#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 4.54 -0.07 2.46 1.01 -0.33 -4.95 121.20 123.86 3hk9 s ILE 3 Ca 0.00 -0.11 0.01 0.00 0.00 0.00 0.00 60.65 60.54 3hk9 s ILE 3 Cb 0.00 -3.07 0.01 0.00 0.01 0.00 0.00 42.46 39.41 3hk9 s ILE 3 CO 0.00 0.41 0.58 -0.46 0.00 0.00 0.00 174.94 175.47 3hk9 n ASN 4 N 4.06 1.17 -4.55 3.58 0.23 -1.26 -4.19 115.26 114.30 3hk9 n ASN 4 Ca -0.16 -1.14 -0.34 0.00 -0.53 0.00 0.00 54.58 52.41 3hk9 n ASN 4 Cb 0.52 -0.00 -0.11 0.00 -2.08 0.00 0.00 39.78 38.11 3hk9 n ASN 4 CO 0.00 0.00 0.00 -0.55 -0.93 0.00 0.00 177.26 175.78 3hk9 s SER 5 N -0.16 5.01 0.30 0.53 0.15 -1.26 -5.00 113.70 113.27 3hk9 s SER 5 Ca 0.01 -0.06 0.04 0.00 0.70 0.00 0.00 55.95 56.64 3hk9 s SER 5 Cb 0.00 -1.78 0.48 0.00 -1.71 0.00 0.00 66.02 63.01 3hk9 s SER 5 CO 0.01 0.19 1.76 -0.09 1.20 0.00 0.00 173.24 176.31 3hk9 h ARG 6 N 6.52 0.44 -0.32 5.44 2.43 -1.98 -0.41 114.38 126.50 3hk9 h ARG 6 Ca -0.34 -0.15 -0.15 0.00 -0.81 0.00 0.00 59.98 58.53 3hk9 h ARG 6 Cb 1.19 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 30.69 3hk9 h ARG 6 CO 0.64 0.64 -0.39 1.05 -1.51 0.00 0.00 179.97 180.39 3hk9 h GLU 7 N 0.40 0.77 -0.09 0.20 4.11 -1.99 -0.84 114.58 117.13 3hk9 h GLU 7 Ca 0.06 -0.40 -0.16 0.00 0.07 0.00 0.00 59.36 58.94 3hk9 h GLU 7 Cb 0.60 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.85 3hk9 h GLU 7 CO 0.04 1.02 -0.63 0.28 0.07 0.00 0.00 179.01 179.80 3hk9 h VAL 8 N 0.63 1.38 0.58 -1.06 2.07 -1.94 -1.97 116.25 115.93 3hk9 h VAL 8 Ca 0.05 -1.99 -0.03 0.00 0.82 0.00 0.00 66.70 65.55 3hk9 h VAL 8 Cb 0.95 1.99 0.01 0.00 -1.52 0.00 0.00 31.29 32.72 3hk9 h VAL 8 CO 0.09 0.60 -0.28 0.25 0.02 0.00 0.00 177.57 178.25 3hk9 h LEU 9 N 0.24 -0.66 -1.19 2.57 5.85 -0.85 -0.48 115.31 120.79 3hk9 h LEU 9 Ca -0.01 -0.01 0.15 0.00 0.84 0.00 0.00 57.88 58.85 3hk9 h LEU 9 Cb 1.15 0.17 -0.08 0.00 0.37 0.00 0.00 40.66 42.27 3hk9 h LEU 9 CO 0.10 -0.42 0.60 0.00 -0.34 0.00 0.00 178.44 178.38 3hk9 h ALA 10 N -0.46 1.76 0.33 1.25 0.00 -1.12 0.37 119.26 121.39 3hk9 h ALA 10 Ca -0.08 0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 3hk9 h ALA 10 Cb 0.62 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.28 3hk9 h ALA 10 CO 0.13 -0.02 -0.16 1.49 0.00 0.00 0.00 179.25 180.69 3hk9 h GLU 11 N 0.76 -0.43 -0.72 0.00 4.81 -0.98 -2.02 114.58 116.01 3hk9 h GLU 11 Ca 0.48 0.03 -0.07 0.00 -0.13 0.00 0.00 59.36 59.67 3hk9 h GLU 11 Cb 0.72 0.10 -0.03 0.00 0.63 0.00 0.00 28.75 30.17 3hk9 h GLU 11 CO -0.25 -0.19 0.18 0.87 -0.73 0.00 0.00 179.01 178.90 3hk9 h LYS 12 N -0.60 1.15 0.50 1.92 1.79 -0.45 -1.82 116.57 119.06 3hk9 h LYS 12 Ca -0.05 -0.27 -0.02 0.00 -2.18 0.00 0.00 60.65 58.13 3hk9 h LYS 12 Cb 0.44 -0.15 0.00 0.00 -1.58 0.00 0.00 32.23 30.94 3hk9 h LYS 12 CO 0.07 1.01 -0.24 0.28 -1.08 0.00 0.00 179.45 179.49 3hk9 h VAL 13 N 1.09 0.50 -0.50 0.50 2.07 -0.94 0.11 116.25 119.07 3hk9 h VAL 13 Ca 0.23 -0.03 0.05 0.00 0.82 0.00 0.00 66.70 67.77 3hk9 h VAL 13 Cb 0.37 0.52 -0.03 0.00 -1.52 0.00 0.00 31.29 30.63 3hk9 h VAL 13 CO 0.00 0.00 0.34 0.11 0.02 0.00 0.00 177.57 178.04 3hk9 h LYS 14 N -0.69 0.46 -0.12 1.57 1.57 -1.31 0.31 116.57 118.35 3hk9 h LYS 14 Ca -0.07 -0.03 -0.04 0.00 -1.87 0.00 0.00 60.65 58.64 3hk9 h LYS 14 Cb 0.53 -0.10 -0.00 0.00 0.08 0.00 0.00 32.23 32.73 3hk9 h LYS 14 CO 0.11 0.30 -0.07 -0.97 -0.57 0.00 0.00 179.45 178.25 3hk9 h ASN 15 N 0.47 0.28 -0.20 0.86 -1.24 -0.94 -1.70 115.58 113.11 3hk9 h ASN 15 Ca 0.22 -0.43 -0.00 0.00 0.71 0.00 0.00 56.30 56.79 3hk9 h ASN 15 Cb 0.26 -0.08 -0.01 0.00 0.73 0.00 0.00 38.32 39.22 3hk9 h ASN 15 CO -0.06 0.65 0.12 0.00 -1.29 0.00 0.00 177.43 176.85 3hk9 h ALA 16 N 0.64 0.26 -0.54 1.57 0.00 0.04 -0.86 119.26 120.36 3hk9 h ALA 16 Ca 0.03 -0.04 0.01 0.00 0.00 0.00 0.00 54.91 54.90 3hk9 h ALA 16 Cb 0.55 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.23 3hk9 h ALA 16 CO 0.02 -0.23 0.35 0.28 0.00 0.00 0.00 179.25 179.68 3hk9 h VAL 17 N 0.24 1.13 -0.24 0.00 2.07 -1.00 -1.15 116.25 117.30 3hk9 h VAL 17 Ca 0.07 -0.25 -0.13 0.00 0.82 0.00 0.00 66.70 67.21 3hk9 h VAL 17 Cb 0.03 0.34 -0.01 0.00 -1.52 0.00 0.00 31.29 30.13 3hk9 h VAL 17 CO -0.01 0.13 -0.41 0.78 0.02 0.00 0.00 177.57 178.08 3hk9 h ASN 18 N 0.72 0.60 0.95 0.57 -0.26 -1.12 -3.17 115.58 113.87 3hk9 h ASN 18 Ca 0.20 -0.27 0.00 0.00 -0.56 0.00 0.00 56.30 55.67 3hk9 h ASN 18 Cb -0.07 -0.17 0.00 0.00 -1.06 0.00 0.00 38.32 37.02 3hk9 h ASN 18 CO -0.05 0.94 -0.30 0.59 -1.06 0.00 0.00 177.43 177.55 3hk9 n ASN 19 N -4.03 0.51 -4.65 5.81 3.02 -0.34 -4.87 115.26 110.71 3hk9 n ASN 19 Ca -0.02 0.23 -0.43 0.00 -0.03 0.00 0.00 54.58 54.34 3hk9 n ASN 19 Cb 0.52 -0.20 -0.02 0.00 -0.61 0.00 0.00 39.78 39.47 3hk9 n ASN 19 CO 0.00 0.00 0.00 -1.58 -2.62 0.00 0.00 177.26 173.06 3hk9 s GLN 20 N -3.07 4.08 0.26 3.52 2.00 -0.45 -4.96 119.66 121.04 3hk9 s GLN 20 Ca 0.10 1.83 -0.30 0.00 -2.00 0.00 0.00 55.36 54.99 3hk9 s GLN 20 Cb 0.15 -3.92 -0.11 0.00 0.80 0.00 0.00 33.01 29.94 3hk9 s GLN 20 CO 0.64 -0.93 1.52 -2.14 -0.50 0.00 0.00 175.29 173.88 3hk9 s PRO 21 N 4.04 4.20 -0.13 1.67 0.02 -1.26 -4.92 135.00 138.61 3hk9 s PRO 21 Ca 0.66 2.43 -0.07 0.00 0.02 0.00 0.00 61.00 64.04 3hk9 s PRO 21 Cb -0.26 -3.07 -0.04 0.00 0.02 0.00 0.00 34.50 31.14 3hk9 s PRO 21 CO 0.24 -0.53 0.14 0.08 -0.33 0.00 0.00 177.00 176.60 3hk9 s VAL 22 N 0.10 5.47 -0.34 3.83 1.01 0.39 -4.67 120.40 126.21 3hk9 s VAL 22 Ca 0.62 0.20 -0.09 0.00 0.00 0.00 0.00 61.98 62.71 3hk9 s VAL 22 Cb -0.45 -3.40 0.02 0.00 0.00 0.00 0.00 36.38 32.56 3hk9 s VAL 22 CO 0.44 0.60 0.14 -0.89 0.00 0.00 0.00 175.10 175.40 3hk9 s THR 23 N -0.87 4.27 -0.73 3.92 2.01 -0.71 -0.73 115.64 122.80 3hk9 s THR 23 Ca 0.14 -0.79 -0.20 0.00 0.31 0.00 0.00 61.69 61.16 3hk9 s THR 23 Cb -0.12 -3.31 0.11 0.00 0.01 0.00 0.00 72.50 69.19 3hk9 s THR 23 CO 0.03 -0.09 0.92 -0.62 -0.69 0.00 0.00 174.62 174.18 3hk9 s ASP 24 N 1.52 6.34 0.00 3.53 -1.08 0.45 -4.73 116.67 122.70 3hk9 s ASP 24 Ca 0.02 -1.52 0.08 0.00 -0.52 0.00 0.00 52.55 50.61 3hk9 s ASP 24 Cb -0.18 -2.37 0.48 0.00 -1.46 0.00 0.00 42.92 39.39 3hk9 s ASP 24 CO 0.05 -1.19 1.14 1.15 0.52 0.00 0.00 175.17 176.84 3hk9 n MET 25 N 6.76 0.80 -3.15 4.34 0.00 -1.26 -0.72 117.12 123.87 3hk9 n MET 25 Ca 0.03 0.00 0.04 0.00 0.00 0.00 0.00 57.70 57.78 3hk9 n MET 25 Cb 0.46 -1.16 -0.01 0.00 0.00 0.00 0.00 33.22 32.51 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 -1.47 0.33 3.17 5.65 -1.26 -4.76 115.29 114.95 3hk9 s HIS 26 Ca 0.12 1.57 0.00 0.00 0.25 0.00 0.00 55.06 57.01 3hk9 s HIS 26 Cb 0.06 0.52 -0.01 0.00 -1.18 0.00 0.00 32.58 31.97 3hk9 s HIS 26 CO 0.09 -0.80 0.39 0.95 -0.65 0.00 0.00 174.74 174.72 3hk9 s THR 27 N 2.87 0.00 -0.23 0.89 -4.23 -0.68 -0.96 115.64 113.31 3hk9 s THR 27 Ca 0.18 -1.74 0.10 0.00 -1.18 0.00 0.00 61.69 59.05 3hk9 s THR 27 Cb -0.14 -2.57 0.43 0.00 1.34 0.00 0.00 72.50 71.55 3hk9 s THR 27 CO -0.20 0.00 1.21 1.41 -0.54 0.00 0.00 174.62 176.50 3hk9 n HIS 28 N -0.56 0.69 -3.41 3.99 8.25 0.23 -2.95 115.22 121.46 3hk9 n HIS 28 Ca 0.03 -1.67 -0.19 0.00 -0.26 0.00 0.00 57.72 55.63 3hk9 n HIS 28 Cb 0.62 -0.27 -0.00 0.00 1.12 0.00 0.00 29.99 31.46 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 -3.28 3.94 0.05 2.41 1.43 -1.17 -4.64 118.68 117.40 3hk9 s LEU 29 Ca 0.41 -0.12 0.01 0.00 -1.03 0.00 0.00 54.13 53.40 3hk9 s LEU 29 Cb 0.38 -2.81 -0.03 0.00 0.03 0.00 0.00 46.19 43.76 3hk9 s LEU 29 CO -0.04 -0.46 -0.05 -0.36 0.23 0.00 0.00 176.35 175.66 3hk9 s PHE 30 N -2.22 0.55 0.26 0.29 0.08 -1.26 -4.37 117.98 111.30 3hk9 s PHE 30 Ca 0.45 -0.68 -0.31 0.00 0.12 0.00 0.00 56.93 56.51 3hk9 s PHE 30 Cb -0.10 -0.35 -0.13 0.00 -0.57 0.00 0.00 43.02 41.88 3hk9 s PHE 30 CO 0.32 -0.18 1.48 0.45 -0.10 0.00 0.00 175.22 177.19 3hk9 n SER 31 N 1.01 3.21 -0.06 1.36 2.88 -1.26 -4.83 113.62 115.93 3hk9 n SER 31 Ca -0.20 1.15 0.24 0.00 -1.33 0.00 0.00 58.87 58.73 3hk9 n SER 31 Cb 0.57 -1.50 0.72 0.00 -0.75 0.00 0.00 64.21 63.25 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 4.42 0.00 0.00 -1.46 0.13 -1.94 0.50 132.00 133.65 3hk9 h PRO 32 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 3hk9 h PRO 32 Cb 1.25 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.38 3hk9 h PRO 32 CO 0.77 0.00 0.00 0.27 -0.23 0.00 0.00 178.00 178.81 3hk9 n ASN 33 N -4.17 0.00 0.09 1.44 6.94 -1.26 -1.84 115.26 116.46 3hk9 n ASN 33 Ca 0.13 0.49 0.13 0.00 -0.02 0.00 0.00 54.58 55.31 3hk9 n ASN 33 Cb 0.78 -0.50 0.45 0.00 -2.36 0.00 0.00 39.78 38.16 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 -1.50 0.70 0.00 -2.53 3.01 0.17 -5.02 117.46 112.29 3hk9 n PHE 34 Ca 0.03 0.22 0.00 0.00 1.01 0.00 0.00 57.45 58.71 3hk9 n PHE 34 Cb 0.13 -0.86 0.00 0.00 -0.01 0.00 0.00 39.48 38.74 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 1.05 -1.07 0.00 1.37 0.00 -0.76 -4.53 105.19 101.25 3hk9 n GLY 35 Ca 0.05 -1.98 0.05 0.00 0.00 0.00 0.00 46.02 44.14 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 0.15 0.30 1.61 1.02 -1.26 -2.22 120.64 120.24 3hk9 n GLU 36 Ca 0.00 0.18 0.18 0.00 -0.02 0.00 0.00 57.16 57.49 3hk9 n GLU 36 Cb 0.00 -1.50 0.96 0.00 -0.02 0.00 0.00 31.44 30.88 3hk9 n GLU 36 CO 0.00 0.00 0.00 0.97 1.18 0.00 0.00 177.13 179.28 3hk9 h ILE 37 N 0.00 0.27 -3.52 -3.67 6.09 -1.97 -3.37 117.51 111.35 3hk9 h ILE 37 Ca 0.00 -0.20 -0.59 0.00 -1.37 0.00 0.00 64.86 62.70 3hk9 h ILE 37 Cb 0.08 1.15 -0.09 0.00 0.47 0.00 0.00 36.82 38.43 3hk9 h ILE 37 CO 0.00 0.03 0.63 -0.22 -3.07 0.00 0.00 178.15 175.52 3hk9 s LEU 38 N -6.81 3.97 0.09 2.19 2.96 -0.94 -4.84 118.68 115.30 3hk9 s LEU 38 Ca -0.04 0.53 -0.15 0.00 -0.22 0.00 0.00 54.13 54.26 3hk9 s LEU 38 Cb 0.13 -3.28 -0.06 0.00 0.50 0.00 0.00 46.19 43.47 3hk9 s LEU 38 CO 0.50 -0.91 0.50 -0.76 -1.32 0.00 0.00 176.35 174.37 3hk9 s LEU 39 N 3.58 4.41 0.01 -0.68 1.43 -1.26 -5.01 118.68 121.16 3hk9 s LEU 39 Ca 0.39 1.05 -0.28 0.00 -1.03 0.00 0.00 54.13 54.26 3hk9 s LEU 39 Cb -0.11 -3.01 0.10 0.00 0.03 0.00 0.00 46.19 43.19 3hk9 s LEU 39 CO 0.20 0.19 0.82 -1.66 0.23 0.00 0.00 176.35 176.13 3hk9 s TRP 40 N -1.30 -0.43 0.00 0.29 1.48 -1.26 -0.96 118.94 116.77 3hk9 s TRP 40 Ca 0.32 0.39 0.00 0.00 -1.06 0.00 0.00 56.10 55.75 3hk9 s TRP 40 Cb -0.16 0.52 0.00 0.00 -1.16 0.00 0.00 33.47 32.67 3hk9 s TRP 40 CO 0.18 -0.59 0.00 -0.40 -4.06 0.00 0.00 176.95 172.07 3hk9 n ASP 41 N -0.02 0.00 -0.15 -2.66 5.68 -1.26 -4.57 116.55 113.56 3hk9 n ASP 41 Ca -0.12 0.00 0.10 0.00 -0.50 0.00 0.00 54.79 54.27 3hk9 n ASP 41 Cb 0.61 0.00 0.43 0.00 -1.14 0.00 0.00 41.12 41.02 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 0.93 -0.38 2.12 6.09 -1.96 -0.57 117.51 123.74 3hk9 h ILE 42 Ca 0.00 -0.20 -0.14 0.00 -1.37 0.00 0.00 64.86 63.16 3hk9 h ILE 42 Cb 0.00 0.30 -0.01 0.00 0.47 0.00 0.00 36.82 37.58 3hk9 h ILE 42 CO 0.00 0.11 -0.30 0.44 -3.07 0.00 0.00 178.15 175.33 3hk9 h ASP 43 N 0.58 0.87 -0.41 2.19 3.32 -1.96 -0.89 116.42 120.13 3hk9 h ASP 43 Ca 0.32 -0.36 -0.04 0.00 0.02 0.00 0.00 57.03 56.97 3hk9 h ASP 43 Cb 0.49 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.78 3hk9 h ASP 43 CO -0.11 1.10 0.08 -0.33 -1.72 0.00 0.00 179.24 178.27 3hk9 h GLU 44 N 0.71 0.67 -0.37 3.56 4.39 -1.55 -2.26 114.58 119.73 3hk9 h GLU 44 Ca 0.08 -0.17 0.04 0.00 0.34 0.00 0.00 59.36 59.65 3hk9 h GLU 44 Cb 0.85 -0.08 -0.04 0.00 -0.10 0.00 0.00 28.75 29.38 3hk9 h GLU 44 CO 0.07 0.70 0.14 -0.07 -1.16 0.00 0.00 179.01 178.69 3hk9 h LEU 45 N 0.53 0.16 -0.99 1.33 3.38 -0.93 -2.42 115.31 116.37 3hk9 h LEU 45 Ca 0.13 0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.13 3hk9 h LEU 45 Cb 0.34 0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.11 3hk9 h LEU 45 CO 0.00 0.13 0.00 -0.07 0.09 0.00 0.00 178.44 178.60 3hk9 h LEU 46 N 0.30 0.00 -2.97 1.67 3.38 -0.99 -2.96 115.31 113.74 3hk9 h LEU 46 Ca 0.17 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.14 3hk9 h LEU 46 Cb 0.13 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.88 3hk9 h LEU 46 CO -0.16 0.00 0.00 0.35 0.09 0.00 0.00 178.44 178.72 3hk9 n THR 47 N -2.59 1.35 -1.64 0.22 -2.24 -0.86 -4.74 114.28 103.78 3hk9 n THR 47 Ca 0.02 -1.17 -0.43 0.00 -2.27 0.00 0.00 64.05 60.20 3hk9 n THR 47 Cb 0.27 0.32 -0.00 0.00 -2.10 0.00 0.00 70.33 68.81 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 0.63 1.63 0.31 4.78 9.36 -1.02 -4.71 117.16 128.15 3hk9 n TYR 48 Ca 0.18 0.59 0.21 0.00 3.32 0.00 0.00 57.90 62.20 3hk9 n TYR 48 Cb 0.61 -2.31 1.12 0.00 -0.63 0.00 0.00 39.34 38.14 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 2.03 0.00 -0.58 2.98 2.07 -1.92 -0.62 115.15 119.12 3hk9 h HIS 49 Ca -0.44 0.00 -0.07 0.00 -2.85 0.00 0.00 60.37 57.02 3hk9 h HIS 49 Cb 1.32 0.00 -0.02 0.00 2.57 0.00 0.00 27.41 31.27 3hk9 h HIS 49 CO 0.47 0.00 0.09 1.88 -3.07 0.00 0.00 177.93 177.31 3hk9 h TYR 50 N 0.00 0.97 0.00 6.12 -1.99 -1.95 -1.92 116.97 118.20 3hk9 h TYR 50 Ca 0.00 -0.12 -0.15 0.00 2.00 0.00 0.00 58.73 60.47 3hk9 h TYR 50 Cb 0.01 -0.27 -0.02 0.00 2.00 0.00 0.00 36.73 38.45 3hk9 h TYR 50 CO 0.00 0.83 -0.69 -0.07 -0.00 0.00 0.00 178.16 178.22 3hk9 h LEU 51 N 0.87 0.00 -0.24 3.88 3.38 -1.43 -2.70 115.31 119.07 3hk9 h LEU 51 Ca 0.18 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.12 3hk9 h LEU 51 Cb 0.38 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.12 3hk9 h LEU 51 CO 0.01 0.69 0.02 0.58 0.09 0.00 0.00 178.44 179.83 3hk9 h VAL 52 N 0.00 1.25 -0.68 1.22 2.07 -1.18 0.13 116.25 119.06 3hk9 h VAL 52 Ca -0.01 -0.85 0.01 0.00 0.82 0.00 0.00 66.70 66.68 3hk9 h VAL 52 Cb 1.46 1.33 -0.04 0.00 -1.52 0.00 0.00 31.29 32.53 3hk9 h VAL 52 CO 0.09 0.27 0.44 0.00 0.02 0.00 0.00 177.57 178.39 3hk9 h ALA 53 N 0.83 0.86 -0.29 1.67 0.00 -1.37 -2.26 119.26 118.70 3hk9 h ALA 53 Ca 0.07 -0.04 -0.11 0.00 0.00 0.00 0.00 54.91 54.83 3hk9 h ALA 53 Cb 0.38 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 3hk9 h ALA 53 CO 0.01 0.26 -0.24 0.93 0.00 0.00 0.00 179.25 180.21 3hk9 h GLU 54 N 0.89 0.68 -0.25 0.00 5.08 -1.26 -3.13 114.58 