#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 3.66 -0.81 -1.33 1.01 -1.26 -4.96 121.20 117.51 3hk9 s ILE 3 Ca 0.00 -2.38 0.13 0.00 0.00 0.00 0.00 60.65 58.39 3hk9 s ILE 3 Cb 0.00 -3.44 0.61 0.00 0.01 0.00 0.00 42.46 39.64 3hk9 s ILE 3 CO 0.00 -0.79 1.46 -0.46 0.00 0.00 0.00 174.94 175.15 3hk9 n ASN 4 N 4.19 4.29 -3.74 3.58 6.94 -1.26 -4.90 115.26 124.36 3hk9 n ASN 4 Ca 0.01 -2.54 -0.13 0.00 -0.02 0.00 0.00 54.58 51.90 3hk9 n ASN 4 Cb 0.40 -0.58 -0.10 0.00 -2.36 0.00 0.00 39.78 37.14 3hk9 n ASN 4 CO 0.00 0.00 0.00 -0.94 -1.03 0.00 0.00 177.26 175.29 3hk9 s SER 5 N -0.70 -0.38 0.45 0.53 1.04 -1.26 -5.02 113.70 108.36 3hk9 s SER 5 Ca 0.41 0.67 0.12 0.00 0.48 0.00 0.00 55.95 57.63 3hk9 s SER 5 Cb 0.29 0.71 1.00 0.00 0.10 0.00 0.00 66.02 68.12 3hk9 s SER 5 CO 0.16 -0.20 2.04 -0.09 0.98 0.00 0.00 173.24 176.13 3hk9 h ARG 6 N 5.17 0.19 -0.69 4.02 2.43 -1.99 -1.01 114.38 122.51 3hk9 h ARG 6 Ca -0.27 -0.02 -0.06 0.00 -0.81 0.00 0.00 59.98 58.81 3hk9 h ARG 6 Cb 1.18 -0.04 -0.03 0.00 -0.42 0.00 0.00 29.97 30.66 3hk9 h ARG 6 CO 0.29 0.22 0.18 0.93 -1.51 0.00 0.00 179.97 180.07 3hk9 h GLU 7 N 0.20 1.09 -0.11 0.20 3.07 -1.99 0.25 114.58 117.28 3hk9 h GLU 7 Ca 0.05 -0.26 -0.23 0.00 -0.50 0.00 0.00 59.36 58.42 3hk9 h GLU 7 Cb 0.14 -0.15 0.01 0.00 -0.84 0.00 0.00 28.75 27.91 3hk9 h GLU 7 CO 0.00 0.96 -0.85 0.28 -1.40 0.00 0.00 179.01 178.01 3hk9 h VAL 8 N 1.03 1.28 -0.39 3.13 2.07 -1.84 -2.82 116.25 118.71 3hk9 h VAL 8 Ca 0.22 -2.05 0.06 0.00 0.82 0.00 0.00 66.70 65.74 3hk9 h VAL 8 Cb 0.35 2.09 -0.05 0.00 -1.52 0.00 0.00 31.29 32.16 3hk9 h VAL 8 CO 0.00 0.65 0.06 0.25 0.02 0.00 0.00 177.57 178.54 3hk9 h LEU 9 N 0.49 -0.03 -0.67 2.57 5.85 -0.98 -0.37 115.31 122.18 3hk9 h LEU 9 Ca -0.07 0.07 0.03 0.00 0.84 0.00 0.00 57.88 58.75 3hk9 h LEU 9 Cb 1.48 0.10 -0.04 0.00 0.37 0.00 0.00 40.66 42.57 3hk9 h LEU 9 CO 0.17 0.02 0.41 0.00 -0.34 0.00 0.00 178.44 178.70 3hk9 h ALA 10 N 1.30 0.88 -0.37 1.25 0.00 -0.91 0.21 119.26 121.61 3hk9 h ALA 10 Ca 0.19 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.07 3hk9 h ALA 10 Cb 0.23 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 3hk9 h ALA 10 CO -0.26 0.16 0.18 1.49 0.00 0.00 0.00 179.25 180.82 3hk9 h GLU 11 N 0.80 0.53 -0.44 0.00 4.81 -1.11 -0.65 114.58 118.52 3hk9 h GLU 11 Ca 0.28 -0.08 -0.10 0.00 -0.13 0.00 0.00 59.36 59.33 3hk9 h GLU 11 Cb 0.05 -0.10 -0.02 0.00 0.63 0.00 0.00 28.75 29.32 3hk9 h GLU 11 CO -0.12 0.47 -0.13 0.87 -0.73 0.00 0.00 179.01 179.37 3hk9 h LYS 12 N 0.47 0.80 -0.23 1.92 1.57 -0.42 -1.78 116.57 118.90 3hk9 h LYS 12 Ca 0.13 -0.28 -0.06 0.00 -1.87 0.00 0.00 60.65 58.57 3hk9 h LYS 12 Cb 0.11 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.35 3hk9 h LYS 12 CO -0.02 0.89 -0.08 0.28 -0.57 0.00 0.00 179.45 179.96 3hk9 h VAL 13 N 0.72 1.29 -0.83 0.50 2.07 -0.41 -1.99 116.25 117.60 3hk9 h VAL 13 Ca 0.12 -1.10 0.01 0.00 0.82 0.00 0.00 66.70 66.54 3hk9 h VAL 13 Cb 0.63 1.55 -0.04 0.00 -1.52 0.00 0.00 31.29 31.90 3hk9 h VAL 13 CO 0.04 0.34 0.54 0.11 0.02 0.00 0.00 177.57 178.62 3hk9 h LYS 14 N 0.17 1.10 -0.43 1.57 1.57 -1.01 0.30 116.57 119.85 3hk9 h LYS 14 Ca 0.05 -0.07 -0.04 0.00 -1.87 0.00 0.00 60.65 58.72 3hk9 h LYS 14 Cb 0.55 -0.25 -0.02 0.00 0.08 0.00 0.00 32.23 32.60 3hk9 h LYS 14 CO 0.03 0.74 0.09 -0.91 -0.57 0.00 0.00 179.45 178.83 3hk9 h ASN 15 N 1.13 0.66 0.03 0.86 2.35 -1.28 0.89 115.58 120.22 3hk9 h ASN 15 Ca 0.30 -0.24 -0.00 0.00 -0.55 0.00 0.00 56.30 55.81 3hk9 h ASN 15 Cb -0.12 -0.17 0.00 0.00 0.05 0.00 0.00 38.32 38.08 3hk9 h ASN 15 CO -0.06 0.73 -0.01 0.00 -1.65 0.00 0.00 177.43 176.43 3hk9 h ALA 16 N 0.95 -0.04 -0.54 -0.83 0.00 -1.00 0.12 119.26 117.92 3hk9 h ALA 16 Ca 0.13 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.99 3hk9 h ALA 16 Cb 0.34 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.11 3hk9 h ALA 16 CO 0.00 -0.47 0.35 0.28 0.00 0.00 0.00 179.25 179.41 3hk9 h VAL 17 N -0.14 1.14 -0.40 0.00 2.07 -0.86 -1.09 116.25 116.98 3hk9 h VAL 17 Ca -0.00 -0.28 -0.12 0.00 0.82 0.00 0.00 66.70 67.12 3hk9 h VAL 17 Cb 0.12 0.36 -0.01 0.00 -1.52 0.00 0.00 31.29 30.24 3hk9 h VAL 17 CO 0.01 0.14 -0.24 0.78 0.02 0.00 0.00 177.57 178.28 3hk9 h ASN 18 N 0.73 0.83 1.91 0.57 -0.26 -0.68 -3.19 115.58 115.49 3hk9 h ASN 18 Ca 0.20 -0.31 0.00 0.00 -0.56 0.00 0.00 56.30 55.63 3hk9 h ASN 18 Cb -0.07 -0.23 0.00 0.00 -1.06 0.00 0.00 38.32 36.96 3hk9 h ASN 18 CO -0.04 1.03 0.00 0.78 -1.06 0.00 0.00 177.43 178.14 3hk9 h ASN 19 N 0.70 0.00 -2.70 5.81 2.35 -0.57 -3.46 115.58 117.70 3hk9 h ASN 19 Ca 0.09 0.00 -0.56 0.00 -0.55 0.00 0.00 56.30 55.29 3hk9 h ASN 19 Cb 0.77 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.12 3hk9 h ASN 19 CO 0.06 0.00 1.05 -1.58 -1.65 0.00 0.00 177.43 175.32 3hk9 s GLN 20 N -3.20 4.12 0.36 0.81 2.00 -0.43 -4.97 119.66 118.35 3hk9 s GLN 20 Ca 0.07 1.98 -0.28 0.00 -2.00 0.00 0.00 55.36 55.13 3hk9 s GLN 20 Cb 0.06 -3.95 -0.11 0.00 0.80 0.00 0.00 33.01 29.81 3hk9 s GLN 20 CO 0.66 -0.90 1.50 -2.14 -0.50 0.00 0.00 175.29 173.91 3hk9 s PRO 21 N 4.04 4.12 -0.13 1.67 0.02 -1.26 -4.93 135.00 138.52 3hk9 s PRO 21 Ca 0.69 2.56 -0.07 0.00 0.02 0.00 0.00 61.00 64.20 3hk9 s PRO 21 Cb -0.29 -2.98 -0.04 0.00 0.02 0.00 0.00 34.50 31.20 3hk9 s PRO 21 CO 0.26 -0.54 0.11 0.08 -0.33 0.00 0.00 177.00 176.58 3hk9 s VAL 22 N -0.90 5.23 -0.35 3.83 1.01 0.17 -4.64 120.40 124.74 3hk9 s VAL 22 Ca 0.55 0.11 -0.08 0.00 0.00 0.00 0.00 61.98 62.56 3hk9 s VAL 22 Cb -0.46 -3.29 0.04 0.00 0.00 0.00 0.00 36.38 32.66 3hk9 s VAL 22 CO 0.60 0.57 0.14 -0.89 0.00 0.00 0.00 175.10 175.52 3hk9 s THR 23 N -0.63 4.02 -0.78 3.92 2.01 -0.56 -0.37 115.64 123.24 3hk9 s THR 23 Ca 0.12 -1.06 -0.19 0.00 0.31 0.00 0.00 61.69 60.88 3hk9 s THR 23 Cb -0.12 -3.27 0.13 0.00 0.01 0.00 0.00 72.50 69.25 3hk9 s THR 23 CO 0.02 -0.20 0.93 -0.62 -0.69 0.00 0.00 174.62 174.07 3hk9 s ASP 24 N 1.45 6.45 0.00 3.53 -1.08 0.28 -4.72 116.67 122.58 3hk9 s ASP 24 Ca -0.01 -1.80 0.04 0.00 -0.52 0.00 0.00 52.55 50.27 3hk9 s ASP 24 Cb -0.19 -2.35 0.25 0.00 -1.46 0.00 0.00 42.92 39.17 3hk9 s ASP 24 CO 0.04 -1.07 0.83 1.15 0.52 0.00 0.00 175.17 176.64 3hk9 n MET 25 N 6.30 0.63 -3.27 4.34 0.00 -1.26 -1.39 117.12 122.47 3hk9 n MET 25 Ca 0.09 0.00 0.03 0.00 0.00 0.00 0.00 57.70 57.82 3hk9 n MET 25 Cb 0.46 -1.11 -0.02 0.00 0.00 0.00 0.00 33.22 32.56 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 -1.15 0.33 3.17 5.65 -1.26 -4.77 115.29 115.25 3hk9 s HIS 26 Ca 0.06 1.44 -0.05 0.00 0.25 0.00 0.00 55.06 56.76 3hk9 s HIS 26 Cb 0.03 0.48 0.01 0.00 -1.18 0.00 0.00 32.58 31.92 3hk9 s HIS 26 CO 0.05 -0.61 0.49 0.95 -0.65 0.00 0.00 174.74 174.97 3hk9 s THR 27 N 2.83 0.00 -0.28 0.89 -4.23 -0.83 -0.97 115.64 113.05 3hk9 s THR 27 Ca 0.08 -1.53 0.08 0.00 -1.18 0.00 0.00 61.69 59.14 3hk9 s THR 27 Cb -0.12 -2.59 0.46 0.00 1.34 0.00 0.00 72.50 71.59 3hk9 s THR 27 CO -0.18 0.00 1.19 1.41 -0.54 0.00 0.00 174.62 176.50 3hk9 n HIS 28 N -0.53 2.44 -3.74 3.99 8.25 0.33 -3.12 115.22 122.84 3hk9 n HIS 28 Ca -0.00 -2.15 -0.20 0.00 -0.26 0.00 0.00 57.72 55.10 3hk9 n HIS 28 Cb 0.62 -0.33 -0.02 0.00 1.12 0.00 0.00 29.99 31.38 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 -3.57 3.84 0.05 2.41 1.43 -1.21 -4.57 118.68 117.06 3hk9 s LEU 29 Ca 0.49 -0.29 0.02 0.00 -1.03 0.00 0.00 54.13 53.32 3hk9 s LEU 29 Cb 0.40 -2.50 -0.03 0.00 0.03 0.00 0.00 46.19 44.10 3hk9 s LEU 29 CO 0.03 -0.31 -0.08 -0.36 0.23 0.00 0.00 176.35 175.86 3hk9 s PHE 30 N -2.20 0.73 0.43 0.29 0.08 -1.26 -4.41 117.98 111.63 3hk9 s PHE 30 Ca 0.41 -0.56 -0.25 0.00 0.12 0.00 0.00 56.93 56.65 3hk9 s PHE 30 Cb -0.08 -0.43 -0.10 0.00 -0.57 0.00 0.00 43.02 41.85 3hk9 s PHE 30 CO 0.28 -0.09 1.21 0.45 -0.10 0.00 0.00 175.22 176.97 3hk9 n SER 31 N 1.24 2.21 -0.34 1.36 2.88 -1.26 -4.80 113.62 114.91 3hk9 n SER 31 Ca -0.21 1.08 0.12 0.00 -1.33 0.00 0.00 58.87 58.53 3hk9 n SER 31 Cb 0.55 -1.47 0.33 0.00 -0.75 0.00 0.00 64.21 62.88 3hk9 n SER 31 CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 3hk9 h PRO 32 N 1.88 0.75 0.00 -1.46 0.11 -1.94 -1.58 132.00 129.76 3hk9 h PRO 32 Ca -0.47 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.59 3hk9 h PRO 32 Cb 1.31 -0.17 0.00 0.00 0.11 0.00 0.00 31.00 32.25 3hk9 h PRO 32 CO 0.59 0.50 0.00 0.27 -0.21 0.00 0.00 178.00 179.14 3hk9 n ASN 33 N -4.69 0.37 0.06 -2.05 6.94 -1.26 -1.99 115.26 112.64 3hk9 n ASN 33 Ca 0.22 0.65 0.11 0.00 -0.02 0.00 0.00 54.58 55.54 3hk9 n ASN 33 Cb 0.53 -0.71 0.46 0.00 -2.36 0.00 0.00 39.78 37.70 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 -1.98 0.42 -0.53 -2.53 3.01 -0.59 -5.02 117.46 110.23 3hk9 n PHE 34 Ca 0.00 0.14 0.00 0.00 1.01 0.00 0.00 57.45 58.60 3hk9 n PHE 34 Cb 0.07 -0.73 0.00 0.00 -0.01 0.00 0.00 39.48 38.81 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 0.70 -1.00 0.31 1.37 0.00 -0.84 -4.44 105.19 101.28 3hk9 n GLY 35 Ca 0.05 -1.83 0.16 0.00 0.00 0.00 0.00 46.02 44.40 3hk9 n GLY 35 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3hk9 h GLU 36 N 0.00 0.00 -0.10 1.61 4.39 -1.95 -2.14 114.58 116.40 3hk9 h GLU 36 Ca 0.00 0.00 0.03 0.00 0.34 0.00 0.00 59.36 59.73 3hk9 h GLU 36 Cb 0.00 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 28.65 3hk9 h GLU 36 CO 0.00 0.00 0.09 0.97 -1.16 0.00 0.00 179.01 178.91 3hk9 h ILE 37 N 0.00 0.66 -3.49 3.13 2.10 -1.97 -3.37 117.51 114.57 3hk9 h ILE 37 Ca 0.00 0.00 -0.57 0.00 1.08 0.00 0.00 64.86 65.37 3hk9 h ILE 37 Cb 0.43 0.93 -0.07 0.00 -1.09 0.00 0.00 36.82 37.02 3hk9 h ILE 37 CO 0.00 0.00 0.84 -0.22 -1.08 0.00 0.00 178.15 177.69 3hk9 s LEU 38 N -8.15 3.83 0.07 2.19 2.96 -0.81 -4.82 118.68 113.96 3hk9 s LEU 38 Ca -0.05 0.75 -0.17 0.00 -0.22 0.00 0.00 54.13 54.44 3hk9 s LEU 38 Cb 0.16 -3.50 -0.06 0.00 0.50 0.00 0.00 46.19 43.28 3hk9 s LEU 38 CO 0.60 -1.02 0.53 -0.76 -1.32 0.00 0.00 176.35 174.37 3hk9 s LEU 39 N 3.93 4.48 0.03 -0.68 1.43 -1.26 -5.01 118.68 121.60 3hk9 s LEU 39 Ca 0.45 1.15 -0.27 0.00 -1.03 0.00 0.00 54.13 54.43 3hk9 s LEU 39 Cb -0.10 -2.90 0.09 0.00 0.03 0.00 0.00 46.19 43.31 3hk9 s LEU 39 CO 0.22 0.25 0.80 -1.66 0.23 0.00 0.00 176.35 176.19 3hk9 s TRP 40 N -1.18 -0.42 0.00 0.29 1.48 -1.26 -1.13 118.94 116.72 3hk9 s TRP 40 Ca 0.30 0.33 0.00 0.00 -1.06 0.00 0.00 56.10 55.67 3hk9 s TRP 40 Cb -0.18 0.53 0.00 0.00 -1.16 0.00 0.00 33.47 32.66 3hk9 s TRP 40 CO 0.18 -0.62 0.00 -0.40 -4.06 0.00 0.00 176.95 172.05 3hk9 n ASP 41 N -0.14 0.00 0.25 -2.66 5.75 -1.26 -4.62 116.55 113.88 3hk9 n ASP 41 Ca -0.12 0.00 0.09 0.00 -0.01 0.00 0.00 54.79 54.75 3hk9 n ASP 41 Cb 0.62 0.00 0.65 0.00 -1.03 0.00 0.00 41.12 41.36 3hk9 n ASP 41 CO 0.00 0.00 0.00 -0.29 -0.11 0.00 0.00 177.20 176.80 3hk9 h ILE 42 N 0.00 0.91 -0.04 2.12 6.09 -1.95 -0.69 117.51 123.94 3hk9 h ILE 42 Ca 0.00 -0.31 -0.17 0.00 -1.37 0.00 0.00 64.86 63.01 3hk9 h ILE 42 Cb 0.00 1.17 -0.01 0.00 0.47 0.00 0.00 36.82 38.45 3hk9 h ILE 42 CO 0.00 0.08 -0.73 0.44 -3.07 0.00 0.00 178.15 174.87 3hk9 h ASP 43 N 0.00 0.30 -0.04 2.19 3.32 -1.96 -1.76 116.42 118.47 3hk9 h ASP 43 Ca -0.00 -0.20 -0.19 0.00 0.02 0.00 0.00 57.03 56.66 3hk9 h ASP 43 Cb 0.17 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 39.63 3hk9 h ASP 43 CO 0.01 0.93 -0.66 -0.33 -1.72 0.00 0.00 179.24 177.47 3hk9 h GLU 44 N 0.16 0.66 -0.46 3.56 4.39 -1.64 -2.22 114.58 119.04 3hk9 h GLU 44 Ca -0.02 -0.48 -0.00 0.00 0.34 0.00 0.00 59.36 59.19 3hk9 h GLU 44 Cb 1.29 0.08 -0.02 0.00 -0.10 0.00 0.00 28.75 30.00 3hk9 h GLU 44 CO 0.11 1.10 0.28 -0.07 -1.16 0.00 0.00 179.01 179.28 3hk9 h LEU 45 N 0.48 0.55 -0.85 1.33 3.38 -1.02 -2.53 115.31 116.65 3hk9 h LEU 45 Ca -0.02 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.90 3hk9 h LEU 45 Cb 1.25 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.86 3hk9 h LEU 45 CO 0.13 0.44 0.00 -0.07 0.09 0.00 0.00 178.44 179.03 3hk9 h LEU 46 N 0.62 0.00 -3.12 1.67 3.38 -1.24 -2.99 115.31 113.63 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 -0.02 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.73 3hk9 h LEU 46 CO -0.03 0.00 0.00 0.35 0.09 0.00 0.00 178.44 178.85 3hk9 n THR 47 N -2.76 1.76 -1.69 0.22 -2.24 -0.84 -4.73 114.28 104.00 3hk9 n THR 47 Ca 0.02 -1.29 -0.42 0.00 -2.27 0.00 0.00 64.05 60.09 3hk9 n THR 47 Cb 0.33 0.13 -0.00 0.00 -2.10 0.00 0.00 70.33 68.69 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 0.71 2.12 0.31 4.78 9.36 -1.01 -4.76 117.16 128.66 3hk9 n TYR 48 Ca 0.22 0.55 0.20 0.00 3.32 0.00 0.00 57.90 62.20 3hk9 n TYR 48 Cb 0.80 -2.39 1.03 0.00 -0.63 0.00 0.00 39.34 38.16 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 2.35 0.00 -0.86 2.98 2.07 -1.92 -1.12 115.15 118.66 3hk9 h HIS 49 Ca -0.46 0.00 -0.03 0.00 -2.85 0.00 0.00 60.37 57.03 3hk9 h HIS 49 Cb 1.29 0.00 -0.04 0.00 2.57 0.00 0.00 27.41 31.23 3hk9 h HIS 49 CO 0.49 0.00 0.41 1.88 -3.07 0.00 0.00 177.93 177.65 3hk9 h TYR 50 N 0.00 1.24 0.00 6.12 -1.99 -1.94 -1.91 116.97 118.49 3hk9 h TYR 50 Ca 0.00 -0.06 -0.06 0.00 2.00 0.00 0.00 58.73 60.61 3hk9 h TYR 50 Cb 0.11 -0.38 -0.01 0.00 2.00 0.00 0.00 36.73 38.45 3hk9 h TYR 50 CO 0.00 0.89 -0.27 -0.07 -0.00 0.00 0.00 178.16 178.71 3hk9 h LEU 51 N 1.22 0.00 -0.23 3.88 4.07 -1.52 -2.65 115.31 120.08 3hk9 h LEU 51 Ca 0.30 0.00 -0.07 0.00 0.08 0.00 0.00 57.88 58.18 3hk9 h LEU 51 Cb 0.12 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 41.85 3hk9 h LEU 51 CO -0.04 0.27 -0.14 0.58 -1.08 0.00 0.00 178.44 178.03 3hk9 h VAL 52 N 0.00 1.31 -0.69 1.22 2.07 -1.16 -0.15 116.25 118.85 3hk9 h VAL 52 Ca -0.00 -1.25 -0.03 0.00 0.82 0.00 0.00 66.70 66.24 3hk9 h VAL 52 Cb 1.07 1.63 -0.03 0.00 -1.52 0.00 0.00 31.29 32.44 3hk9 h VAL 52 CO 0.04 0.38 0.31 0.00 0.02 0.00 0.00 177.57 178.32 3hk9 h ALA 53 N 0.70 0.89 -0.34 1.67 0.00 -1.33 -2.57 119.26 118.28 3hk9 h ALA 53 Ca 0.05 -0.16 -0.16 0.00 0.00 0.00 0.00 54.91 54.64 3hk9 h ALA 53 Cb 0.66 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 3hk9 h ALA 53 CO 0.04 0.48 -0.41 0.93 0.00 0.00 0.00 179.25 180.29 3hk9 h GLU 54 N 0.97 0.84 -0.24 0.00 5.08 -1.36 -3.12 114.58 116.74 3hk9 h GLU 54 Ca 0.23 -0.45 -0.09 0.00 -1.00 0.00 0.00 59.36 58.05 3hk9 h GLU 54 Cb 0.16 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.42 3hk9 h GLU 54 CO -0.02 1.09 -0.25 -0.24 -1.00 0.00 0.00 179.01 178.59 3hk9 h VAL 55 N 0.68 1.26 0.00 3.13 3.04 -0.94 -2.50 116.25 120.91 3hk9 h VAL 55 Ca 0.05 -1.24 0.00 0.00 -1.01 0.00 0.00 66.70 64.50 3hk9 h VAL 55 Cb 0.98 1.35 0.00 0.00 -2.01 0.00 0.00 31.29 31.61 3hk9 h VAL 55 CO 0.09 0.39 0.00 0.24 -1.01 0.00 0.00 177.57 177.29 3hk9 h MET 56 N 0.40 0.00 0.00 4.17 2.86 -1.39 0.12 114.93 121.09 3hk9 h MET 56 Ca 0.06 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.70 3hk9 h MET 56 Cb 0.65 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.31 3hk9 h MET 56 CO 0.05 0.00 0.00 0.00 1.06 0.00 0.00 176.91 178.02 3hk9 h ARG 57 N 0.00 0.00 0.00 1.72 3.08 -1.48 -3.39 114.38 114.32 3hk9 h ARG 57 Ca 0.00 0.00 -0.15 0.00 0.07 0.00 0.00 59.98 59.90 3hk9 h ARG 57 Cb 0.23 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.26 3hk9 h ARG 57 CO 0.00 0.00 -1.49 0.91 -1.07 0.00 0.00 179.97 178.32 3hk9 n TRP 58 N -2.55 0.00 -1.92 3.04 7.02 -0.43 -5.07 117.44 117.53 3hk9 n TRP 58 Ca 0.05 0.00 -0.37 0.00 -1.02 0.00 0.00 57.50 56.15 3hk9 n TRP 58 Cb 0.44 -0.31 0.04 0.00 -2.42 0.00 0.00 31.31 29.05 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 -2.16 2.39 -2.56 -0.99 -1.32 0.29 -4.94 115.64 106.35 3hk9 s THR 59 Ca -0.12 0.27 0.23 0.00 -1.21 0.00 0.00 61.69 60.86 3hk9 s THR 59 Cb 0.05 -3.12 0.39 0.00 -1.51 0.00 0.00 72.50 68.31 3hk9 s THR 59 CO 0.16 -0.03 1.39 -0.90 -2.21 0.00 0.00 174.62 173.03 3hk9 n ASP 60 N -1.26 3.36 -4.68 8.08 3.85 -1.26 -4.87 116.55 119.76 3hk9 n ASP 60 Ca 0.12 -1.99 -0.42 0.00 -0.71 0.00 0.00 54.79 51.79 3hk9 n ASP 60 Cb 0.47 -0.21 -0.03 0.00 -1.35 0.00 0.00 41.12 40.01 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 -1.58 4.47 0.73 2.12 1.01 -1.26 -5.00 120.40 120.89 3hk9 s VAL 61 Ca 0.37 1.77 -0.15 0.00 0.00 0.00 0.00 61.98 63.97 3hk9 s VAL 61 Cb 0.22 -4.14 0.04 0.00 0.00 0.00 0.00 36.38 32.50 3hk9 s VAL 61 CO 0.31 -0.03 1.23 -0.94 0.00 0.00 0.00 175.10 175.68 3hk9 s SER 62 N 1.37 4.15 0.33 3.32 1.04 -1.26 -4.78 113.70 117.88 3hk9 s SER 62 Ca 0.52 2.43 0.01 0.00 0.48 0.00 0.00 55.95 59.40 3hk9 s SER 62 Cb -0.21 -2.60 0.57 0.00 0.10 0.00 0.00 66.02 63.88 3hk9 s SER 62 CO 0.18 -2.30 1.95 -0.29 0.98 0.00 0.00 173.24 173.77 3hk9 h ILE 63 N -0.23 1.18 -0.58 -1.02 6.09 -1.97 0.19 117.51 121.18 3hk9 h ILE 63 Ca -0.48 -0.47 -0.03 0.00 -1.37 0.00 0.00 64.86 62.51 3hk9 h ILE 63 Cb 1.31 0.40 -0.03 0.00 0.47 0.00 0.00 36.82 38.97 3hk9 h ILE 63 CO 0.50 0.20 0.26 -0.33 -3.07 0.00 0.00 178.15 175.71 3hk9 h GLU 64 N 0.82 0.85 -0.57 2.19 3.07 -1.92 -1.21 114.58 117.81 3hk9 h GLU 64 Ca 0.21 -0.14 -0.10 0.00 -0.50 0.00 0.00 59.36 58.84 3hk9 h GLU 64 Cb 0.04 -0.15 -0.02 0.00 -0.84 0.00 0.00 28.75 27.78 3hk9 h GLU 64 CO -0.03 0.70 -0.03 0.00 -1.40 0.00 0.00 179.01 178.26 3hk9 h ALA 65 N 1.10 0.88 0.13 3.43 0.00 -1.72 -1.96 119.26 121.12 3hk9 h ALA 65 Ca 0.20 -0.31 0.01 0.00 0.00 0.00 0.00 54.91 54.81 3hk9 h ALA 65 Cb 0.15 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 3hk9 h ALA 65 CO -0.02 0.65 -0.20 0.35 0.00 0.00 0.00 179.25 180.03 3hk9 h PHE 66 N 0.91 -0.52 0.00 0.00 3.57 -0.48 -1.30 116.94 119.12 3hk9 h PHE 66 Ca 0.16 0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.66 3hk9 h PHE 66 Cb 0.57 0.21 -0.00 0.00 2.79 0.00 0.00 35.95 39.52 3hk9 h PHE 66 CO 0.04 -0.29 -0.06 -1.49 -2.23 0.00 0.00 178.31 174.28 3hk9 h TRP 67 N -0.39 0.00 -0.13 0.41 -0.00 -1.13 -2.58 115.95 112.13 3hk9 h TRP 67 Ca 0.02 0.00 -0.17 0.00 -0.00 0.00 0.00 58.89 58.74 3hk9 h TRP 67 Cb 0.40 0.00 -0.01 0.00 -0.00 0.00 0.00 29.16 29.55 3hk9 h TRP 67 CO -0.18 0.06 -0.64 0.00 -0.00 0.00 0.00 178.44 177.68 3hk9 h ALA 68 N 1.94 0.65 -2.39 1.49 0.00 -0.46 -3.46 119.26 117.03 3hk9 h ALA 68 Ca -0.00 -0.56 -0.49 0.00 0.00 0.00 0.00 54.91 53.86 3hk9 h ALA 68 Cb 0.15 -0.07 0.12 0.00 0.00 0.00 0.00 17.79 17.98 3hk9 h ALA 68 CO 0.01 0.72 0.33 0.00 0.00 0.00 0.00 179.25 180.30 3hk9 s MET 69 N -3.81 2.04 0.93 0.00 0.23 -0.79 -5.04 119.30 112.87 3hk9 s MET 69 Ca -0.07 0.70 -0.12 0.00 -1.03 0.00 0.00 55.69 55.18 3hk9 s MET 69 Cb 0.11 -1.91 0.15 0.00 -1.53 0.00 0.00 34.83 31.65 3hk9 s MET 69 CO 0.84 -1.67 1.10 -1.54 -2.03 0.00 0.00 175.02 171.72 3hk9 s SER 70 N -3.81 3.29 0.16 -1.18 1.04 -1.26 -4.77 113.70 107.16 3hk9 s SER 70 Ca 0.61 1.25 -0.16 0.00 0.48 0.00 0.00 55.95 58.13 3hk9 s SER 70 Cb -0.15 -1.91 0.09 0.00 0.10 0.00 0.00 66.02 64.15 3hk9 s SER 70 CO 0.55 -2.72 1.73 0.50 0.98 0.00 0.00 173.24 174.27 3hk9 h LYS 71 N -1.61 0.19 -0.77 4.02 1.63 -1.96 -0.08 116.57 117.99 3hk9 h LYS 71 Ca -0.51 -0.01 0.00 0.00 -0.85 0.00 0.00 60.65 59.28 3hk9 h LYS 71 Cb 1.31 -0.04 -0.04 0.00 -0.60 0.00 0.00 32.23 32.86 3hk9 h LYS 71 CO 0.58 0.13 0.50 -0.09 -3.45 0.00 0.00 179.45 177.11 3hk9 h ARG 72 N 0.20 1.03 -0.45 1.90 2.43 -1.93 -1.56 114.38 115.99 3hk9 h ARG 72 Ca 0.18 -0.07 -0.09 0.00 -0.81 0.00 0.00 59.98 59.18 3hk9 h ARG 72 Cb 0.21 -0.23 -0.02 0.00 -0.42 0.00 0.00 29.97 29.51 3hk9 h ARG 72 CO -0.24 0.69 -0.10 0.93 -1.51 0.00 0.00 179.97 179.74 3hk9 h GLU 73 N 1.05 0.81 -0.49 0.20 5.08 -1.71 -1.26 114.58 118.26 3hk9 h GLU 73 Ca 0.28 -0.27 -0.10 0.00 -1.00 0.00 0.00 59.36 58.27 3hk9 h GLU 73 Cb -0.10 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.06 3hk9 h GLU 73 CO -0.06 0.88 -0.11 1.96 -1.00 0.00 0.00 179.01 180.68 3hk9 h GLN 74 N 0.73 0.91 -0.56 2.33 4.20 -0.71 -2.15 115.11 119.86 3hk9 h GLN 74 Ca 0.12 -0.32 -0.09 0.00 0.06 0.00 0.00 58.65 58.42 3hk9 h GLN 74 Cb 0.59 -0.07 -0.02 0.00 0.30 0.00 0.00 27.48 28.28 3hk9 h GLN 74 CO 0.04 0.97 0.00 0.00 -0.67 0.00 0.00 178.83 179.17 3hk9 h ALA 75 N 1.05 0.93 -0.65 3.87 0.00 -0.98 -1.83 119.26 121.66 3hk9 h ALA 75 Ca 0.13 -0.30 -0.07 0.00 0.00 0.00 0.00 54.91 54.67 3hk9 h ALA 75 Cb 0.64 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.19 3hk9 h ALA 75 CO 0.04 0.64 0.12 -0.44 0.00 0.00 0.00 179.25 179.61 3hk9 h ASP 76 N 0.90 1.01 0.09 0.00 3.32 -0.98 -0.96 116.42 119.80 3hk9 h ASP 76 Ca 0.16 -0.25 -0.00 0.00 0.02 0.00 0.00 57.03 56.96 3hk9 h ASP 76 Cb 0.52 -0.27 0.00 0.00 0.22 0.00 0.00 39.33 39.81 3hk9 h ASP 76 CO 0.03 1.01 -0.04 0.25 -1.72 0.00 0.00 179.24 178.76 3hk9 h LEU 77 N 0.98 -0.11 -0.72 1.55 5.85 -1.21 -1.70 115.31 119.96 3hk9 h LEU 77 Ca 0.20 -0.23 0.02 0.00 0.84 0.00 0.00 57.88 58.71 3hk9 h LEU 77 Cb 0.42 0.03 -0.04 0.00 0.37 0.00 0.00 40.66 41.43 3hk9 h LEU 77 CO 0.01 0.17 0.46 0.40 -0.34 0.00 0.00 178.44 179.15 3hk9 h ILE 78 N -0.39 1.14 0.08 4.05 2.04 -1.29 0.20 117.51 123.34 3hk9 h ILE 78 Ca -0.01 -0.32 0.00 0.00 1.00 0.00 0.00 64.86 65.53 3hk9 h ILE 78 Cb 0.33 0.13 -0.01 0.00 -0.74 0.00 0.00 36.82 36.53 3hk9 h ILE 78 CO 0.02 0.17 -0.08 -0.25 0.00 0.00 0.00 178.15 178.01 3hk9 h TRP 79 N 0.93 -0.21 -0.70 1.37 2.91 -1.13 0.57 115.95 119.68 3hk9 h TRP 79 Ca 0.28 0.00 -0.04 0.00 1.13 0.00 0.00 58.89 60.26 3hk9 h TRP 79 Cb -0.04 0.08 -0.03 0.00 -0.51 0.00 0.00 29.16 28.66 3hk9 h TRP 79 CO -0.03 -0.13 0.30 1.49 -1.03 0.00 0.00 178.44 179.04 3hk9 h GLU 80 N -0.18 1.03 0.06 2.65 4.57 -0.89 -0.09 114.58 121.73 3hk9 h GLU 80 Ca 0.00 -0.18 -0.27 0.00 -1.18 0.00 0.00 59.36 57.74 3hk9 h GLU 80 Cb 0.18 -0.17 0.02 0.00 -0.16 0.00 0.00 28.75 28.61 3hk9 h GLU 80 CO -0.02 0.84 -1.13 0.93 -1.18 0.00 0.00 179.01 178.45 3hk9 h GLU 81 N 0.99 0.58 0.00 1.92 4.39 -0.48 -0.19 114.58 121.79 3hk9 h GLU 81 Ca 0.24 -0.70 0.00 0.00 0.34 0.00 0.00 59.36 59.23 3hk9 h GLU 81 Cb 0.18 0.22 0.00 0.00 -0.10 0.00 0.00 28.75 29.05 3hk9 h GLU 81 CO -0.02 1.30 -1.84 1.28 -1.16 0.00 0.00 179.01 178.57 3hk9 n LEU 82 N -3.78 0.11 -0.06 1.33 4.77 0.18 -3.96 117.00 115.59 3hk9 n LEU 82 Ca -0.11 -0.06 -0.08 0.00 -0.03 0.00 0.00 56.01 55.73 3hk9 n LEU 82 Cb 0.93 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.95 3hk9 n LEU 82 CO 0.56 0.03 -0.92 0.49 -1.33 0.00 0.00 177.39 176.21 3hk9 n PHE 83 N -2.14 0.00 -0.12 -1.77 3.72 -0.08 -3.11 117.46 113.97 3hk9 n PHE 83 Ca -0.03 0.00 -0.25 0.00 -0.05 0.00 0.00 57.45 57.12 3hk9 n PHE 83 Cb 0.52 -0.53 -0.11 0.00 -0.94 0.00 0.00 39.48 38.41 3hk9 n PHE 83 CO 0.00 0.00 0.00 -0.89 -0.05 0.00 0.00 176.76 175.82 3hk9 n ILE 84 N -2.76 1.54 0.21 4.37 2.08 -1.01 -4.25 119.36 119.55 3hk9 n ILE 84 Ca -0.22 -0.20 0.09 0.00 0.56 0.00 0.00 62.75 62.97 3hk9 n ILE 84 Cb 0.79 -1.95 0.44 0.00 -0.75 0.00 0.00 39.64 38.17 3hk9 n ILE 84 CO 0.00 0.00 0.00 0.11 0.56 0.00 0.00 176.55 177.22 3hk9 h LYS 85 N -0.94 0.00 -3.86 0.38 1.57 -1.21 -3.44 116.57 109.06 3hk9 h LYS 85 Ca -0.50 0.00 -0.13 0.00 -1.87 0.00 0.00 60.65 58.15 3hk9 h LYS 85 Cb 1.47 0.00 -0.18 0.00 0.08 0.00 0.00 32.23 33.60 3hk9 h LYS 85 CO -0.29 0.27 -0.55 1.03 -0.57 0.00 0.00 179.45 179.34 3hk9 s ARG 86 N -3.71 0.57 0.25 3.15 3.00 -1.25 -5.06 118.95 115.90 3hk9 s ARG 86 Ca -0.00 -0.80 -0.30 0.00 0.00 0.00 0.00 55.73 54.64 3hk9 s ARG 86 Cb 0.11 0.22 -0.09 0.00 0.00 0.00 0.00 34.95 35.19 3hk9 s ARG 86 CO 0.65 -0.14 1.18 -1.12 0.00 0.00 0.00 175.30 175.87 3hk9 s SER 87 N -2.17 7.10 -1.10 0.23 0.01 -1.26 -3.57 113.70 112.94 3hk9 s SER 87 Ca -0.04 2.33 -0.11 0.00 1.31 0.00 0.00 55.95 59.44 3hk9 s SER 87 Cb -0.01 -2.62 -0.07 0.00 0.21 0.00 0.00 66.02 63.53 3hk9 s SER 87 CO -0.05 -0.31 2.26 -0.81 0.41 0.00 0.00 173.24 174.74 3hk9 n PRO 88 N 1.70 2.38 0.09 12.44 -0.04 -1.18 -4.61 135.00 145.79 3hk9 n PRO 88 Ca 0.01 -1.84 0.12 0.00 -0.04 0.00 0.00 63.50 61.76 3hk9 n PRO 88 Cb 0.44 -2.73 0.22 0.00 -0.04 0.00 0.00 33.50 31.39 3hk9 n PRO 88 CO 0.00 0.00 0.00 -0.39 -0.04 0.00 0.00 175.50 175.07 3hk9 h VAL 89 N 3.65 0.00 -4.28 0.52 -1.51 -1.90 -3.28 116.25 109.45 3hk9 h VAL 89 Ca 0.57 -0.58 -0.52 0.00 -1.23 0.00 0.00 66.70 64.93 3hk9 h VAL 89 Cb 0.36 1.31 0.17 0.00 -2.13 0.00 0.00 31.29 31.00 3hk9 h VAL 89 CO 1.69 0.00 0.26 -0.94 -1.23 0.00 0.00 177.57 177.35 3hk9 s SER 90 N -4.61 3.47 0.18 4.19 1.04 -1.26 -4.74 113.70 111.98 3hk9 s SER 90 Ca 0.07 2.09 -0.13 0.00 0.48 0.00 0.00 55.95 58.46 3hk9 s SER 90 Cb 0.12 -2.56 0.10 0.00 0.10 0.00 0.00 66.02 63.78 3hk9 s SER 90 CO 0.69 -2.73 1.82 -0.08 0.98 0.00 0.00 173.24 173.92 3hk9 h GLU 91 N -1.55 0.64 -0.60 4.02 4.57 -1.97 0.09 114.58 119.78 3hk9 h GLU 91 Ca -0.43 -0.04 -0.08 0.00 -1.18 0.00 0.00 59.36 57.63 3hk9 h GLU 91 Cb 1.26 -0.14 -0.02 0.00 -0.16 0.00 0.00 28.75 29.68 3hk9 h GLU 91 CO 0.45 0.42 0.08 0.00 -1.18 0.00 0.00 179.01 178.78 3hk9 h ALA 92 N 1.22 0.80 -0.23 2.92 0.00 -1.95 -0.87 119.26 121.15 3hk9 h ALA 92 Ca 0.21 -0.27 -0.06 0.00 0.00 0.00 0.00 54.91 54.79 3hk9 h ALA 92 Cb -0.01 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.55 3hk9 h ALA 92 CO -0.08 0.57 -0.10 0.00 0.00 0.00 0.00 179.25 179.64 3hk9 h ARG 94 N 0.20 0.92 -0.97 0.00 2.43 -0.86 -1.16 114.38 114.94 3hk9 h ARG 94 Ca 0.05 -0.06 0.02 0.00 -0.81 0.00 0.00 59.98 59.19 3hk9 h ARG 94 Cb 0.58 -0.21 -0.05 0.00 -0.42 0.00 0.00 29.97 29.88 3hk9 h ARG 94 CO 0.03 0.61 0.64 0.78 -1.51 0.00 0.00 179.97 180.52 3hk9 h GLY 95 N 0.95 1.38 1.01 2.80 0.00 -0.91 -1.32 103.07 106.98 3hk9 h GLY 95 Ca 0.49 -0.50 0.00 0.00 0.00 0.00 0.00 47.33 47.32 3hk9 h GLY 95 CO -0.25 0.47 0.63 -2.08 0.00 0.00 0.00 176.54 175.31 3hk9 h VAL 96 N 1.29 1.26 -0.38 4.60 2.07 -1.00 -1.66 116.25 122.42 3hk9 h VAL 96 Ca 0.37 -0.51 -0.16 0.00 0.82 0.00 0.00 66.70 67.22 3hk9 h VAL 96 Cb -0.11 -0.16 -0.01 0.00 -1.52 0.00 0.00 31.29 29.49 3hk9 h VAL 96 CO -0.09 0.26 -0.39 -0.07 0.02 0.00 0.00 177.57 177.29 3hk9 h LEU 97 N 1.34 1.00 -1.08 2.57 3.38 -1.22 -2.36 115.31 118.93 3hk9 h LEU 97 Ca 0.36 -0.46 -0.00 0.00 0.09 0.00 0.00 57.88 57.87 3hk9 h LEU 97 Cb -0.12 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 40.31 3hk9 h LEU 97 CO -0.07 1.26 0.54 0.74 0.09 0.00 0.00 178.44 181.00 3hk9 h THR 98 N 0.76 1.23 -0.09 0.22 2.02 -0.85 -1.19 112.91 115.02 3hk9 h THR 98 Ca 0.06 -0.48 -0.00 0.00 0.77 0.00 0.00 66.41 66.75 3hk9 h THR 98 Cb 0.99 -0.01 -0.00 0.00 -1.74 0.00 0.00 68.15 67.38 3hk9 h THR 98 CO 0.10 0.24 0.04 0.00 0.37 0.00 0.00 175.52 176.27 3hk9 h LEU 100 N 0.01 -0.01 -0.25 0.00 3.38 -1.03 -1.51 115.31 115.90 3hk9 h LEU 100 Ca 0.03 0.04 -0.00 0.00 0.09 0.00 0.00 57.88 58.04 3hk9 h LEU 100 Cb 0.14 0.06 -0.01 0.00 0.09 0.00 0.00 40.66 40.93 3hk9 h LEU 100 CO -0.00 0.02 0.15 -0.61 0.09 0.00 0.00 178.44 178.09 3hk9 h GLN 101 N 0.12 0.34 -0.56 1.13 4.15 -1.17 -0.78 115.11 118.34 3hk9 h GLN 101 Ca 0.11 -0.03 0.08 0.00 0.77 0.00 0.00 58.65 59.58 3hk9 h GLN 101 Cb 0.11 -0.07 -0.03 0.00 0.21 0.00 0.00 27.48 27.70 3hk9 h GLN 101 CO -0.15 0.28 0.38 0.78 -1.93 0.00 0.00 178.83 178.19 3hk9 h GLY 102 N 0.31 0.57 1.36 2.39 0.00 -0.88 0.54 103.07 107.36 3hk9 h GLY 102 Ca 0.09 -0.17 0.00 0.00 0.00 0.00 0.00 47.33 47.25 3hk9 h GLY 102 CO -0.02 0.12 0.00 1.04 0.00 0.00 0.00 176.54 177.68 3hk9 n LEU 103 N -4.47 0.00 0.00 3.11 4.77 -0.60 -4.87 117.00 114.94 3hk9 n LEU 103 Ca 0.09 0.18 0.00 0.00 -0.03 0.00 0.00 56.01 56.25 3hk9 n LEU 103 Cb 0.32 -0.18 0.00 0.00 -2.33 0.00 0.00 43.42 41.23 3hk9 n LEU 103 CO 0.34 -0.02 0.00 0.61 -1.33 0.00 0.00 177.39 176.99 3hk9 n GLY 104 N 0.96 0.79 3.91 -0.72 0.00 0.18 -5.07 105.19 105.23 3hk9 n GLY 104 Ca 0.16 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.91 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 3.71 -0.46 0.99 1.43 -0.34 -5.00 118.68 119.01 3hk9 s LEU 105 Ca 0.00 0.85 -0.10 0.00 -1.03 0.00 0.00 54.13 53.85 3hk9 s LEU 105 Cb 0.00 -3.78 0.10 0.00 0.03 0.00 0.00 46.19 42.54 3hk9 s LEU 105 CO 0.00 -0.51 0.34 -0.62 0.23 0.00 0.00 176.35 175.78 3hk9 s ASP 106 N -4.04 5.76 0.57 2.29 -1.08 -1.26 -3.90 116.67 115.02 3hk9 s ASP 106 Ca 0.46 -1.73 0.32 0.00 -0.52 0.00 0.00 52.55 51.09 3hk9 s ASP 106 Cb -0.10 -2.03 1.75 0.00 -1.46 0.00 0.00 42.92 41.08 3hk9 s ASP 106 CO 0.42 -0.66 2.18 -0.65 0.52 0.00 0.00 175.17 176.98 3hk9 h PRO 107 N 8.50 0.00 0.00 4.34 0.11 -1.91 -2.74 132.00 140.29 3hk9 h PRO 107 Ca -0.23 