 0.91 -0.04 0.00 0.00 0.00 175.10 176.21 3hk9 s MET 142 N 0.85 1.94 -0.30 2.72 -1.94 0.14 -1.37 119.30 121.33 3hk9 s MET 142 Ca 0.21 -1.24 0.03 0.00 -1.71 0.00 0.00 55.69 52.98 3hk9 s MET 142 Cb -0.14 -2.44 0.08 0.00 2.01 0.00 0.00 34.83 34.34 3hk9 s MET 142 CO 0.07 -1.20 -0.02 0.99 -0.01 0.00 0.00 175.02 174.85 3hk9 s THR 143 N -2.96 2.14 -0.41 2.05 2.01 -1.12 -3.56 115.64 113.79 3hk9 s THR 143 Ca 0.64 -1.98 -0.10 0.00 0.31 0.00 0.00 61.69 60.56 3hk9 s THR 143 Cb -0.06 -2.44 0.07 0.00 0.01 0.00 0.00 72.50 70.07 3hk9 s THR 143 CO 0.42 -0.36 0.25 0.20 -0.69 0.00 0.00 174.62 174.45 3hk9 s ASN 144 N 1.03 5.70 -0.50 3.53 -0.87 0.16 -4.95 114.94 119.04 3hk9 s ASN 144 Ca 0.02 -1.36 -0.17 0.00 -1.57 0.00 0.00 52.86 49.78 3hk9 s ASN 144 Cb -0.19 -2.01 0.07 0.00 -0.02 0.00 0.00 41.25 39.10 3hk9 s ASN 144 CO -0.07 -0.51 0.51 -0.62 -2.57 0.00 0.00 177.10 173.84 3hk9 s ASP 145 N 2.01 6.18 0.13 -1.22 2.15 -1.26 -1.93 116.67 122.74 3hk9 s ASP 145 Ca 0.03 -1.22 0.16 0.00 0.43 0.00 0.00 52.55 51.95 3hk9 s ASP 145 Cb -0.22 -2.23 0.72 0.00 -0.30 0.00 0.00 42.92 40.88 3hk9 s ASP 145 CO 0.04 -0.79 1.50 -0.81 -0.17 0.00 0.00 175.17 174.93 3hk9 n PRO 146 N 5.65 0.09 0.01 4.34 -0.04 -1.26 -2.04 135.00 141.75 3hk9 n PRO 146 Ca -0.10 0.41 0.13 0.00 -0.04 0.00 0.00 63.50 63.90 3hk9 n PRO 146 Cb 0.44 -1.69 0.42 0.00 -0.04 0.00 0.00 33.50 32.62 3hk9 n PRO 146 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 3hk9 n PHE 147 N -1.86 0.13 -3.05 0.54 3.72 -1.26 -4.46 117.46 111.22 3hk9 n PHE 147 Ca 0.02 0.04 -0.40 0.00 -0.05 0.00 0.00 57.45 57.06 3hk9 n PHE 147 Cb 0.14 -0.46 -0.05 0.00 -0.94 0.00 0.00 39.48 38.18 3hk9 n PHE 147 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 3hk9 s ASP 148 N -3.25 6.92 0.20 4.37 2.15 -0.87 -4.97 116.67 121.23 3hk9 s ASP 148 Ca 0.12 1.11 -0.11 0.00 0.43 0.00 0.00 52.55 54.10 3hk9 s ASP 148 Cb 0.17 -2.40 0.18 0.00 -0.30 0.00 0.00 42.92 40.57 3hk9 s ASP 148 CO 0.62 -0.18 1.82 0.44 -0.17 0.00 0.00 175.17 177.70 3hk9 h ASP 149 N 6.97 0.59 -0.68 -0.34 3.32 -1.88 0.48 116.42 124.88 3hk9 h ASP 149 Ca -0.38 0.01 -0.07 0.00 0.02 0.00 0.00 57.03 56.62 3hk9 h ASP 149 Cb 1.18 -0.11 -0.03 0.00 0.22 0.00 0.00 39.33 40.59 3hk9 h ASP 149 CO 0.77 0.41 0.16 0.78 -1.72 0.00 0.00 179.24 179.64 3hk9 h ASN 150 N 0.72 1.04 -0.05 6.45 2.35 -1.94 -2.37 115.58 121.79 3hk9 h ASN 150 Ca 0.26 -0.24 -0.21 0.00 -0.55 0.00 0.00 56.30 55.57 3hk9 h ASN 150 Cb 0.07 -0.27 0.01 0.00 0.05 0.00 0.00 38.32 38.18 3hk9 h ASN 150 CO -0.13 1.01 -0.78 -0.33 -1.65 0.00 0.00 177.43 175.55 3hk9 h GLU 151 N 1.03 0.61 -0.66 0.81 5.08 -1.77 -3.20 114.58 116.47 3hk9 h GLU 151 Ca 0.21 -0.59 -0.02 0.00 -1.00 0.00 0.00 59.36 57.96 3hk9 h GLU 151 Cb 0.38 0.15 -0.03 0.00 0.50 0.00 0.00 28.75 29.75 3hk9 h GLU 151 CO 0.00 1.21 0.33 -0.09 -1.00 0.00 0.00 179.01 179.46 3hk9 h ARG 152 N 0.23 0.94 -0.48 2.33 2.43 -0.88 -2.51 114.38 116.44 3hk9 h ARG 152 Ca -0.08 -0.13 -0.04 0.00 -0.81 0.00 0.00 59.98 58.92 3hk9 h ARG 152 Cb 1.44 -0.17 -0.02 0.00 -0.42 0.00 0.00 29.97 30.79 3hk9 h ARG 152 CO 0.16 0.73 0.14 0.82 -1.51 0.00 0.00 179.97 180.31 3hk9 h ILE 153 N 0.90 1.20 -0.25 1.20 2.04 -1.53 -0.36 117.51 120.72 3hk9 h ILE 153 Ca 0.23 -0.67 -0.01 0.00 1.00 0.00 0.00 64.86 65.40 3hk9 h ILE 153 Cb 0.09 0.68 -0.01 0.00 -0.74 0.00 0.00 36.82 36.84 3hk9 h ILE 153 CO -0.03 0.25 0.11 0.28 0.00 0.00 0.00 178.15 178.76 3hk9 h SER 154 N 0.69 0.33 -0.46 1.72 0.02 -1.45 0.57 113.55 114.97 3hk9 h SER 154 Ca 0.16 -0.14 -0.11 0.00 -0.84 0.00 0.00 61.79 60.86 3hk9 h SER 154 Cb 0.22 -0.09 -0.01 0.00 0.14 0.00 0.00 62.40 62.66 3hk9 h SER 154 CO -0.01 0.38 -0.13 -0.50 -1.14 0.00 0.00 176.83 175.43 3hk9 h TRP 155 N 0.26 1.02 -0.28 3.45 4.06 -1.18 -0.74 115.95 122.55 3hk9 h TRP 155 Ca 0.08 -0.23 -0.06 0.00 2.06 0.00 0.00 58.89 60.75 3hk9 h TRP 155 Cb 0.14 -0.25 -0.02 0.00 -1.00 0.00 0.00 29.16 28.04 3hk9 h TRP 155 CO -0.02 1.00 -0.10 -0.07 -3.56 0.00 0.00 178.44 175.69 3hk9 h LEU 156 N 0.74 0.43 -1.50 -4.49 3.38 -0.93 -2.47 115.31 110.47 3hk9 h LEU 156 Ca 0.11 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.98 3hk9 h LEU 156 Cb 0.68 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.32 3hk9 h LEU 156 CO 0.05 0.58 0.00 -0.62 0.09 0.00 0.00 178.44 178.54 3hk9 n GLU 157 N -4.23 1.90 -0.65 1.13 1.02 0.18 -4.89 120.64 115.10 3hk9 n GLU 157 Ca 0.01 -0.77 0.00 0.00 -0.02 0.00 0.00 57.16 56.38 3hk9 n GLU 157 Cb 0.30 -1.61 0.00 0.00 -0.02 0.00 0.00 31.44 30.10 3hk9 n GLU 157 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3hk9 n GLY 158 N 0.25 0.81 3.70 0.62 0.00 -0.93 -5.03 105.19 104.61 3hk9 n GLY 158 Ca 0.07 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.67 3hk9 n GLY 158 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hk9 s LYS 159 N -0.35 4.14 -0.06 1.61 -0.14 -0.30 -4.99 119.74 119.64 3hk9 s LYS 159 Ca 0.00 2.58 0.03 0.00 -1.36 0.00 0.00 55.97 57.21 3hk9 s LYS 159 Cb 0.00 -3.48 0.01 0.00 -1.68 0.00 0.00 37.83 32.68 3hk9 s LYS 159 CO 0.00 -0.81 -0.14 -0.65 -0.76 0.00 0.00 175.35 172.99 3hk9 s GLN 160 N 2.38 1.84 0.69 1.68 -1.52 -1.26 -4.61 119.66 118.85 3hk9 s GLN 160 Ca 0.79 -0.49 -0.14 0.00 -1.95 0.00 0.00 55.36 53.58 3hk9 s GLN 160 Cb -0.46 -1.50 0.02 0.00 -0.22 0.00 0.00 33.01 30.84 3hk9 s GLN 160 CO 0.35 0.07 1.11 -1.25 -0.25 0.00 0.00 175.29 175.32 3hk9 s PRO 161 N 0.53 2.64 0.91 2.91 0.04 -1.26 -4.98 135.00 135.79 3hk9 s PRO 161 Ca -0.13 1.33 -0.12 0.00 0.04 0.00 0.00 61.00 62.12 3hk9 s PRO 161 Cb -0.15 -1.93 0.14 0.00 0.04 0.00 0.00 34.50 32.59 3hk9 s PRO 161 CO 0.04 -1.37 1.12 0.16 0.04 0.00 0.00 177.00 176.99 3hk9 s ASP 162 N -2.80 3.48 0.64 6.66 1.47 -1.26 -4.86 116.67 120.00 3hk9 s ASP 162 Ca 0.65 1.06 0.27 0.00 1.18 0.00 0.00 52.55 55.71 3hk9 s ASP 162 Cb -0.20 -1.68 1.42 0.00 -0.34 0.00 0.00 42.92 42.12 3hk9 s ASP 162 CO 0.46 -2.58 1.81 0.77 0.68 0.00 0.00 175.17 176.30 3hk9 h SER 163 N -1.52 0.00 1.33 2.11 4.64 -2.00 -0.58 113.55 117.53 3hk9 h SER 163 Ca -0.51 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.81 3hk9 h SER 163 Cb 1.32 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.41 3hk9 h SER 163 CO 0.61 0.00 -0.28 0.03 -0.87 0.00 0.00 176.83 176.32 3hk9 h ARG 164 N 0.00 0.00 -5.71 4.77 3.08 -1.90 -3.45 114.38 111.17 3hk9 h ARG 164 Ca 0.07 0.00 -0.66 0.00 0.07 0.00 0.00 59.98 59.46 3hk9 h ARG 164 Cb 0.99 0.00 -0.21 0.00 0.08 0.00 0.00 29.97 30.82 3hk9 h ARG 164 CO -0.00 0.00 -0.70 -0.06 -1.07 0.00 0.00 179.97 178.14 3hk9 s PHE 165 N -3.16 2.94 0.12 3.04 0.08 -0.23 -0.62 117.98 120.15 3hk9 s PHE 165 Ca 0.08 -0.22 0.10 0.00 0.12 0.00 0.00 56.93 57.01 3hk9 s PHE 165 Cb 0.11 -1.82 -0.04 0.00 -0.57 0.00 0.00 43.02 40.71 3hk9 s PHE 165 CO 0.66 0.10 -0.25 -1.01 -0.10 0.00 0.00 175.22 174.63 3hk9 s HIS 166 N -0.19 2.15 0.23 0.36 3.76 0.43 -4.61 115.29 117.42 3hk9 s HIS 166 Ca 0.02 -0.39 -0.09 0.00 -0.15 0.00 0.00 55.06 54.45 3hk9 s HIS 166 Cb -0.13 -1.18 -0.07 0.00 1.11 0.00 0.00 32.58 32.32 3hk9 s HIS 166 CO 0.03 0.28 0.55 0.00 -0.85 0.00 0.00 174.74 174.75 3hk9 s ALA 167 N -1.07 3.57 -0.05 -1.40 0.00 -1.26 -0.69 121.76 120.86 3hk9 s ALA 167 Ca 0.12 -0.31 -0.02 0.00 0.00 0.00 0.00 51.96 51.75 3hk9 s ALA 167 Cb -0.10 -2.42 0.03 0.00 0.00 0.00 0.00 23.12 20.63 3hk9 s ALA 167 CO 0.05 0.48 0.05 0.00 0.00 0.00 0.00 175.76 176.35 3hk9 s ALA 168 N -1.84 0.33 -0.82 0.00 0.00 -1.23 -0.12 121.76 118.07 3hk9 s ALA 168 Ca 0.47 0.10 -0.26 0.00 0.00 0.00 0.00 51.96 52.27 3hk9 s ALA 168 Cb -0.11 -0.67 0.03 0.00 0.00 0.00 0.00 23.12 22.37 3hk9 s ALA 168 CO 0.22 -0.53 1.40 -1.17 0.00 0.00 0.00 175.76 175.68 3hk9 s LEU 169 N 2.13 3.27 -0.01 0.00 2.96 -0.73 -0.66 118.68 125.64 3hk9 s LEU 169 Ca 0.05 -0.68 -0.30 0.00 -0.22 0.00 0.00 54.13 52.97 3hk9 s LEU 169 Cb -0.12 -2.56 -0.03 0.00 0.50 0.00 0.00 46.19 43.97 3hk9 s LEU 169 CO -0.04 -1.82 1.04 -0.60 -1.32 0.00 0.00 176.35 173.61 3hk9 s ARG 170 N 5.67 4.50 -0.13 1.98 6.06 -0.81 -1.12 118.95 135.10 3hk9 s ARG 170 Ca 0.42 1.50 0.15 0.00 -2.50 0.00 0.00 55.73 55.30 3hk9 s ARG 170 Cb -0.06 -3.45 0.29 0.00 0.06 0.00 0.00 34.95 31.78 3hk9 s ARG 170 CO 0.08 -0.15 1.15 1.28 -2.50 0.00 0.00 175.30 175.15 3hk9 n LEU 171 N 4.14 2.08 -0.26 -0.88 4.77 0.29 -4.40 117.00 122.73 3hk9 n LEU 171 Ca 0.07 -2.96 0.06 0.00 -0.03 0.00 0.00 56.01 53.15 3hk9 n LEU 171 Cb 0.49 -0.38 0.17 0.00 -2.33 0.00 0.00 43.42 41.38 3hk9 n LEU 171 CO 0.53 0.79 0.83 0.44 -1.33 0.00 0.00 177.39 178.65 3hk9 h ASP 172 N 0.25 -0.32 -0.52 -1.43 5.19 -1.92 -1.73 116.42 115.95 3hk9 h ASP 172 Ca -0.01 0.20 -0.00 0.00 -0.62 0.00 0.00 57.03 56.59 3hk9 h ASP 172 Cb 1.09 0.34 -0.02 0.00 0.18 0.00 0.00 39.33 40.91 3hk9 h ASP 172 CO 0.00 -0.18 0.31 -0.65 -3.12 0.00 0.00 179.24 175.60 3hk9 h PRO 173 N 0.11 0.71 0.06 3.56 0.11 -1.94 0.23 132.00 134.83 3hk9 h PRO 173 Ca 0.43 -0.07 -0.00 0.00 0.11 0.00 0.00 66.00 66.47 3hk9 h PRO 173 Cb 0.77 -0.15 0.00 0.00 0.11 0.00 0.00 31.00 31.73 3hk9 h PRO 173 CO -0.67 0.52 -0.03 1.25 -0.21 0.00 0.00 178.00 178.86 3hk9 h LEU 174 N 0.69 -0.06 0.02 2.35 5.85 -1.65 -0.91 115.31 121.60 3hk9 h LEU 174 Ca 0.18 -0.11 -0.27 0.00 0.84 0.00 0.00 57.88 58.52 3hk9 h LEU 174 Cb 0.00 0.02 0.02 0.00 0.37 0.00 0.00 40.66 41.07 3hk9 h LEU 174 CO -0.03 0.07 -1.13 -0.07 -0.34 0.00 0.00 178.44 176.94 3hk9 h LEU 175 N -0.20 0.75 -1.13 2.25 4.07 -1.31 -3.12 115.31 116.62 3hk9 h LEU 175 Ca -0.01 -0.66 0.00 0.00 0.08 0.00 0.00 57.88 57.29 3hk9 h LEU 175 Cb 0.17 -0.23 0.00 0.00 