#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vhj s THR 3 N 0.00 3.16 0.34 0.00 -4.23 -0.92 -5.04 115.64 108.95 1vhj s THR 3 Ca 0.00 -1.49 0.02 0.00 -1.18 0.00 0.00 61.69 59.04 1vhj s THR 3 Cb 0.00 -3.08 0.23 0.00 1.34 0.00 0.00 72.50 71.00 1vhj s THR 3 CO 0.00 -0.14 1.96 -0.65 -0.54 0.00 0.00 174.62 175.26 1vhj h PRO 4 N 1.32 0.81 -0.01 3.99 0.11 -2.02 -3.20 132.00 132.99 1vhj h PRO 4 Ca -0.44 -0.08 0.00 0.00 0.11 0.00 0.00 66.00 65.59 1vhj h PRO 4 Cb 1.26 -0.17 0.00 0.00 0.11 0.00 0.00 31.00 32.20 1vhj h PRO 4 CO 0.60 0.59 -0.31 0.72 -0.21 0.00 0.00 178.00 179.39 1vhj n HIS 5 N -4.39 0.00 -3.72 0.65 8.25 -1.26 -4.92 115.22 109.82 1vhj n HIS 5 Ca 0.06 0.00 -0.22 0.00 -0.26 0.00 0.00 57.72 57.30 1vhj n HIS 5 Cb 0.09 0.00 -0.18 0.00 1.12 0.00 0.00 29.99 31.03 1vhj n HIS 5 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 1vhj s ILE 6 N -1.74 0.16 -1.12 1.59 1.01 -1.21 -4.70 121.20 115.18 1vhj s ILE 6 Ca 0.11 0.26 -0.03 0.00 0.00 0.00 0.00 60.65 60.99 1vhj s ILE 6 Cb 0.11 -0.36 0.26 0.00 0.01 0.00 0.00 42.46 42.48 1vhj s ILE 6 CO 0.36 0.22 1.89 -0.46 0.00 0.00 0.00 174.94 176.95 1vhj n ASN 7 N 5.22 7.18 -4.11 3.58 6.94 -1.26 -2.16 115.26 130.64 1vhj n ASN 7 Ca -0.05 -3.48 -0.24 0.00 -0.02 0.00 0.00 54.58 50.79 1vhj n ASN 7 Cb 0.50 -1.25 -0.09 0.00 -2.36 0.00 0.00 39.78 36.58 1vhj n ASN 7 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1vhj s ALA 8 N -3.03 2.68 0.22 -2.53 0.00 -1.26 -4.68 121.76 113.17 1vhj s ALA 8 Ca 0.41 -1.43 0.09 0.00 0.00 0.00 0.00 51.96 51.02 1vhj s ALA 8 Cb 0.16 0.82 -0.04 0.00 0.00 0.00 0.00 23.12 24.05 1vhj s ALA 8 CO -0.07 -0.37 -0.05 -0.65 0.00 0.00 0.00 175.76 174.62 1vhj s GLN 9 N -3.74 2.19 0.22 0.00 -0.21 -1.26 -3.04 119.66 113.81 1vhj s GLN 9 Ca 0.27 -1.33 -0.32 0.00 0.02 0.00 0.00 55.36 54.00 1vhj s GLN 9 Cb 0.04 -2.17 -0.13 0.00 1.00 0.00 0.00 33.01 31.75 1vhj s GLN 9 CO 0.15 0.40 1.62 -0.12 -2.12 0.00 0.00 175.29 175.22 1vhj n MET 10 N -0.41 2.49 0.00 2.91 0.00 -1.26 -1.50 117.12 119.35 1vhj n MET 10 Ca -0.09 0.89 0.00 0.00 -0.00 0.00 0.00 57.70 58.51 1vhj n MET 10 Cb 0.57 -2.68 0.00 0.00 0.00 0.00 0.00 33.22 31.11 1vhj n MET 10 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1vhj n GLY 11 N 3.20 3.01 0.17 -5.12 0.00 -1.26 -4.94 105.19 100.25 1vhj n GLY 11 Ca 0.14 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.17 1vhj n GLY 11 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1vhj h ASP 12 N 0.00 0.01 -2.86 1.61 3.32 -1.64 -3.43 116.42 113.44 1vhj h ASP 12 Ca 0.00 -0.01 -0.63 0.00 0.02 0.00 0.00 