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.86 3hk9 h PRO 107 Cb 1.08 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.19 3hk9 h PRO 107 CO 0.85 0.05 -0.11 0.00 -0.21 0.00 0.00 178.00 178.58 3hk9 h ALA 108 N 1.95 1.53 0.00 -0.75 0.00 -2.01 -2.62 119.26 117.36 3hk9 h ALA 108 Ca -0.00 -0.10 -0.05 0.00 0.00 0.00 0.00 54.91 54.76 3hk9 h ALA 108 Cb 0.20 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 3hk9 h ALA 108 CO 0.01 0.14 -0.35 1.79 0.00 0.00 0.00 179.25 180.84 3hk9 h THR 109 N 0.00 0.37 -2.36 0.00 1.35 -1.93 -3.47 112.91 106.87 3hk9 h THR 109 Ca -0.00 -1.53 -0.35 0.00 -0.55 0.00 0.00 66.41 63.97 3hk9 h THR 109 Cb 0.25 2.13 -0.07 0.00 -1.73 0.00 0.00 68.15 68.72 3hk9 h THR 109 CO 0.01 0.21 -0.39 0.54 -0.25 0.00 0.00 175.52 175.64 3hk9 n ARG 110 N -3.11 -1.67 -2.95 4.72 1.74 -0.99 -4.88 116.66 109.53 3hk9 n ARG 110 Ca 0.02 0.93 -0.44 0.00 -0.77 0.00 0.00 57.85 57.59 3hk9 n ARG 110 Cb 0.63 -5.43 -0.01 0.00 -1.02 0.00 0.00 32.46 26.62 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 -2.24 6.83 0.40 0.55 -1.08 -1.26 -4.86 116.67 115.00 3hk9 s ASP 111 Ca 0.00 -2.49 0.07 0.00 -0.52 0.00 0.00 52.55 49.62 3hk9 s ASP 111 Cb 0.00 -2.39 0.83 0.00 -1.46 0.00 0.00 42.92 39.90 3hk9 s ASP 111 CO 0.00 -0.91 2.02 0.25 0.52 0.00 0.00 175.17 177.05 3hk9 h LEU 112 N 10.02 0.53 -0.99 -1.34 5.85 -1.98 -2.21 115.31 125.20 3hk9 h LEU 112 Ca 0.23 -0.01 -0.10 0.00 0.84 0.00 0.00 57.88 58.84 3hk9 h LEU 112 Cb 0.96 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.85 3hk9 h LEU 112 CO 1.16 0.36 -0.40 1.56 -0.34 0.00 0.00 178.44 180.78 3hk9 h GLN 113 N 0.61 0.21 -0.19 1.25 1.08 -1.99 -0.42 115.11 115.67 3hk9 h GLN 113 Ca 0.22 -0.10 -0.17 0.00 -1.45 0.00 0.00 58.65 57.15 3hk9 h GLN 113 Cb 0.11 -0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 27.53 3hk9 h GLN 113 CO -0.06 0.58 -0.58 0.28 -0.95 0.00 0.00 178.83 178.11 3hk9 h VAL 114 N 0.18 1.32 -0.22 -0.54 2.07 -1.83 -2.18 116.25 115.04 3hk9 h VAL 114 Ca 0.02 -1.83 -0.01 0.00 0.82 0.00 0.00 66.70 65.69 3hk9 h VAL 114 Cb 0.79 1.79 -0.01 0.00 -1.52 0.00 0.00 31.29 32.35 3hk9 h VAL 114 CO 0.06 0.57 0.08 1.88 0.02 0.00 0.00 177.57 180.18 3hk9 h TYR 115 N 0.45 0.34 -0.02 1.57 0.05 -1.03 -2.50 116.97 115.84 3hk9 h TYR 115 Ca 0.00 -0.03 -0.00 0.00 0.05 0.00 0.00 58.73 58.75 3hk9 h TYR 115 Cb 1.14 -0.10 -0.00 0.00 1.01 0.00 0.00 36.73 38.78 3hk9 h TYR 115 CO 0.05 0.39 0.00 0.00 -1.05 0.00 0.00 178.16 177.55 3hk9 h ARG 116 N 0.19 0.02 -0.03 4.88 3.08 -1.01 -1.75 114.38 119.77 3hk9 h ARG 116 Ca 0.07 -0.00 -0.07 0.00 0.07 0.00 0.00 59.98 60.05 3hk9 h ARG 116 Cb 0.20 -0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.23 3hk9 h ARG 116 CO -0.00 0.02 -0.31 0.93 -1.07 0.00 0.00 179.97 179.53 3hk9 h GLU 117 N 0.02 0.05 -0.40 0.04 5.08 -0.94 -2.58 114.58 115.86 3hk9 h GLU 117 Ca 0.01 -0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.34 3hk9 h GLU 117 Cb 0.01 -0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.24 3hk9 h GLU 117 CO -0.00 0.36 0.21 -0.92 -1.00 0.00 0.00 179.01 177.66 3hk9 h TYR 118 N 0.05 0.56 -0.08 4.33 3.20 -1.15 -3.19 116.97 120.68 3hk9 h TYR 118 Ca 0.00 -0.02 -0.20 0.00 3.14 0.00 0.00 58.73 61.66 3hk9 h TYR 118 Cb 0.58 -0.18 -0.00 0.00 1.54 0.00 0.00 36.73 38.67 3hk9 h TYR 118 CO 0.00 0.45 -0.77 0.74 -1.64 0.00 0.00 178.16 176.94 3hk9 h PHE 119 N 0.51 0.64 -0.11 -3.82 0.04 -1.57 -3.28 116.94 109.34 3hk9 h PHE 119 Ca 0.14 -0.29 0.00 0.00 2.80 0.00 0.00 57.97 60.62 3hk9 h PHE 119 Cb 0.09 -0.09 -0.01 0.00 2.20 0.00 0.00 35.95 38.14 3hk9 h PHE 119 CO -0.02 1.07 0.07 0.00 -0.60 0.00 0.00 178.31 178.83 3hk9 h ALA 120 N 0.85 1.94 -0.67 2.45 0.00 -1.45 -2.56 119.26 119.81 3hk9 h ALA 120 Ca -0.04 -0.01 -0.35 0.00 0.00 0.00 0.00 54.91 54.51 3hk9 h ALA 120 Cb 1.36 -0.04 -0.21 0.00 0.00 0.00 0.00 17.79 18.90 3hk9 h ALA 120 CO 0.14 0.05 0.44 0.36 0.00 0.00 0.00 179.25 180.24 3hk9 n LYS 121 N -4.52 1.84 -3.97 0.00 2.85 -1.22 -4.91 118.16 108.23 3hk9 n LYS 121 Ca -0.01 -2.01 -0.09 0.00 -1.05 0.00 0.00 58.31 55.15 3hk9 n LYS 121 Cb 0.09 -1.79 -0.09 0.00 -0.65 0.00 0.00 35.03 32.59 3hk9 n LYS 121 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 177.40 177.50 3hk9 s LYS 122 N -2.21 0.61 0.24 -1.58 1.02 -0.97 -5.11 119.74 111.75 3hk9 s LYS 122 Ca 0.38 -0.91 0.06 0.00 0.02 0.00 0.00 55.97 55.52 3hk9 s LYS 122 Cb 0.32 0.23 -0.03 0.00 -0.52 0.00 0.00 37.83 37.83 3hk9 s LYS 122 CO 0.07 -0.15 0.31 0.95 -0.92 0.00 0.00 175.35 175.61 3hk9 s THR 123 N -3.10 5.00 0.19 2.17 -4.23 -1.26 -4.97 115.64 109.43 3hk9 s THR 123 Ca -0.01 -1.12 -0.13 0.00 -1.18 0.00 0.00 61.69 59.25 3hk9 s THR 123 Cb 0.02 -3.71 0.12 0.00 1.34 0.00 0.00 72.50 70.27 3hk9 s THR 123 CO -0.07 -0.34 1.70 0.28 -0.54 0.00 0.00 174.62 175.65 3hk9 h SER 124 N 1.27 -0.10 -0.60 3.99 0.02 -1.98 -0.30 113.55 115.85 3hk9 h SER 124 Ca -0.51 0.11 0.06 0.00 -0.84 0.00 0.00 61.79 60.61 3hk9 h SER 124 Cb 1.23 0.17 -0.05 0.00 0.14 0.00 0.00 62.40 63.89 3hk9 h SER 124 CO 0.61 -0.02 0.31 -0.33 -1.14 0.00 0.00 176.83 176.25 3hk9 h GLU 125 N 0.18 0.56 -0.30 3.45 3.07 -1.95 -1.39 114.58 118.20 3hk9 h GLU 125 Ca 0.26 -0.03 -0.11 0.00 -0.50 0.00 0.00 59.36 58.97 3hk9 h GLU 125 Cb 0.37 -0.13 -0.01 0.00 -0.84 0.00 0.00 28.75 28.14 3hk9 h GLU 125 CO -0.38 0.37 -0.28 0.93 -1.40 0.00 0.00 179.01 178.25 3hk9 h GLU 126 N 0.57 0.62 -0.20 2.33 5.08 -1.67 -2.68 114.58 118.63 3hk9 h GLU 126 Ca 0.28 -0.26 -0.16 0.00 -1.00 0.00 0.00 59.36 58.21 3hk9 h GLU 126 Cb 0.21 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.43 3hk9 h GLU 126 CO -0.20 0.84 -0.53 0.37 -1.00 0.00 0.00 179.01 178.49 3hk9 h GLN 127 N 0.54 0.59 -0.30 2.33 5.75 -0.61 -2.00 115.11 121.41 3hk9 h GLN 127 Ca 0.07 -0.36 -0.11 0.00 -0.15 0.00 0.00 58.65 58.09 3hk9 h GLN 127 Cb 0.76 0.04 -0.01 0.00 1.07 0.00 0.00 27.48 29.33 3hk9 h GLN 127 CO 0.06 0.97 -0.29 -0.39 -2.65 0.00 0.00 178.83 176.53 3hk9 h VAL 128 N 0.45 1.28 -0.19 2.39 -1.51 -1.21 0.79 116.25 118.26 3hk9 h VAL 128 Ca 0.01 -1.39 -0.00 0.00 -1.23 0.00 0.00 66.70 64.09 3hk9 h VAL 128 Cb 1.07 1.37 -0.01 0.00 -2.13 0.00 0.00 31.29 31.60 3hk9 h VAL 128 CO 0.10 0.45 0.10 0.44 -1.23 0.00 0.00 177.57 177.43 3hk9 h ASP 129 N 0.53 0.23 0.45 4.19 3.32 -1.33 -0.51 116.42 123.31 3hk9 h ASP 129 Ca 0.07 -0.09 -0.02 0.00 0.02 0.00 0.00 57.03 57.01 3hk9 h ASP 129 Cb 0.77 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 40.27 3hk9 h ASP 129 CO 0.06 0.25 -0.22 0.74 -1.72 0.00 0.00 179.24 178.36 3hk9 h THR 130 N 0.20 0.56 -0.16 0.35 2.02 -1.09 -2.36 112.91 112.42 3hk9 h THR 130 Ca 0.07 -0.10 0.00 0.00 0.77 0.00 0.00 66.41 67.15 3hk9 h THR 130 Cb 0.07 0.61 -0.01 0.00 -1.74 0.00 0.00 68.15 67.08 3hk9 h THR 130 CO -0.01 0.02 0.10 0.58 0.37 0.00 0.00 175.52 176.58 3hk9 h VAL 131 N -0.66 1.03 -0.61 3.16 2.07 -0.83 -0.04 116.25 120.37 3hk9 h VAL 131 Ca -0.06 -0.07 0.05 0.00 0.82 0.00 0.00 66.70 67.44 3hk9 h VAL 131 Cb 0.49 0.80 -0.04 0.00 -1.52 0.00 0.00 31.29 31.03 3hk9 h VAL 131 CO 0.10 0.04 0.40 -0.07 0.02 0.00 0.00 177.57 178.06 3hk9 h LEU 132 N 0.21 0.56 0.01 2.57 3.38 -1.12 0.12 115.31 121.04 3hk9 h LEU 132 Ca 0.06 -0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.03 3hk9 h LEU 132 Cb -0.02 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.61 3hk9 h LEU 132 CO -0.02 0.37 -0.00 -0.61 0.09 0.00 0.00 178.44 178.27 3hk9 h GLN 133 N 0.64 -0.01 -0.77 1.13 4.15 -0.85 -1.43 115.11 117.97 3hk9 h GLN 133 Ca 0.25 0.00 -0.04 0.00 0.77 0.00 0.00 58.65 59.64 3hk9 h GLN 133 Cb 0.20 0.00 -0.03 0.00 0.21 0.00 0.00 27.48 27.85 3hk9 h GLN 133 CO -0.07 0.43 0.34 -0.07 -1.93 0.00 0.00 178.83 177.53 3hk9 h LEU 134 N -0.45 1.04 -0.75 -2.39 3.38 -0.45 -2.63 115.31 113.06 3hk9 h LEU 134 Ca -0.00 -0.15 0.00 0.00 0.09 0.00 0.00 57.88 57.81 3hk9 h LEU 134 Cb 0.44 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.92 3hk9 h LEU 134 CO 0.00 0.91 0.00 0.00 0.09 0.00 0.00 178.44 179.44 3hk9 n ALA 135 N -2.41 2.58 -4.08 1.53 0.00 0.37 -4.94 120.51 113.56 3hk9 n ALA 135 Ca 0.07 -0.39 -0.28 0.00 0.00 0.00 0.00 53.44 52.84 3hk9 n ALA 135 Cb 0.16 -1.21 -0.05 0.00 0.00 0.00 0.00 19.45 18.35 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 -0.07 0.04 -4.47 0.00 5.15 -0.63 -4.81 115.26 110.48 3hk9 n ASN 136 Ca 0.18 -1.11 -0.35 0.00 -0.60 0.00 0.00 54.58 52.70 3hk9 n ASN 136 Cb 0.28 -2.50 -0.12 0.00 -0.53 0.00 0.00 39.78 36.90 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 -4.11 4.21 -0.15 3.44 1.01 -0.69 -0.66 120.40 123.46 3hk9 s VAL 137 Ca 0.01 -0.22 0.09 0.00 0.00 0.00 0.00 61.98 61.86 3hk9 s VAL 137 Cb -0.01 -2.93 -0.23 0.00 0.00 0.00 0.00 36.38 33.21 3hk9 s VAL 137 CO 0.93 0.39 0.26 -1.54 0.00 0.00 0.00 175.10 175.14 3hk9 n SER 138 N 4.44 1.05 -3.93 3.32 3.41 0.50 -4.74 113.62 117.66 3hk9 n SER 138 Ca -0.17 0.14 -0.19 0.00 -0.26 0.00 0.00 58.87 58.40 3hk9 n SER 138 Cb 0.52 0.05 -0.16 0.00 -0.26 0.00 0.00 64.21 64.36 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 -6.17 0.86 -0.11 4.04 1.01 -0.90 -4.69 116.67 110.70 3hk9 s ASP 139 Ca -0.15 -0.12 0.03 0.00 0.71 0.00 0.00 52.55 53.01 3hk9 s ASP 139 Cb 0.07 -0.28 0.00 0.00 1.01 0.00 0.00 42.92 43.72 3hk9 s ASP 139 CO 0.77 0.01 -0.22 -0.69 0.21 0.00 0.00 175.17 175.25 3hk9 s VAL 140 N 0.42 2.01 -0.25 -1.27 1.01 0.56 -0.56 120.40 122.32 3hk9 s VAL 140 Ca -0.05 -0.97 -0.10 0.00 0.00 0.00 0.00 61.98 60.85 3hk9 s VAL 140 Cb -0.09 -1.75 -0.05 0.00 0.00 0.00 0.00 36.38 34.49 3hk9 s VAL 140 CO 0.00 0.54 0.16 -0.69 0.00 0.00 0.00 175.10 175.11 3hk9 s VAL 141 N 0.56 5.28 0.81 2.92 1.01 -0.48 0.06 120.40 130.56 3hk9 s VAL 141 Ca -0.14 0.15 -0.07 0.00 0.00 0.00 0.00 61.98 61.93 3hk9 s VAL 141 Cb -0.17 -3.47 0.17 0.00 0.00 0.00 0.00 36.38 32.91 3hk9 s VAL 141 CO 0.04 0.32 1.10 0.23 0.00 0.00 0.00 175.10 176.80 3hk9 n MET 142 N 4.50 -0.56 -4.02 2.72 2.81 0.61 -1.96 117.12 121.22 3hk9 n MET 142 Ca -0.15 -2.40 -0.31 0.00 -1.81 0.00 0.00 57.70 53.04 3hk9 n MET 142 Cb 0.52 -0.92 -0.15 0.00 -0.71 0.00 0.00 33.22 31.96 3hk9 n MET 142 CO 0.00 0.00 0.00 0.99 1.51 0.00 0.00 175.97 178.47 3hk9 s THR 143 N -3.34 2.20 -0.42 2.03 2.01 -1.18 -3.66 115.64 113.27 3hk9 s THR 143 Ca 0.68 -2.19 -0.12 0.00 0.31 0.00 0.00 61.69 60.38 3hk9 s THR 143 Cb -0.03 -2.58 0.06 0.00 0.01 0.00 0.00 72.50 69.97 3hk9 s THR 143 CO 0.46 -0.51 0.29 0.20 -0.69 0.00 0.00 174.62 174.37 3hk9 s ASN 144 N 0.96 5.83 -0.39 3.53 -0.87 0.50 -4.93 114.94 119.57 3hk9 s ASN 144 Ca 0.08 -1.32 -0.11 0.00 -1.57 0.00 0.00 52.86 49.94 3hk9 s ASN 144 Cb -0.19 -2.06 0.04 0.00 -0.02 0.00 0.00 41.25 39.02 3hk9 s ASN 144 CO -0.08 -0.53 0.24 -0.62 -2.57 0.00 0.00 177.10 173.53 3hk9 s ASP 145 N 2.11 5.79 0.34 -1.22 2.15 -1.26 -1.25 116.67 123.32 3hk9 s ASP 145 Ca 0.03 -1.09 0.25 0.00 0.43 0.00 0.00 52.55 52.18 3hk9 s ASP 145 Cb -0.22 -2.04 1.18 0.00 -0.30 0.00 0.00 42.92 41.53 3hk9 s ASP 145 CO 0.05 -0.43 1.77 1.55 -0.17 0.00 0.00 175.17 177.93 3hk9 h PRO 146 N 8.47 0.00 0.00 4.34 0.13 -1.97 -2.49 132.00 140.48 3hk9 h PRO 146 Ca -0.25 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.88 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 0.70 0.00 -0.05 1.19 -0.23 0.00 0.00 178.00 179.61 3hk9 n PHE 147 N -2.39 0.19 -3.09 1.56 3.72 -1.26 -4.66 117.46 111.53 3hk9 n PHE 147 Ca 0.00 0.05 -0.42 0.00 -0.05 0.00 0.00 57.45 57.03 3hk9 n PHE 147 Cb 0.16 -0.57 -0.07 0.00 -0.94 0.00 0.00 39.48 38.07 3hk9 n PHE 147 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 3hk9 s ASP 148 N -3.32 6.38 0.23 4.37 2.15 -0.94 -4.96 116.67 120.58 3hk9 s ASP 148 Ca 0.13 -0.10 -0.11 0.00 0.43 0.00 0.00 52.55 52.90 3hk9 s ASP 148 Cb 0.18 -2.33 0.31 0.00 -0.30 0.00 0.00 42.92 40.78 3hk9 s ASP 148 CO 0.56 -0.71 1.62 0.44 -0.17 0.00 0.00 175.17 176.90 3hk9 h ASP 149 N 8.71 -0.58 0.19 -0.34 3.32 -1.88 0.51 116.42 126.35 3hk9 h ASP 149 Ca -0.26 0.21 -0.01 0.00 0.02 0.00 0.00 57.03 56.99 3hk9 h ASP 149 Cb 1.10 0.41 -0.01 0.00 0.22 0.00 0.00 39.33 41.06 3hk9 h ASP 149 CO 0.88 -0.22 -0.17 0.78 -1.72 0.00 0.00 179.24 178.79 3hk9 h ASN 150 N 0.02 -0.45 -1.00 6.45 2.35 -1.95 -1.33 115.58 119.67 3hk9 h ASN 150 Ca 0.35 0.03 0.15 0.00 -0.55 0.00 0.00 56.30 56.28 3hk9 h ASN 150 Cb 0.56 0.15 -0.09 0.00 0.05 0.00 0.00 38.32 38.98 3hk9 h ASN 150 CO -0.71 -0.23 0.61 -0.08 -1.65 0.00 0.00 177.43 175.38 3hk9 h GLU 151 N -0.35 0.86 -0.86 0.81 4.81 -1.83 -0.93 114.58 117.09 3hk9 h GLU 151 Ca -0.02 -0.05 0.01 0.00 -0.13 0.00 0.00 59.36 59.16 3hk9 h GLU 151 Cb 0.30 -0.19 -0.04 0.00 0.63 0.00 0.00 28.75 29.44 3hk9 h GLU 151 CO -0.01 0.57 0.57 -0.09 -0.73 0.00 0.00 179.01 179.32 3hk9 h ARG 152 N 0.89 1.12 -0.71 1.92 2.43 -0.70 -2.29 114.38 117.03 3hk9 h ARG 152 Ca 0.53 -0.07 0.04 0.00 -0.81 0.00 0.00 59.98 59.67 3hk9 h ARG 152 Cb 0.65 -0.25 -0.05 0.00 -0.42 0.00 0.00 29.97 29.90 3hk9 h ARG 152 CO -0.32 0.74 0.44 0.82 -1.51 0.00 0.00 179.97 180.14 3hk9 h ILE 153 N 1.15 1.07 -0.73 1.20 1.08 0.02 -0.51 117.51 120.79 3hk9 h ILE 153 Ca 0.32 -0.29 0.06 0.00 -0.39 0.00 0.00 64.86 64.56 3hk9 h ILE 153 Cb -0.12 0.15 -0.06 0.00 -3.07 0.00 0.00 36.82 33.73 3hk9 h ILE 153 CO -0.07 0.15 0.42 0.28 -0.69 0.00 0.00 178.15 178.24 3hk9 h SER 154 N 0.84 0.64 -0.30 1.72 0.02 -1.35 0.24 113.55 115.35 3hk9 h SER 154 Ca 0.29 0.03 -0.18 0.00 -0.84 0.00 0.00 61.79 61.09 3hk9 h SER 154 Cb 0.07 -0.10 -0.00 0.00 0.14 0.00 0.00 62.40 62.51 3hk9 h SER 154 CO -0.13 0.40 -0.51 -0.50 -1.14 0.00 0.00 176.83 174.96 3hk9 h TRP 155 N 0.77 1.10 -0.14 3.45 4.06 -1.29 -2.07 115.95 121.83 3hk9 h TRP 155 Ca 0.33 -0.38 -0.03 0.00 2.06 0.00 0.00 58.89 60.87 3hk9 h TRP 155 Cb 0.20 -0.21 -0.01 0.00 -1.00 0.00 0.00 29.16 28.13 3hk9 h TRP 155 CO -0.06 1.21 -0.04 -0.07 -3.56 0.00 0.00 178.44 175.91 3hk9 h LEU 156 N 0.69 0.19 -0.60 -4.49 3.38 -0.38 -1.57 115.31 112.54 3hk9 h LEU 156 Ca 0.03 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3hk9 h LEU 156 Cb 1.11 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.81 3hk9 h LEU 156 CO 0.12 0.27 0.00 -0.62 0.09 0.00 0.00 178.44 178.29 3hk9 n GLU 157 