1.08 0.00 0.00 40.66 41.68 3hk9 h LEU 175 CO 0.01 1.47 -0.36 0.59 -1.08 0.00 0.00 178.44 179.07 3hk9 n ASN 176 N -3.76 2.09 -2.60 -0.43 3.02 0.80 -3.81 115.26 110.57 3hk9 n ASN 176 Ca -0.11 -1.54 -0.00 0.00 -0.03 0.00 0.00 54.58 52.89 3hk9 n ASN 176 Cb 0.93 0.39 0.06 0.00 -0.61 0.00 0.00 39.78 40.56 3hk9 n ASN 176 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3hk9 n GLU 177 N 0.18 1.41 -0.14 3.52 1.02 -0.36 -4.95 120.64 121.32 3hk9 n GLU 177 Ca 0.09 -2.72 0.20 0.00 -0.02 0.00 0.00 57.16 54.71 3hk9 n GLU 177 Cb 0.46 -0.88 0.59 0.00 -0.02 0.00 0.00 31.44 31.58 3hk9 n GLU 177 CO 0.00 0.00 0.00 -0.92 1.18 0.00 0.00 177.13 177.39 3hk9 h TYR 178 N 1.97 0.29 -0.49 -0.32 3.20 -1.47 0.00 116.97 120.15 3hk9 h TYR 178 Ca -0.24 0.01 0.04 0.00 3.14 0.00 0.00 58.73 61.68 3hk9 h TYR 178 Cb 1.35 -0.09 -0.04 0.00 1.54 0.00 0.00 36.73 39.49 3hk9 h TYR 178 CO 0.31 0.10 0.25 0.93 -1.64 0.00 0.00 178.16 178.11 3hk9 h GLU 179 N 0.23 0.49 0.00 1.82 4.39 -1.90 0.17 114.58 119.79 3hk9 h GLU 179 Ca 0.37 -0.03 -0.23 0.00 0.34 0.00 0.00 59.36 59.81 3hk9 h GLU 179 Cb 1.10 -0.11 -0.04 0.00 -0.10 0.00 0.00 28.75 29.61 3hk9 h GLU 179 CO -0.08 0.32 -1.34 1.96 -1.16 0.00 0.00 179.01 178.71 3hk9 h GLN 180 N 0.50 0.00 0.00 2.33 7.50 -1.78 -3.37 115.11 120.29 3hk9 h GLN 180 Ca 0.21 0.00 -0.18 0.00 0.50 0.00 0.00 58.65 59.18 3hk9 h GLN 180 Cb 0.10 0.00 -0.02 0.00 0.05 0.00 0.00 27.48 27.61 3hk9 h GLN 180 CO -0.14 0.63 -0.84 1.15 -1.50 0.00 0.00 178.83 178.14 3hk9 h THR 181 N 0.00 1.55 -0.10 -0.54 2.02 -0.77 -3.25 112.91 111.83 3hk9 h THR 181 Ca -0.16 -2.73 0.03 0.00 0.77 0.00 0.00 66.41 64.32 3hk9 h THR 181 Cb 1.83 2.50 -0.00 0.00 -1.74 0.00 0.00 68.15 70.73 3hk9 h THR 181 CO 0.09 0.79 0.08 0.07 0.37 0.00 0.00 175.52 176.91 3hk9 h LYS 182 N 0.04 0.00 0.00 6.66 2.10 -0.82 -0.94 116.57 123.61 3hk9 h LYS 182 Ca -0.02 0.00 -0.12 0.00 -2.00 0.00 0.00 60.65 58.51 3hk9 h LYS 182 Cb 1.47 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 32.78 3hk9 h LYS 182 CO 0.12 0.00 -0.55 0.45 -2.00 0.00 0.00 179.45 177.47 3hk9 h HIS 183 N 0.00 0.00 0.00 0.07 3.86 -1.78 -2.57 115.15 114.73 3hk9 h HIS 183 Ca 0.05 0.00 -0.20 0.00 -1.16 0.00 0.00 60.37 59.06 3hk9 h HIS 183 Cb 0.20 0.00 -0.03 0.00 1.06 0.00 0.00 27.41 28.64 3hk9 h HIS 183 CO 0.00 0.55 -0.97 0.00 0.86 0.00 0.00 177.93 178.37 3hk9 h ARG 184 N 0.00 0.00 -0.12 2.45 3.08 -1.34 -2.85 114.38 115.60 3hk9 h ARG 184 Ca -0.01 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.03 3hk9 h ARG 184 Cb 1.00 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.05 3hk9 h ARG 184 CO 0.07 0.91 0.03 -0.07 -1.07 0.00 0.00 179.97 179.85 3hk9 h LEU 185 N 0.00 0.17 -1.81 3.04 3.38 -1.19 -2.13 115.31 116.76 3hk9 h LEU 185 Ca -0.02 -0.21 -0.03 0.00 0.09 0.00 0.00 57.88 57.71 3hk9 h LEU 185 Cb 1.73 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 42.43 3hk9 h LEU 185 CO 0.12 0.34 -0.12 0.08 0.09 0.00 0.00 178.44 178.95 3hk9 h ARG 186 N -0.00 0.00 0.00 1.13 0.11 -1.20 0.12 114.38 114.54 3hk9 h ARG 186 Ca 0.04 0.00 -0.03 0.00 0.10 0.00 0.00 59.98 60.09 3hk9 h ARG 186 Cb 0.23 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 31.30 3hk9 h ARG 186 CO -0.00 0.12 -0.15 -0.44 0.10 0.00 0.00 179.97 179.60 3hk9 h ASP 187 N 0.00 0.00 -0.70 0.08 3.32 -1.16 -2.45 116.42 115.52 3hk9 h ASP 187 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3hk9 h ASP 187 Cb 0.23 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.78 3hk9 h ASP 187 CO 0.02 0.15 0.00 0.79 -1.72 0.00 0.00 179.24 178.48 3hk9 n TRP 188 N -3.44 1.34 -0.28 4.55 8.01 0.27 -4.93 117.44 122.96 3hk9 n TRP 188 Ca -0.01 -0.57 0.00 0.00 -1.31 0.00 0.00 57.50 55.61 3hk9 n TRP 188 Cb 0.33 -0.16 0.00 0.00 -2.01 0.00 0.00 31.31 29.47 3hk9 n TRP 188 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 3hk9 n GLY 189 N 1.36 0.68 3.44 6.99 0.00 -0.92 -5.03 105.19 111.71 3hk9 n GLY 189 Ca 0.26 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.84 3hk9 n GLY 189 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3hk9 s TYR 190 N -2.45 3.03 -1.04 1.61 2.02 -0.36 -4.96 117.35 115.21 3hk9 s TYR 190 Ca 0.00 -0.57 -0.13 0.00 -0.37 0.00 0.00 57.07 55.99 3hk9 s TYR 190 Cb 0.00 -3.63 -0.08 0.00 -0.40 0.00 0.00 41.96 37.85 3hk9 s TYR 190 CO 0.00 -1.09 2.17 1.63 -1.57 0.00 0.00 175.55 176.69 3hk9 n LYS 191 N 6.26 2.19 -2.64 -0.62 4.76 -1.26 -2.60 118.16 124.25 3hk9 n LYS 191 Ca -0.07 -1.87 -0.41 0.00 -2.87 0.00 0.00 58.31 53.09 3hk9 n LYS 191 Cb 0.45 -2.79 -0.04 0.00 -1.84 0.00 0.00 35.03 30.81 3hk9 n LYS 191 CO 0.00 0.00 0.00 0.14 -1.37 0.00 0.00 177.40 176.17 3hk9 s VAL 192 N 3.80 4.41 0.90 -0.18 -7.23 -1.26 -4.50 120.40 116.33 3hk9 s VAL 192 Ca 0.51 1.89 -0.10 0.00 -1.81 0.00 0.00 61.98 62.47 3hk9 s VAL 192 Cb 0.13 -4.21 0.20 0.00 0.56 0.00 0.00 36.38 33.06 3hk9 s VAL 192 CO 0.01 0.24 1.22 0.20 -0.31 0.00 0.00 175.10 176.46 3hk9 s ASN 193 N 0.41 3.35 0.13 4.85 0.01 -1.26 -4.95 114.94 117.49 3hk9 s ASN 193 Ca 0.51 -0.14 -0.10 0.00 -0.71 0.00 0.00 52.86 52.42 3hk9 s ASN 193 Cb -0.25 0.07 -0.09 0.00 0.41 0.00 0.00 41.25 41.39 3hk9 s ASN 193 CO 0.30 -2.55 1.36 0.44 -1.51 0.00 0.00 177.10 175.15 3hk9 h ASP 194 N -1.30 0.86 -3.02 -1.22 5.19 -2.03 -3.44 116.42 111.46 3hk9 h ASP 194 Ca -0.40 -0.54 -0.58 0.00 -0.62 0.00 0.00 57.03 54.90 3hk9 h ASP 194 Cb 1.23 -0.25 -0.03 0.00 0.18 0.00 0.00 39.33 40.46 3hk9 h ASP 194 CO 0.33 1.32 -0.36 -1.83 -3.12 0.00 0.00 179.24 175.59 3hk9 s GLU 195 N -3.83 3.55 -1.03 3.56 -1.05 -1.26 -5.01 118.70 113.63 3hk9 s GLU 195 Ca -0.09 -0.23 -0.21 0.00 -0.15 0.00 0.00 54.97 54.28 3hk9 s GLU 195 Cb 0.09 -2.89 0.07 0.00 -0.44 0.00 0.00 34.13 30.97 3hk9 s GLU 195 CO 0.89 0.48 1.41 -0.46 0.95 0.00 0.00 175.26 178.53 3hk9 s TRP 196 N -1.68 2.72 0.24 4.83 -0.11 -1.26 -4.67 118.94 119.01 3hk9 s TRP 196 Ca 0.39 -1.09 0.00 0.00 1.22 0.00 0.00 56.10 56.63 3hk9 s TRP 196 Cb -0.12 -4.60 0.00 0.00 -1.50 0.00 0.00 33.47 27.26 3hk9 s TRP 196 CO 0.27 -1.81 0.04 0.27 -4.62 0.00 0.00 176.95 171.09 3hk9 n ASN 197 N 8.20 2.50 -0.32 5.86 6.94 -1.26 -4.96 115.26 132.22 3hk9 n ASN 197 Ca 0.33 -2.01 0.08 0.00 -0.02 0.00 0.00 54.58 52.96 3hk9 n ASN 197 Cb 0.50 0.13 0.29 0.00 -2.36 0.00 0.00 39.78 38.33 3hk9 n ASN 197 CO 0.00 0.00 0.00 -0.08 -1.03 0.00 0.00 177.26 176.15 3hk9 h GLU 198 N 0.00 0.88 0.13 -3.83 4.57 -1.99 -0.62 114.58 113.72 3hk9 h GLU 198 Ca -0.19 -0.05 -0.01 0.00 -1.18 0.00 0.00 59.36 57.93 3hk9 h GLU 198 Cb 0.60 -0.20 0.00 0.00 -0.16 0.00 0.00 28.75 28.99 3hk9 h GLU 198 CO 0.31 0.58 -0.06 0.78 -1.18 0.00 0.00 179.01 179.44 3hk9 h GLY 199 N 0.90 -0.18 0.92 1.92 0.00 -1.94 -1.34 103.07 103.35 3hk9 h GLY 199 Ca 0.46 0.07 0.02 0.00 0.00 0.00 0.00 47.33 47.87 3hk9 h GLY 199 CO -0.22 -0.07 0.35 1.76 0.00 0.00 0.00 176.54 178.36 3hk9 h SER 200 N -0.36 0.58 -0.28 0.19 0.02 -1.66 -1.61 113.55 110.43 3hk9 h SER 200 Ca -0.02 -0.00 0.03 0.00 -0.84 0.00 0.00 61.79 60.96 3hk9 h SER 200 Cb 0.29 -0.13 -0.03 0.00 0.14 0.00 0.00 62.40 62.67 3hk9 h SER 200 CO 0.03 0.41 0.10 0.40 -1.14 0.00 0.00 176.83 176.63 3hk9 h ILE 201 N 0.70 0.93 -0.69 3.27 2.04 -1.06 -1.26 117.51 121.44 3hk9 h ILE 201 Ca 0.22 -0.08 -0.03 0.00 1.00 0.00 0.00 64.86 65.97 3hk9 h ILE 201 Cb -0.02 0.68 -0.03 0.00 -0.74 0.00 0.00 36.82 36.72 3hk9 h ILE 201 CO -0.08 0.04 0.30 1.56 0.00 0.00 0.00 178.15 179.97 3hk9 h GLN 202 N 0.23 1.02 -0.25 2.37 1.08 -0.91 -1.75 115.11 116.90 3hk9 h GLN 202 Ca 0.12 -0.17 -0.12 0.00 -1.45 0.00 0.00 58.65 57.04 3hk9 h GLN 202 Cb 0.09 -0.17 -0.01 0.00 -0.05 0.00 0.00 27.48 27.33 3hk9 h GLN 202 CO -0.12 0.83 -0.34 0.93 -0.95 0.00 0.00 178.83 179.18 3hk9 h GLU 203 N 0.98 0.52 -0.41 1.46 4.39 -1.03 -0.37 114.58 120.11 3hk9 h GLU 203 Ca 0.23 -0.24 -0.12 0.00 0.34 0.00 0.00 59.36 59.58 3hk9 h GLU 203 Cb 0.17 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.79 3hk9 h GLU 203 CO -0.02 0.79 -0.21 0.28 -1.16 0.00 0.00 179.01 178.69 3hk9 h VAL 204 N 0.45 1.27 -0.57 3.13 2.07 -1.03 -0.96 116.25 120.61 3hk9 h VAL 204 Ca 0.05 -1.33 -0.04 0.00 0.82 0.00 0.00 66.70 66.20 3hk9 h VAL 204 Cb 0.80 1.18 -0.02 0.00 -1.52 0.00 0.00 31.29 31.72 3hk9 h VAL 204 CO 0.07 0.45 0.21 0.11 0.02 0.00 0.00 177.57 178.42 3hk9 h LYS 205 N 0.71 0.87 -0.67 1.57 1.57 -0.99 -2.11 116.57 117.52 3hk9 h LYS 205 Ca 0.10 -0.17 0.03 0.00 -1.87 0.00 0.00 60.65 58.73 3hk9 h LYS 205 Cb 0.73 -0.13 -0.04 0.00 0.08 0.00 0.00 32.23 32.86 3hk9 h LYS 205 CO 0.06 0.77 0.42 -0.09 -0.57 0.00 0.00 179.45 180.03 3hk9 h ARG 206 N 0.80 0.80 -0.20 3.15 2.43 -0.68 0.14 114.38 120.82 3hk9 h ARG 206 Ca 0.19 -0.05 0.03 0.00 -0.81 0.00 0.00 59.98 59.34 3hk9 h ARG 206 Cb 0.24 -0.18 -0.03 0.00 -0.42 0.00 0.00 29.97 29.58 3hk9 h ARG 206 CO -0.01 0.53 0.00 0.35 -1.51 0.00 0.00 179.97 179.33 3hk9 h PHE 207 N 0.82 -0.00 -0.37 2.20 3.57 -0.82 0.25 116.94 122.60 3hk9 h PHE 207 Ca 0.27 0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.77 3hk9 h PHE 207 Cb 0.01 0.03 -0.02 0.00 2.79 0.00 0.00 35.95 38.76 3hk9 h PHE 207 CO -0.04 -0.02 0.18 -0.07 -2.23 0.00 0.00 178.31 176.12 3hk9 h LEU 208 N 0.07 0.48 -0.30 0.59 3.38 -0.87 -2.24 115.31 116.41 3hk9 h LEU 208 Ca 0.09 -0.12 -0.02 0.00 0.09 0.00 0.00 57.88 57.92 3hk9 h LEU 208 Cb 0.11 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.73 3hk9 h LEU 208 CO -0.15 0.47 0.13 0.74 0.09 0.00 0.00 178.44 179.71 3hk9 h THR 209 N 0.46 1.17 -0.66 0.22 2.02 -0.37 -0.08 112.91 115.67 3hk9 h THR 209 Ca 0.13 -0.51 0.06 0.00 0.77 0.00 