#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hk9 s ILE 3 N 0.00 4.81 -0.11 -1.33 1.01 -1.26 -4.87 121.20 119.45 3hk9 s ILE 3 Ca 0.00 -0.89 0.16 0.00 0.00 0.00 0.00 60.65 59.93 3hk9 s ILE 3 Cb 0.00 -4.46 0.38 0.00 0.01 0.00 0.00 42.46 38.39 3hk9 s ILE 3 CO 0.00 -1.08 1.18 -0.46 0.00 0.00 0.00 174.94 174.58 3hk9 n ASN 4 N 6.34 1.40 -3.49 3.58 6.94 -1.26 -4.68 115.26 124.09 3hk9 n ASN 4 Ca -0.09 -3.02 -0.13 0.00 -0.02 0.00 0.00 54.58 51.32 3hk9 n ASN 4 Cb 0.43 -0.42 -0.04 0.00 -2.36 0.00 0.00 39.78 37.40 3hk9 n ASN 4 CO 0.00 0.00 0.00 -0.94 -1.03 0.00 0.00 177.26 175.29 3hk9 s SER 5 N -2.61 -0.53 0.28 0.53 1.04 -1.26 -5.02 113.70 106.13 3hk9 s SER 5 Ca 0.33 0.27 -0.03 0.00 0.48 0.00 0.00 55.95 57.00 3hk9 s SER 5 Cb 0.34 0.50 0.39 0.00 0.10 0.00 0.00 66.02 67.35 3hk9 s SER 5 CO -0.09 -0.71 1.95 -0.09 0.98 0.00 0.00 173.24 175.27 3hk9 h ARG 6 N 2.38 1.14 -0.34 4.02 2.43 -1.97 0.28 114.38 122.32 3hk9 h ARG 6 Ca -0.28 -0.08 0.02 0.00 -0.81 0.00 0.00 59.98 58.84 3hk9 h ARG 6 Cb 1.23 -0.25 -0.03 0.00 -0.42 0.00 0.00 29.97 30.50 3hk9 h ARG 6 CO 0.36 0.77 0.17 1.49 -1.51 0.00 0.00 179.97 181.26 3hk9 h GLU 7 N 1.17 0.35 -0.50 0.20 4.81 -1.99 0.43 114.58 119.04 3hk9 h GLU 7 Ca 0.31 -0.02 -0.12 0.00 -0.13 0.00 0.00 59.36 59.40 3hk9 h GLU 7 Cb -0.11 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.18 3hk9 h GLU 7 CO -0.06 0.23 -0.15 0.28 -0.73 0.00 0.00 179.01 178.57 3hk9 h VAL 8 N 0.36 1.27 -0.33 0.32 2.07 -1.84 -2.95 116.25 115.15 3hk9 h VAL 8 Ca 0.14 -1.31 0.00 0.00 0.82 0.00 0.00 66.70 66.36 3hk9 h VAL 8 Cb 0.05 1.06 -0.02 0.00 -1.52 0.00 0.00 31.29 30.86 3hk9 h VAL 8 CO -0.10 0.46 0.21 0.25 0.02 0.00 0.00 177.57 178.42 3hk9 h LEU 9 N 0.86 0.37 -0.51 2.57 5.85 -0.48 -2.09 115.31 121.88 3hk9 h LEU 9 Ca 0.12 -0.01 0.08 0.00 0.84 0.00 0.00 57.88 58.91 3hk9 h LEU 9 Cb 0.72 -0.09 -0.06 0.00 0.37 0.00 0.00 40.66 41.60 3hk9 h LEU 9 CO 0.06 0.27 0.16 0.00 -0.34 0.00 0.00 178.44 178.58 3hk9 h ALA 10 N 1.12 0.61 0.13 1.25 0.00 -0.05 0.92 119.26 123.25 3hk9 h ALA 10 Ca 0.12 0.08 -0.00 0.00 0.00 0.00 0.00 54.91 55.11 3hk9 h ALA 10 Cb -0.05 0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.82 3hk9 h ALA 10 CO -0.03 -0.25 -0.09 1.49 0.00 0.00 0.00 179.25 180.38 3hk9 h GLU 11 N 0.32 -0.21 -0.56 0.00 4.81 -1.33 -0.20 114.58 117.40 3hk9 h GLU 11 Ca 0.25 0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.49 3hk9 h GLU 11 Cb 0.30 0.05 -0.03 0.00 0.63 0.00 0.00 28.75 29.70 3hk9 h GLU 11 CO -0.28 -0.14 0.34 0.87 -0.73 0.00 0.00 179.01 179.07 3hk9 h LYS 12 N -0.22 0.76 -0.03 1.92 1.79 -0.91 -0.63 116.57 119.25 3hk9 h LYS 12 Ca -0.01 -0.07 -0.00 0.00 -2.18 0.00 0.00 60.65 58.39 3hk9 h LYS 12 Cb 0.19 -0.16 -0.00 0.00 -1.58 0.00 0.00 32.23 30.68 3hk9 h LYS 12 CO 0.00 0.55 0.01 0.28 -1.08 0.00 0.00 179.45 179.22 3hk9 h VAL 13 N 0.76 1.17 -0.72 0.50 2.07 -0.71 0.23 116.25 119.56 3hk9 h VAL 13 Ca 0.20 -0.50 0.04 0.00 0.82 0.00 0.00 66.70 67.27 3hk9 h VAL 13 Cb -0.01 1.44 -0.05 0.00 -1.52 0.00 0.00 31.29 31.14 3hk9 h VAL 13 CO -0.04 0.13 0.43 0.11 0.02 0.00 0.00 177.57 178.23 3hk9 h LYS 14 N -0.14 0.80 -0.01 1.57 1.57 -0.90 0.11 116.57 119.57 3hk9 h LYS 14 Ca 0.01 -0.05 -0.00 0.00 -1.87 0.00 0.00 60.65 58.74 3hk9 h LYS 14 Cb 0.21 -0.18 -0.00 0.00 0.08 0.00 0.00 32.23 32.34 3hk9 h LYS 14 CO -0.00 0.53 0.00 -0.91 -0.57 0.00 0.00 179.45 178.50 3hk9 h ASN 15 N 0.82 0.01 -0.40 0.86 2.35 -0.95 0.02 115.58 118.29 3hk9 h ASN 15 Ca 0.30 -0.17 -0.00 0.00 -0.55 0.00 0.00 56.30 55.89 3hk9 h ASN 15 Cb 0.10 -0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.44 3hk9 h ASN 15 CO -0.14 0.17 0.25 0.00 -1.65 0.00 0.00 177.43 176.06 3hk9 h ALA 16 N 0.84 0.51 -0.25 -0.83 0.00 -0.61 -0.54 119.26 118.38 3hk9 h ALA 16 Ca 0.00 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.86 3hk9 h ALA 16 Cb 0.17 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 3hk9 h ALA 16 CO -0.00 -0.01 0.14 0.28 0.00 0.00 0.00 179.25 179.66 3hk9 h VAL 17 N 0.53 1.12 -0.75 0.00 2.07 -0.70 -0.45 116.25 118.07 3hk9 h VAL 17 Ca 0.14 -0.31 -0.00 0.00 0.82 0.00 0.00 66.70 67.35 3hk9 h VAL 17 Cb -0.02 0.87 -0.04 0.00 -1.52 0.00 0.00 31.29 30.59 3hk9 h VAL 17 CO -0.03 0.12 0.46 0.78 0.02 0.00 0.00 177.57 178.92 3hk9 h ASN 18 N 0.29 0.89 1.17 0.57 -0.26 -0.78 -3.01 115.58 114.45 3hk9 h ASN 18 Ca 0.09 -0.04 0.00 0.00 -0.56 0.00 0.00 56.30 55.79 3hk9 h ASN 18 Cb 0.06 -0.22 0.00 0.00 -1.06 0.00 0.00 38.32 37.10 3hk9 h ASN 18 CO -0.01 0.67 -0.45 0.78 -1.06 0.00 0.00 177.43 177.36 3hk9 h ASN 19 N 1.03 0.00 -2.61 5.81 2.35 -0.78 -3.46 115.58 117.91 3hk9 h ASN 19 Ca 0.27 -0.11 -0.55 0.00 -0.55 0.00 0.00 56.30 55.37 3hk9 h ASN 19 Cb -0.06 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.30 3hk9 h ASN 19 CO -0.05 0.05 1.08 -1.58 -1.65 0.00 0.00 177.43 175.28 3hk9 s GLN 20 N -3.18 4.18 0.18 0.81 2.00 -0.20 -4.95 119.66 118.49 3hk9 s GLN 20 Ca 0.06 2.20 -0.31 0.00 -2.00 0.00 0.00 55.36 55.31 3hk9 s GLN 20 Cb 0.12 -3.97 -0.09 0.00 0.80 0.00 0.00 33.01 29.86 3hk9 s GLN 20 CO 0.69 -0.84 1.39 -1.25 -0.50 0.00 0.00 175.29 174.78 3hk9 s PRO 21 N 3.99 4.32 -0.00 1.67 0.04 -1.26 -4.94 135.00 138.82 3hk9 s PRO 21 Ca 0.73 2.15 -0.16 0.00 0.04 0.00 0.00 61.00 63.77 3hk9 s PRO 21 Cb -0.34 -3.18 -0.06 0.00 0.04 0.00 0.00 34.50 30.96 3hk9 s PRO 21 CO 0.30 -0.38 0.44 0.08 0.04 0.00 0.00 177.00 177.48 3hk9 s VAL 22 N 0.45 5.00 -0.31 -0.36 1.01 -0.20 -4.68 120.40 121.31 3hk9 s VAL 22 Ca 0.61 0.91 -0.08 0.00 0.00 0.00 0.00 61.98 63.42 3hk9 s VAL 22 Cb -0.39 -3.75 0.01 0.00 0.00 0.00 0.00 36.38 32.25 3hk9 s VAL 22 CO 0.37 0.55 0.12 -0.89 0.00 0.00 0.00 175.10 175.24 3hk9 s THR 23 N -0.91 4.21 -0.70 3.92 2.01 -0.68 -0.84 115.64 122.65 3hk9 s THR 23 Ca 0.25 -0.65 -0.19 0.00 0.31 0.00 0.00 61.69 61.40 3hk9 s THR 23 Cb -0.17 -3.19 0.11 0.00 0.01 0.00 0.00 72.50 69.26 3hk9 s THR 23 CO 0.14 0.03 0.87 -0.62 -0.69 0.00 0.00 174.62 174.35 3hk9 s ASP 24 N 1.53 6.32 0.00 3.53 -1.08 0.71 -4.74 116.67 122.95 3hk9 s ASP 24 Ca 0.03 -1.55 0.15 0.00 -0.52 0.00 0.00 52.55 50.67 3hk9 s ASP 24 Cb -0.17 -2.35 0.92 0.00 -1.46 0.00 0.00 42.92 39.86 3hk9 s ASP 24 CO 0.04 -1.15 1.47 1.15 0.52 0.00 0.00 175.17 177.20 3hk9 n MET 25 N 6.57 0.83 -3.27 4.34 0.00 -1.26 -0.56 117.12 123.76 3hk9 n MET 25 Ca 0.01 0.00 0.02 0.00 0.00 0.00 0.00 57.70 57.73 3hk9 n MET 25 Cb 0.45 -1.29 -0.02 0.00 0.00 0.00 0.00 33.22 32.35 3hk9 n MET 25 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 175.97 174.39 3hk9 s HIS 26 N -2.00 -1.47 0.26 3.17 5.65 -1.26 -4.74 115.29 114.90 3hk9 s HIS 26 Ca 0.23 1.75 -0.06 0.00 0.25 0.00 0.00 55.06 57.23 3hk9 s HIS 26 Cb 0.11 0.56 -0.02 0.00 -1.18 0.00 0.00 32.58 32.05 3hk9 s HIS 26 CO 0.18 -0.82 0.36 0.95 -0.65 0.00 0.00 174.74 174.76 3hk9 s THR 27 N 2.83 0.00 -0.26 0.89 -4.23 -0.61 -0.94 115.64 113.31 3hk9 s THR 27 Ca 0.15 -1.67 0.09 0.00 -1.18 0.00 0.00 61.69 59.08 3hk9 s THR 27 Cb -0.14 -2.42 0.45 0.00 1.34 0.00 0.00 72.50 71.72 3hk9 s THR 27 CO -0.20 0.00 1.27 1.41 -0.54 0.00 0.00 174.62 176.56 3hk9 n HIS 28 N -0.41 1.16 -3.96 3.99 8.25 0.16 -2.89 115.22 121.53 3hk9 n HIS 28 Ca 0.01 -1.80 -0.25 0.00 -0.26 0.00 0.00 57.72 55.42 3hk9 n HIS 28 Cb 0.63 -0.35 -0.03 0.00 1.12 0.00 0.00 29.99 31.36 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 -3.38 4.29 0.03 2.41 1.43 -1.19 -4.65 118.68 117.62 3hk9 s LEU 29 Ca 0.44 0.12 0.04 0.00 -1.03 0.00 0.00 54.13 53.70 3hk9 s LEU 29 Cb 0.39 -2.86 -0.02 0.00 0.03 0.00 0.00 46.19 43.73 3hk9 s LEU 29 CO -0.02 0.02 -0.13 -0.36 0.23 0.00 0.00 176.35 176.09 3hk9 s PHE 30 N -1.81 1.12 0.24 0.29 0.08 -1.26 -4.48 117.98 112.16 3hk9 s PHE 30 Ca 0.34 -0.34 -0.30 0.00 0.12 0.00 0.00 56.93 56.75 3hk9 s PHE 30 Cb -0.10 -0.67 -0.15 0.00 -0.57 0.00 0.00 43.02 41.53 3hk9 s PHE 30 CO 0.28 0.02 1.13 0.45 -0.10 0.00 0.00 175.22 177.01 3hk9 n SER 31 N 1.98 1.56 -0.24 1.36 2.88 -1.26 -4.76 113.62 115.15 3hk9 n SER 31 Ca -0.18 1.16 0.29 0.00 -1.33 0.00 0.00 58.87 58.81 3hk9 n SER 31 Cb 0.55 -1.28 0.68 0.00 -0.75 0.00 0.00 64.21 63.41 3hk9 n SER 31 CO 0.00 0.00 0.00 1.55 -1.23 0.00 0.00 175.04 175.36 3hk9 h PRO 32 N 2.88 0.09 0.00 -1.46 0.13 -1.93 -1.41 132.00 130.29 3hk9 h PRO 32 Ca -0.42 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.71 3hk9 h PRO 32 Cb 1.33 -0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.44 3hk9 h PRO 32 CO 0.67 0.06 0.00 0.27 -0.23 0.00 0.00 178.00 178.76 3hk9 n ASN 33 N -4.31 0.00 -0.01 1.44 6.94 -1.26 -2.14 115.26 115.91 3hk9 n ASN 33 Ca 0.21 -0.10 0.14 0.00 -0.02 0.00 0.00 54.58 54.81 3hk9 n ASN 33 Cb 0.99 -0.21 0.54 0.00 -2.36 0.00 0.00 39.78 38.75 3hk9 n ASN 33 CO 0.00 0.00 0.00 0.49 -1.03 0.00 0.00 177.26 176.72 3hk9 n PHE 34 N -1.21 0.00 -0.47 -2.53 3.01 -0.53 -4.99 117.46 110.74 3hk9 n PHE 34 Ca 0.09 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.55 3hk9 n PHE 34 Cb 0.11 -0.39 0.00 0.00 -0.01 0.00 0.00 39.48 39.18 3hk9 n PHE 34 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3hk9 n GLY 35 N 1.46 -1.86 0.02 1.37 0.00 -0.91 -4.45 105.19 100.82 3hk9 n GLY 35 Ca 0.08 -1.93 0.01 0.00 0.00 0.00 0.00 46.02 44.19 3hk9 n GLY 35 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3hk9 n GLU 36 N 0.00 0.02 0.28 1.61 1.02 -1.26 -1.73 120.64 120.58 3hk9 n GLU 36 Ca 0.00 0.47 0.13 0.00 -0.02 0.00 0.00 57.16 57.74 3hk9 n GLU 36 Cb 0.00 -1.61 0.82 0.00 -0.02 0.00 0.00 31.44 30.63 3hk9 n GLU 36 CO 0.00 0.00 0.00 0.97 1.18 0.00 0.00 177.13 179.28 3hk9 h ILE 37 N 0.00 0.63 -3.57 -3.67 2.10 -1.96 -3.36 117.51 107.67 3hk9 h ILE 37 Ca 0.00 -0.15 -0.57 0.00 1.08 0.00 0.00 64.86 65.22 3hk9 h ILE 37 Cb 0.11 1.09 -0.07 0.00 -1.09 0.00 0.00 36.82 36.86 3hk9 h ILE 37 CO 0.00 0.04 0.86 -0.22 -1.08 0.00 0.00 178.15 177.74 3hk9 s LEU 38 N -7.83 3.78 0.09 2.19 2.96 -0.70 -4.84 118.68 114.33 3hk9 s LEU 38 Ca -0.04 0.63 -0.19 0.00 -0.22 0.00 0.00 54.13 54.31 3hk9 s LEU 38 Cb 0.15 -3.50 -0.07 0.00 0.50 0.00 0.00 46.19 43.27 3hk9 s LEU 38 CO 0.58 -1.10 0.58 -0.76 -1.32 0.00 0.00 176.35 174.33 3hk9 s LEU 39 N 4.09 4.50 0.12 -0.68 1.43 -1.26 -5.01 118.68 121.88 3hk9 s LEU 39 Ca 0.46 1.26 -0.24 0.00 -1.03 0.00 0.00 54.13 54.57 3hk9 s LEU 39 Cb -0.09 -2.97 0.08 0.00 0.03 0.00 0.00 46.19 43.23 3hk9 s LEU 39 CO 0.25 0.25 0.67 -1.66 0.23 0.00 0.00 176.35 176.09 3hk9 s TRP 40 N -1.17 -0.50 0.00 0.29 1.48 -1.26 -0.87 118.94 116.92 3hk9 s TRP 40 Ca 0.31 0.31 0.00 0.00 -1.06 0.00 0.00 56.10 55.65 3hk9 s TRP 40 Cb -0.19 0.55 0.00 0.00 -1.16 0.00 0.00 33.47 32.67 3hk9 s TRP 40 CO 0.19 -0.78 0.00 -0.40 -4.06 0.00 0.00 176.95 171.91 3hk9 n ASP 41 N -0.34 0.00 -0.21 -2.66 5.68 -1.26 -4.55 116.55 113.21 3hk9 n ASP 41 Ca -0.15 0.00 0.07 0.00 -0.50 0.00 0.00 54.79 54.21 3hk9 n ASP 41 Cb 0.64 0.00 0.34 0.00 -1.14 0.00 0.00 41.12 40.96 3hk9 n ASP 41 CO 0.00 0.00 0.00 -0.29 -1.33 0.00 0.00 177.20 175.58 3hk9 h ILE 42 N 0.00 1.00 -0.27 2.12 6.09 -1.95 -1.42 117.51 123.08 3hk9 h ILE 42 Ca 0.00 -0.27 -0.11 0.00 -1.37 0.00 0.00 64.86 63.11 3hk9 h ILE 42 Cb 0.00 0.15 -0.01 0.00 0.47 0.00 0.00 36.82 37.43 3hk9 h ILE 42 CO 0.00 0.14 -0.31 0.44 -3.07 0.00 0.00 178.15 175.36 3hk9 h ASP 43 N 0.78 0.58 -0.37 2.19 3.32 -1.96 -1.09 116.42 119.88 3hk9 h ASP 43 Ca 0.34 -0.22 -0.15 0.00 0.02 0.00 0.00 57.03 57.02 3hk9 h ASP 43 Cb 0.32 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.71 3hk9 h ASP 43 CO -0.12 0.85 -0.36 -0.33 -1.72 0.00 0.00 179.24 177.56 3hk9 h GLU 44 N 0.48 0.92 -0.55 3.56 4.39 -1.63 -2.49 114.58 119.25 3hk9 h GLU 44 Ca 0.06 -0.47 0.00 0.00 0.34 0.00 0.00 59.36 59.29 3hk9 h GLU 44 Cb 0.77 0.01 -0.03 0.00 -0.10 0.00 0.00 28.75 29.40 3hk9 h GLU 44 CO 0.06 1.12 0.35 -0.07 -1.16 0.00 0.00 179.01 179.31 3hk9 h LEU 45 N 0.75 0.65 -1.44 1.33 3.38 -0.96 -2.33 115.31 116.70 3hk9 h LEU 45 Ca 0.07 -0.04 -0.02 0.00 0.09 0.00 0.00 57.88 57.98 3hk9 h LEU 45 Cb 0.95 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 41.53 3hk9 h LEU 45 CO 0.09 0.50 -0.08 -0.07 0.09 0.00 0.00 178.44 178.97 3hk9 h LEU 46 N 0.75 0.00 -2.77 1.67 3.38 -1.13 -3.01 115.31 114.20 3hk9 h LEU 46 Ca 0.20 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.17 3hk9 h LEU 46 Cb -0.05 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.70 3hk9 h LEU 46 CO -0.04 0.08 0.00 0.35 0.09 0.00 0.00 178.44 178.92 3hk9 n THR 47 N -3.23 0.99 -1.59 0.22 -2.24 -0.92 -4.71 114.28 102.81 3hk9 n THR 47 Ca 0.00 -1.00 -0.42 0.00 -2.27 0.00 0.00 64.05 60.36 3hk9 n THR 47 Cb 0.33 0.51 0.01 0.00 -2.10 0.00 0.00 70.33 69.07 3hk9 n THR 47 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3hk9 n TYR 48 N 1.42 0.98 0.32 4.78 9.36 -0.96 -4.71 117.16 128.36 3hk9 n TYR 48 Ca 0.22 0.60 0.21 0.00 3.32 0.00 0.00 57.90 62.24 3hk9 n TYR 48 Cb 0.58 -2.20 1.07 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 1.54 0.00 -0.66 2.98 2.07 -1.92 -0.96 115.15 118.20 3hk9 h HIS 49 Ca -0.43 0.00 -0.03 0.00 -2.85 0.00 0.00 60.37 57.06 3hk9 h HIS 49 Cb 1.35 0.00 -0.03 0.00 2.57 0.00 0.00 27.41 31.30 3hk9 h HIS 49 CO 0.43 0.01 0.28 1.88 -3.07 0.00 0.00 177.93 177.46 3hk9 h TYR 50 N 0.00 0.96 0.00 6.12 -1.99 -1.94 -1.82 116.97 118.30 3hk9 h TYR 50 Ca -0.00 -0.05 -0.08 0.00 2.00 0.00 0.00 58.73 60.60 3hk9 h TYR 50 Cb 0.13 -0.30 -0.01 0.00 2.00 0.00 0.00 36.73 38.55 3hk9 h TYR 50 CO 0.00 0.73 -0.37 -0.07 -0.00 0.00 0.00 178.16 178.45 3hk9 h LEU 51 N 0.94 0.00 -0.20 3.88 4.07 -1.48 -2.76 115.31 119.77 3hk9 h LEU 51 Ca 0.22 0.00 -0.05 0.00 0.08 0.00 0.00 57.88 58.14 3hk9 h LEU 51 Cb 0.16 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 41.90 3hk9 h LEU 51 CO -0.02 0.37 -0.05 0.58 -1.08 0.00 0.00 178.44 178.23 3hk9 h VAL 52 N 0.00 1.29 -0.37 1.22 2.07 -1.16 0.44 116.25 119.74 3hk9 h VAL 52 Ca -0.00 -1.04 0.01 0.00 0.82 0.00 0.00 66.70 66.49 3hk9 h VAL 52 Cb 1.25 1.55 -0.02 0.00 -1.52 0.00 0.00 31.29 32.55 3hk9 h VAL 52 CO 0.05 0.32 0.23 0.00 0.02 0.00 0.00 177.57 178.18 3hk9 h ALA 53 N 0.74 0.47 -0.54 1.67 0.00 -1.36 -2.50 119.26 117.73 3hk9 h ALA 53 Ca 0.05 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.88 3hk9 h ALA 53 Cb 0.50 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 