#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hk7 s ILE 3 N 0.00 4.43 -0.07 2.46 1.01 -1.26 -4.82 121.20 122.94 3hk7 s ILE 3 Ca 0.00 -0.38 0.13 0.00 0.00 0.00 0.00 60.65 60.40 3hk7 s ILE 3 Cb 0.00 -4.62 0.26 0.00 0.01 0.00 0.00 42.46 38.11 3hk7 s ILE 3 CO 0.00 -1.34 1.12 -0.46 0.00 0.00 0.00 174.94 174.26 3hk7 n ASN 4 N 7.42 1.17 -3.49 3.58 6.94 -1.26 -4.69 115.26 124.93 3hk7 n ASN 4 Ca -0.04 -2.65 -0.13 0.00 -0.02 0.00 0.00 54.58 51.74 3hk7 n ASN 4 Cb 0.45 -0.35 -0.03 0.00 -2.36 0.00 0.00 39.78 37.49 3hk7 n ASN 4 CO 0.00 0.00 0.00 -0.94 -1.03 0.00 0.00 177.26 175.29 3hk7 s SER 5 N -2.16 -0.52 0.25 0.53 1.04 -1.26 -5.02 113.70 106.56 3hk7 s SER 5 Ca 0.24 0.10 -0.06 0.00 0.48 0.00 0.00 55.95 56.71 3hk7 s SER 5 Cb 0.24 0.56 0.26 0.00 0.10 0.00 0.00 66.02 67.18 3hk7 s SER 5 CO -0.05 -0.86 1.92 -0.09 0.98 0.00 0.00 173.24 175.15 3hk7 h ARG 6 N 2.33 1.31 -0.89 4.02 2.43 -1.97 -0.97 114.38 120.64 3hk7 h ARG 6 Ca -0.32 -0.09 0.03 0.00 -0.81 0.00 0.00 59.98 58.79 3hk7 h ARG 6 Cb 1.26 -0.29 -0.05 0.00 -0.42 0.00 0.00 29.97 30.47 3hk7 h ARG 6 CO 0.40 0.88 0.58 1.49 -1.51 0.00 0.00 179.97 181.80 3hk7 h GLU 7 N 1.35 1.10 -0.24 0.20 4.81 -2.00 0.92 114.58 120.73 3hk7 h GLU 7 Ca 0.36 -0.07 -0.16 0.00 -0.13 0.00 0.00 59.36 59.37 3hk7 h GLU 7 Cb -0.14 -0.25 0.00 0.00 0.63 0.00 0.00 28.75 28.99 3hk7 h GLU 7 CO -0.08 0.73 -0.47 0.28 -0.73 0.00 0.00 179.01 178.74 3hk7 h VAL 8 N 1.13 1.30 -0.41 0.32 2.07 -1.83 -3.12 116.25 115.71 3hk7 h VAL 8 Ca 0.35 -1.67 0.07 0.00 0.82 0.00 0.00 66.70 66.27 3hk7 h VAL 8 Cb -0.02 1.77 -0.06 0.00 -1.52 0.00 0.00 31.29 31.46 3hk7 h VAL 8 CO -0.11 0.53 0.05 -0.07 0.02 0.00 0.00 177.57 177.99 3hk7 h LEU 9 N 0.46 -0.06 -0.86 2.57 3.38 -0.59 -1.52 115.31 118.70 3hk7 h LEU 9 Ca 0.01 0.08 0.12 0.00 0.09 0.00 0.00 57.88 58.18 3hk7 h LEU 9 Cb 1.07 0.12 -0.09 0.00 0.09 0.00 0.00 40.66 41.86 3hk7 h LEU 9 CO 0.10 0.01 0.48 0.00 0.09 0.00 0.00 178.44 179.12 3hk7 h ALA 10 N 1.33 1.27 -0.07 1.53 0.00 -0.80 0.61 119.26 123.13 3hk7 h ALA 10 Ca 0.20 0.06 -0.03 0.00 0.00 0.00 0.00 54.91 55.14 3hk7 h ALA 10 Cb 0.27 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.97 3hk7 h ALA 10 CO -0.29 0.02 -0.06 1.49 0.00 0.00 0.00 179.25 180.40 3hk7 h GLU 11 N 0.73 0.17 -0.68 0.00 4.81 -1.34 -1.12 114.58 117.16 3hk7 h GLU 11 Ca 0.44 -0.08 -0.05 0.00 -0.13 0.00 0.00 59.36 59.54 3hk7 h GLU 11 Cb 0.53 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.88 3hk7 h GLU 11 CO -0.31 0.59 0.23 0.87 -0.73 0.00 0.00 179.01 179.66 3hk7 h LYS 12 N -0.24 1.04 0.08 1.92 1.79 -0.70 -0.94 116.57 119.51 3hk7 h LYS 12 Ca 0.01 -0.21 -0.00 0.00 -2.18 0.00 0.00 60.65 58.27 3hk7 h LYS 12 Cb 0.55 -0.16 0.00 0.00 -1.58 0.00 0.00 32.23 31.04 3hk7 h LYS 12 CO 0.02 0.89 -0.04 0.28 -1.08 0.00 0.00 179.45 179.52 3hk7 h VAL 13 N 0.98 1.14 -0.39 0.50 2.07 0.18 -1.09 116.25 119.64 3hk7 h VAL 13 Ca 0.22 -0.78 0.06 0.00 0.82 0.00 0.00 66.70 67.02 3hk7 h VAL 13 Cb 0.27 1.64 -0.05 0.00 -1.52 0.00 0.00 31.29 31.63 3hk7 h VAL 13 CO -0.01 0.19 0.09 0.11 0.02 0.00 0.00 177.57 177.97 3hk7 h LYS 14 N -0.46 0.22 -0.16 1.57 1.57 -1.15 0.13 116.57 118.30 3hk7 h LYS 14 Ca -0.01 -0.01 0.02 0.00 -1.87 0.00 0.00 60.65 58.77 3hk7 h LYS 14 Cb 0.39 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.63 3hk7 h LYS 14 CO 0.02 0.15 0.04 -0.91 -0.57 0.00 0.00 179.45 178.18 3hk7 h ASN 15 N 0.23 0.04 -0.01 0.86 2.35 -1.17 0.65 115.58 118.53 3hk7 h ASN 15 Ca 0.19 0.02 0.02 0.00 -0.55 0.00 0.00 56.30 55.98 3hk7 h ASN 15 Cb 0.21 0.02 -0.03 0.00 0.05 0.00 0.00 38.32 38.57 3hk7 h ASN 15 CO -0.23 0.04 -0.14 0.00 -1.65 0.00 0.00 177.43 175.45 3hk7 h ALA 16 N 1.11 -0.16 -0.47 -0.83 0.00 -0.53 -0.37 119.26 118.00 3hk7 h ALA 16 Ca 0.07 0.01 0.01 0.00 0.00 0.00 0.00 54.91 55.00 3hk7 h ALA 16 Cb 0.05 0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.07 3hk7 h ALA 16 CO -0.08 -0.63 0.30 0.28 0.00 0.00 0.00 179.25 179.12 3hk7 h VAL 17 N -0.23 1.10 -0.54 0.00 2.07 -0.56 -1.21 116.25 116.87 3hk7 h VAL 17 Ca 0.05 -0.21 -0.03 0.00 0.82 0.00 0.00 66.70 67.33 3hk7 h VAL 17 Cb 0.30 0.43 -0.03 0.00 -1.52 0.00 0.00 31.29 30.47 3hk7 h VAL 17 CO -0.15 0.11 0.20 0.78 0.02 0.00 0.00 177.57 178.53 3hk7 h ASN 18 N 0.61 0.73 0.76 0.57 -0.26 -0.53 -3.09 115.58 114.38 3hk7 h ASN 18 Ca 0.18 -0.10 0.00 0.00 -0.56 0.00 0.00 56.30 55.82 3hk7 h ASN 18 Cb -0.05 -0.19 0.00 0.00 -1.06 0.00 0.00 38.32 37.03 3hk7 h ASN 18 CO -0.05 0.67 -0.64 0.59 -1.06 0.00 0.00 177.43 176.94 3hk7 n ASN 19 N -4.32 0.65 -4.64 5.81 3.02 -0.18 -4.88 115.26 110.71 3hk7 n ASN 19 Ca 0.04 0.03 -0.43 0.00 -0.03 0.00 0.00 54.58 54.20 3hk7 n ASN 19 Cb 0.17 0.23 -0.03 0.00 -0.61 0.00 0.00 39.78 39.55 3hk7 n ASN 19 CO 0.00 0.00 0.00 -1.58 -2.62 0.00 0.00 177.26 173.06 3hk7 s GLN 20 N -3.14 3.99 0.30 3.52 2.00 -0.48 -4.95 119.66 120.89 3hk7 s GLN 20 Ca 0.07 1.88 -0.29 0.00 -2.00 0.00 0.00 55.36 55.01 3hk7 s GLN 20 Cb 0.14 -3.99 -0.11 0.00 0.80 0.00 0.00 33.01 29.86 3hk7 s GLN 20 CO 0.72 -1.06 1.50 -1.25 -0.50 0.00 0.00 175.29 174.70 3hk7 s PRO 21 N 4.31 4.19 -0.10 1.67 0.04 -1.26 -4.94 135.00 138.90 3hk7 s PRO 21 Ca 0.71 2.46 -0.12 0.00 0.04 0.00 0.00 61.00 64.08 3hk7 s PRO 21 Cb -0.28 -3.04 -0.05 0.00 0.04 0.00 0.00 34.50 31.17 3hk7 s PRO 21 CO 0.28 -0.50 0.27 0.08 0.04 0.00 0.00 177.00 177.17 3hk7 s VAL 22 N -0.35 5.29 -0.39 -0.36 1.01 0.53 -4.71 120.40 121.42 3hk7 s VAL 22 Ca 0.58 0.52 -0.10 0.00 0.00 0.00 0.00 61.98 62.98 3hk7 s VAL 22 Cb -0.45 -3.58 0.04 0.00 0.00 0.00 0.00 36.38 32.39 3hk7 s VAL 22 CO 0.50 0.52 0.22 -0.89 0.00 0.00 0.00 175.10 175.44 3hk7 s THR 23 N -0.44 4.42 -0.71 3.92 2.01 -0.82 -0.84 115.64 123.19 3hk7 s THR 23 Ca 0.18 -1.04 -0.23 0.00 0.31 0.00 0.00 61.69 60.91 3hk7 s THR 23 Cb -0.14 -3.54 0.07 0.00 0.01 0.00 0.00 72.50 68.90 3hk7 s THR 23 CO 0.06 -0.32 1.03 -0.62 -0.69 0.00 0.00 174.62 174.09 3hk7 s ASP 24 N 1.72 6.23 0.00 3.53 -1.08 0.23 -4.75 116.67 122.55 3hk7 s ASP 24 Ca 0.02 -1.07 0.00 0.00 -0.52 0.00 0.00 52.55 50.98 3hk7 s ASP 24 Cb -0.20 -2.44 0.00 0.00 -1.46 0.00 0.00 42.92 38.82 3hk7 s ASP 24 CO 0.05 -1.44 0.88 1.15 0.52 0.00 0.00 175.17 176.33 3hk7 n MET 25 N 7.79 0.88 -3.15 4.34 0.00 -1.26 -0.92 117.12 124.80 3hk7 n MET 25 Ca 0.01 0.00 0.04 0.00 0.00 0.00 0.00 57.70 57.75 3hk7 n MET 25 Cb 0.46 -1.00 -0.01 0.00 0.00 0.00 0.00 33.22 32.67 3hk7 n MET 25 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 175.97 174.39 3hk7 s HIS 26 N -1.99 -1.29 0.31 3.17 5.65 -1.26 -4.76 115.29 115.12 3hk7 s HIS 26 Ca 0.00 1.26 0.02 0.00 0.25 0.00 0.00 55.06 56.59 3hk7 s HIS 26 Cb 0.00 0.41 -0.02 0.00 -1.18 0.00 0.00 32.58 31.79 3hk7 s HIS 26 CO 0.00 -0.71 0.34 0.95 -0.65 0.00 0.00 174.74 174.66 3hk7 s THR 27 N 2.89 0.00 -0.33 0.89 -4.23 -0.54 -0.65 115.64 113.66 3hk7 s THR 27 Ca 0.14 -1.83 0.08 0.00 -1.18 0.00 0.00 61.69 58.90 3hk7 s THR 27 Cb -0.12 -2.54 0.45 0.00 1.34 0.00 0.00 72.50 71.63 3hk7 s THR 27 CO -0.19 0.00 1.15 1.41 -0.54 0.00 0.00 174.62 176.45 3hk7 n HIS 28 N -0.55 2.77 -3.84 3.99 8.25 0.16 -2.85 115.22 123.14 3hk7 n HIS 28 Ca 0.04 -2.51 -0.22 0.00 -0.26 0.00 0.00 57.72 54.77 3hk7 n HIS 28 Cb 0.62 -0.25 -0.04 0.00 1.12 0.00 0.00 29.99 31.44 3hk7 n HIS 28 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 3hk7 s LEU 29 N -3.58 3.42 0.02 2.41 1.43 -1.22 -4.53 118.68 116.64 3hk7 s LEU 29 Ca 0.47 -0.68 -0.03 0.00 -1.03 0.00 0.00 54.13 52.86 3hk7 s LEU 29 Cb 0.40 -1.99 -0.01 0.00 0.03 0.00 0.00 46.19 44.62 3hk7 s LEU 29 CO -0.04 -0.44 0.04 -0.36 0.23 0.00 0.00 176.35 175.79 3hk7 s PHE 30 N -2.41 0.20 0.31 0.29 0.08 -1.26 -4.42 117.98 110.78 3hk7 s PHE 30 Ca 0.42 -0.45 -0.28 0.00 0.12 0.00 0.00 56.93 56.74 3hk7 s PHE 30 Cb -0.03 -0.15 -0.13 0.00 -0.57 0.00 0.00 43.02 42.13 3hk7 s PHE 30 CO 0.26 -0.27 1.16 0.45 -0.10 0.00 0.00 175.22 176.72 3hk7 n SER 31 N 1.29 2.07 0.00 1.36 2.88 -1.26 -4.82 113.62 115.14 3hk7 n SER 31 Ca -0.22 1.19 0.19 0.00 -1.33 0.00 0.00 58.87 58.70 3hk7 n SER 31 Cb 0.56 -1.39 0.66 0.00 -0.75 0.00 0.00 64.21 63.30 3hk7 n SER 31 CO 0.00 0.00 0.00 1.55 -1.23 0.00 0.00 175.04 175.36 3hk7 h PRO 32 N 2.32 0.05 -0.08 -1.46 0.13 -1.93 -1.31 132.00 129.72 3hk7 h PRO 32 Ca -0.43 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 3hk7 h PRO 32 Cb 1.31 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.43 3hk7 h PRO 32 CO 0.62 0.03 0.00 0.27 -0.23 0.00 0.00 178.00 178.69 3hk7 n ASN 33 N -4.40 0.08 -0.26 1.44 6.94 -1.26 -2.61 115.26 115.19 3hk7 n ASN 33 Ca 0.09 -1.18 0.11 0.00 -0.02 0.00 0.00 54.58 53.59 3hk7 n ASN 33 Cb 0.56 -0.04 0.01 0.00 -2.36 0.00 0.00 39.78 37.95 3hk7 n ASN 33 CO 0.00 0.00 0.00 0.49 -1.03 0.00 0.00 177.26 176.72 3hk7 n PHE 34 N -0.41 0.00 0.00 -2.53 3.01 -0.49 -4.98 117.46 112.06 3hk7 n PHE 34 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.46 3hk7 n PHE 34 Cb 0.02 -0.03 0.00 0.00 -0.01 0.00 0.00 39.48 39.46 3hk7 n PHE 34 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3hk7 n GLY 35 N 1.45 -1.60 0.00 1.37 0.00 -1.07 -4.45 105.19 100.89 3hk7 n GLY 35 Ca 0.07 -2.05 0.06 0.00 0.00 0.00 0.00 46.02 44.10 3hk7 n GLY 35 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3hk7 n GLU 36 N 0.00 0.21 0.25 1.61 1.02 -1.26 -2.25 120.64 120.21 3hk7 n GLU 36 Ca 0.00 0.15 0.08 0.00 -0.02 0.00 0.00 57.16 57.36 3hk7 n GLU 36 Cb 0.00 -1.50 0.60 0.00 -0.02 0.00 0.00 31.44 30.52 3hk7 n GLU 36 CO 0.00 0.00 0.00 0.97 1.18 0.00 0.00 177.13 179.28 3hk7 h ILE 37 N 0.00 1.00 -3.57 -3.67 2.10 -1.97 -3.36 117.51 108.03 3hk7 h ILE 37 Ca 0.00 -0.32 -0.56 0.00 1.08 0.00 0.00 64.86 65.05 3hk7 h ILE 37 Cb 0.10 1.18 -0.07 0.00 -1.09 0.00 0.00 36.82 36.94 3hk7 h ILE 37 CO 0.00 0.09 0.93 -0.22 -1.08 0.00 0.00 178.15 177.87 3hk7 s LEU 38 N -8.65 3.69 0.17 2.19 2.96 -0.96 -4.86 118.68 113.24 3hk7 s LEU 38 Ca -0.04 0.64 -0.19 0.00 -0.22 0.00 0.00 54.13 54.32 3hk7 s LEU 38 Cb 0.16 -3.55 -0.08 0.00 0.50 0.00 0.00 46.19 43.23 3hk7 s LEU 38 CO 0.67 -1.20 0.66 -0.76 -1.32 0.00 0.00 176.35 174.40 3hk7 s LEU 39 N 4.41 4.40 -0.07 -0.68 1.43 -1.26 -5.01 118.68 121.90 3hk7 s LEU 39 Ca 0.49 1.34 -0.31 0.00 -1.03 0.00 0.00 54.13 54.62 3hk7 s LEU 39 Cb -0.09 -3.37 0.11 0.00 0.03 0.00 0.00 46.19 42.88 3hk7 s LEU 39 CO 0.29 0.11 1.04 -1.66 0.23 0.00 0.00 176.35 176.36 3hk7 s TRP 40 N -1.40 -0.23 0.00 0.29 1.48 -1.26 -0.86 118.94 116.97 3hk7 s TRP 40 Ca 0.39 0.11 0.00 0.00 -1.06 0.00 0.00 56.10 55.54 3hk7 s TRP 40 Cb -0.17 0.54 0.00 0.00 -1.16 0.00 0.00 33.47 32.67 3hk7 s TRP 40 CO 0.21 -0.41 0.00 -0.40 -4.06 0.00 0.00 176.95 172.28 3hk7 n ASP 41 N -0.22 0.00 0.08 -2.66 3.85 -1.26 -4.59 116.55 111.76 3hk7 n ASP 41 Ca -0.05 0.00 0.09 0.00 -0.71 0.00 0.00 54.79 54.12 3hk7 n ASP 41 Cb 0.60 0.00 0.55 0.00 -1.35 0.00 0.00 41.12 40.92 3hk7 n ASP 41 CO 0.00 0.00 0.00 -0.29 -1.01 0.00 0.00 177.20 175.90 3hk7 h ILE 42 N 0.00 0.99 -0.10 2.12 6.09 -1.94 -2.10 117.51 122.56 3hk7 h ILE 42 Ca 0.00 -0.09 -0.18 0.00 -1.37 0.00 0.00 64.86 63.22 3hk7 h ILE 42 Cb 0.00 0.70 -0.00 0.00 0.47 0.00 0.00 36.82 37.99 3hk7 h ILE 42 CO 0.00 0.05 -0.70 0.44 -3.07 0.00 0.00 178.15 174.87 3hk7 h ASP 43 N 0.26 0.54 -0.13 2.19 3.32 -1.95 -2.08 116.42 118.57 3hk7 h ASP 43 Ca 0.13 -0.34 -0.02 0.00 0.02 0.00 0.00 57.03 56.83 3hk7 h ASP 43 Cb 0.19 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.58 3hk7 h ASP 43 CO -0.03 1.07 0.02 -0.33 -1.72 0.00 0.00 179.24 178.26 3hk7 h GLU 44 N 0.32 0.22 -0.61 3.56 4.39 -1.69 -1.41 114.58 119.36 3hk7 h GLU 44 Ca -0.02 -0.06 0.09 0.00 0.34 0.00 0.00 59.36 59.70 3hk7 h GLU 44 Cb 1.27 -0.02 -0.07 0.00 -0.10 0.00 0.00 28.75 29.82 3hk7 h GLU 44 CO 0.12 0.42 0.26 -0.07 -1.16 0.00 0.00 179.01 178.57 3hk7 h LEU 45 N -0.01 0.29 -1.27 1.33 3.38 -1.37 -1.99 115.31 115.67 3hk7 h LEU 45 Ca 0.04 0.07 -0.07 0.00 0.09 0.00 0.00 57.88 58.01 3hk7 h LEU 45 Cb 0.30 0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.07 3hk7 h LEU 45 CO 0.00 0.18 -0.33 -0.07 0.09 0.00 0.00 178.44 178.31 3hk7 h LEU 46 N 0.46 0.00 -3.64 1.67 4.07 -1.18 -2.96 115.31 113.72 3hk7 h LEU 46 Ca 0.30 0.00 -0.13 0.00 0.08 0.00 0.00 57.88 58.13 3hk7 h LEU 46 Cb 0.34 0.00 -0.08 0.00 1.08 0.00 0.00 40.66 42.00 3hk7 h LEU 46 CO -0.28 0.33 0.15 0.35 -1.08 0.00 0.00 178.44 177.92 3hk7 n THR 47 N -3.81 2.83 -1.84 0.22 -2.24 -0.55 -4.74 114.28 104.15 3hk7 n THR 47 Ca -0.01 -1.62 -0.41 0.00 -2.27 0.00 0.00 64.05 59.74 3hk7 n THR 47 Cb 0.41 -0.32 -0.01 0.00 -2.10 0.00 0.00 70.33 68.31 3hk7 n THR 47 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 3hk7 s TYR 48 N -2.92 2.75 0.59 4.78 5.04 -0.98 -4.75 117.35 121.85 3hk7 s TYR 48 Ca 0.54 1.00 0.29 0.00 -2.44 0.00 0.00 57.07 56.46 3hk7 s TYR 48 Cb 0.43 -3.99 1.73 0.00 0.35 0.00 0.00 41.96 40.47 3hk7 s TYR 48 CO 0.14 -3.12 2.17 1.12 -1.34 0.00 0.00 175.55 174.51 3hk7 h HIS 49 N 4.07 0.00 -0.73 4.97 2.07 -1.92 0.34 115.15 123.96 3hk7 h HIS 49 Ca -0.48 0.00 -0.00 0.00 -2.85 0.00 0.00 60.37 57.03 3hk7 h HIS 49 Cb 1.23 0.00 -0.04 0.00 2.57 0.00 0.00 27.41 31.17 3hk7 h HIS 49 CO 0.57 0.00 0.45 1.88 -3.07 0.00 0.00 177.93 177.75 3hk7 h TYR 50 N 0.00 0.95 0.00 6.12 -1.99 -1.94 -0.19 116.97 119.93 3hk7 h TYR 50 Ca 0.05 0.00 -0.15 0.00 2.00 0.00 0.00 58.73 60.63 3hk7 h TYR 50 Cb 0.27 -0.31 -0.02 0.00 2.00 0.00 0.00 36.73 38.66 3hk7 h TYR 50 CO 0.00 0.63 -0.70 -0.07 -0.00 0.00 0.00 178.16 178.02 3hk7 h LEU 51 N 1.00 0.00 -0.20 3.88 -0.00 -0.67 -2.89 115.31 116.43 3hk7 h LEU 51 Ca 0.26 0.00 -0.02 0.00 -0.00 0.00 0.00 57.88 58.12 3hk7 h LEU 51 Cb -0.05 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 40.60 3hk7 h LEU 51 CO -0.05 0.70 0.04 0.58 -0.00 0.00 0.00 178.44 179.71 3hk7 h VAL 52 N 0.00 1.22 -0.50 1.22 2.07 -0.27 -0.61 116.25 119.38 3hk7 h VAL 52 Ca -0.01 -0.71 0.04 0.00 0.82 0.00 0.00 66.70 66.84 3hk7 h VAL 52 Cb 1.41 1.30 -0.04 0.00 -1.52 0.00 0.00 31.29 32.44 3hk7 h VAL 52 CO 0.09 0.22 0.25 0.00 0.02 0.00 0.00 177.57 178.15 3hk7 h ALA 53 N 0.84 0.63 -0.51 1.67 0.00 -1.10 -2.51 119.26 118.29 3hk7 h ALA 53 Ca 0.06 0.02 -0.12 0.00 0.00 0.00 0.00 54.91 54.88 3hk7 h ALA 53 Cb 0.30 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 3hk7 h ALA 53 CO 0.00 -0.10 -0.14 0.93 0.00 0.00 0.00 179.25 179.94 3hk7 h GLU 54 N 0.48 0.99 -0.17 0.00 5.08 -1.33 -3.08 