116.59 3hk9 h GLU 54 Ca 0.25 -0.34 -0.05 0.00 -1.00 0.00 0.00 59.36 58.23 3hk9 h GLU 54 Cb -0.07 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.17 3hk9 h GLU 54 CO -0.07 0.94 -0.06 -0.24 -1.00 0.00 0.00 179.01 178.59 3hk9 h VAL 55 N 0.43 1.18 0.00 3.13 3.04 -0.62 -2.17 116.25 121.24 3hk9 h VAL 55 Ca 0.05 -0.76 0.00 0.00 -1.01 0.00 0.00 66.70 64.98 3hk9 h VAL 55 Cb 0.79 1.06 0.00 0.00 -2.01 0.00 0.00 31.29 31.13 3hk9 h VAL 55 CO 0.06 0.25 0.00 0.24 -1.01 0.00 0.00 177.57 177.11 3hk9 h MET 56 N 0.37 0.00 -0.00 4.17 2.86 -1.35 -0.26 114.93 120.72 3hk9 h MET 56 Ca 0.08 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.72 3hk9 h MET 56 Cb 0.34 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.00 3hk9 h MET 56 CO 0.01 0.00 -0.13 0.54 1.06 0.00 0.00 176.91 178.40 3hk9 n ARG 57 N -2.62 0.02 0.01 1.72 1.74 -0.82 -4.51 116.66 112.21 3hk9 n ARG 57 Ca -0.01 -0.00 -0.03 0.00 -0.77 0.00 0.00 57.85 57.04 3hk9 n ARG 57 Cb 0.13 -1.50 -0.01 0.00 -1.02 0.00 0.00 32.46 30.06 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 -1.49 0.00 -1.85 -1.55 7.02 -0.19 -5.08 117.44 114.31 3hk9 n TRP 58 Ca 0.07 0.00 -0.38 0.00 -1.02 0.00 0.00 57.50 56.17 3hk9 n TRP 58 Cb 0.34 -0.13 0.04 0.00 -2.42 0.00 0.00 31.31 29.14 3hk9 n TRP 58 CO 0.00 0.00 0.00 -0.08 -2.02 0.00 0.00 177.69 175.59 3hk9 s THR 59 N -2.18 2.23 -2.00 -0.99 -1.32 -0.71 -4.92 115.64 105.75 3hk9 s THR 59 Ca -0.07 0.17 0.15 0.00 -1.21 0.00 0.00 61.69 60.73 3hk9 s THR 59 Cb 0.01 -3.08 0.43 0.00 -1.51 0.00 0.00 72.50 68.35 3hk9 s THR 59 CO 0.09 -0.01 1.36 -0.90 -2.21 0.00 0.00 174.62 172.95 3hk9 n ASP 60 N -1.14 2.60 -4.72 8.08 3.85 -1.26 -4.87 116.55 119.10 3hk9 n ASP 60 Ca 0.11 -2.00 -0.42 0.00 -0.71 0.00 0.00 54.79 51.77 3hk9 n ASP 60 Cb 0.46 -0.33 -0.03 0.00 -1.35 0.00 0.00 41.12 39.87 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 -1.35 4.10 0.61 2.12 1.01 -1.26 -5.00 120.40 120.63 3hk9 s VAL 61 Ca 0.32 1.56 -0.17 0.00 0.00 0.00 0.00 61.98 63.70 3hk9 s VAL 61 Cb 0.17 -4.00 -0.02 0.00 0.00 0.00 0.00 36.38 32.53 3hk9 s VAL 61 CO 0.22 0.15 1.14 -0.94 0.00 0.00 0.00 175.10 175.67 3hk9 s SER 62 N 0.80 5.26 0.44 3.32 1.04 -1.26 -4.85 113.70 118.45 3hk9 s SER 62 Ca 0.56 2.14 0.12 0.00 0.48 0.00 0.00 55.95 59.25 3hk9 s SER 62 Cb -0.28 -2.57 0.98 0.00 0.10 0.00 0.00 66.02 64.25 3hk9 s SER 62 CO 0.30 -1.53 2.02 -0.29 0.98 0.00 0.00 173.24 174.72 3hk9 h ILE 63 N 0.53 1.10 -0.52 -1.02 6.09 -1.96 -0.62 117.51 121.12 3hk9 h ILE 63 Ca -0.48 -0.43 -0.10 0.00 -1.37 0.00 0.00 64.86 62.48 3hk9 h ILE 63 Cb 1.26 1.07 -0.02 0.00 0.47 0.00 0.00 36.82 39.60 3hk9 h ILE 63 CO 0.55 0.14 -0.07 -0.33 -3.07 0.00 0.00 178.15 175.37 3hk9 h GLU 64 N 0.16 0.96 -0.17 2.19 3.07 -1.92 -2.02 114.58 116.86 3hk9 h GLU 64 Ca 0.04 -0.34 -0.10 0.00 -0.50 0.00 0.00 59.36 58.46 3hk9 h GLU 64 Cb 0.19 -0.07 -0.01 0.00 -0.84 0.00 0.00 28.75 28.01 3hk9 h GLU 64 CO 0.01 1.01 -0.32 0.00 -1.40 0.00 0.00 179.01 178.30 3hk9 h ALA 65 N 0.92 1.14 -0.20 3.43 0.00 -1.69 -1.91 119.26 120.95 3hk9 h ALA 65 Ca 0.14 -0.37 -0.01 0.00 0.00 0.00 0.00 54.91 54.67 3hk9 h ALA 65 Cb 0.62 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 3hk9 h ALA 65 CO 0.04 0.55 0.08 0.35 0.00 0.00 0.00 179.25 180.27 3hk9 h PHE 66 N 0.29 0.31 0.00 0.00 3.57 -0.76 -1.72 116.94 118.62 3hk9 h PHE 66 Ca 0.04 -0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.48 3hk9 h PHE 66 Cb 0.72 -0.09 -0.00 0.00 2.79 0.00 0.00 35.95 39.36 3hk9 h PHE 66 CO 0.02 0.35 -0.16 -1.49 -2.23 0.00 0.00 178.31 174.79 3hk9 h TRP 67 N 0.17 0.00 -0.19 0.41 -0.00 -1.21 -3.00 115.95 112.13 3hk9 h TRP 67 Ca 0.07 0.00 -0.10 0.00 -0.00 0.00 0.00 58.89 58.86 3hk9 h TRP 67 Cb 0.17 0.00 -0.00 0.00 -0.00 0.00 0.00 29.16 29.33 3hk9 h TRP 67 CO -0.01 0.16 -0.26 0.00 -0.00 0.00 0.00 178.44 178.33 3hk9 h ALA 68 N 1.84 0.28 -2.31 1.49 0.00 -0.58 -3.45 119.26 116.52 3hk9 h ALA 68 Ca -0.00 -0.39 -0.52 0.00 0.00 0.00 0.00 54.91 54.00 3hk9 h ALA 68 Cb 0.44 -0.05 0.15 0.00 0.00 0.00 0.00 17.79 18.33 3hk9 h ALA 68 CO 0.02 0.27 0.29 0.00 0.00 0.00 0.00 179.25 179.83 3hk9 s MET 69 N -4.18 1.85 1.05 0.00 0.23 -0.72 -5.01 119.30 112.51 3hk9 s MET 69 Ca -0.13 1.32 -0.13 0.00 -1.03 0.00 0.00 55.69 55.72 3hk9 s MET 69 Cb 0.06 -1.84 0.21 0.00 -1.53 0.00 0.00 34.83 31.74 3hk9 s MET 69 CO 0.79 -1.97 1.08 -1.54 -2.03 0.00 0.00 175.02 171.35 3hk9 s SER 70 N -3.09 2.19 0.15 -1.18 1.04 -1.26 -4.74 113.70 106.81 3hk9 s SER 70 Ca 0.64 1.17 -0.16 0.00 0.48 0.00 0.00 55.95 58.08 3hk9 s SER 70 Cb -0.19 -1.84 0.03 0.00 0.10 0.00 0.00 66.02 64.12 3hk9 s SER 70 CO 0.56 -3.40 1.80 0.50 0.98 0.00 0.00 173.24 173.68 3hk9 h LYS 71 N -2.08 0.45 -0.91 4.02 3.64 -1.95 -0.47 116.57 119.27 3hk9 h LYS 71 Ca -0.56 -0.03 0.01 0.00 -1.27 0.00 0.00 60.65 58.80 3hk9 h LYS 71 Cb 1.33 -0.10 -0.05 0.00 -0.41 0.00 0.00 32.23 33.01 3hk9 h LYS 71 CO 0.56 0.30 0.60 -0.09 -2.27 0.00 0.00 179.45 178.55 3hk9 h ARG 72 N 0.47 1.21 -0.58 1.90 2.43 -1.94 -0.55 114.38 117.31 3hk9 h ARG 72 Ca 0.15 -0.08 -0.10 0.00 -0.81 0.00 0.00 59.98 59.15 3hk9 h ARG 72 Cb 0.00 -0.27 -0.02 0.00 -0.42 0.00 0.00 29.97 29.26 3hk9 h ARG 72 CO -0.07 0.80 -0.03 0.93 -1.51 0.00 0.00 179.97 180.10 3hk9 h GLU 73 N 1.24 1.04 -0.52 0.20 5.08 -1.78 -0.73 114.58 119.11 3hk9 h GLU 73 Ca 0.33 -0.35 -0.01 0.00 -1.00 0.00 0.00 59.36 58.34 3hk9 h GLU 73 Cb -0.14 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.00 3hk9 h GLU 73 CO -0.07 1.04 0.28 1.96 -1.00 0.00 0.00 179.01 181.22 3hk9 h GLN 74 N 0.93 0.73 -0.68 2.33 4.20 -0.60 -1.40 115.11 120.63 3hk9 h GLN 74 Ca 0.16 -0.09 -0.00 0.00 0.06 0.00 0.00 58.65 58.78 3hk9 h GLN 74 Cb 0.59 -0.14 -0.03 0.00 0.30 0.00 0.00 27.48 28.19 3hk9 h GLN 74 CO 0.04 0.57 0.42 0.00 -0.67 0.00 0.00 178.83 179.19 3hk9 h ALA 75 N 1.12 0.87 -0.60 3.87 0.00 -0.85 -1.44 119.26 122.23 3hk9 h ALA 75 Ca 0.18 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 3hk9 h ALA 75 Cb 0.06 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.55 3hk9 h ALA 75 CO -0.03 0.34 0.34 -0.44 0.00 0.00 0.00 179.25 179.46 3hk9 h ASP 76 N 0.93 0.73 -0.29 0.00 3.32 -0.71 -1.34 116.42 119.06 3hk9 h ASP 76 Ca 0.25 -0.08 -0.03 0.00 0.02 0.00 0.00 57.03 57.19 3hk9 h ASP 76 Cb -0.04 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 39.31 3hk9 h ASP 76 CO -0.05 0.60 0.06 0.25 -1.72 0.00 0.00 179.24 178.38 3hk9 h LEU 77 N 0.81 0.45 -1.03 1.55 5.85 -0.97 -1.82 115.31 120.16 3hk9 h LEU 77 Ca 0.21 -0.25 -0.05 0.00 0.84 0.00 0.00 57.88 58.63 3hk9 h LEU 77 Cb 0.02 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 40.90 3hk9 h LEU 77 CO -0.04 0.59 0.12 0.40 -0.34 0.00 0.00 178.44 179.17 3hk9 h ILE 78 N 0.30 1.23 -0.07 4.05 2.04 -1.13 0.11 117.51 124.03 3hk9 h ILE 78 Ca 0.09 -0.82 -0.01 0.00 1.00 0.00 0.00 64.86 65.12 3hk9 h ILE 78 Cb 0.32 0.68 -0.00 0.00 -0.74 0.00 0.00 36.82 37.08 3hk9 h ILE 78 CO 0.00 0.31 0.01 -0.25 0.00 0.00 0.00 178.15 178.22 3hk9 h TRP 79 N 0.80 0.13 -0.27 1.37 2.91 -1.13 0.69 115.95 120.45 3hk9 h TRP 79 Ca 0.17 -0.02 -0.02 0.00 1.13 0.00 0.00 58.89 60.15 3hk9 h TRP 79 Cb 0.30 -0.04 -0.01 0.00 -0.51 0.00 0.00 29.16 28.90 3hk9 h TRP 79 CO 0.02 0.35 0.08 1.49 -1.03 0.00 0.00 178.44 179.35 3hk9 h GLU 80 N -0.13 0.42 -0.21 2.65 4.57 -1.13 -0.08 114.58 120.68 3hk9 h GLU 80 Ca 0.02 -0.09 -0.12 0.00 -1.18 0.00 0.00 59.36 57.98 3hk9 h GLU 80 Cb 0.30 -0.06 -0.00 0.00 -0.16 0.00 0.00 28.75 28.83 3hk9 h GLU 80 CO 0.00 0.49 -0.36 0.93 -1.18 0.00 0.00 179.01 178.90 3hk9 h GLU 81 N 0.27 0.61 0.00 1.92 4.39 -0.78 0.09 114.58 121.07 3hk9 h GLU 81 Ca 0.09 -0.38 0.00 0.00 0.34 0.00 0.00 59.36 59.41 3hk9 h GLU 81 Cb 0.25 0.04 0.00 0.00 -0.10 0.00 0.00 28.75 28.94 3hk9 h GLU 81 CO -0.00 0.99 -1.35 1.28 -1.16 0.00 0.00 179.01 178.77 3hk9 n LEU 82 N -4.28 0.57 -0.03 1.33 4.77 0.23 -3.93 117.00 115.67 3hk9 n LEU 82 Ca -0.06 -0.22 -0.05 0.00 -0.03 0.00 0.00 56.01 55.65 3hk9 n LEU 82 Cb 0.51 -0.02 -0.03 0.00 -2.33 0.00 0.00 43.42 41.55 3hk9 n LEU 82 CO 0.45 0.12 -0.73 0.49 -1.33 0.00 0.00 177.39 176.39 3hk9 n PHE 83 N -1.86 0.00 -0.08 -1.77 3.72 -0.11 -3.30 117.46 114.06 3hk9 n PHE 83 Ca 0.01 0.00 -0.19 0.00 -0.05 0.00 0.00 57.45 57.22 3hk9 n PHE 83 Cb 0.44 -0.27 -0.12 0.00 -0.94 0.00 0.00 39.48 38.59 3hk9 n PHE 83 CO 0.00 0.00 0.00 0.82 -0.05 0.00 0.00 176.76 177.53 3hk9 h ILE 84 N 0.00 1.24 0.00 4.37 1.08 -1.27 -3.39 117.51 119.53 3hk9 h ILE 84 Ca -0.15 -2.26 -0.01 0.00 -0.39 0.00 0.00 64.86 62.04 3hk9 h ILE 84 Cb 1.24 2.69 -0.00 0.00 -3.07 0.00 0.00 36.82 37.68 3hk9 h ILE 84 CO -0.02 0.46 -0.06 0.11 -0.69 0.00 0.00 178.15 177.94 3hk9 h LYS 85 N -0.92 0.00 -3.34 2.37 1.57 -1.14 -3.45 116.57 111.65 3hk9 h LYS 85 Ca -0.22 0.00 -0.13 0.00 -1.87 0.00 0.00 60.65 58.42 3hk9 h LYS 85 Cb 1.25 0.00 -0.20 0.00 0.08 0.00 0.00 32.23 33.36 3hk9 h LYS 85 CO -0.11 0.06 -0.41 1.03 -0.57 0.00 0.00 179.45 179.45 3hk9 s ARG 86 N -3.34 0.56 0.34 3.15 3.00 -1.25 -5.06 118.95 116.34 3hk9 s ARG 86 Ca 0.05 -0.34 -0.29 0.00 0.00 0.00 0.00 55.73 55.16 3hk9 s ARG 86 Cb 0.07 0.24 -0.10 0.00 0.00 0.00 0.00 34.95 35.15 3hk9 s ARG 86 CO 0.64 -0.14 1.34 -1.12 0.00 0.00 0.00 175.30 176.01 3hk9 s SER 87 N -1.39 6.69 -1.44 0.23 0.01 -1.26 -3.55 113.70 112.99 3hk9 s SER 87 Ca -0.14 2.75 -0.11 0.00 1.31 0.00 0.00 55.95 59.76 3hk9 s SER 87 Cb -0.07 -2.65 -0.05 0.00 0.21 0.00 0.00 66.02 63.46 3hk9 s SER 87 CO 0.02 -0.60 2.60 -0.81 0.41 0.00 0.00 173.24 174.86 3hk9 n PRO 88 N 0.72 3.14 0.01 12.44 -0.04 -1.21 -4.63 135.00 145.43 3hk9 n PRO 88 Ca 0.00 -2.18 0.12 0.00 -0.04 0.00 0.00 63.50 61.41 3hk9 n PRO 88 Cb 0.41 -2.89 0.33 0.00 -0.04 0.00 0.00 33.50 31.31 3hk9 n PRO 88 CO 0.00 0.00 0.00 1.33 -0.04 0.00 0.00 175.50 176.79 3hk9 n VAL 89 N 4.20 0.06 -1.22 0.52 0.24 -1.26 -3.60 118.33 117.26 3hk9 n VAL 89 Ca 0.66 -0.04 -0.31 0.00 -2.04 0.00 0.00 64.34 62.60 3hk9 n VAL 89 Cb 0.27 0.02 0.10 0.00 -1.47 0.00 0.00 33.84 32.76 3hk9 n VAL 89 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 3hk9 s SER 90 N -3.18 4.26 0.24 -1.34 1.04 -1.26 -4.77 113.70 108.68 3hk9 s SER 90 Ca 0.11 1.93 -0.07 0.00 0.48 0.00 0.00 55.95 58.41 3hk9 s SER 90 Cb 0.17 -2.54 0.25 0.00 0.10 0.00 0.00 66.02 64.01 3hk9 s SER 90 CO 0.66 -2.20 1.90 -0.08 0.98 0.00 0.00 173.24 174.50 3hk9 h GLU 91 N -1.11 1.17 -0.21 4.02 4.57 -1.97 0.22 114.58 121.28 3hk9 h GLU 91 Ca -0.44 -0.07 -0.16 0.00 -1.18 0.00 0.00 59.36 57.51 3hk9 h GLU 91 Cb 1.24 -0.26 -0.01 0.00 -0.16 0.00 0.00 28.75 29.56 3hk9 h GLU 91 CO 0.50 0.78 -0.51 0.00 -1.18 0.00 0.00 179.01 178.59 3hk9 h ALA 92 N 1.35 0.71 -0.22 2.92 0.00 -1.95 -0.59 119.26 121.49 3hk9 h ALA 92 Ca 0.35 -0.49 -0.18 0.00 0.00 0.00 0.00 54.91 54.58 3hk9 h ALA 92 Cb -0.08 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.62 3hk9 h ALA 92 CO -0.09 0.68 -0.59 0.00 0.00 0.00 0.00 179.25 179.25 3hk9 h ARG 94 N 0.54 1.21 -0.76 0.00 2.43 -0.87 -2.73 114.38 114.19 3hk9 h ARG 94 Ca 0.00 -0.15 0.02 0.00 -0.81 0.00 0.00 59.98 59.05 3hk9 h ARG 94 Cb 1.17 -0.23 -0.04 0.00 -0.42 0.00 0.00 29.97 30.45 3hk9 h ARG 94 CO 0.12 0.89 0.49 0.78 -1.51 0.00 0.00 179.97 180.74 3hk9 h GLY 95 N 1.20 1.09 0.70 2.80 0.00 -0.87 -1.33 103.07 106.67 3hk9 h GLY 95 Ca 0.30 -0.38 0.04 0.00 0.00 0.00 0.00 47.33 47.29 3hk9 h GLY 95 CO -0.05 0.34 0.14 -2.08 0.00 0.00 0.00 176.54 174.89 3hk9 h VAL 96 N 0.98 0.91 -0.38 4.60 2.07 -1.17 -1.11 116.25 122.15 3hk9 h VAL 96 Ca 0.30 -0.10 0.01 0.00 0.82 0.00 0.00 66.70 67.72 3hk9 h VAL 96 Cb -0.04 0.58 -0.02 0.00 -1.52 0.00 0.00 31.29 30.30 3hk9 h VAL 96 CO -0.09 0.05 0.24 -0.07 0.02 0.00 0.00 177.57 177.72 3hk9 h LEU 97 N 0.30 0.41 -0.87 2.57 3.38 -1.30 -1.89 115.31 117.90 3hk9 h LEU 97 Ca 0.17 -0.01 0.08 0.00 0.09 0.00 0.00 57.88 58.21 3hk9 h LEU 97 Cb 0.13 -0.10 -0.07 0.00 0.09 0.00 0.00 40.66 40.72 3hk9 h LEU 97 CO -0.16 0.30 0.53 0.74 0.09 0.00 0.00 178.44 179.94 3hk9 h THR 98 N 0.49 0.98 -0.15 0.22 2.02 -0.76 -0.39 112.91 115.32 3hk9 h THR 98 Ca 0.14 -0.32 -0.00 0.00 0.77 0.00 0.00 66.41 67.00 3hk9 h THR 98 Cb -0.04 -0.02 -0.01 0.00 -1.74 0.00 0.00 68.15 66.34 3hk9 h THR 98 CO -0.04 0.17 0.09 0.00 0.37 0.00 0.00 175.52 176.11 3hk9 h LEU 100 N 0.16 -0.23 0.06 0.00 3.38 -0.60 -1.92 115.31 116.16 3hk9 h LEU 100 Ca 0.05 0.04 0.01 0.00 0.09 0.00 0.00 57.88 58.07 3hk9 h LEU 100 Cb 0.04 0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 3hk9 h LEU 100 CO -0.01 -0.11 -0.10 -0.61 0.09 0.00 0.00 178.44 177.70 3hk9 h GLN 101 N -0.12 -0.19 -0.41 1.13 4.15 -0.99 -1.21 115.11 117.47 3hk9 h GLN 101 Ca 0.04 0.01 0.12 0.00 0.77 0.00 0.00 58.65 59.59 3hk9 h GLN 101 Cb 0.18 0.04 -0.02 0.00 0.21 0.00 0.00 27.48 27.90 3hk9 h GLN 101 CO -0.11 -0.13 0.34 0.78 -1.93 0.00 0.00 178.83 177.79 3hk9 h GLY 102 N -0.20 0.00 0.90 2.39 0.00 -0.79 0.26 103.07 105.63 3hk9 h GLY 102 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.35 3hk9 h GLY 102 CO -0.06 0.00 -0.09 1.04 0.00 0.00 0.00 176.54 177.43 3hk9 n LEU 103 N -4.11 0.45 0.00 3.11 4.77 -0.74 -4.90 117.00 115.58 3hk9 n LEU 103 Ca 0.07 0.01 0.00 0.00 -0.03 0.00 0.00 56.01 56.05 3hk9 n LEU 103 Cb 0.53 -0.17 0.00 0.00 -2.33 0.00 0.00 43.42 41.45 3hk9 n LEU 103 CO 0.33 0.08 0.00 0.61 -1.33 0.00 0.00 177.39 177.08 3hk9 n GLY 104 N 1.26 0.36 3.86 -0.72 0.00 0.91 -5.07 105.19 105.79 3hk9 n GLY 104 Ca 0.15 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.86 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 3.27 -0.33 0.99 1.43 -0.51 -4.98 118.68 118.54 3hk9 s LEU 105 Ca 0.00 1.46 -0.02 0.00 -1.03 0.00 0.00 54.13 54.54 3hk9 s LEU 105 Cb 0.00 -4.48 0.07 0.00 0.03 0.00 0.00 46.19 41.81 3hk9 s LEU 105 CO 0.00 -0.89 0.05 -0.62 0.23 0.00 0.00 176.35 175.13 3hk9 s ASP 106 N -4.01 4.98 0.34 2.29 2.15 -1.26 -3.73 116.67 117.42 3hk9 s ASP 106 Ca 0.56 -1.52 0.25 0.00 0.43 0.00 0.00 52.55 52.27 3hk9 s ASP 106 Cb -0.11 -1.74 1.17 0.00 -0.30 0.00 0.00 42.92 41.94 3hk9 s ASP 106 CO 0.51 -0.34 1.77 1.55 -0.17 0.00 0.00 175.17 178.49 3hk9 h PRO 107 N 7.99 0.00 -0.60 