3hk9 h ALA 53 CO 0.02 -0.11 0.09 0.93 0.00 0.00 0.00 179.25 180.18 3hk9 h GLU 54 N 0.46 0.90 -0.51 0.00 5.08 -1.35 -3.10 114.58 116.06 3hk9 h GLU 54 Ca 0.14 -0.24 -0.06 0.00 -1.00 0.00 0.00 59.36 58.20 3hk9 h GLU 54 Cb -0.01 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.11 3hk9 h GLU 54 CO -0.06 0.87 0.06 -0.24 -1.00 0.00 0.00 179.01 178.64 3hk9 h VAL 55 N 0.79 1.24 0.00 3.13 3.04 -0.75 -2.35 116.25 121.34 3hk9 h VAL 55 Ca 0.17 -0.92 0.00 0.00 -1.01 0.00 0.00 66.70 64.93 3hk9 h VAL 55 Cb 0.41 0.79 0.00 0.00 -2.01 0.00 0.00 31.29 30.47 3hk9 h VAL 55 CO 0.01 0.33 0.00 0.23 -1.01 0.00 0.00 177.57 177.13 3hk9 n MET 56 N -4.24 0.16 0.09 4.17 2.81 -0.96 -0.46 117.12 118.69 3hk9 n MET 56 Ca 0.03 0.56 0.13 0.00 -1.81 0.00 0.00 57.70 56.61 3hk9 n MET 56 Cb 0.27 -1.93 0.34 0.00 -0.71 0.00 0.00 33.22 31.19 3hk9 n MET 56 CO 0.00 0.00 0.00 0.54 1.51 0.00 0.00 175.97 178.02 3hk9 n ARG 57 N -2.26 0.27 -0.04 0.03 1.74 -0.88 -4.39 116.66 111.13 3hk9 n ARG 57 Ca -0.00 0.17 -0.07 0.00 -0.77 0.00 0.00 57.85 57.18 3hk9 n ARG 57 Cb 0.11 -1.77 -0.03 0.00 -1.02 0.00 0.00 32.46 29.75 3hk9 n ARG 57 CO 0.00 0.00 0.00 0.91 -1.52 0.00 0.00 177.63 177.02 3hk9 n TRP 58 N -2.20 0.00 -2.33 -1.55 5.03 0.25 -5.07 117.44 111.57 3hk9 n TRP 58 Ca 0.05 0.00 -0.38 0.00 3.03 0.00 0.00 57.50 60.20 3hk9 n TRP 58 Cb 0.43 -0.29 -0.02 0.00 -1.03 0.00 0.00 31.31 30.40 3hk9 n TRP 58 CO 0.00 0.00 0.00 -0.08 -0.03 0.00 0.00 177.69 177.58 3hk9 s THR 59 N -2.15 3.23 -2.10 -0.99 -1.32 0.39 -4.93 115.64 107.77 3hk9 s THR 59 Ca -0.11 1.01 0.28 0.00 -1.21 0.00 0.00 61.69 61.66 3hk9 s THR 59 Cb 0.03 -3.55 0.47 0.00 -1.51 0.00 0.00 72.50 67.94 3hk9 s THR 59 CO 0.16 0.07 1.74 -0.90 -2.21 0.00 0.00 174.62 173.47 3hk9 n ASP 60 N -0.00 1.09 -4.72 8.08 3.85 -1.26 -4.85 116.55 118.74 3hk9 n ASP 60 Ca 0.05 -1.13 -0.42 0.00 -0.71 0.00 0.00 54.79 52.58 3hk9 n ASP 60 Cb 0.47 0.03 -0.03 0.00 -1.35 0.00 0.00 41.12 40.24 3hk9 n ASP 60 CO 0.00 0.00 0.00 -0.69 -1.01 0.00 0.00 177.20 175.50 3hk9 s VAL 61 N -2.23 3.48 0.52 2.12 1.01 -1.26 -4.98 120.40 119.05 3hk9 s VAL 61 Ca 0.33 1.11 -0.21 0.00 0.00 0.00 0.00 61.98 63.21 3hk9 s VAL 61 Cb 0.20 -3.71 -0.06 0.00 0.00 0.00 0.00 36.38 32.81 3hk9 s VAL 61 CO 0.42 0.11 1.19 -0.94 0.00 0.00 0.00 175.10 175.88 3hk9 s SER 62 N 0.84 5.76 0.43 3.32 1.04 -1.26 -4.83 113.70 118.99 3hk9 s SER 62 Ca 0.60 2.36 0.10 0.00 0.48 0.00 0.00 55.95 59.49 3hk9 s SER 62 Cb -0.35 -2.60 0.95 0.00 0.10 0.00 0.00 66.02 64.12 3hk9 s SER 62 CO 0.32 -1.21 2.06 -0.29 0.98 0.00 0.00 173.24 175.11 3hk9 h ILE 63 N 1.48 1.09 -0.24 -1.02 6.09 -1.96 0.23 117.51 123.17 3hk9 h ILE 63 Ca -0.50 -0.23 -0.18 0.00 -1.37 0.00 0.00 64.86 62.58 3hk9 h ILE 63 Cb 1.27 0.73 -0.00 0.00 0.47 0.00 0.00 36.82 39.29 3hk9 h ILE 63 CO 0.58 0.10 -0.56 -0.33 -3.07 0.00 0.00 178.15 174.87 3hk9 h GLU 64 N 0.37 0.74 -0.26 2.19 3.07 -1.92 -2.56 114.58 116.21 3hk9 h GLU 64 Ca 0.10 -0.47 -0.11 0.00 -0.50 0.00 0.00 59.36 58.37 3hk9 h GLU 64 Cb 0.02 0.06 -0.01 0.00 -0.84 0.00 0.00 28.75 27.97 3hk9 h GLU 64 CO -0.02 1.10 -0.30 0.00 -1.40 0.00 0.00 179.01 178.40 3hk9 h ALA 65 N 0.80 1.01 0.29 3.43 0.00 -1.57 -2.86 119.26 120.37 3hk9 h ALA 65 Ca 0.01 -0.38 -0.01 0.00 0.00 0.00 0.00 54.91 54.53 3hk9 h ALA 65 Cb 1.15 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.81 3hk9 h ALA 65 CO 0.12 0.59 -0.16 0.35 0.00 0.00 0.00 179.25 180.15 3hk9 h PHE 66 N 0.46 -0.41 0.00 0.00 3.57 -0.40 -2.32 116.94 117.83 3hk9 h PHE 66 Ca 0.06 -0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.55 3hk9 h PHE 66 Cb 0.75 0.14 -0.00 0.00 2.79 0.00 0.00 35.95 39.63 3hk9 h PHE 66 CO 0.03 -0.25 -0.03 -1.49 -2.23 0.00 0.00 178.31 174.34 3hk9 h TRP 67 N -0.42 0.00 0.00 0.41 -0.00 -1.43 -1.85 115.95 112.65 3hk9 h TRP 67 Ca -0.03 0.00 -0.13 0.00 -0.00 0.00 0.00 58.89 58.73 3hk9 h TRP 67 Cb 0.34 0.00 -0.02 0.00 -0.00 0.00 0.00 29.16 29.48 3hk9 h TRP 67 CO -0.07 0.03 -0.61 0.00 -0.00 0.00 0.00 178.44 177.78 3hk9 h ALA 68 N 1.97 0.68 -2.30 1.49 0.00 -1.19 -3.46 119.26 116.46 3hk9 h ALA 68 Ca -0.00 -0.56 -0.50 0.00 0.00 0.00 0.00 54.91 53.86 3hk9 h ALA 68 Cb 0.10 -0.10 0.16 0.00 0.00 0.00 0.00 17.79 17.95 3hk9 h ALA 68 CO 0.00 0.76 0.24 -1.64 0.00 0.00 0.00 179.25 178.62 3hk9 s MET 69 N -3.09 1.26 0.92 0.00 -1.94 -0.70 -5.03 119.30 110.72 3hk9 s MET 69 Ca 0.02 1.08 -0.14 0.00 -1.71 0.00 0.00 55.69 54.94 3hk9 s MET 69 Cb 0.09 -1.79 0.15 0.00 2.01 0.00 0.00 34.83 35.29 3hk9 s MET 69 CO 0.75 -2.32 1.20 -1.54 -0.01 0.00 0.00 175.02 173.11 3hk9 s SER 70 N -3.15 3.51 0.14 3.03 1.04 -1.26 -4.81 113.70 112.19 3hk9 s SER 70 Ca 0.64 0.69 -0.16 0.00 0.48 0.00 0.00 55.95 57.59 3hk9 s SER 70 Cb -0.19 -1.06 0.00 0.00 0.10 0.00 0.00 66.02 64.87 3hk9 s SER 70 CO 0.58 -2.52 1.76 0.50 0.98 0.00 0.00 173.24 174.54 3hk9 h LYS 71 N -1.48 0.54 -0.53 4.02 1.63 -1.96 -1.10 116.57 117.68 3hk9 h LYS 71 Ca -0.47 -0.06 -0.06 0.00 -0.85 0.00 0.00 60.65 59.21 3hk9 h LYS 71 Cb 1.30 -0.11 -0.02 0.00 -0.60 0.00 0.00 32.23 32.80 3hk9 h LYS 71 CO 0.54 0.42 0.07 -0.09 -3.45 0.00 0.00 179.45 176.95 3hk9 h ARG 72 N 0.50 0.84 -0.58 1.90 2.43 -1.94 -0.58 114.38 116.96 3hk9 h ARG 72 Ca 0.14 -0.20 -0.09 0.00 -0.81 0.00 0.00 59.98 59.02 3hk9 h ARG 72 Cb 0.03 -0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 29.45 3hk9 h ARG 72 CO -0.02 0.80 0.02 0.93 -1.51 0.00 0.00 179.97 180.18 3hk9 h GLU 73 N 0.80 0.99 -0.36 0.20 5.08 -1.84 0.58 114.58 120.02 3hk9 h GLU 73 Ca 0.17 -0.29 -0.03 0.00 -1.00 0.00 0.00 59.36 58.20 3hk9 h GLU 73 Cb 0.37 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.51 3hk9 h GLU 73 CO 0.01 0.96 0.10 1.96 -1.00 0.00 0.00 179.01 181.04 3hk9 h GLN 74 N 0.91 0.56 -0.58 2.33 4.20 -0.79 -1.56 115.11 120.19 3hk9 h GLN 74 Ca 0.17 -0.13 -0.03 0.00 0.06 0.00 0.00 58.65 58.72 3hk9 h GLN 74 Cb 0.51 -0.08 -0.03 0.00 0.30 0.00 0.00 27.48 28.19 3hk9 h GLN 74 CO 0.02 0.60 0.23 0.00 -0.67 0.00 0.00 178.83 179.02 3hk9 h ALA 75 N 0.94 0.75 -0.76 3.87 0.00 -0.86 -1.59 119.26 121.61 3hk9 h ALA 75 Ca 0.11 -0.16 -0.04 0.00 0.00 0.00 0.00 54.91 54.82 3hk9 h ALA 75 Cb 0.28 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.81 3hk9 h ALA 75 CO -0.00 0.36 0.32 -0.44 0.00 0.00 0.00 179.25 179.49 3hk9 h ASP 76 N 0.79 1.03 -0.03 0.00 3.32 -0.75 -0.90 116.42 119.88 3hk9 h ASP 76 Ca 0.19 -0.16 -0.00 0.00 0.02 0.00 0.00 57.03 57.08 3hk9 h ASP 76 Cb 0.19 -0.27 -0.00 0.00 0.22 0.00 0.00 39.33 39.48 3hk9 h ASP 76 CO -0.02 0.90 0.01 0.25 -1.72 0.00 0.00 179.24 178.67 3hk9 h LEU 77 N 1.08 0.05 -0.60 1.55 5.85 -1.03 -1.27 115.31 120.94 3hk9 h LEU 77 Ca 0.25 -0.23 -0.01 0.00 0.84 0.00 0.00 57.88 58.73 3hk9 h LEU 77 Cb 0.18 -0.01 -0.03 0.00 0.37 0.00 0.00 40.66 41.17 3hk9 h LEU 77 CO -0.02 0.27 0.32 0.40 -0.34 0.00 0.00 178.44 179.07 3hk9 h ILE 78 N -0.17 1.20 -0.09 4.05 2.04 -1.18 0.24 117.51 123.59 3hk9 h ILE 78 Ca 0.01 -0.51 0.01 0.00 1.00 0.00 0.00 64.86 65.38 3hk9 h ILE 78 Cb 0.24 0.43 -0.01 0.00 -0.74 0.00 0.00 36.82 36.74 3hk9 h ILE 78 CO 0.00 0.22 0.00 -0.25 0.00 0.00 0.00 178.15 178.12 3hk9 h TRP 79 N 0.82 0.01 -0.30 1.37 2.91 -1.14 0.35 115.95 119.97 3hk9 h TRP 79 Ca 0.21 0.01 -0.01 0.00 1.13 0.00 0.00 58.89 60.23 3hk9 h TRP 79 Cb 0.05 0.01 -0.01 0.00 -0.51 0.00 0.00 29.16 28.70 3hk9 h TRP 79 CO -0.01 -0.00 0.15 1.49 -1.03 0.00 0.00 178.44 179.03 3hk9 h GLU 80 N 0.04 0.43 -0.14 2.65 4.57 -0.90 -0.00 114.58 121.22 3hk9 h GLU 80 Ca 0.04 -0.06 -0.22 0.00 -1.18 0.00 0.00 59.36 57.94 3hk9 h GLU 80 Cb 0.04 -0.08 0.01 0.00 -0.16 0.00 0.00 28.75 28.56 3hk9 h GLU 80 CO -0.07 0.40 -0.77 0.93 -1.18 0.00 0.00 179.01 178.33 3hk9 h GLU 81 N 0.36 0.74 0.00 1.92 4.39 -0.30 -0.62 114.58 121.06 3hk9 h GLU 81 Ca 0.10 -0.60 0.00 0.00 0.34 0.00 0.00 59.36 59.20 3hk9 h GLU 81 Cb 0.11 0.13 0.00 0.00 -0.10 0.00 0.00 28.75 28.89 3hk9 h GLU 81 CO -0.01 1.21 -1.08 1.28 -1.16 0.00 0.00 179.01 179.25 3hk9 n LEU 82 N -3.92 0.68 -0.02 1.33 4.77 0.12 -3.89 117.00 116.07 3hk9 n LEU 82 Ca -0.07 -0.39 -0.03 0.00 -0.03 0.00 0.00 56.01 55.49 3hk9 n LEU 82 Cb 0.74 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.80 3hk9 n LEU 82 CO 0.52 0.17 -0.66 0.49 -1.33 0.00 0.00 177.39 176.59 3hk9 n PHE 83 N -1.59 0.00 -0.13 -1.77 3.72 -0.05 -3.13 117.46 114.51 3hk9 n PHE 83 Ca 0.02 0.00 -0.27 0.00 -0.05 0.00 0.00 57.45 57.15 3hk9 n PHE 83 Cb 0.33 -0.21 -0.11 0.00 -0.94 0.00 0.00 39.48 38.55 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 -2.34 1.53 0.34 4.37 2.08 -1.00 -4.34 119.36 119.99 3hk9 n ILE 84 Ca -0.08 -0.32 0.14 0.00 0.56 0.00 0.00 62.75 63.05 3hk9 n ILE 84 Cb 0.63 -1.89 0.47 0.00 -0.75 0.00 0.00 39.64 38.10 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 -0.93 0.00 -2.94 0.38 1.57 -1.28 -3.44 116.57 109.93 3hk9 h LYS 85 Ca -0.61 0.00 -0.13 0.00 -1.87 0.00 0.00 60.65 58.04 3hk9 h LYS 85 Cb 1.57 0.00 -0.22 0.00 0.08 0.00 0.00 32.23 33.65 3hk9 h LYS 85 CO -0.35 0.00 -0.28 1.03 -0.57 0.00 0.00 179.45 179.27 3hk9 s ARG 86 N -3.40 0.54 0.30 3.15 3.00 -1.25 -5.04 118.95 116.25 3hk9 s ARG 86 Ca 0.05 0.17 -0.29 0.00 0.00 0.00 0.00 55.73 55.65 3hk9 s ARG 86 Cb 0.08 0.25 -0.11 0.00 0.00 0.00 0.00 34.95 35.18 3hk9 s ARG 86 CO 0.56 -0.12 1.45 -1.12 0.00 0.00 0.00 175.30 176.07 3hk9 s SER 87 N -0.54 6.55 -1.07 0.23 0.01 -1.26 -3.28 113.70 114.35 3hk9 s SER 87 Ca -0.07 2.81 -0.07 0.00 1.31 0.00 0.00 55.95 59.93 3hk9 s SER 87 Cb -0.04 -2.64 -0.10 0.00 0.21 0.00 0.00 66.02 63.46 3hk9 s SER 87 CO 0.02 -0.75 2.64 -0.81 0.41 0.00 0.00 173.24 174.76 3hk9 n PRO 88 N 1.58 2.71 0.14 12.44 -0.04 -1.18 -4.67 135.00 145.98 3hk9 n PRO 88 Ca 0.04 -1.67 0.13 0.00 -0.04 0.00 0.00 63.50 61.97 3hk9 n PRO 88 Cb 0.40 -2.51 0.35 0.00 -0.04 0.00 0.00 33.50 31.70 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 3.03 0.00 -4.21 0.52 -1.51 -1.89 -3.24 116.25 108.95 3hk9 h VAL 89 Ca 0.60 -0.61 -0.51 0.00 -1.23 0.00 0.00 66.70 64.96 3hk9 h VAL 89 Cb 0.40 1.60 0.17 0.00 -2.13 0.00 0.00 31.29 31.32 3hk9 h VAL 89 CO 1.39 0.00 0.25 -0.94 -1.23 0.00 0.00 177.57 177.04 3hk9 s SER 90 N -4.98 3.46 0.18 4.19 1.04 -1.26 -4.74 113.70 111.59 3hk9 s SER 90 Ca 0.09 1.94 -0.13 0.00 0.48 0.00 0.00 55.95 58.33 3hk9 s SER 90 Cb 0.10 -2.49 0.12 0.00 0.10 0.00 0.00 66.02 63.85 3hk9 s SER 90 CO 0.61 -2.72 1.81 -0.08 0.98 0.00 0.00 173.24 173.84 3hk9 h GLU 91 N -1.60 0.61 -0.37 4.02 4.57 -1.97 0.14 114.58 119.97 3hk9 h GLU 91 Ca -0.45 -0.04 -0.10 0.00 -1.18 0.00 0.00 59.36 57.59 3hk9 h GLU 91 Cb 1.26 -0.14 -0.02 0.00 -0.16 0.00 0.00 28.75 29.70 3hk9 h GLU 91 CO 0.47 0.40 -0.19 0.00 -1.18 0.00 0.00 179.01 178.52 3hk9 h ALA 92 N 1.25 0.98 -0.21 2.92 0.00 -1.95 -1.18 119.26 121.06 3hk9 h ALA 92 Ca 0.22 -0.34 -0.19 0.00 0.00 0.00 0.00 54.91 54.60 3hk9 h ALA 92 Cb 0.04 -0.15 0.01 0.00 0.00 0.00 0.00 17.79 17.69 3hk9 h ALA 92 CO -0.11 0.60 -0.61 0.00 0.00 0.00 0.00 179.25 179.13 3hk9 h ARG 94 N 0.52 0.90 -0.90 0.00 2.43 -0.88 -2.37 114.38 114.08 3hk9 h ARG 94 Ca -0.02 -0.05 0.06 0.00 -0.81 0.00 0.00 59.98 59.16 3hk9 h ARG 94 Cb 1.23 -0.20 -0.06 0.00 -0.42 0.00 0.00 29.97 30.52 3hk9 h ARG 94 CO 0.13 0.59 0.57 0.78 -1.51 0.00 0.00 179.97 180.53 3hk9 h GLY 95 N 0.92 1.36 0.82 2.80 0.00 -1.07 -1.29 103.07 106.62 3hk9 h GLY 95 Ca 0.34 -0.42 0.03 0.00 0.00 0.00 0.00 47.33 47.28 3hk9 h GLY 95 CO -0.15 0.30 0.25 -2.08 0.00 0.00 0.00 176.54 174.86 3hk9 h VAL 96 N 1.05 1.00 -0.79 4.60 2.07 -1.27 -1.89 116.25 121.03 3hk9 h VAL 96 Ca 0.39 -0.17 -0.00 0.00 0.82 0.00 0.00 66.70 67.73 3hk9 h VAL 96 Cb 0.14 0.47 -0.04 0.00 -1.52 0.00 0.00 31.29 30.34 3hk9 h VAL 96 CO -0.16 0.09 0.48 -0.07 0.02 0.00 0.00 177.57 177.93 3hk9 h LEU 97 N 0.49 0.94 -0.86 2.57 3.38 -1.20 -2.13 115.31 118.50 3hk9 h LEU 97 Ca 0.19 -0.06 -0.03 0.00 0.09 0.00 0.00 57.88 58.07 3hk9 h LEU 97 Cb 0.06 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 40.54 3hk9 h LEU 97 CO -0.11 0.72 0.44 0.74 0.09 0.00 0.00 178.44 180.31 3hk9 h THR 98 N 1.08 1.26 0.23 0.22 2.02 -0.83 -1.81 112.91 115.07 3hk9 h THR 98 Ca 0.28 -0.70 -0.01 0.00 0.77 0.00 0.00 66.41 66.75 3hk9 h THR 98 Cb -0.05 0.13 0.00 0.00 -1.74 0.00 0.00 68.15 66.49 3hk9 h THR 98 CO -0.05 0.31 -0.11 0.00 0.37 0.00 0.00 175.52 176.03 3hk9 h LEU 100 N -0.40 -0.96 -0.64 0.00 3.38 -1.23 -1.03 115.31 114.42 3hk9 h LEU 100 Ca -0.03 0.14 0.06 0.00 0.09 0.00 0.00 57.88 58.14 3hk9 h LEU 100 Cb 0.31 0.41 -0.06 0.00 0.09 0.00 0.00 40.66 41.41 3hk9 h LEU 100 CO 0.05 -0.35 0.34 -0.61 0.09 0.00 0.00 178.44 177.96 3hk9 h GLN 101 N -0.38 0.61 -0.04 1.13 4.15 -1.21 -0.40 115.11 118.97 3hk9 h GLN 101 Ca 0.10 -0.04 0.01 0.00 0.77 0.00 0.00 58.65 59.49 3hk9 h GLN 101 Cb 0.53 -0.14 -0.00 0.00 0.21 0.00 0.00 27.48 28.08 3hk9 h GLN 101 CO -0.35 0.41 0.03 0.78 -1.93 0.00 0.00 178.83 177.76 3hk9 h GLY 102 N 0.63 0.00 -0.18 2.39 0.00 -0.05 -0.79 103.07 105.06 3hk9 h GLY 102 Ca 0.29 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.62 3hk9 h GLY 102 CO -0.19 0.00 0.00 1.04 0.00 0.00 0.00 176.54 177.39 3hk9 n LEU 103 N -4.43 1.15 0.00 3.11 4.77 -0.48 -4.89 117.00 116.23 3hk9 n LEU 103 Ca -0.02 -0.41 0.00 0.00 -0.03 0.00 0.00 56.01 55.55 3hk9 n LEU 103 Cb 0.12 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.20 3hk9 n LEU 103 CO 0.33 0.20 0.00 0.61 -1.33 0.00 0.00 177.39 177.21 3hk9 n GLY 104 N 1.11 0.70 3.84 -0.72 0.00 -0.30 -5.07 105.19 104.76 3hk9 n GLY 104 Ca 0.19 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.86 3hk9 n GLY 104 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3hk9 s LEU 105 N 0.00 4.34 -0.42 0.99 1.43 -0.27 -4.98 118.68 119.77 3hk9 s LEU 105 Ca 0.00 1.07 -0.12 0.00 -1.03 0.00 0.00 54.13 54.04 3hk9 s LEU 105 Cb 0.00 -3.24 0.05 0.00 0.03 0.00 0.00 46.19 43.03 3hk9 s LEU 105 CO 0.00 0.11 0.29 -0.62 0.23 0.00 0.00 176.35 176.36 3hk9 s ASP 106 N -1.70 5.88 0.63 2.29 2.15 -1.26 -2.94 116.67 121.72 3hk9 s ASP 106 Ca 0.37 -1.21 0.41 0.00 0.43 0.00 0.00 52.55 52.55 3hk9 s ASP 106 Cb -0.15 -2.08 2.14 0.00 -0.30 0.00 0.00 42.92 42.54 3hk9 s ASP 106 CO 0.19 -0.51 2.28 -0.65 -0.17 0.00 0.00 175.17 176.31 3hk9 h PRO 107 N 8.55 0.00 -0.61 4.34 