114.58 116.55 3hk7 h GLU 54 Ca 0.22 -0.37 -0.08 0.00 -1.00 0.00 0.00 59.36 58.13 3hk7 h GLU 54 Cb 0.13 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.31 3hk7 h GLU 54 CO -0.16 1.05 -0.23 -0.24 -1.00 0.00 0.00 179.01 178.43 3hk7 h VAL 55 N 0.87 1.24 0.00 3.13 3.04 -0.87 -2.66 116.25 121.01 3hk7 h VAL 55 Ca 0.13 -1.10 0.00 0.00 -1.01 0.00 0.00 66.70 64.72 3hk7 h VAL 55 Cb 0.70 1.36 0.00 0.00 -2.01 0.00 0.00 31.29 31.34 3hk7 h VAL 55 CO 0.05 0.34 0.00 0.24 -1.01 0.00 0.00 177.57 177.19 3hk7 h MET 56 N 0.27 0.00 0.00 4.17 2.86 -1.36 -0.09 114.93 120.79 3hk7 h MET 56 Ca 0.05 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.69 3hk7 h MET 56 Cb 0.56 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.22 3hk7 h MET 56 CO 0.04 0.00 -0.10 0.54 1.06 0.00 0.00 176.91 178.45 3hk7 n ARG 57 N -2.67 0.10 -0.03 1.72 1.74 -1.00 -4.34 116.66 112.19 3hk7 n ARG 57 Ca -0.01 0.07 -0.06 0.00 -0.77 0.00 0.00 57.85 57.08 3hk7 n ARG 57 Cb 0.15 -1.60 -0.03 0.00 -1.02 0.00 0.00 32.46 29.96 3hk7 n ARG 57 CO 0.00 0.00 0.00 0.91 -1.52 0.00 0.00 177.63 177.02 3hk7 n TRP 58 N -1.77 0.00 -2.36 -1.55 7.02 -0.23 -5.08 117.44 113.48 3hk7 n TRP 58 Ca 0.06 0.00 -0.38 0.00 -1.02 0.00 0.00 57.50 56.16 3hk7 n TRP 58 Cb 0.37 -0.24 -0.03 0.00 -2.42 0.00 0.00 31.31 29.00 3hk7 n TRP 58 CO 0.00 0.00 0.00 -0.08 -2.02 0.00 0.00 177.69 175.59 3hk7 s THR 59 N -2.12 3.29 -0.80 -0.99 -1.32 -0.22 -4.94 115.64 108.54 3hk7 s THR 59 Ca -0.09 1.11 0.27 0.00 -1.21 0.00 0.00 61.69 61.77 3hk7 s THR 59 Cb 0.03 -3.64 0.27 0.00 -1.51 0.00 0.00 72.50 67.65 3hk7 s THR 59 CO 0.13 0.13 1.81 0.47 -2.21 0.00 0.00 174.62 174.95 3hk7 n ASP 60 N 0.30 0.58 -4.71 8.08 8.00 -1.26 -4.80 116.55 122.73 3hk7 n ASP 60 Ca 0.03 0.56 -0.42 0.00 0.71 0.00 0.00 54.79 55.67 3hk7 n ASP 60 Cb 0.46 -0.71 -0.03 0.00 -0.02 0.00 0.00 41.12 40.82 3hk7 n ASP 60 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3hk7 s VAL 61 N -3.08 2.68 0.58 2.53 1.01 -1.26 -4.96 120.40 117.90 3hk7 s VAL 61 Ca 0.11 0.39 -0.18 0.00 0.00 0.00 0.00 61.98 62.30 3hk7 s VAL 61 Cb 0.14 -3.25 -0.04 0.00 0.00 0.00 0.00 36.38 33.23 3hk7 s VAL 61 CO 0.57 0.02 1.12 -0.94 0.00 0.00 0.00 175.10 175.86 3hk7 s SER 62 N 1.65 5.54 0.40 3.32 1.04 -1.26 -4.82 113.70 119.57 3hk7 s SER 62 Ca 0.72 2.11 0.09 0.00 0.48 0.00 0.00 55.95 59.35 3hk7 s SER 62 Cb -0.43 -2.57 0.89 0.00 0.10 0.00 0.00 66.02 64.00 3hk7 s SER 62 CO 0.32 -1.34 2.00 -0.29 0.98 0.00 0.00 173.24 174.91 3hk7 h ILE 63 N 0.82 1.01 -0.45 -1.02 6.09 -1.97 -0.39 117.51 121.60 3hk7 h ILE 63 Ca -0.49 -0.19 -0.06 0.00 -1.37 0.00 0.00 64.86 62.75 3hk7 h ILE 63 Cb 1.26 0.40 -0.02 0.00 0.47 0.00 0.00 36.82 38.92 3hk7 h ILE 63 CO 0.56 0.10 0.05 -0.33 -3.07 0.00 0.00 178.15 175.46 3hk7 h GLU 64 N 0.56 0.77 0.09 2.19 3.07 -1.93 -1.43 114.58 117.89 3hk7 h GLU 64 Ca 0.24 -0.22 -0.00 0.00 -0.50 0.00 0.00 59.36 58.88 3hk7 h GLU 64 Cb 0.25 -0.08 0.00 0.00 -0.84 0.00 0.00 28.75 28.08 3hk7 h GLU 64 CO -0.07 0.80 -0.04 0.00 -1.40 0.00 0.00 179.01 178.30 3hk7 h ALA 65 N 0.94 -0.12 -0.42 3.43 0.00 -1.65 -1.09 119.26 120.35 3hk7 h ALA 65 Ca 0.13 -0.09 0.09 0.00 0.00 0.00 0.00 54.91 55.04 3hk7 h ALA 65 Cb 0.42 0.05 -0.09 0.00 0.00 0.00 0.00 17.79 18.17 3hk7 h ALA 65 CO 0.01 -0.50 -0.16 0.35 0.00 0.00 0.00 179.25 178.96 3hk7 h PHE 66 N -0.26 -0.38 -0.54 0.00 3.57 -1.01 0.23 116.94 118.56 3hk7 h PHE 66 Ca -0.01 0.04 0.05 0.00 3.53 0.00 0.00 57.97 61.58 3hk7 h PHE 66 Cb 0.22 0.23 -0.03 0.00 2.79 0.00 0.00 35.95 39.16 3hk7 h PHE 66 CO -0.03 -0.24 0.36 -1.49 -2.23 0.00 0.00 178.31 174.68 3hk7 h TRP 67 N -0.07 0.53 0.00 0.41 -0.00 -1.11 -1.04 115.95 114.68 3hk7 h TRP 67 Ca 0.20 0.01 -0.06 0.00 -0.00 0.00 0.00 58.89 59.05 3hk7 h TRP 67 Cb 0.38 -0.18 -0.01 0.00 -0.00 0.00 0.00 29.16 29.36 3hk7 h TRP 67 CO -0.41 0.30 -0.27 0.00 -0.00 0.00 0.00 178.44 178.06 3hk7 h ALA 68 N 1.70 1.26 -2.26 1.49 0.00 0.76 -3.45 119.26 118.76 3hk7 h ALA 68 Ca 0.23 -0.25 -0.45 0.00 0.00 0.00 0.00 54.91 54.44 3hk7 h ALA 68 Cb 0.21 -0.04 0.18 0.00 0.00 0.00 0.00 17.79 18.14 3hk7 h ALA 68 CO -0.06 0.34 0.12 -1.64 0.00 0.00 0.00 179.25 178.01 3hk7 s MET 69 N -4.05 -0.09 0.34 0.00 -1.94 -0.39 -5.05 119.30 108.12 3hk7 s MET 69 Ca -0.02 0.71 -0.00 0.00 -1.71 0.00 0.00 55.69 54.67 3hk7 s MET 69 Cb 0.13 -1.66 -0.04 0.00 2.01 0.00 0.00 34.83 35.27 3hk7 s MET 69 CO 0.66 -3.13 0.56 -1.54 -0.01 0.00 0.00 175.02 171.56 3hk7 s SER 70 N -3.02 6.31 0.27 3.03 1.04 -1.26 -4.88 113.70 115.19 3hk7 s SER 70 Ca 0.67 0.51 -0.01 0.00 0.48 0.00 0.00 55.95 57.59 3hk7 s SER 70 Cb -0.21 -2.06 0.60 0.00 0.10 0.00 0.00 66.02 64.45 3hk7 s SER 70 CO 0.61 -0.29 1.64 0.11 0.98 0.00 0.00 173.24 176.29 3hk7 h LYS 71 N 0.87 0.17 -0.50 4.02 1.79 -1.96 0.45 116.57 121.40 3hk7 h LYS 71 Ca -0.49 -0.01 -0.03 0.00 -2.18 0.00 0.00 60.65 57.94 3hk7 h LYS 71 Cb 1.21 -0.04 -0.02 0.00 -1.58 0.00 0.00 32.23 31.80 3hk7 h LYS 71 CO 0.62 0.11 0.21 0.00 -1.08 0.00 0.00 179.45 179.32 3hk7 h ARG 72 N 0.17 0.75 -0.37 3.15 2.47 -1.94 -0.18 114.38 118.43 3hk7 h ARG 72 Ca 0.50 -0.13 -0.03 0.00 -1.26 0.00 0.00 59.98 59.06 3hk7 h ARG 72 Cb 0.96 -0.12 -0.02 0.00 -1.65 0.00 0.00 29.97 29.13 3hk7 h ARG 72 CO -0.66 0.65 0.12 0.93 0.56 0.00 0.00 179.97 181.57 3hk7 h GLU 73 N 0.67 0.57 0.04 0.04 5.08 -1.38 -1.00 114.58 118.61 3hk7 h GLU 73 Ca 0.17 -0.12 -0.00 0.00 -1.00 0.00 0.00 59.36 58.41 3hk7 h GLU 73 Cb 0.17 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.34 3hk7 h GLU 73 CO -0.02 0.58 -0.02 1.96 -1.00 0.00 0.00 179.01 180.52 3hk7 h GLN 74 N 0.45 -0.05 -0.62 2.33 4.20 -0.88 -0.42 115.11 120.12 3hk7 h GLN 74 Ca 0.12 0.00 0.09 0.00 0.06 0.00 0.00 58.65 58.93 3hk7 h GLN 74 Cb 0.24 0.01 -0.07 0.00 0.30 0.00 0.00 27.48 27.96 3hk7 h GLN 74 CO -0.00 0.01 0.23 0.00 -0.67 0.00 0.00 178.83 178.40 3hk7 h ALA 75 N 0.85 0.80 -0.07 3.87 0.00 -0.92 0.60 119.26 124.39 3hk7 h ALA 75 Ca -0.01 0.08 -0.07 0.00 0.00 0.00 0.00 54.91 54.92 3hk7 h ALA 75 Cb 0.09 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 3hk7 h ALA 75 CO 0.01 -0.18 -0.26 -0.44 0.00 0.00 0.00 179.25 178.37 3hk7 h ASP 76 N 0.42 0.12 0.08 0.00 3.32 -0.85 0.06 116.42 119.56 3hk7 h ASP 76 Ca 0.31 -0.03 -0.00 0.00 0.02 0.00 0.00 57.03 57.32 3hk7 h ASP 76 Cb 0.38 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 39.90 3hk7 h ASP 76 CO -0.31 0.39 -0.04 0.25 -1.72 0.00 0.00 179.24 177.81 3hk7 h LEU 77 N 0.11 -0.09 -0.61 1.55 5.85 0.57 -1.87 115.31 120.82 3hk7 h LEU 77 Ca 0.02 -0.41 0.02 0.00 0.84 0.00 0.00 57.88 58.34 3hk7 h LEU 77 Cb 0.53 0.02 -0.03 0.00 0.37 0.00 0.00 40.66 41.55 3hk7 h LEU 77 CO 0.04 0.39 0.39 0.40 -0.34 0.00 0.00 178.44 179.32 3hk7 h ILE 78 N -0.59 1.12 -0.87 4.05 2.04 -0.80 0.20 117.51 122.66 3hk7 h ILE 78 Ca -0.01 -0.27 0.01 0.00 1.00 0.00 0.00 64.86 65.59 3hk7 h ILE 78 Cb 0.50 0.27 -0.04 0.00 -0.74 0.00 0.00 36.82 36.80 3hk7 h ILE 78 CO 0.02 0.14 0.57 -0.25 0.00 0.00 0.00 178.15 178.63 3hk7 h TRP 79 N 0.78 1.10 -0.19 1.37 2.91 -1.01 0.10 115.95 121.01 3hk7 h TRP 79 Ca 0.23 0.02 -0.14 0.00 1.13 0.00 0.00 58.89 60.14 3hk7 h TRP 79 Cb -0.04 -0.37 0.00 0.00 -0.51 0.00 0.00 29.16 28.24 3hk7 h TRP 79 CO -0.04 0.70 -0.43 1.49 -1.03 0.00 0.00 178.44 179.13 3hk7 h GLU 80 N 1.18 0.63 -0.07 2.65 4.57 -0.70 -1.81 114.58 121.03 3hk7 h GLU 80 Ca 0.32 -0.42 -0.15 0.00 -1.18 0.00 0.00 59.36 57.93 3hk7 h GLU 80 Cb -0.13 0.06 0.01 0.00 -0.16 0.00 0.00 28.75 28.53 3hk7 h GLU 80 CO -0.07 1.04 -0.52 0.93 -1.18 0.00 0.00 179.01 179.21 3hk7 h GLU 81 N 0.31 0.48 0.00 1.92 4.39 -0.41 -0.92 114.58 120.35 3hk7 h GLU 81 Ca 0.00 -0.42 -0.08 0.00 0.34 0.00 0.00 59.36 59.20 3hk7 h GLU 81 Cb 1.03 0.10 -0.02 0.00 -0.10 0.00 0.00 28.75 29.76 3hk7 h GLU 81 CO 0.09 1.06 -1.73 1.28 -1.16 0.00 0.00 179.01 178.56 3hk7 n LEU 82 N -4.24 0.34 -0.09 1.33 4.77 0.34 -3.76 117.00 115.71 3hk7 n LEU 82 Ca -0.09 0.14 -0.11 0.00 -0.03 0.00 0.00 56.01 55.93 3hk7 n LEU 82 Cb 0.62 0.07 -0.10 0.00 -2.33 0.00 0.00 43.42 41.68 3hk7 n LEU 82 CO 0.46 0.05 -1.06 0.49 -1.33 0.00 0.00 177.39 176.00 3hk7 n PHE 83 N -2.53 0.00 -0.10 -1.77 3.72 -0.72 -3.14 117.46 112.92 3hk7 n PHE 83 Ca -0.08 0.00 -0.23 0.00 -0.05 0.00 0.00 57.45 57.09 3hk7 n PHE 83 Cb 0.70 -0.73 -0.12 0.00 -0.94 0.00 0.00 39.48 38.39 3hk7 n PHE 83 CO 0.00 0.00 0.00 -0.89 -0.05 0.00 0.00 176.76 175.82 3hk7 n ILE 84 N -2.84 1.57 0.17 4.37 2.08 -0.98 -4.33 119.36 119.41 3hk7 n ILE 84 Ca -0.30 -0.43 0.04 0.00 0.56 0.00 0.00 62.75 62.63 3hk7 n ILE 84 Cb 0.91 -1.74 0.27 0.00 -0.75 0.00 0.00 39.64 38.32 3hk7 n ILE 84 CO 0.00 0.00 0.00 0.11 0.56 0.00 0.00 176.55 177.22 3hk7 h LYS 85 N -0.48 0.00 -3.57 0.38 1.57 -1.30 -3.45 116.57 109.72 3hk7 h LYS 85 Ca -0.54 0.00 -0.14 0.00 -1.87 0.00 0.00 60.65 58.09 3hk7 h LYS 85 Cb 1.73 0.00 -0.20 0.00 0.08 0.00 0.00 32.23 33.84 3hk7 h LYS 85 CO -0.18 0.43 -0.51 1.03 -0.57 0.00 0.00 179.45 179.66 3hk7 s ARG 86 N -3.49 0.48 0.24 3.15 3.00 -1.25 -5.05 118.95 116.03 3hk7 s ARG 86 Ca 0.01 -0.45 -0.30 0.00 0.00 0.00 0.00 55.73 54.98 3hk7 s ARG 86 Cb 0.11 0.20 -0.10 0.00 0.00 0.00 0.00 34.95 35.16 3hk7 s ARG 86 CO 0.70 -0.11 1.42 -1.12 0.00 0.00 0.00 175.30 176.19 3hk7 s SER 87 N -1.46 6.70 -1.01 0.23 0.01 -1.26 -3.56 113.70 113.34 3hk7 s SER 87 Ca -0.14 2.61 -0.07 0.00 1.31 0.00 0.00 55.95 59.66 3hk7 s SER 87 Cb -0.07 -2.62 -0.06 0.00 0.21 0.00 0.00 66.02 63.48 3hk7 s SER 87 CO 0.01 -0.67 2.21 -0.81 0.41 0.00 0.00 173.24 174.39 3hk7 n PRO 88 N 2.43 2.28 0.12 12.44 -0.04 -1.19 -4.58 135.00 146.46 3hk7 n PRO 88 Ca 0.07 -1.60 0.12 0.00 -0.04 0.00 0.00 63.50 62.06 3hk7 n PRO 88 Cb 0.41 -2.54 0.26 0.00 -0.04 0.00 0.00 33.50 31.59 3hk7 n PRO 88 CO 0.00 0.00 0.00 -0.39 -0.04 0.00 0.00 175.50 175.07 3hk7 h VAL 89 N 3.45 0.00 -4.27 0.52 -1.51 -1.89 -3.26 116.25 109.29 3hk7 h VAL 89 Ca 0.54 -0.65 -0.52 0.00 -1.23 0.00 0.00 66.70 64.84 3hk7 h VAL 89 Cb 0.21 1.52 0.18 0.00 -2.13 0.00 0.00 31.29 31.07 3hk7 h VAL 89 CO 1.53 0.00 0.25 -0.94 -1.23 0.00 0.00 177.57 177.18 3hk7 s SER 90 N -4.94 3.38 0.17 4.19 1.04 -1.26 -4.74 113.70 111.53 3hk7 s SER 90 Ca 0.08 2.06 -0.14 0.00 0.48 0.00 0.00 55.95 58.43 3hk7 s SER 90 Cb 0.11 -2.55 0.06 0.00 0.10 0.00 0.00 66.02 63.74 3hk7 s SER 90 CO 0.66 -2.79 1.78 -0.08 0.98 0.00 0.00 173.24 173.79 3hk7 h GLU 91 N -1.65 0.73 -0.40 4.02 4.57 -1.97 -0.05 114.58 119.83 3hk7 h GLU 91 Ca -0.43 -0.08 -0.01 0.00 -1.18 0.00 0.00 59.36 57.65 3hk7 h GLU 91 Cb 1.26 -0.15 -0.02 0.00 -0.16 0.00 0.00 28.75 29.68 3hk7 h GLU 91 CO 0.45 0.56 0.22 0.00 -1.18 0.00 0.00 179.01 179.06 3hk7 h ALA 92 N 1.13 0.51 -0.45 2.92 0.00 -1.95 0.11 119.26 121.53 3hk7 h ALA 92 Ca 0.19 -0.08 -0.06 0.00 0.00 0.00 0.00 54.91 54.96 3hk7 h ALA 92 Cb 0.04 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 3hk7 h ALA 92 CO -0.03 0.03 0.06 0.00 0.00 0.00 0.00 179.25 179.31 3hk7 h ARG 94 N 0.61 1.07 -0.75 0.00 2.43 -0.80 -1.92 114.38 115.02 3hk7 h ARG 94 Ca 0.13 -0.06 0.11 0.00 -0.81 0.00 0.00 59.98 59.35 3hk7 h ARG 94 Cb 0.41 -0.24 -0.08 0.00 -0.42 0.00 0.00 29.97 29.64 3hk7 h ARG 94 CO 0.01 0.71 0.37 0.78 -1.51 0.00 0.00 179.97 180.33 3hk7 h GLY 95 N 1.11 1.15 0.78 2.80 0.00 -0.61 -0.53 103.07 107.77 3hk7 h GLY 95 Ca 0.35 -0.22 0.02 0.00 0.00 0.00 0.00 47.33 47.48 3hk7 h GLY 95 CO -0.11 0.03 -0.03 -2.08 0.00 0.00 0.00 176.54 174.35 3hk7 h VAL 96 N 0.60 0.89 -0.47 4.60 2.07 -1.11 -1.41 116.25 121.43 3hk7 h VAL 96 Ca 0.38 -0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.94 3hk7 h VAL 96 Cb 0.45 0.89 -0.04 0.00 -1.52 0.00 0.00 31.29 31.07 3hk7 h VAL 96 CO -0.30 0.00 0.23 -0.07 0.02 0.00 0.00 177.57 177.45 3hk7 h LEU 97 N 0.00 0.32 -1.56 2.57 3.38 -1.06 -1.27 115.31 117.68 3hk7 h LEU 97 Ca 0.05 0.03 0.03 0.00 0.09 0.00 0.00 57.88 58.08 3hk7 h LEU 97 Cb 0.08 -0.03 -0.03 0.00 0.09 0.00 0.00 40.66 40.77 3hk7 h LEU 97 CO -0.11 0.22 0.34 0.74 0.09 0.00 0.00 178.44 179.72 3hk7 h THR 98 N 0.45 1.06 -0.27 0.22 2.02 -0.80 -0.97 112.91 114.61 3hk7 h THR 98 Ca 0.21 -0.20 -0.06 0.00 0.77 0.00 0.00 66.41 67.12 3hk7 h THR 98 Cb 0.13 0.43 -0.01 0.00 -1.74 0.00 0.00 68.15 66.96 3hk7 h THR 98 CO -0.15 0.11 -0.08 0.00 0.37 0.00 0.00 175.52 175.76 3hk7 h LEU 100 N 0.27 -0.03 -0.70 0.00 3.38 -0.63 -2.48 115.31 115.13 3hk7 h LEU 100 Ca 0.06 -0.03 0.04 0.00 0.09 0.00 0.00 57.88 58.04 3hk7 h LEU 100 Cb 0.57 0.01 -0.05 0.00 0.09 0.00 0.00 40.66 41.28 3hk7 h LEU 100 CO 0.03 0.01 0.43 -0.61 0.09 0.00 0.00 178.44 178.39 3hk7 h GLN 101 N -0.06 0.80 -0.05 1.13 4.15 -1.21 -1.67 115.11 118.21 3hk7 h GLN 101 Ca -0.00 -0.05 -0.01 0.00 0.77 0.00 0.00 58.65 59.35 3hk7 h GLN 101 Cb 0.06 -0.18 -0.00 0.00 0.21 0.00 0.00 27.48 27.56 3hk7 h GLN 101 CO 0.01 0.53 -0.04 0.78 -1.93 0.00 0.00 178.83 178.18 3hk7 h GLY 102 N 0.83 0.07 0.92 2.39 0.00 -1.10 -1.77 103.07 104.40 3hk7 h GLY 102 Ca 0.29 -0.03 0.00 0.00 0.00 0.00 0.00 47.33 47.59 3hk7 h GLY 102 CO -0.12 0.03 -0.05 1.04 0.00 0.00 0.00 176.54 177.43 3hk7 n LEU 103 N -4.45 0.36 0.00 3.11 4.77 -0.86 -4.88 117.00 115.06 3hk7 n LEU 103 Ca -0.02 0.01 0.00 0.00 -0.03 0.00 0.00 56.01 55.97 3hk7 n LEU 103 Cb 0.15 -0.14 0.00 0.00 -2.33 0.00 0.00 43.42 41.10 3hk7 n LEU 103 CO 0.35 0.06 0.00 0.61 -1.33 0.00 0.00 177.39 177.09 3hk7 n GLY 104 N 1.20 0.44 3.86 -0.72 0.00 -0.67 -5.06 105.19 104.25 3hk7 n GLY 104 Ca 0.17 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.88 3hk7 n GLY 104 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3hk7 s LEU 105 N 0.00 3.43 -0.28 0.99 1.43 -0.69 -4.99 118.68 118.57 3hk7 s LEU 105 Ca 0.00 1.48 -0.01 0.00 -1.03 0.00 0.00 54.13 54.57 3hk7 s LEU 105 Cb 0.00 -4.47 0.05 0.00 0.03 0.00 0.00 46.19 41.80 3hk7 s LEU 105 CO 0.00 -0.72 -0.04 -0.62 0.23 0.00 0.00 176.35 175.20 3hk7 s ASP 106 N -3.64 4.70 0.55 2.29 2.15 -1.26 -3.54 116.67 117.92 3hk7 s ASP 106 Ca 0.57 -1.24 0.22 0.00 0.43 0.00 0.00 52.55 52.53 3hk7 s ASP 106 Cb -0.10 -1.67 1.46 0.00 -0.30 0.00 0.00 42.92 42.31 3hk7 s ASP 106 CO 0.43 -0.22 2.14 -0.65 -0.17 0.00 0.00 175.17 176.69 3hk7 h PRO 107 N 7.95 0.00 -0.82 4.34 0.11 -1.90 -2.68 132.00 138.99 3hk7 h PRO 107 Ca -0.22 0.00 0.17 0.00 0.11 0.00 0.00 66.00 66.06 3hk7 h PRO 107 Cb 1.06 0.00 -0.06 0.00 0.11 0.00 0.00 31.00 32.12 3hk7 h PRO 107 CO 0.52 0.00 0.55 0.00 -0.21 0.00 0.00 178.00 178.86 