4.34 0.13 -1.91 -2.91 132.00 139.03 3hk9 h PRO 107 Ca -0.18 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.95 3hk9 h PRO 107 Cb 1.06 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.16 3hk9 h PRO 107 CO 0.57 0.00 0.38 0.00 -0.23 0.00 0.00 178.00 178.72 3hk9 h ALA 108 N 2.14 1.53 0.00 -0.56 0.00 -2.01 -1.76 119.26 118.60 3hk9 h ALA 108 Ca 0.00 -0.06 -0.08 0.00 0.00 0.00 0.00 54.91 54.77 3hk9 h ALA 108 Cb 0.25 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 3hk9 h ALA 108 CO 0.00 0.42 -0.36 1.79 0.00 0.00 0.00 179.25 181.10 3hk9 h THR 109 N 0.83 0.71 -3.34 0.00 1.35 -1.96 -3.47 112.91 107.03 3hk9 h THR 109 Ca 0.22 -1.70 -0.38 0.00 -0.55 0.00 0.00 66.41 63.99 3hk9 h THR 109 Cb -0.06 2.13 -0.01 0.00 -1.73 0.00 0.00 68.15 68.48 3hk9 h THR 109 CO -0.04 0.36 -0.50 0.54 -0.25 0.00 0.00 175.52 175.62 3hk9 n ARG 110 N -3.31 -2.12 -2.96 4.72 1.74 -0.66 -4.90 116.66 109.18 3hk9 n ARG 110 Ca 0.01 0.92 -0.44 0.00 -0.77 0.00 0.00 57.85 57.57 3hk9 n ARG 110 Cb 0.60 -5.59 -0.02 0.00 -1.02 0.00 0.00 32.46 26.43 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 -2.12 6.77 0.28 0.55 -1.08 -1.26 -4.86 116.67 114.96 3hk9 s ASP 111 Ca 0.04 -2.37 -0.03 0.00 -0.52 0.00 0.00 52.55 49.67 3hk9 s ASP 111 Cb -0.02 -2.39 0.41 0.00 -1.46 0.00 0.00 42.92 39.46 3hk9 s ASP 111 CO 0.04 -0.94 1.94 0.25 0.52 0.00 0.00 175.17 176.99 3hk9 h LEU 112 N 10.02 1.00 -0.34 -1.34 5.85 -1.98 -1.73 115.31 126.79 3hk9 h LEU 112 Ca 0.20 -0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.90 3hk9 h LEU 112 Cb 0.98 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 41.75 3hk9 h LEU 112 CO 1.13 0.71 0.22 1.56 -0.34 0.00 0.00 178.44 181.71 3hk9 h GLN 113 N 1.18 0.46 -0.48 1.25 1.08 -2.00 -0.68 115.11 115.92 3hk9 h GLN 113 Ca 0.35 -0.03 -0.03 0.00 -1.45 0.00 0.00 58.65 57.48 3hk9 h GLN 113 Cb -0.06 -0.10 -0.02 0.00 -0.05 0.00 0.00 27.48 27.25 3hk9 h GLN 113 CO -0.09 0.33 0.17 0.28 -0.95 0.00 0.00 178.83 178.57 3hk9 h VAL 114 N 0.45 1.19 -0.22 -0.54 2.07 -1.86 -2.37 116.25 114.97 3hk9 h VAL 114 Ca 0.12 -0.61 -0.02 0.00 0.82 0.00 0.00 66.70 67.01 3hk9 h VAL 114 Cb -0.02 0.64 -0.01 0.00 -1.52 0.00 0.00 31.29 30.37 3hk9 h VAL 114 CO -0.03 0.24 0.07 1.88 0.02 0.00 0.00 177.57 179.75 3hk9 h TYR 115 N 0.69 0.36 -0.26 1.57 0.05 -0.56 -2.78 116.97 116.05 3hk9 h TYR 115 Ca 0.16 -0.04 0.04 0.00 0.05 0.00 0.00 58.73 58.94 3hk9 h TYR 115 Cb 0.17 -0.10 -0.01 0.00 1.01 0.00 0.00 36.73 37.80 3hk9 h TYR 115 CO 0.01 0.42 0.17 0.00 -1.05 0.00 0.00 178.16 177.72 3hk9 h ARG 116 N 0.19 0.19 -0.38 4.88 3.08 -0.79 -1.85 114.38 119.69 3hk9 h ARG 116 Ca 0.07 -0.01 -0.06 0.00 0.07 0.00 0.00 59.98 60.05 3hk9 h ARG 116 Cb 0.24 -0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.23 3hk9 h ARG 116 CO -0.00 0.12 -0.03 0.93 -1.07 0.00 0.00 179.97 179.92 3hk9 h GLU 117 N 0.19 0.61 -0.32 0.04 5.08 -1.15 -2.59 114.58 116.45 3hk9 h GLU 117 Ca 0.11 -0.15 0.05 0.00 -1.00 0.00 0.00 59.36 58.37 3hk9 h GLU 117 Cb 0.20 -0.08 -0.05 0.00 0.50 0.00 0.00 28.75 29.33 3hk9 h GLU 117 CO -0.02 0.65 0.04 -0.92 -1.00 0.00 0.00 179.01 177.77 3hk9 h TYR 118 N 0.57 0.06 -0.01 4.33 3.20 -1.30 -2.76 116.97 121.07 3hk9 h TYR 118 Ca 0.12 0.02 -0.11 0.00 3.14 0.00 0.00 58.73 61.90 3hk9 h TYR 118 Cb 0.41 0.02 -0.01 0.00 1.54 0.00 0.00 36.73 38.68 3hk9 h TYR 118 CO 0.02 -0.01 -0.50 0.74 -1.64 0.00 0.00 178.16 176.78 3hk9 h PHE 119 N 0.15 0.02 0.00 -3.82 0.04 -1.55 -3.16 116.94 108.61 3hk9 h PHE 119 Ca 0.15 -0.01 -0.06 0.00 2.80 0.00 0.00 57.97 60.85 3hk9 h PHE 119 Cb 0.18 -0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.32 3hk9 h PHE 119 CO -0.19 0.51 -0.31 0.00 -0.60 0.00 0.00 178.31 177.72 3hk9 h ALA 120 N 1.49 1.21 -0.36 2.45 0.00 -1.17 -2.96 119.26 119.92 3hk9 h ALA 120 Ca -0.00 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.63 3hk9 h ALA 120 Cb 0.88 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.62 3hk9 h ALA 120 CO 0.07 0.39 0.00 0.36 0.00 0.00 0.00 179.25 180.06 3hk9 n LYS 121 N -3.77 2.58 -4.22 0.00 2.85 -1.17 -4.91 118.16 109.53 3hk9 n LYS 121 Ca -0.01 -1.60 -0.16 0.00 -1.05 0.00 0.00 58.31 55.49 3hk9 n LYS 121 Cb 0.40 -1.64 -0.11 0.00 -0.65 0.00 0.00 35.03 33.04 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 -1.73 0.96 0.52 -1.58 1.02 -1.12 -5.13 119.74 112.69 3hk9 s LYS 122 Ca 0.29 -1.25 0.04 0.00 0.02 0.00 0.00 55.97 55.06 3hk9 s LYS 122 Cb 0.19 -0.70 0.03 0.00 -0.52 0.00 0.00 37.83 36.83 3hk9 s LYS 122 CO 0.13 0.12 0.72 0.95 -0.92 0.00 0.00 175.35 176.35 3hk9 s THR 123 N -2.51 2.73 0.15 2.17 -4.23 -1.26 -4.97 115.64 107.72 3hk9 s THR 123 Ca 0.09 -0.78 -0.13 0.00 -1.18 0.00 0.00 61.69 59.69 3hk9 s THR 123 Cb -0.03 -2.94 0.03 0.00 1.34 0.00 0.00 72.50 70.90 3hk9 s THR 123 CO 0.01 0.00 1.66 0.28 -0.54 0.00 0.00 174.62 176.04 3hk9 h SER 124 N 0.23 0.74 -0.78 3.99 0.02 -1.98 -2.37 113.55 113.41 3hk9 h SER 124 Ca -0.41 -0.22 -0.02 0.00 -0.84 0.00 0.00 61.79 60.30 3hk9 h SER 124 Cb 1.29 -0.20 -0.04 0.00 0.14 0.00 0.00 62.40 63.60 3hk9 h SER 124 CO 0.49 0.77 0.41 -0.33 -1.14 0.00 0.00 176.83 177.02 3hk9 h GLU 125 N 0.68 1.09 -0.44 3.45 3.07 -1.95 -1.69 114.58 118.80 3hk9 h GLU 125 Ca 0.16 -0.14 -0.09 0.00 -0.50 0.00 0.00 59.36 58.79 3hk9 h GLU 125 Cb 0.30 -0.21 -0.01 0.00 -0.84 0.00 0.00 28.75 27.99 3hk9 h GLU 125 CO -0.00 0.82 -0.06 0.93 -1.40 0.00 0.00 179.01 179.30 3hk9 h GLU 126 N 1.08 0.81 -0.70 2.33 5.08 -1.93 -2.53 114.58 118.72 3hk9 h GLU 126 Ca 0.27 -0.29 -0.07 0.00 -1.00 0.00 0.00 59.36 58.27 3hk9 h GLU 126 Cb 0.06 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.23 3hk9 h GLU 126 CO -0.04 0.91 0.18 0.37 -1.00 0.00 0.00 179.01 179.42 3hk9 h GLN 127 N 0.64 1.11 -0.44 2.33 5.75 -1.22 0.76 115.11 124.04 3hk9 h GLN 127 Ca 0.12 -0.26 -0.08 0.00 -0.15 0.00 0.00 58.65 58.27 3hk9 h GLN 127 Cb 0.58 -0.15 -0.02 0.00 1.07 0.00 0.00 27.48 28.96 3hk9 h GLN 127 CO 0.03 0.98 -0.06 -0.39 -2.65 0.00 0.00 178.83 176.75 3hk9 h VAL 128 N 1.05 1.25 -0.10 2.39 -1.51 -1.26 0.58 116.25 118.64 3hk9 h VAL 128 Ca 0.22 -1.08 -0.00 0.00 -1.23 0.00 0.00 66.70 64.61 3hk9 h VAL 128 Cb 0.36 0.97 -0.00 0.00 -2.13 0.00 0.00 31.29 30.49 3hk9 h VAL 128 CO 0.00 0.37 0.06 0.44 -1.23 0.00 0.00 177.57 177.21 3hk9 h ASP 129 N 0.70 0.12 0.30 4.19 3.32 -1.00 0.29 116.42 124.34 3hk9 h ASP 129 Ca 0.13 -0.07 -0.01 0.00 0.02 0.00 0.00 57.03 57.10 3hk9 h ASP 129 Cb 0.52 -0.03 -0.01 0.00 0.22 0.00 0.00 39.33 40.03 3hk9 h ASP 129 CO 0.03 0.16 -0.20 0.74 -1.72 0.00 0.00 179.24 178.25 3hk9 h THR 130 N 0.08 0.58 -0.18 0.35 2.02 -0.28 -2.15 112.91 113.33 3hk9 h THR 130 Ca 0.04 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.21 3hk9 h THR 130 Cb 0.06 0.58 -0.01 0.00 -1.74 0.00 0.00 68.15 67.05 3hk9 h THR 130 CO -0.01 0.00 0.08 0.58 0.37 0.00 0.00 175.52 176.54 3hk9 h VAL 131 N -0.49 1.15 0.00 3.16 2.07 0.21 -0.48 116.25 121.87 3hk9 h VAL 131 Ca -0.03 -0.44 -0.01 0.00 0.82 0.00 0.00 66.70 67.04 3hk9 h VAL 131 Cb 0.41 1.11 -0.00 0.00 -1.52 0.00 0.00 31.29 31.29 3hk9 h VAL 131 CO 0.02 0.14 -0.07 -0.07 0.02 0.00 0.00 177.57 177.62 3hk9 h LEU 132 N 0.15 0.00 -0.01 2.57 3.38 -0.95 0.40 115.31 120.84 3hk9 h LEU 132 Ca 0.06 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.96 3hk9 h LEU 132 Cb 0.15 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.91 3hk9 h LEU 132 CO -0.01 0.07 -0.28 -0.61 0.09 0.00 0.00 178.44 177.70 3hk9 h GLN 133 N 0.00 0.21 -0.67 1.13 -0.00 -1.03 -1.51 115.11 113.24 3hk9 h GLN 133 Ca -0.00 -0.21 -0.04 0.00 -0.00 0.00 0.00 58.65 58.40 3hk9 h GLN 133 Cb 0.12 0.06 -0.03 0.00 0.00 0.00 0.00 27.48 27.62 3hk9 h GLN 133 CO 0.01 0.92 0.26 -0.07 0.00 0.00 0.00 178.83 179.94 3hk9 h LEU 134 N -0.42 0.92 -0.74 -2.39 3.38 -0.52 -2.52 115.31 113.02 3hk9 h LEU 134 Ca -0.03 -0.13 0.00 0.00 0.09 0.00 0.00 57.88 57.80 3hk9 h LEU 134 Cb 1.01 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 41.52 3hk9 h LEU 134 CO 0.06 0.83 -0.06 0.00 0.09 0.00 0.00 178.44 179.35 3hk9 n ALA 135 N -2.45 2.70 -3.88 1.53 0.00 0.08 -4.94 120.51 113.55 3hk9 n ALA 135 Ca 0.06 -0.41 -0.26 0.00 0.00 0.00 0.00 53.44 52.84 3hk9 n ALA 135 Cb 0.18 -1.20 0.01 0.00 0.00 0.00 0.00 19.45 18.44 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 -0.16 -1.63 -4.45 0.00 5.15 -0.83 -4.79 115.26 108.56 3hk9 n ASN 136 Ca 0.18 -0.90 -0.37 0.00 -0.60 0.00 0.00 54.58 52.89 3hk9 n ASN 136 Cb 0.33 -3.52 -0.13 0.00 -0.53 0.00 0.00 39.78 35.93 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 -3.69 4.32 -0.10 3.44 1.01 -0.63 -0.46 120.40 124.29 3hk9 s VAL 137 Ca 0.18 -0.18 0.12 0.00 0.00 0.00 0.00 61.98 62.11 3hk9 s VAL 137 Cb -0.09 -3.02 -0.24 0.00 0.00 0.00 0.00 36.38 33.03 3hk9 s VAL 137 CO 0.86 0.33 0.46 -1.54 0.00 0.00 0.00 175.10 175.20 3hk9 n SER 138 N 4.93 0.77 -3.84 3.32 3.41 0.09 -4.74 113.62 117.55 3hk9 n SER 138 Ca -0.16 0.27 -0.16 0.00 -0.26 0.00 0.00 58.87 58.56 3hk9 n SER 138 Cb 0.51 0.15 -0.16 0.00 -0.26 0.00 0.00 64.21 64.46 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 -6.01 0.38 -0.13 4.04 1.01 -1.07 -4.72 116.67 110.15 3hk9 s ASP 139 Ca -0.08 -0.03 0.02 0.00 0.71 0.00 0.00 52.55 53.17 3hk9 s ASP 139 Cb 0.07 -0.17 0.01 0.00 1.01 0.00 0.00 42.92 43.84 3hk9 s ASP 139 CO 0.82 -0.07 -0.22 -0.69 0.21 0.00 0.00 175.17 175.22 3hk9 s VAL 140 N 0.74 2.13 -0.24 -1.27 1.01 0.26 -0.41 120.40 122.63 3hk9 s VAL 140 Ca -0.07 -0.96 -0.13 0.00 0.00 0.00 0.00 61.98 60.82 3hk9 s VAL 140 Cb -0.10 -1.85 -0.05 0.00 0.00 0.00 0.00 36.38 34.38 3hk9 s VAL 140 CO -0.01 0.55 0.26 -0.69 0.00 0.00 0.00 175.10 175.20 3hk9 s VAL 141 N 0.73 5.29 0.89 2.92 1.01 0.10 -0.54 120.40 130.80 3hk9 s VAL 141 Ca -0.09 0.37 -0.10 0.00 0.00 0.00 0.00 61.98 62.16 3hk9 s VAL 141 Cb -0.16 -3.59 0.19 0.00 0.00 0.00 0.00 36.38 32.82 3hk9 s VAL 141 CO 0.00 0.28 1.22 -0.04 0.00 0.00 0.00 175.10 176.56 3hk9 s MET 142 N 1.35 0.86 -0.31 2.72 -1.94 0.77 -1.69 119.30 121.05 3hk9 s MET 142 Ca 0.12 -0.79 0.03 0.00 -1.71 0.00 0.00 55.69 53.33 3hk9 s MET 142 Cb -0.14 -2.03 0.09 0.00 2.01 0.00 0.00 34.83 34.76 3hk9 s MET 142 CO 0.07 -2.16 0.03 0.99 -0.01 0.00 0.00 175.02 173.94 3hk9 s THR 143 N -3.64 1.94 -0.37 2.05 2.01 -1.15 -3.71 115.64 112.76 3hk9 s THR 143 Ca 0.73 -1.98 -0.10 0.00 0.31 0.00 0.00 61.69 60.65 3hk9 s THR 143 Cb -0.03 -2.37 0.04 0.00 0.01 0.00 0.00 72.50 70.14 3hk9 s THR 143 CO 0.50 -0.49 0.19 0.20 -0.69 0.00 0.00 174.62 174.33 3hk9 s ASN 144 N 1.10 5.63 -0.50 3.53 -0.87 -0.26 -4.94 114.94 118.63 3hk9 s ASN 144 Ca 0.07 -1.08 -0.15 0.00 -1.57 0.00 0.00 52.86 50.12 3hk9 s ASN 144 Cb -0.19 -1.98 0.10 0.00 -0.02 0.00 0.00 41.25 39.16 3hk9 s ASN 144 CO -0.10 -0.39 0.43 -0.62 -2.57 0.00 0.00 177.10 173.85 3hk9 s ASP 145 N 1.57 6.15 0.52 -1.22 2.15 -1.26 -0.90 116.67 123.67 3hk9 s ASP 145 Ca 0.01 -1.53 0.35 0.00 0.43 0.00 0.00 52.55 51.81 3hk9 s ASP 145 Cb -0.20 -2.19 1.86 0.00 -0.30 0.00 0.00 42.92 42.10 3hk9 s ASP 145 CO 0.05 -0.73 2.06 1.55 -0.17 0.00 0.00 175.17 177.93 3hk9 h PRO 146 N 8.80 0.00 0.00 4.34 0.13 -1.96 -1.65 132.00 141.66 3hk9 h PRO 146 Ca -0.29 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.84 3hk9 h PRO 146 Cb 1.10 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.23 3hk9 h PRO 146 CO 0.94 0.00 -0.08 1.19 -0.23 0.00 0.00 178.00 179.82 3hk9 n PHE 147 N -2.73 0.71 -2.84 1.56 3.72 -1.26 -4.48 117.46 112.13 3hk9 n PHE 147 Ca -0.02 0.21 -0.42 0.00 -0.05 0.00 0.00 57.45 57.16 3hk9 n PHE 147 Cb 0.07 -0.82 -0.04 0.00 -0.94 0.00 0.00 39.48 37.75 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 -4.19 6.82 0.27 4.37 2.15 -0.62 -4.93 116.67 120.54 3hk9 s ASP 148 Ca 0.11 0.95 -0.01 0.00 0.43 0.00 0.00 52.55 54.03 3hk9 s ASP 148 Cb 0.14 -2.46 0.61 0.00 -0.30 0.00 0.00 42.92 40.91 3hk9 s ASP 148 CO 0.60 -0.63 1.67 0.44 -0.17 0.00 0.00 175.17 177.08 3hk9 h ASP 149 N 7.88 0.08 0.39 -0.34 3.32 -1.88 -0.63 116.42 125.24 3hk9 h ASP 149 Ca -0.23 0.17 -0.11 0.00 0.02 0.00 0.00 57.03 56.88 3hk9 h ASP 149 Cb 1.08 0.21 -0.01 0.00 0.22 0.00 0.00 39.33 40.83 3hk9 h ASP 149 CO 0.92 -0.07 -0.47 0.78 -1.72 0.00 0.00 179.24 178.68 3hk9 h ASN 150 N 0.28 0.11 0.17 6.45 2.35 -1.95 -2.97 115.58 120.01 3hk9 h ASN 150 Ca 0.50 -0.05 -0.22 0.00 -0.55 0.00 0.00 56.30 55.97 3hk9 h ASN 150 Cb 0.93 -0.03 0.02 0.00 0.05 0.00 0.00 38.32 39.29 3hk9 h ASN 150 CO -0.57 0.57 -0.98 -0.33 -1.65 0.00 0.00 177.43 174.47 3hk9 h GLU 151 N 0.08 0.35 -0.96 0.81 5.08 -1.53 -3.34 114.58 115.08 3hk9 h GLU 151 Ca 0.00 -0.60 0.11 0.00 -1.00 0.00 0.00 59.36 57.87 3hk9 h GLU 151 Cb 0.87 0.22 -0.07 0.00 0.50 0.00 0.00 28.75 30.27 3hk9 h GLU 151 CO 0.07 1.29 0.61 -0.09 -1.00 0.00 0.00 179.01 179.89 3hk9 h ARG 152 N -0.26 0.93 -0.21 2.33 2.43 -1.19 -2.39 114.38 116.02 3hk9 h ARG 152 Ca -0.17 -0.06 0.03 0.00 -0.81 0.00 0.00 59.98 58.97 3hk9 h ARG 152 Cb 1.76 -0.21 -0.03 0.00 -0.42 0.00 0.00 29.97 31.07 3hk9 h ARG 152 CO 0.18 0.61 0.02 0.82 -1.51 0.00 0.00 179.97 180.09 3hk9 h ILE 153 N 0.95 0.87 -0.37 1.20 2.04 -1.64 0.88 117.51 121.44 3hk9 h ILE 153 Ca 0.46 -0.03 0.04 0.00 1.00 0.00 0.00 64.86 66.33 3hk9 h ILE 153 Cb 0.45 0.77 -0.04 0.00 -0.74 0.00 0.00 36.82 37.26 3hk9 h ILE 153 CO -0.22 0.02 0.15 0.28 0.00 0.00 0.00 178.15 178.37 3hk9 h SER 154 N 0.09 0.18 -0.04 1.72 0.02 -1.56 0.19 113.55 114.15 3hk9 h SER 154 Ca 0.10 0.03 -0.00 0.00 -0.84 0.00 0.00 61.79 61.08 3hk9 h SER 154 Cb 0.11 0.01 -0.00 0.00 0.14 0.00 0.00 62.40 62.66 3hk9 h SER 154 CO -0.15 0.14 0.01 -0.50 -1.14 0.00 0.00 176.83 175.19 3hk9 h TRP 155 N 0.31 0.07 0.00 3.45 4.06 -1.30 -1.14 115.95 121.40 3hk9 h TRP 155 Ca 0.17 -0.01 -0.01 0.00 2.06 0.00 0.00 58.89 61.10 3hk9 h TRP 155 Cb 0.12 -0.02 -0.00 0.00 -1.00 0.00 0.00 29.16 28.26 3hk9 h TRP 155 CO -0.13 0.24 -0.07 -0.07 -3.56 0.00 0.00 178.44 174.85 3hk9 h LEU 156 N -0.12 0.00 -2.40 -4.49 3.38 -0.56 -2.03 115.31 109.09 3hk9 h LEU 156 Ca 0.01 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.91 3hk9 h LEU 156 Cb 0.20 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.91 