0.11 -1.92 -2.37 132.00 140.10 3hk9 h PRO 107 Ca -0.26 0.00 0.05 0.00 0.11 0.00 0.00 66.00 65.90 3hk9 h PRO 107 Cb 1.10 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.18 3hk9 h PRO 107 CO 0.76 0.01 0.40 0.00 -0.21 0.00 0.00 178.00 178.96 3hk9 h ALA 108 N 1.99 1.74 0.00 -0.75 0.00 -2.00 -2.15 119.26 118.08 3hk9 h ALA 108 Ca -0.00 -0.02 -0.14 0.00 0.00 0.00 0.00 54.91 54.75 3hk9 h ALA 108 Cb 0.11 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 3hk9 h ALA 108 CO 0.00 0.18 -0.65 1.79 0.00 0.00 0.00 179.25 180.58 3hk9 h THR 109 N 0.66 1.21 -2.27 0.00 1.35 -1.86 -3.47 112.91 108.53 3hk9 h THR 109 Ca 0.25 -2.44 -0.40 0.00 -0.55 0.00 0.00 66.41 63.28 3hk9 h THR 109 Cb 0.17 2.42 -0.08 0.00 -1.73 0.00 0.00 68.15 68.93 3hk9 h THR 109 CO -0.07 0.63 -0.45 0.54 -0.25 0.00 0.00 175.52 175.92 3hk9 n ARG 110 N -3.40 -1.63 -2.89 4.72 1.74 -0.81 -4.89 116.66 109.50 3hk9 n ARG 110 Ca 0.01 1.04 -0.44 0.00 -0.77 0.00 0.00 57.85 57.69 3hk9 n ARG 110 Cb 0.74 -5.58 -0.01 0.00 -1.02 0.00 0.00 32.46 26.59 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 -2.30 6.87 0.25 0.55 -1.08 -1.26 -4.86 116.67 114.85 3hk9 s ASP 111 Ca 0.00 -2.55 -0.05 0.00 -0.52 0.00 0.00 52.55 49.43 3hk9 s ASP 111 Cb 0.00 -2.42 0.31 0.00 -1.46 0.00 0.00 42.92 39.34 3hk9 s ASP 111 CO 0.00 -0.92 1.91 0.25 0.52 0.00 0.00 175.17 176.93 3hk9 h LEU 112 N 10.32 1.12 -0.98 -1.34 5.85 -1.98 -1.54 115.31 126.76 3hk9 h LEU 112 Ca 0.26 -0.02 0.01 0.00 0.84 0.00 0.00 57.88 58.97 3hk9 h LEU 112 Cb 0.93 -0.26 -0.05 0.00 0.37 0.00 0.00 40.66 41.65 3hk9 h LEU 112 CO 1.22 0.78 0.64 1.56 -0.34 0.00 0.00 178.44 182.30 3hk9 h GLN 113 N 1.31 1.30 -0.43 1.25 1.08 -2.00 -1.10 115.11 116.51 3hk9 h GLN 113 Ca 0.39 -0.09 -0.14 0.00 -1.45 0.00 0.00 58.65 57.36 3hk9 h GLN 113 Cb -0.05 -0.29 -0.01 0.00 -0.05 0.00 0.00 27.48 27.08 3hk9 h GLN 113 CO -0.11 0.87 -0.30 0.28 -0.95 0.00 0.00 178.83 178.62 3hk9 h VAL 114 N 1.34 1.27 -0.96 -0.54 2.07 -1.80 -2.62 116.25 115.01 3hk9 h VAL 114 Ca 0.36 -1.47 0.03 0.00 0.82 0.00 0.00 66.70 66.44 3hk9 h VAL 114 Cb -0.14 1.25 -0.05 0.00 -1.52 0.00 0.00 31.29 30.83 3hk9 h VAL 114 CO -0.08 0.50 0.63 1.88 0.02 0.00 0.00 177.57 180.52 3hk9 h TYR 115 N 0.80 1.19 -0.76 1.57 0.05 -0.67 -2.52 116.97 116.64 3hk9 h TYR 115 Ca 0.09 0.03 -0.01 0.00 0.05 0.00 0.00 58.73 58.88 3hk9 h TYR 115 Cb 0.88 -0.40 -0.04 0.00 1.01 0.00 0.00 36.73 38.19 3hk9 h TYR 115 CO 0.06 0.71 0.42 0.00 -1.05 0.00 0.00 178.16 178.30 3hk9 h ARG 116 N 1.24 1.06 -0.87 4.88 3.08 -1.01 -2.69 114.38 120.08 3hk9 h ARG 116 Ca 0.37 -0.12 0.13 0.00 0.07 0.00 0.00 59.98 60.44 3hk9 h ARG 116 Cb -0.05 -0.21 -0.07 0.00 0.08 0.00 0.00 29.97 29.72 3hk9 h ARG 116 CO -0.11 0.78 0.56 0.93 -1.07 0.00 0.00 179.97 181.06 3hk9 h GLU 117 N 1.05 0.66 -0.45 0.04 5.08 -1.08 -1.90 114.58 117.98 3hk9 h GLU 117 Ca 0.27 -0.04 0.07 0.00 -1.00 0.00 0.00 59.36 58.66 3hk9 h GLU 117 Cb 0.02 -0.15 -0.06 0.00 0.50 0.00 0.00 28.75 29.06 3hk9 h GLU 117 CO -0.04 0.44 0.09 -0.92 -1.00 0.00 0.00 179.01 177.58 3hk9 h TYR 118 N 0.68 0.15 -0.17 4.33 3.20 -1.45 -2.86 116.97 120.86 3hk9 h TYR 118 Ca 0.43 0.03 -0.17 0.00 3.14 0.00 0.00 58.73 62.15 3hk9 h TYR 118 Cb 0.68 -0.00 -0.00 0.00 1.54 0.00 0.00 36.73 38.94 3hk9 h TYR 118 CO -0.00 0.01 -0.60 0.74 -1.64 0.00 0.00 178.16 176.67 3hk9 h PHE 119 N 0.23 0.74 -0.72 -3.82 0.04 -1.45 -3.27 116.94 108.69 3hk9 h PHE 119 Ca 0.22 -0.28 0.05 0.00 2.80 0.00 0.00 57.97 60.76 3hk9 h PHE 119 Cb 0.28 -0.13 -0.04 0.00 2.20 0.00 0.00 35.95 38.26 3hk9 h PHE 119 CO -0.21 1.03 0.47 0.00 -0.60 0.00 0.00 178.31 179.00 3hk9 h ALA 120 N 0.91 1.63 -0.68 2.45 0.00 -1.24 -2.85 119.26 119.48 3hk9 h ALA 120 Ca -0.00 -0.03 -0.55 0.00 0.00 0.00 0.00 54.91 54.33 3hk9 h ALA 120 Cb 1.16 -0.22 -0.20 0.00 0.00 0.00 0.00 17.79 18.52 3hk9 h ALA 120 CO 0.11 0.28 0.60 0.36 0.00 0.00 0.00 179.25 180.60 3hk9 n LYS 121 N -4.47 2.40 -3.53 0.00 2.85 -1.17 -4.88 118.16 109.36 3hk9 n LYS 121 Ca 0.10 -2.56 -0.18 0.00 -1.05 0.00 0.00 58.31 54.61 3hk9 n LYS 121 Cb 0.16 -2.09 -0.06 0.00 -0.65 0.00 0.00 35.03 32.39 3hk9 n LYS 121 CO 0.00 0.00 0.00 0.21 -0.05 0.00 0.00 177.40 177.56 3hk9 s LYS 122 N -2.48 1.05 0.50 -1.58 2.20 -1.08 -5.07 119.74 113.27 3hk9 s LYS 122 Ca 0.53 0.27 0.05 0.00 -0.36 0.00 0.00 55.97 56.46 3hk9 s LYS 122 Cb 0.38 0.50 0.03 0.00 -1.51 0.00 0.00 37.83 37.23 3hk9 s LYS 122 CO -0.20 -0.32 0.68 0.95 -0.36 0.00 0.00 175.35 176.10 3hk9 s THR 123 N -1.16 2.77 0.14 3.43 -4.23 -1.26 -4.96 115.64 110.37 3hk9 s THR 123 Ca -0.11 -0.85 -0.15 0.00 -1.18 0.00 0.00 61.69 59.40 3hk9 s THR 123 Cb -0.00 -2.91 0.01 0.00 1.34 0.00 0.00 72.50 70.94 3hk9 s THR 123 CO 0.10 0.00 1.69 0.28 -0.54 0.00 0.00 174.62 176.14 3hk9 h SER 124 N 0.34 0.62 -0.77 3.99 0.02 -1.97 -1.26 113.55 114.50 3hk9 h SER 124 Ca -0.40 -0.17 0.01 0.00 -0.84 0.00 0.00 61.79 60.38 3hk9 h SER 124 Cb 1.29 -0.16 -0.04 0.00 0.14 0.00 0.00 62.40 63.63 3hk9 h SER 124 CO 0.47 0.63 0.50 -0.33 -1.14 0.00 0.00 176.83 176.96 3hk9 h GLU 125 N 0.58 1.03 -0.42 3.45 3.07 -1.95 -1.28 114.58 119.05 3hk9 h GLU 125 Ca 0.15 -0.07 -0.15 0.00 -0.50 0.00 0.00 59.36 58.79 3hk9 h GLU 125 Cb 0.20 -0.23 -0.01 0.00 -0.84 0.00 0.00 28.75 27.88 3hk9 h GLU 125 CO -0.01 0.69 -0.33 0.93 -1.40 0.00 0.00 179.01 178.89 3hk9 h GLU 126 N 1.05 0.97 -0.14 2.33 5.08 -1.90 -2.51 114.58 119.46 3hk9 h GLU 126 Ca 0.28 -0.48 -0.10 0.00 -1.00 0.00 0.00 59.36 58.06 3hk9 h GLU 126 Cb -0.11 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.13 3hk9 h GLU 126 CO -0.06 1.14 -0.37 0.37 -1.00 0.00 0.00 179.01 179.09 3hk9 h GLN 127 N 0.81 0.30 -0.24 2.33 5.75 -1.02 -1.22 115.11 121.81 3hk9 h GLN 127 Ca 0.08 -0.13 -0.02 0.00 -0.15 0.00 0.00 58.65 58.42 3hk9 h GLN 127 Cb 0.92 -0.01 -0.01 0.00 1.07 0.00 0.00 27.48 29.45 3hk9 h GLN 127 CO 0.09 0.63 0.06 0.28 -2.65 0.00 0.00 178.83 177.24 3hk9 h VAL 128 N 0.25 1.21 -0.03 2.39 2.07 -1.12 0.30 116.25 121.33 3hk9 h VAL 128 Ca 0.03 -0.69 0.02 0.00 0.82 0.00 0.00 66.70 66.88 3hk9 h VAL 128 Cb 0.77 1.20 -0.02 0.00 -1.52 0.00 0.00 31.29 31.72 3hk9 h VAL 128 CO 0.06 0.22 -0.09 0.44 0.02 0.00 0.00 177.57 178.22 3hk9 h ASP 129 N 0.22 -0.27 0.23 0.57 3.32 -1.18 -0.59 116.42 118.73 3hk9 h ASP 129 Ca 0.08 0.05 0.01 0.00 0.02 0.00 0.00 57.03 57.18 3hk9 h ASP 129 Cb 0.28 0.12 -0.04 0.00 0.22 0.00 0.00 39.33 39.91 3hk9 h ASP 129 CO 0.00 -0.13 -0.39 0.74 -1.72 0.00 0.00 179.24 177.74 3hk9 h THR 130 N -0.14 0.20 -0.70 0.35 2.02 -1.04 -2.03 112.91 111.56 3hk9 h THR 130 Ca 0.05 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.22 3hk9 h THR 130 Cb 0.20 0.20 -0.03 0.00 -1.74 0.00 0.00 68.15 66.78 3hk9 h THR 130 CO -0.11 0.00 0.42 0.58 0.37 0.00 0.00 175.52 176.77 3hk9 h VAL 131 N -0.70 1.20 -0.16 3.16 2.07 -0.80 -0.33 116.25 120.69 3hk9 h VAL 131 Ca 0.00 -0.45 -0.06 0.00 0.82 0.00 0.00 66.70 67.01 3hk9 h VAL 131 Cb 0.68 0.24 -0.01 0.00 -1.52 0.00 0.00 31.29 30.68 3hk9 h VAL 131 CO -0.16 0.21 -0.17 -0.07 0.02 0.00 0.00 177.57 177.40 3hk9 h LEU 132 N 0.95 0.25 -0.03 2.57 3.38 -1.03 0.44 115.31 121.84 3hk9 h LEU 132 Ca 0.25 -0.06 -0.02 0.00 0.09 0.00 0.00 57.88 58.14 3hk9 h LEU 132 Cb -0.03 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 40.66 3hk9 h LEU 132 CO -0.05 0.44 -0.07 -0.61 0.09 0.00 0.00 178.44 178.25 3hk9 h GLN 133 N 0.24 0.10 -0.54 1.13 -0.00 -0.87 -0.82 115.11 114.35 3hk9 h GLN 133 Ca 0.05 -0.07 -0.07 0.00 -0.00 0.00 0.00 58.65 58.56 3hk9 h GLN 133 Cb 0.45 0.01 -0.02 0.00 0.00 0.00 0.00 27.48 27.92 3hk9 h GLN 133 CO 0.03 0.65 0.04 -0.07 0.00 0.00 0.00 178.83 179.48 3hk9 h LEU 134 N -0.44 0.85 -0.71 -2.39 3.38 -0.86 -2.46 115.31 112.68 3hk9 h LEU 134 Ca 0.00 -0.20 0.00 0.00 0.09 0.00 0.00 57.88 57.77 3hk9 h LEU 134 Cb 0.65 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 41.18 3hk9 h LEU 134 CO 0.01 0.89 -0.10 0.00 0.09 0.00 0.00 178.44 179.34 3hk9 n ALA 135 N -2.47 2.77 -3.90 1.53 0.00 0.13 -4.95 120.51 113.62 3hk9 n ALA 135 Ca 0.03 -0.41 -0.25 0.00 0.00 0.00 0.00 53.44 52.81 3hk9 n ALA 135 Cb 0.29 -1.18 -0.00 0.00 0.00 0.00 0.00 19.45 18.56 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 -0.24 -1.07 -4.40 0.00 5.15 -0.43 -4.81 115.26 109.47 3hk9 n ASN 136 Ca 0.17 -0.94 -0.37 0.00 -0.60 0.00 0.00 54.58 52.84 3hk9 n ASN 136 Cb 0.34 -3.38 -0.13 0.00 -0.53 0.00 0.00 39.78 36.08 3hk9 n ASN 136 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 3hk9 s VAL 137 N -3.79 4.14 -0.04 3.44 1.01 -0.53 -1.04 120.40 123.60 3hk9 s VAL 137 Ca 0.10 -0.39 -0.10 0.00 0.00 0.00 0.00 61.98 61.59 3hk9 s VAL 137 Cb -0.05 -3.02 -0.30 0.00 0.00 0.00 0.00 36.38 33.01 3hk9 s VAL 137 CO 0.87 0.24 0.69 0.77 0.00 0.00 0.00 175.10 177.66 3hk9 h SER 138 N 8.24 0.59 -3.81 3.32 4.64 -1.28 -3.45 113.55 121.80 3hk9 h SER 138 Ca -0.36 -0.89 -0.42 0.00 -0.47 0.00 0.00 61.79 59.65 3hk9 h SER 138 Cb 1.15 -0.19 -0.31 0.00 -0.31 0.00 0.00 62.40 62.74 3hk9 h SER 138 CO 0.59 1.75 -0.79 -1.81 -0.87 0.00 0.00 176.83 175.71 3hk9 s ASP 139 N -7.26 1.19 -0.15 4.97 1.01 -1.07 -4.71 116.67 110.65 3hk9 s ASP 139 Ca -0.15 -0.18 0.02 0.00 0.71 0.00 0.00 52.55 52.95 3hk9 s ASP 139 Cb 0.06 -0.32 0.01 0.00 1.01 0.00 0.00 42.92 43.68 3hk9 s ASP 139 CO 0.85 0.06 -0.21 -0.69 0.21 0.00 0.00 175.17 175.39 3hk9 s VAL 140 N 0.20 2.05 -0.16 -1.27 1.01 0.01 -0.20 120.40 122.03 3hk9 s VAL 140 Ca -0.03 -0.96 -0.14 0.00 0.00 0.00 0.00 61.98 60.84 3hk9 s VAL 140 Cb -0.08 -1.82 -0.05 0.00 0.00 0.00 0.00 36.38 34.43 3hk9 s VAL 140 CO 0.00 0.54 0.32 -0.69 0.00 0.00 0.00 175.10 175.28 3hk9 s VAL 141 N 0.95 5.29 0.72 2.92 1.01 0.27 -0.48 120.40 131.08 3hk9 s VAL 141 Ca -0.04 0.61 0.00 0.00 0.00 0.00 0.00 61.98 62.55 3hk9 s VAL 141 Cb -0.15 -3.66 0.14 0.00 0.00 0.00 0.00 36.38 32.71 3hk9 s VAL 141 CO -0.05 0.37 1.00 -0.04 0.00 0.00 0.00 175.10 176.38 3hk9 s MET 142 N 0.55 1.63 -0.28 2.72 -1.94 0.79 -1.58 119.30 121.20 3hk9 s MET 142 Ca 0.18 -1.24 0.02 0.00 -1.71 0.00 0.00 55.69 52.93 3hk9 s MET 142 Cb -0.13 -2.35 0.08 0.00 2.01 0.00 0.00 34.83 34.43 3hk9 s MET 142 CO 0.05 -1.47 -0.01 0.99 -0.01 0.00 0.00 175.02 174.56 3hk9 s THR 143 N -3.13 1.80 -0.39 2.05 2.01 -1.14 -3.63 115.64 113.22 3hk9 s THR 143 Ca 0.67 -1.68 -0.08 0.00 0.31 0.00 0.00 61.69 60.91 3hk9 s THR 143 Cb -0.05 -2.15 0.06 0.00 0.01 0.00 0.00 72.50 70.38 3hk9 s THR 143 CO 0.44 -0.32 0.20 0.20 -0.69 0.00 0.00 174.62 174.46 3hk9 s ASN 144 N 1.21 5.52 -0.56 3.53 -0.87 -0.26 -4.95 114.94 118.56 3hk9 s ASN 144 Ca 0.01 -1.36 -0.18 0.00 -1.57 0.00 0.00 52.86 49.75 3hk9 s ASN 144 Cb -0.19 -1.94 0.10 0.00 -0.02 0.00 0.00 41.25 39.20 3hk9 s ASN 144 CO -0.09 -0.45 0.62 -0.62 -2.57 0.00 0.00 177.10 173.99 3hk9 s ASP 145 N 1.81 6.19 0.31 -1.22 -1.08 -1.26 -1.82 116.67 119.60 3hk9 s ASP 145 Ca 0.02 -1.42 0.24 0.00 -0.52 0.00 0.00 52.55 50.87 3hk9 s ASP 145 Cb -0.21 -2.27 1.12 0.00 -1.46 0.00 0.00 42.92 40.10 3hk9 s ASP 145 CO 0.02 -0.98 1.74 1.55 0.52 0.00 0.00 175.17 178.02 3hk9 h PRO 146 N 9.05 0.00 0.00 4.34 0.13 -1.93 -1.75 132.00 141.85 3hk9 h PRO 146 Ca -0.29 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.84 3hk9 h PRO 146 Cb 1.09 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.22 3hk9 h PRO 146 CO 1.05 0.00 -0.20 1.19 -0.23 0.00 0.00 178.00 179.81 3hk9 n PHE 147 N -2.34 0.66 -2.75 1.56 3.72 -1.26 -4.38 117.46 112.66 3hk9 n PHE 147 Ca 0.01 0.19 -0.42 0.00 -0.05 0.00 0.00 57.45 57.17 3hk9 n PHE 147 Cb 0.17 -0.77 -0.03 0.00 -0.94 0.00 0.00 39.48 37.91 3hk9 n PHE 147 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 3hk9 s ASP 148 N -4.16 7.06 0.20 4.37 2.15 -0.66 -4.93 116.67 120.71 3hk9 s ASP 148 Ca 0.10 1.32 -0.10 0.00 0.43 0.00 0.00 52.55 54.30 3hk9 s ASP 148 Cb 0.14 -2.51 0.24 0.00 -0.30 0.00 0.00 42.92 40.49 3hk9 s ASP 148 CO 0.63 -0.53 1.78 0.44 -0.17 0.00 0.00 175.17 177.32 3hk9 h ASP 149 N 7.37 0.38 -0.53 -0.34 3.32 -1.86 0.15 116.42 124.90 3hk9 h ASP 149 Ca -0.25 0.05 -0.02 0.00 0.02 0.00 0.00 57.03 56.83 3hk9 h ASP 149 Cb 1.10 -0.01 -0.02 0.00 0.22 0.00 0.00 39.33 40.62 3hk9 h ASP 149 CO 0.90 0.24 0.27 0.78 -1.72 0.00 0.00 179.24 179.70 3hk9 h ASN 150 N 0.53 0.69 -0.31 6.45 2.35 -1.94 -2.05 115.58 121.30 3hk9 h ASN 150 Ca 0.29 -0.12 -0.14 0.00 -0.55 0.00 0.00 56.30 55.78 3hk9 h ASN 150 Cb 0.27 -0.18 -0.00 0.00 0.05 0.00 0.00 38.32 38.46 3hk9 h ASN 150 CO -0.23 0.62 -0.36 -0.33 -1.65 0.00 0.00 177.43 175.48 3hk9 h GLU 151 N 0.72 0.80 -0.80 0.81 5.08 -1.71 -3.20 114.58 116.28 3hk9 h GLU 151 Ca 0.18 -0.44 -0.04 0.00 -1.00 0.00 0.00 59.36 58.07 3hk9 h GLU 151 Cb 0.10 0.02 -0.04 0.00 0.50 0.00 0.00 28.75 29.34 3hk9 h GLU 151 CO -0.02 1.07 0.36 -0.09 -1.00 0.00 0.00 179.01 179.32 3hk9 h ARG 152 N 0.57 1.18 -0.77 2.33 2.43 -0.59 -2.80 114.38 116.73 3hk9 h ARG 152 Ca 0.04 -0.19 -0.05 0.00 -0.81 0.00 0.00 59.98 58.97 3hk9 h ARG 152 Cb 0.94 -0.20 -0.03 0.00 -0.42 0.00 0.00 29.97 30.26 3hk9 h ARG 152 CO 0.09 0.93 0.28 0.97 -1.51 0.00 0.00 179.97 180.72 3hk9 h ILE 153 N 1.16 1.26 -0.30 1.20 6.09 -1.42 -1.61 117.51 123.88 3hk9 h ILE 153 Ca 0.27 -0.86 0.03 0.00 -1.37 0.00 0.00 64.86 62.93 3hk9 h ILE 153 Cb 0.16 0.38 -0.03 0.00 0.47 0.00 0.00 36.82 37.80 3hk9 h ILE 153 CO -0.03 0.35 0.12 0.28 -3.07 0.00 0.00 178.15 175.80 3hk9 h SER 154 N 1.13 0.15 -0.41 2.19 0.02 -1.49 0.80 113.55 115.94 3hk9 h SER 154 Ca 0.25 0.03 -0.08 0.00 -0.84 0.00 0.00 61.79 61.15 3hk9 h SER 154 Cb 0.26 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.79 3hk9 h SER 154 CO -0.01 0.13 -0.05 -0.50 -1.14 0.00 0.00 176.83 175.25 3hk9 h TRP 155 N 0.27 0.85 -0.14 3.45 4.06 -1.37 0.31 115.95 123.37 3hk9 h TRP 155 Ca 0.13 -0.17 -0.06 0.00 2.06 0.00 0.00 58.89 60.85 3hk9 h TRP 155 Cb 0.08 -0.21 -0.01 0.00 -1.00 0.00 0.00 29.16 28.02 3hk9 h TRP 155 CO -0.12 0.86 -0.20 -0.07 -3.56 0.00 0.00 178.44 175.36 3hk9 h LEU 156 N 0.59 0.23 -2.41 -4.49 3.38 -1.07 -2.59 115.31 108.95 3hk9 h LEU 156 Ca 0.11 -0.06 -0.07 0.00 0.09 0.00 0.00 57.88 57.95 3hk9 h LEU 156 Cb 0.56 -0.06 -0.04 0.00 0.09 0.00 0.00 40.66 41.21 3hk9 h LEU 156 CO 0.03 0.45 0.08 -0.62 0.09 0.00 0.00 178.44 178.48 3hk9 n GLU 157 N -4.21 2.50 -0.38 