3hk7 h ALA 108 N 1.92 2.15 0.00 -0.75 0.00 -2.00 -1.53 119.26 119.05 3hk7 h ALA 108 Ca 0.05 0.01 -0.12 0.00 0.00 0.00 0.00 54.91 54.85 3hk7 h ALA 108 Cb 0.23 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 3hk7 h ALA 108 CO -0.00 -0.39 -0.71 1.79 0.00 0.00 0.00 179.25 179.94 3hk7 h THR 109 N 0.42 0.78 -1.16 0.00 1.35 -1.92 -3.47 112.91 108.91 3hk7 h THR 109 Ca 0.41 -2.16 -0.39 0.00 -0.55 0.00 0.00 66.41 63.73 3hk7 h THR 109 Cb 0.98 2.33 -0.14 0.00 -1.73 0.00 0.00 68.15 69.59 3hk7 h THR 109 CO -0.14 0.44 -0.38 0.54 -0.25 0.00 0.00 175.52 175.73 3hk7 n ARG 110 N -3.14 -1.36 -2.50 4.72 1.74 -0.58 -4.88 116.66 110.66 3hk7 n ARG 110 Ca -0.01 1.14 -0.43 0.00 -0.77 0.00 0.00 57.85 57.79 3hk7 n ARG 110 Cb 0.76 -5.49 -0.00 0.00 -1.02 0.00 0.00 32.46 26.70 3hk7 n ARG 110 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 3hk7 n ASP 111 N -1.18 4.82 -0.25 0.55 -0.08 -1.26 -4.80 116.55 114.35 3hk7 n ASP 111 Ca -0.20 -2.91 0.08 0.00 -1.51 0.00 0.00 54.79 50.26 3hk7 n ASP 111 Cb 0.64 -1.74 0.33 0.00 2.34 0.00 0.00 41.12 42.69 3hk7 n ASP 111 CO 0.00 0.00 0.00 0.25 0.12 0.00 0.00 177.20 177.57 3hk7 h LEU 112 N 12.40 0.72 -0.18 -2.67 5.85 -1.98 -1.65 115.31 127.80 3hk7 h LEU 112 Ca 0.46 0.02 0.00 0.00 0.84 0.00 0.00 57.88 59.20 3hk7 h LEU 112 Cb 0.85 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.74 3hk7 h LEU 112 CO 1.50 0.42 0.12 1.56 -0.34 0.00 0.00 178.44 181.70 3hk7 h GLN 113 N 0.80 0.23 -0.64 1.25 1.08 -2.00 -1.95 115.11 113.88 3hk7 h GLN 113 Ca 0.40 -0.01 0.02 0.00 -1.45 0.00 0.00 58.65 57.60 3hk7 h GLN 113 Cb 0.46 -0.05 -0.04 0.00 -0.05 0.00 0.00 27.48 27.80 3hk7 h GLN 113 CO -0.16 0.15 0.41 0.28 -0.95 0.00 0.00 178.83 178.56 3hk7 h VAL 114 N 0.24 1.11 -0.75 -0.54 2.07 -1.73 -2.40 116.25 114.25 3hk7 h VAL 114 Ca 0.07 -0.28 0.03 0.00 0.82 0.00 0.00 66.70 67.35 3hk7 h VAL 114 Cb -0.02 0.23 -0.05 0.00 -1.52 0.00 0.00 31.29 29.93 3hk7 h VAL 114 CO -0.02 0.15 0.47 1.88 0.02 0.00 0.00 177.57 180.07 3hk7 h TYR 115 N 0.81 0.88 -0.31 1.57 0.05 -1.04 -1.82 116.97 117.10 3hk7 h TYR 115 Ca 0.25 0.02 -0.01 0.00 0.05 0.00 0.00 58.73 59.04 3hk7 h TYR 115 Cb -0.03 -0.29 -0.02 0.00 1.01 0.00 0.00 36.73 37.41 3hk7 h TYR 115 CO -0.04 0.50 0.15 0.00 -1.05 0.00 0.00 178.16 177.72 3hk7 h ARG 116 N 0.91 0.43 -0.40 4.88 3.08 -0.88 -2.31 114.38 120.09 3hk7 h ARG 116 Ca 0.30 -0.04 -0.07 0.00 0.07 0.00 0.00 59.98 60.24 3hk7 h ARG 116 Cb 0.03 -0.09 -0.02 0.00 0.08 0.00 0.00 29.97 29.98 3hk7 h ARG 116 CO -0.12 0.34 -0.06 0.93 -1.07 0.00 0.00 179.97 179.99 3hk7 h GLU 117 N 0.43 0.67 -0.08 0.04 5.08 -0.94 -1.62 114.58 118.16 3hk7 h GLU 117 Ca 0.11 -0.19 0.04 0.00 -1.00 0.00 0.00 59.36 58.32 3hk7 h GLU 117 Cb 0.05 -0.07 -0.06 0.00 0.50 0.00 0.00 28.75 29.17 3hk7 h GLU 117 CO -0.02 0.73 -0.28 -0.92 -1.00 0.00 0.00 179.01 177.53 3hk7 h TYR 118 N 0.62 -0.75 -0.38 4.33 3.20 -1.24 -2.57 116.97 120.17 3hk7 h TYR 118 Ca 0.12 0.03 -0.14 0.00 3.14 0.00 0.00 58.73 61.88 3hk7 h TYR 118 Cb 0.48 0.35 -0.01 0.00 1.54 0.00 0.00 36.73 39.09 3hk7 h TYR 118 CO 0.02 -0.36 -0.31 0.74 -1.64 0.00 0.00 178.16 176.61 3hk7 h PHE 119 N -0.38 0.98 -1.02 -3.82 0.04 -1.59 -3.20 116.94 107.95 3hk7 h PHE 119 Ca 0.09 -0.26 0.26 0.00 2.80 0.00 0.00 57.97 60.85 3hk7 h PHE 119 Cb 0.50 -0.22 -0.09 0.00 2.20 0.00 0.00 35.95 38.34 3hk7 h PHE 119 CO -0.35 1.04 0.66 0.00 -0.60 0.00 0.00 178.31 179.06 3hk7 h ALA 120 N 0.93 2.24 -1.00 2.45 0.00 -0.89 -2.39 119.26 120.61 3hk7 h ALA 120 Ca 0.08 0.05 -0.70 0.00 0.00 0.00 0.00 54.91 54.33 3hk7 h ALA 120 Cb 0.86 0.02 -0.29 0.00 0.00 0.00 0.00 17.79 18.38 3hk7 h ALA 120 CO 0.08 -0.62 0.86 0.36 0.00 0.00 0.00 179.25 179.92 3hk7 n LYS 121 N -4.60 2.75 -3.84 0.00 2.85 -1.12 -4.95 118.16 109.26 3hk7 n LYS 121 Ca 0.24 -3.42 -0.10 0.00 -1.05 0.00 0.00 58.31 53.98 3hk7 n LYS 121 Cb 0.85 -2.28 -0.08 0.00 -0.65 0.00 0.00 35.03 32.87 3hk7 n LYS 121 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 177.40 177.50 3hk7 s LYS 122 N -3.90 0.73 0.23 -1.58 1.02 -0.90 -5.09 119.74 110.26 3hk7 s LYS 122 Ca 0.60 -0.68 0.04 0.00 0.02 0.00 0.00 55.97 55.95 3hk7 s LYS 122 Cb 0.48 0.30 -0.03 0.00 -0.52 0.00 0.00 37.83 38.06 3hk7 s LYS 122 CO -0.15 -0.22 0.37 0.95 -0.92 0.00 0.00 175.35 175.38 3hk7 s THR 123 N -2.80 5.25 0.36 2.17 -4.23 -1.26 -4.97 115.64 110.16 3hk7 s THR 123 Ca -0.03 -0.84 0.04 0.00 -1.18 0.00 0.00 61.69 59.67 3hk7 s THR 123 Cb 0.00 -3.83 0.27 0.00 1.34 0.00 0.00 72.50 70.28 3hk7 s THR 123 CO -0.05 -0.31 2.00 0.77 -0.54 0.00 0.00 174.62 176.49 3hk7 h SER 124 N 1.34 0.70 -0.92 3.99 4.64 -1.97 -1.09 113.55 120.23 3hk7 h SER 124 Ca -0.51 -0.01 0.03 0.00 -0.47 0.00 0.00 61.79 60.83 3hk7 h SER 124 Cb 1.22 -0.17 -0.05 0.00 -0.31 0.00 0.00 62.40 63.09 3hk7 h SER 124 CO 0.63 0.49 0.61 -0.33 -0.87 0.00 0.00 176.83 177.35 3hk7 h GLU 125 N 0.81 1.14 0.03 4.77 3.07 -1.94 0.18 114.58 122.64 3hk7 h GLU 125 Ca 0.25 -0.07 -0.00 0.00 -0.50 0.00 0.00 59.36 59.04 3hk7 h GLU 125 Cb 0.01 -0.26 0.00 0.00 -0.84 0.00 0.00 28.75 27.66 3hk7 h GLU 125 CO -0.06 0.75 -0.01 0.93 -1.40 0.00 0.00 179.01 179.21 3hk7 h GLU 126 N 1.17 -0.04 -0.83 2.33 5.08 -1.63 -2.62 114.58 118.03 3hk7 h GLU 126 Ca 0.36 0.00 0.06 0.00 -1.00 0.00 0.00 59.36 58.78 3hk7 h GLU 126 Cb -0.00 0.01 -0.05 0.00 0.50 0.00 0.00 28.75 29.20 3hk7 h GLU 126 CO -0.11 0.44 0.55 0.37 -1.00 0.00 0.00 179.01 179.26 3hk7 h GLN 127 N -0.53 0.92 0.14 2.33 5.75 -0.96 0.34 115.11 123.10 3hk7 h GLN 127 Ca -0.00 -0.06 -0.01 0.00 -0.15 0.00 0.00 58.65 58.43 3hk7 h GLN 127 Cb 0.49 -0.21 0.00 0.00 1.07 0.00 0.00 27.48 28.84 3hk7 h GLN 127 CO 0.01 0.61 -0.07 0.28 -2.65 0.00 0.00 178.83 177.01 3hk7 h VAL 128 N 0.95 0.92 -0.65 2.39 2.07 -0.97 0.22 116.25 121.18 3hk7 h VAL 128 Ca 0.35 -0.25 0.08 0.00 0.82 0.00 0.00 66.70 67.70 3hk7 h VAL 128 Cb 0.17 1.08 -0.06 0.00 -1.52 0.00 0.00 31.29 30.96 3hk7 h VAL 128 CO -0.12 0.06 0.32 0.44 0.02 0.00 0.00 177.57 178.29 3hk7 h ASP 129 N -0.30 0.42 0.61 0.57 3.32 -0.98 -0.20 116.42 119.85 3hk7 h ASP 129 Ca -0.02 0.05 -0.03 0.00 0.02 0.00 0.00 57.03 57.05 3hk7 h ASP 129 Cb 0.24 -0.02 0.01 0.00 0.22 0.00 0.00 39.33 39.78 3hk7 h ASP 129 CO 0.03 0.26 -0.29 0.74 -1.72 0.00 0.00 179.24 178.26 3hk7 h THR 130 N 0.57 0.34 -0.10 0.35 2.02 -0.66 -2.22 112.91 113.20 3hk7 h THR 130 Ca 0.31 -0.20 0.03 0.00 0.77 0.00 0.00 66.41 67.32 3hk7 h THR 130 Cb 0.28 0.41 -0.03 0.00 -1.74 0.00 0.00 68.15 67.07 3hk7 h THR 130 CO -0.24 0.03 -0.10 0.58 0.37 0.00 0.00 175.52 176.17 3hk7 h VAL 131 N -0.96 0.73 -0.29 3.16 2.07 -0.35 0.14 116.25 120.75 3hk7 h VAL 131 Ca -0.08 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.44 3hk7 h VAL 131 Cb 0.67 0.73 -0.01 0.00 -1.52 0.00 0.00 31.29 31.15 3hk7 h VAL 131 CO 0.14 0.00 0.19 -0.07 0.02 0.00 0.00 177.57 177.85 3hk7 h LEU 132 N -0.12 0.31 0.05 2.57 3.38 -1.10 0.22 115.31 120.63 3hk7 h LEU 132 Ca 0.07 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.03 3hk7 h LEU 132 Cb 0.22 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 40.89 3hk7 h LEU 132 CO -0.17 0.23 -0.02 -0.61 0.09 0.00 0.00 178.44 177.95 3hk7 h GLN 133 N 0.37 -0.06 -0.73 1.13 -0.00 -0.67 -0.70 115.11 114.45 3hk7 h GLN 133 Ca 0.11 0.00 -0.04 0.00 -0.00 0.00 0.00 58.65 58.72 3hk7 h GLN 133 Cb -0.01 0.01 -0.03 0.00 0.00 0.00 0.00 27.48 27.45 3hk7 h GLN 133 CO -0.02 0.39 0.28 -0.07 0.00 0.00 0.00 178.83 179.41 3hk7 h LEU 134 N -0.54 1.01 -0.51 -2.39 3.38 -0.22 -2.60 115.31 113.44 3hk7 h LEU 134 Ca -0.01 -0.15 0.00 0.00 0.09 0.00 0.00 57.88 57.81 3hk7 h LEU 134 Cb 0.48 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 40.97 3hk7 h LEU 134 CO 0.01 0.90 -0.09 0.00 0.09 0.00 0.00 178.44 179.35 3hk7 n ALA 135 N -2.44 2.76 -3.81 1.53 0.00 0.73 -4.94 120.51 114.34 3hk7 n ALA 135 Ca 0.06 -0.35 -0.23 0.00 0.00 0.00 0.00 53.44 52.92 3hk7 n ALA 135 Cb 0.19 -1.25 0.01 0.00 0.00 0.00 0.00 19.45 18.39 3hk7 n ALA 135 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 3hk7 n ASN 136 N -0.50 -0.95 -4.37 0.00 5.15 -0.40 -4.81 115.26 109.38 3hk7 n ASN 136 Ca 0.17 -0.89 -0.36 0.00 -0.60 0.00 0.00 54.58 52.89 3hk7 n ASN 136 Cb 0.30 -3.65 -0.13 0.00 -0.53 0.00 0.00 39.78 35.77 3hk7 n ASN 136 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 3hk7 s VAL 137 N -3.77 3.85 -0.12 3.44 1.01 -0.45 -0.35 120.40 124.01 3hk7 s VAL 137 Ca 0.03 -0.38 0.17 0.00 0.00 0.00 0.00 61.98 61.81 3hk7 s VAL 137 Cb -0.02 -2.80 -0.20 0.00 0.00 0.00 0.00 36.38 33.36 3hk7 s VAL 137 CO 0.84 0.35 0.56 -1.54 0.00 0.00 0.00 175.10 175.31 3hk7 n SER 138 N 4.86 0.52 -3.84 3.32 3.41 -0.02 -4.71 113.62 117.16 3hk7 n SER 138 Ca -0.17 0.23 -0.14 0.00 -0.26 0.00 0.00 58.87 58.53 3hk7 n SER 138 Cb 0.51 0.61 -0.15 0.00 -0.26 0.00 0.00 64.21 64.92 3hk7 n SER 138 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 3hk7 s ASP 139 N -5.56 0.11 -0.10 4.04 1.01 -1.06 -4.74 116.67 110.37 3hk7 s ASP 139 Ca -0.06 0.00 0.03 0.00 0.71 0.00 0.00 52.55 53.24 3hk7 s ASP 139 Cb 0.09 -0.05 0.01 0.00 1.01 0.00 0.00 42.92 43.97 3hk7 s ASP 139 CO 0.83 -0.05 -0.20 -0.69 0.21 0.00 0.00 175.17 175.28 3hk7 s VAL 140 N 0.44 1.76 -0.22 -1.27 1.01 -0.13 -0.60 120.40 121.37 3hk7 s VAL 140 Ca -0.04 -0.83 -0.12 0.00 0.00 0.00 0.00 61.98 60.99 3hk7 s VAL 140 Cb -0.06 -1.55 -0.05 0.00 0.00 0.00 0.00 36.38 34.73 3hk7 s VAL 140 CO -0.01 0.49 0.23 -0.69 0.00 0.00 0.00 175.10 175.12 3hk7 s VAL 141 N 0.59 5.31 0.66 2.92 1.01 -0.10 -0.55 120.40 130.24 3hk7 s VAL 141 Ca -0.14 0.35 -0.04 0.00 0.00 0.00 0.00 61.98 62.15 3hk7 s VAL 141 Cb -0.17 -3.57 0.06 0.00 0.00 0.00 0.00 36.38 32.70 3hk7 s VAL 141 CO 0.05 0.32 0.93 -0.04 0.00 0.00 0.00 175.10 176.36 3hk7 s MET 142 N 1.07 2.25 -0.35 2.72 -1.94 0.10 -1.47 119.30 121.68 3hk7 s MET 142 Ca 0.11 -0.51 -0.01 0.00 -1.71 0.00 0.00 55.69 53.58 3hk7 s MET 142 Cb -0.14 -2.29 0.08 0.00 2.01 0.00 0.00 34.83 34.50 3hk7 s MET 142 CO 0.05 -1.09 0.08 0.99 -0.01 0.00 0.00 175.02 175.04 3hk7 s THR 143 N -3.08 2.89 -0.38 2.05 2.01 -1.13 -3.23 115.64 114.76 3hk7 s THR 143 Ca 0.60 -1.87 -0.11 0.00 0.31 0.00 0.00 61.69 60.62 3hk7 s THR 143 Cb -0.10 -2.89 0.04 0.00 0.01 0.00 0.00 72.50 69.56 3hk7 s THR 143 CO 0.43 -0.43 0.22 0.20 -0.69 0.00 0.00 174.62 174.34 3hk7 s ASN 144 N 1.39 5.72 -0.55 3.53 -0.87 0.09 -4.95 114.94 119.30 3hk7 s ASN 144 Ca 0.03 -1.09 -0.17 0.00 -1.57 0.00 0.00 52.86 50.06 3hk7 s ASN 144 Cb -0.21 -2.02 0.11 0.00 -0.02 0.00 0.00 41.25 39.11 3hk7 s ASN 144 CO -0.04 -0.42 0.56 -0.62 -2.57 0.00 0.00 177.10 174.01 3hk7 s ASP 145 N 1.66 6.18 0.00 -1.22 2.15 -1.26 -1.40 116.67 122.78 3hk7 s ASP 145 Ca 0.02 -1.55 0.08 0.00 0.43 0.00 0.00 52.55 51.53 3hk7 s ASP 145 Cb -0.20 -2.24 0.39 0.00 -0.30 0.00 0.00 42.92 40.57 3hk7 s ASP 145 CO 0.06 -0.92 1.17 -0.81 -0.17 0.00 0.00 175.17 174.50 3hk7 n PRO 146 N 5.66 0.08 0.00 4.34 -0.04 -1.26 -1.78 135.00 142.01 3hk7 n PRO 146 Ca -0.12 0.25 0.12 0.00 -0.04 0.00 0.00 63.50 63.71 3hk7 n PRO 146 Cb 0.42 -1.50 0.14 0.00 -0.04 0.00 0.00 33.50 32.51 3hk7 n PRO 146 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 3hk7 n PHE 147 N -1.35 0.00 -3.23 0.54 3.72 -1.26 -4.68 117.46 111.21 3hk7 n PHE 147 Ca 0.03 0.00 -0.40 0.00 -0.05 0.00 0.00 57.45 57.03 3hk7 n PHE 147 Cb 0.07 -0.09 -0.08 0.00 -0.94 0.00 0.00 39.48 38.45 3hk7 n PHE 147 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 3hk7 s ASP 148 N -2.72 6.41 0.23 4.37 2.15 -0.73 -4.96 116.67 121.41 3hk7 s ASP 148 Ca 0.16 0.39 -0.11 0.00 0.43 0.00 0.00 52.55 53.43 3hk7 s ASP 148 Cb 0.18 -2.28 0.33 0.00 -0.30 0.00 0.00 42.92 40.84 3hk7 s ASP 148 CO 0.66 -0.34 1.62 0.44 -0.17 0.00 0.00 175.17 177.37 3hk7 h ASP 149 N 8.13 -0.54 -0.12 -0.34 3.32 -1.87 -0.52 116.42 124.47 3hk7 h ASP 149 Ca -0.29 0.20 0.03 0.00 0.02 0.00 0.00 57.03 57.00 3hk7 h ASP 149 Cb 1.14 0.40 -0.03 0.00 0.22 0.00 0.00 39.33 41.06 3hk7 h ASP 149 CO 0.73 -0.21 -0.04 0.78 -1.72 0.00 0.00 179.24 178.78 3hk7 h ASN 150 N 0.03 -0.15 -0.30 6.45 2.35 -1.95 -2.17 115.58 119.84 3hk7 h ASN 150 Ca 0.36 0.04 -0.08 0.00 -0.55 0.00 0.00 56.30 56.08 3hk7 h ASN 150 Cb 0.58 0.09 -0.01 0.00 0.05 0.00 0.00 38.32 39.03 3hk7 h ASN 150 CO -0.70 -0.06 -0.11 -0.33 -1.65 0.00 0.00 177.43 174.58 3hk7 h GLU 151 N -0.02 0.61 -0.60 0.81 5.08 -1.70 -3.14 114.58 115.62 3hk7 h GLU 151 Ca 0.06 -0.25 0.07 0.00 -1.00 0.00 0.00 59.36 58.24 3hk7 h GLU 151 Cb 0.12 -0.03 -0.06 0.00 0.50 0.00 0.00 28.75 29.28 3hk7 h GLU 151 CO -0.14 0.82 0.29 -0.09 -1.00 0.00 0.00 179.01 178.89 3hk7 h ARG 152 N 0.37 0.51 -0.77 2.33 2.43 -0.98 -2.10 114.38 116.16 3hk7 h ARG 152 Ca 0.07 -0.03 -0.00 0.00 -0.81 0.00 0.00 59.98 59.21 3hk7 h ARG 152 Cb 0.62 -0.12 -0.04 0.00 -0.42 0.00 0.00 29.97 30.01 3hk7 h ARG 152 CO 0.04 0.34 0.48 0.82 -1.51 0.00 0.00 179.97 180.14 3hk7 h ILE 153 N 0.53 1.21 -0.54 1.20 2.04 -1.42 -0.63 117.51 119.90 3hk7 h ILE 153 Ca 0.28 -0.45 0.08 0.00 1.00 0.00 0.00 64.86 65.78 3hk7 h ILE 153 Cb 0.24 0.12 -0.07 0.00 -0.74 0.00 0.00 36.82 36.37 3hk7 h ILE 153 CO -0.22 0.22 0.17 -1.28 0.00 0.00 0.00 178.15 177.04 3hk7 h SER 154 N 1.06 0.14 -0.31 1.72 0.87 -1.34 -0.41 113.55 115.28 3hk7 h SER 154 Ca 0.28 0.08 -0.16 0.00 -1.23 0.00 0.00 61.79 60.75 3hk7 h SER 154 Cb -0.06 0.07 -0.00 0.00 -0.44 0.00 0.00 62.40 61.97 3hk7 h SER 154 CO -0.05 0.10 -0.44 -0.50 -0.53 0.00 0.00 176.83 175.41 3hk7 h TRP 155 N 0.34 1.06 -0.42 2.24 4.06 -1.14 -2.02 115.95 120.07 3hk7 h TRP 155 Ca 0.27 -0.34 -0.02 0.00 2.06 0.00 0.00 58.89 60.86 3hk7 h TRP 155 Cb 0.33 -0.22 -0.02 0.00 -1.00 0.00 0.00 29.16 28.25 3hk7 h TRP 155 CO -0.18 1.15 0.17 -0.07 -3.56 0.00 0.00 178.44 175.95 3hk7 h LEU 156 N 0.70 0.53 0.00 -4.49 3.38 -0.40 0.06 115.31 115.09 3hk7 h LEU 156 Ca 0.05 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.96 3hk7 h LEU 156 Cb 1.02 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.64 3hk7 h LEU 156 CO 0.10 0.48 0.00 -0.62 0.09 0.00 0.00 178.44 178.49 3hk7 n GLU 157 N -4.38 0.44 -0.33 1.13 1.02 -0.23 -4.89 120.64 113.40 3hk7 n GLU 157 Ca 0.03 0.04 0.00 0.00 -0.02 0.00 0.00 57.16 57.21 3hk7 n GLU 157 Cb 0.14 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.06 3hk7 n GLU 157 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3hk7 n GLY 158 N 0.83 0.83 3.70 0.62 0.00 0.01 -5.04 105.19 