3hk9 h LEU 156 CO -0.00 0.07 0.09 -0.62 0.09 0.00 0.00 178.44 178.07 3hk9 n GLU 157 N -4.14 2.45 -0.85 1.13 1.02 0.65 -4.89 120.64 116.01 3hk9 n GLU 157 Ca -0.03 -1.44 0.00 0.00 -0.02 0.00 0.00 57.16 55.68 3hk9 n GLU 157 Cb 0.15 -1.77 0.00 0.00 -0.02 0.00 0.00 31.44 29.81 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 0.13 1.12 3.73 0.62 0.00 -0.76 -5.01 105.19 105.02 3hk9 n GLY 158 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 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 -0.08 4.23 -0.03 1.61 1.02 -0.47 -5.01 119.74 121.01 3hk9 s LYS 159 Ca 0.00 2.34 0.06 0.00 0.02 0.00 0.00 55.97 58.39 3hk9 s LYS 159 Cb 0.00 -3.14 -0.01 0.00 -0.52 0.00 0.00 37.83 34.16 3hk9 s LYS 159 CO 0.00 -0.55 -0.20 -0.65 -0.92 0.00 0.00 175.35 173.04 3hk9 s GLN 160 N 0.59 1.81 0.61 1.68 -1.52 -1.26 -4.58 119.66 116.99 3hk9 s GLN 160 Ca 0.66 -0.71 -0.15 0.00 -1.95 0.00 0.00 55.36 53.21 3hk9 s GLN 160 Cb -0.43 -1.65 -0.03 0.00 -0.22 0.00 0.00 33.01 30.68 3hk9 s GLN 160 CO 0.36 0.36 1.06 -1.25 -0.25 0.00 0.00 175.29 175.57 3hk9 s PRO 161 N -0.26 3.22 0.97 2.91 0.04 -1.26 -4.96 135.00 135.66 3hk9 s PRO 161 Ca 0.02 1.21 -0.12 0.00 0.04 0.00 0.00 61.00 62.15 3hk9 s PRO 161 Cb -0.10 -2.02 0.17 0.00 0.04 0.00 0.00 34.50 32.60 3hk9 s PRO 161 CO 0.01 -0.89 1.10 0.16 0.04 0.00 0.00 177.00 177.42 3hk9 s ASP 162 N -2.83 2.86 0.55 6.66 1.47 -1.26 -4.86 116.67 119.26 3hk9 s ASP 162 Ca 0.64 1.15 0.24 0.00 1.18 0.00 0.00 52.55 55.76 3hk9 s ASP 162 Cb -0.16 -1.80 1.32 0.00 -0.34 0.00 0.00 42.92 41.93 3hk9 s ASP 162 CO 0.39 -2.98 1.71 0.77 0.68 0.00 0.00 175.17 175.74 3hk9 h SER 163 N -1.79 0.00 1.58 2.11 4.64 -2.00 -1.14 113.55 116.95 3hk9 h SER 163 Ca -0.53 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.79 3hk9 h SER 163 Cb 1.33 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.42 3hk9 h SER 163 CO 0.58 0.00 -0.14 0.03 -0.87 0.00 0.00 176.83 176.44 3hk9 h ARG 164 N 0.00 0.00 -5.68 4.77 3.08 -1.89 -3.45 114.38 111.20 3hk9 h ARG 164 Ca 0.00 0.00 -0.67 0.00 0.07 0.00 0.00 59.98 59.38 3hk9 h ARG 164 Cb 0.64 0.00 -0.26 0.00 0.08 0.00 0.00 29.97 30.43 3hk9 h ARG 164 CO 0.00 0.00 -0.77 -0.06 -1.07 0.00 0.00 179.97 178.07 3hk9 s PHE 165 N -3.17 2.76 0.09 3.04 0.08 -0.43 -0.57 117.98 119.77 3hk9 s PHE 165 Ca 0.08 -0.49 0.10 0.00 0.12 0.00 0.00 56.93 56.74 3hk9 s PHE 165 Cb 0.09 -1.76 -0.03 0.00 -0.57 0.00 0.00 43.02 40.75 3hk9 s PHE 165 CO 0.65 -0.08 -0.27 -1.01 -0.10 0.00 0.00 175.22 174.42 3hk9 s HIS 166 N -0.04 2.30 0.29 0.36 3.76 0.30 -4.66 115.29 117.61 3hk9 s HIS 166 Ca -0.03 -0.40 -0.09 0.00 -0.15 0.00 0.00 55.06 54.39 3hk9 s HIS 166 Cb -0.14 -1.31 -0.07 0.00 1.11 0.00 0.00 32.58 32.17 3hk9 s HIS 166 CO 0.04 0.23 0.61 0.00 -0.85 0.00 0.00 174.74 174.77 3hk9 s ALA 167 N -0.94 3.51 -0.06 -1.40 0.00 -1.26 -0.16 121.76 121.46 3hk9 s ALA 167 Ca 0.13 -0.30 -0.02 0.00 0.00 0.00 0.00 51.96 51.77 3hk9 s ALA 167 Cb -0.10 -2.49 0.03 0.00 0.00 0.00 0.00 23.12 20.57 3hk9 s ALA 167 CO 0.04 0.33 0.04 0.00 0.00 0.00 0.00 175.76 176.17 3hk9 s ALA 168 N -2.00 0.40 -0.61 0.00 0.00 -1.24 -0.38 121.76 117.93 3hk9 s ALA 168 Ca 0.48 0.06 -0.27 0.00 0.00 0.00 0.00 51.96 52.23 3hk9 s ALA 168 Cb -0.11 -0.68 0.01 0.00 0.00 0.00 0.00 23.12 22.34 3hk9 s ALA 168 CO 0.25 -0.51 1.52 -1.17 0.00 0.00 0.00 175.76 175.85 3hk9 s LEU 169 N 2.10 3.32 -0.11 0.00 2.96 -0.79 -1.11 118.68 125.05 3hk9 s LEU 169 Ca 0.05 0.17 -0.26 0.00 -0.22 0.00 0.00 54.13 53.87 3hk9 s LEU 169 Cb -0.12 -2.81 -0.02 0.00 0.50 0.00 0.00 46.19 43.74 3hk9 s LEU 169 CO -0.04 -1.93 0.83 -0.60 -1.32 0.00 0.00 176.35 173.30 3hk9 s ARG 170 N 6.00 4.39 -0.15 1.98 6.06 -0.07 -0.90 118.95 136.27 3hk9 s ARG 170 Ca 0.54 1.08 0.18 0.00 -2.50 0.00 0.00 55.73 55.02 3hk9 s ARG 170 Cb -0.11 -3.52 0.32 0.00 0.06 0.00 0.00 34.95 31.70 3hk9 s ARG 170 CO 0.22 -0.17 1.17 1.28 -2.50 0.00 0.00 175.30 175.30 3hk9 n LEU 171 N 4.59 2.48 -0.23 -0.88 4.77 0.31 -4.32 117.00 123.71 3hk9 n LEU 171 Ca 0.03 -3.21 0.01 0.00 -0.03 0.00 0.00 56.01 52.81 3hk9 n LEU 171 Cb 0.50 -0.45 0.09 0.00 -2.33 0.00 0.00 43.42 41.23 3hk9 n LEU 171 CO 0.49 0.82 0.76 0.44 -1.33 0.00 0.00 177.39 178.56 3hk9 h ASP 172 N 0.22 -0.54 -1.00 -1.43 5.19 -1.92 -2.12 116.42 114.83 3hk9 h ASP 172 Ca 0.00 0.20 0.02 0.00 -0.62 0.00 0.00 57.03 56.63 3hk9 h ASP 172 Cb 1.02 0.39 -0.05 0.00 0.18 0.00 0.00 39.33 40.87 3hk9 h ASP 172 CO 0.01 -0.20 0.66 -0.65 -3.12 0.00 0.00 179.24 175.93 3hk9 h PRO 173 N 0.03 1.27 0.08 3.56 0.11 -1.94 0.27 132.00 135.37 3hk9 h PRO 173 Ca 0.34 -0.08 -0.00 0.00 0.11 0.00 0.00 66.00 66.37 3hk9 h PRO 173 Cb 0.54 -0.29 0.00 0.00 0.11 0.00 0.00 31.00 31.37 3hk9 h PRO 173 CO -0.67 0.84 -0.04 1.25 -0.21 0.00 0.00 178.00 179.17 3hk9 h LEU 174 N 1.30 -0.09 -0.06 2.35 5.85 -1.71 -0.83 115.31 122.13 3hk9 h LEU 174 Ca 0.38 -0.35 -0.24 0.00 0.84 0.00 0.00 57.88 58.51 3hk9 h LEU 174 Cb -0.08 0.02 -0.00 0.00 0.37 0.00 0.00 40.66 40.98 3hk9 h LEU 174 CO -0.10 0.32 -1.06 -0.07 -0.34 0.00 0.00 178.44 177.19 3hk9 h LEU 175 N -0.51 0.39 0.00 2.25 4.07 -1.35 -3.20 115.31 116.95 3hk9 h LEU 175 Ca -0.01 -0.36 0.00 0.00 0.08 0.00 0.00 57.88 57.59 3hk9 h LEU 175 Cb 0.44 -0.12 0.00 0.00 1.08 0.00 0.00 40.66 42.05 3hk9 h LEU 175 CO 0.02 1.22 -1.83 0.59 -1.08 0.00 0.00 178.44 177.36 3hk9 n ASN 176 N -3.61 0.15 -2.61 -0.43 3.02 0.95 -3.83 115.26 108.90 3hk9 n ASN 176 Ca -0.06 -0.02 -0.08 0.00 -0.03 0.00 0.00 54.58 54.38 3hk9 n ASN 176 Cb 0.92 1.76 0.04 0.00 -0.61 0.00 0.00 39.78 41.89 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 -2.26 2.17 -0.24 3.52 1.02 -0.33 -4.93 120.64 119.60 3hk9 n GLU 177 Ca -0.03 -3.68 0.03 0.00 -0.02 0.00 0.00 57.16 53.46 3hk9 n GLU 177 Cb 0.55 -1.74 0.15 0.00 -0.02 0.00 0.00 31.44 30.38 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 2.57 0.45 -1.00 -0.32 3.20 -1.52 0.22 116.97 120.57 3hk9 h TYR 178 Ca 0.01 0.03 0.20 0.00 3.14 0.00 0.00 58.73 62.11 3hk9 h TYR 178 Cb 1.30 -0.09 -0.10 0.00 1.54 0.00 0.00 36.73 39.37 3hk9 h TYR 178 CO 0.60 0.07 0.61 0.93 -1.64 0.00 0.00 178.16 178.73 3hk9 h GLU 179 N 0.42 0.68 0.12 1.82 4.39 -1.90 0.28 114.58 120.38 3hk9 h GLU 179 Ca 0.37 -0.04 -0.34 0.00 0.34 0.00 0.00 59.36 59.70 3hk9 h GLU 179 Cb 0.53 -0.15 -0.01 0.00 -0.10 0.00 0.00 28.75 29.01 3hk9 h GLU 179 CO -0.37 0.45 -1.78 1.96 -1.16 0.00 0.00 179.01 178.11 3hk9 h GLN 180 N 0.70 0.24 0.00 2.33 7.50 -1.66 -3.38 115.11 120.85 3hk9 h GLN 180 Ca 0.57 -0.42 -0.06 0.00 0.50 0.00 0.00 58.65 59.24 3hk9 h GLN 180 Cb 0.97 0.16 -0.01 0.00 0.05 0.00 0.00 27.48 28.65 3hk9 h GLN 180 CO -0.35 1.09 -0.28 1.15 -1.50 0.00 0.00 178.83 178.94 3hk9 h THR 181 N 0.07 0.75 -0.42 -0.54 2.02 0.26 -3.15 112.91 111.90 3hk9 h THR 181 Ca -0.34 -1.21 0.01 0.00 0.77 0.00 0.00 66.41 65.64 3hk9 h THR 181 Cb 2.04 1.76 -0.02 0.00 -1.74 0.00 0.00 68.15 70.19 3hk9 h THR 181 CO 0.12 0.28 0.28 0.07 0.37 0.00 0.00 175.52 176.64 3hk9 h LYS 182 N 0.00 0.54 -0.14 6.66 2.10 -0.66 -1.26 116.57 123.81 3hk9 h LYS 182 Ca -0.00 -0.03 -0.06 0.00 -2.00 0.00 0.00 60.65 58.56 3hk9 h LYS 182 Cb 0.74 -0.12 -0.01 0.00 -0.90 0.00 0.00 32.23 31.93 3hk9 h LYS 182 CO 0.04 0.36 -0.18 0.45 -2.00 0.00 0.00 179.45 178.11 3hk9 h HIS 183 N 0.55 0.25 0.01 0.07 3.86 -1.78 -1.79 115.15 116.33 3hk9 h HIS 183 Ca 0.16 -0.03 -0.20 0.00 -1.16 0.00 0.00 60.37 59.13 3hk9 h HIS 183 Cb -0.04 -0.07 -0.02 0.00 1.06 0.00 0.00 27.41 28.34 3hk9 h HIS 183 CO -0.00 0.41 -0.94 0.00 0.86 0.00 0.00 177.93 178.26 3hk9 h ARG 184 N 0.22 0.05 -0.48 2.45 3.08 -1.42 -2.52 114.38 115.76 3hk9 h ARG 184 Ca 0.04 -0.06 -0.05 0.00 0.07 0.00 0.00 59.98 59.98 3hk9 h ARG 184 Cb 0.45 0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.50 3hk9 h ARG 184 CO 0.03 0.94 0.10 -0.07 -1.07 0.00 0.00 179.97 179.91 3hk9 h LEU 185 N 0.02 0.73 -1.02 3.04 3.38 -0.65 -2.16 115.31 118.65 3hk9 h LEU 185 Ca -0.02 -0.24 -0.10 0.00 0.09 0.00 0.00 57.88 57.60 3hk9 h LEU 185 Cb 1.63 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 42.18 3hk9 h LEU 185 CO 0.13 0.78 -0.48 0.08 0.09 0.00 0.00 178.44 179.05 3hk9 h ARG 186 N 0.65 0.03 0.00 1.13 0.11 -1.26 0.11 114.38 115.15 3hk9 h ARG 186 Ca 0.15 -0.02 -0.04 0.00 0.10 0.00 0.00 59.98 60.17 3hk9 h ARG 186 Cb 0.35 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.42 3hk9 h ARG 186 CO 0.00 0.50 -0.20 -0.44 0.10 0.00 0.00 179.97 179.94 3hk9 h ASP 187 N 0.03 0.00 -0.55 0.08 3.32 -1.03 -2.07 116.42 116.19 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 0.85 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.40 3hk9 h ASP 187 CO 0.06 0.20 0.00 0.79 -1.72 0.00 0.00 179.24 178.58 3hk9 n TRP 188 N -4.14 0.80 -0.28 4.55 8.01 -0.80 -4.93 117.44 120.65 3hk9 n TRP 188 Ca -0.02 -0.38 0.00 0.00 -1.31 0.00 0.00 57.50 55.78 3hk9 n TRP 188 Cb 0.27 -0.03 0.00 0.00 -2.01 0.00 0.00 31.31 29.54 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 1.32 0.64 3.41 6.99 0.00 -0.78 -5.02 105.19 111.76 3hk9 n GLY 189 Ca 0.19 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.77 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 -2.56 2.92 -0.58 1.61 2.02 0.30 -4.95 117.35 116.11 3hk9 s TYR 190 Ca 0.00 -0.91 -0.12 0.00 -0.37 0.00 0.00 57.07 55.67 3hk9 s TYR 190 Cb 0.00 -4.15 -0.11 0.00 -0.40 0.00 0.00 41.96 37.30 3hk9 s TYR 190 CO 0.00 -1.44 1.77 1.63 -1.57 0.00 0.00 175.55 175.94 3hk9 n LYS 191 N 6.78 1.24 -2.80 -0.62 4.76 -1.26 -3.03 118.16 123.23 3hk9 n LYS 191 Ca -0.02 -1.32 -0.37 0.00 -2.87 0.00 0.00 58.31 53.73 3hk9 n LYS 191 Cb 0.45 -2.50 -0.06 0.00 -1.84 0.00 0.00 35.03 31.07 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 4.63 4.24 0.43 -0.18 -7.23 -1.26 -4.59 120.40 116.44 3hk9 s VAL 192 Ca 0.40 1.78 0.07 0.00 -1.81 0.00 0.00 61.98 62.42 3hk9 s VAL 192 Cb 0.10 -3.99 0.01 0.00 0.56 0.00 0.00 36.38 33.06 3hk9 s VAL 192 CO 0.06 0.13 0.60 0.20 -0.31 0.00 0.00 175.10 175.78 3hk9 s ASN 193 N -1.64 5.63 0.34 4.85 0.01 -1.26 -4.96 114.94 117.91 3hk9 s ASN 193 Ca 0.50 -0.32 0.05 0.00 -0.71 0.00 0.00 52.86 52.38 3hk9 s ASN 193 Cb -0.18 -0.76 0.62 0.00 0.41 0.00 0.00 41.25 41.34 3hk9 s ASN 193 CO 0.23 -0.79 1.88 0.44 -1.51 0.00 0.00 177.10 177.35 3hk9 h ASP 194 N 0.56 0.48 -3.21 -1.22 3.45 -2.03 -3.42 116.42 111.04 3hk9 h ASP 194 Ca -0.41 -0.09 -0.58 0.00 0.43 0.00 0.00 57.03 56.39 3hk9 h ASP 194 Cb 1.28 -0.13 -0.04 0.00 -0.56 0.00 0.00 39.33 39.88 3hk9 h ASP 194 CO 0.47 0.55 -0.16 -0.70 -1.57 0.00 0.00 179.24 177.83 3hk9 s GLU 195 N -4.98 3.89 -1.26 3.56 2.56 -1.26 -5.00 118.70 116.21 3hk9 s GLU 195 Ca -0.08 0.36 -0.16 0.00 0.00 0.00 0.00 54.97 55.10 3hk9 s GLU 195 Cb 0.16 -2.99 0.12 0.00 2.00 0.00 0.00 34.13 33.41 3hk9 s GLU 195 CO 0.76 0.54 1.59 1.87 -0.56 0.00 0.00 175.26 179.46 3hk9 n TRP 196 N 0.96 4.81 -3.62 5.30 -0.00 -1.26 -4.65 117.44 118.99 3hk9 n TRP 196 Ca -0.07 -3.11 -0.18 0.00 -0.00 0.00 0.00 57.50 54.14 3hk9 n TRP 196 Cb 0.52 -2.40 0.01 0.00 -0.00 0.00 0.00 31.31 29.44 3hk9 n TRP 196 CO 0.00 0.00 0.00 0.27 -0.00 0.00 0.00 177.69 177.96 3hk9 n ASN 197 N 6.94 2.14 -0.15 5.87 0.23 -1.26 -4.94 115.26 124.09 3hk9 n ASN 197 Ca 0.43 -2.34 0.09 0.00 -0.53 0.00 0.00 54.58 52.22 3hk9 n ASN 197 Cb 0.44 -0.09 0.41 0.00 -2.08 0.00 0.00 39.78 38.45 3hk9 n ASN 197 CO 0.00 0.00 0.00 -0.08 -0.93 0.00 0.00 177.26 176.25 3hk9 h GLU 198 N 0.00 0.61 -0.16 -3.83 4.57 -1.99 -1.28 114.58 112.50 3hk9 h GLU 198 Ca -0.25 -0.04 0.02 0.00 -1.18 0.00 0.00 59.36 57.92 3hk9 h GLU 198 Cb 0.94 -0.14 -0.02 0.00 -0.16 0.00 0.00 28.75 29.37 3hk9 h GLU 198 CO 0.38 0.40 0.02 0.78 -1.18 0.00 0.00 179.01 179.41 3hk9 h GLY 199 N 0.63 0.17 1.09 1.92 0.00 -1.94 -0.28 103.07 104.66 3hk9 h GLY 199 Ca 0.31 0.00 -0.08 0.00 0.00 0.00 0.00 47.33 47.56 3hk9 h GLY 199 CO -0.10 -0.01 0.12 1.76 0.00 0.00 0.00 176.54 178.30 3hk9 h SER 200 N 0.08 1.07 -0.29 0.19 0.02 -1.57 -2.56 113.55 110.49 3hk9 h SER 200 Ca 0.07 -0.25 -0.01 0.00 -0.84 0.00 0.00 61.79 60.77 3hk9 h SER 200 Cb 0.08 -0.28 -0.01 0.00 0.14 0.00 0.00 62.40 62.32 3hk9 h SER 200 CO -0.11 1.05 0.15 0.40 -1.14 0.00 0.00 176.83 177.17 3hk9 h ILE 201 N 1.04 1.14 -0.48 3.27 2.04 -0.95 -2.27 117.51 121.30 3hk9 h ILE 201 Ca 0.21 -0.39 -0.06 0.00 1.00 0.00 0.00 64.86 65.62 3hk9 h ILE 201 Cb 0.43 0.87 -0.02 0.00 -0.74 0.00 0.00 36.82 37.36 3hk9 h ILE 201 CO 0.01 0.14 0.04 1.56 0.00 0.00 0.00 178.15 179.90 3hk9 h GLN 202 N 0.34 0.77 -0.26 2.37 1.08 -0.95 -1.69 115.11 116.77 3hk9 h GLN 202 Ca 0.10 -0.19 -0.17 0.00 -1.45 0.00 0.00 58.65 56.94 3hk9 h GLN 202 Cb 0.09 -0.10 -0.00 0.00 -0.05 0.00 0.00 27.48 27.42 3hk9 h GLN 202 CO -0.01 0.76 -0.52 0.93 -0.95 0.00 0.00 178.83 179.04 3hk9 h GLU 203 N 0.73 0.73 -0.45 1.46 4.39 -1.33 -0.18 114.58 119.93 3hk9 h GLU 203 Ca 0.15 -0.44 -0.07 0.00 0.34 0.00 0.00 59.36 59.34 3hk9 h GLU 203 Cb 0.39 0.04 -0.02 0.00 -0.10 0.00 0.00 28.75 29.07 3hk9 h GLU 203 CO 0.01 1.07 0.02 0.28 -1.16 0.00 0.00 179.01 179.23 3hk9 h VAL 204 N 0.57 1.26 -0.66 3.13 2.07 -1.26 0.16 116.25 121.52 3hk9 h VAL 204 Ca 0.02 -1.02 -0.01 0.00 0.82 0.00 0.00 66.70 66.51 3hk9 h VAL 204 Cb 1.09 1.02 -0.03 0.00 -1.52 0.00 0.00 31.29 31.85 3hk9 h VAL 204 CO 0.11 0.35 0.35 0.11 0.02 0.00 0.00 177.57 178.51 3hk9 h LYS 205 N 0.64 0.91 -0.16 1.57 1.57 -1.19 -1.26 116.57 118.65 3hk9 h LYS 205 Ca 0.13 -0.10 -0.11 0.00 -1.87 0.00 0.00 60.65 58.70 3hk9 h LYS 205 Cb 0.47 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.59 3hk9 h LYS 205 CO 0.02 0.68 -0.39 -0.09 -0.57 0.00 0.00 179.45 179.10 3hk9 h ARG 206 N 0.92 0.34 -0.14 3.15 2.43 -0.39 0.90 114.38 121.59 3hk9 h ARG 206 Ca 0.23 -0.16 -0.00 0.00 -0.81 0.00 0.00 59.98 59.24 3hk9 h ARG 206 Cb 0.04 -0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.58 3hk9 h ARG 206 CO -0.04 0.68 0.07 0.35 -1.51 0.00 0.00 179.97 179.53 3hk9 h PHE 207 N 0.29 0.20 -0.68 2.20 3.57 0.35 -0.32 116.94 122.56 3hk9 h PHE 207 Ca 0.03 -0.01 -0.07 0.00 3.53 0.00 0.00 57.97 61.46 3hk9 h PHE 207 Cb 0.81 -0.06 -0.03 0.00 2.79 0.00 0.00 