1.13 1.02 0.26 -4.90 120.64 116.06 3hk9 n GLU 157 Ca -0.01 -1.47 0.00 0.00 -0.02 0.00 0.00 57.16 55.66 3hk9 n GLU 157 Cb 0.32 -1.78 0.00 0.00 -0.02 0.00 0.00 31.44 29.96 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 0.14 1.30 3.69 0.62 0.00 -0.98 -5.02 105.19 104.94 3hk9 n GLY 158 Ca 0.17 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.75 3hk9 n GLY 158 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3hk9 n LYS 159 N -2.00 2.58 -4.20 1.61 4.76 0.08 -4.99 118.16 116.00 3hk9 n LYS 159 Ca 0.00 0.94 -0.17 0.00 -2.87 0.00 0.00 58.31 56.20 3hk9 n LYS 159 Cb 0.00 -2.80 -0.15 0.00 -1.84 0.00 0.00 35.03 30.24 3hk9 n LYS 159 CO 0.00 0.00 0.00 -0.65 -1.37 0.00 0.00 177.40 175.38 3hk9 s GLN 160 N 2.46 0.57 0.62 1.97 -0.21 -1.26 -4.54 119.66 119.28 3hk9 s GLN 160 Ca 0.82 -0.19 -0.17 0.00 0.02 0.00 0.00 55.36 55.85 3hk9 s GLN 160 Cb -0.55 -0.57 -0.02 0.00 1.00 0.00 0.00 33.01 32.87 3hk9 s GLN 160 CO 0.39 0.08 1.14 -1.25 -2.12 0.00 0.00 175.29 173.53 3hk9 s PRO 161 N 0.14 2.90 0.98 2.91 0.04 -1.26 -4.96 135.00 135.74 3hk9 s PRO 161 Ca -0.01 1.58 -0.15 0.00 0.04 0.00 0.00 61.00 62.46 3hk9 s PRO 161 Cb -0.06 -1.95 0.18 0.00 0.04 0.00 0.00 34.50 32.72 3hk9 s PRO 161 CO -0.00 -1.21 1.18 0.16 0.04 0.00 0.00 177.00 177.17 3hk9 s ASP 162 N -2.11 2.94 0.57 6.66 1.47 -1.26 -4.87 116.67 120.07 3hk9 s ASP 162 Ca 0.71 0.70 0.30 0.00 1.18 0.00 0.00 52.55 55.44 3hk9 s ASP 162 Cb -0.24 -1.06 1.46 0.00 -0.34 0.00 0.00 42.92 42.73 3hk9 s ASP 162 CO 0.36 -2.88 1.87 0.28 0.68 0.00 0.00 175.17 175.48 3hk9 h SER 163 N -1.73 0.00 1.36 2.11 0.02 -2.01 -1.55 113.55 111.75 3hk9 h SER 163 Ca -0.47 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.48 3hk9 h SER 163 Cb 1.30 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.84 3hk9 h SER 163 CO 0.50 0.00 0.00 0.54 -1.14 0.00 0.00 176.83 176.73 3hk9 n ARG 164 N -3.91 0.24 -4.78 3.45 1.74 -1.26 -4.81 116.66 107.33 3hk9 n ARG 164 Ca 0.13 0.22 -0.33 0.00 -0.77 0.00 0.00 57.85 57.10 3hk9 n ARG 164 Cb 0.82 -1.79 -0.14 0.00 -1.02 0.00 0.00 32.46 30.33 3hk9 n ARG 164 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 3hk9 s PHE 165 N -3.12 2.80 0.10 -1.55 0.08 -0.59 -0.81 117.98 114.90 3hk9 s PHE 165 Ca 0.10 -0.44 0.10 0.00 0.12 0.00 0.00 56.93 56.81 3hk9 s PHE 165 Cb 0.12 -1.78 -0.04 0.00 -0.57 0.00 0.00 43.02 40.76 3hk9 s PHE 165 CO 0.57 -0.05 -0.27 -1.01 -0.10 0.00 0.00 175.22 174.36 3hk9 s HIS 166 N -0.03 2.29 0.26 0.36 3.76 0.37 -4.62 115.29 117.68 3hk9 s HIS 166 Ca -0.03 -0.39 -0.08 0.00 -0.15 0.00 0.00 55.06 54.41 3hk9 s HIS 166 Cb -0.14 -1.28 -0.06 0.00 1.11 0.00 0.00 32.58 32.21 3hk9 s HIS 166 CO 0.04 0.27 0.55 0.00 -0.85 0.00 0.00 174.74 174.75 3hk9 s ALA 167 N -0.98 3.59 -0.05 -1.40 0.00 -1.26 -0.15 121.76 121.51 3hk9 s ALA 167 Ca 0.13 -0.39 -0.02 0.00 0.00 0.00 0.00 51.96 51.68 3hk9 s ALA 167 Cb -0.10 -2.38 0.03 0.00 0.00 0.00 0.00 23.12 20.67 3hk9 s ALA 167 CO 0.05 0.39 0.07 0.00 0.00 0.00 0.00 175.76 176.27 3hk9 s ALA 168 N -1.94 0.16 -0.62 0.00 0.00 -1.24 -0.72 121.76 117.41 3hk9 s ALA 168 Ca 0.46 0.25 -0.27 0.00 0.00 0.00 0.00 51.96 52.40 3hk9 s ALA 168 Cb -0.11 -0.63 0.01 0.00 0.00 0.00 0.00 23.12 22.40 3hk9 s ALA 168 CO 0.25 -0.48 1.42 -1.17 0.00 0.00 0.00 175.76 175.79 3hk9 s LEU 169 N 2.12 3.33 0.01 0.00 2.96 -0.87 -1.11 118.68 125.12 3hk9 s LEU 169 Ca 0.04 0.09 -0.27 0.00 -0.22 0.00 0.00 54.13 53.76 3hk9 s LEU 169 Cb -0.12 -2.86 -0.04 0.00 0.50 0.00 0.00 46.19 43.67 3hk9 s LEU 169 CO -0.03 -1.82 0.85 -0.60 -1.32 0.00 0.00 176.35 173.43 3hk9 s ARG 170 N 5.74 4.53 -0.10 1.98 6.06 -0.75 -0.87 118.95 135.54 3hk9 s ARG 170 Ca 0.49 1.20 0.13 0.00 -2.50 0.00 0.00 55.73 55.05 3hk9 s ARG 170 Cb -0.10 -3.42 0.25 0.00 0.06 0.00 0.00 34.95 31.73 3hk9 s ARG 170 CO 0.22 0.10 1.12 1.28 -2.50 0.00 0.00 175.30 175.52 3hk9 n LEU 171 N 3.45 1.71 -0.24 -0.88 4.77 0.05 -4.42 117.00 121.44 3hk9 n LEU 171 Ca 0.02 -2.60 0.04 0.00 -0.03 0.00 0.00 56.01 53.44 3hk9 n LEU 171 Cb 0.51 -0.30 0.15 0.00 -2.33 0.00 0.00 43.42 41.44 3hk9 n LEU 171 CO 0.49 0.68 0.86 0.44 -1.33 0.00 0.00 177.39 178.54 3hk9 h ASP 172 N 0.23 -0.20 -0.72 -1.43 5.19 -1.92 -1.88 116.42 115.69 3hk9 h ASP 172 Ca -0.02 0.17 -0.03 0.00 -0.62 0.00 0.00 57.03 56.53 3hk9 h ASP 172 Cb 1.17 0.27 -0.03 0.00 0.18 0.00 0.00 39.33 40.92 3hk9 h ASP 172 CO 0.01 -0.12 0.35 -0.65 -3.12 0.00 0.00 179.24 175.71 3hk9 h PRO 173 N 0.16 1.05 -0.08 3.56 0.11 -1.95 0.16 132.00 135.01 3hk9 h PRO 173 Ca 0.39 -0.15 -0.02 0.00 0.11 0.00 0.00 66.00 66.33 3hk9 h PRO 173 Cb 0.67 -0.19 -0.00 0.00 0.11 0.00 0.00 31.00 31.58 3hk9 h PRO 173 CO -0.58 0.81 -0.04 1.25 -0.21 0.00 0.00 178.00 179.24 3hk9 h LEU 174 N 1.05 0.18 0.07 2.35 5.85 -1.68 -1.72 115.31 121.40 3hk9 h LEU 174 Ca 0.25 -0.42 -0.25 0.00 0.84 0.00 0.00 57.88 58.30 3hk9 h LEU 174 Cb 0.11 -0.05 -0.00 0.00 0.37 0.00 0.00 40.66 41.09 3hk9 h LEU 174 CO -0.03 0.56 -1.16 -0.07 -0.34 0.00 0.00 178.44 177.40 3hk9 h LEU 175 N -0.19 0.33 -0.47 2.25 4.07 -1.31 -3.21 115.31 116.78 3hk9 h LEU 175 Ca 0.02 -0.34 0.00 0.00 0.08 0.00 0.00 57.88 57.64 3hk9 h LEU 175 Cb 0.49 -0.11 0.00 0.00 1.08 0.00 0.00 40.66 42.12 3hk9 h LEU 175 CO 0.01 1.25 -0.60 0.59 -1.08 0.00 0.00 178.44 178.62 3hk9 n ASN 176 N -3.51 1.29 -2.64 -0.43 3.02 0.57 -3.87 115.26 109.68 3hk9 n ASN 176 Ca -0.06 -1.15 -0.00 0.00 -0.03 0.00 0.00 54.58 53.34 3hk9 n ASN 176 Cb 0.99 0.73 0.06 0.00 -0.61 0.00 0.00 39.78 40.95 3hk9 n ASN 176 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3hk9 n GLU 177 N -0.74 1.47 -0.29 3.52 1.02 -0.65 -4.95 120.64 120.02 3hk9 n GLU 177 Ca 0.05 -2.95 0.17 0.00 -0.02 0.00 0.00 57.16 54.41 3hk9 n GLU 177 Cb 0.33 -1.09 0.44 0.00 -0.02 0.00 0.00 31.44 31.09 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 2.15 0.74 -0.58 -0.32 3.20 -1.54 0.12 116.97 120.74 3hk9 h TYR 178 Ca -0.21 0.02 0.05 0.00 3.14 0.00 0.00 58.73 61.73 3hk9 h TYR 178 Cb 1.34 -0.23 -0.03 0.00 1.54 0.00 0.00 36.73 39.35 3hk9 h TYR 178 CO 0.37 0.19 0.38 0.93 -1.64 0.00 0.00 178.16 178.39 3hk9 h GLU 179 N 0.55 0.60 0.08 1.82 4.39 -1.90 0.21 114.58 120.33 3hk9 h GLU 179 Ca 0.51 -0.04 -0.36 0.00 0.34 0.00 0.00 59.36 59.81 3hk9 h GLU 179 Cb 1.06 -0.13 -0.03 0.00 -0.10 0.00 0.00 28.75 29.54 3hk9 h GLU 179 CO -0.25 0.39 -2.10 1.04 -1.16 0.00 0.00 179.01 176.94 3hk9 n GLN 180 N -4.47 0.72 0.20 2.33 3.00 -0.55 -4.42 117.38 114.19 3hk9 n GLN 180 Ca 0.07 0.23 0.05 0.00 -0.01 0.00 0.00 57.00 57.34 3hk9 n GLN 180 Cb 0.19 -1.67 0.41 0.00 0.00 0.00 0.00 30.24 29.17 3hk9 n GLN 180 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.06 178.21 3hk9 h THR 181 N 0.05 1.05 -0.16 5.09 2.02 -0.56 -3.11 112.91 117.29 3hk9 h THR 181 Ca -0.45 -1.23 0.00 0.00 0.77 0.00 0.00 66.41 65.50 3hk9 h THR 181 Cb 2.01 1.70 -0.01 0.00 -1.74 0.00 0.00 68.15 70.11 3hk9 h THR 181 CO 0.04 0.33 0.10 0.07 0.37 0.00 0.00 175.52 176.43 3hk9 h LYS 182 N 0.00 0.21 0.00 6.66 2.10 -0.79 -1.19 116.57 123.57 3hk9 h LYS 182 Ca -0.00 -0.01 -0.07 0.00 -2.00 0.00 0.00 60.65 58.56 3hk9 h LYS 182 Cb 0.67 -0.05 -0.01 0.00 -0.90 0.00 0.00 32.23 31.95 3hk9 h LYS 182 CO 0.04 0.14 -0.35 0.45 -2.00 0.00 0.00 179.45 177.74 3hk9 h HIS 183 N 0.21 0.00 0.05 0.07 3.86 -1.80 -2.40 115.15 115.15 3hk9 h HIS 183 Ca 0.06 0.00 -0.23 0.00 -1.16 0.00 0.00 60.37 59.04 3hk9 h HIS 183 Cb -0.02 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 28.44 3hk9 h HIS 183 CO 0.00 0.35 -1.06 0.00 0.86 0.00 0.00 177.93 178.07 3hk9 h ARG 184 N 0.00 0.12 -0.32 2.45 3.08 -1.38 -2.59 114.38 115.74 3hk9 h ARG 184 Ca -0.00 -0.19 -0.02 0.00 0.07 0.00 0.00 59.98 59.84 3hk9 h ARG 184 Cb 0.74 0.07 -0.01 0.00 0.08 0.00 0.00 29.97 30.85 3hk9 h ARG 184 CO 0.05 1.06 0.11 -0.07 -1.07 0.00 0.00 179.97 180.05 3hk9 h LEU 185 N 0.04 0.46 -1.52 3.04 3.38 -1.08 -1.70 115.31 117.92 3hk9 h LEU 185 Ca -0.06 -0.19 -0.05 0.00 0.09 0.00 0.00 57.88 57.67 3hk9 h LEU 185 Cb 1.80 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 42.42 3hk9 h LEU 185 CO 0.16 0.52 -0.25 0.08 0.09 0.00 0.00 178.44 179.04 3hk9 h ARG 186 N 0.37 0.00 0.00 1.13 0.11 -1.21 0.10 114.38 114.88 3hk9 h ARG 186 Ca 0.11 0.00 -0.07 0.00 0.10 0.00 0.00 59.98 60.12 3hk9 h ARG 186 Cb 0.22 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.29 3hk9 h ARG 186 CO -0.01 0.25 -0.32 -0.44 0.10 0.00 0.00 179.97 179.55 3hk9 h ASP 187 N 0.00 0.00 -0.56 0.08 3.32 -0.99 -2.56 116.42 115.72 3hk9 h ASP 187 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3hk9 h ASP 187 Cb 0.49 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.04 3hk9 h ASP 187 CO 0.03 0.32 0.00 0.79 -1.72 0.00 0.00 179.24 178.66 3hk9 n TRP 188 N -3.68 0.94 -0.32 4.55 8.01 -0.36 -4.92 117.44 121.66 3hk9 n TRP 188 Ca -0.01 -0.42 0.00 0.00 -1.31 0.00 0.00 57.50 55.76 3hk9 n TRP 188 Cb 0.43 -0.08 0.00 0.00 -2.01 0.00 0.00 31.31 29.64 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 1.24 0.66 3.44 6.99 0.00 -0.96 -5.03 105.19 111.53 3hk9 n GLY 189 Ca 0.20 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.78 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 -2.65 2.91 -0.74 1.61 2.02 0.21 -4.95 117.35 115.76 3hk9 s TYR 190 Ca 0.00 -0.59 -0.08 0.00 -0.37 0.00 0.00 57.07 56.03 3hk9 s TYR 190 Cb 0.00 -3.93 -0.07 0.00 -0.40 0.00 0.00 41.96 37.56 3hk9 s TYR 190 CO 0.00 -1.30 1.91 1.63 -1.57 0.00 0.00 175.55 176.22 3hk9 n LYS 191 N 6.77 1.64 -2.56 -0.62 5.02 -1.26 -2.67 118.16 124.48 3hk9 n LYS 191 Ca -0.06 -1.38 -0.41 0.00 -2.02 0.00 0.00 58.31 54.45 3hk9 n LYS 191 Cb 0.45 -2.47 -0.04 0.00 -0.02 0.00 0.00 35.03 32.95 3hk9 n LYS 191 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 3hk9 s VAL 192 N 3.98 3.98 0.71 -0.18 -7.23 -1.26 -4.47 120.40 115.93 3hk9 s VAL 192 Ca 0.37 1.71 -0.02 0.00 -1.81 0.00 0.00 61.98 62.23 3hk9 s VAL 192 Cb 0.10 -4.09 0.11 0.00 0.56 0.00 0.00 36.38 33.06 3hk9 s VAL 192 CO 0.01 0.29 0.98 0.20 -0.31 0.00 0.00 175.10 176.27 3hk9 s ASN 193 N -0.12 4.45 0.23 4.85 0.01 -1.26 -4.92 114.94 118.17 3hk9 s ASN 193 Ca 0.49 -0.23 -0.06 0.00 -0.71 0.00 0.00 52.86 52.34 3hk9 s ASN 193 Cb -0.28 -0.22 0.22 0.00 0.41 0.00 0.00 41.25 41.37 3hk9 s ASN 193 CO 0.34 -1.78 1.81 0.44 -1.51 0.00 0.00 177.10 176.40 3hk9 h ASP 194 N -0.50 1.06 -2.85 -1.22 5.19 -2.03 -3.43 116.42 112.65 3hk9 h ASP 194 Ca -0.38 -0.15 -0.59 0.00 -0.62 0.00 0.00 57.03 55.29 3hk9 h ASP 194 Cb 1.27 -0.27 -0.07 0.00 0.18 0.00 0.00 39.33 40.44 3hk9 h ASP 194 CO 0.43 0.92 -0.57 -1.83 -3.12 0.00 0.00 179.24 175.07 3hk9 s GLU 195 N -5.59 2.93 -1.08 3.56 -1.05 -1.26 -5.03 118.70 111.19 3hk9 s GLU 195 Ca -0.12 -0.79 -0.22 0.00 -0.15 0.00 0.00 54.97 53.69 3hk9 s GLU 195 Cb 0.16 -2.70 0.04 0.00 -0.44 0.00 0.00 34.13 31.19 3hk9 s GLU 195 CO 0.83 0.51 1.60 -0.46 0.95 0.00 0.00 175.26 178.70 3hk9 s TRP 196 N -1.63 2.47 0.15 4.83 -0.11 -1.26 -4.68 118.94 118.72 3hk9 s TRP 196 Ca 0.31 -0.78 0.01 0.00 1.22 0.00 0.00 56.10 56.85 3hk9 s TRP 196 Cb -0.11 -4.60 0.01 0.00 -1.50 0.00 0.00 33.47 27.27 3hk9 s TRP 196 CO 0.23 -1.85 0.05 0.27 -4.62 0.00 0.00 176.95 171.03 3hk9 n ASN 197 N 9.66 2.05 -0.20 5.86 0.23 -1.26 -4.95 115.26 126.65 3hk9 n ASN 197 Ca 0.38 -1.61 -0.01 0.00 -0.53 0.00 0.00 54.58 52.81 3hk9 n ASN 197 Cb 0.49 0.06 0.10 0.00 -2.08 0.00 0.00 39.78 38.35 3hk9 n ASN 197 CO 0.00 0.00 0.00 -0.08 -0.93 0.00 0.00 177.26 176.25 3hk9 h GLU 198 N 0.00 0.43 -0.60 -3.83 4.57 -1.99 -0.33 114.58 112.83 3hk9 h GLU 198 Ca -0.11 -0.03 0.03 0.00 -1.18 0.00 0.00 59.36 58.07 3hk9 h GLU 198 Cb 0.37 -0.10 -0.04 0.00 -0.16 0.00 0.00 28.75 28.82 3hk9 h GLU 198 CO 0.19 0.29 0.37 0.78 -1.18 0.00 0.00 179.01 179.45 3hk9 h GLY 199 N 0.45 0.86 0.92 1.92 0.00 -1.94 -0.42 103.07 104.87 3hk9 h GLY 199 Ca 0.29 -0.28 -0.04 0.00 0.00 0.00 0.00 47.33 47.30 3hk9 h GLY 199 CO -0.27 0.24 0.09 1.76 0.00 0.00 0.00 176.54 178.36 3hk9 h SER 200 N 0.73 0.57 -0.63 0.19 0.02 -1.58 -1.54 113.55 111.30 3hk9 h SER 200 Ca 0.24 -0.24 -0.00 0.00 -0.84 0.00 0.00 61.79 60.95 3hk9 h SER 200 Cb 0.02 -0.15 -0.03 0.00 0.14 0.00 0.00 62.40 62.38 3hk9 h SER 200 CO -0.10 0.65 0.38 0.40 -1.14 0.00 0.00 176.83 177.03 3hk9 h ILE 201 N 0.45 1.18 -0.32 3.27 2.04 -0.74 -1.68 117.51 121.71 3hk9 h ILE 201 Ca 0.12 -0.40 -0.16 0.00 1.00 0.00 0.00 64.86 65.42 3hk9 h ILE 201 Cb 0.31 0.31 -0.01 0.00 -0.74 0.00 0.00 36.82 36.70 3hk9 h ILE 201 CO 0.00 0.19 -0.42 1.56 0.00 0.00 0.00 178.15 179.48 3hk9 h GLN 202 N 0.85 0.81 -0.36 2.37 1.08 -0.98 -2.06 115.11 116.81 3hk9 h GLN 202 Ca 0.23 -0.44 -0.12 0.00 -1.45 0.00 0.00 58.65 56.87 3hk9 h GLN 202 Cb -0.03 0.02 -0.01 0.00 -0.05 0.00 0.00 27.48 27.41 3hk9 h GLN 202 CO -0.04 1.07 -0.27 0.93 -0.95 0.00 0.00 178.83 179.56 3hk9 h GLU 203 N 0.65 0.75 -0.54 1.46 4.39 -1.12 0.11 114.58 120.27 3hk9 h GLU 203 Ca 0.05 -0.32 -0.11 0.00 0.34 0.00 0.00 59.36 59.31 3hk9 h GLU 203 Cb 0.99 -0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 29.60 3hk9 h GLU 203 CO 0.09 0.93 -0.10 0.28 -1.16 0.00 0.00 179.01 179.06 3hk9 h VAL 204 N 0.64 1.27 -0.80 3.13 2.07 -1.27 -0.35 116.25 120.94 3hk9 h VAL 204 Ca 0.08 -1.26 -0.04 0.00 0.82 0.00 0.00 66.70 66.30 3hk9 h VAL 204 Cb 0.79 0.95 -0.04 0.00 -1.52 0.00 0.00 31.29 31.48 3hk9 h VAL 204 CO 0.07 0.45 0.34 0.11 0.02 0.00 0.00 177.57 178.55 3hk9 h LYS 205 N 0.91 1.19 -0.59 1.57 1.57 -1.12 -2.11 116.57 117.99 3hk9 h LYS 205 Ca 0.14 -0.21 -0.06 0.00 -1.87 0.00 0.00 60.65 58.66 3hk9 h LYS 205 Cb 0.67 -0.20 -0.03 0.00 0.08 0.00 0.00 32.23 32.75 3hk9 h LYS 205 CO 0.05 0.95 0.13 -0.09 -0.57 0.00 0.00 179.45 179.92 3hk9 h ARG 206 N 1.16 0.92 -0.43 3.15 2.43 -0.57 0.22 114.38 121.26 3hk9 h ARG 206 Ca 0.27 -0.20 -0.01 0.00 -0.81 0.00 0.00 59.98 59.23 3hk9 h ARG 206 Cb 0.19 -0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 29.59 3hk9 h ARG 206 CO -0.03 0.83 0.22 0.35 -1.51 0.00 0.00 179.97 179.83 3hk9 h PHE 207 N 0.88 0.61 -0.49 2.20 3.57 -0.57 0.48 116.94 123.60 3hk9 h PHE 207 Ca 0.19 -0.02 -0.13 0.00 3.53 0.00 0.00 57.97 61.53 3hk9 h PHE 207 Cb 0.33 -0.19 -0.01 0.00 2.79 0.00 0.00 35.95 38.87 3hk9 h PHE 207 CO 0.02 0.48 -0.21 -0.07 -2.23 0.00 0.00 178.31 176.30 3hk9 