0.00 66.41 66.85 3hk9 h THR 209 Cb 0.11 0.95 -0.05 0.00 -1.74 0.00 0.00 68.15 67.41 3hk9 h THR 209 CO -0.02 0.18 0.36 0.44 0.37 0.00 0.00 175.52 176.86 3hk9 h ASP 210 N 0.35 0.54 0.62 4.18 3.32 -0.39 -0.80 116.42 124.24 3hk9 h ASP 210 Ca 0.10 0.03 -0.13 0.00 0.02 0.00 0.00 57.03 57.05 3hk9 h ASP 210 Cb 0.16 -0.08 -0.02 0.00 0.22 0.00 0.00 39.33 39.62 3hk9 h ASP 210 CO -0.01 0.35 -0.63 -0.50 -1.72 0.00 0.00 179.24 176.73 3hk9 h TRP 211 N 0.68 0.01 -0.47 4.55 4.06 -1.21 -1.56 115.95 122.01 3hk9 h TRP 211 Ca 0.29 -0.01 -0.11 0.00 2.06 0.00 0.00 58.89 61.13 3hk9 h TRP 211 Cb 0.18 -0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 28.32 3hk9 h TRP 211 CO -0.08 0.64 -0.14 0.82 -3.56 0.00 0.00 178.44 176.12 3hk9 h ILE 212 N 0.01 1.27 -0.40 1.49 2.04 -0.38 -0.15 117.51 121.38 3hk9 h ILE 212 Ca -0.01 -1.26 -0.13 0.00 1.00 0.00 0.00 64.86 64.46 3hk9 h ILE 212 Cb 1.12 1.05 -0.01 0.00 -0.74 0.00 0.00 36.82 38.24 3hk9 h ILE 212 CO 0.08 0.44 -0.28 -0.33 0.00 0.00 0.00 178.15 178.06 3hk9 h GLU 213 N 0.79 0.86 0.01 2.37 5.08 -0.94 0.23 114.58 122.97 3hk9 h GLU 213 Ca 0.12 -0.39 -0.23 0.00 -1.00 0.00 0.00 59.36 57.86 3hk9 h GLU 213 Cb 0.67 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.91 3hk9 h GLU 213 CO 0.05 1.03 -0.97 -0.09 -1.00 0.00 0.00 179.01 178.03 3hk9 h ARG 214 N 0.73 0.42 0.00 2.33 2.43 -1.06 -3.36 114.38 115.87 3hk9 h ARG 214 Ca 0.09 -0.47 -0.28 0.00 -0.81 0.00 0.00 59.98 58.51 3hk9 h ARG 214 Cb 0.83 0.14 -0.05 0.00 -0.42 0.00 0.00 29.97 30.47 3hk9 h ARG 214 CO 0.07 1.13 -2.03 -1.33 -1.51 0.00 0.00 179.97 176.30 3hk9 n MET 215 N -3.74 0.66 -3.66 0.20 2.81 -0.09 -5.00 117.12 108.31 3hk9 n MET 215 Ca -0.07 0.08 -0.26 0.00 -1.81 0.00 0.00 57.70 55.63 3hk9 n MET 215 Cb 0.85 -1.63 0.04 0.00 -0.71 0.00 0.00 33.22 31.77 3hk9 n MET 215 CO 0.00 0.00 0.00 -3.47 1.51 0.00 0.00 175.97 174.01 3hk9 n ASP 216 N -2.78 -4.03 -4.78 7.83 2.03 0.79 -4.57 116.55 111.04 3hk9 n ASP 216 Ca -0.22 -0.93 -0.34 0.00 0.52 0.00 0.00 54.79 53.81 3hk9 n ASP 216 Cb 1.02 -3.75 0.00 0.00 -0.72 0.00 0.00 41.12 37.67 3hk9 n ASP 216 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 3hk9 s PRO 217 N -5.82 3.32 0.35 -0.67 0.04 -1.26 -4.55 135.00 126.41 3hk9 s PRO 217 Ca 0.32 1.50 0.26 0.00 0.04 0.00 0.00 61.00 63.11 3hk9 s PRO 217 Cb -0.10 -2.01 0.74 0.00 0.04 0.00 0.00 34.50 33.17 3hk9 s PRO 217 CO 0.84 -0.85 1.74 -0.39 0.04 0.00 0.00 177.00 178.37 3hk9 h VAL 218 N 0.98 0.00 -1.50 -0.36 -1.51 -0.88 -3.47 116.25 109.51 3hk9 h VAL 218 Ca -0.49 -0.64 0.26 0.00 -1.23 0.00 0.00 66.70 64.60 3hk9 h VAL 218 Cb 1.25 1.61 -0.18 0.00 -2.13 0.00 0.00 31.29 31.83 3hk9 h VAL 218 CO 0.57 0.00 0.80 -0.72 -1.23 0.00 0.00 177.57 176.99 3hk9 s TYR 219 N -3.25 -0.13 -0.12 5.19 -0.85 -1.26 -4.37 117.35 112.56 3hk9 s TYR 219 Ca 0.07 0.07 -0.07 0.00 -0.52 0.00 0.00 57.07 56.62 3hk9 s TYR 219 Cb 0.09 0.52 -0.04 0.00 0.38 0.00 0.00 41.96 42.91 3hk9 s TYR 219 CO 0.59 -0.23 0.12 -1.64 -1.52 0.00 0.00 175.55 172.87 3hk9 s MET 220 N -2.45 3.46 0.23 -3.49 -1.94 -1.00 -1.77 119.30 112.34 3hk9 s MET 220 Ca 0.10 -0.18 0.03 0.00 -1.71 0.00 0.00 55.69 53.92 3hk9 s MET 220 Cb -0.00 -3.16 -0.05 0.00 2.01 0.00 0.00 34.83 33.63 3hk9 s MET 220 CO -0.05 0.71 0.02 0.00 -0.01 0.00 0.00 175.02 175.69 3hk9 s ALA 221 N -0.84 1.73 -0.17 3.03 0.00 -0.28 -0.05 121.76 125.18 3hk9 s ALA 221 Ca 0.14 -1.76 -0.29 0.00 0.00 0.00 0.00 51.96 50.05 3hk9 s ALA 221 Cb -0.12 0.61 0.10 0.00 0.00 0.00 0.00 23.12 23.72 3hk9 s ALA 221 CO 0.03 -0.31 0.87 0.54 0.00 0.00 0.00 175.76 176.90 3hk9 s VAL 222 N -3.52 0.00 -0.09 0.00 0.11 -0.85 -0.55 120.40 115.49 3hk9 s VAL 222 Ca 0.30 0.00 -0.03 0.00 -2.93 0.00 0.00 61.98 59.31 3hk9 s VAL 222 Cb 0.06 -1.00 -0.04 0.00 -1.53 0.00 0.00 36.38 33.88 3hk9 s VAL 222 CO 0.09 0.00 0.05 -0.94 -3.33 0.00 0.00 175.10 170.97 3hk9 s SER 223 N -0.63 5.62 0.13 3.54 1.04 -1.26 -1.55 113.70 120.58 3hk9 s SER 223 Ca -0.03 0.24 0.06 0.00 0.48 0.00 0.00 55.95 56.70 3hk9 s SER 223 Cb -0.02 -1.66 -0.04 0.00 0.10 0.00 0.00 66.02 64.40 3hk9 s SER 223 CO 0.02 0.37 -0.14 -0.76 0.98 0.00 0.00 173.24 173.72 3hk9 s LEU 224 N -1.03 2.42 0.75 2.42 1.43 0.39 -4.92 118.68 120.14 3hk9 s LEU 224 Ca 0.15 -0.84 -0.12 0.00 -1.03 0.00 0.00 54.13 52.29 3hk9 s LEU 224 Cb -0.12 -0.56 0.04 0.00 0.03 0.00 0.00 46.19 45.59 3hk9 s LEU 224 CO 0.04 -0.15 1.11 -2.16 0.23 0.00 0.00 176.35 175.42 3hk9 s PRO 225 N -2.81 2.50 0.58 1.29 0.04 -1.25 -0.66 135.00 134.68 3hk9 s PRO 225 Ca 0.11 0.42 0.27 0.00 0.04 0.00 0.00 61.00 61.84 3hk9 s PRO 225 Cb -0.04 -1.98 1.62 0.00 0.04 0.00 0.00 34.50 34.13 3hk9 s PRO 225 CO 0.03 -1.28 2.11 -1.35 0.04 0.00 0.00 177.00 176.55 3hk9 h PRO 226 N -0.83 0.00 -0.22 0.56 0.11 -1.78 -1.28 132.00 128.55 3hk9 h PRO 226 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 3hk9 h PRO 226 Cb 1.27 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.38 3hk9 h PRO 226 CO 0.63 0.00 0.00 0.25 -0.21 0.00 0.00 178.00 178.67 3hk9 n THR 227 N -3.92 0.30 -1.68 -1.15 -2.24 -1.26 -3.89 114.28 100.43 3hk9 n THR 227 Ca 0.01 -0.33 -0.45 0.00 -2.27 0.00 0.00 64.05 61.02 3hk9 n THR 227 Cb 0.30 0.19 -0.03 0.00 -2.10 0.00 0.00 70.33 68.70 3hk9 n THR 227 CO 0.00 0.00 0.00 0.33 -0.57 0.00 0.00 175.07 174.83 3hk9 n PHE 228 N 0.22 2.31 -4.03 4.78 7.35 -0.48 -4.99 117.46 122.62 3hk9 n PHE 228 Ca 0.11 0.34 -0.08 0.00 -0.76 0.00 0.00 57.45 57.07 3hk9 n PHE 228 Cb 0.24 -2.51 -0.10 0.00 0.35 0.00 0.00 39.48 37.46 3hk9 n PHE 228 CO 0.00 0.00 0.00 -1.12 -0.76 0.00 0.00 176.76 174.88 3hk9 s SER 229 N 0.55 0.37 -0.29 -2.13 0.01 -1.26 -4.68 113.70 106.27 3hk9 s SER 229 Ca 0.71 -0.79 -0.20 0.00 1.31 0.00 0.00 55.95 56.99 3hk9 s SER 229 Cb -0.63 0.18 0.13 0.00 0.21 0.00 0.00 66.02 65.91 3hk9 s SER 229 CO 0.45 -0.51 0.99 0.12 0.41 0.00 0.00 173.24 174.70 3hk9 s PHE 230 N -3.06 -0.55 0.95 2.43 2.19 -1.26 -4.49 117.98 114.20 3hk9 s PHE 230 Ca -0.01 1.18 -0.11 0.00 0.33 0.00 0.00 56.93 58.31 3hk9 s PHE 230 Cb 0.02 0.37 0.17 0.00 -1.31 0.00 0.00 43.02 42.26 3hk9 s PHE 230 CO -0.07 -0.27 1.10 -1.25 1.83 0.00 0.00 175.22 176.56 3hk9 s PRO 231 N 0.89 0.74 -0.28 10.12 0.04 -1.26 -4.15 135.00 141.11 3hk9 s PRO 231 Ca -0.04 1.12 -0.17 0.00 0.04 0.00 0.00 61.00 61.95 3hk9 s PRO 231 Cb -0.04 -1.73 0.08 0.00 0.04 0.00 0.00 34.50 32.85 3hk9 s PRO 231 CO -0.12 -2.68 0.69 -2.00 0.04 0.00 0.00 177.00 172.94 3hk9 s GLU 232 N -4.71 0.73 -1.32 4.56 2.12 -1.26 -5.07 118.70 113.74 3hk9 s GLU 232 Ca 0.66 1.19 -0.14 0.00 0.36 0.00 0.00 54.97 57.03 3hk9 s GLU 232 Cb -0.21 0.18 0.10 0.00 0.26 0.00 0.00 34.13 34.46 3hk9 s GLU 232 CO 0.59 -0.14 1.84 0.39 -0.54 0.00 0.00 175.26 177.40 3hk9 n GLU 233 N 4.06 3.22 -4.16 4.30 -0.58 -1.26 -3.88 120.64 122.33 3hk9 n GLU 233 Ca -0.19 -3.25 -0.13 0.00 -0.42 0.00 0.00 57.16 53.17 3hk9 n GLU 233 Cb 0.58 -3.23 -0.08 0.00 -0.57 0.00 0.00 31.44 28.14 3hk9 n GLU 233 CO 0.00 0.00 0.00 -1.54 -0.48 0.00 0.00 177.13 175.11 3hk9 s SER 234 N 2.99 0.44 0.20 1.62 1.04 -1.26 -5.01 113.70 113.72 3hk9 s SER 234 Ca 0.47 -1.37 -0.10 0.00 0.48 0.00 0.00 55.95 55.44 3hk9 s SER 234 Cb 0.07 0.49 0.14 0.00 0.10 0.00 0.00 66.02 66.81 3hk9 s SER 234 CO 0.00 -1.00 1.81 0.78 0.98 0.00 0.00 173.24 175.81 3hk9 h ASN 235 N 2.40 0.94 -0.26 7.02 2.35 -1.91 -1.47 115.58 124.65 3hk9 h ASN 235 Ca -0.31 -0.12 -0.00 0.00 -0.55 0.00 0.00 56.30 55.32 3hk9 h ASN 235 Cb 1.25 -0.24 -0.01 0.00 0.05 0.00 0.00 38.32 39.36 3hk9 h ASN 235 CO 0.45 0.79 0.15 -0.09 -1.65 0.00 0.00 177.43 177.07 3hk9 h ARG 236 N 1.02 0.36 -0.40 0.81 2.43 -1.90 0.37 114.38 117.08 3hk9 h ARG 236 Ca 0.26 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.39 3hk9 h ARG 236 Cb 0.08 -0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 29.54 3hk9 h ARG 236 CO -0.04 0.32 0.25 0.78 -1.51 0.00 0.00 179.97 179.77 3hk9 h GLY 237 N 0.31 0.57 0.87 2.80 0.00 -1.62 -0.84 103.07 105.16 3hk9 h GLY 237 Ca 0.09 -0.22 -0.05 0.00 0.00 0.00 0.00 47.33 47.15 3hk9 h GLY 237 CO -0.02 0.22 -0.03 3.21 0.00 0.00 0.00 176.54 179.92 3hk9 h ARG 238 N 0.53 0.51 -0.45 4.80 3.08 -1.15 -1.87 114.38 119.83 3hk9 h ARG 238 Ca 0.14 -0.18 0.00 0.00 0.07 0.00 0.00 59.98 60.02 3hk9 h ARG 238 Cb -0.03 -0.04 -0.02 0.00 0.08 0.00 0.00 29.97 29.96 3hk9 h ARG 238 CO -0.03 0.69 0.29 0.82 -1.07 0.00 0.00 179.97 180.68 3hk9 h ILE 239 N 0.28 1.12 -0.66 2.04 2.04 -0.81 0.52 117.51 122.03 3hk9 h ILE 239 Ca 0.07 -0.23 -0.03 0.00 1.00 0.00 0.00 64.86 65.67 3hk9 h ILE 239 Cb 0.48 0.47 -0.03 0.00 -0.74 0.00 0.00 36.82 37.00 3hk9 h ILE 239 CO 0.02 0.12 0.29 0.40 0.00 0.00 0.00 178.15 178.98 3hk9 h ILE 240 N 0.61 1.23 -0.03 -0.67 2.04 -1.12 0.10 117.51 119.68 3hk9 h ILE 240 Ca 0.17 -0.70 -0.09 0.00 1.00 0.00 0.00 64.86 65.24 3hk9 h ILE 240 Cb -0.06 0.46 0.01 0.00 -0.74 0.00 0.00 36.82 36.49 3hk9 h ILE 240 CO -0.03 0.28 -0.33 -0.09 0.00 0.00 0.00 178.15 177.97 3hk9 h ARG 241 N 0.93 0.28 0.00 2.37 2.43 -0.94 -1.61 114.38 117.84 3hk9 h ARG 241 Ca 0.22 -0.26 -0.18 0.00 -0.81 0.00 0.00 59.98 58.95 3hk9 h ARG 241 Cb 0.17 0.06 -0.03 0.00 -0.42 0.00 0.00 29.97 29.75 3hk9 h ARG 241 CO -0.02 0.94 -1.27 -0.44 -1.51 0.00 0.00 179.97 177.67 3hk9 h ASP 242 N -0.28 0.00 0.00 -3.80 3.32 0.00 -3.41 116.42 112.25 3hk9 h ASP 242 Ca -0.03 0.00 -0.04 0.00 0.02 0.00 0.00 57.03 56.98 3hk9 h ASP 242 Cb 1.03 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.57 3hk9 h ASP 242 CO 0.07 0.66 -0.72 0.00 -1.72 0.00 0.00 179.24 177.52 3hk9 h LEU 244 N -0.16 -0.98 0.09 0.00 