35.95 39.46 3hk9 h PHE 207 CO 0.02 0.22 0.17 -0.07 -2.23 0.00 0.00 178.31 176.42 3hk9 h LEU 208 N 0.12 1.02 -0.53 0.59 3.38 -1.02 -2.50 115.31 116.38 3hk9 h LEU 208 Ca 0.05 -0.23 -0.12 0.00 0.09 0.00 0.00 57.88 57.67 3hk9 h LEU 208 Cb 0.09 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.56 3hk9 h LEU 208 CO -0.01 0.99 -0.14 0.74 0.09 0.00 0.00 178.44 180.12 3hk9 h THR 209 N 1.01 1.27 -0.35 0.22 2.02 -0.63 -0.82 112.91 115.62 3hk9 h THR 209 Ca 0.21 -1.30 -0.02 0.00 0.77 0.00 0.00 66.41 66.07 3hk9 h THR 209 Cb 0.36 1.01 -0.01 0.00 -1.74 0.00 0.00 68.15 67.76 3hk9 h THR 209 CO 0.00 0.46 0.12 0.44 0.37 0.00 0.00 175.52 176.91 3hk9 h ASP 210 N 0.90 0.50 0.41 4.18 3.32 -0.97 -1.91 116.42 122.85 3hk9 h ASP 210 Ca 0.13 -0.19 -0.10 0.00 0.02 0.00 0.00 57.03 56.90 3hk9 h ASP 210 Cb 0.71 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 40.12 3hk9 h ASP 210 CO 0.05 0.55 -0.44 -0.50 -1.72 0.00 0.00 179.24 177.19 3hk9 h TRP 211 N 0.41 0.05 -0.45 4.55 4.06 -1.35 -1.13 115.95 122.08 3hk9 h TRP 211 Ca 0.11 -0.01 -0.14 0.00 2.06 0.00 0.00 58.89 60.91 3hk9 h TRP 211 Cb 0.23 -0.01 -0.01 0.00 -1.00 0.00 0.00 29.16 28.36 3hk9 h TRP 211 CO 0.00 0.48 -0.26 0.82 -3.56 0.00 0.00 178.44 175.92 3hk9 h ILE 212 N 0.04 1.27 -0.11 1.49 2.04 -0.97 -0.74 117.51 120.53 3hk9 h ILE 212 Ca -0.00 -1.43 -0.11 0.00 1.00 0.00 0.00 64.86 64.32 3hk9 h ILE 212 Cb 0.80 1.20 -0.01 0.00 -0.74 0.00 0.00 36.82 38.06 3hk9 h ILE 212 CO 0.06 0.49 -0.40 -0.33 0.00 0.00 0.00 178.15 177.97 3hk9 h GLU 213 N 0.83 0.25 0.13 2.37 5.08 -1.01 0.29 114.58 122.51 3hk9 h GLU 213 Ca 0.10 -0.12 -0.30 0.00 -1.00 0.00 0.00 59.36 58.04 3hk9 h GLU 213 Cb 0.85 -0.00 0.03 0.00 0.50 0.00 0.00 28.75 30.13 3hk9 h GLU 213 CO 0.08 0.61 -1.26 -0.09 -1.00 0.00 0.00 179.01 177.35 3hk9 h ARG 214 N 0.21 0.63 0.00 2.33 2.43 -1.00 -3.37 114.38 115.61 3hk9 h ARG 214 Ca 0.02 -0.85 -0.04 0.00 -0.81 0.00 0.00 59.98 58.30 3hk9 h ARG 214 Cb 0.81 0.28 -0.01 0.00 -0.42 0.00 0.00 29.97 30.63 3hk9 h ARG 214 CO 0.06 1.39 -1.84 -1.33 -1.51 0.00 0.00 179.97 176.74 3hk9 n MET 215 N -3.79 0.65 -3.83 0.20 2.81 -0.30 -5.00 117.12 107.86 3hk9 n MET 215 Ca -0.14 -0.11 -0.31 0.00 -1.81 0.00 0.00 57.70 55.33 3hk9 n MET 215 Cb 0.99 -1.59 0.02 0.00 -0.71 0.00 0.00 33.22 31.93 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 -2.41 -3.22 -4.77 7.83 2.03 0.10 -4.56 116.55 111.55 3hk9 n ASP 216 Ca -0.06 -1.05 -0.36 0.00 0.52 0.00 0.00 54.79 53.84 3hk9 n ASP 216 Cb 0.64 -3.05 -0.00 0.00 -0.72 0.00 0.00 41.12 37.98 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 -6.37 3.58 0.47 -0.67 0.04 -1.26 -4.62 135.00 126.16 3hk9 s PRO 217 Ca 0.29 1.70 0.26 0.00 0.04 0.00 0.00 61.00 63.30 3hk9 s PRO 217 Cb -0.12 -2.23 0.69 0.00 0.04 0.00 0.00 34.50 32.89 3hk9 s PRO 217 CO 0.89 -0.69 1.73 -0.39 0.04 0.00 0.00 177.00 178.58 3hk9 h VAL 218 N 1.57 0.08 -1.90 -0.36 -1.51 -1.06 -3.47 116.25 109.61 3hk9 h VAL 218 Ca -0.50 -0.92 0.18 0.00 -1.23 0.00 0.00 66.70 64.24 3hk9 h VAL 218 Cb 1.25 1.85 -0.17 0.00 -2.13 0.00 0.00 31.29 32.10 3hk9 h VAL 218 CO 0.59 0.04 0.64 -0.72 -1.23 0.00 0.00 177.57 176.89 3hk9 s TYR 219 N -3.37 -0.23 -0.13 5.19 -0.85 -1.26 -4.25 117.35 112.44 3hk9 s TYR 219 Ca 0.05 0.13 -0.07 0.00 -0.52 0.00 0.00 57.07 56.65 3hk9 s TYR 219 Cb 0.07 0.53 -0.04 0.00 0.38 0.00 0.00 41.96 42.90 3hk9 s TYR 219 CO 0.63 -0.39 0.14 -1.64 -1.52 0.00 0.00 175.55 172.77 3hk9 s MET 220 N -2.79 3.55 0.20 -3.49 -1.94 -0.73 -1.88 119.30 112.22 3hk9 s MET 220 Ca 0.07 -0.15 0.05 0.00 -1.71 0.00 0.00 55.69 53.96 3hk9 s MET 220 Cb -0.01 -3.22 -0.05 0.00 2.01 0.00 0.00 34.83 33.56 3hk9 s MET 220 CO -0.07 0.70 -0.07 0.00 -0.01 0.00 0.00 175.02 175.57 3hk9 s ALA 221 N -0.81 1.75 -0.10 3.03 0.00 -0.08 0.39 121.76 125.96 3hk9 s ALA 221 Ca 0.14 -1.65 -0.30 0.00 0.00 0.00 0.00 51.96 50.15 3hk9 s ALA 221 Cb -0.12 0.18 0.08 0.00 0.00 0.00 0.00 23.12 23.26 3hk9 s ALA 221 CO 0.03 -0.11 0.76 0.54 0.00 0.00 0.00 175.76 176.98 3hk9 s VAL 222 N -3.26 0.00 -0.09 0.00 0.11 -0.78 -0.53 120.40 115.84 3hk9 s VAL 222 Ca 0.23 0.00 -0.01 0.00 -2.93 0.00 0.00 61.98 59.26 3hk9 s VAL 222 Cb 0.03 -1.00 -0.03 0.00 -1.53 0.00 0.00 36.38 33.85 3hk9 s VAL 222 CO 0.05 0.00 -0.03 -0.94 -3.33 0.00 0.00 175.10 170.86 3hk9 s SER 223 N -1.02 4.99 0.16 3.54 1.04 -1.26 -1.25 113.70 119.89 3hk9 s SER 223 Ca -0.08 0.05 0.08 0.00 0.48 0.00 0.00 55.95 56.48 3hk9 s SER 223 Cb -0.01 -1.43 -0.04 0.00 0.10 0.00 0.00 66.02 64.65 3hk9 s SER 223 CO 0.07 0.34 -0.17 -0.76 0.98 0.00 0.00 173.24 173.70 3hk9 s LEU 224 N -0.66 2.44 0.70 2.42 1.43 0.10 -4.92 118.68 120.19 3hk9 s LEU 224 Ca 0.10 -0.86 -0.11 0.00 -1.03 0.00 0.00 54.13 52.23 3hk9 s LEU 224 Cb -0.12 -0.75 0.01 0.00 0.03 0.00 0.00 46.19 45.36 3hk9 s LEU 224 CO 0.02 -0.07 1.09 -2.16 0.23 0.00 0.00 176.35 175.46 3hk9 s PRO 225 N -2.83 2.90 0.64 1.29 0.04 -1.24 -0.44 135.00 135.36 3hk9 s PRO 225 Ca 0.15 0.54 0.36 0.00 0.04 0.00 0.00 61.00 62.09 3hk9 s PRO 225 Cb -0.05 -2.02 2.03 0.00 0.04 0.00 0.00 34.50 34.50 3hk9 s PRO 225 CO 0.06 -1.02 2.22 -1.00 0.04 0.00 0.00 177.00 177.30 3hk9 h PRO 226 N -0.65 0.00 -0.08 0.56 0.13 -1.76 -1.44 132.00 128.76 3hk9 h PRO 226 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 3hk9 h PRO 226 Cb 1.24 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.37 3hk9 h PRO 226 CO 0.63 0.00 0.00 0.25 -0.23 0.00 0.00 178.00 178.65 3hk9 n THR 227 N -3.35 0.10 -1.64 1.56 -2.24 -1.26 -4.00 114.28 103.46 3hk9 n THR 227 Ca -0.02 -0.19 -0.51 0.00 -2.27 0.00 0.00 64.05 61.06 3hk9 n THR 227 Cb 0.18 0.10 -0.06 0.00 -2.10 0.00 0.00 70.33 68.45 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 -0.16 1.87 -4.14 4.78 7.35 -0.54 -4.99 117.46 121.63 3hk9 n PHE 228 Ca 0.16 0.47 -0.14 0.00 -0.76 0.00 0.00 57.45 57.17 3hk9 n PHE 228 Cb 0.22 -2.44 -0.11 0.00 0.35 0.00 0.00 39.48 37.51 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 1.36 1.27 -0.29 -2.13 0.01 -1.26 -4.68 113.70 107.98 3hk9 s SER 229 Ca 0.86 -0.73 -0.17 0.00 1.31 0.00 0.00 55.95 57.22 3hk9 s SER 229 Cb -0.87 0.02 0.12 0.00 0.21 0.00 0.00 66.02 65.50 3hk9 s SER 229 CO 0.47 -0.24 0.89 0.12 0.41 0.00 0.00 173.24 174.89 3hk9 s PHE 230 N -2.10 -0.72 1.12 2.43 2.19 -1.26 -4.47 117.98 115.17 3hk9 s PHE 230 Ca 0.01 1.46 -0.12 0.00 0.33 0.00 0.00 56.93 58.60 3hk9 s PHE 230 Cb -0.05 0.43 0.26 0.00 -1.31 0.00 0.00 43.02 42.35 3hk9 s PHE 230 CO -0.00 -0.36 1.05 -2.14 1.83 0.00 0.00 175.22 175.60 3hk9 s PRO 231 N 1.35 -0.60 -0.28 10.12 0.02 -1.26 -4.20 135.00 140.15 3hk9 s PRO 231 Ca -0.08 1.03 -0.17 0.00 0.02 0.00 0.00 61.00 61.79 3hk9 s PRO 231 Cb -0.04 -1.58 0.12 0.00 0.02 0.00 0.00 34.50 33.02 3hk9 s PRO 231 CO -0.16 -3.56 0.87 -2.00 -0.33 0.00 0.00 177.00 171.82 3hk9 s GLU 232 N -4.47 0.52 -1.31 5.54 2.12 -1.26 -5.07 118.70 114.77 3hk9 s GLU 232 Ca 0.68 0.87 -0.15 0.00 0.36 0.00 0.00 54.97 56.73 3hk9 s GLU 232 Cb -0.25 0.12 0.10 0.00 0.26 0.00 0.00 34.13 34.37 3hk9 s GLU 232 CO 0.63 -0.10 1.78 0.39 -0.54 0.00 0.00 175.26 177.42 3hk9 n GLU 233 N 3.77 3.23 -4.12 4.30 -0.58 -1.26 -3.89 120.64 122.10 3hk9 n GLU 233 Ca -0.18 -3.33 -0.14 0.00 -0.42 0.00 0.00 57.16 53.09 3hk9 n GLU 233 Cb 0.58 -3.27 -0.06 0.00 -0.57 0.00 0.00 31.44 28.13 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 3.23 0.79 0.18 1.62 1.04 -1.26 -5.01 113.70 114.28 3hk9 s SER 234 Ca 0.48 -1.43 -0.09 0.00 0.48 0.00 0.00 55.95 55.38 3hk9 s SER 234 Cb 0.05 0.60 0.07 0.00 0.10 0.00 0.00 66.02 66.85 3hk9 s SER 234 CO 0.02 -1.18 1.66 0.78 0.98 0.00 0.00 173.24 175.49 3hk9 h ASN 235 N 2.20 1.06 -0.05 7.02 2.35 -1.91 -1.66 115.58 124.58 3hk9 h ASN 235 Ca -0.28 -0.29 -0.00 0.00 -0.55 0.00 0.00 56.30 55.17 3hk9 h ASN 235 Cb 1.24 -0.28 -0.00 0.00 0.05 0.00 0.00 38.32 39.33 3hk9 h ASN 235 CO 0.40 1.09 0.02 -0.09 -1.65 0.00 0.00 177.43 177.20 3hk9 h ARG 236 N 0.99 0.08 -0.94 0.81 2.43 -1.90 0.05 114.38 115.90 3hk9 h ARG 236 Ca 0.18 -0.01 0.01 0.00 -0.81 0.00 0.00 59.98 59.35 3hk9 h ARG 236 Cb 0.52 -0.01 -0.05 0.00 -0.42 0.00 0.00 29.97 30.01 3hk9 h ARG 236 CO 0.02 0.20 0.62 0.78 -1.51 0.00 0.00 179.97 180.09 3hk9 h GLY 237 N -0.06 1.33 1.24 2.80 0.00 -1.67 -1.40 103.07 105.31 3hk9 h GLY 237 Ca 0.02 -0.50 -0.20 0.00 0.00 0.00 0.00 47.33 46.65 3hk9 h GLY 237 CO -0.00 0.49 -0.64 3.21 0.00 0.00 0.00 176.54 179.60 3hk9 h ARG 238 N 1.28 0.77 -0.55 4.80 3.08 -1.17 -1.48 114.38 121.12 3hk9 h ARG 238 Ca 0.35 -0.54 -0.11 0.00 0.07 0.00 0.00 59.98 59.74 3hk9 h ARG 238 Cb -0.14 0.09 -0.02 0.00 0.08 0.00 0.00 29.97 29.98 3hk9 h ARG 238 CO -0.07 1.17 -0.09 0.82 -1.07 0.00 0.00 179.97 180.72 3hk9 h ILE 239 N 0.57 1.27 -0.03 2.04 2.04 -0.82 0.26 117.51 122.84 3hk9 h ILE 239 Ca -0.01 -1.25 -0.01 0.00 1.00 0.00 0.00 64.86 64.59 3hk9 h ILE 239 Cb 1.25 0.95 -0.00 0.00 -0.74 0.00 0.00 36.82 38.27 3hk9 h ILE 239 CO 0.13 0.44 -0.01 0.40 0.00 0.00 0.00 178.15 179.12 3hk9 h ILE 240 N 0.91 1.30 -0.16 -0.67 2.04 -1.27 0.77 117.51 120.43 3hk9 h ILE 240 Ca 0.14 -0.90 -0.01 0.00 1.00 0.00 0.00 64.86 65.09 3hk9 h ILE 240 Cb 0.66 1.85 -0.01 0.00 -0.74 0.00 0.00 36.82 38.59 3hk9 h ILE 240 CO 0.05 0.24 0.04 -0.09 0.00 0.00 0.00 178.15 178.39 3hk9 h ARG 241 N -0.31 0.25 0.00 2.37 2.43 -1.18 -2.07 114.38 115.87 3hk9 h ARG 241 Ca 0.01 -0.06 -0.08 0.00 -0.81 0.00 0.00 59.98 59.04 3hk9 h ARG 241 Cb 0.39 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.89 3hk9 h ARG 241 CO 0.00 0.38 -1.25 -0.25 -1.51 0.00 0.00 179.97 177.34 3hk9 n ASP 242 N -4.83 0.81 0.01 -3.80 8.00 0.91 -4.57 116.55 113.08 3hk9 n ASP 242 Ca -0.05 0.33 -0.02 0.00 0.71 0.00 0.00 54.79 55.76 3hk9 n ASP 242 Cb 0.15 0.38 -0.01 0.00 -0.02 0.00 0.00 41.12 41.63 3hk9 n ASP 242 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3hk9 h LEU 244 N -0.13 -0.93 -0.33 0.00 7.12 -1.06 -2.57 115.31 117.41 3hk9 h LEU 244 Ca -0.04 0.03 0.01 0.00 0.13 0.00 0.00 57.88 58.01 3hk9 h LEU 244 Cb 0.56 0.24 -0.02 0.00 -0.53 0.00 0.00 40.66 40.91 3hk9 h LEU 244 CO -0.02 -0.66 0.21 -0.07 -0.13 0.00 0.00 178.44 177.76 3hk9 h LEU 245 N -1.11 0.36 -0.74 2.25 3.38 -1.63 0.14 115.31 117.95 3hk9 h LEU 245 Ca -0.11 -0.01 0.03 0.00 0.09 0.00 0.00 57.88 57.88 3hk9 h LEU 245 Cb 0.85 -0.08 -0.04 0.00 0.09 0.00 0.00 40.66 41.47 3hk9 h LEU 245 CO 0.19 0.26 0.47 -0.65 0.09 0.00 0.00 178.44 178.80 3hk9 h PRO 246 N 0.43 0.90 -0.30 1.13 0.11 -1.80 -0.45 132.00 132.02 3hk9 h PRO 246 Ca 0.12 -0.05 -0.14 0.00 0.11 0.00 0.00 66.00 66.04 3hk9 h PRO 246 Cb -0.03 -0.20 -0.00 0.00 0.11 0.00 0.00 31.00 30.87 3hk9 h PRO 246 CO -0.04 0.60 -0.35 0.28 -0.21 0.00 0.00 178.00 178.28 3hk9 h VAL 247 N 0.93 1.29 -0.85 3.15 2.07 -1.15 -2.01 116.25 119.69 3hk9 h VAL 247 Ca 0.29 -1.53 -0.01 0.00 0.82 0.00 0.00 66.70 66.27 3hk9 h VAL 247 Cb -0.01 1.58 -0.04 0.00 -1.52 0.00 0.00 31.29 31.30 3hk9 h VAL 247 CO -0.10 0.49 0.48 0.00 0.02 0.00 0.00 177.57 178.46 3hk9 h ALA 248 N 0.70 1.09 0.00 1.67 0.00 -0.46 -1.81 119.26 120.45 3hk9 h ALA 248 Ca 0.04 -0.12 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 3hk9 h ALA 248 Cb 0.94 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 18.38 3hk9 h ALA 248 CO 0.08 0.59 -0.00 1.49 0.00 0.00 0.00 179.25 181.41 3hk9 h GLU 249 N 1.18 -0.01 -0.85 0.00 4.81 -1.03 0.40 114.58 119.09 3hk9 h GLU 249 Ca 0.30 0.00 0.12 0.00 -0.13 0.00 0.00 59.36 59.65 3hk9 h GLU 249 Cb 0.02 0.00 -0.08 0.00 0.63 0.00 0.00 28.75 29.31 3hk9 h GLU 249 CO -0.05 0.22 0.47 -0.22 -0.73 0.00 0.00 179.01 178.70 3hk9 h LYS 250 N -0.23 0.71 -0.17 1.92 3.64 -1.07 -0.74 116.57 120.63 3hk9 h LYS 250 Ca -0.00 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 3hk9 h LYS 250 Cb 0.22 -0.16 0.00 0.00 -0.41 0.00 0.00 32.23 31.89 3hk9 h LYS 250 CO 0.00 0.47 0.00 0.72 -2.27 0.00 0.00 179.45 178.37 3hk9 n HIS 251 N -4.79 0.20 -3.74 1.91 8.25 -0.71 -4.95 115.22 111.39 3hk9 n HIS 251 Ca 0.16 -0.10 -0.23 0.00 -0.26 0.00 0.00 57.72 57.29 3hk9 n HIS 251 Cb 0.36 0.00 0.03 0.00 1.12 0.00 0.00 29.99 31.50 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 0.95 -1.65 -4.48 0.41 4.05 0.95 -4.97 115.26 110.53 3hk9 n ASN 252 Ca 0.17 -0.82 -0.34 0.00 0.45 0.00 0.00 54.58 54.04 3hk9 n ASN 252 Cb 0.50 -4.00 -0.12 0.00 1.23 0.00 0.00 39.78 37.38 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 -3.63 3.86 0.64 -1.44 1.01 0.10 -4.87 121.20 116.88 3hk9 s ILE 253 Ca 0.10 -0.36 -0.15 0.00 0.00 0.00 0.00 60.65 60.23 3hk9 s ILE 253 Cb -0.05 -2.71 -0.01 0.00 0.01 0.00 0.00 42.46 39.71 3hk9 s ILE 253 CO 0.82 0.48 1.10 -2.16 0.00 0.00 0.00 174.94 175.18 3hk9 s PRO 254 N 0.54 2.92 -0.28 2.79 0.04 -1.26 -4.58 135.00 135.18 3hk9 s PRO 254 Ca -0.03 1.39 -0.06 0.00 0.04 0.00 0.00 61.00 62.34 3hk9 s PRO 254 Cb -0.14 -1.97 0.01 0.00 0.04 0.00 0.00 34.50 32.44 3hk9 s PRO 254 CO 0.03 -1.15 0.05 0.12 0.04 0.00 0.00 177.00 176.08 3hk9 s PHE 255 N -2.30 3.11 -0.20 0.56 5.36 0.05 -1.77 117.98 122.79 3hk9 s PHE 255 Ca 0.67 -1.00 -0.15 0.00 -0.96 0.00 0.00 56.93 55.49 3hk9 s PHE 255 Cb -0.20 -2.21 -0.04 0.00 -0.34 0.00 0.00 43.02 40.23 3hk9 s PHE 255 CO 0.39 -0.57 0.38 0.00 -1.46 0.00 0.00 175.22 173.96 3hk9 s ALA 256 N 1.48 3.56 -0.18 11.12 0.00 0.16 -1.32 121.76 136.59 3hk9 s ALA 256 Ca 0.03 -0.55 0.00 0.00 0.00 0.00 0.00 51.96 51.44 3hk9 s ALA 256 Cb -0.17 -2.60 0.01 0.00 0.00 0.00 0.00 23.12 20.37 3hk9 s ALA 256 CO 0.01 -0.27 -0.17 -1.64 0.00 0.00 0.00 175.76 173.68 3hk9 s MET 257 N 1.25 3.07 -0.46 0.00 1.00 0.50 -1.87 119.30 122.79 3hk9 s MET 257 Ca 0.18 -0.79 -0.05 0.00 0.00 0.00 0.00 55.69 55.03 3hk9 s MET 257 Cb -0.15 -2.64 0.12 0.00 0.00 0.00 0.00 34.83 32.17 3hk9 s MET 257 CO 0.08 -0.18 0.29 -1.64 0.00 0.00 0.00 175.02 173.56 3hk9 s MET 258 N 1.27 2.25 -0.09 2.03 -1.94 -0.38 -2.56 119.30 119.88 3hk9 s MET 258 Ca 0.04 -1.90 -0.07 0.00 -1.71 0.00 0.00 55.69 52.04 3hk9 s MET 258 Cb -0.13 -3.73 -0.04 0.00 2.01 0.00 0.00 34.83 32.93 3hk9 s MET 258 CO -0.10 -1.13 0.18 0.42 -0.01 0.00 0.00 175.02 174.38 3hk9 s ILE 259 N 1.04 5.44 0.00 2.53 1.01 -0.83 0.03 121.20 130.42 3hk9 s ILE 259 Ca 0.09 0.25 0.00 0.00 0.00 0.00 0.00 60.65 60.99 3hk9 s ILE 259 Cb -0.23 -3.45 0.00 0.00 0.01 0.00 0.00 42.46 38.78 3hk9 s ILE 259 CO -0.03 0.58 0.00 0.61 0.00 0.00 0.00 174.94 176.10 3hk9 n GLY 260 N 1.84 1.20 3.73 6.18 0.00 0.42 -0.68 105.19 117.87 3hk9 n GLY 260 Ca -0.18 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.44 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 4.86 -0.53 1.61 0.11 -0.78 -2.17 120.40 121.49 3hk9 s VAL 261 Ca 0.00 1.63 -0.05 0.00 -2.93 0.00 0.00 61.98 60.63 3hk9 s VAL 261 Cb 0.00 -4.12 0.14 0.00 -1.53 0.00 0.00 36.38 30.87 3hk9 s VAL 261 CO 0.00 0.30 0.36 -0.75 -3.33 0.00 0.00 175.10 171.68 3hk9 s LYS 262 N 0.38 2.41 0.42 1.54 2.20 0.25 -3.61 119.74 123.33 3hk9 s LYS 262 Ca 0.40 -2.14 -0.24 0.00 -0.36 0.00 0.00 55.97 53.63 3hk9 s LYS 262 Cb -0.20 -3.76 -0.08 0.00 -1.51 0.00 0.00 37.83 32.28 3hk9 s LYS 262 CO 0.22 -1.15 1.12 0.15 -0.36 0.00 0.00 175.35 175.33 3hk9 s LYS 263 N 0.63 3.97 -1.34 4.03 1.02 -1.26 -0.17 119.74 126.62 3hk9 s LYS 263 Ca 0.12 1.69 -0.00 0.00 0.02 0.00 0.00 55.97 57.80 3hk9 s LYS 263 Cb -0.22 -2.51 0.00 0.00 -0.52 0.00 0.00 37.83 34.58 3hk9 s LYS 263 CO -0.03 -0.35 0.62 0.54 -0.92 0.00 0.00 175.35 175.20 3hk9 n ARG 264 N -0.22 -4.46 0.23 1.68 1.74 -1.21 -4.87 116.66 109.55 3hk9 n ARG 264 Ca 0.06 0.56 0.14 0.00 -0.77 0.00 0.00 57.85 57.84 3hk9 n ARG 264 Cb 0.48 -5.00 0.38 0.00 -1.02 0.00 0.00 32.46 27.30 3hk9 n ARG 264 CO 0.00 0.00 0.00 -0.39 -1.52 0.00 0.00 177.63 175.72 3hk9 h VAL 265 N -1.86 0.00 -2.33 1.55 -1.51 -1.12 -3.33 116.25 107.65 3hk9 h VAL 265 Ca -0.62 -0.77 -0.59 0.00 -1.23 0.00 0.00 66.70 63.50 3hk9 h VAL 265 Cb 1.36 1.76 -0.38 0.00 -2.13 0.00 0.00 31.29 31.90 3hk9 h VAL 265 CO 0.58 0.00 -0.98 1.57 -1.23 0.00 0.00 177.57 177.51 3hk9 n HIS 266 N -3.02 -0.65 -0.34 5.19 -0.00 -1.07 -5.02 115.22 110.32 3hk9 n HIS 266 Ca 0.03 -3.39 0.25 0.00 -0.00 0.00 0.00 57.72 54.61 3hk9 n HIS 266 Cb 0.43 0.13 0.54 0.00 -0.00 0.00 0.00 29.99 31.09 3hk9 n HIS 266 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.34 175.34 3hk9 h PRO 267 N 5.35 0.32 -0.03 1.57 0.13 -1.83 -1.16 132.00 136.35 3hk9 h PRO 267 Ca 0.23 -0.02 0.01 0.00 -0.87 0.00 0.00 66.00 65.35 3hk9 h PRO 267 Cb 0.90 -0.07 -0.00 0.00 0.13 0.00 0.00 31.00 31.95 3hk9 h PRO 267 CO 0.40 0.21 0.05 0.00 -0.23 0.00 0.00 178.00 178.43 3hk9 h ALA 268 N 1.61 1.40 -0.00 -0.56 0.00 -1.95 -1.23 119.26 118.52 3hk9 h ALA 268 Ca 0.62 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.53 3hk9 h ALA 268 Cb 1.69 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.48 3hk9 h ALA 268 CO -0.30 -0.06 -0.14 1.28 0.00 0.00 0.00 179.25 180.03 3hk9 n LEU 269 N -3.55 0.42 0.00 0.00 4.77 -0.44 -4.95 117.00 113.25 3hk9 n LEU 269 Ca -0.02 0.06 0.00 0.00 -0.03 0.00 0.00 56.01 56.02 3hk9 n LEU 269 Cb 0.13 -0.23 0.00 0.00 -2.33 0.00 0.00 43.42 40.99 3hk9 n LEU 269 CO 0.24 0.08 0.00 0.61 -1.33 0.00 0.00 177.39 177.00 3hk9 n GLY 270 N 1.33 3.58 0.34 -0.72 0.00 -0.47 -1.54 105.19 107.70 3hk9 n GLY 270 Ca 0.13 -0.10 0.22 0.00 0.00 0.00 0.00 46.02 46.27 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 -0.29 1.61 3.32 -1.95 -0.87 116.42 118.24 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 -2.10 2.47 -0.91 3.45 0.00 -0.59 -4.25 120.51 118.59 3hk9 n ALA 272 Ca -0.03 -0.62 0.07 0.00 0.00 0.00 0.00 53.44 52.87 3hk9 n ALA 272 Cb 0.09 -1.02 0.38 0.00 0.00 0.00 0.00 19.45 18.91 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 1.13 3.16 3.86 0.00 0.00 -0.33 -4.85 105.19 108.15 3hk9 n GLY 273 Ca 0.14 -0.94 -0.36 0.00 0.00 0.00 0.00 46.02 44.86 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 -0.98 6.70 0.31 1.61 1.01 -1.26 -0.76 116.67 123.30 3hk9 s ASP 274 Ca 0.53 0.85 0.01 0.00 0.71 0.00 0.00 52.55 54.65 3hk9 s ASP 274 Cb 0.40 -2.20 0.01 0.00 1.01 0.00 0.00 42.92 42.14 3hk9 s ASP 274 CO 0.15 0.23 0.12 0.33 0.21 0.00 0.00 175.17 176.20 3hk9 n PHE 275 N 1.23 -0.10 -4.21 4.23 7.35 0.76 -4.94 117.46 121.78 3hk9 n PHE 275 Ca -0.10 -1.42 -0.14 0.00 -0.76 0.00 0.00 57.45 55.02 3hk9 n PHE 275 Cb 0.52 -0.23 -0.10 0.00 0.35 0.00 0.00 39.48 40.02 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 -1.85 1.03 -0.02 -2.13 0.11 -1.26 -0.59 120.40 115.70 3hk9 s VAL 276 Ca 0.09 -1.85 -0.24 0.00 -2.93 0.00 0.00 61.98 57.05 3hk9 s VAL 276 Cb -0.01 -1.60 0.05 0.00 -1.53 0.00 0.00 36.38 33.29 3hk9 s VAL 276 CO 0.06 -0.66 0.53 -0.83 -3.33 0.00 0.00 175.10 170.87 3hk9 s GLY 277 N -2.80 -0.42 0.21 6.54 0.00 -0.92 -4.86 107.32 105.07 3hk9 s GLY 277 Ca 0.11 0.86 -0.30 0.00 0.00 0.00 0.00 44.72 45.39 3hk9 s GLY 277 CO -0.00 0.56 1.03 1.25 0.00 0.00 0.00 173.10 175.94 3hk9 s LYS 278 N -1.51 4.70 0.32 2.90 2.20 -1.26 -4.47 119.74 122.62 3hk9 s LYS 278 Ca -0.10 1.62 0.07 0.00 -0.36 0.00 0.00 55.97 57.20 3hk9 s LYS 278 Cb -0.02 -3.28 -0.03 0.00 -1.51 0.00 0.00 37.83 33.00 3hk9 s LYS 278 CO 0.06 0.26 0.28 0.00 -0.36 0.00 0.00 175.35 175.59 3hk9 s ALA 279 N -0.68 3.80 0.42 3.13 0.00 -1.26 -4.79 121.76 122.39 3hk9 s ALA 279 Ca 0.45 -1.62 -0.16 0.00 0.00 0.00 0.00 51.96 50.63 3hk9 s ALA 279 Cb -0.28 -1.19 -0.09 0.00 0.00 0.00 0.00 23.12 21.57 3hk9 s ALA 279 CO 0.34 0.04 0.87 0.45 0.00 0.00 0.00 175.76 177.47 3hk9 s SER 280 N -3.97 6.71 0.02 0.00 0.15 -1.26 -4.97 113.70 110.39 3hk9 s SER 280 Ca 0.40 1.43 0.23 0.00 0.70 0.00 0.00 55.95 58.71 3hk9 s SER 280 Cb -0.06 -2.44 0.13 0.00 -1.71 0.00 0.00 66.02 61.94 3hk9 s SER 280 CO 0.26 -0.40 1.12 0.23 1.20 0.00 0.00 173.24 175.66 3hk9 n MET 281 N -1.01 0.14 -0.30 5.44 2.81 -1.26 -4.46 117.12 118.49 3hk9 n MET 281 Ca 0.05 -0.00 0.11 0.00 -1.81 0.00 0.00 57.70 56.05 3hk9 n MET 281 Cb 0.54 -1.55 0.28 0.00 -0.71 0.00 0.00 33.22 31.78 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 0.00 0.29 -0.35 7.83 5.19 -1.94 1.00 116.42 128.44 3hk9 h ASP 282 Ca 0.00 0.15 -0.04 0.00 -0.62 0.00 0.00 57.03 56.52 3hk9 h ASP 282 Cb 0.61 0.14 -0.01 0.00 0.18 0.00 0.00 39.33 40.24 3hk9 h ASP 282 CO 0.00 0.01 0.08 1.23 -3.12 0.00 0.00 179.24 177.44 3hk9 h GLY 283 N 0.40 0.61 1.22 2.75 0.00 -1.78 -0.62 103.07 105.64 3hk9 h GLY 283 Ca 0.53 -0.38 -0.12 0.00 0.00 0.00 0.00 47.33 47.35 3hk9 h GLY 283 CO -0.51 0.36 -0.18 -2.08 0.00 0.00 0.00 176.54 174.12 3hk9 h VAL 284 N 0.41 1.27 -0.19 4.60 2.07 -1.60 -1.78 116.25 121.02 3hk9 h VAL 284 Ca 0.11 -1.32 -0.00 0.00 0.82 0.00 0.00 66.70 66.31 3hk9 h VAL 284 Cb 0.31 1.11 -0.01 0.00 -1.52 0.00 0.00 31.29 31.18 3hk9 h VAL 284 CO 0.00 0.45 0.12 -0.08 0.02 0.00 0.00 177.57 178.08 3hk9 h GLU 285 N 0.79 0.26 -0.32 1.57 4.81 -0.70 -1.87 114.58 119.12 3hk9 h GLU 285 Ca 0.11 -0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 59.32 3hk9 h GLU 285 Cb 0.72 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 30.03 3hk9 h GLU 285 CO 0.06 0.22 0.20 1.25 -0.73 0.00 0.00 179.01 180.00 3hk9 h HIS 286 N 0.23 0.42 -0.51 0.92 2.76 -0.98 -1.44 115.15 116.54 3hk9 h HIS 286 Ca 0.07 0.00 0.01 0.00 -2.20 0.00 0.00 60.37 58.25 3hk9 h HIS 286 Cb 0.02 -0.14 -0.03 0.00 1.55 0.00 0.00 27.41 28.82 3hk9 h HIS 286 CO -0.05 0.30 0.33 -0.07 -1.30 0.00 0.00 177.93 177.14 3hk9 h LEU 287 N 0.42 0.56 -0.27 0.26 3.38 -1.20 0.84 115.31 119.29 3hk9 h LEU 287 Ca 0.12 -0.01 -0.04 0.00 0.09 0.00 0.00 57.88 58.04 3hk9 h LEU 287 Cb -0.00 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.61 3hk9 h LEU 287 CO -0.02 0.40 0.00 -0.07 0.09 0.00 0.00 178.44 178.84 3hk9 h LEU 288 N 0.67 0.47 -0.04 1.67 3.38 -1.20 -1.58 115.31 118.68 3hk9 h LEU 288 Ca 0.20 -0.30 -0.01 0.00 0.09 0.00 0.00 57.88 57.85 3hk9 h LEU 288 Cb -0.04 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 40.58 3hk9 h LEU 288 CO -0.06 0.66 -0.03 -0.09 0.09 0.00 0.00 178.44 179.01 3hk9 h ARG 289 N 0.27 0.09 0.00 1.13 2.43 -1.13 -3.31 114.38 113.86 3hk9 h ARG 289 Ca 0.08 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.20 3hk9 h ARG 289 Cb 0.42 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.97 3hk9 h ARG 289 CO 0.01 0.54 0.00 0.93 -1.51 0.00 0.00 179.97 179.95 3hk9 h GLU 290 N -0.36 0.00 -2.22 0.20 4.39 -0.91 -3.34 114.58 112.34 3hk9 h GLU 290 Ca 0.01 0.00 -0.57 0.00 0.34 0.00 0.00 59.36 59.13 3hk9 h GLU 290 Cb 0.52 0.00 -0.42 0.00 -0.10 0.00 0.00 28.75 28.76 3hk9 h GLU 290 CO 0.01 0.00 -0.74 0.66 -1.16 0.00 0.00 179.01 177.78 3hk9 n TYR 291 N -2.57 3.25 0.29 4.33 4.01 -0.60 -4.90 117.16 120.96 3hk9 n TYR 291 Ca 0.04 -3.98 0.19 0.00 -0.16 0.00 0.00 57.90 54.00 3hk9 n TYR 291 Cb 0.42 -0.48 1.01 0.00 -0.31 0.00 0.00 39.34 39.98 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 3.15 0.00 -0.36 -0.72 0.13 -1.70 -0.17 132.00 132.33 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 0.61 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.74 3hk9 h PRO 292 CO 0.76 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.62 3hk9 n ASN 293 N -2.82 2.67 -4.57 1.44 3.02 -1.26 -4.87 115.26 108.87 3hk9 n ASN 293 Ca -0.02 -1.91 -0.32 0.00 -0.03 0.00 0.00 54.58 52.30 3hk9 n ASN 293 Cb 0.08 -0.24 -0.11 0.00 -0.61 0.00 0.00 39.78 38.91 3hk9 n ASN 293 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 3hk9 s ASN 294 N -1.36 4.45 -0.10 6.41 -0.87 -0.08 -4.78 114.94 118.62 3hk9 s ASN 294 Ca 0.35 -0.20 -0.03 0.00 -1.57 0.00 0.00 52.86 51.41 3hk9 s ASN 294 Cb 0.20 -0.98 -0.03 0.00 -0.02 0.00 0.00 41.25 40.41 3hk9 s ASN 294 CO 0.27 0.28 0.03 -0.54 -2.57 0.00 0.00 177.10 174.57 3hk9 s LYS 295 N -1.41 3.15 -0.04 -0.60 1.02 -1.26 -4.87 119.74 115.74 3hk9 s LYS 295 Ca 0.17 -0.36 0.03 0.00 0.02 0.00 0.00 55.97 55.83 3hk9 s LYS 295 Cb -0.11 -2.89 0.00 0.00 -0.52 0.00 0.00 37.83 34.31 3hk9 s LYS 295 CO 0.07 0.67 -0.14 -0.06 -0.92 0.00 0.00 175.35 174.97 3hk9 s PHE 296 N -0.78 1.42 -0.20 3.18 0.08 -0.35 -0.77 117.98 120.57 3hk9 s PHE 296 Ca 0.12 -0.41 -0.04 0.00 0.12 0.00 0.00 56.93 56.72 3hk9 s PHE 296 Cb -0.12 -0.98 -0.02 0.00 -0.57 0.00 0.00 43.02 41.33 3hk9 s PHE 296 CO 0.02 -0.15 -0.02 -0.51 -0.10 0.00 0.00 175.22 174.46 3hk9 s LEU 297 N 0.16 3.16 0.01 -0.37 1.43 -0.43 -0.92 118.68 121.71 3hk9 s LEU 297 Ca -0.05 -0.24 0.03 0.00 -1.03 0.00 0.00 54.13 52.84 3hk9 s LEU 297 Cb -0.11 -1.80 -0.01 0.00 0.03 0.00 0.00 46.19 44.30 3hk9 s LEU 297 CO 0.02 0.06 -0.09 -0.69 0.23 0.00 0.00 176.35 175.87 3hk9 s VAL 298 N 1.03 0.71 -0.03 -1.59 1.01 -0.60 -0.37 120.40 120.56 3hk9 s VAL 298 Ca 0.01 -0.54 -0.04 0.00 0.00 0.00 0.00 61.98 61.42 3hk9 s VAL 298 Cb -0.14 -0.63 0.01 0.00 0.00 0.00 0.00 36.38 35.62 3hk9 s VAL 298 CO 0.01 0.09 0.10 0.28 0.00 0.00 0.00 175.10 175.59 3hk9 s THR 299 N -0.43 0.02 0.11 3.92 -1.32 -1.06 -1.19 115.64 115.69 3hk9 s THR 299 Ca 0.01 -0.14 0.09 0.00 -1.21 0.00 0.00 61.69 60.44 3hk9 s THR 299 Cb -0.05 -0.20 -0.04 0.00 -1.51 0.00 0.00 72.50 70.71 3hk9 s THR 299 CO 0.00 -0.08 -0.23 -0.04 -2.21 0.00 0.00 174.62 172.06 3hk9 s MET 300 N -0.22 1.22 0.06 7.08 -1.94 -1.26 -1.97 119.30 122.28 3hk9 s MET 300 Ca -0.03 -1.23 0.12 0.00 -1.71 0.00 0.00 55.69 52.84 3hk9 s MET 300 Cb -0.02 -1.57 -0.17 0.00 2.01 0.00 0.00 34.83 35.08 3hk9 s MET 300 CO 0.00 0.37 0.97 1.25 -0.01 0.00 0.00 175.02 177.60 3hk9 h LEU 301 N 4.01 0.00 -9.65 -0.03 5.85 -1.21 -3.42 115.31 110.85 3hk9 h LEU 301 Ca -0.48 0.00 -0.50 0.00 0.84 0.00 0.00 57.88 57.74 3hk9 h LEU 301 Cb 1.18 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 42.19 3hk9 h LEU 301 CO 0.39 0.85 0.36 -0.55 -0.34 0.00 0.00 178.44 179.15 3hk9 s SER 302 N -6.24 7.57 0.35 1.25 0.15 -1.26 -4.57 113.70 110.94 3hk9 s SER 302 Ca -0.02 1.87 0.05 0.00 0.70 0.00 0.00 55.95 58.56 3hk9 s SER 302 Cb 0.09 -2.60 0.64 0.00 -1.71 0.00 0.00 66.02 62.44 3hk9 s SER 302 CO 0.81 0.04 1.89 -0.09 1.20 0.00 0.00 173.24 177.09 3hk9 h ARG 303 N 4.91 0.49 0.00 5.44 2.43 -1.95 -2.72 114.38 122.98 3hk9 h ARG 303 Ca -0.44 -0.10 0.00 0.00 -0.81 0.00 0.00 59.98 58.63 3hk9 h ARG 303 Cb 1.21 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 30.68 3hk9 h ARG 303 CO 0.70 0.52 0.00 0.39 -1.51 0.00 0.00 179.97 180.07 3hk9 n GLU 304 N -4.29 0.70 -0.00 0.20 4.71 -1.26 -2.82 120.64 117.87 3hk9 n GLU 304 Ca 0.01 0.01 0.08 0.00 -0.01 0.00 0.00 57.16 57.25 3hk9 n GLU 304 Cb 0.23 -1.50 -0.10 0.00 -1.01 0.00 0.00 31.44 29.06 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 -1.06 0.95 0.09 1.62 5.03 -1.02 -4.72 115.26 116.15 3hk9 n ASN 305 Ca 0.17 -0.54 -0.12 0.00 0.87 0.00 0.00 54.58 54.96 3hk9 n ASN 305 Cb 0.11 1.28 -0.06 0.00 -1.02 0.00 0.00 39.78 40.09 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 -0.26 -0.35 3.52 1.08 -1.58 -1.86 115.11 115.66 3hk9 h GLN 306 Ca 0.00 0.02 -0.01 0.00 -1.45 0.00 0.00 58.65 57.21 3hk9 h GLN 306 Cb 0.51 0.06 -0.02 0.00 -0.05 0.00 0.00 27.48 27.98 3hk9 h GLN 306 CO 0.00 -0.17 0.19 1.25 -0.95 0.00 0.00 178.83 179.15 3hk9 h HIS 307 N -0.27 0.48 0.00 2.96 2.76 -1.84 -2.56 115.15 116.69 3hk9 h HIS 307 Ca 0.02 -0.01 -0.05 0.00 -2.20 0.00 0.00 60.37 58.13 3hk9 h HIS 307 Cb 0.28 -0.15 -0.01 0.00 1.55 0.00 0.00 27.41 29.08 3hk9 h HIS 307 CO -0.15 0.38 -0.22 1.05 -1.30 0.00 0.00 177.93 177.70 3hk9 h GLU 308 N 0.44 0.00 -0.52 5.26 4.11 -1.85 -2.08 114.58 119.94 3hk9 h GLU 308 Ca 0.12 0.00 -0.12 0.00 0.07 0.00 0.00 59.36 59.44 3hk9 h GLU 308 Cb 0.06 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.30 3hk9 h GLU 308 CO -0.02 0.22 -0.13 1.25 0.07 0.00 0.00 179.01 180.40 3hk9 h LEU 309 N 0.00 1.01 -0.71 3.06 5.85 -1.02 -0.79 115.31 122.71 3hk9 h LEU 309 Ca -0.00 -0.36 -0.04 0.00 0.84 0.00 0.00 57.88 58.32 3hk9 h LEU 309 Cb 0.59 -0.28 -0.03 0.00 0.37 0.00 0.00 40.66 41.31 3hk9 h LEU 309 CO 0.03 1.14 0.28 0.58 -0.34 0.00 0.00 178.44 180.13 3hk9 h VAL 310 N 0.87 1.25 -0.46 1.05 2.07 -1.02 -1.34 116.25 118.67 3hk9 h VAL 310 Ca 0.13 -0.79 -0.08 0.00 0.82 0.00 0.00 66.70 66.79 3hk9 h VAL 310 Cb 0.70 0.43 -0.02 0.00 -1.52 0.00 0.00 31.29 30.88 3hk9 h VAL 310 CO 0.05 0.31 -0.04 0.58 0.02 0.00 0.00 177.57 178.50 3hk9 h VAL 311 N 1.02 1.25 -0.30 2.57 2.07 -1.04 -2.12 116.25 119.70 3hk9 