N -4.37 0.22 -0.19 1.13 1.02 0.77 -4.88 120.64 114.34 3hk9 n GLU 157 Ca -0.01 0.39 0.00 0.00 -0.02 0.00 0.00 57.16 57.52 3hk9 n GLU 157 Cb 0.19 -1.88 0.00 0.00 -0.02 0.00 0.00 31.44 29.73 3hk9 n GLU 157 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3hk9 n GLY 158 N 0.25 0.88 3.77 0.62 0.00 -0.59 -5.05 105.19 105.07 3hk9 n GLY 158 Ca 0.03 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.65 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 -0.81 3.91 -0.02 1.61 1.02 -0.79 -5.03 119.74 119.63 3hk9 s LYS 159 Ca 0.00 2.16 0.04 0.00 0.02 0.00 0.00 55.97 58.19 3hk9 s LYS 159 Cb 0.00 -2.72 -0.01 0.00 -0.52 0.00 0.00 37.83 34.59 3hk9 s LYS 159 CO 0.00 -0.54 -0.14 -0.65 -0.92 0.00 0.00 175.35 173.10 3hk9 s GLN 160 N -2.29 1.32 0.52 1.68 -1.52 -1.26 -4.69 119.66 113.42 3hk9 s GLN 160 Ca 0.58 -0.50 -0.19 0.00 -1.95 0.00 0.00 55.36 53.29 3hk9 s GLN 160 Cb -0.38 -1.22 -0.07 0.00 -0.22 0.00 0.00 33.01 31.12 3hk9 s GLN 160 CO 0.49 0.25 1.08 -1.25 -0.25 0.00 0.00 175.29 175.61 3hk9 s PRO 161 N -0.11 3.54 1.00 2.91 0.04 -1.26 -4.95 135.00 136.18 3hk9 s PRO 161 Ca 0.01 1.46 -0.12 0.00 0.04 0.00 0.00 61.00 62.38 3hk9 s PRO 161 Cb -0.08 -2.05 0.19 0.00 0.04 0.00 0.00 34.50 32.60 3hk9 s PRO 161 CO 0.00 -0.66 1.10 0.16 0.04 0.00 0.00 177.00 177.64 3hk9 s ASP 162 N -1.97 2.63 0.66 6.66 1.47 -1.26 -4.84 116.67 120.02 3hk9 s ASP 162 Ca 0.69 1.16 0.26 0.00 1.18 0.00 0.00 52.55 55.84 3hk9 s ASP 162 Cb -0.20 -1.82 1.39 0.00 -0.34 0.00 0.00 42.92 41.96 3hk9 s ASP 162 CO 0.25 -3.13 1.78 0.77 0.68 0.00 0.00 175.17 175.52 3hk9 h SER 163 N -1.89 0.00 1.18 2.11 4.64 -2.00 -0.73 113.55 116.86 3hk9 h SER 163 Ca -0.54 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.78 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 -0.34 0.03 -0.87 0.00 0.00 176.83 176.23 3hk9 h ARG 164 N 0.00 0.00 -5.88 4.77 3.08 -1.89 -3.46 114.38 111.00 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 0.84 0.00 -0.23 0.00 0.08 0.00 0.00 29.97 30.66 3hk9 h ARG 164 CO 0.00 0.00 -0.74 -0.06 -1.07 0.00 0.00 179.97 178.10 3hk9 s PHE 165 N -3.14 2.82 0.09 3.04 0.08 -0.28 -0.32 117.98 120.27 3hk9 s PHE 165 Ca 0.08 -0.27 0.10 0.00 0.12 0.00 0.00 56.93 56.96 3hk9 s PHE 165 Cb 0.13 -1.75 -0.03 0.00 -0.57 0.00 0.00 43.02 40.79 3hk9 s PHE 165 CO 0.67 0.08 -0.25 -1.01 -0.10 0.00 0.00 175.22 174.61 3hk9 s HIS 166 N -0.32 2.17 0.28 0.36 3.76 0.11 -4.66 115.29 117.00 3hk9 s HIS 166 Ca 0.03 -0.39 -0.05 0.00 -0.15 0.00 0.00 55.06 54.50 3hk9 s HIS 166 Cb -0.13 -1.22 -0.05 0.00 1.11 0.00 0.00 32.58 32.29 3hk9 s HIS 166 CO 0.03 0.24 0.54 0.00 -0.85 0.00 0.00 174.74 174.69 3hk9 s ALA 167 N -0.98 3.64 -0.07 -1.40 0.00 -1.26 -0.28 121.76 121.40 3hk9 s ALA 167 Ca 0.11 -0.58 -0.03 0.00 0.00 0.00 0.00 51.96 51.47 3hk9 s ALA 167 Cb -0.10 -2.27 0.04 0.00 0.00 0.00 0.00 23.12 20.79 3hk9 s ALA 167 CO 0.04 0.27 0.10 0.00 0.00 0.00 0.00 175.76 176.17 3hk9 s ALA 168 N -2.06 0.12 -0.56 0.00 0.00 -1.24 -0.48 121.76 117.55 3hk9 s ALA 168 Ca 0.43 0.25 -0.28 0.00 0.00 0.00 0.00 51.96 52.37 3hk9 s ALA 168 Cb -0.11 -0.75 0.01 0.00 0.00 0.00 0.00 23.12 22.28 3hk9 s ALA 168 CO 0.30 -0.61 1.49 -1.17 0.00 0.00 0.00 175.76 175.76 3hk9 s LEU 169 N 2.21 3.39 -0.11 0.00 2.96 -0.83 -0.37 118.68 125.93 3hk9 s LEU 169 Ca 0.04 0.34 -0.22 0.00 -0.22 0.00 0.00 54.13 54.07 3hk9 s LEU 169 Cb -0.13 -3.01 -0.03 0.00 0.50 0.00 0.00 46.19 43.52 3hk9 s LEU 169 CO -0.05 -1.79 0.67 -0.60 -1.32 0.00 0.00 176.35 173.26 3hk9 s ARG 170 N 5.69 4.36 -0.15 1.98 6.06 -0.38 -0.66 118.95 135.85 3hk9 s ARG 170 Ca 0.55 0.78 0.15 0.00 -2.50 0.00 0.00 55.73 54.71 3hk9 s ARG 170 Cb -0.12 -3.49 0.34 0.00 0.06 0.00 0.00 34.95 31.74 3hk9 s ARG 170 CO 0.25 -0.03 1.17 1.28 -2.50 0.00 0.00 175.30 175.47 3hk9 n LEU 171 N 4.18 2.28 -0.20 -0.88 4.77 -0.30 -4.46 117.00 122.39 3hk9 n LEU 171 Ca -0.02 -3.25 -0.03 0.00 -0.03 0.00 0.00 56.01 52.69 3hk9 n LEU 171 Cb 0.51 -0.42 0.04 0.00 -2.33 0.00 0.00 43.42 41.21 3hk9 n LEU 171 CO 0.46 0.97 0.69 0.44 -1.33 0.00 0.00 177.39 178.62 3hk9 h ASP 172 N 0.48 -0.82 -0.53 -1.43 5.19 -1.94 -1.60 116.42 115.77 3hk9 h ASP 172 Ca -0.01 0.20 0.08 0.00 -0.62 0.00 0.00 57.03 56.68 3hk9 h ASP 172 Cb 1.08 0.46 -0.06 0.00 0.18 0.00 0.00 39.33 40.98 3hk9 h ASP 172 CO 0.01 -0.26 0.17 -0.65 -3.12 0.00 0.00 179.24 175.39 3hk9 h PRO 173 N -0.08 0.33 0.26 3.56 0.11 -1.95 0.63 132.00 134.86 3hk9 h PRO 173 Ca 0.27 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 66.35 3hk9 h PRO 173 Cb 0.50 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 31.54 3hk9 h PRO 173 CO -0.65 0.22 -0.13 1.25 -0.21 0.00 0.00 178.00 178.48 3hk9 h LEU 174 N 0.34 -0.30 -0.21 2.35 5.85 -1.71 -0.46 115.31 121.17 3hk9 h LEU 174 Ca 0.26 -0.13 -0.11 0.00 0.84 0.00 0.00 57.88 58.74 3hk9 h LEU 174 Cb 0.31 0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.40 3hk9 h LEU 174 CO -0.28 -0.04 -0.52 -0.07 -0.34 0.00 0.00 178.44 177.19 3hk9 h LEU 175 N -0.56 0.00 0.00 2.25 4.07 -1.17 -3.15 115.31 116.75 3hk9 h LEU 175 Ca -0.04 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.92 3hk9 h LEU 175 Cb 0.41 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.15 3hk9 h LEU 175 CO 0.06 0.52 -1.54 0.59 -1.08 0.00 0.00 178.44 176.99 3hk9 n ASN 176 N -3.30 1.79 -2.56 -0.43 3.02 0.22 -3.89 115.26 110.11 3hk9 n ASN 176 Ca 0.01 -0.06 -0.10 0.00 -0.03 0.00 0.00 54.58 54.40 3hk9 n ASN 176 Cb 0.70 1.57 0.04 0.00 -0.61 0.00 0.00 39.78 41.48 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 -1.92 2.29 -0.27 3.52 1.02 -0.19 -4.92 120.64 120.17 3hk9 n GLU 177 Ca -0.02 -3.73 0.06 0.00 -0.02 0.00 0.00 57.16 53.45 3hk9 n GLU 177 Cb 0.34 -1.79 0.20 0.00 -0.02 0.00 0.00 31.44 30.17 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 2.55 0.58 -0.93 -0.32 3.20 -1.49 0.26 116.97 120.82 3hk9 h TYR 178 Ca 0.04 0.04 0.15 0.00 3.14 0.00 0.00 58.73 62.10 3hk9 h TYR 178 Cb 1.30 -0.14 -0.08 0.00 1.54 0.00 0.00 36.73 39.36 3hk9 h TYR 178 CO 0.62 0.09 0.59 0.93 -1.64 0.00 0.00 178.16 178.75 3hk9 h GLU 179 N 0.49 0.70 0.00 1.82 4.39 -1.90 0.55 114.58 120.63 3hk9 h GLU 179 Ca 0.43 -0.04 -0.27 0.00 0.34 0.00 0.00 59.36 59.81 3hk9 h GLU 179 Cb 0.64 -0.16 -0.05 0.00 -0.10 0.00 0.00 28.75 29.08 3hk9 h GLU 179 CO -0.39 0.46 -1.77 1.04 -1.16 0.00 0.00 179.01 177.19 3hk9 n GLN 180 N -4.59 0.64 0.09 2.33 6.02 -0.55 -4.32 117.38 116.99 3hk9 n GLN 180 Ca 0.19 0.22 -0.13 0.00 -0.01 0.00 0.00 57.00 57.26 3hk9 n GLN 180 Cb 0.49 -1.74 -0.11 0.00 1.02 0.00 0.00 30.24 29.90 3hk9 n GLN 180 CO 0.00 0.00 0.00 1.15 -1.01 0.00 0.00 177.06 177.20 3hk9 h THR 181 N 0.00 1.53 -0.30 5.09 2.02 0.23 -3.28 112.91 118.20 3hk9 h THR 181 Ca -0.30 -3.00 0.09 0.00 0.77 0.00 0.00 66.41 63.97 3hk9 h THR 181 Cb 1.94 2.81 -0.01 0.00 -1.74 0.00 0.00 68.15 71.14 3hk9 h THR 181 CO 0.06 0.87 0.38 0.07 0.37 0.00 0.00 175.52 177.28 3hk9 h LYS 182 N 0.08 0.00 0.00 6.66 2.10 -0.11 0.30 116.57 125.60 3hk9 h LYS 182 Ca -0.10 0.00 -0.09 0.00 -2.00 0.00 0.00 60.65 58.46 3hk9 h LYS 182 Cb 1.83 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 33.15 3hk9 h LYS 182 CO 0.18 0.00 -0.45 0.45 -2.00 0.00 0.00 179.45 177.63 3hk9 h HIS 183 N 0.00 0.00 0.14 0.07 3.86 -1.80 -3.02 115.15 114.40 3hk9 h HIS 183 Ca 0.14 0.00 -0.30 0.00 -1.16 0.00 0.00 60.37 59.06 3hk9 h HIS 183 Cb 0.91 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.39 3hk9 h HIS 183 CO 0.00 0.45 -1.40 0.00 0.86 0.00 0.00 177.93 177.83 3hk9 h ARG 184 N 0.00 0.29 -0.36 2.45 3.08 -0.61 -3.11 114.38 116.12 3hk9 h ARG 184 Ca -0.00 -0.50 0.04 0.00 0.07 0.00 0.00 59.98 59.59 3hk9 h ARG 184 Cb 1.07 0.19 -0.04 0.00 0.08 0.00 0.00 29.97 31.26 3hk9 h ARG 184 CO 0.06 1.20 0.13 -0.07 -1.07 0.00 0.00 179.97 180.21 3hk9 h LEU 185 N 0.08 0.14 -1.18 3.04 -0.00 -1.40 -1.69 115.31 114.31 3hk9 h LEU 185 Ca -0.20 0.04 -0.03 0.00 -0.00 0.00 0.00 57.88 57.69 3hk9 h LEU 185 Cb 2.01 0.02 -0.03 0.00 -0.00 0.00 0.00 40.66 42.67 3hk9 h LEU 185 CO 0.19 0.12 0.22 0.08 -0.00 0.00 0.00 178.44 179.05 3hk9 h ARG 186 N 0.28 0.80 0.00 1.13 0.11 -1.45 0.41 114.38 115.65 3hk9 h ARG 186 Ca 0.16 -0.12 -0.00 0.00 0.10 0.00 0.00 59.98 60.12 3hk9 h ARG 186 Cb 0.13 -0.14 -0.00 0.00 1.11 0.00 0.00 29.97 31.07 3hk9 h ARG 186 CO -0.16 0.65 -0.02 -0.44 0.10 0.00 0.00 179.97 180.10 3hk9 h ASP 187 N 0.79 0.00 -0.13 0.08 3.32 -1.25 -0.56 116.42 118.67 3hk9 h ASP 187 Ca 0.19 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.24 3hk9 h ASP 187 Cb 0.15 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.70 3hk9 h ASP 187 CO -0.02 0.02 0.00 0.79 -1.72 0.00 0.00 179.24 178.31 3hk9 n TRP 188 N -3.35 0.15 0.00 4.55 8.01 0.01 -4.94 117.44 121.86 3hk9 n TRP 188 Ca -0.02 -0.07 0.00 0.00 -1.31 0.00 0.00 57.50 56.09 3hk9 n TRP 188 Cb 0.13 0.00 0.00 0.00 -2.01 0.00 0.00 31.31 29.43 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 1.34 0.94 3.44 6.99 0.00 -0.22 -5.06 105.19 112.63 3hk9 n GLY 189 Ca 0.16 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.75 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 -2.00 3.06 -0.69 1.61 2.02 -0.45 -4.96 117.35 115.93 3hk9 s TYR 190 Ca 0.00 -0.57 -0.20 0.00 -0.37 0.00 0.00 57.07 55.93 3hk9 s TYR 190 Cb 0.00 -3.54 -0.16 0.00 -0.40 0.00 0.00 41.96 37.86 3hk9 s TYR 190 CO 0.00 -1.03 1.89 1.63 -1.57 0.00 0.00 175.55 176.47 3hk9 n LYS 191 N 6.13 1.39 -3.14 -0.62 4.76 -1.26 -3.07 118.16 122.35 3hk9 n LYS 191 Ca -0.07 -1.65 -0.39 0.00 -2.87 0.00 0.00 58.31 53.33 3hk9 n LYS 191 Cb 0.45 -2.77 -0.05 0.00 -1.84 0.00 0.00 35.03 30.82 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 4.94 4.90 0.47 -0.18 -7.23 -1.26 -4.46 120.40 117.58 3hk9 s VAL 192 Ca 0.54 1.34 0.01 0.00 -1.81 0.00 0.00 61.98 62.06 3hk9 s VAL 192 Cb 0.13 -3.98 0.01 0.00 0.56 0.00 0.00 36.38 33.10 3hk9 s VAL 192 CO 0.11 0.38 0.68 0.20 -0.31 0.00 0.00 175.10 176.16 3hk9 s ASN 193 N 0.01 5.68 0.36 4.85 0.01 -1.26 -4.97 114.94 119.62 3hk9 s ASN 193 Ca 0.33 0.15 0.04 0.00 -0.71 0.00 0.00 52.86 52.67 3hk9 s ASN 193 Cb -0.18 -1.30 0.67 0.00 0.41 0.00 0.00 41.25 40.84 3hk9 s ASN 193 CO 0.18 -0.81 1.96 0.44 -1.51 0.00 0.00 177.10 177.37 3hk9 h ASP 194 N 0.35 0.58 -3.08 -1.22 5.19 -2.02 -3.42 116.42 112.79 3hk9 h ASP 194 Ca -0.45 -0.05 -0.63 0.00 -0.62 0.00 0.00 57.03 55.28 3hk9 h ASP 194 Cb 1.27 -0.15 -0.07 0.00 0.18 0.00 0.00 39.33 40.56 3hk9 h ASP 194 CO 0.55 0.51 -0.57 -1.83 -3.12 0.00 0.00 179.24 174.78 3hk9 s GLU 195 N -5.36 3.08 -1.21 3.56 -1.05 -1.26 -5.03 118.70 111.43 3hk9 s GLU 195 Ca -0.09 -0.59 -0.19 0.00 -0.15 0.00 0.00 54.97 53.96 3hk9 s GLU 195 Cb 0.17 -2.84 0.08 0.00 -0.44 0.00 0.00 34.13 31.10 3hk9 s GLU 195 CO 0.76 0.59 1.61 -0.46 0.95 0.00 0.00 175.26 178.70 3hk9 s TRP 196 N -1.42 2.83 0.16 4.83 -0.11 -1.26 -4.70 118.94 119.27 3hk9 s TRP 196 Ca 0.31 -1.51 0.01 0.00 1.22 0.00 0.00 56.10 56.13 3hk9 s TRP 196 Cb -0.12 -4.67 0.01 0.00 -1.50 0.00 0.00 33.47 27.19 3hk9 s TRP 196 CO 0.24 -1.77 0.11 0.27 -4.62 0.00 0.00 176.95 171.17 3hk9 n ASN 197 N 8.07 1.60 -0.14 5.86 6.94 -1.26 -4.96 115.26 131.37 3hk9 n ASN 197 Ca 0.43 -1.56 0.07 0.00 -0.02 0.00 0.00 54.58 53.49 3hk9 n ASN 197 Cb 0.47 0.00 0.38 0.00 -2.36 0.00 0.00 39.78 38.27 3hk9 n ASN 197 CO 0.00 0.00 0.00 -0.08 -1.03 0.00 0.00 177.26 176.15 3hk9 h GLU 198 N 0.00 0.67 -0.45 -3.83 4.57 -1.99 -1.92 114.58 111.63 3hk9 h GLU 198 Ca -0.10 -0.04 -0.11 0.00 -1.18 0.00 0.00 59.36 57.93 3hk9 h GLU 198 Cb 0.37 -0.15 -0.02 0.00 -0.16 0.00 0.00 28.75 28.79 3hk9 h GLU 198 CO 0.16 0.44 -0.16 0.78 -1.18 0.00 0.00 179.01 179.06 3hk9 h GLY 199 N 0.69 0.92 0.98 1.92 0.00 -1.94 -1.56 103.07 104.08 3hk9 h GLY 199 Ca 0.28 -0.75 -0.12 0.00 0.00 0.00 0.00 47.33 46.74 3hk9 h GLY 199 CO -0.09 0.68 -0.29 1.76 0.00 0.00 0.00 176.54 178.60 3hk9 h SER 200 N 0.75 0.77 -0.48 0.19 0.02 -1.62 -2.61 113.55 110.57 3hk9 h SER 200 Ca 0.12 -0.47 -0.01 0.00 -0.84 0.00 0.00 61.79 60.59 3hk9 h SER 200 Cb 0.68 -0.22 -0.02 0.00 0.14 0.00 0.00 62.40 62.98 3hk9 h SER 200 CO 0.05 1.08 0.26 0.40 -1.14 0.00 0.00 176.83 177.48 3hk9 h ILE 201 N 0.47 1.17 -0.36 3.27 2.04 -1.28 -1.75 117.51 121.08 3hk9 h ILE 201 Ca 0.05 -0.43 -0.09 0.00 1.00 0.00 0.00 64.86 65.39 3hk9 h ILE 201 Cb 0.86 0.58 -0.02 0.00 -0.74 0.00 0.00 36.82 37.50 3hk9 h ILE 201 CO 0.07 0.18 -0.14 1.56 0.00 0.00 0.00 178.15 179.82 3hk9 h GLN 202 N 0.64 0.64 -0.07 2.37 1.08 -1.29 -1.84 115.11 116.63 3hk9 h GLN 202 Ca 0.17 -0.21 -0.18 0.00 -1.45 0.00 0.00 58.65 56.98 3hk9 h GLN 202 Cb 0.05 -0.05 -0.01 0.00 -0.05 0.00 0.00 27.48 27.42 3hk9 h GLN 202 CO -0.03 0.75 -0.72 0.93 -0.95 0.00 0.00 178.83 178.81 3hk9 h GLU 203 N 0.58 0.36 0.00 1.46 4.39 -1.26 -0.21 114.58 119.90 3hk9 h GLU 203 Ca 0.10 -0.29 -0.00 0.00 0.34 0.00 0.00 59.36 59.50 3hk9 h GLU 203 Cb 0.58 0.06 0.00 0.00 -0.10 0.00 0.00 28.75 29.29 3hk9 h GLU 203 CO 0.04 0.94 -0.00 0.28 -1.16 0.00 0.00 179.01 179.10 3hk9 h VAL 204 N 0.24 1.24 -0.94 3.13 2.07 -1.18 -0.23 116.25 120.58 3hk9 h VAL 204 Ca -0.03 -0.74 0.07 0.00 0.82 0.00 0.00 66.70 66.82 3hk9 h VAL 204 Cb 1.29 1.75 -0.06 0.00 -1.52 0.00 0.00 31.29 32.75 3hk9 h VAL 204 CO 0.12 0.19 0.61 0.11 0.02 0.00 0.00 177.57 178.63 3hk9 h LYS 205 N -0.32 1.05 -0.78 1.57 1.57 -1.30 0.13 116.57 118.48 3hk9 h LYS 205 Ca -0.00 -0.06 -0.02 0.00 -1.87 0.00 0.00 60.65 58.69 3hk9 h LYS 205 Cb 0.32 -0.24 -0.04 0.00 0.08 0.00 0.00 32.23 32.36 3hk9 h LYS 205 CO 0.00 0.70 0.40 -0.09 -0.57 0.00 0.00 179.45 179.89 3hk9 h ARG 206 N 1.08 1.11 0.22 3.15 2.43 -0.75 0.44 114.38 122.06 3hk9 h ARG 206 Ca 0.41 -0.15 -0.01 0.00 -0.81 0.00 0.00 59.98 59.42 3hk9 h ARG 206 Cb 0.19 -0.21 0.00 0.00 -0.42 0.00 0.00 29.97 29.54 3hk9 h ARG 206 CO -0.16 0.84 -0.11 0.35 -1.51 0.00 0.00 179.97 179.39 3hk9 h PHE 207 N 1.09 -0.28 -0.45 2.20 3.57 0.85 0.21 116.94 124.13 3hk9 h PHE 207 Ca 0.27 -0.01 0.04 0.00 3.53 0.00 0.00 57.97 61.80 3hk9 h PHE 207 Cb 0.08 0.09 -0.04 0.00 2.79 0.00 0.00 35.95 38.87 3hk9 h PHE 207 CO 0.01 -0.16 0.23 -0.07 -2.23 0.00 0.00 178.31 176.09 3hk9 h LEU 208 N -0.32 0.34 -0.69 0.59 3.38 -0.36 -2.49 115.31 115.76 3hk9 h LEU 208 Ca -0.03 0.02 -0.02 0.00 0.09 0.00 0.00 57.88 57.94 3hk9 h LEU 208 Cb 0.25 -0.04 -0.03 0.00 0.09 0.00 0.00 40.66 40.92 3hk9 h LEU 208 CO 0.05 0.24 0.34 0.74 0.09 0.00 0.00 178.44 179.90 3hk9 h THR 209 N 0.46 1.23 -0.02 0.22 2.02 0.10 -1.04 112.91 115.88 3hk9 h THR 209 Ca 0.20 -0.62 0.01 0.00 0.77 0.00 0.00 66.41 66.77 3hk9 h THR 209 Cb 0.10 0.37 -0.02 0.00 -1.74 0.00 0.00 68.15 66.86 3hk9 h THR 209 CO -0.13 0.26 -0.06 0.44 0.37 0.00 0.00 175.52 176.40 3hk9 h ASP 210 N 0.96 -0.18 0.26 4.18 3.32 -0.23 -1.48 116.42 123.25 3hk9 h ASP 210 Ca 0.24 0.03 -0.08 0.00 0.02 0.00 0.00 57.03 57.24 3hk9 h ASP 210 Cb 0.10 0.08 -0.01 0.00 0.22 0.00 0.00 39.33 39.72 3hk9 h ASP 210 CO -0.03 -0.09 -0.32 -0.50 -1.72 0.00 0.00 179.24 176.58 3hk9 h TRP 211 N -0.10 0.11 -0.61 4.55 4.06 -1.33 -1.64 115.95 120.99 3hk9 h TRP 211 Ca 0.03 -0.02 -0.07 0.00 2.06 0.00 0.00 58.89 60.89 3hk9 h TRP 211 Cb 0.14 -0.03 -0.02 0.00 -1.00 0.00 0.00 29.16 28.25 3hk9 h TRP 211 CO -0.14 0.41 0.11 0.82 -3.56 0.00 0.00 178.44 176.08 3hk9 h ILE 212 N 0.09 1.26 -0.21 1.49 2.04 -0.80 0.27 117.51 121.65 3hk9 h ILE 212 Ca 0.01 -0.99 -0.10 0.00 1.00 0.00 0.00 64.86 64.78 3hk9 h ILE 212 Cb 0.62 0.71 -0.01 0.00 -0.74 0.00 0.00 36.82 37.39 3hk9 h ILE 212 CO 0.04 0.37 -0.32 -0.33 0.00 0.00 0.00 178.15 177.91 3hk9 h GLU 213 N 0.92 0.43 0.08 2.37 5.08 -0.87 0.35 114.58 122.93 3hk9 h GLU 213 Ca 0.19 -0.18 -0.23 0.00 -1.00 0.00 0.00 59.36 58.14 3hk9 h GLU 213 Cb 0.41 -0.02 0.02 0.00 0.50 0.00 0.00 28.75 29.67 3hk9 h GLU 213 CO 0.01 0.70 -0.93 -0.09 -1.00 0.00 0.00 179.01 177.70 3hk9 h ARG 214 N 0.37 0.49 0.00 2.33 2.43 -0.87 -3.37 114.38 115.76 3hk9 h ARG 214 Ca 0.05 -0.64 -0.23 0.00 -0.81 0.00 0.00 59.98 58.35 3hk9 h ARG 214 Cb 0.74 0.21 -0.04 0.00 -0.42 0.00 0.00 29.97 30.46 3hk9 h ARG 214 CO 0.06 1.26 -1.73 -1.33 -1.51 0.00 0.00 179.97 176.72 3hk9 n MET 215 N -4.01 0.64 -3.62 0.20 2.81 0.04 -4.99 117.12 108.20 3hk9 n MET 215 Ca -0.13 0.17 -0.20 0.00 -1.81 0.00 0.00 57.70 55.73 3hk9 n MET 215 Cb 0.84 -1.73 0.05 0.00 -0.71 0.00 0.00 33.22 31.68 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 -2.86 -1.78 -4.72 7.83 2.03 0.11 -4.59 116.55 112.57 3hk9 n ASP 216 Ca -0.16 -0.75 -0.37 0.00 0.52 0.00 0.00 54.79 54.04 3hk9 n ASP 216 Cb 0.95 -4.42 0.07 0.00 -0.72 0.00 0.00 41.12 37.00 3hk9 n ASP 216 CO 0.00 0.00 0.00 -0.81 -1.92 0.00 0.00 177.20 174.47 3hk9 n PRO 217 N -4.27 1.04 0.21 -0.67 -0.04 -1.26 -4.66 135.00 125.34 3hk9 n PRO 217 Ca -0.27 0.41 0.12 0.00 -0.04 0.00 0.00 63.50 63.72 3hk9 n PRO 217 Cb 0.66 -2.50 0.20 0.00 -0.04 0.00 0.00 33.50 31.82 3hk9 n PRO 217 CO 0.00 0.00 0.00 -0.39 -0.04 0.00 0.00 175.50 175.07 3hk9 h VAL 218 N 0.43 0.00 -1.77 0.52 -1.51 -1.13 -3.47 116.25 109.31 3hk9 h VAL 218 Ca -0.51 -0.94 0.23 0.00 -1.23 0.00 0.00 66.70 64.26 3hk9 h VAL 218 Cb 1.34 1.94 -0.15 0.00 -2.13 0.00 0.00 31.29 32.29 3hk9 h VAL 218 CO 0.52 0.00 0.70 -0.72 -1.23 0.00 0.00 177.57 176.84 3hk9 s TYR 219 N -3.20 -0.15 -0.06 5.19 -0.85 -1.26 -4.32 117.35 112.70 3hk9 s TYR 219 Ca 0.07 0.03 -0.03 0.00 -0.52 0.00 0.00 57.07 56.63 3hk9 s TYR 219 Cb 0.06 0.55 -0.04 0.00 0.38 0.00 0.00 41.96 42.91 3hk9 s TYR 219 CO 0.66 -0.39 0.08 -1.64 -1.52 0.00 0.00 175.55 172.74 3hk9 s MET 220 N -2.70 3.16 0.21 -3.49 -1.94 -0.83 -1.95 119.30 111.76 3hk9 s MET 220 Ca 0.10 -0.37 0.03 0.00 -1.71 0.00 0.00 55.69 53.74 3hk9 s MET 220 Cb 0.00 -2.94 -0.05 0.00 2.01 0.00 0.00 34.83 33.86 3hk9 s MET 220 CO -0.04 0.70 0.01 0.00 -0.01 0.00 0.00 175.02 175.67 3hk9 s ALA 221 N -1.08 1.63 -0.21 3.03 0.00 0.16 0.69 121.76 125.99 3hk9 s ALA 221 Ca 0.19 -1.71 -0.27 0.00 0.00 0.00 0.00 51.96 50.16 3hk9 s ALA 221 Cb -0.12 0.58 0.11 0.00 0.00 0.00 0.00 23.12 23.69 3hk9 s ALA 221 CO 0.09 -0.30 0.92 0.54 0.00 0.00 0.00 175.76 177.00 3hk9 s VAL 222 N -3.55 0.00 -0.17 0.00 0.11 -0.73 -1.15 120.40 114.91 3hk9 s VAL 222 Ca 0.28 0.00 -0.06 0.00 -2.93 0.00 0.00 61.98 59.27 3hk9 s VAL 222 Cb 0.06 -1.00 -0.04 0.00 -1.53 0.00 0.00 36.38 33.87 3hk9 s VAL 222 CO 0.08 0.00 0.03 -0.94 -3.33 0.00 0.00 175.10 170.93 3hk9 s SER 223 N -0.36 5.34 0.22 3.54 1.04 -1.26 -1.16 113.70 121.06 3hk9 s SER 223 Ca -0.01 0.01 0.10 0.00 0.48 0.00 0.00 55.95 56.53 3hk9 s SER 223 Cb -0.03 -1.90 -0.04 0.00 0.10 0.00 0.00 66.02 64.15 3hk9 s SER 223 CO -0.00 0.17 -0.13 -0.76 0.98 0.00 0.00 173.24 173.50 3hk9 s LEU 224 N 0.39 2.83 0.82 2.42 1.43 0.10 -4.94 118.68 121.73 3hk9 s LEU 224 Ca 0.01 -0.73 -0.12 0.00 -1.03 0.00 0.00 54.13 52.26 3hk9 s LEU 224 Cb -0.13 -1.47 0.08 0.00 0.03 0.00 0.00 46.19 44.70 3hk9 s LEU 224 CO 0.01 0.08 1.12 -2.16 0.23 0.00 0.00 176.35 175.63 3hk9 s PRO 225 N -3.07 1.93 0.63 1.29 0.04 -1.25 -1.27 135.00 133.30 3hk9 s PRO 225 Ca 0.26 0.44 0.40 0.00 0.04 0.00 0.00 61.00 62.15 3hk9 s PRO 225 Cb -0.07 -1.92 2.08 0.00 0.04 0.00 0.00 34.50 34.62 3hk9 s PRO 225 CO 0.15 -1.68 2.25 -1.35 0.04 0.00 0.00 177.00 176.41 3hk9 h PRO 226 N -1.13 0.00 -0.54 0.56 0.11 -1.74 -1.70 132.00 127.56 3hk9 h PRO 226 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 3hk9 h PRO 226 Cb 1.29 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.40 3hk9 h PRO 226 CO 0.62 0.01 0.00 0.25 -0.21 0.00 0.00 178.00 178.67 3hk9 n THR 227 N -3.17 0.90 -1.68 -1.15 -2.24 -1.26 -4.03 114.28 101.66 3hk9 n THR 227 Ca -0.02 -0.65 -0.46 0.00 -2.27 0.00 0.00 64.05 60.66 3hk9 n THR 227 Cb 0.14 0.07 -0.04 0.00 -2.10 0.00 0.00 70.33 68.40 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 0.62 2.35 -4.16 4.78 7.35 -0.64 -4.99 117.46 122.77 3hk9 n PHE 228 Ca 0.15 0.17 -0.13 0.00 -0.76 0.00 0.00 57.45 56.87 3hk9 n PHE 228 Cb 0.50 -2.59 -0.11 0.00 0.35 0.00 0.00 39.48 37.63 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 1.62 1.31 -0.29 -2.13 0.01 -1.26 -4.70 113.70 108.27 3hk9 s SER 229 Ca 0.81 -0.81 -0.18 0.00 1.31 0.00 0.00 55.95 57.08 3hk9 s SER 229 Cb -0.65 0.03 0.13 0.00 0.21 0.00 0.00 66.02 65.74 3hk9 s SER 229 CO 0.40 -0.29 0.93 0.12 0.41 0.00 0.00 173.24 174.81 3hk9 s PHE 230 N -2.51 -0.64 0.90 2.43 2.19 -1.26 -4.45 117.98 114.64 3hk9 s PHE 230 Ca 0.04 1.34 -0.11 0.00 0.33 0.00 0.00 56.93 58.53 3hk9 s PHE 230 Cb -0.02 0.40 0.13 0.00 -1.31 0.00 0.00 43.02 42.21 3hk9 s PHE 230 CO -0.01 -0.32 1.11 -2.14 1.83 0.00 0.00 175.22 175.69 3hk9 s PRO 231 N 1.15 1.20 -0.25 10.12 0.02 -1.26 -4.13 135.00 141.85 3hk9 s PRO 231 Ca -0.07 1.22 -0.16 0.00 0.02 0.00 0.00 61.00 62.02 3hk9 s PRO 231 Cb -0.04 -1.77 0.07 0.00 0.02 0.00 0.00 34.50 32.78 3hk9 s PRO 231 CO -0.14 -2.40 0.62 -2.00 -0.33 0.00 0.00 177.00 172.76 3hk9 s GLU 232 N -4.76 0.65 -1.35 5.54 2.12 -1.26 -5.07 118.70 114.57 3hk9 s GLU 232 Ca 0.65 1.07 -0.16 0.00 0.36 0.00 0.00 54.97 56.89 3hk9 s GLU 232 Cb -0.20 0.15 0.07 0.00 0.26 0.00 0.00 34.13 34.41 3hk9 s GLU 232 CO 0.58 -0.14 1.90 0.39 -0.54 0.00 0.00 175.26 177.45 3hk9 n GLU 233 N 4.01 3.11 -4.15 4.30 -0.58 -1.26 -3.86 120.64 122.21 3hk9 n GLU 233 Ca -0.20 -3.09 -0.14 0.00 -0.42 0.00 0.00 57.16 53.31 3hk9 n GLU 233 Cb 0.58 -3.35 -0.07 0.00 -0.57 0.00 0.00 31.44 28.03 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 3.51 0.62 0.15 1.62 1.04 -1.26 -5.00 113.70 114.38 3hk9 s SER 234 Ca 0.50 -1.41 -0.16 0.00 0.48 0.00 0.00 55.95 55.35 3hk9 s SER 234 Cb 0.07 0.53 0.00 0.00 0.10 0.00 0.00 66.02 66.73 3hk9 s SER 234 CO 0.01 -1.06 1.79 0.78 0.98 0.00 0.00 173.24 175.74 3hk9 h ASN 235 N 2.32 0.46 0.09 7.02 2.35 -1.92 -0.92 115.58 124.98 3hk9 h ASN 235 Ca -0.30 -0.04 0.01 0.00 -0.55 0.00 0.00 56.30 55.42 3hk9 h ASN 235 Cb 1.24 -0.12 -0.01 0.00 0.05 0.00 0.00 38.32 39.49 3hk9 h ASN 235 CO 0.43 0.36 -0.10 -0.09 -1.65 0.00 0.00 177.43 176.38 3hk9 h ARG 236 N 0.52 -0.20 -0.81 0.81 2.43 -1.91 0.31 114.38 115.52 3hk9 h ARG 236 Ca 0.14 0.01 0.06 0.00 -0.81 0.00 0.00 59.98 59.38 3hk9 h ARG 236 Cb -0.02 0.05 -0.06 0.00 -0.42 0.00 0.00 29.97 29.51 3hk9 h ARG 236 CO -0.03 -0.14 0.50 0.78 -1.51 0.00 0.00 179.97 179.58 3hk9 h GLY 237 N -0.21 1.22 1.10 2.80 0.00 -1.62 -0.71 103.07 105.63 3hk9 h GLY 237 Ca 0.01 -0.36 -0.19 0.00 0.00 0.00 0.00 47.33 46.78 3hk9 h GLY 237 CO -0.04 0.26 -0.63 3.21 0.00 0.00 0.00 176.54 179.34 3hk9 h ARG 238 N 0.92 0.76 -0.56 4.80 3.08 -0.89 -1.62 114.38 120.88 3hk9 h ARG 238 Ca 0.35 -0.57 -0.02 0.00 0.07 0.00 0.00 59.98 59.81 3hk9 h ARG 238 Cb 0.15 0.10 -0.03 0.00 0.08 0.00 0.00 29.97 30.27 3hk9 h ARG 238 CO -0.16 1.18 0.26 0.82 -1.07 0.00 0.00 179.97 181.00 3hk9 h ILE 239 N 0.49 1.21 -0.30 2.04 2.04 -0.07 0.98 117.51 123.89 3hk9 h ILE 239 Ca -0.03 -0.60 -0.04 0.00 1.00 0.00 0.00 64.86 65.19 3hk9 h ILE 239 Cb 1.26 0.57 -0.01 0.00 -0.74 0.00 0.00 36.82 37.89 3hk9 h ILE 239 CO 0.13 0.24 0.01 0.40 0.00 0.00 0.00 178.15 178.94 3hk9 h ILE 240 N 0.76 1.25 0.53 -0.67 2.04 -1.15 0.97 117.51 121.24 3hk9 h ILE 240 Ca 0.19 -0.90 -0.03 0.00 1.00 0.00 0.00 64.86 65.12 3hk9 h ILE 240 Cb 0.13 1.25 0.01 0.00 -0.74 0.00 0.00 36.82 37.47 3hk9 h ILE 240 CO -0.02 0.29 -0.25 -0.09 0.00 0.00 0.00 178.15 178.08 3hk9 h ARG 241 N 0.32 -0.68 0.00 2.37 2.43 -1.10 -2.19 114.38 115.53 3hk9 h ARG 241 Ca 0.09 0.05 -0.11 0.00 -0.81 0.00 0.00 59.98 59.20 3hk9 h ARG 241 Cb 0.41 0.15 -0.02 0.00 -0.42 0.00 0.00 29.97 30.10 3hk9 h ARG 241 CO 0.01 -0.38 -0.66 -0.44 -1.51 0.00 0.00 179.97 177.00 3hk9 h ASP 242 N -0.92 0.00 0.00 -3.80 3.32 -0.88 -3.40 116.42 110.73 3hk9 h ASP 242 Ca -0.07 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.98 3hk9 h ASP 242 Cb 0.62 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.17 3hk9 h ASP 242 CO 0.12 0.46 -0.09 0.00 -1.72 0.00 0.00 179.24 178.01 3hk9 h LEU 244 N -0.09 -1.13 -0.09 0.00 7.12 -1.33 -1.76 115.31 118.03 3hk9 h LEU 244 Ca 0.00 0.14 -0.00 0.00 0.13 0.00 0.00 57.88 58.15 3hk9 h LEU 244 Cb 0.09 0.44 -0.00 0.00 -0.53 0.00 0.00 40.66 40.66 3hk9 h LEU 244 CO 0.00 -0.44 0.05 -0.07 -0.13 0.00 0.00 178.44 177.85 3hk9 h LEU 245 N -0.56 0.11 -0.65 2.25 3.38 -1.64 0.26 115.31 118.46 3hk9 h LEU 245 Ca 0.05 -0.08 0.06 0.00 0.09 0.00 0.00 57.88 57.99 3hk9 h LEU 245 Cb 0.63 -0.03 -0.05 0.00 0.09 0.00 0.00 40.66 41.29 3hk9 h LEU 245 CO -0.27 0.15 0.36 -0.65 0.09 0.00 0.00 178.44 178.12 3hk9 h PRO 246 N 0.05 0.65 -0.15 1.13 0.11 -1.76 0.18 132.00 132.21 3hk9 h PRO 246 Ca 0.03 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 66.08 3hk9 h PRO 246 Cb 0.07 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 31.03 3hk9 h PRO 246 CO -0.01 0.43 0.01 0.28 -0.21 0.00 0.00 178.00 178.51 3hk9 h VAL 247 N 0.67 1.24 -0.74 3.15 2.07 -1.12 -2.12 116.25 119.39 3hk9 h VAL 247 Ca 0.29 -0.77 0.11 0.00 0.82 0.00 0.00 66.70 67.14 3hk9 h VAL 247 Cb 0.17 1.45 -0.08 0.00 -1.52 0.00 0.00 31.29 31.32 3hk9 h VAL 247 CO -0.18 0.23 0.36 0.00 0.02 0.00 0.00 177.57 178.01 3hk9 h ALA 248 N 0.79 1.04 0.09 1.67 0.00 -0.04 -1.76 119.26 121.05 3hk9 h ALA 248 Ca 0.05 0.07 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 3hk9 h ALA 248 Cb 0.34 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.10 3hk9 h ALA 248 CO 0.01 -0.07 -0.04 1.49 0.00 0.00 0.00 179.25 180.63 3hk9 h GLU 249 N 0.59 -0.12 -0.91 0.00 4.81 -0.85 0.11 114.58 118.22 3hk9 h GLU 249 Ca 0.38 0.01 0.13 0.00 -0.13 0.00 0.00 59.36 59.74 3hk9 h GLU 249 Cb 0.44 0.03 -0.09 0.00 0.63 0.00 0.00 28.75 29.76 3hk9 h GLU 249 CO -0.30 0.07 0.53 -0.22 -0.73 0.00 0.00 179.01 178.36 3hk9 h LYS 250 N -0.28 0.78 -0.14 1.92 3.64 -0.85 -0.38 116.57 121.25 3hk9 h LYS 250 Ca -0.01 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.32 3hk9 h LYS 250 Cb 0.24 -0.18 0.00 0.00 -0.41 0.00 0.00 32.23 31.88 3hk9 h LYS 250 CO 0.02 0.52 0.00 0.72 -2.27 0.00 0.00 179.45 178.44 3hk9 n HIS 251 N -4.74 0.17 -3.88 1.91 8.25 -0.71 -4.96 115.22 111.25 3hk9 n HIS 251 Ca 0.18 -0.08 -0.26 0.00 -0.26 0.00 0.00 57.72 57.29 3hk9 n HIS 251 Cb 0.39 0.00 -0.00 0.00 1.12 0.00 0.00 29.99 31.49 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 0.78 -1.32 -4.23 0.41 5.15 0.25 -4.98 115.26 111.32 3hk9 n ASN 252 Ca 0.17 -0.99 -0.31 0.00 -0.60 0.00 0.00 54.58 52.85 3hk9 n ASN 252 Cb 0.46 -3.19 -0.17 0.00 -0.53 0.00 0.00 39.78 36.35 3hk9 n ASN 252 CO 0.00 0.00 0.00 0.27 1.40 0.00 0.00 177.26 178.93 3hk9 s ILE 253 N -3.84 1.94 0.76 -1.44 -4.36 -0.36 -4.86 121.20 109.03 3hk9 s ILE 253 Ca 0.09 -0.99 -0.14 0.00 -0.26 0.00 0.00 60.65 59.36 3hk9 s ILE 253 Cb -0.03 -1.66 0.05 0.00 1.25 0.00 0.00 42.46 42.07 3hk9 s ILE 253 CO 0.88 0.54 1.19 -2.84 0.24 0.00 0.00 174.94 174.94 3hk9 s PRO 254 N 0.04 2.01 -0.28 0.37 0.02 -1.26 -4.62 135.00 131.27 3hk9 s PRO 254 Ca -0.08 1.67 -0.05 0.00 0.02 0.00 0.00 61.00 62.56 3hk9 s PRO 254 Cb -0.15 -1.83 0.02 0.00 0.02 0.00 0.00 34.50 32.56 3hk9 s PRO 254 CO 0.05 -1.92 0.04 0.12 -0.33 0.00 0.00 177.00 174.96 3hk9 s PHE 255 N -2.16 3.13 -0.20 6.54 5.36 0.91 -1.96 117.98 129.61 3hk9 s PHE 255 Ca 0.72 -1.17 -0.19 0.00 -0.96 0.00 0.00 56.93 55.33 3hk9 s PHE 255 Cb -0.27 -2.20 -0.03 0.00 -0.34 0.00 0.00 43.02 40.18 3hk9 s PHE 255 CO 0.48 -0.63 0.56 0.00 -1.46 0.00 0.00 175.22 174.17 3hk9 s ALA 256 N 1.44 3.54 -0.16 11.12 0.00 0.22 -1.41 121.76 136.51 3hk9 s ALA 256 Ca 0.02 -0.35 0.02 0.00 0.00 0.00 0.00 51.96 51.64 3hk9 s ALA 256 Cb -0.17 -2.87 0.01 0.00 0.00 0.00 0.00 23.12 20.09 3hk9 s ALA 256 CO 0.01 -0.48 -0.20 -1.64 0.00 0.00 0.00 175.76 173.44 3hk9 s MET 257 N 1.73 3.02 -0.47 0.00 1.00 0.60 -1.78 119.30 123.40 3hk9 s MET 257 Ca 0.26 -0.83 -0.03 0.00 0.00 0.00 0.00 55.69 55.08 3hk9 s MET 257 Cb -0.16 -2.52 0.12 0.00 0.00 0.00 0.00 34.83 32.28 3hk9 s MET 257 CO 0.10 -0.11 0.28 -1.64 0.00 0.00 0.00 175.02 173.65 3hk9 s MET 258 N 1.06 2.19 0.05 2.03 -1.94 -0.31 -2.55 119.30 119.84 3hk9 s MET 258 Ca -0.01 -2.02 -0.08 0.00 -1.71 0.00 0.00 55.69 51.88 3hk9 s MET 258 Cb -0.14 -3.65 -0.05 0.00 2.01 0.00 0.00 34.83 33.00 3hk9 s MET 258 CO -0.07 -1.11 0.34 0.42 -0.01 0.00 0.00 175.02 174.59 3hk9 s ILE 259 N 0.82 5.19 0.00 2.53 1.01 -0.83 -0.72 121.20 129.20 3hk9 s ILE 259 Ca 0.10 0.29 0.00 0.00 0.00 0.00 0.00 60.65 61.05 3hk9 s ILE 259 Cb -0.22 -3.61 