106.14 3hk7 n GLY 158 Ca 0.13 -0.05 -0.42 0.00 0.00 0.00 0.00 46.02 45.68 3hk7 n GLY 158 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hk7 s LYS 159 N -0.67 4.23 -0.05 1.61 1.02 -0.77 -5.00 119.74 120.11 3hk7 s LYS 159 Ca 0.00 2.27 0.04 0.00 0.02 0.00 0.00 55.97 58.30 3hk7 s LYS 159 Cb 0.00 -3.41 -0.02 0.00 -0.52 0.00 0.00 37.83 33.87 3hk7 s LYS 159 CO 0.00 -0.64 -0.16 -0.65 -0.92 0.00 0.00 175.35 172.98 3hk7 s GLN 160 N 1.95 2.54 0.63 1.68 -1.52 -1.26 -4.61 119.66 119.07 3hk7 s GLN 160 Ca 0.70 -0.73 -0.13 0.00 -1.95 0.00 0.00 55.36 53.25 3hk7 s GLN 160 Cb -0.40 -2.35 -0.02 0.00 -0.22 0.00 0.00 33.01 30.02 3hk7 s GLN 160 CO 0.31 0.57 1.05 -1.25 -0.25 0.00 0.00 175.29 175.72 3hk7 s PRO 161 N -0.60 3.28 0.94 2.91 0.04 -1.26 -4.96 135.00 135.35 3hk7 s PRO 161 Ca 0.09 1.01 -0.12 0.00 0.04 0.00 0.00 61.00 62.02 3hk7 s PRO 161 Cb -0.11 -2.03 0.16 0.00 0.04 0.00 0.00 34.50 32.55 3hk7 s PRO 161 CO 0.01 -0.83 1.11 0.16 0.04 0.00 0.00 177.00 177.49 3hk7 s ASP 162 N -3.41 3.17 0.65 6.66 1.47 -1.26 -4.88 116.67 119.07 3hk7 s ASP 162 Ca 0.60 1.10 0.27 0.00 1.18 0.00 0.00 52.55 55.70 3hk7 s ASP 162 Cb -0.14 -1.73 1.48 0.00 -0.34 0.00 0.00 42.92 42.19 3hk7 s ASP 162 CO 0.46 -2.78 1.83 0.77 0.68 0.00 0.00 175.17 176.13 3hk7 h SER 163 N -1.65 0.00 1.79 2.11 4.64 -2.01 -1.08 113.55 117.35 3hk7 h SER 163 Ca -0.52 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 60.77 3hk7 h SER 163 Cb 1.33 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.41 3hk7 h SER 163 CO 0.60 0.00 -0.21 0.03 -0.87 0.00 0.00 176.83 176.37 3hk7 h ARG 164 N 0.00 0.00 -5.64 4.77 3.08 -1.90 -3.45 114.38 111.24 3hk7 h ARG 164 Ca 0.00 0.00 -0.66 0.00 0.07 0.00 0.00 59.98 59.39 3hk7 h ARG 164 Cb 0.74 0.00 -0.20 0.00 0.08 0.00 0.00 29.97 30.59 3hk7 h ARG 164 CO 0.00 0.13 -0.68 -0.06 -1.07 0.00 0.00 179.97 178.29 3hk7 s PHE 165 N -3.15 3.00 0.18 3.04 0.08 -0.41 -0.96 117.98 119.76 3hk7 s PHE 165 Ca 0.06 -0.16 0.10 0.00 0.12 0.00 0.00 56.93 57.04 3hk7 s PHE 165 Cb 0.06 -1.86 -0.04 0.00 -0.57 0.00 0.00 43.02 40.61 3hk7 s PHE 165 CO 0.70 0.13 -0.16 -1.01 -0.10 0.00 0.00 175.22 174.78 3hk7 s HIS 166 N -0.14 2.50 0.14 0.36 3.76 0.29 -4.67 115.29 117.52 3hk7 s HIS 166 Ca 0.02 -0.28 -0.03 0.00 -0.15 0.00 0.00 55.06 54.63 3hk7 s HIS 166 Cb -0.13 -1.24 -0.05 0.00 1.11 0.00 0.00 32.58 32.27 3hk7 s HIS 166 CO 0.03 0.49 0.34 0.00 -0.85 0.00 0.00 174.74 174.75 3hk7 s ALA 167 N -1.63 3.85 -0.07 -1.40 0.00 -1.26 0.00 121.76 121.25 3hk7 s ALA 167 Ca 0.23 -0.69 -0.02 0.00 0.00 0.00 0.00 51.96 51.47 3hk7 s ALA 167 Cb -0.09 -2.03 0.03 0.00 0.00 0.00 0.00 23.12 21.04 3hk7 s ALA 167 CO 0.13 0.65 0.05 0.00 0.00 0.00 0.00 175.76 176.59 3hk7 s ALA 168 N -1.67 0.40 -0.77 0.00 0.00 -1.20 0.67 121.76 119.19 3hk7 s ALA 168 Ca 0.39 0.01 -0.26 0.00 0.00 0.00 0.00 51.96 52.10 3hk7 s ALA 168 Cb -0.12 -0.73 0.01 0.00 0.00 0.00 0.00 23.12 22.29 3hk7 s ALA 168 CO 0.26 -0.59 1.53 -1.17 0.00 0.00 0.00 175.76 175.79 3hk7 s LEU 169 N 2.10 3.25 0.07 0.00 2.96 -0.79 -0.73 118.68 125.55 3hk7 s LEU 169 Ca 0.04 -0.42 -0.30 0.00 -0.22 0.00 0.00 54.13 53.23 3hk7 s LEU 169 Cb -0.13 -2.55 -0.05 0.00 0.50 0.00 0.00 46.19 43.96 3hk7 s LEU 169 CO -0.05 -2.02 1.01 -0.60 -1.32 0.00 0.00 176.35 173.38 3hk7 s ARG 170 N 6.10 4.60 -0.12 1.98 6.06 -0.49 -1.55 118.95 135.52 3hk7 s ARG 170 Ca 0.49 1.51 0.14 0.00 -2.50 0.00 0.00 55.73 55.38 3hk7 s ARG 170 Cb -0.08 -3.39 0.31 0.00 0.06 0.00 0.00 34.95 31.85 3hk7 s ARG 170 CO 0.11 0.04 1.16 1.28 -2.50 0.00 0.00 175.30 175.38 3hk7 n LEU 171 N 3.32 2.00 -0.13 -0.88 4.77 -0.17 -4.39 117.00 121.52 3hk7 n LEU 171 Ca 0.05 -2.96 -0.05 0.00 -0.03 0.00 0.00 56.01 53.02 3hk7 n LEU 171 Cb 0.49 -0.36 0.02 0.00 -2.33 0.00 0.00 43.42 41.24 3hk7 n LEU 171 CO 0.52 0.86 0.74 0.44 -1.33 0.00 0.00 177.39 178.62 3hk7 h ASP 172 N 0.45 -0.58 -0.66 -1.43 5.19 -1.93 -1.65 116.42 115.80 3hk7 h ASP 172 Ca -0.03 0.15 0.04 0.00 -0.62 0.00 0.00 57.03 56.57 3hk7 h ASP 172 Cb 1.15 0.33 -0.04 0.00 0.18 0.00 0.00 39.33 40.96 3hk7 h ASP 172 CO 0.01 -0.20 0.43 -0.65 -3.12 0.00 0.00 179.24 175.71 3hk7 h PRO 173 N -0.08 0.74 0.03 3.56 0.11 -1.95 0.64 132.00 135.05 3hk7 h PRO 173 Ca 0.20 -0.04 -0.00 0.00 0.11 0.00 0.00 66.00 66.27 3hk7 h PRO 173 Cb 0.39 -0.17 0.00 0.00 0.11 0.00 0.00 31.00 31.34 3hk7 h PRO 173 CO -0.48 0.49 -0.02 1.25 -0.21 0.00 0.00 178.00 179.04 3hk7 h LEU 174 N 0.76 -0.04 -0.07 2.35 5.85 -1.69 -2.27 115.31 120.21 3hk7 h LEU 174 Ca 0.27 -0.48 -0.20 0.00 0.84 0.00 0.00 57.88 58.31 3hk7 h LEU 174 Cb 0.11 0.01 -0.03 0.00 0.37 0.00 0.00 40.66 41.12 3hk7 h LEU 174 CO -0.08 0.47 -0.95 -0.07 -0.34 0.00 0.00 178.44 177.48 3hk7 h LEU 175 N -0.55 0.00 -1.07 2.25 3.38 -1.19 -3.20 115.31 114.94 3hk7 h LEU 175 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3hk7 h LEU 175 Cb 0.51 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.26 3hk7 h LEU 175 CO 0.01 0.95 -0.22 0.59 0.09 0.00 0.00 178.44 179.85 3hk7 n ASN 176 N -3.38 1.76 -2.53 -0.43 3.02 0.20 -3.81 115.26 110.08 3hk7 n ASN 176 Ca -0.00 -1.38 -0.01 0.00 -0.03 0.00 0.00 54.58 53.17 3hk7 n ASN 176 Cb 0.90 0.34 0.06 0.00 -0.61 0.00 0.00 39.78 40.48 3hk7 n ASN 176 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3hk7 n GLU 177 N 0.14 1.33 -0.25 3.52 1.02 -0.86 -4.96 120.64 120.58 3hk7 n GLU 177 Ca 0.07 -2.52 0.20 0.00 -0.02 0.00 0.00 57.16 54.89 3hk7 n GLU 177 Cb 0.34 -0.71 0.53 0.00 -0.02 0.00 0.00 31.44 31.57 3hk7 n GLU 177 CO 0.00 0.00 0.00 -0.92 1.18 0.00 0.00 177.13 177.39 3hk7 h TYR 178 N 1.81 0.51 -0.58 -0.32 3.20 -1.56 0.34 116.97 120.37 3hk7 h TYR 178 Ca -0.27 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.62 3hk7 h TYR 178 Cb 1.36 -0.16 -0.03 0.00 1.54 0.00 0.00 36.73 39.44 3hk7 h TYR 178 CO 0.26 0.12 0.36 0.93 -1.64 0.00 0.00 178.16 178.20 3hk7 h GLU 179 N 0.38 0.78 0.03 1.82 4.39 -1.90 0.24 114.58 120.31 3hk7 h GLU 179 Ca 0.48 -0.06 -0.32 0.00 0.34 0.00 0.00 59.36 59.81 3hk7 h GLU 179 Cb 1.25 -0.17 -0.04 0.00 -0.10 0.00 0.00 28.75 29.68 3hk7 h GLU 179 CO -0.18 0.53 -1.84 1.04 -1.16 0.00 0.00 179.01 177.40 3hk7 n GLN 180 N -4.43 0.67 0.09 2.33 3.00 -0.45 -4.34 117.38 114.25 3hk7 n GLN 180 Ca 0.06 0.26 -0.04 0.00 -0.01 0.00 0.00 57.00 57.27 3hk7 n GLN 180 Cb 0.06 -1.75 -0.00 0.00 0.00 0.00 0.00 30.24 28.55 3hk7 n GLN 180 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.06 178.21 3hk7 h THR 181 N 0.02 1.56 0.00 5.09 2.02 -0.74 -3.27 112.91 117.59 3hk7 h THR 181 Ca -0.34 -2.88 -0.00 0.00 0.77 0.00 0.00 66.41 63.96 3hk7 h THR 181 Cb 2.03 2.57 -0.00 0.00 -1.74 0.00 0.00 68.15 71.01 3hk7 h THR 181 CO 0.07 0.81 -0.01 0.07 0.37 0.00 0.00 175.52 176.84 3hk7 h LYS 182 N 0.00 0.00 -0.26 6.66 2.10 -0.72 -0.78 116.57 123.58 3hk7 h LYS 182 Ca -0.01 0.00 -0.17 0.00 -2.00 0.00 0.00 60.65 58.47 3hk7 h LYS 182 Cb 1.50 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.83 3hk7 h LYS 182 CO 0.11 0.01 -0.50 0.45 -2.00 0.00 0.00 179.45 177.52 3hk7 h HIS 183 N 0.00 1.00 -0.01 0.07 3.86 -1.80 -2.55 115.15 115.73 3hk7 h HIS 183 Ca -0.00 -0.36 -0.09 0.00 -1.16 0.00 0.00 60.37 58.76 3hk7 h HIS 183 Cb 0.03 -0.19 -0.01 0.00 1.06 0.00 0.00 27.41 28.30 3hk7 h HIS 183 CO 0.00 1.17 -0.43 0.00 0.86 0.00 0.00 177.93 179.53 3hk7 h ARG 184 N 0.55 0.01 -0.21 2.45 3.08 -1.34 -2.30 114.38 116.62 3hk7 h ARG 184 Ca 0.01 -0.01 -0.03 0.00 0.07 0.00 0.00 59.98 60.03 3hk7 h ARG 184 Cb 1.11 -0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.15 3hk7 h ARG 184 CO 0.11 0.44 0.02 1.25 -1.07 0.00 0.00 179.97 180.72 3hk7 h LEU 185 N 0.01 0.35 -0.91 3.04 5.85 -1.15 -2.65 115.31 119.85 3hk7 h LEU 185 Ca -0.00 -0.29 -0.10 0.00 0.84 0.00 0.00 57.88 58.33 3hk7 h LEU 185 Cb 0.77 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.69 3hk7 h LEU 185 CO 0.06 0.55 -0.29 0.08 -0.34 0.00 0.00 178.44 178.50 3hk7 h ARG 186 N 0.14 0.46 0.00 1.25 0.11 -1.09 -0.89 114.38 114.37 3hk7 h ARG 186 Ca 0.06 -0.19 0.00 0.00 0.10 0.00 0.00 59.98 59.96 3hk7 h ARG 186 Cb 0.36 -0.02 0.00 0.00 1.11 0.00 0.00 29.97 31.42 3hk7 h ARG 186 CO 0.01 0.71 0.00 -0.44 0.10 0.00 0.00 179.97 180.35 3hk7 h ASP 187 N 0.40 0.00 0.07 0.08 3.32 -1.26 -1.84 116.42 117.19 3hk7 h ASP 187 Ca 0.05 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.10 3hk7 h ASP 187 Cb 0.72 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.27 3hk7 h ASP 187 CO 0.05 0.00 -0.55 0.79 -1.72 0.00 0.00 179.24 177.82 3hk7 n TRP 188 N -2.69 0.00 0.00 4.55 8.01 -0.84 -4.95 117.44 121.53 3hk7 n TRP 188 Ca -0.00 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.19 3hk7 n TRP 188 Cb 0.18 -0.04 0.00 0.00 -2.01 0.00 0.00 31.31 29.44 3hk7 n TRP 188 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 3hk7 n GLY 189 N 1.43 1.00 3.47 6.99 0.00 -0.69 -5.08 105.19 112.31 3hk7 n GLY 189 Ca 0.08 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.67 3hk7 n GLY 189 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3hk7 s TYR 190 N -2.00 3.09 -1.34 1.61 2.02 -0.40 -4.98 117.35 115.36 3hk7 s TYR 190 Ca 0.00 -0.43 -0.17 0.00 -0.37 0.00 0.00 57.07 56.10 3hk7 s TYR 190 Cb 0.00 -3.32 0.06 0.00 -0.40 0.00 0.00 41.96 38.31 3hk7 s TYR 190 CO 0.00 -0.91 1.87 1.17 -1.57 0.00 0.00 175.55 176.11 3hk7 n LYS 191 N 5.99 3.11 -2.95 -0.62 3.00 -1.26 -2.40 118.16 123.03 3hk7 n LYS 191 Ca -0.06 -3.11 -0.41 0.00 -0.00 0.00 0.00 58.31 54.73 3hk7 n LYS 191 Cb 0.46 -3.44 -0.04 0.00 0.00 0.00 0.00 35.03 32.01 3hk7 n LYS 191 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.40 177.54 3hk7 s VAL 192 N 3.93 4.95 0.89 3.15 -7.23 -1.26 -4.44 120.40 120.38 3hk7 s VAL 192 Ca 0.52 1.55 -0.14 0.00 -1.81 0.00 0.00 61.98 62.10 3hk7 s VAL 192 Cb 0.07 -4.10 0.14 0.00 0.56 0.00 0.00 36.38 33.05 3hk7 s VAL 192 CO 0.03 0.12 1.25 0.20 -0.31 0.00 0.00 175.10 176.39 3hk7 s ASN 193 N 1.04 3.79 0.22 4.85 0.01 -1.26 -4.94 114.94 118.65 3hk7 s ASN 193 Ca 0.38 0.52 -0.09 0.00 -0.71 0.00 0.00 52.86 52.96 3hk7 s ASN 193 Cb -0.17 -0.78 0.17 0.00 0.41 0.00 0.00 41.25 40.88 3hk7 s ASN 193 CO 0.15 -2.33 1.84 0.44 -1.51 0.00 0.00 177.10 175.69 3hk7 h ASP 194 N -1.36 1.01 -2.48 -1.22 3.45 -2.03 -3.43 116.42 110.36 3hk7 h ASP 194 Ca -0.45 -0.09 -0.53 0.00 0.43 0.00 0.00 57.03 56.38 3hk7 h ASP 194 Cb 1.28 -0.26 -0.05 0.00 -0.56 0.00 0.00 39.33 39.75 3hk7 h ASP 194 CO 0.52 0.81 -0.52 -1.83 -1.57 0.00 0.00 179.24 176.65 3hk7 s GLU 195 N -5.87 3.09 -1.16 3.56 -1.05 -1.26 -5.04 118.70 110.98 3hk7 s GLU 195 Ca -0.13 -0.84 -0.19 0.00 -0.15 0.00 0.00 54.97 53.66 3hk7 s GLU 195 Cb 0.16 -2.73 0.08 0.00 -0.44 0.00 0.00 34.13 31.20 3hk7 s GLU 195 CO 0.81 0.46 1.55 -0.46 0.95 0.00 0.00 175.26 178.57 3hk7 s TRP 196 N -1.87 2.80 0.53 4.83 -0.11 -1.26 -4.67 118.94 119.18 3hk7 s TRP 196 Ca 0.33 -1.38 0.02 0.00 1.22 0.00 0.00 56.10 56.29 3hk7 s TRP 196 Cb -0.10 -4.65 0.01 0.00 -1.50 0.00 0.00 33.47 27.23 3hk7 s TRP 196 CO 0.26 -1.78 0.11 0.54 -4.62 0.00 0.00 176.95 171.45 3hk7 s ASN 197 N 4.30 4.28 0.33 5.86 2.20 -1.26 -4.95 114.94 125.69 3hk7 s ASN 197 Ca 0.48 -1.58 0.11 0.00 -0.94 0.00 0.00 52.86 50.93 3hk7 s ASN 197 Cb 0.01 0.58 0.97 0.00 -2.00 0.00 0.00 41.25 40.81 3hk7 s ASN 197 CO -0.01 -0.96 1.67 -0.08 -2.94 0.00 0.00 177.10 174.79 3hk7 h GLU 198 N 1.15 0.35 0.57 3.55 4.57 -1.99 -0.65 114.58 122.13 3hk7 h GLU 198 Ca -0.42 -0.02 -0.03 0.00 -1.18 0.00 0.00 59.36 57.71 3hk7 h GLU 198 Cb 1.32 -0.08 0.00 0.00 -0.16 0.00 0.00 28.75 29.83 3hk7 h GLU 198 CO 0.69 0.23 -0.29 0.78 -1.18 0.00 0.00 179.01 179.24 3hk7 h GLY 199 N 0.36 -0.82 1.46 1.92 0.00 -1.94 -1.07 103.07 102.99 3hk7 h GLY 199 Ca 0.68 0.31 -0.00 0.00 0.00 0.00 0.00 47.33 48.32 3hk7 h GLY 199 CO -0.59 -0.30 0.32 1.76 0.00 0.00 0.00 176.54 177.73 3hk7 h SER 200 N -0.78 0.63 -0.44 0.19 0.02 -1.50 -1.31 113.55 110.35 3hk7 h SER 200 Ca -0.08 -0.03 -0.03 0.00 -0.84 0.00 0.00 61.79 60.81 3hk7 h SER 200 Cb 0.61 -0.16 -0.02 0.00 0.14 0.00 0.00 62.40 62.97 3hk7 h SER 200 CO 0.12 0.49 0.15 0.40 -1.14 0.00 0.00 176.83 176.85 3hk7 h ILE 201 N 0.73 1.21 -0.05 3.27 2.04 -0.93 -1.74 117.51 122.05 3hk7 h ILE 201 Ca 0.19 -0.70 -0.17 0.00 1.00 0.00 0.00 64.86 65.19 3hk7 h ILE 201 Cb -0.02 0.84 -0.01 0.00 -0.74 0.00 0.00 36.82 36.89 3hk7 h ILE 201 CO -0.04 0.25 -0.72 1.56 0.00 0.00 0.00 178.15 179.21 3hk7 h GLN 202 N 0.57 0.25 -0.09 2.37 1.08 -0.78 -2.58 115.11 115.94 3hk7 h GLN 202 Ca 0.14 -0.21 -0.16 0.00 -1.45 0.00 0.00 58.65 56.98 3hk7 h GLN 202 Cb 0.24 0.04 -0.01 0.00 -0.05 0.00 0.00 27.48 27.70 3hk7 h GLN 202 CO -0.01 0.86 -0.63 0.93 -0.95 0.00 0.00 178.83 179.04 3hk7 h GLU 203 N 0.17 0.31 -0.37 1.46 4.39 -1.16 -0.39 114.58 118.99 3hk7 h GLU 203 Ca -0.02 -0.22 -0.10 0.00 0.34 0.00 0.00 59.36 59.36 3hk7 h GLU 203 Cb 1.27 0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 29.95 3hk7 h GLU 203 CO 0.11 0.84 -0.14 0.28 -1.16 0.00 0.00 179.01 178.94 3hk7 h VAL 204 N 0.23 1.28 -0.01 3.13 2.07 -1.30 -2.01 116.25 119.64 3hk7 h VAL 204 Ca -0.01 -1.25 0.01 0.00 0.82 0.00 0.00 66.70 66.27 3hk7 h VAL 204 Cb 1.15 1.31 -0.01 0.00 -1.52 0.00 0.00 31.29 32.22 3hk7 h VAL 204 CO 0.10 0.41 -0.04 0.11 0.02 0.00 0.00 177.57 178.17 3hk7 h LYS 205 N 0.55 -0.07 -0.85 1.57 1.57 -1.29 -2.08 116.57 115.97 3hk7 h LYS 205 Ca 0.09 0.00 0.13 0.00 -1.87 0.00 0.00 60.65 59.01 3hk7 h LYS 205 Cb 0.67 0.02 -0.09 0.00 0.08 0.00 0.00 32.23 32.91 3hk7 h LYS 205 CO 0.05 -0.05 0.45 -0.09 -0.57 0.00 0.00 179.45 179.24 3hk7 h ARG 206 N -0.08 0.65 0.07 3.15 2.43 -0.96 0.26 114.38 119.90 3hk7 h ARG 206 Ca 0.02 -0.04 0.02 0.00 -0.81 0.00 0.00 59.98 59.17 3hk7 h ARG 206 Cb 0.10 -0.15 -0.03 0.00 -0.42 0.00 0.00 29.97 29.48 3hk7 h ARG 206 CO -0.05 0.43 -0.20 0.35 -1.51 0.00 0.00 179.97 178.99 3hk7 h PHE 207 N 0.67 -0.52 -0.12 2.20 3.57 -0.78 0.37 116.94 122.33 3hk7 h PHE 207 Ca 0.45 0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.98 3hk7 h PHE 207 Cb 0.59 0.22 -0.02 0.00 2.79 0.00 0.00 35.95 39.53 3hk7 h PHE 207 CO -0.08 -0.28 0.02 -0.07 -2.23 0.00 0.00 178.31 175.66 3hk7 h LEU 208 N -0.35 -0.01 -1.38 0.59 3.38 -0.56 -2.15 115.31 114.82 3hk7 h LEU 208 Ca 0.04 0.02 0.05 0.00 0.09 0.00 0.00 57.88 58.08 3hk7 h LEU 208 Cb 0.39 0.03 -0.04 0.00 0.09 0.00 0.00 40.66 41.13 3hk7 h LEU 208 CO -0.13 0.02 0.46 0.74 0.09 0.00 0.00 178.44 179.61 3hk7 