7.12 -1.23 -2.56 115.31 117.59 3hk9 h LEU 244 Ca -0.06 0.04 -0.00 0.00 0.13 0.00 0.00 57.88 57.99 3hk9 h LEU 244 Cb 0.65 0.26 0.00 0.00 -0.53 0.00 0.00 40.66 41.04 3hk9 h LEU 244 CO -0.04 -0.67 -0.05 -0.07 -0.13 0.00 0.00 178.44 177.49 3hk9 h LEU 245 N -1.09 -0.11 -0.71 2.25 3.38 -1.54 0.15 115.31 117.64 3hk9 h LEU 245 Ca -0.10 -0.01 0.07 0.00 0.09 0.00 0.00 57.88 57.92 3hk9 h LEU 245 Cb 0.85 0.03 -0.06 0.00 0.09 0.00 0.00 40.66 41.56 3hk9 h LEU 245 CO 0.16 -0.06 0.39 -0.65 0.09 0.00 0.00 178.44 178.37 3hk9 h PRO 246 N -0.14 0.69 -0.29 1.13 0.11 -1.79 0.83 132.00 132.53 3hk9 h PRO 246 Ca -0.01 -0.04 -0.05 0.00 0.11 0.00 0.00 66.00 66.00 3hk9 h PRO 246 Cb 0.11 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 31.05 3hk9 h PRO 246 CO 0.02 0.46 -0.02 0.28 -0.21 0.00 0.00 178.00 178.53 3hk9 h VAL 247 N 0.71 1.27 -0.80 3.15 2.07 -1.28 -1.78 116.25 119.58 3hk9 h VAL 247 Ca 0.32 -0.99 0.01 0.00 0.82 0.00 0.00 66.70 66.87 3hk9 h VAL 247 Cb 0.23 1.32 -0.04 0.00 -1.52 0.00 0.00 31.29 31.28 3hk9 h VAL 247 CO -0.20 0.32 0.53 0.00 0.02 0.00 0.00 177.57 178.24 3hk9 h ALA 248 N 0.82 1.02 -0.47 1.67 0.00 -0.18 -1.78 119.26 120.33 3hk9 h ALA 248 Ca 0.08 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 3hk9 h ALA 248 Cb 0.47 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 3hk9 h ALA 248 CO 0.02 0.42 0.17 1.49 0.00 0.00 0.00 179.25 181.35 3hk9 h GLU 249 N 1.08 0.72 -0.39 0.00 4.81 -0.74 0.32 114.58 120.38 3hk9 h GLU 249 Ca 0.30 -0.14 0.01 0.00 -0.13 0.00 0.00 59.36 59.40 3hk9 h GLU 249 Cb -0.11 -0.11 -0.02 0.00 0.63 0.00 0.00 28.75 29.13 3hk9 h GLU 249 CO -0.07 0.66 0.24 -0.22 -0.73 0.00 0.00 179.01 178.90 3hk9 h LYS 250 N 0.62 0.48 -0.35 1.92 3.64 -0.91 -2.08 116.57 119.90 3hk9 h LYS 250 Ca 0.16 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.51 3hk9 h LYS 250 Cb 0.23 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 31.94 3hk9 h LYS 250 CO -0.01 0.32 0.00 0.72 -2.27 0.00 0.00 179.45 178.21 3hk9 n HIS 251 N -4.84 0.46 -4.12 1.91 8.25 -0.71 -4.92 115.22 111.24 3hk9 n HIS 251 Ca 0.01 -0.23 -0.32 0.00 -0.26 0.00 0.00 57.72 56.92 3hk9 n HIS 251 Cb 0.04 0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.13 3hk9 n HIS 251 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 3hk9 n ASN 252 N 0.68 -2.20 -4.54 0.41 4.05 0.60 -4.94 115.26 109.31 3hk9 n ASN 252 Ca 0.15 -1.01 -0.35 0.00 0.45 0.00 0.00 54.58 53.82 3hk9 n ASN 252 Cb 0.37 -2.88 -0.11 0.00 1.23 0.00 0.00 39.78 38.38 3hk9 n ASN 252 CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 177.26 173.58 3hk9 s ILE 253 N -3.56 4.56 0.70 -1.44 1.01 0.79 -4.87 121.20 118.39 3hk9 s ILE 253 Ca 0.45 -0.10 -0.15 0.00 0.00 0.00 0.00 60.65 60.85 3hk9 s ILE 253 Cb -0.25 -3.09 0.02 0.00 0.01 0.00 0.00 42.46 39.16 3hk9 s ILE 253 CO 0.91 0.40 1.16 -2.16 0.00 0.00 0.00 174.94 175.25 3hk9 s PRO 254 N 0.97 2.40 -0.28 2.79 0.04 -1.26 -4.60 135.00 135.07 3hk9 s PRO 254 Ca 0.04 1.59 -0.07 0.00 0.04 0.00 0.00 61.00 62.60 3hk9 s PRO 254 Cb -0.14 -1.88 -0.00 0.00 0.04 0.00 0.00 34.50 32.52 3hk9 s PRO 254 CO 0.03 -1.60 0.07 0.12 0.04 0.00 0.00 177.00 175.66 3hk9 s PHE 255 N -2.16 3.11 -0.20 0.56 5.36 0.08 -2.36 117.98 122.37 3hk9 s PHE 255 Ca 0.71 -0.82 -0.16 0.00 -0.96 0.00 0.00 56.93 55.69 3hk9 s PHE 255 Cb -0.25 -2.24 -0.04 0.00 -0.34 0.00 0.00 43.02 40.15 3hk9 s PHE 255 CO 0.44 -0.52 0.42 0.00 -1.46 0.00 0.00 175.22 174.10 3hk9 s ALA 256 N 1.53 3.55 -0.17 11.12 0.00 0.93 -1.12 121.76 137.61 3hk9 s ALA 256 Ca 0.04 -0.49 0.01 0.00 0.00 0.00 0.00 51.96 51.52 3hk9 s ALA 256 Cb -0.16 -2.65 0.02 0.00 0.00 0.00 0.00 23.12 20.32 3hk9 s ALA 256 CO 0.02 -0.29 -0.18 -1.64 0.00 0.00 0.00 175.76 173.66 3hk9 s MET 257 N 1.30 2.77 -0.41 0.00 -1.94 0.78 -2.02 119.30 119.78 3hk9 s MET 257 Ca 0.20 -0.74 -0.06 0.00 -1.71 0.00 0.00 55.69 53.37 3hk9 s MET 257 Cb -0.15 -2.41 0.09 0.00 2.01 0.00 0.00 34.83 34.37 3hk9 s MET 257 CO 0.08 -0.21 0.23 -1.64 -0.01 0.00 0.00 175.02 173.48 3hk9 s MET 258 N 1.32 2.35 -0.12 2.03 -1.94 -0.60 -2.46 119.30 119.89 3hk9 s MET 258 Ca 0.04 -1.63 -0.06 0.00 -1.71 0.00 0.00 55.69 52.33 3hk9 s MET 258 Cb -0.13 -3.68 -0.04 0.00 2.01 0.00 0.00 34.83 32.99 3hk9 s MET 258 CO -0.12 -1.01 0.11 0.42 -0.01 0.00 0.00 175.02 174.41 3hk9 s ILE 259 N 1.30 5.24 0.00 2.53 1.01 -0.55 -0.46 121.20 130.27 3hk9 s ILE 259 Ca 0.05 0.11 0.00 0.00 0.00 0.00 0.00 60.65 60.80 3hk9 s ILE 259 Cb -0.23 -3.28 0.00 0.00 0.01 0.00 0.00 42.46 38.96 3hk9 s ILE 259 CO -0.01 0.60 0.00 0.61 0.00 0.00 0.00 174.94 176.14 3hk9 n GLY 260 N 2.21 1.00 3.72 6.18 0.00 0.17 0.48 105.19 118.94 3hk9 n GLY 260 Ca -0.19 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.42 3hk9 n GLY 260 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hk9 s VAL 261 N -2.00 4.98 -0.54 1.61 0.11 -0.91 -1.89 120.40 121.76 3hk9 s VAL 261 Ca 0.00 1.60 -0.08 0.00 -2.93 0.00 0.00 61.98 60.57 3hk9 s VAL 261 Cb 0.00 -4.11 0.14 0.00 -1.53 0.00 0.00 36.38 30.88 3hk9 s VAL 261 CO 0.00 0.24 0.41 -0.75 -3.33 0.00 0.00 175.10 171.67 3hk9 s LYS 262 N 0.77 2.61 0.40 1.54 2.20 0.53 -3.81 119.74 123.99 3hk9 s LYS 262 Ca 0.41 -2.01 -0.27 0.00 -0.36 0.00 0.00 55.97 53.74 3hk9 s LYS 262 Cb -0.19 -3.94 -0.10 0.00 -1.51 0.00 0.00 37.83 32.10 3hk9 s LYS 262 CO 0.21 -1.20 1.43 1.63 -0.36 0.00 0.00 175.35 177.07 3hk9 n LYS 263 N 4.49 2.42 -3.90 4.03 4.76 -1.26 -0.63 118.16 128.07 3hk9 n LYS 263 Ca -0.02 0.85 -0.32 0.00 -2.87 0.00 0.00 58.31 55.96 3hk9 n LYS 263 Cb 0.41 -2.60 0.01 0.00 -1.84 0.00 0.00 35.03 31.01 3hk9 n LYS 263 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 3hk9 n ARG 264 N 0.19 -0.55 0.04 1.97 3.00 -1.21 -4.84 116.66 115.28 3hk9 n ARG 264 Ca 0.03 -0.01 0.13 0.00 -0.01 0.00 0.00 57.85 58.00 3hk9 n ARG 264 Cb 0.40 -1.49 0.52 0.00 0.00 0.00 0.00 32.46 31.88 3hk9 n ARG 264 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.63 178.96 3hk9 n VAL 265 N -3.62 0.32 -3.37 1.55 0.24 0.19 -3.94 118.33 109.71 3hk9 n VAL 265 Ca -0.11 -0.07 -0.26 0.00 -2.04 0.00 0.00 64.34 61.86 3hk9 n VAL 265 Cb 0.42 -0.60 -0.10 0.00 -1.47 0.00 0.00 33.84 32.09 3hk9 n VAL 265 CO 0.00 0.00 0.00 1.57 -2.14 0.00 0.00 176.83 176.26 3hk9 n HIS 266 N -1.80 -0.96 -0.28 6.34 -0.00 -1.07 -5.03 115.22 112.42 3hk9 n HIS 266 Ca 0.06 -3.29 0.08 0.00 -0.00 0.00 0.00 57.72 54.57 3hk9 n HIS 266 Cb 0.35 0.25 0.20 0.00 -0.00 0.00 0.00 29.99 30.79 3hk9 n HIS 266 CO 0.00 0.00 0.00 -1.35 -0.00 0.00 0.00 176.34 174.99 3hk9 h PRO 267 N 5.51 0.09 -0.79 1.57 0.11 -1.83 -2.18 132.00 134.48 3hk9 h PRO 267 Ca 0.25 -0.01 0.19 0.00 0.11 0.00 0.00 66.00 66.54 3hk9 h PRO 267 Cb 0.91 -0.02 -0.05 0.00 0.11 0.00 0.00 31.00 31.95 3hk9 h PRO 267 CO 0.37 0.06 0.54 0.00 -0.21 0.00 0.00 178.00 178.76 3hk9 h ALA 268 N 1.79 2.34 0.00 -0.75 0.00 -1.95 -0.83 119.26 119.85 3hk9 h ALA 268 Ca 0.47 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.38 3hk9 h ALA 268 Cb 0.87 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.65 3hk9 h ALA 268 CO -0.74 -0.57 0.00 1.28 0.00 0.00 0.00 179.25 179.22 3hk9 n LEU 269 N -4.43 0.09 0.00 0.00 4.77 -0.82 -4.96 117.00 111.65 3hk9 n LEU 269 Ca 0.16 0.52 0.00 0.00 -0.03 0.00 0.00 56.01 56.65 3hk9 n LEU 269 Cb 0.67 -0.50 0.00 0.00 -2.33 0.00 0.00 43.42 41.27 3hk9 n LEU 269 CO 0.34 -0.17 0.00 0.61 -1.33 0.00 0.00 177.39 176.84 3hk9 n GLY 270 N 0.65 2.50 0.21 -0.72 0.00 -0.32 -2.37 105.19 105.13 3hk9 n GLY 270 Ca 0.05 -0.30 0.15 0.00 0.00 0.00 0.00 46.02 45.92 3hk9 n GLY 270 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3hk9 h ASP 271 N 0.00 0.00 -0.52 1.61 3.32 -1.94 -0.58 116.42 118.32 3hk9 h ASP 271 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3hk9 h ASP 271 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 3hk9 h ASP 271 CO 0.00 0.00 0.00 0.00 -1.72 0.00 0.00 179.24 177.52 3hk9 n ALA 272 N -1.87 2.42 -1.05 3.45 0.00 -1.00 -4.33 120.51 118.13 3hk9 n ALA 272 Ca -0.01 -0.94 -0.01 0.00 0.00 0.00 0.00 53.44 52.48 3hk9 n ALA 272 Cb 0.08 -0.96 0.30 0.00 0.00 0.00 0.00 19.45 18.88 3hk9 n ALA 272 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hk9 n GLY 273 N 1.36 3.75 3.87 0.00 0.00 -0.22 -4.84 105.19 109.11 3hk9 n GLY 273 Ca 0.18 -1.02 -0.36 0.00 0.00 0.00 0.00 46.02 44.82 3hk9 n GLY 273 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3hk9 s ASP 274 N -1.33 6.55 0.31 1.61 1.01 -1.26 -0.64 116.67 122.92 3hk9 s ASP 274 Ca 0.52 0.64 0.01 0.00 0.71 0.00 0.00 52.55 54.43 3hk9 s ASP 274 Cb 0.41 -2.13 0.01 0.00 1.01 0.00 0.00 42.92 42.23 3hk9 s ASP 274 CO 0.12 0.31 0.11 0.33 0.21 0.00 0.00 175.17 176.25 3hk9 n PHE 275 N 1.50 -0.11 -4.21 4.23 7.35 0.20 -4.92 117.46 121.49 3hk9 n PHE 275 Ca -0.14 -1.40 -0.15 0.00 -0.76 0.00 0.00 57.45 55.00 3hk9 n PHE 275 Cb 0.53 -0.23 -0.11 0.00 0.35 0.00 0.00 39.48 40.03 3hk9 n PHE 275 CO 0.00 0.00 0.00 0.54 -0.76 0.00 0.00 176.76 176.54 3hk9 s VAL 276 N -1.83 1.08 -0.12 -2.13 0.11 -1.26 -0.35 120.40 115.90 3hk9 s VAL 276 Ca 0.09 -1.82 -0.22 0.00 -2.93 0.00 0.00 61.98 57.10 3hk9 s VAL 276 Cb -0.01 -1.58 0.05 0.00 -1.53 0.00 0.00 36.38 33.31 3hk9 s VAL 276 CO 0.05 -0.62 0.54 -0.83 -3.33 0.00 0.00 175.10 170.92 3hk9 s GLY 277 N -2.74 -0.41 0.18 6.54 0.00 -0.79 -4.86 107.32 105.24 3hk9 s GLY 277 Ca 0.10 1.24 -0.30 0.00 0.00 0.00 0.00 44.72 45.76 3hk9 s GLY 277 CO 0.01 0.98 1.24 1.25 0.00 0.00 0.00 173.10 176.58 3hk9 s LYS 278 N -0.47 4.45 0.36 2.90 2.20 -1.26 -4.50 119.74 123.42 3hk9 s LYS 278 Ca -0.06 1.94 0.07 0.00 -0.36 0.00 0.00 