h LEU 208 N 0.56 1.03 -0.40 0.59 3.38 -1.02 -2.32 115.31 117.13 3hk9 h LEU 208 Ca 0.15 -0.39 -0.09 0.00 0.09 0.00 0.00 57.88 57.64 3hk9 h LEU 208 Cb 0.09 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.54 3hk9 h LEU 208 CO -0.02 1.19 -0.08 0.74 0.09 0.00 0.00 178.44 180.36 3hk9 h THR 209 N 0.86 1.27 -0.94 0.22 2.02 -0.77 -0.49 112.91 115.08 3hk9 h THR 209 Ca 0.11 -1.16 -0.01 0.00 0.77 0.00 0.00 66.41 66.13 3hk9 h THR 209 Cb 0.79 1.20 -0.05 0.00 -1.74 0.00 0.00 68.15 68.35 3hk9 h THR 209 CO 0.07 0.39 0.57 0.44 0.37 0.00 0.00 175.52 177.35 3hk9 h ASP 210 N 0.59 1.14 1.02 4.18 3.32 -0.85 -1.62 116.42 124.20 3hk9 h ASP 210 Ca 0.10 -0.07 -0.12 0.00 0.02 0.00 0.00 57.03 56.97 3hk9 h ASP 210 Cb 0.60 -0.29 -0.02 0.00 0.22 0.00 0.00 39.33 39.84 3hk9 h ASP 210 CO 0.04 0.87 -0.55 -0.50 -1.72 0.00 0.00 179.24 177.38 3hk9 h TRP 211 N 1.30 0.00 -0.34 4.55 4.06 -1.23 -2.14 115.95 122.14 3hk9 h TRP 211 Ca 0.34 0.00 -0.12 0.00 2.06 0.00 0.00 58.89 61.17 3hk9 h TRP 211 Cb -0.05 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.10 3hk9 h TRP 211 CO 0.01 0.55 -0.26 0.82 -3.56 0.00 0.00 178.44 176.00 3hk9 h ILE 212 N 0.00 1.29 -0.61 1.49 2.04 -0.64 -0.67 117.51 120.42 3hk9 h ILE 212 Ca -0.01 -1.42 -0.08 0.00 1.00 0.00 0.00 64.86 64.36 3hk9 h ILE 212 Cb 1.21 1.44 -0.02 0.00 -0.74 0.00 0.00 36.82 38.71 3hk9 h ILE 212 CO 0.07 0.46 0.06 -0.33 0.00 0.00 0.00 178.15 178.41 3hk9 h GLU 213 N 0.57 1.03 -0.07 2.37 5.08 -1.25 0.40 114.58 122.70 3hk9 h GLU 213 Ca 0.06 -0.30 -0.18 0.00 -1.00 0.00 0.00 59.36 57.95 3hk9 h GLU 213 Cb 0.83 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.96 3hk9 h GLU 213 CO 0.07 0.99 -0.72 -0.09 -1.00 0.00 0.00 179.01 178.26 3hk9 h ARG 214 N 0.93 0.37 0.00 2.33 2.43 -1.30 -3.34 114.38 115.80 3hk9 h ARG 214 Ca 0.18 -0.30 -0.13 0.00 -0.81 0.00 0.00 59.98 58.92 3hk9 h ARG 214 Cb 0.48 0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 30.07 3hk9 h ARG 214 CO 0.02 0.94 -2.07 -1.33 -1.51 0.00 0.00 179.97 176.02 3hk9 n MET 215 N -3.83 0.67 -3.83 0.20 2.81 -0.27 -5.00 117.12 107.86 3hk9 n MET 215 Ca -0.04 -0.11 -0.28 0.00 -1.81 0.00 0.00 57.70 55.47 3hk9 n MET 215 Cb 0.70 -1.54 0.01 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 -2.46 -2.27 -4.76 7.83 2.03 0.14 -4.55 116.55 112.51 3hk9 n ASP 216 Ca -0.14 -1.00 -0.37 0.00 0.52 0.00 0.00 54.79 53.81 3hk9 n ASP 216 Cb 0.77 -3.25 0.02 0.00 -0.72 0.00 0.00 41.12 37.94 3hk9 n ASP 216 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 3hk9 s PRO 217 N -6.31 3.31 0.28 -0.67 0.04 -1.26 -4.60 135.00 125.79 3hk9 s PRO 217 Ca 0.18 1.86 0.25 0.00 0.04 0.00 0.00 61.00 63.34 3hk9 s PRO 217 Cb -0.07 -2.16 0.66 0.00 0.04 0.00 0.00 34.50 32.97 3hk9 s PRO 217 CO 0.87 -0.94 1.71 -0.39 0.04 0.00 0.00 177.00 178.29 3hk9 h VAL 218 N 1.36 0.00 -1.60 -0.36 -1.51 -1.27 -3.47 116.25 109.40 3hk9 h VAL 218 Ca -0.50 -0.64 0.24 0.00 -1.23 0.00 0.00 66.70 64.57 3hk9 h VAL 218 Cb 1.28 1.63 -0.18 0.00 -2.13 0.00 0.00 31.29 31.89 3hk9 h VAL 218 CO 0.57 0.00 0.76 -0.72 -1.23 0.00 0.00 177.57 176.96 3hk9 s TYR 219 N -3.14 -0.15 -0.13 5.19 -0.85 -1.26 -4.22 117.35 112.80 3hk9 s TYR 219 Ca 0.09 0.08 -0.06 0.00 -0.52 0.00 0.00 57.07 56.66 3hk9 s TYR 219 Cb 0.10 0.52 -0.04 0.00 0.38 0.00 0.00 41.96 42.93 3hk9 s TYR 219 CO 0.62 -0.27 0.09 -1.64 -1.52 0.00 0.00 175.55 172.84 3hk9 s MET 220 N -2.53 3.47 0.19 -3.49 -1.94 -0.82 -2.04 119.30 112.12 3hk9 s MET 220 Ca 0.09 -0.24 0.05 0.00 -1.71 0.00 0.00 55.69 53.88 3hk9 s MET 220 Cb -0.00 -3.11 -0.05 0.00 2.01 0.00 0.00 34.83 33.68 3hk9 s MET 220 CO -0.05 0.64 -0.08 0.00 -0.01 0.00 0.00 175.02 175.52 3hk9 s ALA 221 N -0.66 1.69 -0.22 3.03 0.00 -0.05 -0.15 121.76 125.39 3hk9 s ALA 221 Ca 0.12 -1.61 -0.25 0.00 0.00 0.00 0.00 51.96 50.22 3hk9 s ALA 221 Cb -0.12 0.14 0.07 0.00 0.00 0.00 0.00 23.12 23.21 3hk9 s ALA 221 CO 0.02 -0.10 0.69 0.54 0.00 0.00 0.00 175.76 176.91 3hk9 s VAL 222 N -3.27 0.00 -0.08 0.00 0.11 -0.80 -0.77 120.40 115.59 3hk9 s VAL 222 Ca 0.21 -0.00 -0.05 0.00 -2.93 0.00 0.00 61.98 59.21 3hk9 s VAL 222 Cb 0.03 -0.97 -0.04 0.00 -1.53 0.00 0.00 36.38 33.87 3hk9 s VAL 222 CO 0.04 -0.00 0.13 -0.94 -3.33 0.00 0.00 175.10 171.00 3hk9 s SER 223 N 0.08 6.18 0.10 3.54 1.04 -1.26 -1.46 113.70 121.93 3hk9 s SER 223 Ca -0.02 0.37 0.05 0.00 0.48 0.00 0.00 55.95 56.84 3hk9 s SER 223 Cb -0.04 -1.94 -0.03 0.00 0.10 0.00 0.00 66.02 64.10 3hk9 s SER 223 CO 0.03 0.36 -0.14 -0.76 0.98 0.00 0.00 173.24 173.71 3hk9 s LEU 224 N -1.28 2.34 0.81 2.42 1.43 0.42 -4.91 118.68 119.91 3hk9 s LEU 224 Ca 0.18 -0.72 -0.12 0.00 -1.03 0.00 0.00 54.13 52.45 3hk9 s LEU 224 Cb -0.12 -0.53 0.08 0.00 0.03 0.00 0.00 46.19 45.65 3hk9 s LEU 224 CO 0.08 -0.11 1.11 -2.16 0.23 0.00 0.00 176.35 175.50 3hk9 s PRO 225 N -2.22 1.99 0.62 1.29 0.04 -1.25 -0.46 135.00 135.01 3hk9 s PRO 225 Ca 0.03 0.49 0.34 0.00 0.04 0.00 0.00 61.00 61.90 3hk9 s PRO 225 Cb -0.07 -1.92 1.92 0.00 0.04 0.00 0.00 34.50 34.47 3hk9 s PRO 225 CO 0.02 -1.65 2.21 -1.35 0.04 0.00 0.00 177.00 176.27 3hk9 h PRO 226 N -1.11 0.00 -0.22 0.56 0.11 -1.77 -1.58 132.00 127.99 3hk9 h PRO 226 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 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 0.61 0.00 0.00 0.25 -0.21 0.00 0.00 178.00 178.65 3hk9 n THR 227 N -3.53 0.29 -1.64 -1.15 -2.24 -1.26 -4.05 114.28 100.70 3hk9 n THR 227 Ca -0.01 -0.37 -0.46 0.00 -2.27 0.00 0.00 64.05 60.94 3hk9 n THR 227 Cb 0.19 0.27 -0.03 0.00 -2.10 0.00 0.00 70.33 68.66 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 0.32 1.88 -3.95 4.78 7.35 -0.59 -4.99 117.46 122.25 3hk9 n PHE 228 Ca 0.14 0.51 -0.09 0.00 -0.76 0.00 0.00 57.45 57.25 3hk9 n PHE 228 Cb 0.29 -2.40 -0.10 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 0.17 0.21 -0.28 -2.13 0.01 -1.26 -4.69 113.70 105.73 3hk9 s SER 229 Ca 0.69 -0.54 -0.20 0.00 1.31 0.00 0.00 55.95 57.21 3hk9 s SER 229 Cb -0.71 0.19 0.10 0.00 0.21 0.00 0.00 66.02 65.81 3hk9 s SER 229 CO 0.51 -0.44 0.85 0.12 0.41 0.00 0.00 173.24 174.68 3hk9 s PHE 230 N -2.28 -0.74 0.94 2.43 2.19 -1.26 -4.46 117.98 114.80 3hk9 s PHE 230 Ca -0.08 1.61 -0.11 0.00 0.33 0.00 0.00 56.93 58.68 3hk9 s PHE 230 Cb -0.03 0.42 0.16 0.00 -1.31 0.00 0.00 43.02 42.25 3hk9 s PHE 230 CO -0.03 -0.36 1.10 -2.14 1.83 0.00 0.00 175.22 175.61 3hk9 s PRO 231 N 0.94 0.83 -0.27 10.12 0.02 -1.26 -4.10 135.00 141.28 3hk9 s PRO 231 Ca -0.04 1.17 -0.15 0.00 0.02 0.00 0.00 61.00 62.00 3hk9 s PRO 231 Cb -0.05 -1.73 0.08 0.00 0.02 0.00 0.00 34.50 32.82 3hk9 s PRO 231 CO -0.11 -2.64 0.65 -2.00 -0.33 0.00 0.00 177.00 172.58 3hk9 s GLU 232 N -4.71 0.67 -0.98 5.54 2.12 -1.26 -5.07 118.70 114.99 3hk9 s GLU 232 Ca 0.65 1.17 -0.22 0.00 0.36 0.00 0.00 54.97 56.94 3hk9 s GLU 232 Cb -0.21 0.12 0.07 0.00 0.26 0.00 0.00 34.13 34.37 3hk9 s GLU 232 CO 0.59 -0.15 1.35 -1.21 -0.54 0.00 0.00 175.26 175.30 3hk9 s GLU 233 N 1.61 3.58 0.24 4.30 0.41 -1.26 -3.91 118.70 123.67 3hk9 s GLU 233 Ca -0.10 -1.28 -0.22 0.00 -0.41 0.00 0.00 54.97 52.97 3hk9 s GLU 233 Cb -0.05 -5.19 0.04 0.00 -1.78 0.00 0.00 34.13 27.14 3hk9 s GLU 233 CO -0.19 -2.08 0.83 -1.54 -0.49 0.00 0.00 175.26 171.78 3hk9 s SER 234 N 4.55 -0.19 0.18 -0.19 1.04 -1.26 -4.99 113.70 112.84 3hk9 s SER 234 Ca 0.42 -0.60 -0.13 0.00 0.48 0.00 0.00 55.95 56.12 3hk9 s SER 234 Cb -0.02 0.65 0.09 0.00 0.10 0.00 0.00 66.02 66.84 3hk9 s SER 234 CO -0.09 -1.21 1.84 0.78 0.98 0.00 0.00 173.24 175.54 3hk9 h ASN 235 N 2.00 0.63 -0.33 7.02 2.35 -1.92 -1.80 115.58 123.53 3hk9 h ASN 235 Ca -0.22 -0.01 -0.01 0.00 -0.55 0.00 0.00 56.30 55.50 3hk9 h ASN 235 Cb 1.24 -0.15 -0.01 0.00 0.05 0.00 0.00 38.32 39.44 3hk9 h ASN 235 CO 0.26 0.45 0.16 -0.09 -1.65 0.00 0.00 177.43 176.57 3hk9 h ARG 236 N 0.75 0.47 -0.97 0.81 2.43 -1.91 -0.39 114.38 115.57 3hk9 h ARG 236 Ca 0.21 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 59.31 3hk9 h ARG 236 Cb -0.07 -0.09 -0.05 0.00 -0.42 0.00 0.00 29.97 29.35 3hk9 h ARG 236 CO -0.05 0.42 0.60 0.78 -1.51 0.00 0.00 179.97 180.21 3hk9 h GLY 237 N 0.39 1.39 1.87 2.80 0.00 -1.63 -1.04 103.07 106.84 3hk9 h GLY 237 Ca 0.11 -0.56 -0.22 0.00 0.00 0.00 0.00 47.33 46.66 3hk9 h GLY 237 CO -0.02 0.54 -1.04 3.21 0.00 0.00 0.00 176.54 179.24 3hk9 h ARG 238 N 1.32 0.10 -0.43 4.80 3.08 -1.18 -2.01 114.38 120.06 3hk9 h ARG 238 Ca 0.35 -0.16 -0.14 0.00 0.07 0.00 0.00 59.98 60.09 3hk9 h ARG 238 Cb -0.09 0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.01 3hk9 h ARG 238 CO -0.07 1.04 -0.29 0.82 -1.07 0.00 0.00 179.97 180.40 3hk9 h ILE 239 N 0.04 1.27 -0.28 2.04 2.04 -0.86 0.23 117.51 121.98 3hk9 h ILE 239 Ca -0.05 -1.46 -0.07 0.00 1.00 0.00 0.00 64.86 64.29 3hk9 h ILE 239 Cb 1.76 1.25 -0.01 0.00 -0.74 0.00 0.00 36.82 39.09 3hk9 h ILE 239 CO 0.15 0.50 -0.09 0.40 0.00 0.00 0.00 178.15 179.10 3hk9 h ILE 240 N 0.80 1.29 -0.07 -0.67 2.04 -1.23 0.11 117.51 119.77 3hk9 h ILE 240 Ca 0.09 -1.14 -0.03 0.00 1.00 0.00 0.00 64.86 64.77 3hk9 h ILE 240 Cb 0.88 1.45 -0.00 0.00 -0.74 0.00 0.00 36.82 38.40 3hk9 h ILE 240 CO 0.08 0.36 -0.09 -0.09 0.00 0.00 0.00 178.15 178.41 3hk9 h ARG 241 N 0.31 0.18 0.00 2.37 2.43 -1.27 -1.60 114.38 116.80 3hk9 h ARG 241 Ca 0.07 -0.10 0.00 0.00 -0.81 0.00 0.00 59.98 59.14 3hk9 h ARG 241 Cb 0.58 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.14 3hk9 h ARG 241 CO 0.03 0.65 -0.92 -0.44 -1.51 0.00 0.00 179.97 177.78 3hk9 h ASP 242 N -0.28 0.00 0.00 -3.80 3.32 -0.63 -3.41 116.42 111.61 3hk9 h ASP 242 Ca 0.01 -0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.03 3hk9 h ASP 242 Cb 0.63 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.18 3hk9 h ASP 242 CO 0.02 0.01 -0.33 0.00 -1.72 0.00 0.00 179.24 177.23 3hk9 h LEU 244 N 0.00 -0.27 -0.12 0.00 7.12 -1.12 -2.55 115.31 118.37 3hk9 h LEU 244 Ca 0.00 -0.12 0.00 0.00 0.13 0.00 0.00 57.88 57.89 3hk9 h LEU 244 Cb 0.33 0.07 -0.01 0.00 -0.53 0.00 0.00 40.66 40.52 3hk9 h LEU 244 CO 0.00 -0.04 0.08 -0.07 -0.13 0.00 0.00 178.44 178.28 3hk9 h LEU 245 N -0.50 0.14 -0.46 2.25 3.38 -1.53 0.25 115.31 118.83 3hk9 h LEU 245 Ca -0.03 -0.02 0.03 0.00 0.09 0.00 0.00 57.88 57.95 3hk9 h LEU 245 Cb 0.38 -0.04 -0.04 0.00 0.09 0.00 0.00 40.66 41.05 3hk9 h LEU 245 CO 0.05 0.12 0.24 -0.65 0.09 0.00 0.00 178.44 178.29 3hk9 h PRO 246 N 0.15 0.47 -0.54 1.13 0.11 -1.79 -1.15 132.00 130.38 3hk9 h PRO 246 Ca 0.04 -0.03 -0.05 0.00 0.11 0.00 0.00 66.00 66.08 3hk9 h PRO 246 Cb -0.00 -0.11 -0.02 0.00 0.11 0.00 0.00 31.00 30.98 3hk9 h PRO 246 CO -0.01 0.31 0.15 0.28 -0.21 0.00 0.00 178.00 178.52 3hk9 h VAL 247 N 0.48 1.24 -0.63 3.15 2.07 -1.31 -1.94 116.25 119.32 3hk9 h VAL 247 Ca 0.20 -0.83 -0.02 0.00 0.82 0.00 0.00 66.70 66.87 3hk9 h VAL 247 Cb 0.09 0.75 -0.03 0.00 -1.52 0.00 0.00 31.29 30.58 3hk9 h VAL 247 CO -0.13 0.31 0.30 0.00 0.02 0.00 0.00 177.57 178.06 3hk9 h ALA 248 N 1.02 0.81 -0.24 1.67 0.00 -0.61 -2.12 119.26 119.79 3hk9 h ALA 248 Ca 0.17 -0.14 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 3hk9 h ALA 248 Cb 0.31 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 3hk9 h ALA 248 CO -0.00 0.37 0.06 1.49 0.00 0.00 0.00 179.25 181.18 3hk9 h GLU 249 N 0.86 0.39 -0.53 0.00 4.81 -1.14 0.35 114.58 119.32 3hk9 h GLU 249 Ca 0.21 -0.09 0.09 0.00 -0.13 0.00 0.00 59.36 59.44 3hk9 h GLU 249 Cb 0.13 -0.05 -0.07 0.00 0.63 0.00 0.00 28.75 29.38 3hk9 h GLU 249 CO -0.03 0.49 0.12 -0.22 -0.73 0.00 0.00 179.01 178.64 3hk9 h LYS 250 N 0.22 0.25 -0.40 1.92 3.64 -1.17 -1.06 116.57 119.98 3hk9 h LYS 250 Ca 0.08 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.44 3hk9 h LYS 250 Cb 0.27 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.03 3hk9 h LYS 250 CO 0.00 0.17 0.00 0.72 -2.27 0.00 0.00 179.45 178.07 3hk9 n HIS 251 N -5.10 0.52 -4.02 1.91 8.25 -0.81 -4.94 115.22 111.04 3hk9 n HIS 251 Ca 0.07 -0.26 -0.31 0.00 -0.26 0.00 0.00 57.72 56.95 3hk9 n HIS 251 Cb 0.26 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.38 3hk9 n HIS 251 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 3hk9 n ASN 252 N 0.95 -3.38 -4.66 0.41 4.05 0.38 -4.95 115.26 108.06 3hk9 n ASN 252 Ca 0.17 -0.90 -0.35 0.00 0.45 0.00 0.00 54.58 53.96 3hk9 n ASN 252 Cb 0.45 -3.37 -0.09 0.00 1.23 0.00 0.00 39.78 37.99 3hk9 n ASN 252 CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 177.26 173.58 3hk9 s ILE 253 N -3.41 5.01 0.68 -1.44 1.01 0.97 -4.82 121.20 119.19 3hk9 s ILE 253 Ca 0.55 0.05 -0.13 0.00 0.00 0.00 0.00 60.65 61.11 3hk9 s ILE 253 Cb -0.29 -3.27 0.01 0.00 0.01 0.00 0.00 42.46 38.92 3hk9 s ILE 253 CO 0.87 0.45 1.09 -2.84 0.00 0.00 0.00 174.94 174.51 3hk9 s PRO 254 N 0.40 2.75 -0.27 2.79 0.02 -1.26 -4.56 135.00 134.87 3hk9 s PRO 254 Ca 0.05 1.25 -0.06 0.00 0.02 0.00 0.00 61.00 62.26 3hk9 s PRO 254 Cb -0.12 -1.95 0.01 0.00 0.02 0.00 0.00 34.50 32.45 3hk9 s PRO 254 CO -0.00 -1.27 0.04 0.12 -0.33 0.00 0.00 177.00 175.56 3hk9 s PHE 255 N -2.60 3.10 -0.19 6.54 5.36 0.34 -1.95 117.98 128.59 3hk9 s PHE 255 Ca 0.64 -1.00 -0.13 0.00 -0.96 0.00 0.00 56.93 55.47 3hk9 s PHE 255 Cb -0.18 -2.20 -0.05 0.00 -0.34 0.00 0.00 43.02 40.25 3hk9 s PHE 255 CO 0.46 -0.57 0.28 0.00 -1.46 0.00 0.00 175.22 173.93 3hk9 s ALA 256 N 1.48 3.60 -0.15 11.12 0.00 0.79 -1.09 121.76 137.50 3hk9 s ALA 256 Ca 0.03 -0.56 0.02 0.00 0.00 0.00 0.00 51.96 51.45 3hk9 s ALA 256 Cb -0.16 -2.41 0.02 0.00 0.00 0.00 0.00 23.12 20.56 3hk9 s ALA 256 CO 0.01 -0.02 -0.20 -1.64 0.00 0.00 0.00 175.76 173.91 3hk9 s MET 257 N 0.72 2.84 -0.44 0.00 1.00 0.65 -1.90 119.30 122.17 3hk9 s MET 257 Ca 0.15 -0.78 -0.04 0.00 0.00 0.00 0.00 55.69 55.02 3hk9 s MET 257 Cb -0.13 -2.38 0.12 0.00 0.00 0.00 0.00 34.83 32.43 3hk9 s MET 257 CO 0.04 -0.11 0.25 -1.64 0.00 0.00 0.00 175.02 173.56 3hk9 s MET 258 N 1.06 2.13 -0.13 2.03 -1.94 -0.53 -2.11 119.30 119.81 3hk9 s MET 258 Ca -0.02 -1.89 -0.08 0.00 -1.71 0.00 0.00 55.69 52.00 3hk9 s MET 258 Cb -0.14 -3.65 -0.04 0.00 2.01 0.00 0.00 34.83 33.00 3hk9 s MET 258 CO -0.06 -1.10 0.15 0.42 -0.01 0.00 0.00 175.02 174.41 3hk9 s ILE 259 N 1.05 5.49 0.00 2.53 1.01 -0.61 -0.43 121.20 130.23 3hk9 s ILE 259 Ca 0.09 0.22 0.00 0.00 