h VAL 311 Ca 0.24 -1.06 -0.06 0.00 0.82 0.00 0.00 66.70 66.64 3hk9 h VAL 311 Cb 0.22 0.94 -0.02 0.00 -1.52 0.00 0.00 31.29 30.91 3hk9 h VAL 311 CO -0.02 0.37 -0.07 0.25 0.02 0.00 0.00 177.57 178.12 3hk9 h LEU 312 N 0.72 0.46 -1.32 2.57 5.85 -0.62 -0.97 115.31 122.00 3hk9 h LEU 312 Ca 0.13 -0.10 -0.05 0.00 0.84 0.00 0.00 57.88 58.70 3hk9 h LEU 312 Cb 0.50 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.39 3hk9 h LEU 312 CO 0.03 0.57 -0.09 0.00 -0.34 0.00 0.00 178.44 178.61 3hk9 h ALA 313 N 1.48 1.44 0.00 1.25 0.00 -0.62 -1.23 119.26 121.58 3hk9 h ALA 313 Ca 0.09 -0.21 -0.04 0.00 0.00 0.00 0.00 54.91 54.76 3hk9 h ALA 313 Cb 0.40 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 3hk9 h ALA 313 CO 0.02 0.39 -0.19 0.00 0.00 0.00 0.00 179.25 179.47 3hk9 h ARG 314 N 0.34 0.00 0.15 0.00 3.08 -0.65 -3.17 114.38 114.13 3hk9 h ARG 314 Ca 0.07 0.00 -0.33 0.00 0.07 0.00 0.00 59.98 59.79 3hk9 h ARG 314 Cb 0.37 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.42 3hk9 h ARG 314 CO 0.02 0.19 -1.63 0.87 -1.07 0.00 0.00 179.97 178.35 3hk9 h LYS 315 N 0.00 0.32 -4.70 0.04 1.79 -1.05 -3.46 116.57 109.51 3hk9 h LYS 315 Ca -0.00 -0.55 -0.62 0.00 -2.18 0.00 0.00 60.65 57.30 3hk9 h LYS 315 Cb 0.43 0.20 -0.36 0.00 -1.58 0.00 0.00 32.23 30.92 3hk9 h LYS 315 CO 0.02 1.21 -0.83 -0.06 -1.08 0.00 0.00 179.45 178.71 3hk9 s PHE 316 N -2.60 2.33 -0.78 -1.35 0.08 -0.83 -4.98 117.98 109.85 3hk9 s PHE 316 Ca -0.12 -1.39 0.20 0.00 0.12 0.00 0.00 56.93 55.74 3hk9 s PHE 316 Cb 0.06 -1.66 0.81 0.00 -0.57 0.00 0.00 43.02 41.67 3hk9 s PHE 316 CO 0.86 -0.71 1.61 -1.13 -0.10 0.00 0.00 175.22 175.75 3hk9 n SER 317 N 4.72 0.31 -0.71 1.36 3.41 -1.26 -2.11 113.62 119.35 3hk9 n SER 317 Ca -0.17 0.57 0.07 0.00 -0.26 0.00 0.00 58.87 59.08 3hk9 n SER 317 Cb 0.49 -0.64 0.19 0.00 -0.26 0.00 0.00 64.21 64.00 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 -1.83 2.05 -4.45 4.04 6.94 -1.26 -4.77 115.26 115.98 3hk9 n ASN 318 Ca 0.03 -1.97 -0.34 0.00 -0.02 0.00 0.00 54.58 52.29 3hk9 n ASN 318 Cb 0.22 -0.24 -0.13 0.00 -2.36 0.00 0.00 39.78 37.27 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 -1.07 3.11 -0.21 -4.53 2.96 -0.90 -1.21 118.68 116.85 3hk9 s LEU 319 Ca 0.27 -0.20 0.00 0.00 -0.22 0.00 0.00 54.13 53.98 3hk9 s LEU 319 Cb 0.14 -1.75 0.05 0.00 0.50 0.00 0.00 46.19 45.13 3hk9 s LEU 319 CO 0.19 0.14 -0.06 -0.32 -1.32 0.00 0.00 176.35 174.97 3hk9 s MET 320 N 0.52 1.67 0.17 1.98 -2.45 -0.10 -4.94 119.30 116.15 3hk9 s MET 320 Ca -0.04 -0.82 -0.15 0.00 -1.25 0.00 0.00 55.69 53.43 3hk9 s MET 320 Cb -0.15 -2.39 -0.07 0.00 1.25 0.00 0.00 34.83 33.47 3hk9 s MET 320 CO 0.03 -0.51 0.58 0.96 1.05 0.00 0.00 175.02 177.13 3hk9 s ILE 321 N 1.47 4.81 0.04 10.11 -4.36 -1.26 -1.55 121.20 130.45 3hk9 s ILE 321 Ca -0.03 0.89 -0.04 0.00 -0.26 0.00 0.00 60.65 61.21 3hk9 s ILE 321 Cb -0.17 -3.75 -0.02 0.00 1.25 0.00 0.00 42.46 39.77 3hk9 s ILE 321 CO -0.07 0.22 0.07 0.72 0.24 0.00 0.00 174.94 176.11 3hk9 s PHE 322 N -1.50 0.26 0.24 1.37 -0.12 -0.34 -2.32 117.98 115.58 3hk9 s PHE 322 Ca 0.39 -0.61 0.00 0.00 -0.05 0.00 0.00 56.93 56.66 3hk9 s PHE 322 Cb -0.15 -0.18 0.00 0.00 -0.63 0.00 0.00 43.02 42.06 3hk9 s PHE 322 CO 0.19 -0.36 0.00 0.41 -0.05 0.00 0.00 175.22 175.41 3hk9 n GLY 323 N 0.67 -1.30 2.96 1.99 0.00 0.01 -4.39 105.19 105.14 3hk9 n GLY 323 Ca -0.18 -0.56 -0.30 0.00 0.00 0.00 0.00 46.02 44.98 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 -0.10 3.29 0.00 0.00 -0.00 -1.26 -3.31 118.94 117.55 3hk9 s TRP 325 Ca 0.16 1.34 0.00 0.00 -0.00 0.00 0.00 56.10 57.60 3hk9 s TRP 325 Cb -0.25 -3.34 0.00 0.00 -0.00 0.00 0.00 33.47 29.88 3hk9 s TRP 325 CO -0.01 -0.94 0.00 1.87 -0.00 0.00 0.00 176.95 177.87 3hk9 n TRP 326 N 5.25 0.00 0.64 5.86 -0.00 -1.26 -0.83 117.44 127.10 3hk9 n TRP 326 Ca 0.10 0.00 0.08 0.00 -0.00 0.00 0.00 57.50 57.68 3hk9 n TRP 326 Cb 0.47 0.00 0.36 0.00 -0.00 0.00 0.00 31.31 32.14 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 0.00 0.72 5.87 3.72 -1.26 -1.08 117.46 125.44 3hk9 n PHE 327 Ca 0.00 0.00 0.11 0.00 -0.05 0.00 0.00 57.45 57.51 3hk9 n PHE 327 Cb 0.00 -0.38 0.04 0.00 -0.94 0.00 0.00 39.48 38.20 3hk9 n PHE 327 CO 0.00 0.00 0.00 -1.33 -0.05 0.00 0.00 176.76 175.38 3hk9 n MET 328 N -1.38 0.18 -1.19 -1.08 2.81 -0.01 -4.56 117.12 111.90 3hk9 n MET 328 Ca 0.06 -0.01 -0.21 0.00 -1.81 0.00 0.00 57.70 55.73 3hk9 n MET 328 Cb 0.15 -1.56 -0.12 0.00 -0.71 0.00 0.00 33.22 30.99 3hk9 n MET 328 CO 0.00 0.00 0.00 -1.71 1.51 0.00 0.00 175.97 175.77 3hk9 n ASN 329 N -1.79 6.33 -4.04 7.83 5.15 -0.24 -3.70 115.26 124.80 3hk9 n ASN 329 Ca 0.03 -2.63 -0.22 0.00 -0.60 0.00 0.00 54.58 51.15 3hk9 n ASN 329 Cb 0.40 -1.42 -0.16 0.00 -0.53 0.00 0.00 39.78 38.07 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 1.73 1.52 0.16 1.20 0.01 -1.26 -4.97 114.94 113.32 3hk9 s ASN 330 Ca 0.66 -0.24 -0.10 0.00 -0.71 0.00 0.00 52.86 52.46 3hk9 s ASN 330 Cb 0.29 -0.44 0.19 0.00 0.41 0.00 0.00 41.25 41.70 3hk9 s ASN 330 CO -0.05 0.09 1.04 -2.65 -1.51 0.00 0.00 177.10 174.01 3hk9 n PRO 331 N 3.31 -0.14 -0.28 -0.60 -0.02 -1.26 -0.07 135.00 135.93 3hk9 n PRO 331 Ca -0.19 1.03 0.05 0.00 -2.02 0.00 0.00 63.50 62.37 3hk9 n PRO 331 Cb 0.54 -1.53 0.26 0.00 -0.02 0.00 0.00 33.50 32.75 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 0.94 0.18 -0.52 4.57 -1.97 -1.67 114.58 116.10 3hk9 h GLU 332 Ca 0.25 -0.06 -0.33 0.00 -1.18 0.00 0.00 59.36 58.05 3hk9 h GLU 332 Cb 0.42 -0.21 0.01 0.00 -0.16 0.00 0.00 28.75 28.81 3hk9 h GLU 332 CO -0.67 0.62 -1.60 0.82 -1.18 0.00 0.00 179.01 177.00 3hk9 h ILE 333 N 0.97 1.02 -0.99 2.32 1.08 -0.74 -3.10 117.51 118.07 3hk9 h ILE 333 Ca 0.38 -2.51 0.09 0.00 -0.39 0.00 0.00 64.86 62.44 3hk9 h ILE 333 Cb 0.24 2.81 -0.07 0.00 -3.07 0.00 0.00 36.82 36.72 3hk9 h ILE 333 CO -0.14 0.81 0.63 0.40 -0.69 0.00 0.00 178.15 179.16 3hk9 h ILE 334 N 0.00 1.00 0.19 -0.67 2.04 -0.88 0.13 117.51 119.32 3hk9 h ILE 334 Ca -0.32 -0.36 -0.01 0.00 1.00 0.00 0.00 64.86 65.17 3hk9 h ILE 334 Cb 2.02 -0.16 0.00 0.00 -0.74 0.00 0.00 36.82 37.94 3hk9 h ILE 334 CO 0.16 0.19 -0.09 -1.13 0.00 0.00 0.00 178.15 177.29 3hk9 h ASN 335 N 1.06 -0.21 -0.64 1.72 -1.24 -1.41 -0.45 115.58 114.41 3hk9 h ASN 335 Ca 0.46 -0.24 -0.04 0.00 0.71 0.00 0.00 56.30 57.18 3hk9 h ASN 335 Cb 0.34 0.05 -0.03 0.00 0.73 0.00 0.00 38.32 39.41 3hk9 h ASN 335 CO -0.21 0.14 0.24 1.05 -1.29 0.00 0.00 177.43 177.36 3hk9 h GLU 336 N -0.60 1.00 -0.09 6.67 4.11 -1.38 -1.68 114.58 122.61 3hk9 h GLU 336 Ca -0.03 -0.18 -0.01 0.00 0.07 0.00 0.00 59.36 59.21 3hk9 h GLU 336 Cb 0.44 -0.16 -0.00 0.00 0.50 0.00 0.00 28.75 29.53 3hk9 h GLU 336 CO 0.04 0.83 0.00 0.52 0.07 0.00 0.00 179.01 180.47 3hk9 h MET 337 N 0.97 0.16 -0.16 1.06 2.86 -0.75 -1.32 114.93 117.76 3hk9 h MET 337 Ca 0.22 -0.05 -0.04 0.00 -2.06 0.00 0.00 59.70 57.77 3hk9 h MET 337 Cb 0.23 -0.01 -0.01 0.00 0.06 0.00 0.00 31.60 31.86 3hk9 h MET 337 CO -0.02 0.42 -0.07 1.15 1.06 0.00 0.00 176.91 179.45 3hk9 h THR 338 N -0.11 1.15 -0.05 2.22 2.02 -0.94 0.15 112.91 117.35 3hk9 h THR 338 Ca 0.03 -0.63 -0.12 0.00 0.77 0.00 0.00 66.41 66.46 3hk9 h THR 338 Cb 0.35 1.11 0.01 0.00 -1.74 0.00 0.00 68.15 67.88 3hk9 h THR 338 CO 0.00 0.20 -0.45 0.03 0.37 0.00 0.00 175.52 175.67 3hk9 h ARG 339 N 0.23 0.39 -0.67 6.66 3.08 -1.23 -1.80 114.38 121.04 3hk9 h ARG 339 Ca 0.05 -0.36 -0.01 0.00 0.07 0.00 0.00 59.98 59.74 3hk9 h ARG 339 Cb 0.28 0.09 -0.03 0.00 0.08 0.00 0.00 29.97 30.39 3hk9 h ARG 339 CO 0.01 1.01 0.39 0.52 -1.07 0.00 0.00 179.97 180.84 3hk9 h MET 340 N -0.10 0.92 0.16 0.04 2.86 -0.96 -1.23 114.93 116.62 3hk9 h MET 340 Ca -0.04 -0.09 -0.01 0.00 -2.06 0.00 0.00 59.70 57.50 3hk9 h MET 340 Cb 1.13 -0.19 0.00 0.00 0.06 0.00 0.00 31.60 32.61 3hk9 h MET 340 CO 0.09 0.67 -0.08 0.00 1.06 0.00 0.00 176.91 178.65 3hk9 h ARG 341 N 0.91 -0.21 -0.70 1.72 3.08 -0.99 -2.35 114.38 115.84 3hk9 h ARG 341 Ca 0.24 0.01 -0.04 0.00 0.07 0.00 0.00 59.98 60.26 3hk9 h ARG 341 Cb -0.00 0.05 -0.03 0.00 0.08 0.00 0.00 29.97 30.06 3hk9 h ARG 341 CO -0.04 -0.05 0.26 1.98 -1.07 0.00 0.00 179.97 181.05 3hk9 h MET 342 N -0.33 1.05 -0.27 0.04 4.05 -1.22 0.84 114.93 119.08 3hk9 h MET 342 Ca -0.02 -0.19 -0.06 0.00 -0.28 0.00 0.00 59.70 59.15 3hk9 h MET 342 Cb 0.26 -0.17 -0.02 0.00 -0.80 0.00 0.00 31.60 30.87 3hk9 h MET 342 CO 0.04 0.86 -0.09 0.93 0.23 0.00 0.00 176.91 178.88 3hk9 h GLU 343 N 1.02 0.43 0.00 0.39 5.08 -1.17 0.20 114.58 120.54 3hk9 h GLU 343 Ca 0.23 -0.11 0.00 0.00 -1.00 0.00 0.00 59.36 58.48 3hk9 h GLU 343 Cb 0.22 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.42 3hk9 h GLU 343 CO -0.02 0.53 -1.31 -1.33 -1.00 0.00 0.00 179.01 175.89 3hk9 n MET 344 N -4.24 0.78 0.00 2.33 2.81 -0.89 -4.62 117.12 113.28 3hk9 n MET 344 Ca 0.01 -0.08 0.00 0.00 -1.81 0.00 0.00 57.70 55.82 3hk9 n MET 344 Cb 0.29 -1.40 0.00 0.00 -0.71 0.00 0.00 33.22 31.39 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 -1.76 0.77 0.00 4.03 4.77 0.29 -4.89 117.00 120.21 3hk9 n LEU 345 Ca 0.00 -0.77 0.00 0.00 -0.03 0.00 0.00 56.01 55.21 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 0.38 0.19 0.00 0.61 -1.33 0.00 0.00 177.39 177.25 3hk9 n GLY 346 N -0.03 3.60 1.16 -0.72 0.00 0.71 -1.48 105.19 108.42 3hk9 n GLY 346 Ca 0.00 -0.07 0.09 0.00 0.00 0.00 0.00 46.02 46.03 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 1.42 -1.57 2.61 -2.24 -1.26 -4.28 114.28 108.96 3hk9 n THR 347 Ca 0.00 -1.17 -0.34 0.00 -2.27 0.00 0.00 64.05 60.27 3hk9 n THR 347 Cb 0.00 0.29 -0.04 0.00 -2.10 0.00 0.00 70.33 68.48 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 0.88 7.73 -3.57 3.42 3.41 -0.55 -4.71 113.62 120.23 3hk9 n SER 348 Ca 0.21 -2.88 -0.07 0.00 -0.26 0.00 0.00 58.87 55.86 3hk9 n SER 348 Cb 0.68 -1.42 -0.01 0.00 -0.26 0.00 0.00 64.21 63.21 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 0.13 -0.09 -0.38 7.33 -0.12 -1.26 -4.85 117.98 118.74 3hk9 s PHE 349 Ca 0.62 -0.42 -0.03 0.00 -0.05 0.00 0.00 56.93 57.04 3hk9 s PHE 349 Cb 0.23 0.74 0.09 0.00 -0.63 0.00 0.00 43.02 43.45 3hk9 s PHE 349 CO -0.09 -1.30 0.16 0.42 -0.05 0.00 0.00 175.22 174.36 3hk9 s ILE 350 N -3.35 3.28 0.43 -4.49 1.01 -0.98 -4.67 121.20 112.43 3hk9 s ILE 350 Ca 0.13 -1.84 0.10 0.00 0.00 0.00 0.00 60.65 59.04 3hk9 s ILE 350 Cb -0.05 -3.14 0.24 0.00 0.01 0.00 0.00 42.46 39.51 3hk9 s ILE 350 CO 0.08 -0.53 2.05 1.55 0.00 0.00 0.00 174.94 178.08 3hk9 h PRO 351 N 8.06 0.30 -3.19 2.79 0.13 -1.86 0.07 132.00 138.31 3hk9 h PRO 351 Ca -0.16 -0.03 -0.03 0.00 -0.87 0.00 0.00 66.00 64.91 3hk9 h PRO 351 Cb 1.05 -0.06 -0.12 0.00 0.13 0.00 0.00 31.00 32.00 3hk9 h PRO 351 CO 0.66 0.26 0.08 -1.14 -0.23 0.00 0.00 178.00 177.63 3hk9 s GLN 352 N -5.16 1.22 0.05 0.86 2.00 -1.26 -3.56 119.66 113.80 3hk9 s GLN 352 Ca -0.07 -0.62 -0.09 0.00 -2.00 0.00 0.00 55.36 52.59 3hk9 s GLN 352 Cb 0.17 0.54 0.00 0.00 0.80 0.00 0.00 33.01 34.51 3hk9 s GLN 352 CO 0.71 -0.51 0.19 -3.38 -0.50 0.00 0.00 175.29 171.80 3hk9 s HIS 353 N -3.79 0.08 -0.02 1.67 -3.43 -1.26 -4.61 115.29 103.92 3hk9 s HIS 353 Ca 0.03 -0.34 0.04 0.00 -0.80 0.00 0.00 55.06 53.99 3hk9 s HIS 353 Cb 0.00 -0.04 -0.25 0.00 -1.43 0.00 0.00 32.58 30.86 3hk9 s HIS 353 CO -0.11 -0.44 0.74 0.66 -2.00 0.00 0.00 174.74 173.59 3hk9 h SER 354 N 3.37 0.18 -1.64 7.38 4.64 -1.93 -3.44 113.55 122.10 3hk9 h SER 354 Ca -0.32 -0.31 -0.35 0.00 -0.47 0.00 0.00 61.79 60.34 3hk9 h SER 354 Cb 1.19 -0.06 -0.08 0.00 -0.31 0.00 0.00 62.40 63.15 3hk9 h SER 354 CO 0.50 1.27 -0.38 -0.67 -0.87 0.00 0.00 176.83 176.68 3hk9 n ASP 355 N -3.27 -5.05 -4.70 4.97 -0.08 -0.13 -4.90 116.55 103.39 3hk9 n ASP 355 Ca -0.17 0.20 -0.43 0.00 -1.51 0.00 0.00 54.79 52.87 3hk9 n ASP 355 Cb 1.04 -4.10 -0.03 0.00 2.34 0.00 0.00 41.12 40.37 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 -0.28 2.24 -0.02 -1.67 0.00 -1.26 -4.38 120.51 115.15 3hk9 n ALA 356 Ca -0.19 0.41 0.05 0.00 0.00 0.00 0.00 53.44 53.72 3hk9 n ALA 356 Cb 0.61 -2.45 -0.12 0.00 0.00 0.00 0.00 19.45 17.49 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 3.46 0.67 -4.61 0.00 1.74 -1.26 0.76 116.66 117.42 3hk9 n ARG 357 Ca 0.15 -0.12 -0.30 0.00 -0.77 0.00 0.00 57.85 56.81 3hk9 n ARG 357 Cb 0.33 -1.39 -0.17 0.00 -1.02 0.00 0.00 32.46 30.22 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 -3.00 1.70 0.16 1.55 1.01 -1.26 -4.30 120.40 116.26 3hk9 s VAL 358 Ca -0.06 -0.77 -0.25 0.00 0.00 0.00 0.00 61.98 60.90 3hk9 s VAL 358 Cb 0.09 -1.53 0.01 0.00 0.00 0.00 0.00 36.38 34.95 3hk9 s VAL 358 CO 0.67 0.48 1.39 -0.11 0.00 0.00 0.00 175.10 177.52 3hk9 n LEU 359 N 4.06 -0.86 0.27 3.92 7.94 -0.13 -0.96 117.00 131.24 3hk9 n LEU 359 Ca -0.20 1.59 0.17 0.00 -1.11 0.00 0.00 56.01 56.47 3hk9 n LEU 359 Cb 0.52 -0.24 0.82 0.00 0.53 0.00 0.00 43.42 45.04 3hk9 n LEU 359 CO 0.25 -1.33 1.14 -0.33 -1.11 0.00 0.00 177.39 176.02 3hk9 h GLU 360 N 0.00 0.00 0.00 1.96 3.07 -1.94 -2.16 114.58 115.51 3hk9 h GLU 360 Ca 0.19 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.05 3hk9 h GLU 360 Cb 0.41 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.32 3hk9 h GLU 360 CO -0.86 0.00 0.00 1.96 -1.40 0.00 0.00 179.01 178.71 3hk9 h GLN 361 N 0.00 0.00 -0.29 2.33 4.20 -1.45 -1.10 115.11 118.80 3hk9 h GLN 361 Ca 0.06 0.00 0.02 0.00 0.06 0.00 0.00 58.65 58.78 3hk9 h GLN 361 Cb 0.73 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.49 3hk9 h GLN 361 CO -0.00 0.00 0.19 -0.07 -0.67 0.00 0.00 178.83 178.28 3hk9 h LEU 362 N 0.00 0.27 0.28 1.46 3.38 -1.57 0.14 115.31 119.26 3hk9 h LEU 362 Ca 0.00 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 3hk9 h LEU 362 Cb 0.10 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 40.79 3hk9 h LEU 362 CO 0.00 0.19 -0.13 0.40 0.09 0.00 0.00 178.44 178.99 3hk9 h ILE 363 N 0.32 0.76 0.22 1.22 2.04 -1.43 -2.87 117.51 117.77 3hk9 h ILE 363 Ca 0.11 -0.27 -0.31 0.00 1.00 0.00 0.00 64.86 65.40 3hk9 h ILE 363 Cb 0.07 0.92 0.04 0.00 -0.74 0.00 0.00 36.82 37.10 3hk9 h ILE 