55.97 57.56 3hk9 s LYS 278 Cb -0.03 -3.23 -0.02 0.00 -1.51 0.00 0.00 37.83 33.04 3hk9 s LYS 278 CO 0.04 -0.16 0.36 0.00 -0.36 0.00 0.00 175.35 175.23 3hk9 s ALA 279 N 0.07 4.00 0.27 3.13 0.00 -1.26 -4.80 121.76 123.17 3hk9 s ALA 279 Ca 0.55 -1.68 -0.17 0.00 0.00 0.00 0.00 51.96 50.66 3hk9 s ALA 279 Cb -0.34 -1.25 -0.09 0.00 0.00 0.00 0.00 23.12 21.45 3hk9 s ALA 279 CO 0.37 -0.07 0.72 0.45 0.00 0.00 0.00 175.76 177.23 3hk9 s SER 280 N -4.08 6.89 0.00 0.00 0.15 -1.25 -4.96 113.70 110.45 3hk9 s SER 280 Ca 0.44 1.32 0.26 0.00 0.70 0.00 0.00 55.95 58.67 3hk9 s SER 280 Cb -0.06 -2.38 0.75 0.00 -1.71 0.00 0.00 66.02 62.61 3hk9 s SER 280 CO 0.28 -0.09 1.56 0.23 1.20 0.00 0.00 173.24 176.42 3hk9 n MET 281 N 0.14 0.71 -0.22 5.44 2.81 -1.26 -4.38 117.12 120.35 3hk9 n MET 281 Ca 0.01 -0.41 0.03 0.00 -1.81 0.00 0.00 57.70 55.52 3hk9 n MET 281 Cb 0.52 -1.49 0.14 0.00 -0.71 0.00 0.00 33.22 31.68 3hk9 n MET 281 CO 0.00 0.00 0.00 -0.44 1.51 0.00 0.00 175.97 177.04 3hk9 h ASP 282 N 0.99 0.10 -0.48 7.83 5.19 -1.93 0.13 116.42 128.25 3hk9 h ASP 282 Ca 0.00 0.11 -0.13 0.00 -0.62 0.00 0.00 57.03 56.40 3hk9 h ASP 282 Cb 0.50 0.14 -0.01 0.00 0.18 0.00 0.00 39.33 40.13 3hk9 h ASP 282 CO 0.00 0.04 -0.19 1.23 -3.12 0.00 0.00 179.24 177.20 3hk9 h GLY 283 N 0.33 1.08 1.07 2.75 0.00 -1.76 -1.33 103.07 105.19 3hk9 h GLY 283 Ca 0.36 -0.93 -0.12 0.00 0.00 0.00 0.00 47.33 46.64 3hk9 h GLY 283 CO -0.42 0.85 -0.18 -2.08 0.00 0.00 0.00 176.54 174.72 3hk9 h VAL 284 N 0.86 1.27 -0.52 4.60 2.07 -1.73 -1.66 116.25 121.15 3hk9 h VAL 284 Ca 0.12 -1.33 0.01 0.00 0.82 0.00 0.00 66.70 66.33 3hk9 h VAL 284 Cb 0.76 1.16 -0.03 0.00 -1.52 0.00 0.00 31.29 31.66 3hk9 h VAL 284 CO 0.06 0.45 0.33 -0.08 0.02 0.00 0.00 177.57 178.36 3hk9 h GLU 285 N 0.77 0.65 -0.32 1.57 4.81 -0.84 -1.47 114.58 119.75 3hk9 h GLU 285 Ca 0.11 -0.04 -0.05 0.00 -0.13 0.00 0.00 59.36 59.25 3hk9 h GLU 285 Cb 0.74 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 29.97 3hk9 h GLU 285 CO 0.06 0.43 0.01 1.25 -0.73 0.00 0.00 179.01 180.03 3hk9 h HIS 286 N 0.67 0.60 -0.02 0.92 2.76 -1.14 -2.22 115.15 116.72 3hk9 h HIS 286 Ca 0.20 -0.10 0.03 0.00 -2.20 0.00 0.00 60.37 58.30 3hk9 h HIS 286 Cb -0.04 -0.16 -0.03 0.00 1.55 0.00 0.00 27.41 28.73 3hk9 h HIS 286 CO -0.05 0.66 -0.16 -0.07 -1.30 0.00 0.00 177.93 177.01 3hk9 h LEU 287 N 0.35 -0.47 -0.48 0.26 3.38 -1.04 0.24 115.31 117.55 3hk9 h LEU 287 Ca 0.09 0.07 0.01 0.00 0.09 0.00 0.00 57.88 58.15 3hk9 h LEU 287 Cb 0.42 0.20 -0.03 0.00 0.09 0.00 0.00 40.66 41.34 3hk9 h LEU 287 CO 0.01 -0.22 0.30 -0.07 0.09 0.00 0.00 178.44 178.56 3hk9 h LEU 288 N -0.25 0.51 -0.15 1.67 3.38 -1.25 -1.18 115.31 118.05 3hk9 h LEU 288 Ca 0.06 -0.01 -0.11 0.00 0.09 0.00 0.00 57.88 57.91 3hk9 h LEU 288 Cb 0.33 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.96 3hk9 h LEU 288 CO -0.17 0.37 -0.35 -0.09 0.09 0.00 0.00 178.44 178.28 3hk9 h ARG 289 N 0.62 0.50 0.00 1.13 2.43 -1.22 -3.30 114.38 114.53 3hk9 h ARG 289 Ca 0.18 -0.34 0.00 0.00 -0.81 0.00 0.00 59.98 59.01 3hk9 h ARG 289 Cb -0.04 0.05 0.00 0.00 -0.42 0.00 0.00 29.97 29.56 3hk9 h ARG 289 CO -0.06 0.95 0.00 0.39 -1.51 0.00 0.00 179.97 179.75 3hk9 n GLU 290 N -4.34 0.24 -3.18 0.20 -0.58 0.06 -4.16 120.64 108.89 3hk9 n GLU 290 Ca -0.07 0.20 -0.25 0.00 -0.42 0.00 0.00 57.16 56.63 3hk9 n GLU 290 Cb 0.51 -1.78 -0.06 0.00 -0.57 0.00 0.00 31.44 29.54 3hk9 n GLU 290 CO 0.00 0.00 0.00 0.66 -0.48 0.00 0.00 177.13 177.31 3hk9 n TYR 291 N -2.20 2.40 0.30 -0.32 4.01 -0.45 -4.92 117.16 115.99 3hk9 n TYR 291 Ca 0.06 -3.93 0.20 0.00 -0.16 0.00 0.00 57.90 54.06 3hk9 n TYR 291 Cb 0.42 -0.47 1.03 0.00 -0.31 0.00 0.00 39.34 40.00 3hk9 n TYR 291 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 3hk9 h PRO 292 N 3.52 0.00 -0.02 -0.72 0.13 -1.72 -1.33 132.00 131.86 3hk9 h PRO 292 Ca 0.13 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.26 3hk9 h PRO 292 Cb 0.71 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.84 3hk9 h PRO 292 CO 0.70 0.00 -0.06 0.09 -0.23 0.00 0.00 178.00 178.49 3hk9 n ASN 293 N -2.91 1.73 -4.75 1.44 5.03 -1.26 -4.87 115.26 109.66 3hk9 n ASN 293 Ca -0.02 -1.50 -0.31 0.00 0.87 0.00 0.00 54.58 53.63 3hk9 n ASN 293 Cb 0.10 0.04 -0.07 0.00 -1.02 0.00 0.00 39.78 38.83 3hk9 n ASN 293 CO 0.00 0.00 0.00 0.20 -1.83 0.00 0.00 177.26 175.63 3hk9 s ASN 294 N -2.10 5.42 -0.07 6.41 -0.87 -0.50 -4.80 114.94 118.43 3hk9 s ASN 294 Ca 0.33 -0.03 -0.00 0.00 -1.57 0.00 0.00 52.86 51.58 3hk9 s ASN 294 Cb 0.20 -1.43 -0.03 0.00 -0.02 0.00 0.00 41.25 39.97 3hk9 s ASN 294 CO 0.37 0.18 -0.04 -0.54 -2.57 0.00 0.00 177.10 174.50 3hk9 s LYS 295 N -2.31 2.84 -0.07 -0.60 1.02 -1.26 -4.85 119.74 114.50 3hk9 s LYS 295 Ca 0.28 -0.49 0.02 0.00 0.02 0.00 0.00 55.97 55.80 3hk9 s LYS 295 Cb -0.12 -2.68 0.01 0.00 -0.52 0.00 0.00 37.83 34.52 3hk9 s LYS 295 CO 0.20 0.68 -0.14 -0.06 -0.92 0.00 0.00 175.35 175.11 3hk9 s PHE 296 N -0.85 1.64 -0.23 3.18 0.08 0.07 -0.74 117.98 121.13 3hk9 s PHE 296 Ca 0.13 -0.64 -0.08 0.00 0.12 0.00 0.00 56.93 56.47 3hk9 s PHE 296 Cb -0.11 -1.19 -0.04 0.00 -0.57 0.00 0.00 43.02 41.12 3hk9 s PHE 296 CO 0.02 -0.32 0.08 -0.51 -0.10 0.00 0.00 175.22 174.40 3hk9 s LEU 297 N 0.67 3.65 0.01 -0.37 1.43 -0.27 -0.49 118.68 123.31 3hk9 s LEU 297 Ca -0.14 -0.07 0.03 0.00 -1.03 0.00 0.00 54.13 52.92 3hk9 s LEU 297 Cb -0.16 -1.96 -0.01 0.00 0.03 0.00 0.00 46.19 44.09 3hk9 s LEU 297 CO 0.04 0.05 -0.09 -0.69 0.23 0.00 0.00 176.35 175.88 3hk9 s VAL 298 N 1.14 0.74 -0.05 -1.59 1.01 -0.72 -0.15 120.40 120.76 3hk9 s VAL 298 Ca 0.05 -0.62 -0.07 0.00 0.00 0.00 0.00 61.98 61.34 3hk9 s VAL 298 Cb -0.14 -0.66 0.02 0.00 0.00 0.00 0.00 36.38 35.59 3hk9 s VAL 298 CO 0.04 0.05 0.19 0.28 0.00 0.00 0.00 175.10 175.65 3hk9 s THR 299 N -0.54 0.02 0.15 3.92 -1.32 -1.03 -1.31 115.64 115.54 3hk9 s THR 299 Ca 0.01 -0.17 0.09 0.00 -1.21 0.00 0.00 61.69 60.40 3hk9 s THR 299 Cb -0.05 -0.33 -0.04 0.00 -1.51 0.00 0.00 72.50 70.57 3hk9 s THR 299 CO 0.00 -0.10 -0.20 -0.04 -2.21 0.00 0.00 174.62 172.07 3hk9 s MET 300 N -0.29 1.27 0.05 7.08 -1.94 -1.26 -1.48 119.30 122.74 3hk9 s MET 300 Ca -0.04 -1.36 0.13 0.00 -1.71 0.00 0.00 55.69 52.71 3hk9 s MET 300 Cb -0.03 -1.45 -0.17 0.00 2.01 0.00 0.00 34.83 35.19 3hk9 s MET 300 CO 0.01 0.31 0.91 1.25 -0.01 0.00 0.00 175.02 177.49 3hk9 h LEU 301 N 3.50 0.00 -9.46 -0.03 5.85 -0.28 -3.42 115.31 111.47 3hk9 h LEU 301 Ca -0.44 0.00 -0.54 0.00 0.84 0.00 0.00 57.88 57.73 3hk9 h LEU 301 Cb 1.20 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 42.19 3hk9 h LEU 301 CO 0.47 0.84 0.23 -0.55 -0.34 0.00 0.00 178.44 179.09 3hk9 s SER 302 N -6.17 7.24 0.43 1.25 0.15 -1.26 -4.58 113.70 110.76 3hk9 s SER 302 Ca -0.02 1.49 0.13 0.00 0.70 0.00 0.00 55.95 58.25 3hk9 s SER 302 Cb 0.09 -2.50 1.01 0.00 -1.71 0.00 0.00 66.02 62.91 3hk9 s SER 302 CO 0.81 -0.11 2.00 -0.09 1.20 0.00 0.00 173.24 177.05 3hk9 h ARG 303 N 6.28 0.40 0.00 5.44 2.43 -1.96 -1.84 114.38 125.13 3hk9 h ARG 303 Ca -0.42 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 58.72 3hk9 h ARG 303 Cb 1.21 -0.09 0.00 0.00 -0.42 0.00 0.00 29.97 30.67 3hk9 h ARG 303 CO 0.73 0.27 0.00 0.39 -1.51 0.00 0.00 179.97 179.85 3hk9 n GLU 304 N -4.47 0.11 0.03 0.20 4.71 -1.26 -3.02 120.64 116.94 3hk9 n GLU 304 Ca 0.08 0.12 0.11 0.00 -0.01 0.00 0.00 57.16 57.46 3hk9 n GLU 304 Cb 0.32 -1.50 -0.11 0.00 -1.01 0.00 0.00 31.44 29.14 3hk9 n GLU 304 CO 0.00 0.00 0.00 0.09 0.09 0.00 0.00 177.13 177.31 3hk9 n ASN 305 N -1.42 0.33 -0.10 1.62 5.03 -0.69 -4.64 115.26 115.37 3hk9 n ASN 305 Ca 0.07 0.13 -0.05 0.00 0.87 0.00 0.00 54.58 55.59 3hk9 n ASN 305 Cb 0.22 1.38 0.01 0.00 -1.02 0.00 0.00 39.78 40.38 3hk9 n ASN 305 CO 0.00 0.00 0.00 1.56 -1.83 0.00 0.00 177.26 176.99 3hk9 h GLN 306 N 0.00 0.05 -0.13 3.52 1.08 -1.57 -1.51 115.11 116.55 3hk9 h GLN 306 Ca -0.01 -0.00 -0.02 0.00 -1.45 0.00 0.00 58.65 57.17 3hk9 h GLN 306 Cb 1.03 -0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 28.44 3hk9 h GLN 306 CO 0.00 0.03 0.02 1.25 -0.95 0.00 0.00 178.83 179.19 3hk9 h HIS 307 N 0.05 0.23 0.00 2.96 2.76 -1.82 -2.47 115.15 116.86 3hk9 h HIS 307 Ca 0.18 -0.03 -0.04 0.00 -2.20 0.00 0.00 60.37 58.28 3hk9 h HIS 307 Cb 0.26 -0.06 -0.01 0.00 1.55 0.00 0.00 27.41 29.15 3hk9 h HIS 307 CO -0.29 0.40 -0.17 1.05 -1.30 0.00 0.00 177.93 177.62 3hk9 h GLU 308 N 0.00 0.00 -0.50 5.26 4.11 -1.84 -2.01 114.58 119.60 3hk9 h GLU 308 Ca 0.04 0.00 -0.12 0.00 0.07 0.00 0.00 59.36 59.35 3hk9 h GLU 308 Cb 0.29 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.52 3hk9 h GLU 308 CO 0.00 0.17 -0.16 1.25 0.07 0.00 0.00 179.01 180.34 3hk9 h LEU 309 N 0.00 1.00 -0.42 3.06 5.85 -1.05 -1.29 115.31 122.46 3hk9 h LEU 309 Ca -0.00 -0.37 -0.03 0.00 0.84 0.00 0.00 57.88 58.31 3hk9 h LEU 309 Cb 0.47 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 41.21 3hk9 h LEU 309 CO 0.02 1.15 0.13 0.58 -0.34 0.00 0.00 178.44 179.98 3hk9 h VAL 310 N 0.85 1.22 -0.38 1.05 2.07 -0.92 -1.96 116.25 118.17 3hk9 h VAL 310 Ca 0.12 -0.71 -0.02 0.00 0.82 0.00 0.00 66.70 66.91 3hk9 h VAL 310 Cb 0.73 0.89 -0.02 0.00 -1.52 0.00 0.00 31.29 31.37 3hk9 h VAL 310 CO 0.06 0.25 0.14 0.58 0.02 0.00 0.00 177.57 178.62 3hk9 h VAL 311 N 0.54 1.15 -0.26 2.57 2.07 -1.23 -1.62 116.25 119.47 3hk9 h VAL 311 Ca 0.14 -0.49 -0.09 0.00 0.82 0.00 0.00 66.70 67.08 3hk9 h VAL 311 Cb 0.26 0.71 -0.01 0.00 -1.52 0.00 0.00 31.29 30.73 3hk9 h VAL 311 CO -0.00 0.19 -0.21 0.25 0.02 0.00 0.00 177.57 177.81 3hk9 