0.00 0.00 0.00 60.65 60.96 3hk9 s ILE 259 Cb -0.23 -3.42 0.00 0.00 0.01 0.00 0.00 42.46 38.82 3hk9 s ILE 259 CO -0.04 0.59 0.00 0.61 0.00 0.00 0.00 174.94 176.11 3hk9 n GLY 260 N 2.18 1.06 3.71 6.18 0.00 0.39 -0.22 105.19 118.49 3hk9 n GLY 260 Ca -0.19 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.42 3hk9 n GLY 260 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hk9 s VAL 261 N -2.00 4.94 -0.52 1.61 0.11 -0.96 -1.49 120.40 122.07 3hk9 s VAL 261 Ca 0.00 1.75 -0.08 0.00 -2.93 0.00 0.00 61.98 60.72 3hk9 s VAL 261 Cb 0.00 -4.18 0.14 0.00 -1.53 0.00 0.00 36.38 30.80 3hk9 s VAL 261 CO 0.00 0.17 0.39 -0.75 -3.33 0.00 0.00 175.10 171.58 3hk9 s LYS 262 N 1.16 2.56 0.27 1.54 2.20 0.84 -3.89 119.74 124.42 3hk9 s LYS 262 Ca 0.44 -1.96 -0.30 0.00 -0.36 0.00 0.00 55.97 53.79 3hk9 s LYS 262 Cb -0.19 -3.92 -0.11 0.00 -1.51 0.00 0.00 37.83 32.10 3hk9 s LYS 262 CO 0.21 -1.19 1.58 0.15 -0.36 0.00 0.00 175.35 175.74 3hk9 s LYS 263 N 1.01 4.15 -1.28 4.03 -0.14 -1.26 -0.56 119.74 125.69 3hk9 s LYS 263 Ca 0.09 2.52 -0.05 0.00 -1.36 0.00 0.00 55.97 57.17 3hk9 s LYS 263 Cb -0.23 -3.05 -0.01 0.00 -1.68 0.00 0.00 37.83 32.86 3hk9 s LYS 263 CO -0.02 -0.61 0.66 0.54 -0.76 0.00 0.00 175.35 175.16 3hk9 n ARG 264 N 2.51 -3.54 0.13 1.68 1.74 -1.20 -4.89 116.66 113.10 3hk9 n ARG 264 Ca 0.09 0.55 0.13 0.00 -0.77 0.00 0.00 57.85 57.84 3hk9 n ARG 264 Cb 0.38 -4.82 0.44 0.00 -1.02 0.00 0.00 32.46 27.44 3hk9 n ARG 264 CO 0.00 0.00 0.00 -0.39 -1.52 0.00 0.00 177.63 175.72 3hk9 h VAL 265 N -1.82 0.00 -2.37 1.55 -1.51 -1.04 -3.33 116.25 107.73 3hk9 h VAL 265 Ca -0.63 -0.42 -0.59 0.00 -1.23 0.00 0.00 66.70 63.83 3hk9 h VAL 265 Cb 1.36 1.31 -0.38 0.00 -2.13 0.00 0.00 31.29 31.45 3hk9 h VAL 265 CO 0.55 0.00 -0.97 -2.28 -1.23 0.00 0.00 177.57 173.64 3hk9 s HIS 266 N -3.23 1.13 0.29 5.19 5.65 -1.03 -5.02 115.29 118.27 3hk9 s HIS 266 Ca 0.07 -2.35 0.03 0.00 0.25 0.00 0.00 55.06 53.07 3hk9 s HIS 266 Cb 0.10 -0.94 0.74 0.00 -1.18 0.00 0.00 32.58 31.30 3hk9 s HIS 266 CO 0.52 -0.82 1.65 -1.35 -0.65 0.00 0.00 174.74 174.09 3hk9 h PRO 267 N 5.63 0.24 -0.05 2.88 0.11 -1.83 -1.55 132.00 137.41 3hk9 h PRO 267 Ca 0.27 -0.01 0.02 0.00 0.11 0.00 0.00 66.00 66.38 3hk9 h PRO 267 Cb 0.91 -0.05 -0.00 0.00 0.11 0.00 0.00 31.00 31.96 3hk9 h PRO 267 CO 0.38 0.16 0.08 0.00 -0.21 0.00 0.00 178.00 178.40 3hk9 h ALA 268 N 1.78 1.50 -0.01 -0.75 0.00 -1.95 -1.26 119.26 118.57 3hk9 h ALA 268 Ca 0.57 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.48 3hk9 h ALA 268 Cb 1.15 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.95 3hk9 h ALA 268 CO -0.63 -0.11 -0.02 1.28 0.00 0.00 0.00 179.25 179.77 3hk9 n LEU 269 N -3.64 0.66 0.00 0.00 4.77 -0.58 -4.95 117.00 113.26 3hk9 n LEU 269 Ca -0.02 -0.18 0.00 0.00 -0.03 0.00 0.00 56.01 55.78 3hk9 n LEU 269 Cb 0.17 -0.04 0.00 0.00 -2.33 0.00 0.00 43.42 41.22 3hk9 n LEU 269 CO 0.25 0.11 0.00 0.61 -1.33 0.00 0.00 177.39 177.03 3hk9 n GLY 270 N 1.12 2.97 0.33 -0.72 0.00 -0.48 -1.41 105.19 107.01 3hk9 n GLY 270 Ca 0.20 -0.20 0.13 0.00 0.00 0.00 0.00 46.02 46.16 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 3.58 0.00 -0.18 1.61 3.32 -1.94 0.55 116.42 123.36 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 -1.83 2.50 -0.64 3.45 0.00 -0.50 -4.36 120.51 119.13 3hk9 n ALA 272 Ca -0.02 -0.63 0.03 0.00 0.00 0.00 0.00 53.44 52.82 3hk9 n ALA 272 Cb 0.44 -1.03 0.32 0.00 0.00 0.00 0.00 19.45 19.18 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 1.24 2.93 3.87 0.00 0.00 0.19 -4.87 105.19 108.56 3hk9 n GLY 273 Ca 0.17 -0.80 -0.36 0.00 0.00 0.00 0.00 46.02 45.03 3hk9 n GLY 273 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3hk9 s ASP 274 N -0.69 6.52 0.26 1.61 1.01 -1.26 -0.64 116.67 123.47 3hk9 s ASP 274 Ca 0.47 0.60 0.01 0.00 0.71 0.00 0.00 52.55 54.34 3hk9 s ASP 274 Cb 0.36 -2.11 0.01 0.00 1.01 0.00 0.00 42.92 42.19 3hk9 s ASP 274 CO 0.13 0.31 0.12 0.33 0.21 0.00 0.00 175.17 176.27 3hk9 n PHE 275 N 1.50 -0.38 -4.22 4.23 7.35 0.27 -4.93 117.46 121.28 3hk9 n PHE 275 Ca -0.14 -1.17 -0.14 0.00 -0.76 0.00 0.00 57.45 55.24 3hk9 n PHE 275 Cb 0.53 -0.20 -0.10 0.00 0.35 0.00 0.00 39.48 40.07 3hk9 n PHE 275 CO 0.00 0.00 0.00 0.54 -0.76 0.00 0.00 176.76 176.54 3hk9 s VAL 276 N -1.56 1.06 -0.17 -2.13 0.11 -1.26 -0.11 120.40 116.34 3hk9 s VAL 276 Ca 0.09 -1.92 -0.24 0.00 -2.93 0.00 0.00 61.98 56.98 3hk9 s VAL 276 Cb -0.01 -1.69 0.06 0.00 -1.53 0.00 0.00 36.38 33.22 3hk9 s VAL 276 CO 0.06 -0.70 0.62 -0.83 -3.33 0.00 0.00 175.10 170.92 3hk9 s GLY 277 N -2.93 -0.48 0.26 6.54 0.00 -0.56 -4.83 107.32 105.32 3hk9 s GLY 277 Ca 0.13 1.54 -0.29 0.00 0.00 0.00 0.00 44.72 46.09 3hk9 s GLY 277 CO -0.00 1.26 1.29 1.25 0.00 0.00 0.00 173.10 176.90 3hk9 s LYS 278 N -0.23 4.40 0.32 2.90 2.20 -1.26 -4.52 119.74 123.54 3hk9 s LYS 278 Ca -0.04 2.10 0.08 0.00 -0.36 0.00 0.00 55.97 57.74 3hk9 s LYS 278 Cb -0.03 -3.14 -0.03 0.00 -1.51 0.00 0.00 37.83 33.11 3hk9 s LYS 278 CO 0.04 -0.17 0.22 0.00 -0.36 0.00 0.00 175.35 175.07 3hk9 s ALA 279 N -0.55 3.66 0.33 3.13 0.00 -1.26 -4.79 121.76 122.28 3hk9 s ALA 279 Ca 0.52 -1.65 -0.18 0.00 0.00 0.00 0.00 51.96 50.66 3hk9 s ALA 279 Cb -0.37 -1.07 -0.09 0.00 0.00 0.00 0.00 23.12 21.58 3hk9 s ALA 279 CO 0.45 0.08 0.80 0.45 0.00 0.00 0.00 175.76 177.53 3hk9 s SER 280 N -3.91 6.90 0.00 0.00 0.15 -1.26 -4.96 113.70 110.63 3hk9 s SER 280 Ca 0.38 1.44 0.26 0.00 0.70 0.00 0.00 55.95 58.73 3hk9 s SER 280 Cb -0.05 -2.43 0.68 0.00 -1.71 0.00 0.00 66.02 62.50 3hk9 s SER 280 CO 0.25 -0.19 1.52 0.23 1.20 0.00 0.00 173.24 176.25 3hk9 n MET 281 N -0.17 0.88 -0.24 5.44 2.81 -1.26 -4.37 117.12 120.21 3hk9 n MET 281 Ca 0.03 -0.55 0.03 0.00 -1.81 0.00 0.00 57.70 55.41 3hk9 n MET 281 Cb 0.53 -1.49 0.16 0.00 -0.71 0.00 0.00 33.22 31.71 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 1.34 0.25 -0.30 7.83 5.19 -1.93 0.61 116.42 129.41 3hk9 h ASP 282 Ca 0.00 0.10 -0.03 0.00 -0.62 0.00 0.00 57.03 56.48 3hk9 h ASP 282 Cb 0.53 0.08 -0.01 0.00 0.18 0.00 0.00 39.33 40.11 3hk9 h ASP 282 CO 0.00 0.11 0.06 1.23 -3.12 0.00 0.00 179.24 177.52 3hk9 h GLY 283 N 0.43 0.53 0.90 2.75 0.00 -1.76 -1.00 103.07 104.90 3hk9 h GLY 283 Ca 0.38 -0.35 -0.03 0.00 0.00 0.00 0.00 47.33 47.33 3hk9 h GLY 283 CO -0.38 0.32 0.07 -2.08 0.00 0.00 0.00 176.54 174.48 3hk9 h VAL 284 N 0.32 1.22 -0.53 4.60 2.07 -1.74 -1.64 116.25 120.55 3hk9 h VAL 284 Ca 0.09 -0.73 0.07 0.00 0.82 0.00 0.00 66.70 66.95 3hk9 h VAL 284 Cb 0.33 1.12 -0.06 0.00 -1.52 0.00 0.00 31.29 31.16 3hk9 h VAL 284 CO 0.00 0.24 0.21 -0.08 0.02 0.00 0.00 177.57 177.97 3hk9 h GLU 285 N 0.33 0.40 -0.38 1.57 4.81 -0.80 -1.34 114.58 119.18 3hk9 h GLU 285 Ca 0.10 -0.02 -0.05 0.00 -0.13 0.00 0.00 59.36 59.25 3hk9 h GLU 285 Cb 0.29 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.57 3hk9 h GLU 285 CO 0.00 0.27 0.03 1.25 -0.73 0.00 0.00 179.01 179.83 3hk9 h HIS 286 N 0.41 0.70 -0.47 0.92 2.76 -1.04 -1.98 115.15 116.46 3hk9 h HIS 286 Ca 0.25 -0.11 0.03 0.00 -2.20 0.00 0.00 60.37 58.33 3hk9 h HIS 286 Cb 0.24 -0.19 -0.03 0.00 1.55 0.00 0.00 27.41 28.98 3hk9 h HIS 286 CO -0.14 0.72 0.27 -0.07 -1.30 0.00 0.00 177.93 177.40 3hk9 h LEU 287 N 0.48 0.42 -0.46 0.26 3.38 -0.92 0.02 115.31 118.49 3hk9 h LEU 287 Ca 0.11 0.01 -0.06 0.00 0.09 0.00 0.00 57.88 58.03 3hk9 h LEU 287 Cb 0.42 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.07 3hk9 h LEU 287 CO 0.01 0.30 0.05 -0.07 0.09 0.00 0.00 178.44 178.82 3hk9 h LEU 288 N 0.53 0.76 -0.12 1.67 3.38 -1.18 -1.93 115.31 118.43 3hk9 h LEU 288 Ca 0.19 -0.28 -0.10 0.00 0.09 0.00 0.00 57.88 57.78 3hk9 h LEU 288 Cb 0.04 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.59 3hk9 h LEU 288 CO -0.10 0.85 -0.31 -0.09 0.09 0.00 0.00 178.44 178.88 3hk9 h ARG 289 N 0.65 0.43 0.00 1.13 2.43 -1.21 -3.31 114.38 114.49 3hk9 h ARG 289 Ca 0.14 -0.30 0.00 0.00 -0.81 0.00 0.00 59.98 59.01 3hk9 h ARG 289 Cb 0.43 0.05 0.00 0.00 -0.42 0.00 0.00 29.97 30.03 3hk9 h ARG 289 CO 0.01 0.91 -0.05 0.39 -1.51 0.00 0.00 179.97 179.72 3hk9 n GLU 290 N -4.39 0.07 -3.15 0.20 -0.58 -0.02 -4.15 120.64 108.61 3hk9 n GLU 290 Ca -0.07 0.05 -0.23 0.00 -0.42 0.00 0.00 57.16 56.49 3hk9 n GLU 290 Cb 0.49 -1.58 -0.05 0.00 -0.57 0.00 0.00 31.44 29.73 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 -1.69 1.78 0.26 -0.32 4.01 -0.73 -4.93 117.16 115.54 3hk9 n TYR 291 Ca 0.06 -3.88 0.17 0.00 -0.16 0.00 0.00 57.90 54.10 3hk9 n TYR 291 Cb 0.36 -0.45 0.93 0.00 -0.31 0.00 0.00 39.34 39.88 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 3.37 0.00 -0.21 -0.72 0.13 -1.72 -1.00 132.00 131.85 3hk9 h PRO 292 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 3hk9 h PRO 292 Cb 0.77 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.90 3hk9 h PRO 292 CO 0.64 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.50 3hk9 n ASN 293 N -2.71 2.62 -4.74 1.44 5.03 -1.26 -4.89 115.26 110.75 3hk9 n ASN 293 Ca -0.02 -1.86 -0.30 0.00 0.87 0.00 0.00 54.58 53.27 3hk9 n ASN 293 Cb 0.07 -0.13 -0.07 0.00 -1.02 0.00 0.00 39.78 38.63 3hk9 n ASN 293 CO 0.00 0.00 0.00 0.20 -1.83 0.00 0.00 177.26 175.63 3hk9 s ASN 294 N -1.67 5.34 -0.10 6.41 -0.87 -0.38 -4.79 114.94 118.87 3hk9 s ASN 294 Ca 0.35 -0.07 -0.02 0.00 -1.57 0.00 0.00 52.86 51.54 3hk9 s ASN 294 Cb 0.20 -1.38 -0.03 0.00 -0.02 0.00 0.00 41.25 40.03 3hk9 s ASN 294 CO 0.30 0.17 -0.01 -0.54 -2.57 0.00 0.00 177.10 174.45 3hk9 s LYS 295 N -2.36 3.11 -0.12 -0.60 1.02 -1.26 -4.87 119.74 114.67 3hk9 s LYS 295 Ca 0.28 -0.44 0.01 0.00 0.02 0.00 0.00 55.97 55.84 3hk9 s LYS 295 Cb -0.12 -2.80 0.02 0.00 -0.52 0.00 0.00 37.83 34.40 3hk9 s LYS 295 CO 0.21 0.60 -0.15 -0.06 -0.92 0.00 0.00 175.35 175.03 3hk9 s PHE 296 N -0.61 1.99 -0.24 3.18 0.08 -0.36 -0.50 117.98 121.52 3hk9 s PHE 296 Ca 0.10 -0.98 -0.09 0.00 0.12 0.00 0.00 56.93 56.08 3hk9 s PHE 296 Cb -0.12 -1.45 -0.04 0.00 -0.57 0.00 0.00 43.02 40.84 3hk9 s PHE 296 CO 0.02 -0.52 0.13 -0.51 -0.10 0.00 0.00 175.22 174.24 3hk9 s LEU 297 N 1.13 3.91 0.01 -0.37 1.43 -0.25 -0.88 118.68 123.65 3hk9 s LEU 297 Ca -0.03 0.02 0.03 0.00 -1.03 0.00 0.00 54.13 53.12 3hk9 s LEU 297 Cb -0.14 -2.04 -0.01 0.00 0.03 0.00 0.00 46.19 44.02 3hk9 s LEU 297 CO -0.04 0.05 -0.09 -0.69 0.23 0.00 0.00 176.35 175.81 3hk9 s VAL 298 N 1.15 0.72 -0.06 -1.59 1.01 -0.75 -0.25 120.40 120.63 3hk9 s VAL 298 Ca 0.06 -0.53 -0.05 0.00 0.00 0.00 0.00 61.98 61.47 3hk9 s VAL 298 Cb -0.14 -0.63 0.02 0.00 0.00 0.00 0.00 36.38 35.63 3hk9 s VAL 298 CO 0.05 0.10 0.15 0.28 0.00 0.00 0.00 175.10 175.68 3hk9 s THR 299 N -0.42 -0.01 0.13 3.92 -1.32 -0.90 -1.52 115.64 115.53 3hk9 s THR 299 Ca 0.02 0.04 0.11 0.00 -1.21 0.00 0.00 61.69 60.64 3hk9 s THR 299 Cb -0.05 -0.22 -0.04 0.00 -1.51 0.00 0.00 72.50 70.68 3hk9 s THR 299 CO -0.00 0.02 -0.24 -0.04 -2.21 0.00 0.00 174.62 172.14 3hk9 s MET 300 N 0.31 1.52 0.03 7.08 -1.94 -1.26 -1.57 119.30 123.47 3hk9 s MET 300 Ca -0.02 -1.33 0.11 0.00 -1.71 0.00 0.00 55.69 52.75 3hk9 s MET 300 Cb -0.03 -1.95 -0.20 0.00 2.01 0.00 0.00 34.83 34.65 3hk9 s MET 300 CO -0.01 0.45 0.90 1.25 -0.01 0.00 0.00 175.02 177.60 3hk9 h LEU 301 N 3.76 0.00 -9.49 -0.03 5.85 -0.91 -3.42 115.31 111.06 3hk9 h LEU 301 Ca -0.50 0.00 -0.54 0.00 0.84 0.00 0.00 57.88 57.68 3hk9 h LEU 301 Cb 1.17 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 42.17 3hk9 h LEU 301 CO 0.42 0.94 0.25 -0.55 -0.34 0.00 0.00 178.44 179.16 3hk9 s SER 302 N -6.27 7.29 0.44 1.25 0.15 -1.26 -4.56 113.70 110.73 3hk9 s SER 302 Ca -0.02 1.55 0.11 0.00 0.70 0.00 0.00 55.95 58.29 3hk9 s SER 302 Cb 0.09 -2.51 0.98 0.00 -1.71 0.00 0.00 66.02 62.86 3hk9 s SER 302 CO 0.82 -0.08 2.05 -0.09 1.20 0.00 0.00 173.24 177.13 3hk9 h ARG 303 N 6.03 0.41 0.00 5.44 2.43 -1.96 -1.70 114.38 125.03 3hk9 h ARG 303 Ca -0.43 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 58.72 3hk9 h ARG 303 Cb 1.21 -0.09 0.00 0.00 -0.42 0.00 0.00 29.97 30.67 3hk9 h ARG 303 CO 0.73 0.27 0.00 0.39 -1.51 0.00 0.00 179.97 179.85 3hk9 n GLU 304 N -4.48 0.29 0.01 0.20 4.71 -1.26 -2.81 120.64 117.30 3hk9 n GLU 304 Ca 0.04 0.09 0.11 0.00 -0.01 0.00 0.00 57.16 57.40 3hk9 n GLU 304 Cb 0.17 -1.50 -0.14 0.00 -1.01 0.00 0.00 31.44 28.96 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 -1.29 0.19 -0.08 1.62 5.03 -0.64 -4.67 115.26 115.41 3hk9 n ASN 305 Ca 0.10 -0.01 -0.06 0.00 0.87 0.00 0.00 54.58 55.47 3hk9 n ASN 305 Cb 0.17 1.69 0.00 0.00 -1.02 0.00 0.00 39.78 40.62 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 0.06 -0.39 3.52 1.08 -1.55 -1.87 115.11 115.94 3hk9 h GLN 306 Ca 0.00 -0.00 -0.04 0.00 -1.45 0.00 0.00 58.65 57.15 3hk9 h GLN 306 Cb 0.96 -0.01 -0.02 0.00 -0.05 0.00 0.00 27.48 28.37 3hk9 h GLN 306 CO 0.00 0.04 0.07 1.25 -0.95 0.00 0.00 178.83 179.24 3hk9 h HIS 307 N 0.06 0.69 0.00 2.96 2.76 -1.83 -2.72 115.15 117.06 3hk9 h HIS 307 Ca 0.15 -0.09 -0.05 0.00 -2.20 0.00 0.00 60.37 58.18 3hk9 h HIS 307 Cb 0.21 -0.19 -0.01 0.00 1.55 0.00 0.00 27.41 28.98 3hk9 h HIS 307 CO -0.25 0.68 -0.23 1.05 -1.30 0.00 0.00 177.93 177.88 3hk9 h GLU 308 N 0.50 0.00 -0.43 5.26 4.11 -1.84 -2.34 114.58 119.85 3hk9 h GLU 308 Ca 0.12 0.00 -0.14 0.00 0.07 0.00 0.00 59.36 59.41 3hk9 h GLU 308 Cb 0.35 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.59 3hk9 h GLU 308 CO 0.01 0.23 -0.29 1.25 0.07 0.00 0.00 179.01 180.27 3hk9 h LEU 309 N 0.00 0.98 -0.41 3.06 5.85 -1.13 -0.94 115.31 122.71 3hk9 h LEU 309 Ca -0.00 -0.40 -0.03 0.00 0.84 0.00 0.00 57.88 58.29 3hk9 h LEU 309 Cb 0.61 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 41.35 3hk9 h LEU 309 CO 0.03 1.19 0.15 0.58 -0.34 0.00 0.00 178.44 180.05 3hk9 h VAL 310 N 0.79 1.21 -0.33 1.05 2.07 -1.17 -1.50 116.25 118.37 3hk9 h VAL 310 Ca 0.09 -0.65 -0.03 0.00 0.82 0.00 0.00 66.70 66.93 3hk9 h VAL 310 Cb 0.87 0.87 -0.02 0.00 -1.52 0.00 0.00 31.29 31.49 3hk9 h VAL 310 CO 0.08 0.23 0.10 0.58 0.02 0.00 0.00 177.57 178.58 3hk9 h VAL 311 N 0.51 1.15 -0.13 2.57 2.07 -1.23 -1.62 116.25 119.57 3hk9 h VAL 311 Ca 0.13 -0.51 -0.10 0.00 0.82 0.00 0.00 66.70 67.05 3hk9 h VAL 311 Cb 0.22 0.79 -0.01 0.00 -1.52 0.00 0.00 31.29 30.77 