363 CO -0.02 0.06 -1.34 0.10 0.00 0.00 0.00 178.15 176.94 3hk9 h TYR 364 N -0.51 0.93 -0.41 1.37 -0.00 -1.59 -1.70 116.97 115.06 3hk9 h TYR 364 Ca -0.04 -0.66 0.08 0.00 0.00 0.00 0.00 58.73 58.11 3hk9 h TYR 364 Cb 0.38 -0.04 -0.07 0.00 0.00 0.00 0.00 36.73 36.99 3hk9 h TYR 364 CO -0.02 1.51 -0.06 0.87 -0.00 0.00 0.00 178.16 180.47 3hk9 h LYS 365 N 0.09 0.05 -0.01 0.10 1.79 -1.10 0.16 116.57 117.65 3hk9 h LYS 365 Ca -0.23 -0.00 -0.20 0.00 -2.18 0.00 0.00 60.65 58.04 3hk9 h LYS 365 Cb 2.05 -0.01 -0.01 0.00 -1.58 0.00 0.00 32.23 32.68 3hk9 h LYS 365 CO 0.25 0.03 -0.85 -1.49 -1.08 0.00 0.00 179.45 176.31 3hk9 h TRP 366 N 0.05 0.42 0.02 -1.35 4.06 -1.60 -2.04 115.95 115.50 3hk9 h TRP 366 Ca 0.20 -0.22 -0.00 0.00 2.06 0.00 0.00 58.89 60.93 3hk9 h TRP 366 Cb 0.30 -0.05 0.00 0.00 -1.00 0.00 0.00 29.16 28.41 3hk9 h TRP 366 CO -0.32 1.01 -0.01 1.25 -3.56 0.00 0.00 178.44 176.81 3hk9 h HIS 367 N 0.17 -0.02 -0.74 0.49 2.76 -0.73 0.40 115.15 117.47 3hk9 h HIS 367 Ca -0.05 -0.00 -0.03 0.00 -2.20 0.00 0.00 60.37 58.09 3hk9 h HIS 367 Cb 1.47 0.01 -0.03 0.00 1.55 0.00 0.00 27.41 30.40 3hk9 h HIS 367 CO 0.04 0.30 0.36 0.45 -1.30 0.00 0.00 177.93 177.77 3hk9 h HIS 368 N -0.34 1.07 -0.17 5.26 3.86 -0.77 -2.80 115.15 121.26 3hk9 h HIS 368 Ca -0.00 -0.05 -0.16 0.00 -1.16 0.00 0.00 60.37 59.00 3hk9 h HIS 368 Cb 0.33 -0.33 0.00 0.00 1.06 0.00 0.00 27.41 28.47 3hk9 h HIS 368 CO 0.03 0.79 -0.50 0.77 0.86 0.00 0.00 177.93 179.88 3hk9 h SER 369 N 1.05 0.75 -0.79 2.45 0.02 -1.35 -3.21 113.55 112.47 3hk9 h SER 369 Ca 0.26 -0.59 0.02 0.00 -0.84 0.00 0.00 61.79 60.64 3hk9 h SER 369 Cb 0.12 -0.22 -0.04 0.00 0.14 0.00 0.00 62.40 62.40 3hk9 h SER 369 CO -0.03 1.20 0.51 0.11 -1.14 0.00 0.00 176.83 177.48 3hk9 h LYS 370 N 0.33 0.99 -0.89 3.45 1.57 -0.87 -0.17 116.57 120.97 3hk9 h LYS 370 Ca -0.01 -0.06 0.01 0.00 -1.87 0.00 0.00 60.65 58.72 3hk9 h LYS 370 Cb 1.12 -0.22 -0.05 0.00 0.08 0.00 0.00 32.23 33.17 3hk9 h LYS 370 CO 0.11 0.65 0.59 0.66 -0.57 0.00 0.00 179.45 180.89 3hk9 h SER 371 N 1.02 1.02 -0.25 0.86 4.64 -1.55 0.22 113.55 119.51 3hk9 h SER 371 Ca 0.30 -0.02 -0.12 0.00 -0.47 0.00 0.00 61.79 61.48 3hk9 h SER 371 Cb -0.05 -0.25 -0.00 0.00 -0.31 0.00 0.00 62.40 61.79 3hk9 h SER 371 CO -0.09 0.73 -0.33 0.40 -0.87 0.00 0.00 176.83 176.68 3hk9 h ILE 372 N 1.20 1.31 -0.52 0.95 2.04 -1.46 -2.19 117.51 118.84 3hk9 h ILE 372 Ca 0.33 -1.52 -0.05 0.00 1.00 0.00 0.00 64.86 64.62 3hk9 h ILE 372 Cb -0.13 1.70 -0.02 0.00 -0.74 0.00 0.00 36.82 37.63 3hk9 h ILE 372 CO -0.08 0.48 0.11 0.40 0.00 0.00 0.00 178.15 179.06 3hk9 h ILE 373 N 0.38 1.23 -0.59 -0.67 2.04 -0.62 -1.93 117.51 117.34 3hk9 h ILE 373 Ca 0.03 -0.83 -0.04 0.00 1.00 0.00 0.00 64.86 65.01 3hk9 h ILE 373 Cb 0.91 0.71 -0.03 0.00 -0.74 0.00 0.00 36.82 37.67 3hk9 h ILE 373 CO 0.08 0.31 0.20 0.00 0.00 0.00 0.00 178.15 178.73 3hk9 h ALA 374 N 1.34 0.77 -0.55 1.87 0.00 -0.50 -0.52 119.26 121.68 3hk9 h ALA 374 Ca 0.17 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 3hk9 h ALA 374 Cb 0.31 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.85 3hk9 h ALA 374 CO 0.00 0.42 0.34 0.93 0.00 0.00 0.00 179.25 180.94 3hk9 h GLU 375 N 0.83 0.74 -0.37 0.00 5.08 -0.97 0.11 114.58 120.00 3hk9 h GLU 375 Ca 0.19 -0.06 -0.04 0.00 -1.00 0.00 0.00 59.36 58.45 3hk9 h GLU 375 Cb 0.27 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.34 3hk9 h GLU 375 CO -0.01 0.52 0.07 0.28 -1.00 0.00 0.00 179.01 178.88 3hk9 h VAL 376 N 0.74 1.23 -0.43 3.13 2.07 -1.10 -1.70 116.25 120.18 3hk9 h VAL 376 Ca 0.20 -0.81 -0.00 0.00 0.82 0.00 0.00 66.70 66.90 3hk9 h VAL 376 Cb -0.03 1.06 -0.02 0.00 -1.52 0.00 0.00 31.29 30.77 3hk9 h VAL 376 CO -0.04 0.28 0.26 -0.07 0.02 0.00 0.00 177.57 178.02 3hk9 h LEU 377 N 0.45 0.52 -0.41 2.57 3.38 -0.83 -1.27 115.31 119.72 3hk9 h LEU 377 Ca 0.11 -0.05 0.04 0.00 0.09 0.00 0.00 57.88 58.07 3hk9 h LEU 377 Cb 0.34 -0.13 -0.04 0.00 0.09 0.00 0.00 40.66 40.92 3hk9 h LEU 377 CO 0.00 0.42 0.18 0.40 0.09 0.00 0.00 178.44 179.53 3hk9 h ILE 378 N 0.58 0.92 -0.37 1.22 2.04 -0.61 0.11 117.51 121.40 3hk9 h ILE 378 Ca 0.16 -0.12 -0.01 0.00 1.00 0.00 0.00 64.86 65.89 3hk9 h ILE 378 Cb -0.01 0.53 -0.02 0.00 -0.74 0.00 0.00 36.82 36.58 3hk9 h ILE 378 CO -0.03 0.07 0.21 0.44 0.00 0.00 0.00 178.15 178.84 3hk9 h ASP 379 N 0.36 0.46 -0.61 1.72 3.32 -1.02 0.16 116.42 120.81 3hk9 h ASP 379 Ca 0.18 -0.07 -0.07 0.00 0.02 0.00 0.00 57.03 57.09 3hk9 h ASP 379 Cb 0.13 -0.12 -0.02 0.00 0.22 0.00 0.00 39.33 39.54 3hk9 h ASP 379 CO -0.16 0.40 0.12 0.11 -1.72 0.00 0.00 179.24 177.99 3hk9 h LYS 380 N 0.48 0.99 -0.41 3.56 6.56 -0.88 -0.26 116.57 126.61 3hk9 h LYS 380 Ca 0.13 -0.26 -0.14 0.00 -1.06 0.00 0.00 60.65 59.33 3hk9 h LYS 380 Cb 0.04 -0.12 -0.01 0.00 -0.57 0.00 0.00 32.23 31.56 3hk9 h LYS 380 CO -0.02 0.92 -0.29 1.88 -2.06 0.00 0.00 179.45 179.88 3hk9 h TYR 381 N 0.90 1.02 -0.80 -1.35 0.05 -0.63 -2.90 116.97 113.26 3hk9 h TYR 381 Ca 0.19 -0.27 -0.03 0.00 0.05 0.00 0.00 58.73 58.67 3hk9 h TYR 381 Cb 0.40 -0.23 -0.04 0.00 1.01 0.00 0.00 36.73 37.87 3hk9 h TYR 381 CO 0.03 1.06 0.38 0.22 -1.05 0.00 0.00 178.16 178.80 3hk9 h ASP 382 N 0.75 1.05 -0.89 3.88 3.58 -0.40 -1.10 116.42 123.29 3hk9 h ASP 382 Ca 0.09 -0.12 -0.02 0.00 0.42 0.00 0.00 57.03 57.39 3hk9 h ASP 382 Cb 0.85 -0.27 -0.04 0.00 1.72 0.00 0.00 39.33 41.59 3hk9 h ASP 382 CO 0.07 0.89 0.47 0.44 -2.88 0.00 0.00 179.24 178.23 3hk9 h ASP 383 N 1.15 1.12 1.15 2.28 3.32 -0.86 -1.05 116.42 123.53 3hk9 h ASP 383 Ca 0.28 -0.11 -0.13 0.00 0.02 0.00 0.00 57.03 57.08 3hk9 h ASP 383 Cb 0.12 -0.29 -0.02 0.00 0.22 0.00 0.00 39.33 39.36 3hk9 h ASP 383 CO -0.03 0.91 -0.64 0.16 -1.72 0.00 0.00 179.24 177.92 3hk9 h ILE 384 N 1.25 1.17 -0.76 0.35 3.07 -1.30 -2.99 117.51 118.30 3hk9 h ILE 384 Ca 0.31 -2.44 -0.04 0.00 1.55 0.00 0.00 64.86 64.24 3hk9 h ILE 384 Cb 0.05 2.43 -0.03 0.00 -0.27 0.00 0.00 36.82 39.00 3hk9 h ILE 384 CO -0.05 0.62 0.31 0.25 -1.05 0.00 0.00 178.15 178.24 3hk9 h LEU 385 N 0.00 1.04 -1.78 0.16 5.85 -0.76 -0.39 115.31 119.43 3hk9 h LEU 385 Ca -0.01 -0.15 -0.01 0.00 0.84 0.00 0.00 57.88 58.55 3hk9 h LEU 385 Cb 1.38 -0.27 -0.00 0.00 0.37 0.00 0.00 40.66 42.14 3hk9 h LEU 385 CO 0.08 0.91 -0.06 1.56 -0.34 0.00 0.00 178.44 180.60 3hk9 h GLN 386 N 1.10 0.00 -0.36 1.25 1.08 -1.07 -0.70 115.11 116.42 3hk9 h GLN 386 Ca 0.26 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.46 3hk9 h GLN 386 Cb 0.19 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.62 3hk9 h GLN 386 CO -0.02 0.06 0.00 0.00 -0.95 0.00 0.00 178.83 177.92 3hk9 n ALA 387 N -2.15 2.45 -0.12 3.87 0.00 -0.42 -4.93 120.51 119.22 3hk9 n ALA 387 Ca -0.01 -0.77 0.00 0.00 0.00 0.00 0.00 53.44 52.67 3hk9 n ALA 387 Cb 0.27 -0.99 0.00 0.00 0.00 0.00 0.00 19.45 18.73 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 1.27 0.55 3.73 0.00 0.00 -0.27 -5.06 105.19 105.40 3hk9 n GLY 388 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 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 -2.27 3.74 -0.18 1.61 -0.11 -0.29 -4.97 118.94 116.47 3hk9 s TRP 389 Ca 0.00 1.64 -0.01 0.00 1.22 0.00 0.00 56.10 58.95 3hk9 s TRP 389 Cb 0.00 -2.98 -0.00 0.00 -1.50 0.00 0.00 33.47 28.99 3hk9 s TRP 389 CO 0.00 0.17 -0.11 -1.83 -4.62 0.00 0.00 176.95 170.56 3hk9 s GLU 390 N 0.26 3.28 0.20 5.86 1.03 -1.26 -3.64 118.70 124.43 3hk9 s GLU 390 Ca 0.45 -0.70 -0.01 0.00 0.03 0.00 0.00 54.97 54.74 3hk9 s GLU 390 Cb -0.22 -2.76 -0.04 0.00 -0.80 0.00 0.00 34.13 30.31 3hk9 s GLU 390 CO 0.26 -0.05 0.40 0.54 -1.33 0.00 0.00 175.26 175.08 3hk9 s VAL 391 N 1.02 5.19 0.22 1.83 0.11 -1.26 -4.77 120.40 122.75 3hk9 s VAL 391 Ca -0.01 -0.33 0.06 0.00 -2.93 0.00 0.00 61.98 58.77 3hk9 s VAL 391 Cb -0.15 -3.73 -0.04 0.00 -1.53 0.00 0.00 36.38 30.94 3hk9 s VAL 391 CO -0.02 -0.17 0.23 0.42 -3.33 0.00 0.00 175.10 172.22 3hk9 s THR 392 N -1.87 4.72 0.40 5.04 -4.23 -1.26 -1.19 115.64 117.24 3hk9 s THR 392 Ca 0.39 -1.17 0.06 0.00 -1.18 0.00 0.00 61.69 59.79 3hk9 s THR 392 Cb -0.11 -3.51 0.27 0.00 1.34 0.00 0.00 72.50 70.49 3hk9 s THR 392 CO 0.29 -0.26 2.05 -0.08 -0.54 0.00 0.00 174.62 176.07 3hk9 h GLU 393 N 1.71 0.61 -0.64 3.99 4.81 -1.99 -2.04 114.58 121.04 3hk9 h GLU 393 Ca -0.49 -0.04 -0.09 0.00 -0.13 0.00 0.00 59.36 58.61 3hk9 h GLU 393 Cb 1.22 -0.14 -0.02 0.00 0.63 0.00 0.00 28.75 30.44 3hk9 h GLU 393 CO 0.62 0.41 0.04 0.93 -0.73 0.00 0.00 179.01 180.27 3hk9 h GLU 394 N 0.63 1.10 -0.19 1.92 4.39 -1.99 -0.77 114.58 119.67 3hk9 h GLU 394 Ca 0.17 -0.33 -0.08 0.00 0.34 0.00 0.00 59.36 59.46 3hk9 h GLU 394 Cb -0.07 -0.11 -0.01 0.00 -0.10 0.00 0.00 28.75 28.45 3hk9 h GLU 394 CO -0.04 1.05 -0.24 0.93 -1.16 0.00 0.00 179.01 179.55 3hk9 h GLU 395 N 1.01 0.34 -0.06 2.33 5.08 -1.79 -0.20 114.58 121.28 3hk9 h GLU 395 Ca 0.18 -0.11 -0.01 0.00 -1.00 0.00 0.00 59.36 58.42 3hk9 h GLU 395 Cb 0.53 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.75 3hk9 h GLU 395 CO 0.03 0.56 -0.01 0.82 -1.00 0.00 0.00 179.01 179.41 3hk9 h ILE 396 N 0.30 1.27 -1.00 3.13 2.04 -1.02 -0.77 117.51 121.46 3hk9 h ILE 396 Ca 0.05 -0.84 0.05 0.00 1.00 0.00 0.00 64.86 65.11 3hk9 h ILE 396 Cb 0.59 1.73 -0.06 0.00 -0.74 0.00 0.00 36.82 38.34 3hk9 h ILE 396 CO 0.04 0.23 0.65 0.11 0.00 0.00 0.00 178.15 179.18 3hk9 h LYS 397 N -0.22 1.19 0.27 2.37 1.57 -0.87 0.38 116.57 121.26 3hk9 h LYS 397 Ca 0.02 -0.07 -0.01 0.00 -1.87 0.00 0.00 60.65 58.71 3hk9 h LYS 397 Cb 0.37 -0.27 0.00 0.00 0.08 0.00 0.00 32.23 32.42 3hk9 h LYS 397 CO 0.00 0.78 -0.13 -0.09 -0.57 0.00 0.00 179.45 179.45 3hk9 h ARG 398 N 1.22 -0.35 -0.48 3.15 2.43 -0.85 0.87 114.38 120.37 3hk9 h ARG 398 Ca 0.41 0.02 0.01 0.00 -0.81 0.00 0.00 59.98 59.62 3hk9 h ARG 398 Cb 0.08 0.08 -0.03 0.00 -0.42 0.00 0.00 29.97 29.68 3hk9 h ARG 398 CO -0.15 -0.20 0.30 -0.44 -1.51 0.00 0.00 179.97 177.97 3hk9 h ASP 399 N -0.40 0.50 -0.82 -3.80 3.32 -0.58 -1.07 116.42 113.57 3hk9 h ASP 399 Ca -0.04 -0.00 -0.03 0.00 0.02 0.00 0.00 57.03 56.98 3hk9 h ASP 399 Cb 0.31 -0.11 -0.04 0.00 0.22 0.00 0.00 39.33 39.71 3hk9 h ASP 399 CO 0.06 0.36 0.38 0.58 -1.72 0.00 0.00 179.24 178.89 3hk9 h VAL 400 N 0.60 1.26 -0.46 -1.35 2.07 -0.84 -1.82 116.25 115.71 3hk9 h VAL 400 Ca 0.19 -0.75 -0.05 0.00 0.82 0.00 0.00 66.70 66.91 3hk9 h VAL 400 Cb -0.02 0.23 -0.02 0.00 -1.52 0.00 0.00 31.29 29.96 3hk9 h VAL 400 CO -0.07 0.32 0.09 0.00 0.02 0.00 0.00 177.57 177.93 3hk9 h ALA 401 N 1.20 1.30 -0.30 1.67 0.00 -0.33 -1.89 119.26 120.91 3hk9 h ALA 401 Ca 0.28 -0.19 -0.04 0.00 0.00 0.00 0.00 54.91 54.96 3hk9 h ALA 401 Cb 0.15 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 3hk9 h ALA 401 CO -0.03 0.49 0.04 -0.44 0.00 0.00 0.00 179.25 179.31 3hk9 h ASP 402 N 0.68 0.49 -0.49 0.00 3.32 -0.46 0.35 116.42 120.30 3hk9 h ASP 402 Ca 0.15 -0.27 -0.09 0.00 0.02 0.00 0.00 57.03 56.84 3hk9 h ASP 402 Cb 0.28 -0.13 -0.02 0.00 0.22 0.00 0.00 39.33 39.68 3hk9 h ASP 402 CO 0.00 0.63 -0.05 -0.07 -1.72 0.00 0.00 179.24 178.04 3hk9 h LEU 403 N 0.33 0.89 -0.27 1.55 3.38 -1.09 -0.10 115.31 120.00 3hk9 h LEU 403 Ca 0.09 -0.33 0.00 0.00 0.09 0.00 0.00 57.88 57.73 3hk9 h LEU 403 Cb 0.36 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 40.87 3hk9 h LEU 403 CO 0.01 1.01 -0.55 0.49 0.09 0.00 0.00 178.44 179.49 3hk9 n PHE 404 N -4.28 0.00 0.13 1.13 3.72 -0.73 -4.24 117.46 113.18 3hk9 n PHE 404 Ca 0.01 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.41 3hk9 n PHE 404 Cb 0.35 -0.12 0.00 0.00 -0.94 0.00 0.00 39.48 38.76 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 -1.06 -2.03 -0.29 4.37 2.88 -0.55 -1.74 113.62 115.19 3hk9 n SER 405 Ca 0.07 0.48 -0.04 0.00 -1.33 0.00 0.00 58.87 58.05 3hk9 n SER 405 Cb 0.36 2.09 0.11 0.00 -0.75 0.00 0.00 64.21 66.02 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 1.17 -0.98 -1.46 3.08 -1.04 -2.99 114.38 112.17 3hk9 h ARG 406 Ca 0.00 -0.16 0.06 0.00 0.07 0.00 0.00 59.98 59.95 3hk9 h ARG 406 Cb 0.00 -0.22 -0.06 0.00 0.08 0.00 0.00 29.97 29.77 3hk9 h ARG 406 CO 0.00 0.89 0.64 -0.91 -1.07 0.00 0.00 179.97 179.51 3hk9 h ASN 407 N 1.17 1.02 0.31 7.04 2.35 -1.22 -0.32 115.58 125.92 3hk9 h ASN 407 Ca 0.29 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 56.03 3hk9 h ASN 407 Cb 0.09 -0.22 0.00 0.00 0.05 0.00 0.00 38.32 38.24 3hk9 h ASN 407 CO -0.04 0.66 -0.15 0.15 -1.65 0.00 0.00 177.43 176.40 3hk9 h PHE 408 N 1.16 -0.39 -0.33 1.19 3.57 -1.76 -1.46 116.94 118.93 3hk9 h PHE 408 Ca 0.41 -0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.89 3hk9 h PHE 408 Cb 0.13 0.13 -0.02 0.00 2.79 0.00 0.00 35.95 38.99 3hk9 h PHE 408 CO -0.00 -0.07 0.12 -1.49 -2.23 0.00 0.00 178.31 174.63 3hk9 h TRP 409 N -0.71 0.45 -0.25 0.41 4.06 -1.39 -0.36 115.95 118.16 3hk9 h TRP 409 Ca -0.04 -0.01 -0.17 0.00 2.06 0.00 0.00 58.89 60.73 3hk9 h TRP 409 Cb 0.49 -0.14 -0.00 0.00 -1.00 0.00 0.00 29.16 28.50 3hk9 h TRP 409 CO 0.01 0.37 -0.52 -0.09 -3.56 0.00 0.00 178.44 174.66 3hk9 h ARG 410 N 0.46 0.71 -0.14 0.49 2.43 -1.04 -1.34 114.38 115.94 3hk9 h ARG 410 Ca 0.11 -0.43 -0.05 0.00 -0.81 0.00 0.00 59.98 58.80 3hk9 h ARG 410 Cb 0.12 0.04 -0.00 0.00 -0.42 0.00 0.00 29.97 29.71 3hk9 h ARG 410 CO -0.01 1.05 -0.13 0.35 -1.51 0.00 0.00 179.97 179.73 3hk9 h PHE 411 N 0.55 0.40 0.00 2.20 3.57 -0.48 -3.01 116.94 120.16 3hk9 h PHE 411 Ca 0.02 -0.12 0.00 0.00 3.53 0.00 0.00 57.97 61.40 3hk9 h PHE 411 Cb 1.09 -0.08 0.00 0.00 2.79 0.00 0.00 35.95 39.74 3hk9 h PHE 411 CO 0.06 0.72 0.00 1.33 -2.23 0.00 0.00 178.31 178.18 3hk9 n VAL 412 N -4.58 0.85 -2.82 1.41 0.24 -0.22 -4.90 118.33 108.31 3hk9 n VAL 412 Ca -0.06 0.21 -0.09 0.00 -2.04 0.00 0.00 64.34 62.35 3hk9 n VAL 412 Cb 0.35 -0.97 0.04 0.00 -1.47 0.00 0.00 33.84 31.79 3hk9 n VAL 412 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3hk9 n GLY 413 N 0.19 0.18 0.00 7.63 0.00 -0.86 -4.81 105.19 107.53 3hk9 n GLY 413 Ca 0.04 -0.24 0.00 0.00 0.00 0.00 0.00 46.02 45.82 3hk9 n GLY 413 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86