h LEU 312 N 0.54 0.46 -1.27 2.57 5.85 -0.69 -1.87 115.31 120.90 3hk9 h LEU 312 Ca 0.13 -0.14 -0.07 0.00 0.84 0.00 0.00 57.88 58.64 3hk9 h LEU 312 Cb 0.13 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.02 3hk9 h LEU 312 CO -0.01 0.68 -0.21 0.00 -0.34 0.00 0.00 178.44 178.56 3hk9 h ALA 313 N 1.36 1.40 -0.26 1.25 0.00 -0.57 -1.47 119.26 120.97 3hk9 h ALA 313 Ca 0.07 -0.27 -0.06 0.00 0.00 0.00 0.00 54.91 54.65 3hk9 h ALA 313 Cb 0.60 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.29 3hk9 h ALA 313 CO 0.04 0.42 -0.11 0.00 0.00 0.00 0.00 179.25 179.61 3hk9 h ARG 314 N 0.21 0.43 0.01 0.00 3.08 -0.92 -3.11 114.38 114.08 3hk9 h ARG 314 Ca 0.04 -0.11 -0.26 0.00 0.07 0.00 0.00 59.98 59.72 3hk9 h ARG 314 Cb 0.50 -0.05 0.02 0.00 0.08 0.00 0.00 29.97 30.52 3hk9 h ARG 314 CO 0.03 0.54 -1.03 0.87 -1.07 0.00 0.00 179.97 179.31 3hk9 h LYS 315 N 0.40 0.62 -4.59 0.04 1.79 -1.02 -3.45 116.57 110.36 3hk9 h LYS 315 Ca 0.08 -0.68 -0.59 0.00 -2.18 0.00 0.00 60.65 57.28 3hk9 h LYS 315 Cb 0.44 0.19 -0.36 0.00 -1.58 0.00 0.00 32.23 30.92 3hk9 h LYS 315 CO 0.02 1.27 -0.83 -0.06 -1.08 0.00 0.00 179.45 178.78 3hk9 s PHE 316 N -3.28 2.10 -0.51 -1.35 0.08 -0.71 -4.99 117.98 109.32 3hk9 s PHE 316 Ca -0.09 -1.20 0.24 0.00 0.12 0.00 0.00 56.93 56.00 3hk9 s PHE 316 Cb 0.07 -1.55 0.96 0.00 -0.57 0.00 0.00 43.02 41.93 3hk9 s PHE 316 CO 0.91 -0.66 1.72 -1.13 -0.10 0.00 0.00 175.22 175.96 3hk9 n SER 317 N 4.79 0.68 -0.56 1.36 3.41 -1.26 -2.17 113.62 119.86 3hk9 n SER 317 Ca -0.16 0.65 0.07 0.00 -0.26 0.00 0.00 58.87 59.18 3hk9 n SER 317 Cb 0.50 -0.80 0.25 0.00 -0.26 0.00 0.00 64.21 63.89 3hk9 n SER 317 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 3hk9 n ASN 318 N -2.24 1.64 -4.55 4.04 6.94 -1.26 -4.75 115.26 115.09 3hk9 n ASN 318 Ca 0.03 -1.87 -0.35 0.00 -0.02 0.00 0.00 54.58 52.37 3hk9 n ASN 318 Cb 0.25 -0.17 -0.11 0.00 -2.36 0.00 0.00 39.78 37.40 3hk9 n ASN 318 CO 0.00 0.00 0.00 -0.22 -1.03 0.00 0.00 177.26 176.01 3hk9 s LEU 319 N -1.24 3.55 -0.23 -4.53 2.96 -0.92 -0.75 118.68 117.52 3hk9 s LEU 319 Ca 0.26 -0.05 0.00 0.00 -0.22 0.00 0.00 54.13 54.12 3hk9 s LEU 319 Cb 0.14 -1.90 0.06 0.00 0.50 0.00 0.00 46.19 44.99 3hk9 s LEU 319 CO 0.19 0.12 -0.04 -0.32 -1.32 0.00 0.00 176.35 174.98 3hk9 s MET 320 N 0.66 1.50 0.35 1.98 -2.45 0.36 -4.92 119.30 116.78 3hk9 s MET 320 Ca 0.01 -0.91 -0.15 0.00 -1.25 0.00 0.00 55.69 53.39 3hk9 s MET 320 Cb -0.14 -2.52 -0.09 0.00 1.25 0.00 0.00 34.83 33.33 3hk9 s MET 320 CO 0.02 -0.60 0.76 0.96 1.05 0.00 0.00 175.02 177.21 3hk9 s ILE 321 N 1.45 4.68 0.00 10.11 -4.36 -1.26 -1.76 121.20 130.06 3hk9 s ILE 321 Ca -0.05 0.93 -0.14 0.00 -0.26 0.00 0.00 60.65 61.12 3hk9 s ILE 321 Cb -0.19 -3.63 0.02 0.00 1.25 0.00 0.00 42.46 39.91 3hk9 s ILE 321 CO -0.06 -0.26 0.30 0.72 0.24 0.00 0.00 174.94 175.88 3hk9 s PHE 322 N -2.08 -0.15 0.35 1.37 -0.12 -0.42 -2.32 117.98 114.60 3hk9 s PHE 322 Ca 0.54 0.18 0.00 0.00 -0.05 0.00 0.00 56.93 57.60 3hk9 s PHE 322 Cb -0.10 0.09 0.00 0.00 -0.63 0.00 0.00 43.02 42.38 3hk9 s PHE 322 CO 0.20 -0.42 0.00 0.41 -0.05 0.00 0.00 175.22 175.36 3hk9 n GLY 323 N 1.09 -1.85 2.91 1.99 0.00 0.02 -4.39 105.19 104.95 3hk9 n GLY 323 Ca -0.21 -0.77 -0.30 0.00 0.00 0.00 0.00 46.02 44.74 3hk9 n GLY 323 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hk9 s TRP 325 N -0.44 3.28 0.00 0.00 -0.00 -1.26 -2.95 118.94 117.58 3hk9 s TRP 325 Ca 0.19 1.26 0.00 0.00 -0.00 0.00 0.00 56.10 57.54 3hk9 s TRP 325 Cb -0.21 -3.41 0.00 0.00 -0.00 0.00 0.00 33.47 29.85 3hk9 s TRP 325 CO -0.03 -1.26 0.00 1.87 -0.00 0.00 0.00 176.95 177.53 3hk9 n TRP 326 N 4.75 0.00 0.57 5.86 -0.00 -1.26 -0.74 117.44 126.63 3hk9 n TRP 326 Ca 0.10 0.00 0.09 0.00 -0.00 0.00 0.00 57.50 57.69 3hk9 n TRP 326 Cb 0.46 0.00 0.38 0.00 -0.00 0.00 0.00 31.31 32.15 3hk9 n TRP 326 CO 0.00 0.00 0.00 1.19 -0.00 0.00 0.00 177.69 178.88 3hk9 n PHE 327 N 0.00 0.09 0.29 5.87 3.72 -1.26 -1.48 117.46 124.69 3hk9 n PHE 327 Ca 0.00 0.03 0.12 0.00 -0.05 0.00 0.00 57.45 57.55 3hk9 n PHE 327 Cb 0.00 -0.55 0.08 0.00 -0.94 0.00 0.00 39.48 38.07 3hk9 n PHE 327 CO 0.00 0.00 0.00 0.52 -0.05 0.00 0.00 176.76 177.23 3hk9 h MET 328 N 0.00 0.00 -2.43 -1.08 2.86 -1.18 -3.40 114.93 109.69 3hk9 h MET 328 Ca 0.00 0.00 -0.34 0.00 -2.06 0.00 0.00 59.70 57.30 3hk9 h MET 328 Cb 0.31 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 31.94 3hk9 h MET 328 CO 0.00 0.00 1.15 -1.71 1.06 0.00 0.00 176.91 177.41 3hk9 n ASN 329 N -2.51 6.12 -4.07 1.22 5.15 -0.55 -3.65 115.26 116.97 3hk9 n ASN 329 Ca 0.02 -2.46 -0.21 0.00 -0.60 0.00 0.00 54.58 51.32 3hk9 n ASN 329 Cb 0.51 -1.39 -0.15 0.00 -0.53 0.00 0.00 39.78 38.22 3hk9 n ASN 329 CO 0.00 0.00 0.00 0.20 1.40 0.00 0.00 177.26 178.86 3hk9 s ASN 330 N 2.17 1.48 0.16 1.20 0.01 -1.26 -4.97 114.94 113.73 3hk9 s ASN 330 Ca 0.64 -0.23 -0.17 0.00 -0.71 0.00 0.00 52.86 52.39 3hk9 s ASN 330 Cb 0.25 -0.21 0.11 0.00 0.41 0.00 0.00 41.25 41.81 3hk9 s ASN 330 CO -0.02 0.14 1.21 -2.65 -1.51 0.00 0.00 177.10 174.27 3hk9 n PRO 331 N 2.86 -0.24 -0.26 -0.60 -0.02 -1.26 -0.01 135.00 135.48 3hk9 n PRO 331 Ca -0.15 1.19 0.02 0.00 -2.02 0.00 0.00 63.50 62.55 3hk9 n PRO 331 Cb 0.55 -1.77 0.15 0.00 -0.02 0.00 0.00 33.50 32.41 3hk9 n PRO 331 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 3hk9 h GLU 332 N 0.00 0.63 0.17 -0.52 4.57 -1.97 -0.81 114.58 116.65 3hk9 h GLU 332 Ca 0.22 -0.04 -0.26 0.00 -1.18 0.00 0.00 59.36 58.11 3hk9 h GLU 332 Cb 0.42 -0.14 0.03 0.00 -0.16 0.00 0.00 28.75 28.89 3hk9 h GLU 332 CO -0.76 0.42 -1.11 0.82 -1.18 0.00 0.00 179.01 177.20 3hk9 h ILE 333 N 0.65 1.39 -0.87 2.32 1.08 -1.24 -3.07 117.51 117.77 3hk9 h ILE 333 Ca 0.36 -2.56 0.08 0.00 -0.39 0.00 0.00 64.86 62.36 3hk9 h ILE 333 Cb 0.37 3.05 -0.07 0.00 -3.07 0.00 0.00 36.82 37.10 3hk9 h ILE 333 CO -0.26 0.75 0.52 0.40 -0.69 0.00 0.00 178.15 178.87 3hk9 h ILE 334 N -0.08 0.97 0.18 -0.67 2.04 -0.20 -0.53 117.51 119.22 3hk9 h ILE 334 Ca -0.19 -0.31 -0.01 0.00 1.00 0.00 0.00 64.86 65.36 3hk9 h ILE 334 Cb 1.86 -0.01 0.00 0.00 -0.74 0.00 0.00 36.82 37.93 3hk9 h ILE 334 CO 0.21 0.16 -0.08 -1.13 0.00 0.00 0.00 178.15 177.31 3hk9 h ASN 335 N 0.90 -0.20 -0.70 1.72 -1.24 -1.22 -1.06 115.58 113.77 3hk9 h ASN 335 Ca 0.40 -0.08 -0.07 0.00 0.71 0.00 0.00 56.30 57.26 3hk9 h ASN 335 Cb 0.30 0.05 -0.03 0.00 0.73 0.00 0.00 38.32 39.37 3hk9 h ASN 335 CO -0.22 -0.04 0.18 1.05 -1.29 0.00 0.00 177.43 177.11 3hk9 h GLU 336 N -0.35 1.12 -0.26 6.67 4.11 -1.37 -1.74 114.58 122.75 3hk9 h GLU 336 Ca -0.02 -0.26 -0.03 0.00 0.07 0.00 0.00 59.36 59.11 3hk9 h GLU 336 Cb 0.27 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.36 3hk9 h GLU 336 CO 0.04 0.98 0.03 0.52 0.07 0.00 0.00 179.01 180.65 3hk9 h MET 337 N 1.07 0.44 -0.52 1.06 2.86 -1.06 -1.38 114.93 117.41 3hk9 h MET 337 Ca 0.22 -0.12 -0.07 0.00 -2.06 0.00 0.00 59.70 57.67 3hk9 h MET 337 Cb 0.36 -0.05 -0.02 0.00 0.06 0.00 0.00 31.60 31.95 3hk9 h MET 337 CO 0.00 0.57 0.05 1.15 1.06 0.00 0.00 176.91 179.74 3hk9 h THR 338 N 0.24 1.24 -0.22 2.22 2.02 -1.09 -0.41 112.91 116.91 3hk9 h THR 338 Ca 0.08 -0.95 -0.10 0.00 0.77 0.00 0.00 66.41 66.21 3hk9 h THR 338 Cb 0.35 0.79 -0.00 0.00 -1.74 0.00 0.00 68.15 67.55 3hk9 h THR 338 CO 0.01 0.34 -0.25 0.03 0.37 0.00 0.00 175.52 176.02 3hk9 h ARG 339 N 0.79 0.57 -0.63 6.66 3.08 -1.22 -1.29 114.38 122.34 3hk9 h ARG 339 Ca 0.16 -0.31 -0.07 0.00 0.07 0.00 0.00 59.98 59.83 3hk9 h ARG 339 Cb 0.40 0.02 -0.03 0.00 0.08 0.00 0.00 29.97 30.44 3hk9 h ARG 339 CO 0.01 0.90 0.11 0.52 -1.07 0.00 0.00 179.97 180.45 3hk9 h MET 340 N 0.26 1.02 -0.01 0.04 2.86 -1.11 -0.96 114.93 117.03 3hk9 h MET 340 Ca 0.03 -0.25 -0.00 0.00 -2.06 0.00 0.00 59.70 57.42 3hk9 h MET 340 Cb 0.82 -0.13 -0.00 0.00 0.06 0.00 0.00 31.60 32.35 3hk9 h MET 340 CO 0.06 0.93 0.00 0.00 1.06 0.00 0.00 176.91 178.96 3hk9 h ARG 341 N 0.96 0.01 -0.59 1.72 3.08 -1.03 -2.73 114.38 115.80 3hk9 h ARG 341 Ca 0.20 -0.00 -0.06 0.00 0.07 0.00 0.00 59.98 60.18 3hk9 h ARG 341 Cb 0.40 -0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.43 3hk9 h ARG 341 CO 0.01 0.21 0.12 1.98 -1.07 0.00 0.00 179.97 181.22 3hk9 h MET 342 N -0.19 0.96 -0.71 0.04 4.05 -1.10 0.25 114.93 118.22 3hk9 h MET 342 Ca 0.00 -0.24 0.05 0.00 -0.28 0.00 0.00 59.70 59.23 3hk9 h MET 342 Cb 0.20 -0.12 -0.04 0.00 -0.80 0.00 0.00 31.60 30.84 3hk9 h MET 342 CO -0.00 0.89 0.47 0.93 0.23 0.00 0.00 176.91 179.43 3hk9 h GLU 343 N 0.86 0.77 0.00 0.39 5.08 -1.16 0.30 114.58 120.83 3hk9 h GLU 343 Ca 0.18 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.50 3hk9 h GLU 343 Cb 0.38 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.46 3hk9 h GLU 343 CO 0.01 0.51 -1.29 -1.33 -1.00 0.00 0.00 179.01 175.91 3hk9 n MET 344 N -4.47 0.71 0.00 2.33 2.81 -1.03 -4.61 117.12 112.86 3hk9 n MET 344 Ca 0.10 -0.07 0.00 0.00 -1.81 0.00 0.00 57.70 55.92 3hk9 n MET 344 Cb 0.18 -1.42 0.00 0.00 -0.71 0.00 0.00 33.22 31.27 3hk9 n MET 344 CO 0.00 0.00 0.00 1.28 1.51 0.00 0.00 175.97 178.76 3hk9 n LEU 345 N -1.73 0.44 0.00 4.03 4.77 0.85 -4.90 117.00 120.46 3hk9 n LEU 345 Ca 0.01 -0.60 0.00 0.00 -0.03 0.00 0.00 56.01 55.39 3hk9 n LEU 345 Cb 0.38 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.47 3hk9 n LEU 345 CO 0.39 0.11 0.00 0.61 -1.33 0.00 0.00 177.39 177.17 3hk9 n GLY 346 N 0.32 3.69 0.74 -0.72 0.00 0.11 -1.78 105.19 107.54 3hk9 n GLY 346 Ca 0.00 -0.04 0.06 0.00 0.00 0.00 0.00 46.02 46.04 3hk9 n GLY 346 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3hk9 