3hk9 h VAL 311 CO -0.01 0.19 -0.37 0.25 0.02 0.00 0.00 177.57 177.65 3hk9 h LEU 312 N 0.47 0.29 -1.00 2.57 5.85 -0.53 -2.21 115.31 120.75 3hk9 h LEU 312 Ca 0.11 -0.11 -0.09 0.00 0.84 0.00 0.00 57.88 58.63 3hk9 h LEU 312 Cb 0.16 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.09 3hk9 h LEU 312 CO -0.01 0.65 -0.29 0.00 -0.34 0.00 0.00 178.44 178.45 3hk9 h ALA 313 N 1.37 1.15 -0.10 1.25 0.00 -0.34 -1.69 119.26 120.90 3hk9 h ALA 313 Ca 0.03 -0.35 -0.02 0.00 0.00 0.00 0.00 54.91 54.57 3hk9 h ALA 313 Cb 0.77 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.45 3hk9 h ALA 313 CO 0.06 0.54 -0.03 0.00 0.00 0.00 0.00 179.25 179.82 3hk9 h ARG 314 N 0.33 0.15 0.16 0.00 3.08 -0.87 -2.98 114.38 114.24 3hk9 h ARG 314 Ca 0.05 -0.02 -0.30 0.00 0.07 0.00 0.00 59.98 59.78 3hk9 h ARG 314 Cb 0.68 -0.03 0.02 0.00 0.08 0.00 0.00 29.97 30.72 3hk9 h ARG 314 CO 0.05 0.20 -1.30 0.87 -1.07 0.00 0.00 179.97 178.72 3hk9 h LYS 315 N 0.15 0.49 -4.51 0.04 1.79 -1.09 -3.45 116.57 109.98 3hk9 h LYS 315 Ca 0.04 -0.74 -0.58 0.00 -2.18 0.00 0.00 60.65 57.18 3hk9 h LYS 315 Cb 0.16 0.26 -0.36 0.00 -1.58 0.00 0.00 32.23 30.71 3hk9 h LYS 315 CO 0.01 1.34 -0.82 -0.06 -1.08 0.00 0.00 179.45 178.83 3hk9 s PHE 316 N -2.80 1.99 0.23 -1.35 0.08 -0.84 -4.99 117.98 110.29 3hk9 s PHE 316 Ca -0.08 -1.13 0.35 0.00 0.12 0.00 0.00 56.93 56.19 3hk9 s PHE 316 Cb 0.06 -1.49 1.57 0.00 -0.57 0.00 0.00 43.02 42.58 3hk9 s PHE 316 CO 0.92 -0.64 2.06 0.66 -0.10 0.00 0.00 175.22 178.13 3hk9 h SER 317 N 8.08 0.00 -0.10 1.36 4.64 -1.88 -2.17 113.55 123.47 3hk9 h SER 317 Ca -0.34 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.98 3hk9 h SER 317 Cb 1.13 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.22 3hk9 h SER 317 CO 0.48 0.02 0.00 -0.46 -0.87 0.00 0.00 176.83 176.00 3hk9 n ASN 318 N -3.13 0.63 -4.45 4.97 6.94 -1.26 -4.69 115.26 114.27 3hk9 n ASN 318 Ca -0.00 -1.84 -0.35 0.00 -0.02 0.00 0.00 54.58 52.36 3hk9 n ASN 318 Cb 0.26 -0.07 -0.12 0.00 -2.36 0.00 0.00 39.78 37.49 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 -1.19 3.29 -0.23 -4.53 2.96 -0.82 -1.23 118.68 116.93 3hk9 s LEU 319 Ca 0.15 -0.20 0.02 0.00 -0.22 0.00 0.00 54.13 53.88 3hk9 s LEU 319 Cb 0.08 -1.84 0.05 0.00 0.50 0.00 0.00 46.19 44.98 3hk9 s LEU 319 CO 0.11 0.05 -0.10 -0.32 -1.32 0.00 0.00 176.35 174.77 3hk9 s MET 320 N 1.08 2.11 0.31 1.98 -2.45 -0.06 -4.91 119.30 117.36 3hk9 s MET 320 Ca 0.02 -1.12 -0.14 0.00 -1.25 0.00 0.00 55.69 53.21 3hk9 s MET 320 Cb -0.14 -2.69 -0.09 0.00 1.25 0.00 0.00 34.83 33.16 3hk9 s MET 320 CO 0.02 -0.52 0.71 0.96 1.05 0.00 0.00 175.02 177.24 3hk9 s ILE 321 N 1.25 4.71 0.02 10.11 -4.36 -1.26 -1.81 121.20 129.85 3hk9 s ILE 321 Ca -0.06 0.89 -0.11 0.00 -0.26 0.00 0.00 60.65 61.12 3hk9 s ILE 321 Cb -0.18 -3.61 0.01 0.00 1.25 0.00 0.00 42.46 39.92 3hk9 s ILE 321 CO -0.07 -0.17 0.22 0.72 0.24 0.00 0.00 174.94 175.89 3hk9 s PHE 322 N -1.96 -0.03 0.37 1.37 -0.12 -0.58 -2.10 117.98 114.93 3hk9 s PHE 322 Ca 0.53 -0.07 0.00 0.00 -0.05 0.00 0.00 56.93 57.35 3hk9 s PHE 322 Cb -0.10 0.01 0.00 0.00 -0.63 0.00 0.00 43.02 42.30 3hk9 s PHE 322 CO 0.18 -0.39 0.00 0.41 -0.05 0.00 0.00 175.22 175.37 3hk9 n GLY 323 N 1.04 -1.98 2.92 1.99 0.00 -0.17 -4.38 105.19 104.61 3hk9 n GLY 323 Ca -0.21 -0.81 -0.30 0.00 0.00 0.00 0.00 46.02 44.70 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 -0.26 3.19 0.00 0.00 -0.00 -1.26 -3.04 118.94 117.57 3hk9 s TRP 325 Ca 0.17 1.23 0.00 0.00 -0.00 0.00 0.00 56.10 57.50 3hk9 s TRP 325 Cb -0.25 -3.41 0.00 0.00 -0.00 0.00 0.00 33.47 29.81 3hk9 s TRP 325 CO -0.01 -1.27 0.00 1.87 -0.00 0.00 0.00 176.95 177.54 3hk9 n TRP 326 N 5.24 0.00 0.38 5.86 -0.00 -1.26 -0.50 117.44 127.17 3hk9 n TRP 326 Ca 0.11 0.00 0.09 0.00 -0.00 0.00 0.00 57.50 57.70 3hk9 n TRP 326 Cb 0.46 0.00 0.38 0.00 -0.00 0.00 0.00 31.31 32.15 3hk9 n TRP 326 CO 0.00 0.00 0.00 1.19 -0.00 0.00 0.00 177.69 178.88 3hk9 n PHE 327 N 0.00 0.39 0.23 5.87 3.72 -1.26 -0.83 117.46 125.58 3hk9 n PHE 327 Ca 0.00 0.16 0.12 0.00 -0.05 0.00 0.00 57.45 57.68 3hk9 n PHE 327 Cb 0.00 -0.76 0.07 0.00 -0.94 0.00 0.00 39.48 37.85 3hk9 n PHE 327 CO 0.00 0.00 0.00 0.52 -0.05 0.00 0.00 176.76 177.23 3hk9 h MET 328 N 0.00 0.00 -2.54 -1.08 2.86 -1.03 -3.40 114.93 109.73 3hk9 h MET 328 Ca 0.00 0.00 -0.32 0.00 -2.06 0.00 0.00 59.70 57.32 3hk9 h MET 328 Cb 0.25 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 31.89 3hk9 h MET 328 CO 0.00 0.00 1.20 -1.71 1.06 0.00 0.00 176.91 177.46 3hk9 n ASN 329 N -2.62 5.64 -4.09 1.22 5.15 -0.01 -3.61 115.26 116.95 3hk9 n ASN 329 Ca 0.01 -2.39 -0.22 0.00 -0.60 0.00 0.00 54.58 51.39 3hk9 n ASN 329 Cb 0.52 -1.28 -0.15 0.00 -0.53 0.00 0.00 39.78 38.34 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 2.33 1.53 0.17 1.20 0.01 -1.26 -4.97 114.94 113.94 3hk9 s ASN 330 Ca 0.58 -0.24 -0.21 0.00 -0.71 0.00 0.00 52.86 52.28 3hk9 s ASN 330 Cb 0.23 -0.19 0.07 0.00 0.41 0.00 0.00 41.25 41.77 3hk9 s ASN 330 CO -0.02 0.16 1.34 -2.65 -1.51 0.00 0.00 177.10 174.41 3hk9 n PRO 331 N 2.79 -0.29 -0.26 -0.60 -0.02 -1.26 0.33 135.00 135.69 3hk9 n PRO 331 Ca -0.14 1.32 0.05 0.00 -2.02 0.00 0.00 63.50 62.70 3hk9 n PRO 331 Cb 0.55 -1.95 0.18 0.00 -0.02 0.00 0.00 33.50 32.27 3hk9 n PRO 331 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 3hk9 h GLU 332 N 0.00 0.47 0.20 -0.52 4.57 -1.97 -0.98 114.58 116.36 3hk9 h GLU 332 Ca 0.22 -0.03 -0.28 0.00 -1.18 0.00 0.00 59.36 58.09 3hk9 h GLU 332 Cb 0.43 -0.11 0.03 0.00 -0.16 0.00 0.00 28.75 28.95 3hk9 h GLU 332 CO -0.84 0.31 -1.24 0.82 -1.18 0.00 0.00 179.01 176.89 3hk9 h ILE 333 N 0.49 1.34 -0.80 2.32 1.08 -1.22 -3.08 117.51 117.65 3hk9 h ILE 333 Ca 0.41 -2.61 0.10 0.00 -0.39 0.00 0.00 64.86 62.36 3hk9 h ILE 333 Cb 0.58 3.08 -0.07 0.00 -3.07 0.00 0.00 36.82 37.34 3hk9 h ILE 333 CO -0.37 0.77 0.44 0.40 -0.69 0.00 0.00 178.15 178.70 3hk9 h ILE 334 N -0.08 0.88 0.31 -0.67 2.04 0.13 -0.29 117.51 119.83 3hk9 h ILE 334 Ca -0.22 -0.25 -0.02 0.00 1.00 0.00 0.00 64.86 65.37 3hk9 h ILE 334 Cb 1.95 0.09 0.00 0.00 -0.74 0.00 0.00 36.82 38.12 3hk9 h ILE 334 CO 0.21 0.13 -0.15 -1.13 0.00 0.00 0.00 178.15 177.22 3hk9 h ASN 335 N 0.73 -0.36 -0.75 1.72 -1.24 -1.26 -1.02 115.58 113.39 3hk9 h ASN 335 Ca 0.39 -0.05 -0.06 0.00 0.71 0.00 0.00 56.30 57.29 3hk9 h ASN 335 Cb 0.39 0.09 -0.03 0.00 0.73 0.00 0.00 38.32 39.50 3hk9 h ASN 335 CO -0.26 -0.18 0.26 1.05 -1.29 0.00 0.00 177.43 177.01 3hk9 h GLU 336 N -0.52 1.16 -0.41 6.67 4.11 -1.39 -1.87 114.58 122.33 3hk9 h GLU 336 Ca -0.04 -0.24 -0.04 0.00 0.07 0.00 0.00 59.36 59.11 3hk9 h GLU 336 Cb 0.39 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.45 3hk9 h GLU 336 CO 0.07 0.97 0.08 0.52 0.07 0.00 0.00 179.01 180.73 3hk9 h MET 337 N 1.12 0.67 -0.18 1.06 2.86 -1.01 -1.76 114.93 117.69 3hk9 h MET 337 Ca 0.25 -0.17 -0.08 0.00 -2.06 0.00 0.00 59.70 57.64 3hk9 h MET 337 Cb 0.28 -0.08 -0.01 0.00 0.06 0.00 0.00 31.60 31.84 3hk9 h MET 337 CO -0.01 0.70 -0.25 1.15 1.06 0.00 0.00 176.91 179.56 3hk9 h THR 338 N 0.53 1.25 -0.07 2.22 2.02 -1.01 -1.25 112.91 116.59 3hk9 h THR 338 Ca 0.13 -1.18 -0.14 0.00 0.77 0.00 0.00 66.41 65.99 3hk9 h THR 338 Cb 0.34 1.39 0.01 0.00 -1.74 0.00 0.00 68.15 68.15 3hk9 h THR 338 CO 0.00 0.36 -0.51 0.03 0.37 0.00 0.00 175.52 175.78 3hk9 h ARG 339 N 0.30 0.47 -0.78 6.66 3.08 -1.21 -1.75 114.38 121.15 3hk9 h ARG 339 Ca 0.05 -0.41 -0.03 0.00 0.07 0.00 0.00 59.98 59.66 3hk9 h ARG 339 Cb 0.61 0.09 -0.04 0.00 0.08 0.00 0.00 29.97 30.71 3hk9 h ARG 339 CO 0.04 1.05 0.37 0.52 -1.07 0.00 0.00 179.97 180.89 3hk9 h MET 340 N 0.03 1.13 0.27 0.04 2.86 -1.24 -0.62 114.93 117.40 3hk9 h MET 340 Ca -0.04 -0.17 -0.01 0.00 -2.06 0.00 0.00 59.70 57.42 3hk9 h MET 340 Cb 1.17 -0.20 0.00 0.00 0.06 0.00 0.00 31.60 32.63 3hk9 h MET 340 CO 0.10 0.88 -0.13 0.00 1.06 0.00 0.00 176.91 178.82 3hk9 h ARG 341 N 1.10 -0.35 -0.75 1.72 3.08 -1.24 -2.65 114.38 115.28 3hk9 h ARG 341 Ca 0.27 0.02 -0.04 0.00 0.07 0.00 0.00 59.98 60.31 3hk9 h ARG 341 Cb 0.12 0.08 -0.03 0.00 0.08 0.00 0.00 29.97 30.22 3hk9 h ARG 341 CO -0.03 -0.17 0.33 1.98 -1.07 0.00 0.00 179.97 181.01 3hk9 h MET 342 N -0.47 1.10 -0.64 0.04 4.05 -1.13 0.33 114.93 118.21 3hk9 h MET 342 Ca -0.04 -0.18 -0.00 0.00 -0.28 0.00 0.00 59.70 59.20 3hk9 h MET 342 Cb 0.35 -0.19 -0.03 0.00 -0.80 0.00 0.00 31.60 30.93 3hk9 h MET 342 CO 0.06 0.88 0.40 0.93 0.23 0.00 0.00 176.91 179.41 3hk9 h GLU 343 N 1.07 0.86 0.00 0.39 5.08 -1.08 0.17 114.58 121.07 3hk9 h GLU 343 Ca 0.25 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.55 3hk9 h GLU 343 Cb 0.16 -0.19 0.00 0.00 0.50 0.00 0.00 28.75 29.23 3hk9 h GLU 343 CO -0.03 0.59 -1.44 -1.33 -1.00 0.00 0.00 179.01 175.80 3hk9 n MET 344 N -4.42 0.41 0.00 2.33 2.81 -1.01 -4.60 117.12 112.65 3hk9 n MET 344 Ca 0.06 -0.09 0.00 0.00 -1.81 0.00 0.00 57.70 55.86 3hk9 n MET 344 Cb 0.06 -1.49 0.00 0.00 -0.71 0.00 0.00 33.22 31.09 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 -1.84 0.52 0.00 4.03 4.77 0.12 -4.89 117.00 119.71 3hk9 n LEU 345 Ca 0.00 -0.67 0.00 0.00 -0.03 0.00 0.00 56.01 55.31 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 0.43 0.13 0.00 0.61 -1.33 0.00 0.00 177.39 177.23 3hk9 n GLY 346 N 0.29 3.45 0.74 -0.72 0.00 0.60 -1.77 105.19 107.77 3hk9 n GLY 346 Ca 0.00 -0.10 0.06 0.00 0.00 0.00 0.00 46.02 45.98 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 1.16 -1.39 2.61 -2.24 -1.26 -4.33 114.28 108.83 3hk9 n THR 347 Ca 0.00 -1.10 -0.29 0.00 -2.27 0.00 0.00 64.05 60.40 3hk9 n THR 347 Cb 0.00 0.41 -0.07 0.00 -2.10 0.00 0.00 70.33 68.57 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 0.50 7.10 -3.81 3.42 3.41 -0.73 -4.69 113.62 118.82 3hk9 n SER 348 Ca 0.14 -2.78 -0.07 0.00 -0.26 0.00 0.00 58.87 55.89 3hk9 n SER 348 Cb 0.50 -1.41 -0.02 0.00 -0.26 0.00 0.00 64.21 63.02 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 0.37 -0.22 -0.43 7.33 -0.12 -1.26 -4.81 117.98 118.84 3hk9 s PHE 349 Ca 0.64 -0.21 -0.05 0.00 -0.05 0.00 0.00 56.93 57.26 3hk9 s PHE 349 Cb 0.26 0.69 0.11 0.00 -0.63 0.00 0.00 43.02 43.46 3hk9 s PHE 349 CO -0.08 -1.19 0.25 0.42 -0.05 0.00 0.00 175.22 174.57 3hk9 s ILE 350 N -3.88 3.54 0.47 -4.49 1.01 -0.89 -4.65 121.20 112.30 3hk9 s ILE 350 Ca 0.10 -2.01 0.18 0.00 0.00 0.00 0.00 60.65 58.93 3hk9 s ILE 350 Cb -0.05 -3.40 0.36 0.00 0.01 0.00 0.00 42.46 39.38 3hk9 s ILE 350 CO 0.05 -0.72 1.97 1.55 0.00 0.00 0.00 174.94 177.79 3hk9 h PRO 351 N 8.13 0.25 -3.11 2.79 0.13 -1.85 -0.42 132.00 137.92 3hk9 h PRO 351 Ca -0.15 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.97 3hk9 h PRO 351 Cb 1.05 -0.06 -0.10 0.00 0.13 0.00 0.00 31.00 32.03 3hk9 h PRO 351 CO 0.74 0.17 0.15 -1.14 -0.23 0.00 0.00 178.00 177.69 3hk9 s GLN 352 N -5.26 1.42 0.06 0.86 2.00 -1.26 -3.67 119.66 113.82 3hk9 s GLN 352 Ca -0.07 -0.73 -0.10 0.00 -2.00 0.00 0.00 55.36 52.47 3hk9 s GLN 352 Cb 0.20 0.57 0.00 0.00 0.80 0.00 0.00 33.01 34.58 3hk9 s GLN 352 CO 0.75 -0.62 0.21 -3.38 -0.50 0.00 0.00 175.29 171.74 3hk9 s HIS 353 N -3.83 0.07 -0.04 1.67 -3.43 -1.26 -4.59 115.29 103.87 3hk9 s HIS 353 Ca 0.06 -0.37 -0.05 0.00 -0.80 0.00 0.00 55.06 53.91 3hk9 s HIS 353 Cb -0.02 -0.02 -0.28 0.00 -1.43 0.00 0.00 32.58 30.83 3hk9 s HIS 353 CO -0.05 -0.49 0.68 0.66 -2.00 0.00 0.00 174.74 173.53 3hk9 h SER 354 N 3.10 0.43 -0.84 7.38 4.64 -1.93 -3.45 113.55 122.88 3hk9 h SER 354 Ca -0.33 -0.69 -0.29 0.00 -0.47 0.00 0.00 61.79 60.01 3hk9 h SER 354 Cb 1.20 -0.14 -0.10 0.00 -0.31 0.00 0.00 62.40 63.05 3hk9 h SER 354 CO 0.51 1.59 -0.28 -0.67 -0.87 0.00 0.00 176.83 177.12 3hk9 n ASP 355 N -3.46 -4.69 -4.65 4.97 -0.08 -0.12 -4.89 116.55 103.64 3hk9 n ASP 355 Ca -0.22 0.31 -0.48 0.00 -1.51 0.00 0.00 54.79 52.89 3hk9 n ASP 355 Cb 1.06 -3.49 -0.05 0.00 2.34 0.00 0.00 41.12 40.97 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 0.93 0.56 -0.01 -1.67 0.00 -1.26 -4.36 120.51 114.70 3hk9 n ALA 356 Ca -0.15 0.45 0.07 0.00 0.00 0.00 0.00 53.44 53.81 3hk9 n ALA 356 Cb 0.49 -2.28 -0.13 0.00 0.00 0.00 0.00 19.45 17.53 3hk9 n ALA 356 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3hk9 n ARG 357 N 3.55 0.58 -4.75 0.00 1.74 -1.26 0.37 116.66 116.90 3hk9 n ARG 357 Ca 0.18 -0.14 -0.26 0.00 -0.77 0.00 0.00 57.85 56.86 3hk9 n ARG 357 Cb 0.25 -1.40 -0.17 0.00 -1.02 0.00 0.00 32.46 30.12 3hk9 n ARG 357 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 3hk9 s VAL 358 N -3.11 1.36 0.20 1.55 1.01 -1.26 -4.45 120.40 115.70 3hk9 s VAL 358 Ca -0.06 -0.62 -0.20 0.00 0.00 0.00 0.00 61.98 61.10 3hk9 s VAL 358 Cb 0.10 -1.21 0.15 0.00 0.00 0.00 0.00 36.38 35.42 3hk9 s VAL 358 CO 0.70 0.40 1.47 -0.11 0.00 0.00 0.00 175.10 177.56 3hk9 n LEU 359 N 3.68 -0.72 0.33 3.92 7.94 -0.05 -1.12 117.00 130.98 3hk9 n LEU 359 Ca -0.22 1.67 0.22 0.00 -1.11 0.00 0.00 56.01 56.57 3hk9 n LEU 359 Cb 0.52 -0.34 1.15 0.00 0.53 0.00 0.00 43.42 45.29 3hk9 n LEU 359 CO 0.26 -1.46 1.17 -0.33 -1.11 0.00 0.00 177.39 175.92 3hk9 h GLU 360 N 0.00 0.00 0.00 1.96 3.07 -1.94 -2.50 114.58 115.17 3hk9 h GLU 360 Ca 0.28 0.00 -0.00 0.00 -0.50 0.00 0.00 59.36 59.14 3hk9 h GLU 360 Cb 0.52 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 28.43 3hk9 h GLU 360 CO -0.93 0.00 -0.02 1.96 -1.40 0.00 0.00 179.01 178.62 3hk9 h GLN 361 N 0.00 0.00 -0.23 2.33 4.20 -1.53 -1.51 115.11 118.37 3hk9 h GLN 361 Ca 0.00 0.00 0.07 0.00 0.06 0.00 0.00 58.65 58.78 3hk9 h GLN 361 Cb 0.08 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.85 3hk9 h GLN 361 CO 0.00 0.02 0.19 -0.07 -0.67 0.00 0.00 178.83 178.29 3hk9 h LEU 362 N 0.00 0.00 0.15 1.46 3.38 -1.62 0.18 115.31 118.86 3hk9 h LEU 362 Ca -0.00 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 3hk9 h LEU 362 Cb 0.11 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.86 3hk9 h LEU 362 CO 0.00 0.00 -0.07 0.40 0.09 0.00 0.00 178.44 178.86 3hk9 h ILE 363 N 0.00 0.99 -0.04 1.22 2.04 -1.52 -3.07 117.51 117.14 3hk9 h ILE 363 Ca 0.11 -0.99 -0.25 0.00 1.00 0.00 0.00 64.86 64.73 3hk9 h ILE 363 Cb 0.49 1.56 0.02 0.00 -0.74 0.00 0.00 36.82 38.14 3hk9 h ILE 363 CO -0.00 0.22 -0.96 0.10 0.00 0.00 0.00 