h THR 209 N 0.06 1.05 -0.26 0.22 2.02 -0.15 0.50 112.91 116.35 3hk7 h THR 209 Ca 0.05 -0.27 -0.04 0.00 0.77 0.00 0.00 66.41 66.93 3hk7 h THR 209 Cb 0.05 0.21 -0.01 0.00 -1.74 0.00 0.00 68.15 66.66 3hk7 h THR 209 CO -0.08 0.14 0.01 0.44 0.37 0.00 0.00 175.52 176.41 3hk7 h ASP 210 N 0.78 0.45 1.18 4.18 3.32 0.21 -2.27 116.42 124.27 3hk7 h ASP 210 Ca 0.29 -0.30 -0.06 0.00 0.02 0.00 0.00 57.03 56.98 3hk7 h ASP 210 Cb 0.17 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 39.59 3hk7 h ASP 210 CO -0.09 0.63 -0.31 -0.50 -1.72 0.00 0.00 179.24 177.25 3hk7 h TRP 211 N 0.25 0.00 -0.26 4.55 4.06 -0.87 -1.15 115.95 122.54 3hk7 h TRP 211 Ca 0.08 0.00 -0.17 0.00 2.06 0.00 0.00 58.89 60.85 3hk7 h TRP 211 Cb 0.39 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 28.55 3hk7 h TRP 211 CO 0.03 0.31 -0.53 0.82 -3.56 0.00 0.00 178.44 175.51 3hk7 h ILE 212 N 0.00 1.29 -0.01 1.49 2.04 -0.84 0.12 117.51 121.60 3hk7 h ILE 212 Ca -0.00 -1.73 -0.18 0.00 1.00 0.00 0.00 64.86 63.94 3hk7 h ILE 212 Cb 0.98 1.66 -0.01 0.00 -0.74 0.00 0.00 36.82 38.70 3hk7 h ILE 212 CO 0.04 0.56 -0.79 -0.08 0.00 0.00 0.00 178.15 177.87 3hk7 h GLU 213 N 0.58 0.14 0.07 2.37 4.81 -1.25 0.24 114.58 121.55 3hk7 h GLU 213 Ca 0.02 -0.14 -0.26 0.00 -0.13 0.00 0.00 59.36 58.85 3hk7 h GLU 213 Cb 1.11 0.04 0.01 0.00 0.63 0.00 0.00 28.75 30.53 3hk7 h GLU 213 CO 0.11 0.86 -1.11 -0.09 -0.73 0.00 0.00 179.01 178.05 3hk7 h ARG 214 N 0.09 0.38 0.00 1.92 2.43 -1.07 -3.37 114.38 114.76 3hk7 h ARG 214 Ca -0.03 -0.51 -0.26 0.00 -0.81 0.00 0.00 59.98 58.37 3hk7 h ARG 214 Cb 1.39 0.17 -0.05 0.00 -0.42 0.00 0.00 29.97 31.06 3hk7 h ARG 214 CO 0.12 1.19 -2.21 -1.33 -1.51 0.00 0.00 179.97 176.23 3hk7 n MET 215 N -3.66 0.83 -3.53 0.20 2.81 0.41 -5.01 117.12 109.16 3hk7 n MET 215 Ca -0.08 -0.05 -0.19 0.00 -1.81 0.00 0.00 57.70 55.56 3hk7 n MET 215 Cb 0.94 -1.49 0.07 0.00 -0.71 0.00 0.00 33.22 32.02 3hk7 n MET 215 CO 0.00 0.00 0.00 -3.47 1.51 0.00 0.00 175.97 174.01 3hk7 n ASP 216 N -2.58 -1.94 -4.75 7.83 4.64 0.85 -4.63 116.55 115.97 3hk7 n ASP 216 Ca -0.24 -0.71 -0.37 0.00 -1.38 0.00 0.00 54.79 52.09 3hk7 n ASP 216 Cb 0.97 -4.67 0.04 0.00 -1.04 0.00 0.00 41.12 36.42 3hk7 n ASP 216 CO 0.00 0.00 0.00 -2.16 -0.82 0.00 0.00 177.20 174.22 3hk7 s PRO 217 N -5.57 2.92 0.41 -0.67 0.04 -1.26 -4.59 135.00 126.28 3hk7 s PRO 217 Ca 0.03 1.99 0.22 0.00 0.04 0.00 0.00 61.00 63.28 3hk7 s PRO 217 Cb -0.01 -2.00 0.37 0.00 0.04 0.00 0.00 34.50 32.90 3hk7 s PRO 217 CO 0.77 -1.29 1.61 -0.39 0.04 0.00 0.00 177.00 177.73 3hk7 h VAL 218 N 0.96 0.26 -1.81 -0.36 -1.51 -0.12 -3.47 116.25 110.20 3hk7 h VAL 218 Ca -0.51 -1.30 0.18 0.00 -1.23 0.00 0.00 66.70 63.85 3hk7 h VAL 218 Cb 1.31 2.06 -0.18 0.00 -2.13 0.00 0.00 31.29 32.35 3hk7 h VAL 218 CO 0.55 0.14 0.66 -0.72 -1.23 0.00 0.00 177.57 176.98 3hk7 s TYR 219 N -3.20 -0.23 -0.05 5.19 -0.85 -1.26 -4.26 117.35 112.68 3hk7 s TYR 219 Ca 0.05 0.17 -0.06 0.00 -0.52 0.00 0.00 57.07 56.72 3hk7 s TYR 219 Cb 0.06 0.52 -0.04 0.00 0.38 0.00 0.00 41.96 42.88 3hk7 s TYR 219 CO 0.68 -0.35 0.20 -1.64 -1.52 0.00 0.00 175.55 172.91 3hk7 s MET 220 N -2.59 3.50 0.12 -3.49 -1.94 -0.75 -1.88 119.30 112.27 3hk7 s MET 220 Ca 0.07 -0.14 0.01 0.00 -1.71 0.00 0.00 55.69 53.92 3hk7 s MET 220 Cb -0.01 -3.14 -0.04 0.00 2.01 0.00 0.00 34.83 33.65 3hk7 s MET 220 CO -0.06 0.71 -0.03 0.00 -0.01 0.00 0.00 175.02 175.63 3hk7 s ALA 221 N -1.18 1.04 -0.27 3.03 0.00 -0.59 0.28 121.76 124.06 3hk7 s ALA 221 Ca 0.22 -1.42 -0.24 0.00 0.00 0.00 0.00 51.96 50.52 3hk7 s ALA 221 Cb -0.13 0.33 0.08 0.00 0.00 0.00 0.00 23.12 23.41 3hk7 s ALA 221 CO 0.12 -0.29 0.78 0.54 0.00 0.00 0.00 175.76 176.91 3hk7 s VAL 222 N -3.69 0.00 -0.09 0.00 0.11 -0.52 -1.00 120.40 115.22 3hk7 s VAL 222 Ca 0.16 0.00 -0.12 0.00 -2.93 0.00 0.00 61.98 59.08 3hk7 s VAL 222 Cb 0.06 -1.00 -0.05 0.00 -1.53 0.00 0.00 36.38 33.86 3hk7 s VAL 222 CO -0.02 0.00 0.30 -0.94 -3.33 0.00 0.00 175.10 171.11 3hk7 s SER 223 N 0.54 6.57 0.18 3.54 1.04 -1.26 -1.04 113.70 123.27 3hk7 s SER 223 Ca -0.01 0.68 0.10 0.00 0.48 0.00 0.00 55.95 57.20 3hk7 s SER 223 Cb -0.05 -2.18 -0.04 0.00 0.10 0.00 0.00 66.02 63.85 3hk7 s SER 223 CO -0.03 0.27 -0.20 -0.76 0.98 0.00 0.00 173.24 173.49 3hk7 s LEU 224 N -0.52 2.44 0.75 2.42 1.43 0.75 -4.92 118.68 121.03 3hk7 s LEU 224 Ca 0.19 -0.87 -0.11 0.00 -1.03 0.00 0.00 54.13 52.31 3hk7 s LEU 224 Cb -0.14 -0.96 0.04 0.00 0.03 0.00 0.00 46.19 45.15 3hk7 s LEU 224 CO 0.08 0.03 1.09 -2.16 0.23 0.00 0.00 176.35 175.61 3hk7 s PRO 225 N -2.77 2.51 0.56 1.29 0.04 -1.25 -0.66 135.00 134.72 3hk7 s PRO 225 Ca 0.18 0.60 0.24 0.00 0.04 0.00 0.00 61.00 62.06 3hk7 s PRO 225 Cb -0.07 -1.97 1.51 0.00 0.04 0.00 0.00 34.50 34.01 3hk7 s PRO 225 CO 0.08 -1.31 2.12 -1.35 0.04 0.00 0.00 177.00 176.58 3hk7 h PRO 226 N -0.86 0.00 -0.02 0.56 0.11 -1.76 -1.30 132.00 128.73 3hk7 h PRO 226 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 3hk7 h PRO 226 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 3hk7 h PRO 226 CO 0.61 0.00 0.00 0.25 -0.21 0.00 0.00 178.00 178.65 3hk7 n THR 227 N -4.16 0.02 -1.61 -1.15 -2.24 -1.26 -4.08 114.28 99.79 3hk7 n THR 227 Ca 0.01 -0.08 -0.46 0.00 -2.27 0.00 0.00 64.05 61.25 3hk7 n THR 227 Cb 0.26 -0.19 -0.03 0.00 -2.10 0.00 0.00 70.33 68.28 3hk7 n THR 227 CO 0.00 0.00 0.00 0.33 -0.57 0.00 0.00 175.07 174.83 3hk7 n PHE 228 N -0.62 1.60 -3.71 4.78 7.35 -0.49 -5.00 117.46 121.38 3hk7 n PHE 228 Ca 0.20 0.60 -0.12 0.00 -0.76 0.00 0.00 57.45 57.38 3hk7 n PHE 228 Cb 0.16 -2.34 -0.06 0.00 0.35 0.00 0.00 39.48 37.60 3hk7 n PHE 228 CO 0.00 0.00 0.00 -1.54 -0.76 0.00 0.00 176.76 174.46 3hk7 s SER 229 N -0.03 -0.19 -0.27 -2.13 1.04 -1.26 -4.67 113.70 106.19 3hk7 s SER 229 Ca 0.68 -0.18 -0.23 0.00 0.48 0.00 0.00 55.95 56.70 3hk7 s SER 229 Cb -0.75 0.40 0.08 0.00 0.10 0.00 0.00 66.02 65.86 3hk7 s SER 229 CO 0.53 -0.69 0.78 0.12 0.98 0.00 0.00 173.24 174.97 3hk7 s PHE 230 N -2.86 -0.78 1.11 5.02 2.19 -1.26 -4.49 117.98 116.92 3hk7 s PHE 230 Ca -0.03 1.80 -0.13 0.00 0.33 0.00 0.00 56.93 58.91 3hk7 s PHE 230 Cb 0.00 0.36 0.26 0.00 -1.31 0.00 0.00 43.02 42.33 3hk7 s PHE 230 CO -0.05 -0.38 1.05 -2.14 1.83 0.00 0.00 175.22 175.53 3hk7 s PRO 231 N 0.64 -0.52 -0.29 10.12 0.02 -1.26 -4.13 135.00 139.58 3hk7 s PRO 231 Ca -0.02 0.80 -0.16 0.00 0.02 0.00 0.00 61.00 61.65 3hk7 s PRO 231 Cb -0.05 -1.60 0.15 0.00 0.02 0.00 0.00 34.50 33.01 3hk7 s PRO 231 CO -0.05 -3.45 0.98 -2.00 -0.33 0.00 0.00 177.00 172.15 3hk7 s GLU 232 N -4.59 0.37 -1.29 5.54 2.12 -1.26 -5.06 118.70 114.53 3hk7 s GLU 232 Ca 0.68 0.65 -0.16 0.00 0.36 0.00 0.00 54.97 56.50 3hk7 s GLU 232 Cb -0.23 0.07 0.11 0.00 0.26 0.00 0.00 34.13 34.34 3hk7 s GLU 232 CO 0.63 -0.08 1.71 0.39 -0.54 0.00 0.00 175.26 177.37 3hk7 n GLU 233 N 3.69 3.25 -4.18 4.30 -0.58 -1.26 -3.85 120.64 122.01 3hk7 n GLU 233 Ca -0.19 -3.40 -0.13 0.00 -0.42 0.00 0.00 57.16 53.03 3hk7 n GLU 233 Cb 0.58 -3.29 -0.09 0.00 -0.57 0.00 0.00 31.44 28.07 3hk7 n GLU 233 CO 0.00 0.00 0.00 -1.54 -0.48 0.00 0.00 177.13 175.11 3hk7 s SER 234 N 3.43 0.32 0.16 1.62 1.04 -1.26 -5.01 113.70 114.00 3hk7 s SER 234 Ca 0.49 -1.37 -0.14 0.00 0.48 0.00 0.00 55.95 55.41 3hk7 s SER 234 Cb 0.03 0.44 0.05 0.00 0.10 0.00 0.00 66.02 66.64 3hk7 s SER 234 CO 0.03 -0.92 1.75 0.78 0.98 0.00 0.00 173.24 175.85 3hk7 h ASN 235 N 2.50 0.68 0.04 7.02 2.35 -1.91 0.63 115.58 126.88 3hk7 h ASN 235 Ca -0.33 -0.12 0.01 0.00 -0.55 0.00 0.00 56.30 55.30 3hk7 h ASN 235 Cb 1.25 -0.17 -0.01 0.00 0.05 0.00 0.00 38.32 39.44 3hk7 h ASN 235 CO 0.48 0.61 -0.06 -0.09 -1.65 0.00 0.00 177.43 176.72 3hk7 h ARG 236 N 0.69 -0.12 -0.31 0.81 2.43 -1.90 0.25 114.38 116.23 3hk7 h ARG 236 Ca 0.18 0.01 0.01 0.00 -0.81 0.00 0.00 59.98 59.37 3hk7 h ARG 236 Cb 0.11 0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 29.67 3hk7 h ARG 236 CO -0.02 -0.08 0.18 0.78 -1.51 0.00 0.00 179.97 179.32 3hk7 h GLY 237 N -0.13 0.42 1.34 2.80 0.00 -1.64 -0.98 103.07 104.88 3hk7 h GLY 237 Ca 0.01 -0.14 -0.11 0.00 0.00 0.00 0.00 47.33 47.09 3hk7 h GLY 237 CO -0.03 0.12 -0.21 3.21 0.00 0.00 0.00 176.54 179.63 3hk7 h ARG 238 N 0.37 0.76 -0.44 4.80 3.08 -0.68 -1.44 114.38 120.83 3hk7 h ARG 238 Ca 0.12 -0.30 -0.10 0.00 0.07 0.00 0.00 59.98 59.76 3hk7 h ARG 238 Cb -0.01 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 29.99 3hk7 h ARG 238 CO -0.05 0.91 -0.13 0.82 -1.07 0.00 0.00 179.97 180.45 3hk7 h ILE 239 N 0.67 1.27 -0.33 2.04 2.04 -0.29 0.24 117.51 123.16 3hk7 h ILE 239 Ca 0.09 -1.25 -0.06 0.00 1.00 0.00 0.00 64.86 64.65 3hk7 h ILE 239 Cb 0.72 1.17 -0.01 0.00 -0.74 0.00 0.00 36.82 37.96 3hk7 h ILE 239 CO 0.06 0.42 -0.02 0.40 0.00 0.00 0.00 178.15 179.01 3hk7 h ILE 240 N 0.69 1.26 -0.31 -0.67 2.04 -1.12 0.12 117.51 119.52 3hk7 h ILE 240 Ca 0.11 -1.01 -0.12 0.00 1.00 0.00 0.00 64.86 64.84 3hk7 h ILE 240 Cb 0.67 1.27 -0.01 0.00 -0.74 0.00 0.00 36.82 38.02 3hk7 h ILE 240 CO 0.05 0.33 -0.29 -0.09 0.00 0.00 0.00 178.15 178.15 3hk7 h ARG 241 N 0.38 0.74 0.00 2.37 2.43 -1.21 -1.69 114.38 117.40 3hk7 h ARG 241 Ca 0.09 -0.38 -0.09 0.00 -0.81 0.00 0.00 59.98 58.78 3hk7 h ARG 241 Cb 0.48 0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 30.02 3hk7 h ARG 241 CO 0.02 1.00 -1.74 -0.25 -1.51 0.00 0.00 179.97 177.49 3hk7 n ASP 242 N -4.24 0.35 0.00 -3.80 8.00 0.07 -4.61 116.55 112.31 3hk7 n ASP 242 Ca -0.03 0.14 -0.00 0.00 0.71 0.00 0.00 54.79 55.61 3hk7 n ASP 242 Cb 0.47 1.15 -0.00 0.00 -0.02 0.00 0.00 41.12 42.73 3hk7 n ASP 242 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3hk7 h LEU 244 N -0.02 -0.61 -0.31 0.00 7.12 -1.29 -1.90 115.31 118.30 3hk7 h LEU 244 Ca 0.00 0.08 0.07 0.00 0.13 0.00 0.00 57.88 58.16 3hk7 h LEU 244 Cb 0.02 0.24 -0.07 0.00 -0.53 0.00 0.00 40.66 40.31 3hk7 h LEU 244 CO 0.00 -0.15 -0.19 -0.07 -0.13 0.00 0.00 178.44 177.89 3hk7 h LEU 245 N -0.17 -0.64 -0.53 2.25 3.38 -1.56 0.28 115.31 118.32 3hk7 h LEU 245 Ca 0.02 0.14 0.04 0.00 0.09 0.00 0.00 57.88 58.16 3hk7 h LEU 245 Cb 0.22 0.33 -0.04 0.00 0.09 0.00 0.00 40.66 41.26 3hk7 h LEU 245 CO -0.17 -0.23 0.29 -0.65 0.09 0.00 0.00 178.44 177.78 3hk7 h PRO 246 N -0.16 0.56 -0.51 1.13 0.11 -1.79 0.37 132.00 131.72 3hk7 h PRO 246 Ca 0.16 -0.03 -0.03 0.00 0.11 0.00 0.00 66.00 66.21 3hk7 h PRO 246 Cb 0.40 -0.13 -0.02 0.00 0.11 0.00 0.00 31.00 31.37 3hk7 h PRO 246 CO -0.41 0.37 0.19 0.28 -0.21 0.00 0.00 178.00 178.22 3hk7 h VAL 247 N 0.58 1.22 -0.82 3.15 2.07 -0.80 -0.76 116.25 120.89 3hk7 h VAL 247 Ca 0.22 -0.70 -0.01 0.00 0.82 0.00 0.00 66.70 67.04 3hk7 h VAL 247 Cb 0.08 0.72 -0.04 0.00 -1.52 0.00 0.00 31.29 30.54 3hk7 h VAL 247 CO -0.13 0.26 0.49 0.00 0.02 0.00 0.00 177.57 178.21 3hk7 h ALA 248 N 1.04 1.32 -0.34 1.67 0.00 0.03 -1.79 119.26 121.18 3hk7 h ALA 248 Ca 0.17 -0.09 -0.15 0.00 0.00 0.00 0.00 54.91 54.83 3hk7 h ALA 248 Cb 0.22 -0.33 -0.00 0.00 0.00 0.00 0.00 17.79 17.68 3hk7 h ALA 248 CO -0.01 0.58 -0.37 1.49 0.00 0.00 0.00 179.25 180.94 3hk7 h GLU 249 N 1.13 0.86 -0.62 0.00 4.81 -0.57 0.10 114.58 120.29 3hk7 h GLU 249 Ca 0.29 -0.46 0.01 0.00 -0.13 0.00 0.00 59.36 59.07 3hk7 h GLU 249 Cb -0.04 0.02 -0.03 0.00 0.63 0.00 0.00 28.75 29.33 3hk7 h GLU 249 CO -0.05 1.11 0.41 -0.22 -0.73 0.00 0.00 179.01 179.52 3hk7 h LYS 250 N 0.65 0.80 -0.30 1.92 3.64 -0.72 -2.42 116.57 120.14 3hk7 h LYS 250 Ca 0.05 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 3hk7 h LYS 250 Cb 0.96 -0.18 0.00 0.00 -0.41 0.00 0.00 32.23 32.60 3hk7 h LYS 250 CO 0.09 0.53 0.00 0.72 -2.27 0.00 0.00 179.45 178.52 3hk7 n HIS 251 N -4.67 0.39 -3.98 1.91 8.25 -0.71 -4.94 115.22 111.47 3hk7 n HIS 251 Ca 0.05 -0.20 -0.29 0.00 -0.26 0.00 0.00 57.72 57.02 3hk7 n HIS 251 Cb 0.04 0.00 -0.00 0.00 1.12 0.00 0.00 29.99 31.15 3hk7 n HIS 251 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 3hk7 n ASN 252 N 0.84 -2.68 -4.54 0.41 4.05 -0.05 -4.95 115.26 108.33 3hk7 n ASN 252 Ca 0.17 -0.91 -0.34 0.00 0.45 0.00 0.00 54.58 53.95 3hk7 n ASN 252 Cb 0.44 -3.37 -0.11 0.00 1.23 0.00 0.00 39.78 37.97 3hk7 n ASN 252 CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 177.26 173.58 3hk7 s ILE 253 N -3.52 4.15 0.54 -1.44 -1.09 0.15 -4.81 121.20 115.19 3hk7 s ILE 253 Ca 0.42 -0.27 -0.20 0.00 -2.23 0.00 0.00 60.65 58.37 3hk7 s ILE 253 Cb -0.22 -2.83 -0.05 0.00 -1.58 0.00 0.00 42.46 37.78 3hk7 s ILE 253 CO 0.87 0.49 1.20 -2.84 -1.23 0.00 0.00 174.94 173.43 3hk7 s PRO 254 N 0.31 3.28 -0.28 2.79 0.02 -1.26 -4.63 135.00 135.24 3hk7 s PRO 254 Ca -0.02 1.82 -0.08 0.00 0.02 0.00 0.00 61.00 62.74 3hk7 s PRO 254 Cb -0.14 -2.11 -0.01 0.00 0.02 0.00 0.00 34.50 32.26 3hk7 s PRO 254 CO 0.02 -0.95 0.09 0.12 -0.33 0.00 0.00 177.00 175.95 3hk7 s PHE 255 N -1.58 3.12 -0.21 6.54 5.36 -0.25 -1.81 117.98 129.14 3hk7 s PHE 255 Ca 0.72 -0.62 -0.12 0.00 -0.96 0.00 0.00 56.93 55.96 3hk7 s PHE 255 Cb -0.30 -2.27 -0.05 0.00 -0.34 0.00 0.00 43.02 40.07 3hk7 s PHE 255 CO 0.34 -0.44 0.22 0.00 -1.46 0.00 0.00 175.22 173.88 3hk7 s ALA 256 N 1.58 3.61 -0.15 11.12 0.00 0.14 -1.13 121.76 136.94 3hk7 s ALA 256 Ca 0.05 -0.71 0.02 0.00 0.00 0.00 0.00 51.96 51.31 3hk7 s ALA 256 Cb -0.16 -2.37 0.01 0.00 0.00 0.00 0.00 23.12 20.60 3hk7 s ALA 256 CO 0.04 -0.11 -0.20 -1.64 0.00 0.00 0.00 175.76 173.85 3hk7 s MET 257 N 0.90 2.88 -0.47 0.00 1.00 0.36 -1.45 119.30 122.52 3hk7 s MET 257 Ca 0.11 -0.79 -0.04 0.00 0.00 0.00 0.00 55.69 54.97 3hk7 s MET 257 Cb -0.13 -2.40 0.12 0.00 0.00 0.00 0.00 34.83 32.42 3hk7 s MET 257 CO 0.04 -0.11 0.29 -1.64 0.00 0.00 0.00 175.02 173.60 3hk7 s MET 258 N 1.06 2.24 -0.09 2.03 -1.94 -0.21 -2.17 119.30 120.22 3hk7 s MET 258 Ca -0.02 -1.97 -0.09 0.00 -1.71 0.00 0.00 55.69 51.90 3hk7 s MET 258 Cb -0.14 -3.69 -0.04 0.00 2.01 0.00 0.00 34.83 32.96 3hk7 s MET 258 CO -0.07 -1.12 0.22 0.42 -0.01 0.00 0.00 175.02 174.46 3hk7 s ILE 259 N 0.91 5.37 0.00 2.53 1.01 -0.57 -0.18 121.20 130.27 3hk7 s ILE 259 Ca 0.10 0.40 0.00 0.00 0.00 0.00 0.00 60.65 61.14 3hk7 s ILE 259 Cb -0.23 -3.49 0.00 0.00 0.01 0.00 0.00 42.46 38.75 3hk7 s ILE 259 CO -0.03 0.61 0.00 0.61 0.00 0.00 0.00 174.94 176.12 3hk7 n GLY 260 N 1.95 1.02 3.67 6.18 0.00 0.17 -0.30 105.19 117.87 3hk7 n GLY 260 Ca -0.18 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.44 3hk7 n GLY 260 