n THR 347 N 0.00 1.11 -1.39 2.61 -2.24 -1.26 -4.32 114.28 108.79 3hk9 n THR 347 Ca 0.00 -1.07 -0.31 0.00 -2.27 0.00 0.00 64.05 60.41 3hk9 n THR 347 Cb 0.00 0.44 -0.06 0.00 -2.10 0.00 0.00 70.33 68.61 3hk9 n THR 347 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 3hk9 n SER 348 N 0.55 7.44 -3.68 3.42 3.41 -0.73 -4.72 113.62 119.31 3hk9 n SER 348 Ca 0.14 -2.74 -0.07 0.00 -0.26 0.00 0.00 58.87 55.93 3hk9 n SER 348 Cb 0.48 -1.44 -0.01 0.00 -0.26 0.00 0.00 64.21 62.98 3hk9 n SER 348 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 3hk9 s PHE 349 N 0.71 -0.13 -0.38 7.33 -0.12 -1.26 -4.83 117.98 119.31 3hk9 s PHE 349 Ca 0.65 -0.37 -0.00 0.00 -0.05 0.00 0.00 56.93 57.15 3hk9 s PHE 349 Cb 0.24 0.74 0.10 0.00 -0.63 0.00 0.00 43.02 43.47 3hk9 s PHE 349 CO -0.07 -1.30 0.13 0.42 -0.05 0.00 0.00 175.22 174.35 3hk9 s ILE 350 N -3.60 2.91 0.46 -4.49 1.01 -0.98 -4.66 121.20 111.85 3hk9 s ILE 350 Ca 0.12 -2.10 0.15 0.00 0.00 0.00 0.00 60.65 58.82 3hk9 s ILE 350 Cb -0.06 -3.01 0.32 0.00 0.01 0.00 0.00 42.46 39.72 3hk9 s ILE 350 CO 0.08 -0.61 2.03 1.55 0.00 0.00 0.00 174.94 177.99 3hk9 h PRO 351 N 7.89 0.27 -3.11 2.79 0.13 -1.86 0.11 132.00 138.23 3hk9 h PRO 351 Ca -0.11 -0.02 -0.00 0.00 -0.87 0.00 0.00 66.00 65.01 3hk9 h PRO 351 Cb 1.04 -0.06 -0.10 0.00 0.13 0.00 0.00 31.00 32.01 3hk9 h PRO 351 CO 0.62 0.18 0.15 -1.14 -0.23 0.00 0.00 178.00 177.58 3hk9 s GLN 352 N -5.28 1.41 0.06 0.86 2.00 -1.26 -3.63 119.66 113.82 3hk9 s GLN 352 Ca -0.07 -0.71 -0.10 0.00 -2.00 0.00 0.00 55.36 52.48 3hk9 s GLN 352 Cb 0.19 0.57 0.00 0.00 0.80 0.00 0.00 33.01 34.57 3hk9 s GLN 352 CO 0.73 -0.62 0.20 -3.38 -0.50 0.00 0.00 175.29 171.72 3hk9 s HIS 353 N -3.83 0.07 -0.04 1.67 -3.43 -1.26 -4.59 115.29 103.89 3hk9 s HIS 353 Ca 0.06 -0.37 -0.07 0.00 -0.80 0.00 0.00 55.06 53.88 3hk9 s HIS 353 Cb -0.02 -0.03 -0.29 0.00 -1.43 0.00 0.00 32.58 30.81 3hk9 s HIS 353 CO -0.06 -0.48 0.70 0.66 -2.00 0.00 0.00 174.74 173.57 3hk9 h SER 354 N 3.16 0.50 -1.51 7.38 4.64 -1.93 -3.45 113.55 122.34 3hk9 h SER 354 Ca -0.33 -0.76 -0.28 0.00 -0.47 0.00 0.00 61.79 59.95 3hk9 h SER 354 Cb 1.20 -0.16 -0.05 0.00 -0.31 0.00 0.00 62.40 63.07 3hk9 h SER 354 CO 0.51 1.65 -0.32 -0.67 -0.87 0.00 0.00 176.83 177.12 3hk9 n ASP 355 N -3.51 -4.44 -4.70 4.97 -0.08 -0.14 -4.91 116.55 103.74 3hk9 n ASP 355 Ca -0.22 0.12 -0.44 0.00 -1.51 0.00 0.00 54.79 52.74 3hk9 n ASP 355 Cb 1.06 -3.44 -0.03 0.00 2.34 0.00 0.00 41.12 41.05 3hk9 n ASP 355 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3hk9 n ALA 356 N -0.60 1.87 -0.02 -1.67 0.00 -1.26 -4.41 120.51 114.42 3hk9 n ALA 356 Ca -0.16 0.40 0.03 0.00 0.00 0.00 0.00 53.44 53.71 3hk9 n ALA 356 Cb 0.56 -2.38 -0.08 0.00 0.00 0.00 0.00 19.45 17.55 3hk9 n ALA 356 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3hk9 n ARG 357 N 2.49 0.90 -4.49 0.00 1.74 -1.26 0.15 116.66 116.20 3hk9 n ARG 357 Ca 0.12 -0.07 -0.28 0.00 -0.77 0.00 0.00 57.85 56.84 3hk9 n ARG 357 Cb 0.33 -1.26 -0.17 0.00 -1.02 0.00 0.00 32.46 30.35 3hk9 n ARG 357 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 3hk9 s VAL 358 N -2.61 1.45 0.13 1.55 1.01 -1.26 -4.38 120.40 116.29 3hk9 s VAL 358 Ca -0.04 -0.62 -0.24 0.00 0.00 0.00 0.00 61.98 61.08 3hk9 s VAL 358 Cb 0.06 -1.33 -0.03 0.00 0.00 0.00 0.00 36.38 35.08 3hk9 s VAL 358 CO 0.44 0.43 1.23 -0.11 0.00 0.00 0.00 175.10 177.09 3hk9 n LEU 359 N 4.14 -0.82 0.18 3.92 7.94 -0.28 -0.74 117.00 131.35 3hk9 n LEU 359 Ca -0.19 1.42 0.18 0.00 -1.11 0.00 0.00 56.01 56.31 3hk9 n LEU 359 Cb 0.51 -0.20 0.79 0.00 0.53 0.00 0.00 43.42 45.06 3hk9 n LEU 359 CO 0.24 -1.16 1.16 -0.33 -1.11 0.00 0.00 177.39 176.19 3hk9 h GLU 360 N 0.00 0.00 -0.17 1.96 3.07 -1.95 -2.15 114.58 115.34 3hk9 h GLU 360 Ca 0.14 0.00 0.05 0.00 -0.50 0.00 0.00 59.36 59.05 3hk9 h GLU 360 Cb 0.34 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.24 3hk9 h GLU 360 CO -0.75 0.00 0.16 1.96 -1.40 0.00 0.00 179.01 178.97 3hk9 h GLN 361 N 0.00 0.00 -0.44 2.33 4.20 -1.34 -1.02 115.11 118.84 3hk9 h GLN 361 Ca 0.12 0.00 0.13 0.00 0.06 0.00 0.00 58.65 58.96 3hk9 h GLN 361 Cb 0.84 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.60 3hk9 h GLN 361 CO -0.00 0.00 0.40 -0.07 -0.67 0.00 0.00 178.83 178.49 3hk9 h LEU 362 N 0.00 0.00 0.18 1.46 3.38 -1.56 -0.79 115.31 117.99 3hk9 h LEU 362 Ca 0.08 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.04 3hk9 h LEU 362 Cb 0.40 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.15 3hk9 h LEU 362 CO -0.00 0.00 -0.09 0.40 0.09 0.00 0.00 178.44 178.84 3hk9 h ILE 363 N 0.00 0.91 -0.03 1.22 2.04 -1.42 -3.07 117.51 117.16 3hk9 h ILE 363 Ca 0.21 -0.93 -0.25 0.00 1.00 0.00 0.00 64.86 64.89 3hk9 h ILE 363 Cb 1.00 1.42 0.01 0.00 -0.74 0.00 0.00 36.82 38.52 3hk9 h ILE 363 CO -0.00 0.20 -0.95 0.10 0.00 0.00 0.00 178.15 177.49 3hk9 h TYR 364 N -0.74 0.93 -0.26 1.37 -0.00 -1.54 -1.97 116.97 114.76 3hk9 h TYR 364 Ca -0.02 -0.48 0.04 0.00 0.00 0.00 0.00 58.73 58.26 3hk9 h TYR 364 Cb 0.51 -0.12 -0.04 0.00 0.00 0.00 0.00 36.73 37.09 3hk9 h TYR 364 CO 0.06 1.31 0.04 0.87 -0.00 0.00 0.00 178.16 180.45 3hk9 h LYS 365 N 0.38 0.13 0.00 0.10 1.79 -1.31 0.87 116.57 118.54 3hk9 h LYS 365 Ca -0.10 -0.01 -0.16 0.00 -2.18 0.00 0.00 60.65 58.20 3hk9 h LYS 365 Cb 1.60 -0.03 -0.02 0.00 -1.58 0.00 0.00 32.23 32.19 3hk9 h LYS 365 CO 0.18 0.09 -0.76 -1.49 -1.08 0.00 0.00 179.45 176.39 3hk9 h TRP 366 N 0.14 0.00 -0.06 -1.35 4.06 -1.62 -2.07 115.95 115.05 3hk9 h TRP 366 Ca 0.12 0.00 -0.14 0.00 2.06 0.00 0.00 58.89 60.94 3hk9 h TRP 366 Cb 0.13 0.00 0.01 0.00 -1.00 0.00 0.00 29.16 28.30 3hk9 h TRP 366 CO -0.17 0.76 -0.49 1.25 -3.56 0.00 0.00 178.44 176.23 3hk9 h HIS 367 N 0.00 0.62 -0.50 0.49 2.76 -1.12 -0.48 115.15 116.92 3hk9 h HIS 367 Ca -0.01 -0.29 -0.08 0.00 -2.20 0.00 0.00 60.37 57.79 3hk9 h HIS 367 Cb 1.49 -0.09 -0.02 0.00 1.55 0.00 0.00 27.41 30.34 3hk9 h HIS 367 CO 0.00 1.07 -0.02 0.45 -1.30 0.00 0.00 177.93 178.14 3hk9 h HIS 368 N -0.01 0.93 0.03 5.26 3.86 -0.90 -2.85 115.15 121.47 3hk9 h HIS 368 Ca -0.04 -0.14 -0.16 0.00 -1.16 0.00 0.00 60.37 58.86 3hk9 h HIS 368 Cb 1.16 -0.25 0.01 0.00 1.06 0.00 0.00 27.41 29.40 3hk9 h HIS 368 CO 0.13 0.85 -0.66 0.77 0.86 0.00 0.00 177.93 179.88 3hk9 h SER 369 N 0.79 0.52 -0.74 2.45 0.02 -1.40 -3.25 113.55 111.94 3hk9 h SER 369 Ca 0.15 -0.81 0.01 0.00 -0.84 0.00 0.00 61.79 60.30 3hk9 h SER 369 Cb 0.50 -0.16 -0.04 0.00 0.14 0.00 0.00 62.40 62.84 3hk9 h SER 369 CO 0.03 1.27 0.49 0.11 -1.14 0.00 0.00 176.83 177.58 3hk9 h LYS 370 N -0.17 0.95 -0.44 3.45 1.57 -1.10 -0.10 116.57 120.73 3hk9 h LYS 370 Ca -0.09 -0.06 -0.06 0.00 -1.87 0.00 0.00 60.65 58.57 3hk9 h LYS 370 Cb 1.40 -0.21 -0.02 0.00 0.08 0.00 0.00 32.23 33.47 3hk9 h LYS 370 CO 0.13 0.63 0.01 0.66 -0.57 0.00 0.00 179.45 180.30 3hk9 h SER 371 N 0.98 0.68 -0.04 0.86 4.64 -1.60 0.13 113.55 119.20 3hk9 h SER 371 Ca 0.27 -0.15 -0.07 0.00 -0.47 0.00 0.00 61.79 61.37 3hk9 h SER 371 Cb -0.08 -0.18 0.00 0.00 -0.31 0.00 0.00 62.40 61.83 3hk9 h SER 371 CO -0.06 0.75 -0.27 0.40 -0.87 0.00 0.00 176.83 176.78 3hk9 h ILE 372 N 0.68 1.47 -0.75 0.95 2.04 -1.40 -2.75 117.51 117.75 3hk9 h ILE 372 Ca 0.14 -1.76 0.00 0.00 1.00 0.00 0.00 64.86 64.24 3hk9 h ILE 372 Cb 0.41 2.48 -0.04 0.00 -0.74 0.00 0.00 36.82 38.93 3hk9 h ILE 372 CO 0.02 0.49 0.48 0.40 0.00 0.00 0.00 178.15 179.54 3hk9 h ILE 373 N -0.31 1.20 -0.63 -0.67 2.04 -0.93 -1.96 117.51 116.26 3hk9 h ILE 373 Ca -0.02 -0.37 -0.04 0.00 1.00 0.00 0.00 64.86 65.43 3hk9 h ILE 373 Cb 0.94 0.11 -0.03 0.00 -0.74 0.00 0.00 36.82 37.10 3hk9 h ILE 373 CO 0.05 0.19 0.24 0.00 0.00 0.00 0.00 178.15 178.64 3hk9 h ALA 374 N 1.52 0.82 -0.74 1.87 0.00 -0.76 -1.43 119.26 120.54 3hk9 h ALA 374 Ca 0.27 -0.18 -0.06 0.00 0.00 0.00 0.00 54.91 54.95 3hk9 h ALA 374 Cb -0.10 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.41 3hk9 h ALA 374 CO -0.06 0.44 0.23 1.49 0.00 0.00 0.00 179.25 181.35 3hk9 h GLU 375 N 0.88 1.15 -0.29 0.00 4.57 -1.08 -0.48 114.58 119.34 3hk9 h GLU 375 Ca 0.21 -0.25 -0.01 0.00 -1.18 0.00 0.00 59.36 58.13 3hk9 h GLU 375 Cb 0.22 -0.16 -0.01 0.00 -0.16 0.00 0.00 28.75 28.63 3hk9 h GLU 375 CO -0.02 0.98 0.14 0.28 -1.18 0.00 0.00 179.01 179.21 3hk9 h VAL 376 N 1.10 1.15 -0.84 0.32 2.07 -1.09 -2.09 116.25 116.87 3hk9 h VAL 376 Ca 0.24 -0.43 0.01 0.00 0.82 0.00 0.00 66.70 67.34 3hk9 h VAL 376 Cb 0.31 0.91 -0.04 0.00 -1.52 0.00 0.00 31.29 30.95 3hk9 h VAL 376 CO -0.01 0.15 0.55 -0.07 0.02 0.00 0.00 177.57 178.22 3hk9 h LEU 377 N 0.33 0.97 -0.31 2.57 3.38 -1.01 -0.89 115.31 120.34 3hk9 h LEU 377 Ca 0.10 -0.03 0.01 0.00 0.09 0.00 0.00 57.88 58.05 3hk9 h LEU 377 Cb 0.12 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.60 3hk9 h LEU 377 CO -0.01 0.70 0.18 0.40 0.09 0.00 0.00 178.44 179.80 3hk9 h ILE 378 N 1.14 1.03 -0.28 1.22 2.04 -0.82 0.24 117.51 122.08 3hk9 h ILE 378 Ca 0.31 -0.13 0.00 0.00 1.00 0.00 0.00 64.86 66.04 3hk9 h ILE 378 Cb -0.12 0.63 -0.01 0.00 -0.74 0.00 0.00 36.82 36.57 3hk9 h ILE 378 CO -0.07 0.07 0.19 0.44 0.00 0.00 0.00 178.15 178.78 3hk9 h ASP 379 N 0.37 0.32 -0.41 1.72 3.32 -0.90 -0.27 116.42 120.57 3hk9 h ASP 379 Ca 0.12 -0.01 -0.10 0.00 0.02 0.00 0.00 57.03 57.07 3hk9 h ASP 379 Cb 0.00 -0.08 -0.02 0.00 0.22 0.00 0.00 39.33 39.46 3hk9 h ASP 379 CO -0.06 0.23 -0.09 0.11 -1.72 0.00 0.00 179.24 177.71 3hk9 h LYS 380 N 0.38 0.85 -0.20 3.56 6.56 -0.77 -1.17 116.57 125.78 3hk9 h LYS 380 Ca 0.10 -0.29 -0.20 0.00 -1.06 