178.15 177.51 3hk9 h TYR 364 N -0.70 0.97 -0.41 1.37 -0.00 -1.60 -2.20 116.97 114.40 3hk9 h TYR 364 Ca -0.02 -0.50 0.03 0.00 0.00 0.00 0.00 58.73 58.24 3hk9 h TYR 364 Cb 0.51 -0.12 -0.03 0.00 0.00 0.00 0.00 36.73 37.08 3hk9 h TYR 364 CO 0.07 1.33 0.20 0.87 -0.00 0.00 0.00 178.16 180.64 3hk9 h LYS 365 N 0.40 0.40 0.01 0.10 1.79 -1.10 0.13 116.57 118.30 3hk9 h LYS 365 Ca -0.10 -0.02 -0.20 0.00 -2.18 0.00 0.00 60.65 58.14 3hk9 h LYS 365 Cb 1.60 -0.09 -0.02 0.00 -1.58 0.00 0.00 32.23 32.14 3hk9 h LYS 365 CO 0.19 0.26 -0.93 -1.49 -1.08 0.00 0.00 179.45 176.39 3hk9 h TRP 366 N 0.41 0.12 -0.14 -1.35 4.06 -1.62 -2.25 115.95 115.18 3hk9 h TRP 366 Ca 0.17 -0.07 -0.18 0.00 2.06 0.00 0.00 58.89 60.87 3hk9 h TRP 366 Cb 0.08 -0.01 0.01 0.00 -1.00 0.00 0.00 29.16 28.24 3hk9 h TRP 366 CO -0.10 0.96 -0.61 1.25 -3.56 0.00 0.00 178.44 176.38 3hk9 h HIS 367 N 0.03 0.87 -0.39 0.49 2.76 -1.15 0.23 115.15 118.00 3hk9 h HIS 367 Ca -0.03 -0.38 -0.11 0.00 -2.20 0.00 0.00 60.37 57.65 3hk9 h HIS 367 Cb 1.62 -0.14 -0.02 0.00 1.55 0.00 0.00 27.41 30.43 3hk9 h HIS 367 CO 0.01 1.18 -0.19 0.45 -1.30 0.00 0.00 177.93 178.08 3hk9 h HIS 368 N 0.32 0.84 0.04 5.26 3.86 -0.81 -2.97 115.15 121.69 3hk9 h HIS 368 Ca -0.04 -0.18 -0.16 0.00 -1.16 0.00 0.00 60.37 58.83 3hk9 h HIS 368 Cb 1.24 -0.21 0.01 0.00 1.06 0.00 0.00 27.41 29.52 3hk9 h HIS 368 CO 0.10 0.88 -0.65 0.77 0.86 0.00 0.00 177.93 179.89 3hk9 h SER 369 N 0.66 0.51 -0.72 2.45 0.02 -1.40 -3.28 113.55 111.79 3hk9 h SER 369 Ca 0.10 -0.81 0.04 0.00 -0.84 0.00 0.00 61.79 60.28 3hk9 h SER 369 Cb 0.69 -0.16 -0.04 0.00 0.14 0.00 0.00 62.40 63.03 3hk9 h SER 369 CO 0.05 1.26 0.47 0.11 -1.14 0.00 0.00 176.83 177.59 3hk9 h LYS 370 N -0.18 0.80 -0.40 3.45 1.57 -0.98 0.40 116.57 121.22 3hk9 h LYS 370 Ca -0.09 -0.05 -0.08 0.00 -1.87 0.00 0.00 60.65 58.56 3hk9 h LYS 370 Cb 1.40 -0.18 -0.02 0.00 0.08 0.00 0.00 32.23 33.51 3hk9 h LYS 370 CO 0.13 0.53 -0.07 0.66 -0.57 0.00 0.00 179.45 180.13 3hk9 h SER 371 N 0.82 0.66 -0.04 0.86 4.64 -1.62 0.23 113.55 119.10 3hk9 h SER 371 Ca 0.29 -0.17 -0.14 0.00 -0.47 0.00 0.00 61.79 61.30 3hk9 h SER 371 Cb 0.13 -0.18 0.01 0.00 -0.31 0.00 0.00 62.40 62.06 3hk9 h SER 371 CO -0.09 0.77 -0.53 0.40 -0.87 0.00 0.00 176.83 176.51 3hk9 h ILE 372 N 0.63 1.41 -0.54 0.95 2.04 -1.44 -2.66 117.51 117.90 3hk9 h ILE 372 Ca 0.12 -1.95 -0.05 0.00 1.00 0.00 0.00 64.86 63.98 3hk9 h ILE 372 Cb 0.49 2.43 -0.02 0.00 -0.74 0.00 0.00 36.82 38.98 3hk9 h ILE 372 CO 0.03 0.57 0.13 0.40 0.00 0.00 0.00 178.15 179.28 3hk9 h ILE 373 N -0.05 1.22 -0.38 -0.67 2.04 -0.73 -2.01 117.51 116.94 3hk9 h ILE 373 Ca -0.05 -0.80 -0.02 0.00 1.00 0.00 0.00 64.86 64.98 3hk9 h ILE 373 Cb 1.21 0.67 -0.02 0.00 -0.74 0.00 0.00 36.82 37.94 3hk9 h ILE 373 CO 0.11 0.30 0.17 0.00 0.00 0.00 0.00 178.15 178.72 3hk9 h ALA 374 N 1.35 0.49 -0.96 1.87 0.00 -0.58 -1.65 119.26 119.78 3hk9 h ALA 374 Ca 0.18 -0.12 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 3hk9 h ALA 374 Cb 0.29 -0.15 -0.05 0.00 0.00 0.00 0.00 17.79 17.88 3hk9 h ALA 374 CO -0.00 0.07 0.59 1.49 0.00 0.00 0.00 179.25 181.40 3hk9 h GLU 375 N 0.47 1.30 -0.19 0.00 4.57 -1.08 -0.08 114.58 119.56 3hk9 h GLU 375 Ca 0.13 -0.11 -0.01 0.00 -1.18 0.00 0.00 59.36 58.18 3hk9 h GLU 375 Cb 0.15 -0.28 -0.01 0.00 -0.16 0.00 0.00 28.75 28.46 3hk9 h GLU 375 CO -0.01 0.90 0.06 0.28 -1.18 0.00 0.00 179.01 179.06 3hk9 h VAL 376 N 1.33 1.18 -0.79 0.32 2.07 -1.13 -2.16 116.25 117.06 3hk9 h VAL 376 Ca 0.35 -0.56 0.02 0.00 0.82 0.00 0.00 66.70 67.33 3hk9 h VAL 376 Cb -0.08 1.20 -0.04 0.00 -1.52 0.00 0.00 31.29 30.85 3hk9 h VAL 376 CO -0.07 0.18 0.51 -0.07 0.02 0.00 0.00 177.57 178.14 3hk9 h LEU 377 N 0.14 0.86 -0.37 2.57 3.38 -0.93 -0.42 115.31 120.54 3hk9 h LEU 377 Ca 0.06 -0.01 0.01 0.00 0.09 0.00 0.00 57.88 58.04 3hk9 h LEU 377 Cb 0.22 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.74 3hk9 h LEU 377 CO -0.00 0.61 0.22 0.40 0.09 0.00 0.00 178.44 179.76 3hk9 h ILE 378 N 1.02 1.04 -0.48 1.22 2.04 -0.84 0.36 117.51 121.88 3hk9 h ILE 378 Ca 0.31 -0.16 -0.01 0.00 1.00 0.00 0.00 64.86 66.00 3hk9 h ILE 378 Cb -0.04 0.55 -0.02 0.00 -0.74 0.00 0.00 36.82 36.57 3hk9 h ILE 378 CO -0.09 0.08 0.27 0.44 0.00 0.00 0.00 178.15 178.85 3hk9 h ASP 379 N 0.45 0.59 -0.35 1.72 3.32 -0.92 -0.30 116.42 120.94 3hk9 h ASP 379 Ca 0.15 -0.08 -0.13 0.00 0.02 0.00 0.00 57.03 56.99 3hk9 h ASP 379 Cb -0.00 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 39.39 3hk9 h ASP 379 CO -0.07 0.49 -0.27 0.11 -1.72 0.00 0.00 179.24 177.79 3hk9 h LYS 380 N 0.63 0.86 -0.24 3.56 6.56 -0.56 -1.83 116.57 125.56 3hk9 h LYS 380 Ca 0.17 -0.38 -0.19 0.00 -1.06 0.00 0.00 60.65 59.19 3hk9 h LYS 380 Cb 0.03 -0.02 0.00 0.00 -0.57 0.00 0.00 32.23 31.67 3hk9 h LYS 380 CO -0.03 1.02 -0.61 1.88 -2.06 0.00 0.00 179.45 179.65 3hk9 h TYR 381 N 0.73 1.02 -0.38 -1.35 0.05 -0.22 -3.13 116.97 113.70 3hk9 h TYR 381 Ca 0.09 -0.39 -0.07 0.00 0.05 0.00 0.00 58.73 58.41 3hk9 h TYR 381 Cb 0.82 -0.18 -0.02 0.00 1.01 0.00 0.00 36.73 38.36 3hk9 h TYR 381 CO 0.05 1.20 -0.07 0.22 -1.05 0.00 0.00 178.16 178.52 3hk9 h ASP 382 N 0.60 0.61 -0.90 3.88 3.58 -0.96 -0.31 116.42 122.91 3hk9 h ASP 382 Ca -0.00 -0.15 -0.01 0.00 0.42 0.00 0.00 57.03 57.29 3hk9 h ASP 382 Cb 1.22 -0.16 -0.04 0.00 1.72 0.00 0.00 39.33 42.06 3hk9 h ASP 382 CO 0.13 0.72 0.54 0.44 -2.88 0.00 0.00 179.24 178.19 3hk9 h ASP 383 N 0.59 1.09 0.99 2.28 3.32 -1.29 0.11 116.42 123.52 3hk9 h ASP 383 Ca 0.11 -0.07 -0.21 0.00 0.02 0.00 0.00 57.03 56.88 3hk9 h ASP 383 Cb 0.47 -0.28 -0.03 0.00 0.22 0.00 0.00 39.33 39.71 3hk9 h ASP 383 CO 0.02 0.85 -1.03 0.16 -1.72 0.00 0.00 179.24 177.52 3hk9 h ILE 384 N 1.25 1.55 -0.23 0.35 3.07 -1.44 -2.95 117.51 119.11 3hk9 h ILE 384 Ca 0.32 -3.24 -0.01 0.00 1.55 0.00 0.00 64.86 63.48 3hk9 h ILE 384 Cb -0.04 2.76 -0.01 0.00 -0.27 0.00 0.00 36.82 39.26 3hk9 h ILE 384 CO -0.06 0.88 0.10 0.25 -1.05 0.00 0.00 178.15 178.28 3hk9 h LEU 385 N 0.00 0.31 -2.16 0.16 5.85 -0.72 -1.34 115.31 117.41 3hk9 h LEU 385 Ca -0.04 -0.14 -0.01 0.00 0.84 0.00 0.00 57.88 58.53 3hk9 h LEU 385 Cb 1.76 -0.08 -0.00 0.00 0.37 0.00 0.00 40.66 42.71 3hk9 h LEU 385 CO 0.12 0.36 -0.05 1.56 -0.34 0.00 0.00 178.44 180.10 3hk9 h GLN 386 N 0.23 0.00 -0.01 1.25 1.08 -1.04 -0.56 115.11 116.05 3hk9 h GLN 386 Ca 0.08 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.28 3hk9 h GLN 386 Cb 0.14 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.57 3hk9 h GLN 386 CO -0.01 0.05 0.00 0.00 -0.95 0.00 0.00 178.83 177.92 3hk9 n ALA 387 N -2.17 2.64 0.00 3.87 0.00 -0.60 -4.89 120.51 119.37 3hk9 n ALA 387 Ca -0.02 -0.27 0.00 0.00 0.00 0.00 0.00 53.44 53.15 3hk9 n ALA 387 Cb 0.20 -1.38 0.00 0.00 0.00 0.00 0.00 19.45 18.26 3hk9 n ALA 387 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hk9 n GLY 388 N 1.03 0.59 3.78 0.00 0.00 -0.22 -5.06 105.19 105.30 3hk9 n GLY 388 Ca 0.21 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.86 3hk9 n GLY 388 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 3hk9 s TRP 389 N -2.00 3.71 -0.22 1.61 -0.11 -0.64 -5.01 118.94 116.27 3hk9 s TRP 389 Ca 0.00 1.79 -0.20 0.00 1.22 0.00 0.00 56.10 58.91 3hk9 s TRP 389 Cb 0.00 -2.96 -0.02 0.00 -1.50 0.00 0.00 33.47 28.99 3hk9 s TRP 389 CO 0.00 0.17 0.62 -2.00 -4.62 0.00 0.00 176.95 171.12 3hk9 s GLU 390 N -1.92 4.16 -0.19 5.86 2.12 -1.26 -4.36 118.70 123.10 3hk9 s GLU 390 Ca 0.49 0.56 -0.02 0.00 0.36 0.00 0.00 54.97 56.36 3hk9 s GLU 390 Cb -0.20 -3.61 -0.00 0.00 0.26 0.00 0.00 34.13 30.58 3hk9 s GLU 390 CO 0.26 -0.31 -0.10 0.14 -0.54 0.00 0.00 175.26 174.71 3hk9 s VAL 391 N 2.15 2.91 0.21 3.70 -7.23 -1.26 -5.08 120.40 115.79 3hk9 s VAL 391 Ca 0.27 -0.66 0.02 0.00 -1.81 0.00 0.00 61.98 59.81 3hk9 s VAL 391 Cb -0.16 -2.29 -0.03 0.00 0.56 0.00 0.00 36.38 34.46 3hk9 s VAL 391 CO 0.09 0.47 0.35 0.42 -0.31 0.00 0.00 175.10 176.13 3hk9 s THR 392 N 1.26 5.26 0.46 5.32 -4.23 -1.26 -4.45 115.64 118.00 3hk9 s THR 392 Ca 0.03 -0.70 0.16 0.00 -1.18 0.00 0.00 61.69 60.00 3hk9 s THR 392 Cb -0.14 -3.79 0.21 0.00 1.34 0.00 0.00 72.50 70.12 3hk9 s THR 392 CO -0.05 -0.23 2.03 -0.08 -0.54 0.00 0.00 174.62 175.76 3hk9 h GLU 393 N 1.67 0.00 -0.27 3.99 4.81 -1.99 -1.92 114.58 120.87 3hk9 h GLU 393 Ca -0.50 0.00 -0.16 0.00 -0.13 0.00 0.00 59.36 58.57 3hk9 h GLU 393 Cb 1.21 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.58 3hk9 h GLU 393 CO 0.65 0.14 -0.49 1.49 -0.73 0.00 0.00 179.01 180.08 3hk9 h GLU 394 N 0.00 0.74 -0.07 1.92 4.57 -2.00 -1.93 114.58 117.81 3hk9 h GLU 394 Ca -0.00 -0.43 -0.13 0.00 -1.18 0.00 0.00 59.36 57.61 3hk9 h GLU 394 Cb 0.26 0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 28.87 3hk9 h GLU 394 CO 0.02 1.06 -0.55 0.93 -1.18 0.00 0.00 179.01 179.28 3hk9 h GLU 395 N 0.58 0.21 -0.34 1.92 5.08 -1.80 -2.13 114.58 118.11 3hk9 h GLU 395 Ca 0.03 -0.13 -0.05 0.00 -1.00 0.00 0.00 59.36 58.21 3hk9 h GLU 395 Cb 1.06 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 30.31 3hk9 h GLU 395 CO 0.10 0.71 0.03 0.82 -1.00 0.00 0.00 179.01 179.67 3hk9 h ILE 396 N 0.16 1.25 -0.78 3.13 2.04 -1.18 -1.05 117.51 121.08 3hk9 h ILE 396 Ca 0.00 -0.88 -0.03 0.00 1.00 0.00 0.00 64.86 64.95 3hk9 h ILE 396 Cb 1.02 1.17 -0.04 0.00 -0.74 0.00 0.00 36.82 38.24 3hk9 h ILE 396 CO 0.08 0.29 0.37 0.11 0.00 0.00 0.00 178.15 179.00 3hk9 h LYS 397 N 0.39 1.12 0.18 2.37 1.57 -1.24 0.77 116.57 121.72 3hk9 h LYS 397 Ca 0.10 -0.16 -0.01 0.00 -1.87 0.00 0.00 60.65 58.71 3hk9 h LYS 397 Cb 0.39 -0.20 0.00 0.00 0.08 0.00 0.00 32.23 32.50 3hk9 h LYS 397 CO 0.01 0.87 -0.08 -0.09 -0.57 0.00 0.00 179.45 179.58 3hk9 h ARG 398 N 1.11 -0.23 -0.37 3.15 2.43 -1.16 0.30 114.38 119.61 3hk9 h ARG 398 Ca 0.27 0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.45 3hk9 h ARG 398 Cb 0.12 0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 29.71 3hk9 h ARG 398 CO -0.03 -0.10 0.20 -0.44 -1.51 0.00 0.00 179.97 178.09 3hk9 h ASP 399 N -0.30 0.46 -0.58 -3.80 3.32 -0.93 -1.58 116.42 113.01 3hk9 h ASP 399 Ca -0.02 -0.09 -0.02 0.00 0.02 0.00 0.00 57.03 56.92 3hk9 h ASP 399 Cb 0.23 -0.12 -0.03 0.00 0.22 0.00 0.00 39.33 39.63 3hk9 h ASP 399 CO 0.04 0.42 0.30 0.58 -1.72 0.00 0.00 179.24 178.86 3hk9 h VAL 400 N 0.47 1.20 -0.53 -1.35 2.07 -0.75 -1.79 116.25 115.57 3hk9 h VAL 400 Ca 0.13 -0.55 -0.08 0.00 0.82 0.00 0.00 66.70 67.02 3hk9 h VAL 400 Cb 0.06 0.41 -0.02 0.00 -1.52 0.00 0.00 31.29 30.22 3hk9 h VAL 400 CO -0.02 0.23 0.00 0.00 0.02 0.00 0.00 177.57 177.80 3hk9 h ALA 401 N 1.47 1.00 0.41 1.67 0.00 -0.53 -1.59 119.26 121.69 3hk9 h ALA 401 Ca 0.21 -0.28 -0.02 0.00 0.00 0.00 0.00 54.91 54.82 3hk9 h ALA 401 Cb 0.08 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.67 3hk9 h ALA 401 CO -0.03 0.61 -0.20 -0.44 0.00 0.00 0.00 179.25 179.20 3hk9 h ASP 402 N 0.84 -0.47 -0.50 0.00 3.32 -0.53 0.12 116.42 119.20 3hk9 h ASP 402 Ca 0.16 -0.02 0.06 0.00 0.02 0.00 0.00 57.03 57.25 3hk9 h ASP 402 Cb 0.49 0.12 -0.05 0.00 0.22 0.00 0.00 39.33 40.11 3hk9 h ASP 402 CO 0.02 -0.29 0.21 -0.07 -1.72 0.00 0.00 179.24 177.39 3hk9 h LEU 403 N -0.61 0.26 -0.65 1.55 3.38 -1.21 -0.06 115.31 117.96 3hk9 h LEU 403 Ca -0.06 0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.96 3hk9 h LEU 403 Cb 0.46 0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.22 3hk9 h LEU 403 CO 0.09 0.18 -0.34 0.49 0.09 0.00 0.00 178.44 178.95 3hk9 n PHE 404 N -4.96 0.00 0.22 1.13 3.72 -0.61 -4.24 117.46 112.72 3hk9 n PHE 404 Ca 0.05 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.45 3hk9 n PHE 404 Cb 0.17 -0.08 0.00 0.00 -0.94 0.00 0.00 39.48 38.63 3hk9 n PHE 404 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 3hk9 n SER 405 N -0.46 -3.61 -0.27 4.37 2.88 -0.20 -1.68 113.62 114.65 3hk9 n SER 405 Ca 0.11 0.83 -0.01 0.00 -1.33 0.00 0.00 58.87 58.47 3hk9 n SER 405 Cb 0.39 3.40 0.11 0.00 -0.75 0.00 0.00 64.21 67.35 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 0.82 -0.69 -1.46 3.08 -0.82 -2.85 114.38 112.47 3hk9 h ARG 406 Ca 0.00 -0.05 0.09 0.00 0.07 0.00 0.00 59.98 60.09 3hk9 h ARG 406 Cb 0.00 -0.19 -0.07 0.00 0.08 0.00 0.00 29.97 29.79 3hk9 h ARG 406 CO 0.00 0.54 0.32 -0.91 -1.07 0.00 0.00 179.97 178.86 3hk9 h ASN 407 N 0.85 0.40 0.65 7.04 2.35 -1.21 0.16 115.58 125.82 3hk9 h ASN 407 Ca 0.33 0.07 -0.03 0.00 -0.55 0.00 0.00 56.30 56.11 3hk9 h ASN 407 Cb 0.14 0.00 0.01 0.00 0.05 0.00 0.00 38.32 38.52 3hk9 h ASN 407 CO -0.16 0.23 -0.31 0.15 -1.65 0.00 0.00 177.43 175.69 3hk9 h PHE 408 N 0.55 -0.81 -0.83 1.19 3.57 -1.73 -1.25 116.94 117.64 3hk9 h PHE 408 Ca 0.34 -0.02 0.04 0.00 3.53 0.00 0.00 57.97 61.86 3hk9 h PHE 408 Cb 0.38 0.27 -0.05 0.00 2.79 0.00 0.00 35.95 39.33 3hk9 h PHE 408 CO -0.12 -0.47 0.55 -1.49 -2.23 0.00 0.00 178.31 174.54 3hk9 h TRP 409 N -0.96 0.99 -0.65 0.41 4.06 -1.34 -0.06 115.95 118.40 3hk9 h TRP 409 Ca -0.09 0.02 -0.06 0.00 2.06 0.00 0.00 58.89 60.83 3hk9 h TRP 409 Cb 0.69 -0.33 -0.03 0.00 -1.00 0.00 0.00 29.16 28.50 3hk9 h TRP 409 CO -0.01 0.56 0.17 -0.09 -3.56 0.00 0.00 178.44 175.51 3hk9 h ARG 410 N 1.01 1.03 -0.30 0.49 2.43 -0.64 -1.72 114.38 116.68 3hk9 h ARG 410 Ca 0.34 -0.24 -0.08 0.00 -0.81 0.00 0.00 59.98 59.19 3hk9 h ARG 410 Cb 0.07 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 29.47 3hk9 h ARG 410 CO -0.10 0.92 -0.12 0.35 -1.51 0.00 0.00 179.97 179.50 3hk9 h PHE 411 N 0.95 0.70 0.00 2.20 3.57 0.04 -2.96 116.94 121.43 3hk9 h PHE 411 Ca 0.20 -0.17 -0.01 0.00 3.53 0.00 0.00 57.97 61.53 3hk9 h PHE 411 Cb 0.34 -0.16 -0.00 0.00 2.79 0.00 0.00 35.95 38.92 3hk9 h PHE 411 CO 0.03 0.83 -0.05 -0.39 -2.23 0.00 0.00 178.31 176.49 3hk9 h VAL 412 N 0.36 0.16 -0.44 1.41 -1.51 -0.99 -3.47 116.25 111.78 3hk9 h VAL 412 Ca 0.07 -0.56 0.00 0.00 -1.23 0.00 0.00 66.70 64.98 3hk9 h VAL 412 Cb 0.64 1.48 0.00 0.00 -2.13 0.00 0.00 31.29 31.28 3hk9 h VAL 412 CO 0.04 0.05 0.00 0.61 -1.23 0.00 0.00 177.57 177.04 3hk9 n GLY 413 N -0.15 0.94 0.00 5.19 0.00 -0.70 -4.75 105.19 105.71 3hk9 n GLY 413 Ca -0.00 -0.52 0.00 0.00 0.00 0.00 0.00 46.02 45.50 3hk9 n GLY 413 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86