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hk7 s VAL 261 N -1.85 5.05 -0.48 1.61 0.11 -0.90 -1.86 120.40 122.07 3hk7 s VAL 261 Ca 0.00 1.15 -0.16 0.00 -2.93 0.00 0.00 61.98 60.04 3hk7 s VAL 261 Cb 0.00 -3.93 0.08 0.00 -1.53 0.00 0.00 36.38 31.00 3hk7 s VAL 261 CO 0.00 0.15 0.43 -0.75 -3.33 0.00 0.00 175.10 171.60 3hk7 s LYS 262 N 1.66 2.99 0.34 1.54 2.20 -0.01 -3.84 119.74 124.63 3hk7 s LYS 262 Ca 0.29 -1.35 -0.28 0.00 -0.36 0.00 0.00 55.97 54.27 3hk7 s LYS 262 Cb -0.16 -4.15 -0.10 0.00 -1.51 0.00 0.00 37.83 31.91 3hk7 s LYS 262 CO 0.11 -1.09 1.24 0.15 -0.36 0.00 0.00 175.35 175.40 3hk7 s LYS 263 N 1.74 4.32 -1.34 4.03 -0.14 -1.26 -0.62 119.74 126.46 3hk7 s LYS 263 Ca 0.05 2.07 -0.01 0.00 -1.36 0.00 0.00 55.97 56.72 3hk7 s LYS 263 Cb -0.24 -2.99 0.00 0.00 -1.68 0.00 0.00 37.83 32.92 3hk7 s LYS 263 CO 0.07 -0.17 0.64 0.54 -0.76 0.00 0.00 175.35 175.67 3hk7 n ARG 264 N 0.68 -4.54 0.24 1.68 1.74 -1.21 -4.89 116.66 110.36 3hk7 n ARG 264 Ca 0.01 0.57 0.13 0.00 -0.77 0.00 0.00 57.85 57.79 3hk7 n ARG 264 Cb 0.43 -5.03 0.45 0.00 -1.02 0.00 0.00 32.46 27.29 3hk7 n ARG 264 CO 0.00 0.00 0.00 -0.39 -1.52 0.00 0.00 177.63 175.72 3hk7 h VAL 265 N -1.87 0.19 -2.37 1.55 -1.51 -1.21 -3.32 116.25 107.72 3hk7 h VAL 265 Ca -0.61 -0.90 -0.59 0.00 -1.23 0.00 0.00 66.70 63.37 3hk7 h VAL 265 Cb 1.36 1.77 -0.39 0.00 -2.13 0.00 0.00 31.29 31.90 3hk7 h VAL 265 CO 0.58 0.08 -0.94 1.57 -1.23 0.00 0.00 177.57 177.63 3hk7 n HIS 266 N -3.17 -0.17 -0.34 5.19 -0.00 -1.06 -5.02 115.22 110.65 3hk7 n HIS 266 Ca 0.02 -3.50 0.18 0.00 -0.00 0.00 0.00 57.72 54.42 3hk7 n HIS 266 Cb 0.43 0.01 0.36 0.00 -0.00 0.00 0.00 29.99 30.78 3hk7 n HIS 266 CO 0.00 0.00 0.00 -1.35 -0.00 0.00 0.00 176.34 174.99 3hk7 h PRO 267 N 5.22 0.02 -0.45 1.57 0.11 -1.83 -1.39 132.00 135.26 3hk7 h PRO 267 Ca 0.21 -0.00 0.08 0.00 0.11 0.00 0.00 66.00 66.41 3hk7 h PRO 267 Cb 0.88 -0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.96 3hk7 h PRO 267 CO 0.45 0.01 0.31 0.00 -0.21 0.00 0.00 178.00 178.55 3hk7 h ALA 268 N 1.98 2.10 0.00 -0.75 0.00 -1.95 -1.62 119.26 119.03 3hk7 h ALA 268 Ca 0.65 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.55 3hk7 h ALA 268 Cb 1.45 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.20 3hk7 h ALA 268 CO -0.88 -0.20 0.00 1.28 0.00 0.00 0.00 179.25 179.45 3hk7 n LEU 269 N -4.46 0.00 0.00 0.00 4.77 -0.52 -4.97 117.00 111.82 3hk7 n LEU 269 Ca 0.07 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.05 3hk7 n LEU 269 Cb 0.34 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.43 3hk7 n LEU 269 CO 0.35 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.02 3hk7 n GLY 270 N 0.77 3.45 0.22 -0.72 0.00 -0.61 -0.84 105.19 107.45 3hk7 n GLY 270 Ca 0.18 0.24 0.15 0.00 0.00 0.00 0.00 46.02 46.60 3hk7 n GLY 270 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3hk7 h ASP 271 N 0.00 0.00 -0.57 1.61 3.32 -1.93 -2.24 116.42 116.62 3hk7 h ASP 271 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3hk7 h ASP 271 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 3hk7 h ASP 271 CO 0.00 0.00 0.00 0.00 -1.72 0.00 0.00 179.24 177.52 3hk7 n ALA 272 N -1.94 3.07 -1.21 3.45 0.00 -0.02 -4.38 120.51 119.48 3hk7 n ALA 272 Ca 0.00 -1.39 -0.01 0.00 0.00 0.00 0.00 53.44 52.04 3hk7 n ALA 272 Cb 0.22 -1.03 0.24 0.00 0.00 0.00 0.00 19.45 18.87 3hk7 n ALA 272 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hk7 n GLY 273 N 1.01 4.38 3.88 0.00 0.00 -0.84 -4.84 105.19 108.78 3hk7 n GLY 273 Ca 0.23 -1.12 -0.35 0.00 0.00 0.00 0.00 46.02 44.78 3hk7 n GLY 273 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3hk7 s ASP 274 N -2.01 6.49 0.26 1.61 1.01 -1.26 -0.92 116.67 121.86 3hk7 s ASP 274 Ca 0.46 0.56 0.01 0.00 0.71 0.00 0.00 52.55 54.30 3hk7 s ASP 274 Cb 0.39 -2.09 0.01 0.00 1.01 0.00 0.00 42.92 42.25 3hk7 s ASP 274 CO 0.06 0.28 0.11 0.33 0.21 0.00 0.00 175.17 176.16 3hk7 n PHE 275 N 1.27 -0.32 -4.19 4.23 7.35 0.21 -4.93 117.46 121.07 3hk7 n PHE 275 Ca -0.13 -1.19 -0.14 0.00 -0.76 0.00 0.00 57.45 55.24 3hk7 n PHE 275 Cb 0.53 -0.20 -0.10 0.00 0.35 0.00 0.00 39.48 40.06 3hk7 n PHE 275 CO 0.00 0.00 0.00 0.54 -0.76 0.00 0.00 176.76 176.54 3hk7 s VAL 276 N -1.59 0.95 -0.13 -2.13 0.11 -1.26 -0.83 120.40 115.52 3hk7 s VAL 276 Ca 0.08 -1.79 -0.27 0.00 -2.93 0.00 0.00 61.98 57.08 3hk7 s VAL 276 Cb -0.01 -1.53 0.06 0.00 -1.53 0.00 0.00 36.38 33.38 3hk7 s VAL 276 CO 0.05 -0.66 0.65 -0.83 -3.33 0.00 0.00 175.10 170.98 3hk7 s GLY 277 N -2.72 -0.51 0.28 6.54 0.00 -0.78 -4.85 107.32 105.28 3hk7 s GLY 277 Ca 0.09 1.46 -0.29 0.00 0.00 0.00 0.00 44.72 45.98 3hk7 s GLY 277 CO -0.01 1.16 1.20 1.25 0.00 0.00 0.00 173.10 176.70 3hk7 s LYS 278 N -0.59 4.50 0.39 2.90 2.20 -1.26 -4.53 119.74 123.36 3hk7 s LYS 278 Ca -0.07 1.98 0.08 0.00 -0.36 0.00 0.00 55.97 57.60 3hk7 s LYS 278 Cb -0.02 -3.15 -0.03 0.00 -1.51 0.00 0.00 37.83 33.12 3hk7 s LYS 278 CO 0.06 0.00 0.30 0.00 -0.36 0.00 0.00 175.35 175.35 3hk7 s ALA 279 N -0.96 3.86 0.18 3.13 0.00 -1.26 -4.78 121.76 121.93 3hk7 s ALA 279 Ca 0.48 -1.86 -0.16 0.00 0.00 0.00 0.00 51.96 50.42 3hk7 s ALA 279 Cb -0.35 -0.91 -0.07 0.00 0.00 0.00 0.00 23.12 21.78 3hk7 s ALA 279 CO 0.45 -0.13 0.60 0.45 0.00 0.00 0.00 175.76 177.13 3hk7 s SER 280 N -4.03 6.88 0.00 0.00 0.15 -1.26 -4.98 113.70 110.47 3hk7 s SER 280 Ca 0.44 1.17 0.28 0.00 0.70 0.00 0.00 55.95 58.54 3hk7 s SER 280 Cb -0.03 -2.32 1.03 0.00 -1.71 0.00 0.00 66.02 62.99 3hk7 s SER 280 CO 0.26 0.06 1.73 0.23 1.20 0.00 0.00 173.24 176.73 3hk7 n MET 281 N 0.70 1.05 -0.14 5.44 2.81 -1.26 -4.35 117.12 121.37 3hk7 n MET 281 Ca -0.04 -0.54 -0.04 0.00 -1.81 0.00 0.00 57.70 55.27 3hk7 n MET 281 Cb 0.52 -1.49 0.04 0.00 -0.71 0.00 0.00 33.22 31.58 3hk7 n MET 281 CO 0.00 0.00 0.00 -0.44 1.51 0.00 0.00 175.97 177.04 3hk7 h ASP 282 N 1.31 0.15 -0.71 7.83 3.32 -1.94 0.24 116.42 126.62 3hk7 h ASP 282 Ca 0.00 0.05 -0.03 0.00 0.02 0.00 0.00 57.03 57.07 3hk7 h ASP 282 Cb 0.43 0.04 -0.03 0.00 0.22 0.00 0.00 39.33 39.99 3hk7 h ASP 282 CO 0.00 0.12 0.31 1.23 -1.72 0.00 0.00 179.24 179.18 3hk7 h GLY 283 N 0.31 1.13 0.74 2.75 0.00 -1.76 0.67 103.07 106.91 3hk7 h GLY 283 Ca 0.21 -0.59 -0.03 0.00 0.00 0.00 0.00 47.33 46.91 3hk7 h GLY 283 CO -0.22 0.56 -0.04 -2.08 0.00 0.00 0.00 176.54 174.77 3hk7 h VAL 284 N 1.01 1.29 -0.19 4.60 2.07 -1.74 -1.26 116.25 122.03 3hk7 h VAL 284 Ca 0.24 -0.99 0.05 0.00 0.82 0.00 0.00 66.70 66.82 3hk7 h VAL 284 Cb 0.17 1.69 -0.06 0.00 -1.52 0.00 0.00 31.29 31.57 3hk7 h VAL 284 CO -0.02 0.29 -0.20 -0.08 0.02 0.00 0.00 177.57 177.58 3hk7 h GLU 285 N -0.06 -0.21 -0.09 1.57 4.81 -0.34 -0.80 114.58 119.45 3hk7 h GLU 285 Ca 0.03 0.01 0.04 0.00 -0.13 0.00 0.00 59.36 59.31 3hk7 h GLU 285 Cb 0.46 0.05 -0.04 0.00 0.63 0.00 0.00 28.75 29.85 3hk7 h GLU 285 CO 0.01 -0.14 -0.14 1.25 -0.73 0.00 0.00 179.01 179.27 3hk7 h HIS 286 N -0.22 -0.35 -0.31 0.92 2.76 -0.80 -1.04 115.15 116.11 3hk7 h HIS 286 Ca 0.12 0.02 0.05 0.00 -2.20 0.00 0.00 60.37 58.36 3hk7 h HIS 286 Cb 0.40 0.17 -0.04 0.00 1.55 0.00 0.00 27.41 29.49 3hk7 h HIS 286 CO -0.34 -0.20 0.04 -0.07 -1.30 0.00 0.00 177.93 176.06 3hk7 h LEU 287 N -0.19 -0.04 -0.52 0.26 3.38 -0.74 0.25 115.31 117.71 3hk7 h LEU 287 Ca 0.08 0.06 -0.03 0.00 0.09 0.00 0.00 57.88 58.08 3hk7 h LEU 287 Cb 0.30 0.09 -0.02 0.00 0.09 0.00 0.00 40.66 41.11 3hk7 h LEU 287 CO -0.20 0.02 0.21 -0.07 0.09 0.00 0.00 178.44 178.49 3hk7 h LEU 288 N 0.14 0.72 -0.07 1.67 3.38 -0.92 -1.39 115.31 118.83 3hk7 h LEU 288 Ca 0.15 -0.16 -0.10 0.00 0.09 0.00 0.00 57.88 57.86 3hk7 h LEU 288 Cb 0.18 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 40.75 3hk7 h LEU 288 CO -0.22 0.69 -0.34 -0.09 0.09 0.00 0.00 178.44 178.57 3hk7 h ARG 289 N 0.71 0.36 0.00 1.13 2.43 -0.93 -3.33 114.38 114.75 3hk7 h ARG 289 Ca 0.18 -0.29 -0.06 0.00 -0.81 0.00 0.00 59.98 59.00 3hk7 h ARG 289 Cb 0.19 0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 29.79 3hk7 h ARG 289 CO -0.02 0.93 -0.27 0.93 -1.51 0.00 0.00 179.97 180.03 3hk7 h GLU 290 N -0.13 0.00 -2.25 0.20 4.39 -0.52 -3.34 114.58 112.93 3hk7 h GLU 290 Ca -0.02 0.00 -0.59 0.00 0.34 0.00 0.00 59.36 59.09 3hk7 h GLU 290 Cb 0.99 0.00 -0.42 0.00 -0.10 0.00 0.00 28.75 29.23 3hk7 h GLU 290 CO 0.07 0.27 -0.66 0.66 -1.16 0.00 0.00 179.01 178.19 3hk7 n TYR 291 N -3.33 3.72 0.32 4.33 4.01 -0.53 -4.90 117.16 120.78 3hk7 n TYR 291 Ca 0.01 -4.03 0.18 0.00 -0.16 0.00 0.00 57.90 53.91 3hk7 n TYR 291 Cb 0.51 -0.50 0.98 0.00 -0.31 0.00 0.00 39.34 40.01 3hk7 n TYR 291 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 3hk7 h PRO 292 N 3.30 0.00 -0.23 -0.72 0.13 -1.69 -0.27 132.00 132.52 3hk7 h PRO 292 Ca 0.15 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.28 3hk7 h PRO 292 Cb 0.57 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.70 3hk7 h PRO 292 CO 0.80 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.66 3hk7 n ASN 293 N -3.04 2.07 -4.63 1.44 5.03 -1.26 -4.87 115.26 110.00 3hk7 n ASN 293 Ca -0.02 -1.80 -0.31 0.00 0.87 0.00 0.00 54.58 53.33 3hk7 n ASN 293 Cb 0.26 -0.15 -0.09 0.00 -1.02 0.00 0.00 39.78 38.78 3hk7 n ASN 293 CO 0.00 0.00 0.00 0.20 -1.83 0.00 0.00 177.26 175.63 3hk7 s ASN 294 N -1.50 4.72 -0.09 6.41 -0.87 -0.12 -4.82 114.94 118.68 3hk7 s ASN 294 Ca 0.33 -0.22 -0.04 0.00 -1.57 0.00 0.00 52.86 51.35 3hk7 s ASN 294 Cb 0.18 -1.06 -0.04 0.00 -0.02 0.00 0.00 41.25 40.32 3hk7 s ASN 294 CO 0.26 0.21 0.10 -0.54 -2.57 0.00 0.00 177.10 174.56 3hk7 s LYS 295 N -1.99 3.26 -0.07 -0.60 1.02 -1.26 -4.84 119.74 115.27 3hk7 s LYS 295 Ca 0.22 -0.27 0.01 0.00 0.02 0.00 0.00 55.97 55.95 3hk7 s LYS 295 Cb -0.11 -3.03 0.02 0.00 -0.52 0.00 0.00 37.83 34.19 3hk7 s LYS 295 CO 0.13 0.73 -0.09 -0.06 -0.92 0.00 0.00 175.35 175.15 3hk7 s PHE 296 N -1.03 1.26 -0.23 3.18 0.08 -0.03 -1.09 117.98 120.12 3hk7 s PHE 296 Ca 0.16 -0.48 -0.07 0.00 0.12 0.00 0.00 56.93 56.67 3hk7 s PHE 296 Cb -0.12 -0.99 -0.03 0.00 -0.57 0.00 0.00 43.02 41.31 3hk7 s PHE 296 CO 0.06 -0.30 0.05 -0.51 -0.10 0.00 0.00 175.22 174.42 3hk7 s LEU 297 N 0.97 3.45 -0.01 -0.37 1.43 -0.28 -0.76 118.68 123.10 3hk7 s LEU 297 Ca -0.09 -0.16 0.03 0.00 -1.03 0.00 0.00 54.13 52.88 3hk7 s LEU 297 Cb -0.15 -1.90 -0.01 0.00 0.03 0.00 0.00 46.19 44.16 3hk7 s LEU 297 CO 0.00 0.03 -0.11 -0.69 0.23 0.00 0.00 176.35 175.81 3hk7 s VAL 298 N 1.25 0.84 -0.01 -1.59 1.01 -0.60 -0.49 120.40 120.81 3hk7 s VAL 298 Ca 0.04 -0.45 -0.01 0.00 0.00 0.00 0.00 61.98 61.57 3hk7 s VAL 298 Cb -0.15 -0.70 0.00 0.00 0.00 0.00 0.00 36.38 35.53 3hk7 s VAL 298 CO 0.03 0.24 0.03 0.28 0.00 0.00 0.00 175.10 175.67 3hk7 s THR 299 N -0.22 0.01 0.06 3.92 -1.32 -0.92 -1.76 115.64 115.42 3hk7 s THR 299 Ca 0.04 -0.09 0.09 0.00 -1.21 0.00 0.00 61.69 60.51 3hk7 s THR 299 Cb -0.04 -0.07 -0.03 0.00 -1.51 0.00 0.00 72.50 70.84 3hk7 s THR 299 CO -0.00 -0.05 -0.24 -0.04 -2.21 0.00 0.00 174.62 172.08 3hk7 s MET 300 N -0.14 1.49 0.23 7.08 -1.94 -1.26 -1.51 119.30 123.25 3hk7 s MET 300 Ca -0.02 -1.08 0.16 0.00 -1.71 0.00 0.00 55.69 53.04 3hk7 s MET 300 Cb -0.01 -1.71 0.02 0.00 2.01 0.00 0.00 34.83 35.14 3hk7 s MET 300 CO -0.00 0.43 1.26 1.25 -0.01 0.00 0.00 175.02 177.95 3hk7 h LEU 301 N 4.60 0.00 -9.39 -0.03 5.85 -0.97 -3.42 115.31 111.95 3hk7 h LEU 301 Ca -0.46 0.00 -0.56 0.00 0.84 0.00 0.00 57.88 57.71 3hk7 h LEU 301 Cb 1.16 0.00 -0.05 0.00 0.37 0.00 0.00 40.66 42.14 3hk7 h LEU 301 CO 0.42 0.46 0.13 -0.55 -0.34 0.00 0.00 178.44 178.57 3hk7 s SER 302 N -6.20 7.07 0.31 1.25 0.15 -1.26 -4.53 113.70 110.49 3hk7 s SER 302 Ca 0.02 1.28 0.05 0.00 0.70 0.00 0.00 55.95 58.00 3hk7 s SER 302 Cb 0.08 -2.44 0.69 0.00 -1.71 0.00 0.00 66.02 62.64 3hk7 s SER 302 CO 0.76 -0.12 1.83 -0.09 1.20 0.00 0.00 173.24 176.82 3hk7 h ARG 303 N 6.61 0.82 0.00 5.44 2.43 -1.96 -1.46 114.38 126.26 3hk7 h ARG 303 Ca -0.41 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 58.71 3hk7 h ARG 303 Cb 1.20 -0.18 0.00 0.00 -0.42 0.00 0.00 29.97 30.57 3hk7 h ARG 303 CO 0.75 0.54 0.00 0.39 -1.51 0.00 0.00 179.97 180.14 3hk7 n GLU 304 N -4.64 0.37 -0.00 0.20 4.71 -1.26 -2.39 120.64 117.63 3hk7 n GLU 304 Ca 0.20 0.07 0.08 0.00 -0.01 0.00 0.00 57.16 57.50 3hk7 n GLU 304 Cb 0.46 -1.50 -0.12 0.00 -1.01 0.00 0.00 31.44 29.27 3hk7 n GLU 304 CO 0.00 0.00 0.00 0.09 0.09 0.00 0.00 177.13 177.31 3hk7 n ASN 305 N -1.15 0.89 -0.06 1.62 5.03 -0.55 -4.71 115.26 116.33 3hk7 n ASN 305 Ca 0.10 -0.47 -0.07 0.00 0.87 0.00 0.00 54.58 55.01 3hk7 n ASN 305 Cb 0.09 1.38 -0.01 0.00 -1.02 0.00 0.00 39.78 40.22 3hk7 n ASN 305 CO 0.00 0.00 0.00 1.56 -1.83 0.00 0.00 177.26 176.99 3hk7 h GLN 306 N 0.00 -0.04 0.03 3.52 1.08 -1.50 -1.18 115.11 117.01 3hk7 h GLN 306 Ca 0.00 0.00 -0.00 0.00 -1.45 0.00 0.00 58.65 57.20 3hk7 h GLN 306 Cb 0.59 0.01 0.00 0.00 -0.05 0.00 0.00 27.48 28.03 3hk7 h GLN 306 CO 0.00 -0.03 -0.01 1.25 -0.95 0.00 0.00 178.83 179.09 3hk7 h HIS 307 N -0.04 -0.03 0.00 2.96 2.76 -1.84 -2.49 115.15 116.47 3hk7 h HIS 307 Ca 0.13 -0.00 -0.02 0.00 -2.20 0.00 0.00 60.37 58.28 3hk7 h HIS 307 Cb 0.24 0.01 -0.00 0.00 1.55 0.00 0.00 27.41 29.21 3hk7 h HIS 307 CO -0.28 0.20 -0.11 1.05 -1.30 0.00 0.00 177.93 177.49 3hk7 h GLU 308 N -0.26 0.00 -0.44 5.26 4.11 -1.84 -1.32 114.58 120.08 3hk7 h GLU 308 Ca -0.00 0.00 -0.11 0.00 0.07 0.00 0.00 59.36 59.31 3hk7 h GLU 308 Cb 0.25 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.48 3hk7 h GLU 308 CO 0.01 0.11 -0.16 1.25 0.07 0.00 0.00 179.01 180.28 3hk7 h LEU 309 N 0.00 0.90 -0.48 3.06 5.85 -0.99 -0.64 115.31 123.01 3hk7 h LEU 309 Ca -0.00 -0.38 0.01 0.00 0.84 0.00 0.00 57.88 58.34 3hk7 h LEU 309 Cb 0.28 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.04 3hk7 h LEU 309 CO 0.01 1.09 0.32 0.58 -0.34 0.00 0.00 178.44 180.09 3hk7 h VAL 310 N 0.72 1.12 -0.58 1.05 2.07 -0.81 -1.37 116.25 118.46 3hk7 h VAL 310 Ca 0.10 -0.22 -0.04 0.00 0.82 0.00 0.00 66.70 67.36 3hk7 h VAL 310 Cb 0.72 0.42 -0.03 0.00 -1.52 0.00 0.00 31.29 30.88 3hk7 h VAL 310 CO 0.05 0.12 0.20 0.58 0.02 0.00 0.00 177.57 178.54 3hk7 h VAL 311 N 0.64 1.22 -0.58 2.57 2.07 -1.21 -1.80 116.25 119.16 3hk7 h VAL 311 Ca 0.18 -0.72 -0.04 0.00 0.82 0.00 0.00 66.70 66.93 3hk7 h VAL 311 Cb -0.07 0.56 -0.03 0.00 -1.52 0.00 0.00 31.29 30.24 3hk7 h VAL 311 CO -0.04 0.28 