0.00 0.00 0.01 0.00 0.00 42.46 38.64 3hk9 s ILE 259 CO -0.04 0.31 0.00 0.61 0.00 0.00 0.00 174.94 175.82 3hk9 n GLY 260 N 0.94 1.76 3.72 6.18 0.00 -0.39 -0.14 105.19 117.26 3hk9 n GLY 260 Ca -0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.51 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 -1.92 4.76 -0.59 1.61 0.11 -1.06 -1.75 120.40 121.56 3hk9 s VAL 261 Ca 0.00 2.04 -0.06 0.00 -2.93 0.00 0.00 61.98 61.04 3hk9 s VAL 261 Cb 0.00 -4.31 0.15 0.00 -1.53 0.00 0.00 36.38 30.69 3hk9 s VAL 261 CO 0.00 0.21 0.43 -0.75 -3.33 0.00 0.00 175.10 171.67 3hk9 s LYS 262 N 0.68 2.61 0.43 1.54 2.20 -0.49 -3.93 119.74 122.79 3hk9 s LYS 262 Ca 0.50 -2.27 -0.26 0.00 -0.36 0.00 0.00 55.97 53.59 3hk9 s LYS 262 Cb -0.22 -3.85 -0.09 0.00 -1.51 0.00 0.00 37.83 32.16 3hk9 s LYS 262 CO 0.28 -1.18 1.39 1.63 -0.36 0.00 0.00 175.35 177.11 3hk9 n LYS 263 N 4.00 2.21 -4.01 4.03 4.76 -1.26 -0.90 118.16 126.98 3hk9 n LYS 263 Ca 0.04 0.79 -0.37 0.00 -2.87 0.00 0.00 58.31 55.90 3hk9 n LYS 263 Cb 0.40 -2.56 -0.00 0.00 -1.84 0.00 0.00 35.03 31.03 3hk9 n LYS 263 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 3hk9 n ARG 264 N -0.03 -1.07 0.05 1.97 3.00 -1.21 -4.85 116.66 114.52 3hk9 n ARG 264 Ca 0.05 0.21 0.12 0.00 -0.01 0.00 0.00 57.85 58.23 3hk9 n ARG 264 Cb 0.40 -3.40 0.48 0.00 0.00 0.00 0.00 32.46 29.95 3hk9 n ARG 264 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.63 178.96 3hk9 n VAL 265 N -4.67 0.46 -3.23 1.55 0.24 0.51 -3.80 118.33 109.38 3hk9 n VAL 265 Ca -0.18 -0.03 -0.23 0.00 -2.04 0.00 0.00 64.34 61.86 3hk9 n VAL 265 Cb 0.61 -0.69 -0.07 0.00 -1.47 0.00 0.00 33.84 32.22 3hk9 n VAL 265 CO 0.00 0.00 0.00 1.57 -2.14 0.00 0.00 176.83 176.26 3hk9 n HIS 266 N -1.87 -1.30 -0.34 6.34 -0.00 -1.05 -5.03 115.22 111.97 3hk9 n HIS 266 Ca 0.05 -3.04 0.23 0.00 -0.00 0.00 0.00 57.72 54.96 3hk9 n HIS 266 Cb 0.33 0.34 0.48 0.00 -0.00 0.00 0.00 29.99 31.15 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 5.10 0.40 0.00 1.57 0.13 -1.83 -1.44 132.00 135.93 3hk9 h PRO 267 Ca 0.18 -0.02 -0.01 0.00 -0.87 0.00 0.00 66.00 65.28 3hk9 h PRO 267 Cb 0.93 -0.09 -0.00 0.00 0.13 0.00 0.00 31.00 31.97 3hk9 h PRO 267 CO 0.34 0.26 -0.02 0.00 -0.23 0.00 0.00 178.00 178.35 3hk9 h ALA 268 N 1.69 1.40 -0.00 -0.56 0.00 -1.95 -1.55 119.26 118.28 3hk9 h ALA 268 Ca 0.66 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.54 3hk9 h ALA 268 Cb 1.56 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.35 3hk9 h ALA 268 CO -0.41 0.03 -0.01 1.28 0.00 0.00 0.00 179.25 180.14 3hk9 n LEU 269 N -3.70 0.38 0.00 0.00 4.77 -0.54 -4.95 117.00 112.96 3hk9 n LEU 269 Ca -0.03 -0.09 0.00 0.00 -0.03 0.00 0.00 56.01 55.86 3hk9 n LEU 269 Cb 0.11 -0.04 0.00 0.00 -2.33 0.00 0.00 43.42 41.17 3hk9 n LEU 269 CO 0.27 0.06 0.00 0.61 -1.33 0.00 0.00 177.39 177.00 3hk9 n GLY 270 N 1.09 3.39 0.29 -0.72 0.00 -0.59 -1.86 105.19 106.79 3hk9 n GLY 270 Ca 0.21 -0.16 0.17 0.00 0.00 0.00 0.00 46.02 46.25 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 2.25 0.00 -0.45 1.61 3.32 -1.94 -0.02 116.42 121.19 3hk9 h ASP 271 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3hk9 h ASP 271 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 3hk9 h ASP 271 CO 0.00 0.00 0.00 0.00 -1.72 0.00 0.00 179.24 177.52 3hk9 n ALA 272 N -1.93 2.43 -0.81 3.45 0.00 -0.78 -4.33 120.51 118.55 3hk9 n ALA 272 Ca -0.02 -0.83 0.08 0.00 0.00 0.00 0.00 53.44 52.67 3hk9 n ALA 272 Cb 0.15 -0.97 0.35 0.00 0.00 0.00 0.00 19.45 18.98 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 1.28 3.15 3.86 0.00 0.00 -0.02 -4.84 105.19 108.61 3hk9 n GLY 273 Ca 0.17 -0.90 -0.36 0.00 0.00 0.00 0.00 46.02 44.92 3hk9 n GLY 273 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3hk9 s ASP 274 N -1.09 6.69 0.00 1.61 1.01 -1.26 -0.36 116.67 123.27 3hk9 s ASP 274 Ca 0.49 0.85 0.00 0.00 0.71 0.00 0.00 52.55 54.60 3hk9 s ASP 274 Cb 0.36 -2.20 0.00 0.00 1.01 0.00 0.00 42.92 42.09 3hk9 s ASP 274 CO 0.17 0.23 0.00 0.33 0.21 0.00 0.00 175.17 176.11 3hk9 n PHE 275 N 1.22 -0.97 -4.04 4.23 7.35 -0.08 -4.92 117.46 120.26 3hk9 n PHE 275 Ca -0.10 0.00 -0.08 0.00 -0.76 0.00 0.00 57.45 56.51 3hk9 n PHE 275 Cb 0.52 0.00 -0.10 0.00 0.35 0.00 0.00 39.48 40.26 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 0.04 0.19 -0.04 -2.13 0.11 -1.26 -1.39 120.40 115.91 3hk9 s VAL 276 Ca 0.00 -1.55 -0.25 0.00 -2.93 0.00 0.00 61.98 57.25 3hk9 s VAL 276 Cb 0.00 -1.27 0.05 0.00 -1.53 0.00 0.00 36.38 33.63 3hk9 s VAL 276 CO 0.00 -0.86 0.54 -0.83 -3.33 0.00 0.00 175.10 170.62 3hk9 s GLY 277 N -2.64 -0.42 0.28 6.54 0.00 -0.72 -4.85 107.32 105.51 3hk9 s GLY 277 Ca 0.02 0.97 -0.29 0.00 0.00 0.00 0.00 44.72 45.42 3hk9 s GLY 277 CO -0.08 0.67 1.13 1.25 0.00 0.00 0.00 173.10 176.06 3hk9 s LYS 278 N -1.18 4.60 0.30 2.90 2.20 -1.26 -4.46 119.74 122.84 3hk9 s LYS 278 Ca -0.11 1.85 0.08 0.00 -0.36 0.00 0.00 55.97 57.43 3hk9 s LYS 278 Cb -0.02 -3.18 -0.03 0.00 -1.51 0.00 0.00 37.83 33.08 3hk9 s LYS 278 CO 0.08 0.15 0.21 0.00 -0.36 0.00 0.00 175.35 175.42 3hk9 s ALA 279 N -1.08 3.64 0.36 3.13 0.00 -1.26 -4.80 121.76 121.76 3hk9 s ALA 279 Ca 0.45 -1.61 -0.22 0.00 0.00 0.00 0.00 51.96 50.59 3hk9 s ALA 279 Cb -0.33 -1.10 -0.10 0.00 0.00 0.00 0.00 23.12 21.59 3hk9 s ALA 279 CO 0.42 0.11 0.90 0.45 0.00 0.00 0.00 175.76 177.64 3hk9 s SER 280 N -3.89 7.05 0.00 0.00 0.15 -1.26 -4.96 113.70 110.79 3hk9 s SER 280 Ca 0.37 1.65 0.25 0.00 0.70 0.00 0.00 55.95 58.92 3hk9 s SER 280 Cb -0.06 -2.52 0.46 0.00 -1.71 0.00 0.00 66.02 62.20 3hk9 s SER 280 CO 0.25 -0.22 1.38 0.23 1.20 0.00 0.00 173.24 176.08 3hk9 n MET 281 N -0.12 0.33 -0.12 5.44 2.81 -1.26 -4.47 117.12 119.74 3hk9 n MET 281 Ca 0.04 -0.21 -0.06 0.00 -1.81 0.00 0.00 57.70 55.65 3hk9 n MET 281 Cb 0.52 -1.50 -0.00 0.00 -0.71 0.00 0.00 33.22 31.54 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 0.52 -0.87 -0.94 7.83 3.32 -1.93 0.20 116.42 124.55 3hk9 h ASP 282 Ca 0.00 0.17 0.02 0.00 0.02 0.00 0.00 57.03 57.24 3hk9 h ASP 282 Cb 0.52 0.43 -0.05 0.00 0.22 0.00 0.00 39.33 40.45 3hk9 h ASP 282 CO 0.00 -0.28 0.62 1.23 -1.72 0.00 0.00 179.24 179.09 3hk9 h GLY 283 N -0.19 1.33 1.12 2.75 0.00 -1.78 0.93 103.07 107.23 3hk9 h GLY 283 Ca 0.19 -0.48 -0.18 0.00 0.00 0.00 0.00 47.33 46.85 3hk9 h GLY 283 CO -0.51 0.46 -0.51 -2.08 0.00 0.00 0.00 176.54 173.90 3hk9 h VAL 284 N 1.25 1.28 -0.19 4.60 2.07 -1.69 -1.38 116.25 122.19 3hk9 h VAL 284 Ca 0.35 -1.69 0.02 0.00 0.82 0.00 0.00 66.70 66.20 3hk9 h VAL 284 Cb -0.10 1.62 -0.02 0.00 -1.52 0.00 0.00 31.29 31.26 3hk9 h VAL 284 CO -0.09 0.55 0.03 -0.08 0.02 0.00 0.00 177.57 178.01 3hk9 h GLU 285 N 0.64 0.11 -0.26 1.57 4.81 -0.16 -0.95 114.58 120.33 3hk9 h GLU 285 Ca 0.02 -0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.23 3hk9 h GLU 285 Cb 1.12 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 30.46 3hk9 h GLU 285 CO 0.12 0.07 0.13 1.25 -0.73 0.00 0.00 179.01 179.84 3hk9 h HIS 286 N 0.11 0.37 -0.27 0.92 2.76 -0.78 -1.57 115.15 116.69 3hk9 h HIS 286 Ca 0.09 -0.02 0.04 0.00 -2.20 0.00 0.00 60.37 58.28 3hk9 h HIS 286 Cb 0.08 -0.12 -0.04 0.00 1.55 0.00 0.00 27.41 28.89 3hk9 h HIS 286 CO -0.14 0.35 0.04 -0.07 -1.30 0.00 0.00 177.93 176.81 3hk9 h LEU 287 N 0.29 -0.02 -0.75 0.26 3.38 -1.00 0.11 115.31 117.57 3hk9 h LEU 287 Ca 0.09 0.05 -0.01 0.00 0.09 0.00 0.00 57.88 58.10 3hk9 h LEU 287 Cb 0.12 0.07 -0.04 0.00 0.09 0.00 0.00 40.66 40.90 3hk9 h LEU 287 CO -0.01 0.02 0.44 -0.07 0.09 0.00 0.00 178.44 178.91 3hk9 h LEU 288 N 0.13 0.91 -0.00 1.67 3.38 -1.08 -1.44 115.31 118.89 3hk9 h LEU 288 Ca 0.13 -0.08 -0.02 0.00 0.09 0.00 0.00 57.88 58.00 3hk9 h LEU 288 Cb 0.14 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.66 3hk9 h LEU 288 CO -0.18 0.72 -0.07 -0.09 0.09 0.00 0.00 178.44 178.91 3hk9 h ARG 289 N 1.03 0.06 0.00 1.13 2.43 -0.93 -3.34 114.38 114.76 3hk9 h ARG 289 Ca 0.27 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.38 3hk9 h ARG 289 Cb -0.01 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.56 3hk9 h ARG 289 CO -0.05 0.79 0.00 0.39 -1.51 0.00 0.00 179.97 179.60 3hk9 n GLU 290 N -4.66 0.23 -3.27 0.20 -0.58 0.36 -4.03 120.64 108.89 3hk9 n GLU 290 Ca -0.09 0.29 -0.25 0.00 -0.42 0.00 0.00 57.16 56.69 3hk9 n GLU 290 Cb 0.40 -1.82 -0.07 0.00 -0.57 0.00 0.00 31.44 29.38 3hk9 n GLU 290 CO 0.00 0.00 0.00 0.66 -0.48 0.00 0.00 177.13 177.31 3hk9 n TYR 291 N -2.23 2.26 0.30 -0.32 4.01 -0.54 -4.92 117.16 115.71 3hk9 n TYR 291 Ca 0.04 -3.93 0.15 0.00 -0.16 0.00 0.00 57.90 54.00 3hk9 n TYR 291 Cb 0.34 -0.48 0.71 0.00 -0.31 0.00 0.00 39.34 39.60 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 3.86 0.00 -0.07 -0.72 0.13 -1.70 -2.12 132.00 131.37 3hk9 h PRO 292 Ca 0.14 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.27 3hk9 h PRO 292 Cb 0.73 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.86 3hk9 h PRO 292 CO 0.70 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.56 3hk9 n ASN 293 N -2.60 2.17 -4.80 1.44 4.13 -1.26 -4.88 115.26 109.48 3hk9 n ASN 293 Ca -0.00 -1.73 -0.29 0.00 1.68 0.00 0.00 54.58 54.24 3hk9 n ASN 293 Cb 0.16 -0.04 -0.06 0.00 -1.54 0.00 0.00 39.78 38.31 3hk9 n ASN 293 CO 0.00 0.00 0.00 0.20 0.28 0.00 0.00 177.26 177.74 3hk9 s ASN 294 N -1.90 5.60 -0.12 6.41 -0.87 -0.80 -4.80 114.94 118.46 3hk9 s ASN 294 Ca 0.34 -0.03 -0.02 0.00 -1.57 0.00 0.00 52.86 51.58 3hk9 s ASN 294 Cb 0.20 -1.51 -0.03 0.00 -0.02 0.00 0.00 41.25 39.90 3hk9 s ASN 294 CO 0.31 0.13 -0.05 -0.54 -2.57 0.00 0.00 177.10 174.38 3hk9 s LYS 295 N -2.69 3.32 -0.06 -0.60 1.02 -1.26 -4.84 119.74 114.63 3hk9 s LYS 295 Ca 0.30 -0.53 0.05 0.00 0.02 0.00 0.00 55.97 55.81 3hk9 s LYS 295 Cb -0.11 -2.78 -0.01 0.00 -0.52 0.00 0.00 37.83 34.41 3hk9 s LYS 295 CO 0.23 0.40 -0.21 -0.06 -0.92 0.00 0.00 175.35 174.79 3hk9 s PHE 296 N -0.09 2.15 -0.21 3.18 0.08 -0.09 -0.06 117.98 122.94 3hk9 s PHE 296 Ca 0.01 -0.68 -0.05 0.00 0.12 0.00 0.00 56.93 56.34 3hk9 s PHE 296 Cb -0.13 -1.43 -0.02 0.00 -0.57 0.00 0.00 43.02 40.87 3hk9 s PHE 296 CO 0.03 -0.23 -0.01 -0.51 -0.10 0.00 0.00 175.22 174.39 3hk9 s LEU 297 N 0.02 3.13 -0.00 -0.37 1.43 -0.50 -0.65 118.68 121.74 3hk9 s LEU 297 Ca -0.06 -0.27 0.03 0.00 -1.03 0.00 0.00 54.13 52.80 3hk9 s LEU 297 Cb -0.14 -1.80 -0.01 0.00 0.03 0.00 0.00 46.19 44.28 3hk9 s LEU 297 CO 0.04 0.03 -0.10 -0.69 0.23 0.00 0.00 176.35 175.86 3hk9 s VAL 298 N 1.19 0.82 -0.04 -1.59 1.01 -0.35 -0.29 120.40 121.15 3hk9 s VAL 298 Ca 0.03 -0.50 -0.04 0.00 0.00 0.00 0.00 61.98 61.47 3hk9 s VAL 298 Cb -0.15 -0.69 0.01 0.00 0.00 0.00 0.00 36.38 35.55 3hk9 s VAL 298 CO 0.01 0.19 0.10 0.28 0.00 0.00 0.00 175.10 175.68 3hk9 s THR 299 N -0.32 0.01 0.15 3.92 -1.32 -1.05 -1.73 115.64 115.29 3hk9 s THR 299 Ca 0.03 -0.05 0.10 0.00 -1.21 0.00 0.00 61.69 60.57 3hk9 s THR 299 Cb -0.04 -0.17 -0.04 0.00 -1.51 0.00 0.00 72.50 70.74 3hk9 s THR 299 CO -0.00 -0.03 -0.23 -0.04 -2.21 0.00 0.00 174.62 172.11 3hk9 s MET 300 N -0.04 1.37 0.01 7.08 -1.94 -1.26 -1.97 119.30 122.55 3hk9 s MET 300 Ca -0.01 -1.38 0.05 0.00 -1.71 0.00 0.00 55.69 52.64 3hk9 s MET 300 Cb -0.01 -1.69 -0.24 0.00 2.01 0.00 0.00 34.83 34.89 3hk9 s MET 300 CO 0.00 0.38 0.87 1.25 -0.01 0.00 0.00 175.02 177.52 3hk9 h LEU 301 N 3.58 0.14 -9.58 -0.03 5.85 -0.85 -3.42 115.31 111.01 3hk9 h LEU 301 Ca -0.47 -0.22 -0.52 0.00 0.84 0.00 0.00 57.88 57.51 3hk9 h LEU 301 Cb 1.19 -0.05 -0.02 0.00 0.37 0.00 0.00 40.66 42.16 3hk9 h LEU 301 CO 0.44 1.18 0.38 -0.55 -0.34 0.00 0.00 178.44 179.55 3hk9 s SER 302 N -6.58 7.46 0.37 1.25 0.15 -1.26 -4.55 113.70 110.53 3hk9 s SER 302 Ca -0.05 1.84 0.04 0.00 0.70 0.00 0.00 55.95 58.47 3hk9 s SER 302 Cb 0.08 -2.59 0.69 0.00 -1.71 0.00 0.00 66.02 62.49 3hk9 s SER 302 CO 0.83 -0.09 2.02 -0.09 1.20 0.00 0.00 173.24 177.11 3hk9 h ARG 303 N 5.54 0.75 0.00 5.44 2.43 -1.95 -2.11 114.38 124.47 3hk9 h ARG 303 Ca -0.43 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 58.69 3hk9 h ARG 303 Cb 1.21 -0.17 0.00 0.00 -0.42 0.00 0.00 29.97 30.59 3hk9 h ARG 303 CO 0.72 0.50 0.00 0.39 -1.51 0.00 0.00 179.97 180.07 3hk9 n GLU 304 N -4.44 0.02 0.02 0.20 4.71 -1.26 -2.56 120.64 117.33 3hk9 n GLU 304 Ca 0.05 0.23 0.11 0.00 -0.01 0.00 0.00 57.16 57.54 3hk9 n GLU 304 Cb 0.05 -1.50 -0.08 0.00 -1.01 0.00 0.00 31.44 28.90 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 -1.48 0.44 -0.10 1.62 5.03 -0.80 -4.65 115.26 115.31 3hk9 n ASN 305 Ca 0.04 -0.13 -0.05 0.00 0.87 0.00 0.00 54.58 55.30 3hk9 n ASN 305 Cb 0.17 1.28 0.02 0.00 -1.02 0.00 0.00 39.78 40.23 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 0.14 -0.24 3.52 1.08 -1.52 -1.96 115.11 116.12 3hk9 h GLN 306 Ca 0.00 -0.01 -0.06 0.00 -1.45 0.00 0.00 58.65 57.13 3hk9 h GLN 306 Cb 0.86 -0.03 -0.01 0.00 -0.05 0.00 0.00 27.48 28.25 3hk9 h GLN 306 CO 0.00 0.09 -0.09 1.25 -0.95 0.00 0.00 178.83 179.14 3hk9 h HIS 307 N 0.15 0.55 0.00 2.96 2.76 -1.83 -2.63 115.15 117.12 3hk9 h HIS 307 Ca 0.17 -0.13 -0.03 0.00 -2.20 0.00 0.00 60.37 58.18 3hk9 h HIS 307 Cb 0.22 -0.13 -0.00 0.00 1.55 0.00 0.00 27.41 29.04 3hk9 h HIS 307 CO -0.22 0.73 -0.15 1.05 -1.30 0.00 0.00 177.93 178.04 3hk9 h GLU 308 N 0.22 0.00 -0.31 5.26 4.11 -1.84 -1.65 114.58 120.37 3hk9 h GLU 308 Ca 0.06 0.00 -0.16 0.00 0.07 0.00 0.00 59.36 59.33 3hk9 h GLU 308 Cb 0.57 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.82 3hk9 h GLU 308 CO 0.03 0.15 -0.43 1.25 0.07 0.00 0.00 179.01 180.08 3hk9 h LEU 309 N 0.00 0.85 -0.57 3.06 5.85 -1.19 -0.56 115.31 122.74 3hk9 h LEU 309 Ca -0.00 -0.40 -0.06 0.00 0.84 0.00 0.00 57.88 58.25 3hk9 h LEU 309 Cb 0.50 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 41.26 3hk9 h LEU 309 CO 0.02 1.16 0.11 0.58 -0.34 0.00 0.00 178.44 179.97 3hk9 h VAL 310 N 0.63 1.25 -0.35 1.05 2.07 -0.96 -1.95 116.25 118.00 3hk9 h VAL 310 Ca 0.04 -0.94 -0.07 0.00 0.82 0.00 0.00 66.70 66.55 3hk9 h VAL 310 Cb 1.00 0.76 -0.02 0.00 -1.52 0.00 0.00 31.29 31.51 3hk9 h VAL 310 CO 0.10 0.35 -0.10 0.58 0.02 0.00 0.00 177.57 178.52 3hk9 h VAL 311 N 0.84 1.23 -0.16 2.57 2.07 -1.13 -1.87 116.25 119.80 3hk9 h VAL 311 Ca 0.18 -1.03 -0.06 0.00 0.82 0.00 0.00 66.70 66.61 3hk9 h VAL 311 Cb 0.39 1.08 -0.01 0.00 -1.52 0.00 0.00 31.29 31.22 3hk9 h VAL 311 CO 0.01 0.34 -0.17 0.25 0.02 0.00 0.00 177.57 178.02 3hk9 h LEU 312 N 0.54 0.24 -1.04 2.57 5.85 -0.72 -1.49 115.31 121.27 3hk9 h LEU 312 Ca 0.10 -0.06 -0.10 0.00 0.84 0.00 0.00 57.88 58.66 3hk9 h LEU 312 Cb 0.49 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.44 3hk9 h LEU 312 CO 0.03 0.43 -0.47 0.00 -0.34 0.00 0.00 178.44 178.09 3hk9 h ALA 313 N 1.59 1.21 0.00 1.25 0.00 -0.59 -1.99 119.26 120.73 3hk9 h ALA 313 Ca 0.05 -0.43 -0.06 0.00 0.00 0.00 0.00 54.91 54.46 3hk9 h ALA 313 Cb 0.44 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 3hk9 h ALA 313 CO 0.03 0.60 -0.30 0.00 0.00 0.00 0.00 179.25 179.57 3hk9 h ARG 314 N 0.01 0.00 0.18 0.00 3.08 -0.79 -3.15 114.38 113.72 3hk9 h ARG 314 Ca -0.00 0.00 -0.31 0.00 0.07 0.00 0.00 59.98 59.74 3hk9 h ARG 314 Cb 0.84 0.00 0.02 0.00 0.08 0.00 0.00 29.97 30.91 3hk9 h ARG 314 CO 0.06 0.30 -1.40 0.87 -1.07 0.00 0.00 179.97 178.73 3hk9 h LYS 315 N 0.00 0.39 -4.61 0.04 1.79 -1.10 -3.46 116.57 109.62 3hk9 h LYS 315 Ca -0.00 -0.66 -0.57 0.00 -2.18 0.00 0.00 60.65 57.23 3hk9 h LYS 315 Cb 0.58 0.25 -0.35 0.00 -1.58 0.00 0.00 32.23 31.12 3hk9 h LYS 315 CO 0.04 1.31 -0.83 -0.06 -1.08 0.00 0.00 179.45 178.83 3hk9 s PHE 316 N -2.63 1.88 -0.47 -1.35 0.08 -0.89 -5.00 117.98 109.60 3hk9 s PHE 316 Ca -0.07 -0.92 0.26 0.00 0.12 0.00 0.00 56.93 56.32 3hk9 s PHE 316 Cb 0.06 -1.39 0.85 0.00 -0.57 0.00 0.00 43.02 41.97 3hk9 s PHE 316 CO 0.91 -0.51 1.76 0.66 -0.10 0.00 0.00 175.22 177.94 3hk9 h SER 317 N 7.65 0.00 -0.18 1.36 4.64 -1.90 -2.70 113.55 122.42 3hk9 h SER 317 Ca -0.32 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.00 3hk9 h SER 317 Cb 1.16 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.25 3hk9 h SER 317 CO 0.48 0.00 0.00 -0.46 -0.87 0.00 0.00 176.83 175.98 3hk9 n ASN 318 N -2.56 0.98 -4.35 4.97 6.94 -1.26 -4.71 115.26 115.27 3hk9 n ASN 318 Ca 0.04 -1.98 -0.34 0.00 -0.02 0.00 0.00 54.58 52.27 3hk9 n ASN 318 Cb 0.38 -0.12 -0.14 0.00 -2.36 0.00 0.00 39.78 37.54 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 -1.02 2.86 -0.21 -4.53 2.96 -1.02 -0.92 118.68 116.80 3hk9 s LEU 319 Ca 0.13 -0.34 0.01 0.00 -0.22 0.00 0.00 54.13 53.71 3hk9 s LEU 319 Cb 0.07 -1.69 0.04 0.00 0.50 0.00 0.00 46.19 45.10 3hk9 s LEU 319 CO 0.09 0.07 -0.14 -0.32 -1.32 0.00 0.00 176.35 174.73 3hk9 s MET 320 N 0.92 2.40 0.12 1.98 -2.45 0.18 -4.93 119.30 117.51 3hk9 s MET 320 Ca -0.01 -0.95 -0.10 0.00 -1.25 0.00 0.00 55.69 53.37 3hk9 s MET 320 Cb -0.15 -2.57 -0.06 0.00 1.25 0.00 0.00 34.83 33.30 3hk9 s MET 320 CO 0.00 -0.38 0.45 0.96 1.05 0.00 0.00 175.02 177.10 3hk9 s ILE 321 N 1.29 5.03 0.03 10.11 -4.36 -1.26 -1.21 121.20 130.83 3hk9 s ILE 321 Ca -0.01 0.50 -0.07 0.00 -0.26 0.00 0.00 60.65 60.81 3hk9 s ILE 321 Cb -0.16 -3.66 -0.00 0.00 1.25 0.00 0.00 42.46 39.88 3hk9 s ILE 321 CO -0.09 0.21 0.13 0.72 0.24 0.00 0.00 174.94 176.15 3hk9 s PHE 322 N -1.49 0.13 0.26 1.37 -0.12 -0.71 -2.11 117.98 115.32 3hk9 s PHE 322 Ca 0.37 -0.38 0.00 0.00 -0.05 0.00 0.00 56.93 56.87 3hk9 s PHE 322 Cb -0.14 -0.10 0.00 0.00 -0.63 0.00 0.00 43.02 42.16 3hk9 s PHE 322 CO 0.19 -0.37 0.00 0.41 -0.05 0.00 0.00 175.22 175.40 3hk9 n GLY 323 N 0.86 -1.39 2.99 1.99 0.00 -0.34 -4.44 105.19 104.87 3hk9 n GLY 323 Ca -0.20 -0.60 -0.32 0.00 0.00 0.00 0.00 46.02 44.91 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 -0.16 3.14 0.00 0.00 -0.00 -1.26 -3.03 118.94 117.63 3hk9 s TRP 325 Ca 0.17 1.13 0.00 0.00 -0.00 0.00 0.00 56.10 57.39 3hk9 s TRP 325 Cb -0.24 -3.48 0.00 0.00 -0.00 0.00 0.00 33.47 29.75 3hk9 s TRP 325 CO -0.01 -1.59 0.00 1.87 -0.00 0.00 0.00 176.95 177.22 3hk9 n TRP 326 N 5.07 0.00 1.03 5.86 -0.00 -1.26 -0.44 117.44 127.70 3hk9 n TRP 326 Ca 0.11 0.00 0.11 0.00 -0.00 0.00 0.00 57.50 57.72 3hk9 n TRP 326 Cb 0.46 0.00 0.55 0.00 -0.00 0.00 0.00 31.31 32.31 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 0.39 5.87 3.72 -1.26 -1.84 117.46 124.34 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 -0.28 -0.03 0.00 -0.94 0.00 0.00 39.48 38.23 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 -1.28 0.41 -1.03 -1.08 2.81 0.42 -4.58 117.12 112.79 3hk9 n MET 328 Ca 0.10 -0.02 -0.15 0.00 -1.81 0.00 0.00 57.70 55.82 3hk9 n MET 328 Cb 0.17 -1.61 -0.15 0.00 -0.71 0.00 0.00 33.22 30.92 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 -2.12 5.64 -4.11 7.83 5.15 -0.76 -3.57 115.26 123.31 3hk9 n ASN 329 Ca 0.00 -2.48 -0.23 0.00 -0.60 0.00 0.00 54.58 51.27 3hk9 n ASN 329 Cb 0.48 -1.42 -0.15 0.00 -0.53 0.00 0.00 39.78 38.16 3hk9 n ASN 329 CO 0.00 0.00 0.00 0.20 1.40 0.00 0.00 177.26 178.86 3hk9 s ASN 330 N 2.04 1.75 0.21 1.20 0.01 -1.26 -4.99 114.94 113.90 3hk9 s ASN 330 Ca 0.66 -0.27 -0.10 0.00 -0.71 0.00 0.00 52.86 52.44 3hk9 s ASN 330 Cb 0.30 -0.30 0.29 0.00 0.41 0.00 0.00 41.25 41.94 3hk9 s ASN 330 CO -0.01 0.16 1.27 -2.65 -1.51 0.00 0.00 177.10 174.36 3hk9 n PRO 331 N 2.90 -0.13 -0.31 -0.60 -0.02 -1.26 -0.24 135.00 135.34 3hk9 n PRO 331 Ca -0.16 1.26 -0.00 0.00 -2.02 0.00 0.00 63.50 62.58 3hk9 n PRO 331 Cb 0.54 -1.88 0.18 0.00 -0.02 0.00 0.00 33.50 32.33 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 1.15 0.12 -0.52 4.57 -1.97 -0.53 114.58 117.39 3hk9 h GLU 332 Ca 0.34 -0.07 -0.19 0.00 -1.18 0.00 0.00 59.36 58.26 3hk9 h GLU 332 Cb 0.54 -0.26 0.02 0.00 -0.16 0.00 0.00 28.75 28.89 3hk9 h GLU 332 CO -0.82 0.76 -0.80 0.82 -1.18 0.00 0.00 179.01 177.78 3hk9 h ILE 333 N 1.18 1.49 -0.69 2.32 1.08 -0.86 -2.98 117.51 119.05 3hk9 h ILE 333 Ca 0.34 -2.45 0.07 0.00 -0.39 0.00 0.00 64.86 62.43 3hk9 h ILE 333 Cb -0.08 3.07 -0.06 0.00 -3.07 0.00 0.00 36.82 36.68 3hk9 h ILE 333 CO -0.08 0.70 0.37 0.40 -0.69 0.00 0.00 178.15 178.84 3hk9 h ILE 334 N -0.29 0.91 0.34 -0.67 2.04 -0.53 -0.04 117.51 119.27 3hk9 h ILE 334 Ca -0.13 -0.23 -0.02 0.00 1.00 0.00 0.00 64.86 65.48 3hk9 h ILE 334 Cb 1.60 0.20 0.00 0.00 -0.74 0.00 0.00 36.82 37.88 3hk9 h ILE 334 CO 0.15 0.12 -0.16 -1.13 0.00 0.00 0.00 178.15 177.13 3hk9 h ASN 335 N 0.66 -0.38 -0.30 1.72 -1.24 -1.17 -0.85 115.58 114.01 3hk9 h ASN 335 Ca 0.33 -0.00 -0.08 0.00 0.71 0.00 0.00 56.30 57.25 3hk9 h ASN 335 Cb 0.27 0.10 -0.02 0.00 0.73 0.00 0.00 38.32 39.40 3hk9 h ASN 335 CO -0.22 -0.26 -0.07 1.05 -1.29 0.00 0.00 177.43 176.64 3hk9 h GLU 336 N -0.48 0.69 -0.07 6.67 4.11 -1.33 -2.23 114.58 121.95 3hk9 h GLU 336 Ca -0.05 -0.20 -0.01 0.00 0.07 0.00 0.00 59.36 59.17 3hk9 h GLU 336 Cb 0.36 -0.07 -0.00 0.00 0.50 0.00 0.00 28.75 29.54 3hk9 h GLU 336 CO 0.08 0.76 0.01 0.52 0.07 0.00 0.00 179.01 180.45 3hk9 h MET 337 N 0.64 0.12 -0.75 1.06 2.86 -0.91 -1.76 114.93 116.18 3hk9 h MET 337 Ca 0.12 -0.03 -0.02 0.00 -2.06 0.00 0.00 59.70 57.70 3hk9 h MET 337 Cb 0.51 -0.01 -0.04 0.00 0.06 0.00 0.00 31.60 32.12 3hk9 h MET 337 CO 0.03 0.36 0.38 1.15 1.06 0.00 0.00 176.91 179.89 3hk9 h THR 338 N -0.14 1.23 -0.29 2.22 2.02 -1.10 -0.84 112.91 116.02 3hk9 h THR 338 Ca 0.02 -0.62 -0.12 0.00 0.77 0.00 0.00 66.41 66.46 3hk9 h THR 338 Cb 0.30 0.24 -0.00 0.00 -1.74 0.00 0.00 68.15 66.95 3hk9 h THR 338 CO 0.00 0.27 -0.30 0.03 0.37 0.00 0.00 175.52 175.89 3hk9 h ARG 339 N 1.06 0.72 -0.66 6.66 3.08 -1.35 -0.80 114.38 123.09 3hk9 h ARG 339 Ca 0.26 -0.38 -0.03 0.00 0.07 0.00 0.00 59.98 59.90 3hk9 h ARG 339 Cb 0.07 0.02 -0.03 0.00 0.08 0.00 0.00 29.97 30.11 3hk9 h ARG 339 CO -0.04 1.00 0.29 0.52 -1.07 0.00 0.00 179.97 180.68 3hk9 h MET 340 N 0.46 0.96 -0.28 0.04 2.86 -1.10 -0.97 114.93 116.90 3hk9 h MET 340 Ca 0.04 -0.16 -0.02 0.00 -2.06 0.00 0.00 59.70 57.50 3hk9 h MET 340 Cb 0.88 -0.16 -0.01 0.00 0.06 0.00 0.00 31.60 32.36 3hk9 h MET 340 CO 0.07 0.78 0.08 0.00 1.06 0.00 0.00 176.91 178.91 3hk9 h ARG 341 N 0.91 0.45 -0.13 1.72 3.08 -1.09 -2.32 114.38 117.01 3hk9 h ARG 341 Ca 0.22 -0.10 -0.14 0.00 0.07 0.00 0.00 59.98 60.04 3hk9 h ARG 341 Cb 0.16 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.14 3hk9 h ARG 341 CO -0.02 0.51 -0.51 1.98 -1.07 0.00 0.00 179.97 180.86 3hk9 h MET 342 N 0.29 0.36 -0.28 0.04 4.05 -1.04 0.14 114.93 118.49 3hk9 h MET 342 Ca 0.09 -0.21 -0.09 0.00 -0.28 0.00 0.00 59.70 59.22 3hk9 h MET 342 Cb 0.26 0.02 -0.01 0.00 -0.80 0.00 0.00 31.60 31.06 3hk9 h MET 342 CO -0.00 0.78 -0.19 0.93 0.23 0.00 0.00 176.91 178.66 3hk9 h GLU 343 N 0.28 0.51 0.00 0.39 5.08 -1.07 0.14 114.58 119.92 3hk9 h GLU 343 Ca 0.01 -0.17 0.00 0.00 -1.00 0.00 0.00 59.36 58.20 3hk9 h GLU 343 Cb 1.00 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 30.21 3hk9 h GLU 343 CO 0.09 0.68 -1.46 -1.33 -1.00 0.00 0.00 179.01 175.99 3hk9 n MET 344 N -4.16 0.48 0.00 2.33 2.81 -0.88 -4.59 117.12 113.11 3hk9 n MET 344 Ca 0.00 -0.10 0.00 0.00 -1.81 0.00 0.00 57.70 55.79 3hk9 n MET 344 Cb 0.37 -1.47 0.00 0.00 -0.71 0.00 0.00 33.22 31.41 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 -1.86 0.94 0.00 4.03 4.77 0.48 -4.90 117.00 120.48 3hk9 n LEU 345 Ca -0.00 -0.94 0.00 0.00 -0.03 0.00 0.00 56.01 55.03 3hk9 n LEU 345 Cb 0.43 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.52 3hk9 n LEU 345 CO 0.42 0.24 0.00 0.61 -1.33 0.00 0.00 177.39 177.33 3hk9 n GLY 346 N -0.13 4.01 1.01 -0.72 0.00 0.04 -1.39 105.19 108.01 3hk9 n GLY 346 Ca 0.00 0.07 0.08 0.00 0.00 0.00 0.00 46.02 46.16 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 1.86 -1.54 2.61 -2.24 -1.26 -4.30 114.28 109.40 3hk9 n THR 347 Ca 0.00 -1.47 -0.31 0.00 -2.27 0.00 0.00 64.05 60.00 3hk9 n THR 347 Cb 0.00 0.04 -0.05 0.00 -2.10 0.00 0.00 70.33 68.21 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 0.16 7.23 -3.84 3.42 3.41 -0.48 -4.73 113.62 118.78 3hk9 n SER 348 Ca 0.20 -2.93 -0.08 0.00 -0.26 0.00 0.00 58.87 55.79 3hk9 n SER 348 Cb 0.77 -1.37 -0.03 0.00 -0.26 0.00 0.00 64.21 63.33 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 -0.30 -0.13 -0.38 7.33 -0.12 -1.26 -4.84 117.98 118.28 3hk9 s PHE 349 Ca 0.61 -0.29 -0.06 0.00 -0.05 0.00 0.00 56.93 57.14 3hk9 s PHE 349 Cb 0.27 0.60 0.08 0.00 -0.63 0.00 0.00 43.02 43.34 3hk9 s PHE 349 CO -0.11 -1.16 0.17 0.42 -0.05 0.00 0.00 175.22 174.50 3hk9 s ILE 350 N -3.92 3.66 0.30 -4.49 1.01 -0.90 -4.68 121.20 112.19 3hk9 s ILE 350 Ca 0.12 -1.55 -0.01 0.00 0.00 0.00 0.00 60.65 59.21 3hk9 s ILE 350 Cb -0.05 -3.26 0.22 0.00 0.01 0.00 0.00 42.46 39.38 3hk9 s ILE 350 CO 0.05 -0.44 1.92 1.55 0.00 0.00 0.00 174.94 178.03 3hk9 h PRO 351 N 8.20 0.92 -3.54 2.79 0.13 -1.85 -0.88 132.00 137.77 3hk9 h PRO 351 Ca -0.20 -0.10 -0.06 0.00 -0.87 0.00 0.00 66.00 64.77 3hk9 h PRO 351 Cb 1.07 -0.18 -0.11 0.00 0.13 0.00 0.00 31.00 31.90 3hk9 h PRO 351 CO 0.68 0.69 -0.12 -1.14 -0.23 0.00 0.00 178.00 177.87 3hk9 s GLN 352 N -5.59 1.25 0.03 0.86 2.00 -1.26 -3.28 119.66 113.66 3hk9 s GLN 352 Ca -0.10 -0.96 -0.13 0.00 -2.00 0.00 0.00 55.36 52.16 3hk9 s GLN 352 Cb 0.17 0.46 0.02 0.00 0.80 0.00 0.00 33.01 34.45 3hk9 s GLN 352 CO 0.79 -0.50 0.28 -3.38 -0.50 0.00 0.00 175.29 171.98 3hk9 s HIS 353 N -3.90 -0.09 -0.00 1.67 -3.43 -1.26 -4.60 115.29 103.67 3hk9 s HIS 353 Ca 0.11 -0.01 -0.05 0.00 -0.80 0.00 0.00 55.06 54.31 3hk9 s HIS 353 Cb 0.01 0.07 -0.29 0.00 -1.43 0.00 0.00 32.58 30.94 3hk9 s HIS 353 CO -0.03 -0.46 0.83 0.66 -2.00 0.00 0.00 174.74 173.74 3hk9 h SER 354 N 3.43 0.46 -1.15 7.38 4.64 -1.93 -3.44 113.55 122.94 3hk9 h SER 354 Ca -0.31 -0.63 -0.31 0.00 -0.47 0.00 0.00 61.79 60.07 3hk9 h SER 354 Cb 1.19 -0.15 -0.09 0.00 -0.31 0.00 0.00 62.40 63.04 3hk9 h SER 354 CO 0.45 1.53 -0.31 -0.67 -0.87 0.00 0.00 176.83 176.95 3hk9 n ASP 355 N -3.49 -4.74 -4.71 4.97 -0.08 -0.14 -4.90 116.55 103.45 3hk9 n ASP 355 Ca -0.18 0.26 -0.43 0.00 -1.51 0.00 0.00 54.79 52.93 3hk9 n ASP 355 Cb 1.05 -3.67 -0.02 0.00 2.34 0.00 0.00 41.12 40.82 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 0.37 1.82 0.03 -1.67 0.00 -1.26 -4.40 120.51 115.39 3hk9 n ALA 356 Ca -0.16 0.39 0.06 0.00 0.00 0.00 0.00 53.44 53.73 3hk9 n ALA 356 Cb 0.54 -2.37 -0.09 0.00 0.00 0.00 0.00 19.45 17.54 3hk9 n ALA 356 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3hk9 n ARG 357 N 2.09 0.53 -4.34 0.00 1.74 -1.26 0.12 116.66 115.54 3hk9 n ARG 357 Ca 0.10 -0.10 -0.28 0.00 -0.77 0.00 0.00 57.85 56.80 3hk9 n ARG 357 Cb 0.34 -1.25 -0.17 0.00 -1.02 0.00 0.00 32.46 30.36 3hk9 n ARG 357 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 3hk9 s VAL 358 N -2.74 1.41 0.14 1.55 1.01 -1.26 -4.36 120.40 116.15 3hk9 s VAL 358 Ca -0.04 -0.58 -0.19 0.00 0.00 0.00 0.00 61.98 61.18 3hk9 s VAL 358 Cb 0.07 -1.31 0.04 0.00 0.00 0.00 0.00 36.38 35.19 3hk9 s VAL 358 CO 0.47 0.43 1.15 -0.11 0.00 0.00 0.00 175.10 177.03 3hk9 n LEU 359 N 4.34 -0.66 0.24 3.92 7.94 -0.28 -0.72 117.00 131.77 3hk9 n LEU 359 Ca -0.18 1.31 0.18 0.00 -1.11 0.00 0.00 56.01 56.21 3hk9 n LEU 359 Cb 0.51 -0.22 0.87 0.00 0.53 0.00 0.00 43.42 45.11 3hk9 n LEU 359 CO 0.23 -1.11 1.15 -0.33 -1.11 0.00 0.00 177.39 176.22 3hk9 h GLU 360 N 0.00 0.00 0.00 1.96 3.07 -1.94 -2.31 114.58 115.35 3hk9 h GLU 360 Ca 0.18 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.04 3hk9 h GLU 360 Cb 0.36 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.27 3hk9 h GLU 360 CO -0.71 0.00 0.00 1.96 -1.40 0.00 0.00 179.01 178.86 3hk9 h GLN 361 N 0.00 0.00 -0.29 2.33 4.20 -1.33 -1.18 115.11 118.83 3hk9 h GLN 361 Ca 0.07 0.00 0.01 0.00 0.06 0.00 0.00 58.65 58.79 3hk9 h GLN 361 Cb 0.56 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.33 3hk9 h GLN 361 CO -0.00 0.00 0.20 -0.07 -0.67 0.00 0.00 178.83 178.28 3hk9 h LEU 362 N 0.00 0.32 0.71 1.46 3.38 -1.59 0.10 115.31 119.69 3hk9 h LEU 362 Ca 0.00 -0.01 -0.03 0.00 0.09 0.00 0.00 57.88 57.93 3hk9 h LEU 362 Cb 0.09 -0.08 0.01 0.00 0.09 0.00 0.00 40.66 40.77 3hk9 h LEU 362 CO 0.00 0.23 -0.34 0.40 0.09 0.00 0.00 178.44 178.82 3hk9 h ILE 363 N 0.37 0.21 -0.13 1.22 2.04 -1.45 -2.77 117.51 117.01 3hk9 h ILE 363 Ca 0.11 -0.17 -0.15 0.00 1.00 0.00 0.00 64.86 65.65 3hk9 h ILE 363 Cb -0.01 0.25 0.01 