0.00 0.00 60.65 59.21 3hk9 h LYS 380 Cb -0.04 -0.07 0.00 0.00 -0.57 0.00 0.00 32.23 31.55 3hk9 h LYS 380 CO -0.03 0.91 -0.67 1.88 -2.06 0.00 0.00 179.45 179.48 3hk9 h TYR 381 N 0.77 1.02 -0.53 -1.35 0.05 -0.44 -3.10 116.97 113.40 3hk9 h TYR 381 Ca 0.13 -0.41 -0.07 0.00 0.05 0.00 0.00 58.73 58.43 3hk9 h TYR 381 Cb 0.60 -0.17 -0.02 0.00 1.01 0.00 0.00 36.73 38.14 3hk9 h TYR 381 CO 0.03 1.23 0.06 0.22 -1.05 0.00 0.00 178.16 178.66 3hk9 h ASP 382 N 0.56 0.81 -1.01 3.88 3.58 -0.87 0.39 116.42 123.77 3hk9 h ASP 382 Ca -0.02 -0.18 0.02 0.00 0.42 0.00 0.00 57.03 57.27 3hk9 h ASP 382 Cb 1.28 -0.21 -0.05 0.00 1.72 0.00 0.00 39.33 42.07 3hk9 h ASP 382 CO 0.14 0.84 0.67 0.44 -2.88 0.00 0.00 179.24 178.45 3hk9 h ASP 383 N 0.81 1.15 1.26 2.28 3.32 -1.16 0.15 116.42 124.22 3hk9 h ASP 383 Ca 0.16 -0.03 -0.12 0.00 0.02 0.00 0.00 57.03 57.07 3hk9 h ASP 383 Cb 0.40 -0.28 -0.02 0.00 0.22 0.00 0.00 39.33 39.65 3hk9 h ASP 383 CO 0.01 0.82 -0.77 0.16 -1.72 0.00 0.00 179.24 177.74 3hk9 h ILE 384 N 1.35 0.69 -0.30 0.35 3.07 -1.39 -2.77 117.51 118.51 3hk9 h ILE 384 Ca 0.38 -2.06 -0.06 0.00 1.55 0.00 0.00 64.86 64.66 3hk9 h ILE 384 Cb -0.12 2.26 -0.01 0.00 -0.27 0.00 0.00 36.82 38.68 3hk9 h ILE 384 CO -0.09 0.40 -0.05 0.25 -1.05 0.00 0.00 178.15 177.60 3hk9 h LEU 385 N 0.00 0.57 -1.76 0.16 5.85 -0.43 -0.22 115.31 119.48 3hk9 h LEU 385 Ca -0.05 -0.35 -0.03 0.00 0.84 0.00 0.00 57.88 58.29 3hk9 h LEU 385 Cb 1.41 -0.16 -0.00 0.00 0.37 0.00 0.00 40.66 42.28 3hk9 h LEU 385 CO 0.05 0.79 -0.14 1.56 -0.34 0.00 0.00 178.44 180.36 3hk9 h GLN 386 N 0.35 0.00 -0.01 1.25 1.08 -0.74 -0.87 115.11 116.17 3hk9 h GLN 386 Ca 0.08 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.28 3hk9 h GLN 386 Cb 0.53 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.96 3hk9 h GLN 386 CO 0.03 0.14 0.00 0.00 -0.95 0.00 0.00 178.83 178.05 3hk9 n ALA 387 N -2.27 2.65 0.00 3.87 0.00 -0.93 -4.89 120.51 118.94 3hk9 n ALA 387 Ca -0.01 -0.23 0.00 0.00 0.00 0.00 0.00 53.44 53.20 3hk9 n ALA 387 Cb 0.27 -1.40 0.00 0.00 0.00 0.00 0.00 19.45 18.32 3hk9 n ALA 387 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hk9 n GLY 388 N 0.98 0.83 3.80 0.00 0.00 -0.33 -5.06 105.19 105.41 3hk9 n GLY 388 Ca 0.21 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.87 3hk9 n GLY 388 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 3hk9 s TRP 389 N -2.00 3.60 -0.26 1.61 -0.11 -0.14 -5.01 118.94 116.63 3hk9 s TRP 389 Ca 0.00 1.65 -0.18 0.00 1.22 0.00 0.00 56.10 58.79 3hk9 s TRP 389 Cb 0.00 -2.84 -0.03 0.00 -1.50 0.00 0.00 33.47 29.11 3hk9 s TRP 389 CO 0.00 0.17 0.53 -2.00 -4.62 0.00 0.00 176.95 171.02 3hk9 s GLU 390 N -2.30 4.08 -0.23 5.86 2.12 -1.26 -4.41 118.70 122.55 3hk9 s GLU 390 Ca 0.51 0.35 -0.04 0.00 0.36 0.00 0.00 54.97 56.15 3hk9 s GLU 390 Cb -0.16 -3.65 -0.00 0.00 0.26 0.00 0.00 34.13 30.58 3hk9 s GLU 390 CO 0.21 -0.35 -0.04 0.14 -0.54 0.00 0.00 175.26 174.68 3hk9 s VAL 391 N 2.32 3.32 0.20 3.70 -7.23 -1.26 -5.09 120.40 116.36 3hk9 s VAL 391 Ca 0.22 -0.59 0.02 0.00 -1.81 0.00 0.00 61.98 59.82 3hk9 s VAL 391 Cb -0.16 -2.55 -0.04 0.00 0.56 0.00 0.00 36.38 34.20 3hk9 s VAL 391 CO 0.09 0.37 0.36 0.42 -0.31 0.00 0.00 175.10 176.03 3hk9 s THR 392 N 1.46 5.26 0.47 5.32 -4.23 -1.26 -4.40 115.64 118.25 3hk9 s THR 392 Ca 0.05 -0.64 0.15 0.00 -1.18 0.00 0.00 61.69 60.07 3hk9 s THR 392 Cb -0.15 -3.78 0.21 0.00 1.34 0.00 0.00 72.50 70.12 3hk9 s THR 392 CO -0.03 -0.21 2.04 -0.08 -0.54 0.00 0.00 174.62 175.79 3hk9 h GLU 393 N 1.76 0.00 -0.26 3.99 4.81 -1.99 -1.94 114.58 120.95 3hk9 h GLU 393 Ca -0.49 0.00 -0.16 0.00 -0.13 0.00 0.00 59.36 58.58 3hk9 h GLU 393 Cb 1.20 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.58 3hk9 h GLU 393 CO 0.66 0.13 -0.48 0.93 -0.73 0.00 0.00 179.01 179.53 3hk9 h GLU 394 N 0.00 0.69 -0.32 1.92 4.39 -1.99 -1.71 114.58 117.55 3hk9 h GLU 394 Ca -0.00 -0.40 -0.11 0.00 0.34 0.00 0.00 59.36 59.19 3hk9 h GLU 394 Cb 0.24 0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 28.91 3hk9 h GLU 394 CO 0.02 1.01 -0.26 0.93 -1.16 0.00 0.00 179.01 179.55 3hk9 h GLU 395 N 0.55 0.65 -0.34 2.33 5.08 -1.77 -1.26 114.58 119.82 3hk9 h GLU 395 Ca 0.03 -0.27 -0.03 0.00 -1.00 0.00 0.00 59.36 58.09 3hk9 h GLU 395 Cb 1.03 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 30.24 3hk9 h GLU 395 CO 0.10 0.85 0.10 0.82 -1.00 0.00 0.00 179.01 179.87 3hk9 h ILE 396 N 0.57 1.21 -0.43 3.13 2.04 -1.24 -0.44 117.51 122.36 3hk9 h ILE 396 Ca 0.08 -0.70 -0.03 0.00 1.00 0.00 0.00 64.86 65.20 3hk9 h ILE 396 Cb 0.74 1.03 -0.02 0.00 -0.74 0.00 0.00 36.82 37.83 3hk9 h ILE 396 CO 0.06 0.24 0.14 0.11 0.00 0.00 0.00 178.15 178.70 3hk9 h LYS 397 N 0.40 0.62 -0.19 2.37 1.57 -1.10 0.52 116.57 120.75 3hk9 h LYS 397 Ca 0.11 -0.09 -0.04 0.00 -1.87 0.00 0.00 60.65 58.75 3hk9 h LYS 397 Cb 0.27 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.46 3hk9 h LYS 397 CO -0.00 0.54 -0.05 -0.09 -0.57 0.00 0.00 179.45 179.28 3hk9 h ARG 398 N 0.61 0.38 -0.30 3.15 2.43 -0.88 -0.44 114.38 119.33 3hk9 h ARG 398 Ca 0.15 -0.15 -0.05 0.00 -0.81 0.00 0.00 59.98 59.12 3hk9 h ARG 398 Cb 0.17 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.69 3hk9 h ARG 398 CO -0.01 0.64 -0.01 -0.44 -1.51 0.00 0.00 179.97 178.64 3hk9 h ASP 399 N 0.09 0.52 -0.89 -3.80 3.32 -0.75 -1.92 116.42 112.99 3hk9 h ASP 399 Ca 0.05 -0.32 -0.00 0.00 0.02 0.00 0.00 57.03 56.78 3hk9 h ASP 399 Cb 0.50 -0.14 -0.04 0.00 0.22 0.00 0.00 39.33 39.87 3hk9 h ASP 399 CO 0.02 0.71 0.55 0.58 -1.72 0.00 0.00 179.24 179.38 3hk9 h VAL 400 N 0.32 1.24 -0.67 -1.35 2.07 -0.89 -1.28 116.25 115.69 3hk9 h VAL 400 Ca 0.08 -0.50 -0.04 0.00 0.82 0.00 0.00 66.70 67.06 3hk9 h VAL 400 Cb 0.45 -0.02 -0.03 0.00 -1.52 0.00 0.00 31.29 30.17 3hk9 h VAL 400 CO 0.02 0.25 0.26 0.00 0.02 0.00 0.00 177.57 178.11 3hk9 h ALA 401 N 1.30 1.19 0.51 1.67 0.00 -0.95 -1.58 119.26 121.40 3hk9 h ALA 401 Ca 0.32 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 55.03 3hk9 h ALA 401 Cb -0.07 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.45 3hk9 h ALA 401 CO -0.06 0.59 -0.25 -0.44 0.00 0.00 0.00 179.25 179.08 3hk9 h ASP 402 N 0.97 -0.60 -0.61 0.00 3.32 -0.50 0.95 116.42 119.95 3hk9 h ASP 402 Ca 0.23 0.02 0.03 0.00 0.02 0.00 0.00 57.03 57.33 3hk9 h ASP 402 Cb 0.21 0.16 -0.04 0.00 0.22 0.00 0.00 39.33 39.87 3hk9 h ASP 402 CO -0.02 -0.42 0.36 -0.07 -1.72 0.00 0.00 179.24 177.37 3hk9 h LEU 403 N -0.69 0.58 -0.31 1.55 3.38 -1.03 0.63 115.31 119.43 3hk9 h LEU 403 Ca -0.07 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.91 3hk9 h LEU 403 Cb 0.53 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.17 3hk9 h LEU 403 CO 0.11 0.40 -0.45 0.49 0.09 0.00 0.00 178.44 179.08 3hk9 n PHE 404 N -4.75 0.00 0.13 1.13 3.72 -0.61 -4.31 117.46 112.76 3hk9 n PHE 404 Ca 0.06 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.46 3hk9 n PHE 404 Cb 0.10 -0.14 0.00 0.00 -0.94 0.00 0.00 39.48 38.50 3hk9 n PHE 404 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 3hk9 n SER 405 N -0.99 -2.12 -0.24 4.37 2.88 -0.30 -1.49 113.62 115.73 3hk9 n SER 405 Ca 0.09 0.49 -0.00 0.00 -1.33 0.00 0.00 58.87 58.11 3hk9 n SER 405 Cb 0.35 2.17 0.21 0.00 -0.75 0.00 0.00 64.21 66.20 3hk9 n SER 405 CO 0.00 0.00 0.00 0.03 -1.23 0.00 0.00 175.04 173.84 3hk9 h ARG 406 N 0.00 1.04 -0.65 -1.46 3.08 -0.84 -2.81 114.38 112.75 3hk9 h ARG 406 Ca 0.00 -0.08 0.00 0.00 0.07 0.00 0.00 59.98 59.98 3hk9 h ARG 406 Cb 0.00 -0.23 -0.03 0.00 0.08 0.00 0.00 29.97 29.79 3hk9 h ARG 406 CO 0.00 0.71 0.42 -0.91 -1.07 0.00 0.00 179.97 179.12 3hk9 h ASN 407 N 1.06 0.75 0.73 7.04 2.35 -1.08 -0.09 115.58 126.34 3hk9 h ASN 407 Ca 0.28 -0.03 -0.04 0.00 -0.55 0.00 0.00 56.30 55.96 3hk9 h ASN 407 Cb -0.08 -0.19 0.01 0.00 0.05 0.00 0.00 38.32 38.10 3hk9 h ASN 407 CO -0.06 0.56 -0.35 0.15 -1.65 0.00 0.00 177.43 176.08 3hk9 h PHE 408 N 0.88 -0.91 -0.73 1.19 3.57 -1.72 -1.38 116.94 117.84 3hk9 h PHE 408 Ca 0.24 -0.02 0.02 0.00 3.53 0.00 0.00 57.97 61.73 3hk9 h PHE 408 Cb -0.08 0.30 -0.04 0.00 2.79 0.00 0.00 35.95 38.92 3hk9 h PHE 408 CO -0.03 -0.56 0.48 -1.49 -2.23 0.00 0.00 178.31 174.49 3hk9 h TRP 409 N -0.99 0.90 -0.65 0.41 4.06 -1.43 -1.23 115.95 117.01 3hk9 h TRP 409 Ca -0.10 0.02 -0.04 0.00 2.06 0.00 0.00 58.89 60.83 3hk9 h TRP 409 Cb 0.75 -0.30 -0.03 0.00 -1.00 0.00 0.00 29.16 28.58 3hk9 h TRP 409 CO -0.02 0.55 0.23 -0.09 -3.56 0.00 0.00 178.44 175.55 3hk9 h ARG 410 N 0.95 0.99 -0.38 0.49 2.43 -0.92 0.13 114.38 118.07 3hk9 h ARG 410 Ca 0.28 -0.20 -0.15 0.00 -0.81 0.00 0.00 59.98 59.11 3hk9 h ARG 410 Cb -0.04 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 29.35 3hk9 h ARG 410 CO -0.07 0.85 -0.34 0.35 -1.51 0.00 0.00 179.97 179.25 3hk9 h PHE 411 N 0.92 1.03 0.00 2.20 3.57 -0.39 -3.02 116.94 121.25 3hk9 h PHE 411 Ca 0.21 -0.29 -0.03 0.00 3.53 0.00 0.00 57.97 61.39 3hk9 h PHE 411 Cb 0.25 -0.23 -0.00 0.00 2.79 0.00 0.00 35.95 38.76 3hk9 h PHE 411 CO 0.02 1.09 -0.16 -0.39 -2.23 0.00 0.00 178.31 176.64 3hk9 h VAL 412 N 0.73 0.29 -0.12 1.41 -1.51 -1.12 -3.46 116.25 112.46 3hk9 h VAL 412 Ca 0.07 -1.27 0.00 0.00 -1.23 0.00 0.00 66.70 64.27 3hk9 h VAL 412 Cb 0.91 2.02 0.00 0.00 -2.13 0.00 0.00 31.29 32.09 3hk9 h VAL 412 CO 0.08 0.15 0.00 0.61 -1.23 0.00 0.00 177.57 177.19 3hk9 n GLY 413 N 0.88 0.98 0.01 5.19 0.00 -0.06 -4.81 105.19 107.38 3hk9 n GLY 413 Ca 0.03 -0.53 0.00 0.00 0.00 0.00 0.00 46.02 45.52 3hk9 n GLY 413 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86