0.19 0.25 0.02 0.00 0.00 177.57 178.26 3hk7 h LEU 312 N 0.83 0.80 -1.47 2.57 5.85 -0.44 -1.11 115.31 122.34 3hk7 h LEU 312 Ca 0.19 -0.13 -0.05 0.00 0.84 0.00 0.00 57.88 58.74 3hk7 h LEU 312 Cb 0.21 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.03 3hk7 h LEU 312 CO -0.01 0.75 -0.21 0.00 -0.34 0.00 0.00 178.44 178.63 3hk7 h ALA 313 N 1.36 1.57 0.00 1.25 0.00 -0.44 -0.79 119.26 122.20 3hk7 h ALA 313 Ca 0.19 -0.22 -0.05 0.00 0.00 0.00 0.00 54.91 54.84 3hk7 h ALA 313 Cb 0.24 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 3hk7 h ALA 313 CO -0.01 0.32 -0.22 0.00 0.00 0.00 0.00 179.25 179.35 3hk7 h ARG 314 N 0.07 0.00 0.21 0.00 3.08 -0.63 -3.17 114.38 113.93 3hk7 h ARG 314 Ca 0.01 0.00 -0.35 0.00 0.07 0.00 0.00 59.98 59.71 3hk7 h ARG 314 Cb 0.42 0.00 0.02 0.00 0.08 0.00 0.00 29.97 30.49 3hk7 h ARG 314 CO 0.03 0.22 -1.67 0.87 -1.07 0.00 0.00 179.97 178.34 3hk7 h LYS 315 N 0.00 0.44 -4.87 0.04 1.79 -0.86 -3.46 116.57 109.64 3hk7 h LYS 315 Ca -0.00 -0.75 -0.65 0.00 -2.18 0.00 0.00 60.65 57.07 3hk7 h LYS 315 Cb 0.46 0.28 -0.36 0.00 -1.58 0.00 0.00 32.23 31.04 3hk7 h LYS 315 CO 0.03 1.36 -0.84 -0.06 -1.08 0.00 0.00 179.45 178.86 3hk7 s PHE 316 N -2.58 2.65 -0.30 -1.35 0.08 -0.84 -4.99 117.98 110.65 3hk7 s PHE 316 Ca -0.14 -1.63 0.27 0.00 0.12 0.00 0.00 56.93 55.55 3hk7 s PHE 316 Cb 0.05 -1.81 1.10 0.00 -0.57 0.00 0.00 43.02 41.79 3hk7 s PHE 316 CO 0.88 -0.78 1.80 0.66 -0.10 0.00 0.00 175.22 177.68 3hk7 h SER 317 N 7.95 0.00 -0.22 1.36 4.64 -1.90 -2.09 113.55 123.29 3hk7 h SER 317 Ca -0.38 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.94 3hk7 h SER 317 Cb 1.12 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.21 3hk7 h SER 317 CO 0.57 0.00 0.00 -0.46 -0.87 0.00 0.00 176.83 176.07 3hk7 n ASN 318 N -2.50 1.87 -4.28 4.97 6.94 -1.26 -4.72 115.26 116.28 3hk7 n ASN 318 Ca 0.02 -2.14 -0.33 0.00 -0.02 0.00 0.00 54.58 52.11 3hk7 n ASN 318 Cb 0.26 -0.34 -0.16 0.00 -2.36 0.00 0.00 39.78 37.18 3hk7 n ASN 318 CO 0.00 0.00 0.00 -0.22 -1.03 0.00 0.00 177.26 176.01 3hk7 s LEU 319 N -0.96 2.38 -0.16 -4.53 2.96 -0.79 -0.85 118.68 116.74 3hk7 s LEU 319 Ca 0.17 -0.46 -0.00 0.00 -0.22 0.00 0.00 54.13 53.61 3hk7 s LEU 319 Cb 0.11 -1.51 0.04 0.00 0.50 0.00 0.00 46.19 45.33 3hk7 s LEU 319 CO 0.09 0.14 -0.06 -0.32 -1.32 0.00 0.00 176.35 174.88 3hk7 s MET 320 N 0.45 1.50 0.26 1.98 -2.45 0.06 -4.94 119.30 116.16 3hk7 s MET 320 Ca -0.13 -0.48 -0.10 0.00 -1.25 0.00 0.00 55.69 53.73 3hk7 s MET 320 Cb -0.17 -1.95 -0.07 0.00 1.25 0.00 0.00 34.83 33.89 3hk7 s MET 320 CO 0.06 -0.40 0.59 0.96 1.05 0.00 0.00 175.02 177.28 3hk7 s ILE 321 N 1.63 4.90 0.00 10.11 -4.36 -1.26 -1.55 121.20 130.67 3hk7 s ILE 321 Ca 0.02 0.50 -0.11 0.00 -0.26 0.00 0.00 60.65 60.80 3hk7 s ILE 321 Cb -0.15 -3.64 0.01 0.00 1.25 0.00 0.00 42.46 39.94 3hk7 s ILE 321 CO -0.08 -0.15 0.22 0.72 0.24 0.00 0.00 174.94 175.90 3hk7 s PHE 322 N -1.91 -0.06 0.23 1.37 -0.12 -0.72 -2.19 117.98 114.58 3hk7 s PHE 322 Ca 0.48 0.02 0.00 0.00 -0.05 0.00 0.00 56.93 57.38 3hk7 s PHE 322 Cb -0.11 0.02 0.00 0.00 -0.63 0.00 0.00 43.02 42.30 3hk7 s PHE 322 CO 0.22 -0.35 0.00 0.41 -0.05 0.00 0.00 175.22 175.45 3hk7 n GLY 323 N 1.26 -1.24 2.98 1.99 0.00 -0.38 -4.45 105.19 105.34 3hk7 n GLY 323 Ca -0.22 -0.55 -0.31 0.00 0.00 0.00 0.00 46.02 44.93 3hk7 n GLY 323 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hk7 s TRP 325 N -0.35 2.96 0.00 0.00 -0.00 -1.26 -2.93 118.94 117.36 3hk7 s TRP 325 Ca 0.18 0.93 0.00 0.00 -0.00 0.00 0.00 56.10 57.20 3hk7 s TRP 325 Cb -0.23 -3.60 0.00 0.00 -0.00 0.00 0.00 33.47 29.64 3hk7 s TRP 325 CO -0.02 -2.15 0.00 1.87 -0.00 0.00 0.00 176.95 176.65 3hk7 n TRP 326 N 5.25 0.00 0.45 5.86 -0.00 -1.26 -0.17 117.44 127.57 3hk7 n TRP 326 Ca 0.12 0.00 0.09 0.00 -0.00 0.00 0.00 57.50 57.71 3hk7 n TRP 326 Cb 0.44 0.00 0.38 0.00 -0.00 0.00 0.00 31.31 32.13 3hk7 n TRP 326 CO 0.00 0.00 0.00 1.19 -0.00 0.00 0.00 177.69 178.88 3hk7 n PHE 327 N 0.00 0.33 0.75 5.87 3.72 -1.26 -1.06 117.46 125.81 3hk7 n PHE 327 Ca 0.00 0.13 0.12 0.00 -0.05 0.00 0.00 57.45 57.65 3hk7 n PHE 327 Cb 0.00 -0.71 0.23 0.00 -0.94 0.00 0.00 39.48 38.06 3hk7 n PHE 327 CO 0.00 0.00 0.00 -1.33 -0.05 0.00 0.00 176.76 175.38 3hk7 n MET 328 N -1.80 0.17 -1.28 -1.08 2.81 0.77 -4.53 117.12 112.18 3hk7 n MET 328 Ca 0.03 0.05 -0.31 0.00 -1.81 0.00 0.00 57.70 55.66 3hk7 n MET 328 Cb 0.19 -1.61 -0.07 0.00 -0.71 0.00 0.00 33.22 31.03 3hk7 n MET 328 CO 0.00 0.00 0.00 -1.71 1.51 0.00 0.00 175.97 175.77 3hk7 n ASN 329 N -1.85 7.62 -4.00 7.83 5.15 -0.22 -3.69 115.26 126.10 3hk7 n ASN 329 Ca 0.04 -2.61 -0.19 0.00 -0.60 0.00 0.00 54.58 51.22 3hk7 n ASN 329 Cb 0.40 -1.49 -0.15 0.00 -0.53 0.00 0.00 39.78 38.00 3hk7 n ASN 329 CO 0.00 0.00 0.00 0.20 1.40 0.00 0.00 177.26 178.86 3hk7 s ASN 330 N 1.91 1.00 0.16 1.20 0.01 -1.26 -4.98 114.94 112.98 3hk7 s ASN 330 Ca 0.67 -0.15 -0.17 0.00 -0.71 0.00 0.00 52.86 52.50 3hk7 s ASN 330 Cb 0.23 -0.18 0.10 0.00 0.41 0.00 0.00 41.25 41.82 3hk7 s ASN 330 CO -0.05 0.08 1.20 -2.65 -1.51 0.00 0.00 177.10 174.17 3hk7 n PRO 331 N 3.05 -0.24 -0.22 -0.60 -0.02 -1.26 0.32 135.00 136.03 3hk7 n PRO 331 Ca -0.15 1.19 0.01 0.00 -2.02 0.00 0.00 63.50 62.53 3hk7 n PRO 331 Cb 0.56 -1.76 0.13 0.00 -0.02 0.00 0.00 33.50 32.41 3hk7 n PRO 331 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 3hk7 h GLU 332 N 0.00 0.40 0.12 -0.52 4.57 -1.97 0.15 114.58 117.33 3hk7 h GLU 332 Ca 0.22 -0.02 -0.28 0.00 -1.18 0.00 0.00 59.36 58.09 3hk7 h GLU 332 Cb 0.41 -0.09 0.03 0.00 -0.16 0.00 0.00 28.75 28.94 3hk7 h GLU 332 CO -0.76 0.27 -1.18 0.82 -1.18 0.00 0.00 179.01 176.98 3hk7 h ILE 333 N 0.42 1.31 -0.74 2.32 1.08 -0.94 -2.91 117.51 118.05 3hk7 h ILE 333 Ca 0.33 -2.44 0.04 0.00 -0.39 0.00 0.00 64.86 62.40 3hk7 h ILE 333 Cb 0.44 2.74 -0.05 0.00 -3.07 0.00 0.00 36.82 36.88 3hk7 h ILE 333 CO -0.34 0.74 0.45 0.40 -0.69 0.00 0.00 178.15 178.72 3hk7 h ILE 334 N 0.20 1.07 0.55 -0.67 2.04 0.27 -1.03 117.51 119.93 3hk7 h ILE 334 Ca -0.18 -0.30 -0.03 0.00 1.00 0.00 0.00 64.86 65.36 3hk7 h ILE 334 Cb 1.87 0.12 0.00 0.00 -0.74 0.00 0.00 36.82 38.07 3hk7 h ILE 334 CO 0.23 0.16 -0.27 -1.13 0.00 0.00 0.00 178.15 177.13 3hk7 h ASN 335 N 0.87 -0.65 -0.68 1.72 -1.24 -0.75 -1.28 115.58 113.57 3hk7 h ASN 335 Ca 0.31 0.02 -0.05 0.00 0.71 0.00 0.00 56.30 57.29 3hk7 h ASN 335 Cb 0.07 0.17 -0.03 0.00 0.73 0.00 0.00 38.32 39.26 3hk7 h ASN 335 CO -0.13 -0.46 0.23 1.05 -1.29 0.00 0.00 177.43 176.83 3hk7 h GLU 336 N -0.75 1.07 -0.14 6.67 4.11 -1.34 -1.89 114.58 122.31 3hk7 h GLU 336 Ca -0.07 -0.21 -0.01 0.00 0.07 0.00 0.00 59.36 59.13 3hk7 h GLU 336 Cb 0.58 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.66 3hk7 h GLU 336 CO 0.12 0.90 0.05 0.52 0.07 0.00 0.00 179.01 180.68 3hk7 h MET 337 N 1.03 0.22 -0.66 1.06 2.86 -1.15 -1.18 114.93 117.11 3hk7 h MET 337 Ca 0.23 -0.04 -0.02 0.00 -2.06 0.00 0.00 59.70 57.81 3hk7 h MET 337 Cb 0.28 -0.03 -0.03 0.00 0.06 0.00 0.00 31.60 31.87 3hk7 h MET 337 CO -0.01 0.32 0.33 1.15 1.06 0.00 0.00 176.91 179.76 3hk7 h THR 338 N 0.07 1.21 -0.25 2.22 2.02 -1.08 0.73 112.91 117.83 3hk7 h THR 338 Ca 0.05 -0.57 -0.10 0.00 0.77 0.00 0.00 66.41 66.56 3hk7 h THR 338 Cb 0.19 0.36 -0.00 0.00 -1.74 0.00 0.00 68.15 66.95 3hk7 h THR 338 CO -0.00 0.24 -0.24 0.03 0.37 0.00 0.00 175.52 175.92 3hk7 h ARG 339 N 0.93 0.61 -0.51 6.66 3.08 -1.17 -0.86 114.38 123.11 3hk7 h ARG 339 Ca 0.23 -0.32 -0.07 0.00 0.07 0.00 0.00 59.98 59.90 3hk7 h ARG 339 Cb 0.08 0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.12 3hk7 h ARG 339 CO -0.03 0.91 0.06 0.52 -1.07 0.00 0.00 179.97 180.36 3hk7 h MET 340 N 0.32 0.87 -0.29 0.04 2.86 -0.91 -0.88 114.93 116.93 3hk7 h MET 340 Ca 0.04 -0.25 -0.00 0.00 -2.06 0.00 0.00 59.70 57.43 3hk7 h MET 340 Cb 0.79 -0.09 -0.01 0.00 0.06 0.00 0.00 31.60 32.35 3hk7 h MET 340 CO 0.06 0.87 0.17 0.00 1.06 0.00 0.00 176.91 179.07 3hk7 h ARG 341 N 0.74 0.40 -0.36 1.72 3.08 -0.79 -2.20 114.38 116.97 3hk7 h ARG 341 Ca 0.15 -0.04 -0.15 0.00 0.07 0.00 0.00 59.98 60.01 3hk7 h ARG 341 Cb 0.44 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.40 3hk7 h ARG 341 CO 0.01 0.32 -0.37 1.98 -1.07 0.00 0.00 179.97 180.85 3hk7 h MET 342 N 0.37 0.86 -0.57 0.04 4.05 -1.06 0.30 114.93 118.91 3hk7 h MET 342 Ca 0.11 -0.44 -0.00 0.00 -0.28 0.00 0.00 59.70 59.08 3hk7 h MET 342 Cb 0.03 0.01 -0.03 0.00 -0.80 0.00 0.00 31.60 30.81 3hk7 h MET 342 CO -0.02 1.08 0.35 0.93 0.23 0.00 0.00 176.91 179.48 3hk7 h GLU 343 N 0.71 0.77 0.00 0.39 5.08 -1.01 0.84 114.58 121.35 3hk7 h GLU 343 Ca 0.06 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3hk7 h GLU 343 Cb 0.94 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 30.03 3hk7 h GLU 343 CO 0.09 0.54 -1.59 -1.33 -1.00 0.00 0.00 179.01 175.71 3hk7 n MET 344 N -4.42 0.54 0.00 2.33 2.81 -0.84 -4.61 117.12 112.92 3hk7 n MET 344 Ca 0.05 -0.12 0.00 0.00 -1.81 0.00 0.00 57.70 55.82 3hk7 n MET 344 Cb 0.07 -1.48 0.00 0.00 -0.71 0.00 0.00 33.22 31.10 3hk7 n MET 344 CO 0.00 0.00 0.00 1.28 1.51 0.00 0.00 175.97 178.76 3hk7 n LEU 345 N -1.95 0.51 0.00 4.03 4.77 0.10 -4.92 117.00 119.54 3hk7 n LEU 345 Ca -0.01 -0.67 0.00 0.00 -0.03 0.00 0.00 56.01 55.30 3hk7 n LEU 345 Cb 0.46 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.55 3hk7 n LEU 345 CO 0.43 0.13 0.00 0.61 -1.33 0.00 0.00 177.39 177.22 3hk7 n GLY 346 N 0.32 3.16 0.43 -0.72 0.00 0.28 -1.81 105.19 106.85 3hk7 n GLY 346 Ca 0.00 -0.04 0.06 0.00 0.00 0.00 0.00 46.02 46.04 3hk7 n GLY 346 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3hk7 n THR 347 N 0.00 1.62 -1.45 2.61 -2.24 -1.26 -4.34 114.28 109.21 3hk7 n THR 347 Ca 0.00 -1.60 -0.28 0.00 -2.27 0.00 0.00 64.05 59.90 3hk7 n THR 347 Cb 0.00 0.08 -0.07 0.00 -2.10 0.00 0.00 70.33 68.24 3hk7 n THR 347 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 3hk7 n SER 348 N -0.52 6.88 -3.68 3.42 3.41 -0.75 -4.71 113.62 117.67 3hk7 n SER 348 Ca 0.13 -2.90 -0.08 0.00 -0.26 0.00 0.00 58.87 55.76 3hk7 n SER 348 Cb 0.58 -1.36 -0.02 0.00 -0.26 0.00 0.00 64.21 63.15 3hk7 n SER 348 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 3hk7 s PHE 349 N -0.28 -0.30 -0.40 7.33 -0.12 -1.26 -4.80 117.98 118.15 3hk7 s PHE 349 Ca 0.62 -0.03 -0.08 0.00 -0.05 0.00 0.00 56.93 57.39 3hk7 s PHE 349 Cb 0.29 0.64 0.07 0.00 -0.63 0.00 0.00 43.02 43.39 3hk7 s PHE 349 CO -0.11 -0.99 0.21 0.42 -0.05 0.00 0.00 175.22 174.70 3hk7 s ILE 350 N -3.69 3.97 0.40 -4.49 1.01 -0.93 -4.67 121.20 112.79 3hk7 s ILE 350 Ca 0.08 -1.44 0.07 0.00 0.00 0.00 0.00 60.65 59.35 3hk7 s ILE 350 Cb -0.03 -3.43 0.27 0.00 0.01 0.00 0.00 42.46 39.28 3hk7 s ILE 350 CO -0.01 -0.46 2.04 1.55 0.00 0.00 0.00 174.94 178.06 3hk7 h PRO 351 N 8.31 0.60 -3.24 2.79 0.13 -1.85 -1.01 132.00 137.72 3hk7 h PRO 351 Ca -0.21 -0.04 -0.03 0.00 -0.87 0.00 0.00 66.00 64.85 3hk7 h PRO 351 Cb 1.08 -0.14 -0.12 0.00 0.13 0.00 0.00 31.00 31.95 3hk7 h PRO 351 CO 0.71 0.40 0.04 -1.14 -0.23 0.00 0.00 178.00 177.79 3hk7 s GLN 352 N -5.55 1.21 0.07 0.86 2.00 -1.26 -3.51 119.66 113.48 3hk7 s GLN 352 Ca -0.09 -0.67 -0.07 0.00 -2.00 0.00 0.00 55.36 52.54 3hk7 s GLN 352 Cb 0.18 0.52 -0.01 0.00 0.80 0.00 0.00 33.01 34.50 3hk7 s GLN 352 CO 0.74 -0.51 0.13 -3.38 -0.50 0.00 0.00 175.29 171.78 3hk7 s HIS 353 N -3.80 0.21 -0.11 1.67 -3.43 -1.26 -4.60 115.29 103.96 3hk7 s HIS 353 Ca 0.04 -0.62 0.03 0.00 -0.80 0.00 0.00 55.06 53.71 3hk7 s HIS 353 Cb 0.00 -0.13 -0.24 0.00 -1.43 0.00 0.00 32.58 30.78 3hk7 s HIS 353 CO -0.10 -0.47 0.38 -1.13 -2.00 0.00 0.00 174.74 171.42 3hk7 n SER 354 N 0.22 1.47 -1.49 7.38 3.41 -1.25 -4.76 113.62 118.61 3hk7 n SER 354 Ca -0.16 0.23 -0.16 0.00 -0.26 0.00 0.00 58.87 58.52 3hk7 n SER 354 Cb 0.61 -0.36 -0.04 0.00 -0.26 0.00 0.00 64.21 64.16 3hk7 n SER 354 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 3hk7 n ASP 355 N -3.24 -4.78 -4.70 4.04 4.64 0.18 -4.90 116.55 107.80 3hk7 n ASP 355 Ca -0.28 0.18 -0.43 0.00 -1.38 0.00 0.00 54.79 52.88 3hk7 n ASP 355 Cb 1.05 -3.78 -0.03 0.00 -1.04 0.00 0.00 41.12 37.32 3hk7 n ASP 355 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 3hk7 n ALA 356 N -0.24 2.34 -0.06 -1.67 0.00 -1.26 -4.42 120.51 115.19 3hk7 n ALA 356 Ca -0.17 0.38 -0.03 0.00 0.00 0.00 0.00 53.44 53.63 3hk7 n ALA 356 Cb 0.58 -2.51 -0.16 0.00 0.00 0.00 0.00 19.45 17.36 3hk7 n ALA 356 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3hk7 n ARG 357 N 4.37 0.67 -5.12 0.00 1.74 -1.26 0.37 116.66 117.44 3hk7 n ARG 357 Ca 0.17 -0.04 -0.32 0.00 -0.77 0.00 0.00 57.85 56.88 3hk7 n ARG 357 Cb 0.34 -1.55 -0.16 0.00 -1.02 0.00 0.00 32.46 30.07 3hk7 n ARG 357 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 3hk7 s VAL 358 N -2.84 2.32 0.22 1.55 1.01 -1.26 -4.38 120.40 117.02 3hk7 s VAL 358 Ca -0.09 -0.94 -0.17 0.00 0.00 0.00 0.00 61.98 60.78 3hk7 s VAL 358 Cb 0.09 -1.90 0.23 0.00 0.00 0.00 0.00 36.38 34.80 3hk7 s VAL 358 CO 0.85 0.56 1.56 0.25 0.00 0.00 0.00 175.10 178.32 3hk7 h LEU 359 N 6.47 -1.28 -2.41 3.92 5.85 -1.34 -1.48 115.31 125.04 3hk7 h LEU 359 Ca -0.25 0.28 -0.00 0.00 0.84 0.00 0.00 57.88 58.75 3hk7 h LEU 359 Cb 1.21 0.68 -0.00 0.00 0.37 0.00 0.00 40.66 42.93 3hk7 h LEU 359 CO 0.49 -0.29 -0.01 -0.33 -0.34 0.00 0.00 178.44 177.95 3hk7 h GLU 360 N -0.04 0.00 -0.29 1.25 3.07 -1.93 -2.57 114.58 114.06 3hk7 h GLU 360 Ca 0.33 0.00 0.08 0.00 -0.50 0.00 0.00 59.36 59.27 3hk7 h GLU 360 Cb 0.60 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.49 3hk7 h GLU 360 CO -0.90 0.01 0.31 1.96 -1.40 0.00 0.00 179.01 178.99 3hk7 h GLN 361 N 0.00 0.00 -0.54 2.33 4.20 -1.66 0.12 115.11 119.55 3hk7 h GLN 361 Ca -0.00 0.00 0.16 0.00 0.06 0.00 0.00 58.65 58.87 3hk7 h GLN 361 Cb 0.03 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 27.79 3hk7 h GLN 361 CO 0.00 0.00 0.39 -0.07 -0.67 0.00 0.00 178.83 178.48 3hk7 h LEU 362 N 0.00 0.00 0.34 1.46 3.38 -1.62 0.11 115.31 118.98 3hk7 h LEU 362 Ca 0.14 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.09 3hk7 h LEU 362 Cb 0.75 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.50 3hk7 h LEU 362 CO -0.00 0.00 -0.16 0.40 0.09 0.00 0.00 178.44 178.77 3hk7 h ILE 363 N 0.00 0.63 0.05 1.22 2.04 -1.00 -3.01 117.51 117.44 3hk7 h ILE 363 Ca 0.26 -0.58 -0.23 0.00 1.00 0.00 