0.00 -0.74 0.00 0.00 36.82 36.33 3hk9 h ILE 363 CO -0.02 0.02 -0.51 0.10 0.00 0.00 0.00 178.15 177.74 3hk9 h TYR 364 N -1.09 0.76 -0.47 1.37 -0.00 -1.64 -1.07 116.97 114.83 3hk9 h TYR 364 Ca -0.10 -0.32 0.09 0.00 0.00 0.00 0.00 58.73 58.40 3hk9 h TYR 364 Cb 0.76 -0.12 -0.07 0.00 0.00 0.00 0.00 36.73 37.29 3hk9 h TYR 364 CO -0.01 1.10 0.05 0.87 -0.00 0.00 0.00 178.16 180.17 3hk9 h LYS 365 N 0.20 0.16 0.00 0.10 1.79 -0.91 0.11 116.57 118.03 3hk9 h LYS 365 Ca -0.03 -0.01 -0.19 0.00 -2.18 0.00 0.00 60.65 58.24 3hk9 h LYS 365 Cb 1.14 -0.04 -0.01 0.00 -1.58 0.00 0.00 32.23 31.74 3hk9 h LYS 365 CO 0.11 0.11 -0.87 -1.49 -1.08 0.00 0.00 179.45 176.23 3hk9 h TRP 366 N 0.17 0.23 0.48 -1.35 4.06 -1.54 -2.55 115.95 115.45 3hk9 h TRP 366 Ca 0.24 -0.13 -0.02 0.00 2.06 0.00 0.00 58.89 61.04 3hk9 h TRP 366 Cb 0.33 -0.03 0.00 0.00 -1.00 0.00 0.00 29.16 28.47 3hk9 h TRP 366 CO -0.26 0.94 -0.23 1.25 -3.56 0.00 0.00 178.44 176.58 3hk9 h HIS 367 N 0.08 -0.60 -0.93 0.49 2.76 -0.52 0.43 115.15 116.87 3hk9 h HIS 367 Ca -0.04 -0.01 0.05 0.00 -2.20 0.00 0.00 60.37 58.17 3hk9 h HIS 367 Cb 1.49 0.20 -0.06 0.00 1.55 0.00 0.00 27.41 30.59 3hk9 h HIS 367 CO 0.02 -0.27 0.61 0.45 -1.30 0.00 0.00 177.93 177.44 3hk9 h HIS 368 N -0.93 1.11 -0.01 5.26 3.86 -0.90 -2.69 115.15 120.85 3hk9 h HIS 368 Ca -0.07 0.03 -0.25 0.00 -1.16 0.00 0.00 60.37 58.92 3hk9 h HIS 368 Cb 0.59 -0.37 0.01 0.00 1.06 0.00 0.00 27.41 28.71 3hk9 h HIS 368 CO 0.01 0.61 -0.98 0.77 0.86 0.00 0.00 177.93 179.19 3hk9 h SER 369 N 1.12 0.78 -0.34 2.45 0.02 -1.45 -3.20 113.55 112.93 3hk9 h SER 369 Ca 0.39 -0.61 -0.07 0.00 -0.84 0.00 0.00 61.79 60.66 3hk9 h SER 369 Cb 0.11 -0.24 -0.02 0.00 0.14 0.00 0.00 62.40 62.39 3hk9 h SER 369 CO -0.13 1.41 -0.01 0.11 -1.14 0.00 0.00 176.83 177.07 3hk9 h LYS 370 N 0.35 0.71 -0.24 3.45 1.57 -0.75 -0.72 116.57 120.94 3hk9 h LYS 370 Ca -0.10 -0.19 -0.10 0.00 -1.87 0.00 0.00 60.65 58.39 3hk9 h LYS 370 Cb 1.63 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 33.84 3hk9 h LYS 370 CO 0.19 0.74 -0.29 0.66 -0.57 0.00 0.00 179.45 180.17 3hk9 h SER 371 N 0.67 0.49 -0.07 0.86 4.64 -1.54 0.18 113.55 118.78 3hk9 h SER 371 Ca 0.13 -0.18 -0.04 0.00 -0.47 0.00 0.00 61.79 61.23 3hk9 h SER 371 Cb 0.43 -0.13 -0.00 0.00 -0.31 0.00 0.00 62.40 62.39 3hk9 h SER 371 CO 0.02 0.76 -0.12 0.40 -0.87 0.00 0.00 176.83 177.02 3hk9 h ILE 372 N 0.42 1.40 -0.61 0.95 2.04 -1.49 -2.44 117.51 117.79 3hk9 h ILE 372 Ca 0.06 -1.40 -0.00 0.00 1.00 0.00 0.00 64.86 64.52 3hk9 h ILE 372 Cb 0.72 2.16 -0.03 0.00 -0.74 0.00 0.00 36.82 38.93 3hk9 h ILE 372 CO 0.06 0.39 0.36 0.40 0.00 0.00 0.00 178.15 179.36 3hk9 h ILE 373 N -0.26 1.17 -0.38 -0.67 2.04 -0.98 -2.03 117.51 116.40 3hk9 h ILE 373 Ca 0.00 -0.39 -0.03 0.00 1.00 0.00 0.00 64.86 65.45 3hk9 h ILE 373 Cb 0.69 0.32 -0.02 0.00 -0.74 0.00 0.00 36.82 37.07 3hk9 h ILE 373 CO 0.03 0.18 0.14 0.00 0.00 0.00 0.00 178.15 178.50 3hk9 h ALA 374 N 1.57 0.50 -0.86 1.87 0.00 -0.57 -1.67 119.26 120.08 3hk9 h ALA 374 Ca 0.22 -0.15 0.02 0.00 0.00 0.00 0.00 54.91 55.00 3hk9 h ALA 374 Cb -0.03 -0.15 -0.05 0.00 0.00 0.00 0.00 17.79 17.56 3hk9 h ALA 374 CO -0.04 0.12 0.56 0.93 0.00 0.00 0.00 179.25 180.82 3hk9 h GLU 375 N 0.47 1.09 -0.21 0.00 4.39 -0.88 -0.13 114.58 119.31 3hk9 h GLU 375 Ca 0.13 -0.07 -0.01 0.00 0.34 0.00 0.00 59.36 59.75 3hk9 h GLU 375 Cb 0.21 -0.25 -0.01 0.00 -0.10 0.00 0.00 28.75 28.61 3hk9 h GLU 375 CO -0.01 0.72 0.09 0.28 -1.16 0.00 0.00 179.01 178.93 3hk9 h VAL 376 N 1.12 1.16 -0.96 3.13 2.07 -1.16 -1.98 116.25 119.63 3hk9 h VAL 376 Ca 0.33 -0.47 0.01 0.00 0.82 0.00 0.00 66.70 67.39 3hk9 h VAL 376 Cb -0.06 1.09 -0.05 0.00 -1.52 0.00 0.00 31.29 30.75 3hk9 h VAL 376 CO -0.10 0.15 0.62 -0.07 0.02 0.00 0.00 177.57 178.20 3hk9 h LEU 377 N 0.19 1.11 -0.39 2.57 3.38 -0.85 -0.91 115.31 120.41 3hk9 h LEU 377 Ca 0.07 -0.04 0.01 0.00 0.09 0.00 0.00 57.88 58.01 3hk9 h LEU 377 Cb 0.16 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.61 3hk9 h LEU 377 CO -0.01 0.81 0.25 0.40 0.09 0.00 0.00 178.44 179.99 3hk9 h ILE 378 N 1.30 1.08 0.08 1.22 2.04 -0.80 0.16 117.51 122.59 3hk9 h ILE 378 Ca 0.35 -0.18 -0.00 0.00 1.00 0.00 0.00 64.86 66.03 3hk9 h ILE 378 Cb -0.13 0.53 0.00 0.00 -0.74 0.00 0.00 36.82 36.48 3hk9 h ILE 378 CO -0.07 0.09 -0.04 0.44 0.00 0.00 0.00 178.15 178.57 3hk9 h ASP 379 N 0.51 -0.09 -0.90 1.72 3.32 -0.78 -0.29 116.42 119.90 3hk9 h ASP 379 Ca 0.15 -0.07 0.01 0.00 0.02 0.00 0.00 57.03 57.13 3hk9 h ASP 379 Cb -0.04 0.02 -0.04 0.00 0.22 0.00 0.00 39.33 39.49 3hk9 h ASP 379 CO -0.04 0.02 0.59 0.11 -1.72 0.00 0.00 179.24 178.19 3hk9 h LYS 380 N -0.19 1.20 -0.26 3.56 6.56 -0.89 -0.91 116.57 125.64 3hk9 h LYS 380 Ca -0.01 -0.08 -0.12 0.00 -1.06 0.00 0.00 60.65 59.38 3hk9 h LYS 380 Cb 0.16 -0.27 -0.01 0.00 -0.57 0.00 0.00 32.23 31.54 3hk9 h LYS 380 CO 0.02 0.81 -0.32 1.88 -2.06 0.00 0.00 179.45 179.77 3hk9 h TYR 381 N 1.23 0.64 -0.62 -1.35 0.05 -0.59 -2.88 116.97 113.45 3hk9 h TYR 381 Ca 0.33 -0.16 -0.09 0.00 0.05 0.00 0.00 58.73 58.86 3hk9 h TYR 381 Cb -0.12 -0.15 -0.02 0.00 1.01 0.00 0.00 36.73 37.45 3hk9 h TYR 381 CO -0.01 0.81 0.02 0.22 -1.05 0.00 0.00 178.16 178.16 3hk9 h ASP 382 N 0.48 1.05 -0.72 3.88 3.58 -0.50 -1.01 116.42 123.18 3hk9 h ASP 382 Ca 0.06 -0.29 -0.03 0.00 0.42 0.00 0.00 57.03 57.19 3hk9 h ASP 382 Cb 0.79 -0.28 -0.03 0.00 1.72 0.00 0.00 39.33 41.52 3hk9 h ASP 382 CO 0.06 1.09 0.35 0.44 -2.88 0.00 0.00 179.24 178.30 3hk9 h ASP 383 N 0.99 0.95 1.35 2.28 3.32 -0.99 0.09 116.42 124.41 3hk9 h ASP 383 Ca 0.18 -0.11 -0.12 0.00 0.02 0.00 0.00 57.03 57.00 3hk9 h ASP 383 Cb 0.53 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.82 3hk9 h ASP 383 CO 0.03 0.81 -0.66 0.16 -1.72 0.00 0.00 179.24 177.85 3hk9 h ILE 384 N 1.04 0.88 -0.48 0.35 3.07 -1.32 -2.39 117.51 118.66 3hk9 h ILE 384 Ca 0.25 -2.28 -0.10 0.00 1.55 0.00 0.00 64.86 64.28 3hk9 h ILE 384 Cb 0.11 2.41 -0.02 0.00 -0.27 0.00 0.00 36.82 39.05 3hk9 h ILE 384 CO -0.03 0.50 -0.09 -0.07 -1.05 0.00 0.00 178.15 177.41 3hk9 h LEU 385 N 0.00 0.85 -1.35 0.16 4.07 -0.84 0.33 115.31 118.54 3hk9 h LEU 385 Ca -0.03 -0.26 -0.05 0.00 0.08 0.00 0.00 57.88 57.63 3hk9 h LEU 385 Cb 1.44 -0.23 -0.01 0.00 1.08 0.00 0.00 40.66 42.94 3hk9 h LEU 385 CO 0.07 0.97 -0.10 -0.61 -1.08 0.00 0.00 178.44 177.69 3hk9 h GLN 386 N 0.78 0.32 -0.11 1.13 5.75 -0.85 -1.45 115.11 120.67 3hk9 h GLN 386 Ca 0.13 -0.07 0.00 0.00 -0.15 0.00 0.00 58.65 58.56 3hk9 h GLN 386 Cb 0.60 -0.04 0.00 0.00 1.07 0.00 0.00 27.48 29.10 3hk9 h GLN 386 CO 0.04 0.43 0.00 0.00 -2.65 0.00 0.00 178.83 176.65 3hk9 n ALA 387 N -2.49 2.49 -0.19 3.38 0.00 -0.77 -4.87 120.51 118.06 3hk9 n ALA 387 Ca -0.00 -0.21 0.00 0.00 0.00 0.00 0.00 53.44 53.23 3hk9 n ALA 387 Cb 0.26 -1.01 0.00 0.00 0.00 0.00 0.00 19.45 18.70 3hk9 n ALA 387 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hk9 n GLY 388 N 0.70 0.82 3.77 0.00 0.00 -0.54 -5.05 105.19 104.88 3hk9 n GLY 388 Ca 0.05 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.68 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 -2.53 3.36 -0.67 1.61 -0.11 0.04 -4.98 118.94 115.65 3hk9 s TRP 389 Ca 0.00 1.63 -0.08 0.00 1.22 0.00 0.00 56.10 58.87 3hk9 s TRP 389 Cb 0.00 -3.30 0.18 0.00 -1.50 0.00 0.00 33.47 28.84 3hk9 s TRP 389 CO 0.00 -0.83 0.55 -2.00 -4.62 0.00 0.00 176.95 170.04 3hk9 s GLU 390 N -1.90 2.95 0.15 5.86 2.56 -1.26 -4.08 118.70 122.98 3hk9 s GLU 390 Ca 0.51 -2.36 -0.30 0.00 0.00 0.00 0.00 54.97 52.82 3hk9 s GLU 390 Cb -0.30 -4.04 -0.07 0.00 2.00 0.00 0.00 34.13 31.72 3hk9 s GLU 390 CO 0.38 -1.22 1.07 0.14 -0.56 0.00 0.00 175.26 175.07 3hk9 s VAL 391 N 0.30 4.06 0.16 3.70 -7.23 -1.26 -5.04 120.40 115.09 3hk9 s VAL 391 Ca 0.15 1.72 0.03 0.00 -1.81 0.00 0.00 61.98 62.07 3hk9 s VAL 391 Cb -0.18 -4.10 -0.03 0.00 0.56 0.00 0.00 36.38 32.63 3hk9 s VAL 391 CO -0.05 0.27 0.28 0.42 -0.31 0.00 0.00 175.10 175.71 3hk9 s THR 392 N -0.03 5.24 0.44 5.32 -4.23 -1.26 -4.57 115.64 116.54 3hk9 s THR 392 Ca 0.50 -0.75 0.10 0.00 -1.18 0.00 0.00 61.69 60.35 3hk9 s THR 392 Cb -0.28 -3.71 0.25 0.00 1.34 0.00 0.00 72.50 70.11 3hk9 s THR 392 CO 0.33 -0.11 2.06 -0.08 -0.54 0.00 0.00 174.62 176.28 3hk9 h GLU 393 N 2.08 0.34 -0.20 3.99 4.81 -1.99 -1.62 114.58 121.99 3hk9 h GLU 393 Ca -0.49 -0.03 -0.11 0.00 -0.13 0.00 0.00 59.36 58.60 3hk9 h GLU 393 Cb 1.20 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 30.49 3hk9 h GLU 393 CO 0.67 0.26 -0.37 1.49 -0.73 0.00 0.00 179.01 180.33 3hk9 h GLU 394 N 0.35 0.43 -0.21 1.92 4.57 -1.99 -1.43 114.58 118.22 3hk9 h GLU 394 Ca 0.09 -0.20 -0.16 0.00 -1.18 0.00 0.00 59.36 57.91 3hk9 h GLU 394 Cb 0.02 -0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 28.60 3hk9 h GLU 394 CO -0.01 0.74 -0.52 0.93 -1.18 0.00 0.00 179.01 178.96 3hk9 h GLU 395 N 0.36 0.59 -0.59 1.92 5.08 -1.72 -1.96 114.58 118.26 3hk9 h GLU 395 Ca 0.04 -0.36 -0.03 0.00 -1.00 0.00 0.00 59.36 58.01 3hk9 h GLU 395 Cb 0.82 0.04 -0.03 0.00 0.50 0.00 0.00 28.75 30.08 3hk9 h GLU 395 CO 0.07 0.97 0.27 0.82 -1.00 0.00 0.00 179.01 180.13 3hk9 h ILE 396 N 0.46 1.22 -0.51 3.13 2.04 -1.05 -0.04 117.51 122.75 3hk9 h ILE 396 Ca 0.01 -0.63 -0.07 0.00 1.00 0.00 0.00 64.86 65.18 3hk9 h ILE 396 Cb 1.07 0.54 -0.02 0.00 -0.74 0.00 0.00 36.82 37.66 3hk9 h ILE 396 CO 0.10 0.25 0.05 0.11 0.00 0.00 0.00 178.15 178.66 3hk9 h LYS 397 N 0.81 0.83 0.12 2.37 1.57 -1.12 -1.08 116.57 120.07 3hk9 h LYS 397 Ca 0.20 -0.21 -0.01 0.00 -1.87 0.00 0.00 60.65 58.77 3hk9 h LYS 397 Cb 0.15 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 32.35 3hk9 h LYS 397 CO -0.02 0.81 -0.06 -0.09 -0.57 0.00 0.00 179.45 179.51 3hk9 h ARG 398 N 0.79 -0.16 -0.62 3.15 2.43 -0.84 -0.60 114.38 118.53 3hk9 h ARG 398 Ca 0.16 0.01 0.06 0.00 -0.81 0.00 0.00 59.98 59.40 3hk9 h ARG 398 Cb 0.41 0.04 -0.05 0.00 -0.42 0.00 0.00 29.97 29.94 3hk9 h ARG 398 CO 0.01 0.02 0.33 -0.44 -1.51 0.00 0.00 179.97 178.38 3hk9 h ASP 399 N -0.31 0.48 -0.41 -3.80 3.32 -0.82 -1.17 116.42 113.70 3hk9 h ASP 399 Ca -0.02 0.03 -0.05 0.00 0.02 0.00 0.00 57.03 57.01 3hk9 h ASP 399 Cb 0.25 -0.06 -0.02 0.00 0.22 0.00 0.00 39.33 39.72 3hk9 h ASP 399 CO 0.03 0.31 0.08 0.58 -1.72 0.00 0.00 179.24 178.52 3hk9 h VAL 400 N 0.61 1.22 -0.63 -1.35 2.07 -1.07 -2.09 116.25 115.02 3hk9 h VAL 400 Ca 0.28 -0.81 -0.09 0.00 0.82 0.00 0.00 66.70 66.89 3hk9 h VAL 400 Cb 0.19 0.76 -0.02 0.00 -1.52 0.00 0.00 31.29 30.69 3hk9 h VAL 400 CO -0.18 0.30 0.04 0.00 0.02 0.00 0.00 177.57 177.74 3hk9 h ALA 401 N 1.39 0.88 -0.13 1.67 0.00 -0.13 -1.95 119.26 120.98 3hk9 h ALA 401 Ca 0.15 -0.30 -0.00 0.00 0.00 0.00 0.00 54.91 54.77 3hk9 h ALA 401 Cb 0.31 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 3hk9 h ALA 401 CO 0.00 0.67 0.08 -0.44 0.00 0.00 0.00 179.25 179.56 3hk9 h ASP 402 N 0.99 0.15 -0.28 0.00 3.32 -0.69 0.94 116.42 120.85 3hk9 h ASP 402 Ca 0.18 -0.04 -0.02 0.00 0.02 0.00 0.00 57.03 57.18 3hk9 h ASP 402 Cb 0.51 -0.04 -0.01 0.00 0.22 0.00 0.00 39.33 40.01 3hk9 h ASP 402 CO 0.02 0.14 0.09 -0.07 -1.72 0.00 0.00 179.24 177.71 3hk9 h LEU 403 N 0.15 0.41 -0.04 1.55 3.38 -1.30 0.14 115.31 119.60 3hk9 h LEU 403 Ca 0.05 -0.20 0.00 0.00 0.09 0.00 0.00 57.88 57.82 3hk9 h LEU 403 Cb 0.02 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.66 3hk9 h LEU 403 CO -0.01 0.50 -0.45 0.49 0.09 0.00 0.00 178.44 179.06 3hk9 n PHE 404 N -4.72 0.00 0.20 1.13 3.72 -0.74 -4.29 117.46 112.76 3hk9 n PHE 404 Ca -0.02 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.38 3hk9 n PHE 404 Cb 0.16 -0.25 0.00 0.00 -0.94 0.00 0.00 39.48 38.44 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 -1.43 -3.04 -0.28 4.37 2.88 -0.14 -1.50 113.62 114.48 3hk9 n SER 405 Ca 0.06 0.76 0.05 0.00 -1.33 0.00 0.00 58.87 58.41 3hk9 n SER 405 Cb 0.34 2.90 0.27 0.00 -0.75 0.00 0.00 64.21 66.96 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 0.93 -0.69 -1.46 3.08 -0.92 -2.51 114.38 112.80 3hk9 h ARG 406 Ca 0.00 -0.06 0.01 0.00 0.07 0.00 0.00 59.98 60.01 3hk9 h ARG 406 Cb 0.00 -0.21 -0.04 0.00 0.08 0.00 0.00 29.97 29.81 3hk9 h ARG 406 CO 0.00 0.61 0.46 -0.91 -1.07 0.00 0.00 179.97 179.06 3hk9 h ASN 407 N 0.95 0.78 0.07 7.04 2.35 -0.92 -0.01 115.58 125.85 3hk9 h ASN 407 Ca 0.38 -0.02 -0.00 0.00 -0.55 0.00 0.00 56.30 56.11 3hk9 h ASN 407 Cb 0.26 -0.19 0.00 0.00 0.05 0.00 0.00 38.32 38.43 3hk9 h ASN 407 CO -0.15 0.56 -0.03 0.15 -1.65 0.00 0.00 177.43 176.31 3hk9 h PHE 408 N 0.92 -0.09 -0.39 1.19 3.57 -1.67 -2.04 116.94 118.44 3hk9 h PHE 408 Ca 0.26 -0.00 -0.07 0.00 3.53 0.00 0.00 57.97 61.69 3hk9 h PHE 408 Cb -0.08 0.03 -0.02 0.00 2.79 0.00 0.00 35.95 38.67 3hk9 h PHE 408 CO -0.00 0.35 -0.04 -1.49 -2.23 0.00 0.00 178.31 174.90 3hk9 h TRP 409 N -0.55 0.67 -0.69 0.41 4.06 -1.40 -0.22 115.95 118.22 3hk9 h TRP 409 Ca -0.01 -0.09 -0.08 0.00 2.06 0.00 0.00 58.89 60.78 3hk9 h TRP 409 Cb 0.47 -0.19 -0.03 0.00 -1.00 0.00 0.00 29.16 28.42 3hk9 h TRP 409 CO 0.07 0.66 0.13 -0.09 -3.56 0.00 0.00 178.44 175.66 3hk9 h ARG 410 N 0.59 1.13 -0.12 0.49 2.43 -1.04 0.13 114.38 118.00 3hk9 h ARG 410 Ca 0.12 -0.29 -0.12 0.00 -0.81 0.00 0.00 59.98 58.88 3hk9 h ARG 410 Cb 0.43 -0.14 0.00 0.00 -0.42 0.00 0.00 29.97 29.85 3hk9 h ARG 410 CO 0.02 1.02 -0.39 0.35 -1.51 0.00 0.00 179.97 179.45 3hk9 h PHE 411 N 1.06 0.62 0.00 2.20 3.57 -0.82 -3.15 116.94 120.42 3hk9 h PHE 411 Ca 0.21 -0.26 0.00 0.00 3.53 0.00 0.00 57.97 61.46 3hk9 h PHE 411 Cb 0.42 -0.10 0.00 0.00 2.79 0.00 0.00 35.95 39.06 3hk9 h PHE 411 CO 0.03 1.00 0.00 -0.39 -2.23 0.00 0.00 178.31 176.73 3hk9 h VAL 412 N 0.07 0.00 -1.56 1.41 -1.51 -1.02 -3.47 116.25 110.17 3hk9 h VAL 412 Ca -0.02 -0.51 -0.01 0.00 -1.23 0.00 0.00 66.70 64.94 3hk9 h VAL 412 Cb 1.02 1.43 0.00 0.00 -2.13 0.00 0.00 31.29 31.61 3hk9 h VAL 412 CO 0.08 0.00 -0.01 0.61 -1.23 0.00 0.00 177.57 177.02 3hk9 n GLY 413 N 0.35 0.69 0.00 5.19 0.00 -0.15 -4.80 105.19 106.47 3hk9 n GLY 413 Ca 0.02 -0.57 0.00 0.00 0.00 0.00 0.00 46.02 45.47 3hk9 n GLY 413 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86