0.00 64.86 65.30 3hk7 h ILE 363 Cb 1.04 0.90 -0.01 0.00 -0.74 0.00 0.00 36.82 38.02 3hk7 h ILE 363 CO -0.00 0.10 -1.03 0.10 0.00 0.00 0.00 178.15 177.32 3hk7 h TYR 364 N -0.80 0.36 -0.23 1.37 -0.00 -1.51 -2.30 116.97 113.86 3hk7 h TYR 364 Ca -0.05 -0.23 0.03 0.00 0.00 0.00 0.00 58.73 58.48 3hk7 h TYR 364 Cb 0.52 -0.03 -0.03 0.00 0.00 0.00 0.00 36.73 37.20 3hk7 h TYR 364 CO 0.02 1.11 0.07 0.87 -0.00 0.00 0.00 178.16 180.23 3hk7 h LYS 365 N 0.10 0.16 0.02 0.10 1.79 -0.91 0.17 116.57 118.01 3hk7 h LYS 365 Ca -0.08 -0.01 -0.22 0.00 -2.18 0.00 0.00 60.65 58.16 3hk7 h LYS 365 Cb 1.72 -0.04 -0.00 0.00 -1.58 0.00 0.00 32.23 32.33 3hk7 h LYS 365 CO 0.16 0.11 -0.97 -1.49 -1.08 0.00 0.00 179.45 176.18 3hk7 h TRP 366 N 0.17 0.47 -0.14 -1.35 4.06 -1.60 -2.41 115.95 115.14 3hk7 h TRP 366 Ca 0.10 -0.27 -0.03 0.00 2.06 0.00 0.00 58.89 60.75 3hk7 h TRP 366 Cb 0.08 -0.05 -0.00 0.00 -1.00 0.00 0.00 29.16 28.19 3hk7 h TRP 366 CO -0.13 1.11 -0.03 1.25 -3.56 0.00 0.00 178.44 177.08 3hk7 h HIS 367 N 0.15 0.30 -0.78 0.49 2.76 -1.26 0.21 115.15 117.03 3hk7 h HIS 367 Ca -0.08 -0.06 -0.05 0.00 -2.20 0.00 0.00 60.37 57.99 3hk7 h HIS 367 Cb 1.63 -0.07 -0.03 0.00 1.55 0.00 0.00 27.41 30.48 3hk7 h HIS 367 CO 0.05 0.55 0.31 0.45 -1.30 0.00 0.00 177.93 177.98 3hk7 h HIS 368 N -0.03 1.19 -0.04 5.26 3.86 -1.04 -2.83 115.15 121.52 3hk7 h HIS 368 Ca 0.04 -0.09 -0.12 0.00 -1.16 0.00 0.00 60.37 59.03 3hk7 h HIS 368 Cb 0.45 -0.36 0.01 0.00 1.06 0.00 0.00 27.41 28.57 3hk7 h HIS 368 CO 0.05 0.91 -0.46 0.77 0.86 0.00 0.00 177.93 180.06 3hk7 h SER 369 N 1.14 0.48 -0.91 2.45 0.02 -1.36 -3.26 113.55 112.11 3hk7 h SER 369 Ca 0.26 -0.70 0.04 0.00 -0.84 0.00 0.00 61.79 60.55 3hk7 h SER 369 Cb 0.22 -0.14 -0.05 0.00 0.14 0.00 0.00 62.40 62.56 3hk7 h SER 369 CO -0.02 1.11 0.60 0.11 -1.14 0.00 0.00 176.83 177.48 3hk7 h LYS 370 N -0.11 1.09 -0.24 3.45 1.57 -0.56 -0.26 116.57 121.52 3hk7 h LYS 370 Ca -0.04 -0.07 -0.06 0.00 -1.87 0.00 0.00 60.65 58.61 3hk7 h LYS 370 Cb 1.14 -0.25 -0.01 0.00 0.08 0.00 0.00 32.23 33.19 3hk7 h LYS 370 CO 0.09 0.72 -0.10 0.66 -0.57 0.00 0.00 179.45 180.25 3hk7 h SER 371 N 1.12 0.36 0.01 0.86 4.64 -1.59 0.18 113.55 119.14 3hk7 h SER 371 Ca 0.37 -0.08 -0.13 0.00 -0.47 0.00 0.00 61.79 61.48 3hk7 h SER 371 Cb 0.04 -0.10 0.01 0.00 -0.31 0.00 0.00 62.40 62.05 3hk7 h SER 371 CO -0.11 0.50 -0.51 0.40 -0.87 0.00 0.00 176.83 176.24 3hk7 h ILE 372 N 0.36 1.48 -0.51 0.95 2.04 -1.40 -2.90 117.51 117.54 3hk7 h ILE 372 Ca 0.07 -2.09 -0.04 0.00 1.00 0.00 0.00 64.86 63.80 3hk7 h ILE 372 Cb 0.40 2.72 -0.02 0.00 -0.74 0.00 0.00 36.82 39.18 3hk7 h ILE 372 CO 0.02 0.60 0.13 0.40 0.00 0.00 0.00 178.15 179.30 3hk7 h ILE 373 N -0.26 1.21 -0.57 -0.67 2.04 -0.85 -2.02 117.51 116.39 3hk7 h ILE 373 Ca -0.07 -0.74 -0.04 0.00 1.00 0.00 0.00 64.86 65.01 3hk7 h ILE 373 Cb 1.25 0.68 -0.02 0.00 -0.74 0.00 0.00 36.82 37.99 3hk7 h ILE 373 CO 0.10 0.28 0.19 0.00 0.00 0.00 0.00 178.15 178.72 3hk7 h ALA 374 N 1.41 0.75 -0.48 1.87 0.00 -0.70 -0.95 119.26 121.17 3hk7 h ALA 374 Ca 0.17 -0.19 -0.06 0.00 0.00 0.00 0.00 54.91 54.83 3hk7 h ALA 374 Cb 0.26 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 3hk7 h ALA 374 CO -0.00 0.40 0.05 1.49 0.00 0.00 0.00 179.25 181.19 3hk7 h GLU 375 N 0.80 0.76 -0.41 0.00 4.57 -1.25 0.12 114.58 119.15 3hk7 h GLU 375 Ca 0.19 -0.18 -0.05 0.00 -1.18 0.00 0.00 59.36 58.13 3hk7 h GLU 375 Cb 0.27 -0.10 -0.02 0.00 -0.16 0.00 0.00 28.75 28.74 3hk7 h GLU 375 CO -0.01 0.73 0.05 0.28 -1.18 0.00 0.00 179.01 178.88 3hk7 h VAL 376 N 0.72 1.25 -0.60 0.32 2.07 -0.99 -2.18 116.25 116.83 3hk7 h VAL 376 Ca 0.15 -0.92 -0.04 0.00 0.82 0.00 0.00 66.70 66.71 3hk7 h VAL 376 Cb 0.37 1.04 -0.03 0.00 -1.52 0.00 0.00 31.29 31.15 3hk7 h VAL 376 CO 0.01 0.32 0.22 -0.07 0.02 0.00 0.00 177.57 178.07 3hk7 h LEU 377 N 0.55 0.85 -0.53 2.57 3.38 -0.67 -1.58 115.31 119.88 3hk7 h LEU 377 Ca 0.12 -0.19 0.03 0.00 0.09 0.00 0.00 57.88 57.94 3hk7 h LEU 377 Cb 0.41 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 40.90 3hk7 h LEU 377 CO 0.01 0.80 0.30 0.40 0.09 0.00 0.00 178.44 180.05 3hk7 h ILE 378 N 0.84 1.02 -0.24 1.22 2.04 -0.62 0.21 117.51 121.98 3hk7 h ILE 378 Ca 0.20 -0.20 -0.01 0.00 1.00 0.00 0.00 64.86 65.84 3hk7 h ILE 378 Cb 0.24 0.38 -0.01 0.00 -0.74 0.00 0.00 36.82 36.69 3hk7 h ILE 378 CO -0.01 0.11 0.10 0.44 0.00 0.00 0.00 178.15 178.78 3hk7 h ASP 379 N 0.59 0.34 -0.27 1.72 3.32 -1.12 0.11 116.42 121.11 3hk7 h ASP 379 Ca 0.22 -0.17 -0.11 0.00 0.02 0.00 0.00 57.03 56.99 3hk7 h ASP 379 Cb 0.06 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 39.51 3hk7 h ASP 379 CO -0.12 0.41 -0.22 0.11 -1.72 0.00 0.00 179.24 177.71 3hk7 h LYS 380 N 0.24 0.75 -0.39 3.56 6.56 -0.94 -0.67 116.57 125.68 3hk7 h LYS 380 Ca 0.08 -0.30 -0.12 0.00 -1.06 0.00 0.00 60.65 59.26 3hk7 h LYS 380 Cb 0.18 -0.04 -0.01 0.00 -0.57 0.00 0.00 32.23 31.80 3hk7 h LYS 380 CO -0.01 0.90 -0.21 1.88 -2.06 0.00 0.00 179.45 179.95 3hk7 h TYR 381 N 0.65 0.97 -0.75 -1.35 0.05 -0.53 -2.95 116.97 113.06 3hk7 h TYR 381 Ca 0.09 -0.25 -0.04 0.00 0.05 0.00 0.00 58.73 58.59 3hk7 h TYR 381 Cb 0.72 -0.22 -0.03 0.00 1.01 0.00 0.00 36.73 38.20 3hk7 h TYR 381 CO 0.04 1.02 0.31 0.22 -1.05 0.00 0.00 178.16 178.70 3hk7 h ASP 382 N 0.65 1.00 -0.90 3.88 3.58 -0.71 0.17 116.42 124.10 3hk7 h ASP 382 Ca 0.08 -0.14 0.02 0.00 0.42 0.00 0.00 57.03 57.42 3hk7 h ASP 382 Cb 0.77 -0.26 -0.05 0.00 1.72 0.00 0.00 39.33 41.52 3hk7 h ASP 382 CO 0.06 0.88 0.59 0.44 -2.88 0.00 0.00 179.24 178.34 3hk7 h ASP 383 N 1.08 1.01 1.19 2.28 3.32 -0.97 0.67 116.42 124.99 3hk7 h ASP 383 Ca 0.25 -0.02 -0.14 0.00 0.02 0.00 0.00 57.03 57.15 3hk7 h ASP 383 Cb 0.18 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.46 3hk7 h ASP 383 CO -0.02 0.71 -0.84 0.16 -1.72 0.00 0.00 179.24 177.53 3hk7 h ILE 384 N 1.18 0.84 -0.22 0.35 3.07 -1.30 -2.97 117.51 118.45 3hk7 h ILE 384 Ca 0.34 -2.28 -0.02 0.00 1.55 0.00 0.00 64.86 64.45 3hk7 h ILE 384 Cb -0.07 2.35 -0.01 0.00 -0.27 0.00 0.00 36.82 38.82 3hk7 h ILE 384 CO -0.09 0.48 0.05 0.25 -1.05 0.00 0.00 178.15 177.80 3hk7 h LEU 385 N 0.00 0.33 -1.76 0.16 5.85 -0.29 -0.35 115.31 119.25 3hk7 h LEU 385 Ca -0.06 -0.23 -0.03 0.00 0.84 0.00 0.00 57.88 58.40 3hk7 h LEU 385 Cb 1.49 -0.09 -0.00 0.00 0.37 0.00 0.00 40.66 42.43 3hk7 h LEU 385 CO 0.07 0.48 -0.15 1.56 -0.34 0.00 0.00 178.44 180.06 3hk7 h GLN 386 N 0.17 0.00 0.00 1.25 1.08 -0.96 -0.31 115.11 116.34 3hk7 h GLN 386 Ca 0.07 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.27 3hk7 h GLN 386 Cb 0.27 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.70 3hk7 h GLN 386 CO 0.00 0.15 0.00 0.00 -0.95 0.00 0.00 178.83 178.03 3hk7 n ALA 387 N -2.28 2.58 0.00 3.87 0.00 -0.86 -4.86 120.51 118.97 3hk7 n ALA 387 Ca -0.02 -0.16 0.00 0.00 0.00 0.00 0.00 53.44 53.27 3hk7 n ALA 387 Cb 0.27 -1.41 0.00 0.00 0.00 0.00 0.00 19.45 18.32 3hk7 n ALA 387 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hk7 n GLY 388 N 0.80 0.44 3.76 0.00 0.00 -0.13 -5.06 105.19 105.00 3hk7 n GLY 388 Ca 0.19 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.81 3hk7 n GLY 388 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 3hk7 s TRP 389 N -2.00 3.74 -0.29 1.61 -0.11 -0.20 -5.00 118.94 116.70 3hk7 s TRP 389 Ca 0.00 1.80 -0.21 0.00 1.22 0.00 0.00 56.10 58.90 3hk7 s TRP 389 Cb 0.00 -3.11 -0.01 0.00 -1.50 0.00 0.00 33.47 28.85 3hk7 s TRP 389 CO 0.00 -0.06 0.68 -2.00 -4.62 0.00 0.00 176.95 170.96 3hk7 s GLU 390 N -1.47 3.98 -0.20 5.86 2.12 -1.26 -4.29 118.70 123.43 3hk7 s GLU 390 Ca 0.45 0.47 -0.04 0.00 0.36 0.00 0.00 54.97 56.20 3hk7 s GLU 390 Cb -0.27 -3.71 -0.02 0.00 0.26 0.00 0.00 34.13 30.39 3hk7 s GLU 390 CO 0.35 -0.56 -0.02 0.54 -0.54 0.00 0.00 175.26 175.02 3hk7 s VAL 391 N 2.70 3.73 0.24 3.70 0.11 -1.26 -5.10 120.40 124.52 3hk7 s VAL 391 Ca 0.28 -0.39 0.05 0.00 -2.93 0.00 0.00 61.98 59.00 3hk7 s VAL 391 Cb -0.15 -2.69 -0.03 0.00 -1.53 0.00 0.00 36.38 31.99 3hk7 s VAL 391 CO 0.11 0.43 0.33 0.42 -3.33 0.00 0.00 175.10 173.06 3hk7 s THR 392 N 1.11 5.13 0.34 5.04 -4.23 -1.26 -4.54 115.64 117.23 3hk7 s THR 392 Ca 0.02 -1.04 0.05 0.00 -1.18 0.00 0.00 61.69 59.54 3hk7 s THR 392 Cb -0.14 -3.78 0.15 0.00 1.34 0.00 0.00 72.50 70.07 3hk7 s THR 392 CO 0.01 -0.32 1.87 -0.08 -0.54 0.00 0.00 174.62 175.55 3hk7 h GLU 393 N 1.27 0.47 -0.60 3.99 4.81 -1.99 -1.81 114.58 120.73 3hk7 h GLU 393 Ca -0.51 -0.11 -0.09 0.00 -0.13 0.00 0.00 59.36 58.52 3hk7 h GLU 393 Cb 1.23 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 30.52 3hk7 h GLU 393 CO 0.61 0.54 0.04 0.93 -0.73 0.00 0.00 179.01 180.40 3hk7 h GLU 394 N 0.45 1.03 -0.15 1.92 4.39 -1.99 -0.59 114.58 119.64 3hk7 h GLU 394 Ca 0.09 -0.31 -0.10 0.00 0.34 0.00 0.00 59.36 59.39 3hk7 h GLU 394 Cb 0.37 -0.10 -0.01 0.00 -0.10 0.00 0.00 28.75 28.90 3hk7 h GLU 394 CO 0.02 0.99 -0.36 0.93 -1.16 0.00 0.00 179.01 179.43 3hk7 h GLU 395 N 0.93 0.31 -0.33 2.33 5.08 -1.85 -0.68 114.58 120.37 3hk7 h GLU 395 Ca 0.18 -0.13 -0.08 0.00 -1.00 0.00 0.00 59.36 58.32 3hk7 h GLU 395 Cb 0.50 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.73 3hk7 h GLU 395 CO 0.02 0.63 -0.10 0.82 -1.00 0.00 0.00 179.01 179.38 3hk7 h ILE 396 N 0.26 1.28 -0.64 3.13 2.04 -1.01 -0.04 117.51 122.54 3hk7 h ILE 396 Ca 0.03 -1.16 -0.06 0.00 1.00 0.00 0.00 64.86 64.67 3hk7 h ILE 396 Cb 0.76 1.35 -0.03 0.00 -0.74 0.00 0.00 36.82 38.16 3hk7 h ILE 396 CO 0.06 0.38 0.16 0.11 0.00 0.00 0.00 178.15 178.86 3hk7 h LYS 397 N 0.43 1.00 -0.17 2.37 1.57 -0.85 0.14 116.57 121.06 3hk7 h LYS 397 Ca 0.08 -0.22 -0.01 0.00 -1.87 0.00 0.00 60.65 58.63 3hk7 h LYS 397 Cb 0.60 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 32.76 3hk7 h LYS 397 CO 0.04 0.88 0.05 -0.09 -0.57 0.00 0.00 179.45 179.76 3hk7 h ARG 398 N 0.95 0.26 -0.45 3.15 2.43 -0.93 -0.64 114.38 119.14 3hk7 h ARG 398 Ca 0.20 -0.05 -0.04 0.00 -0.81 0.00 0.00 59.98 59.28 3hk7 h ARG 398 Cb 0.33 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 29.82 3hk7 h ARG 398 CO -0.00 0.37 0.14 -0.44 -1.51 0.00 0.00 179.97 178.53 3hk7 h ASP 399 N 0.09 0.65 -0.31 -3.80 3.32 -0.75 -1.52 116.42 114.10 3hk7 h ASP 399 Ca 0.05 -0.21 -0.05 0.00 0.02 0.00 0.00 57.03 56.85 3hk7 h ASP 399 Cb 0.22 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 39.58 3hk7 h ASP 399 CO -0.00 0.69 0.05 0.58 -1.72 0.00 0.00 179.24 178.83 3hk7 h VAL 400 N 0.59 1.20 -0.24 -1.35 2.07 -0.92 -1.90 116.25 115.71 3hk7 h VAL 400 Ca 0.14 -0.77 -0.12 0.00 0.82 0.00 0.00 66.70 66.77 3hk7 h VAL 400 Cb 0.27 0.85 -0.01 0.00 -1.52 0.00 0.00 31.29 30.88 3hk7 h VAL 400 CO -0.00 0.27 -0.35 0.00 0.02 0.00 0.00 177.57 177.51 3hk7 h ALA 401 N 1.46 0.96 -0.15 1.67 0.00 -0.83 -2.27 119.26 120.10 3hk7 h ALA 401 Ca 0.13 -0.40 -0.01 0.00 0.00 0.00 0.00 54.91 54.63 3hk7 h ALA 401 Cb 0.31 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 3hk7 h ALA 401 CO 0.01 0.61 0.05 -0.44 0.00 0.00 0.00 179.25 179.48 3hk7 h ASP 402 N 0.43 0.22 -0.48 0.00 3.32 -0.53 -0.11 116.42 119.26 3hk7 h ASP 402 Ca 0.05 -0.19 -0.03 0.00 0.02 0.00 0.00 57.03 56.88 3hk7 h ASP 402 Cb 0.81 -0.06 -0.02 0.00 0.22 0.00 0.00 39.33 40.28 3hk7 h ASP 402 CO 0.07 0.34 0.18 -0.07 -1.72 0.00 0.00 179.24 178.04 3hk7 h LEU 403 N 0.08 0.68 0.00 1.55 3.38 -1.30 0.62 115.31 120.31 3hk7 h LEU 403 Ca 0.05 -0.18 0.00 0.00 0.09 0.00 0.00 57.88 57.84 3hk7 h LEU 403 Cb 0.20 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.77 3hk7 h LEU 403 CO -0.00 0.67 -0.63 0.49 0.09 0.00 0.00 178.44 179.06 3hk7 n PHE 404 N -4.56 0.11 0.11 1.13 3.72 -0.86 -4.17 117.46 112.94 3hk7 n PHE 404 Ca 0.01 0.03 0.00 0.00 -0.05 0.00 0.00 57.45 57.45 3hk7 n PHE 404 Cb 0.16 -0.31 0.00 0.00 -0.94 0.00 0.00 39.48 38.39 3hk7 n PHE 404 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 3hk7 n SER 405 N -1.64 -1.48 -0.24 4.37 2.88 -0.27 -1.95 113.62 115.28 3hk7 n SER 405 Ca 0.05 0.40 -0.04 0.00 -1.33 0.00 0.00 58.87 57.95 3hk7 n SER 405 Cb 0.36 1.57 0.14 0.00 -0.75 0.00 0.00 64.21 65.53 3hk7 n SER 405 CO 0.00 0.00 0.00 0.03 -1.23 0.00 0.00 175.04 173.84 3hk7 h ARG 406 N 0.00 1.07 -0.70 -1.46 3.08 -1.11 -2.92 114.38 112.34 3hk7 h ARG 406 Ca 0.00 -0.17 0.06 0.00 0.07 0.00 0.00 59.98 59.94 3hk7 h ARG 406 Cb 0.00 -0.19 -0.05 0.00 0.08 0.00 0.00 29.97 29.81 3hk7 h ARG 406 CO 0.00 0.85 0.40 -0.91 -1.07 0.00 0.00 179.97 179.24 3hk7 h ASN 407 N 1.05 0.61 0.74 7.04 2.35 -1.09 0.19 115.58 126.47 3hk7 h ASN 407 Ca 0.25 0.03 -0.04 0.00 -0.55 0.00 0.00 56.30 55.99 3hk7 h ASN 407 Cb 0.16 -0.10 0.01 0.00 0.05 0.00 0.00 38.32 38.43 3hk7 h ASN 407 CO -0.03 0.40 -0.35 0.15 -1.65 0.00 0.00 177.43 175.95 3hk7 h PHE 408 N 0.74 -0.92 -0.95 1.19 3.57 -1.74 -1.02 116.94 117.82 3hk7 h PHE 408 Ca 0.31 -0.02 0.13 0.00 3.53 0.00 0.00 57.97 61.92 3hk7 h PHE 408 Cb 0.17 0.30 -0.08 0.00 2.79 0.00 0.00 35.95 39.13 3hk7 h PHE 408 CO -0.07 -0.57 0.60 -1.49 -2.23 0.00 0.00 178.31 174.56 3hk7 h TRP 409 N -1.03 1.01 -0.39 0.41 4.06 -1.39 -0.33 115.95 118.28 3hk7 h TRP 409 Ca -0.10 0.03 -0.02 0.00 2.06 0.00 0.00 58.89 60.86 3hk7 h TRP 409 Cb 0.76 -0.32 -0.02 0.00 -1.00 0.00 0.00 29.16 28.58 3hk7 h TRP 409 CO 0.05 0.39 0.18 -0.09 -3.56 0.00 0.00 178.44 175.41 3hk7 h ARG 410 N 0.87 0.58 -0.04 0.49 2.43 -0.55 -2.07 114.38 116.09 3hk7 h ARG 410 Ca 0.47 -0.09 -0.00 0.00 -0.81 0.00 0.00 59.98 59.55 3hk7 h ARG 410 Cb 0.58 -0.10 -0.00 0.00 -0.42 0.00 0.00 29.97 30.03 3hk7 h ARG 410 CO -0.24 0.52 0.02 0.35 -1.51 0.00 0.00 179.97 179.11 3hk7 h PHE 411 N 0.50 0.06 0.00 2.20 3.57 0.27 -2.44 116.94 121.09 3hk7 h PHE 411 Ca 0.13 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.63 3hk7 h PHE 411 Cb 0.14 -0.02 0.00 0.00 2.79 0.00 0.00 35.95 38.86 3hk7 h PHE 411 CO -0.01 0.21 0.00 1.33 -2.23 0.00 0.00 178.31 177.61 3hk7 n VAL 412 N -4.97 0.00 -3.39 1.41 0.24 -0.31 -4.86 118.33 106.44 3hk7 n VAL 412 Ca -0.07 0.00 -0.17 0.00 -2.04 0.00 0.00 64.34 62.06 3hk7 n VAL 412 Cb 0.11 -0.74 0.08 0.00 -1.47 0.00 0.00 33.84 31.82 3hk7 n VAL 412 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3hk7 n GLY 413 N 0.00 -0.35 0.00 7.63 0.00 -0.92 -4.81 105.19 106.75 3hk7 n GLY 413 Ca 0.12 0.10 0.00 0.00 0.00 0.00 0.00 46.02 46.23 3hk7 n GLY 413 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19