57.03 56.41 1vhj h ASP 12 Cb 0.00 -0.00 -0.05 0.00 0.22 0.00 0.00 39.33 39.50 1vhj h ASP 12 CO 0.00 0.48 -0.45 -0.36 -1.72 0.00 0.00 179.24 177.19 1vhj s PHE 13 N -3.96 3.55 1.18 4.55 0.40 -1.26 -4.70 117.98 117.73 1vhj s PHE 13 Ca -0.02 0.42 -0.19 0.00 -0.60 0.00 0.00 56.93 56.55 1vhj s PHE 13 Cb 0.14 -1.88 0.28 0.00 0.51 0.00 0.00 43.02 42.06 1vhj s PHE 13 CO 0.74 0.62 1.12 0.00 0.70 0.00 0.00 175.22 178.41 1vhj s ALA 14 N -1.35 0.72 -1.04 5.36 0.00 -1.26 -4.93 121.76 119.27 1vhj s ALA 14 Ca 0.28 -0.93 0.29 0.00 0.00 0.00 0.00 51.96 51.60 1vhj s ALA 14 Cb -0.13 -2.89 1.16 0.00 0.00 0.00 0.00 23.12 21.26 1vhj s ALA 14 CO 0.19 -3.48 1.87 -0.40 0.00 0.00 0.00 175.76 173.94 1vhj n ASP 15 N -4.67 0.08 -4.19 0.00 3.85 -1.26 -4.64 116.55 105.72 1vhj n ASP 15 Ca 0.13 0.34 -0.29 0.00 -0.71 0.00 0.00 54.79 54.25 1vhj n ASP 15 Cb 0.59 -0.38 -0.17 0.00 -1.35 0.00 0.00 41.12 39.82 1vhj n ASP 15 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.20 176.73 1vhj s VAL 16 N -2.96 1.77 -0.07 2.12 0.11 -1.26 -0.15 120.40 119.96 1vhj s VAL 16 Ca 0.15 -0.88 0.02 0.00 -2.93 0.00 0.00 61.98 58.34 1vhj s VAL 16 Cb 0.19 -1.52 0.01 0.00 -1.53 0.00 0.00 36.38 33.53 1vhj s VAL 16 CO 0.55 0.50 -0.12 -0.69 -3.33 0.00 0.00 175.10 172.00 1vhj s VAL 17 N 0.16 1.16 0.02 2.04 1.01 -0.33 -2.26 120.40 122.19 1vhj s VAL 17 Ca -0.10 -0.48 -0.20 0.00 0.00 0.00 0.00 61.98 61.20 1vhj s VAL 17 Cb -0.15 -1.07 -0.06 0.00 0.00 0.00 0.00 36.38 35.10 1vhj s VAL 17 CO 0.05 0.37 0.57 -0.76 0.00 0.00 0.00 175.10 175.33 1vhj s LEU 18 N 0.78 4.45 -0.28 3.92 1.02 0.27 -1.15 118.68 127.70 1vhj s LEU 18 Ca -0.12 1.17 -0.03 0.00 0.02 0.00 0.00 54.13 55.16 1vhj s LEU 18 Cb -0.15 -2.88 0.09 0.00 0.02 0.00 0.00 46.19 43.26 1vhj s LEU 18 CO 0.02 0.16 0.11 -0.04 0.02 0.00 0.00 176.35 176.63 1vhj s MET 19 N -0.49 0.34 0.70 1.70 -1.94 0.73 -1.40 119.30 118.93 1vhj s MET 19 Ca 0.30 -0.61 -0.10 0.00 -1.71 0.00 0.00 55.69 53.56 1vhj s MET 19 Cb -0.18 -1.50 0.03 0.00 2.01 0.00 0.00 34.83 35.18 1vhj s MET 19 CO 0.17 -0.95 1.07 -1.25 -0.01 0.00 0.00 175.02 174.05 1vhj s PRO 20 N 1.97 2.68 0.05 2.03 0.04 -1.25 -1.21 135.00 139.30 1vhj s PRO 20 Ca 0.08 0.28 -0.16 0.00 0.04 0.00 0.00 61.00 61.23 1vhj s PRO 20 Cb -0.16 -2.06 -0.24 0.00 0.04 0.00 0.00 34.50 32.07 1vhj s PRO 20 CO -0.29 -1.08 1.14 0.78 0.04 0.00 0.00 177.00 177.59 1vhj h GLY 21 N -0.63 0.67 -4.61 0.56 0.00 -1.82 -2.58 103.07 94.65 1vhj h GLY 21 Ca -0.45 -1.20 -0.55 0.00 0.00 0.00 0.00 47.33 45.13 1vhj h GLY 21 CO 0.63 1.06 0.51 -0.35 0.00 0.00 0.00 176.54 178.39 1vhj s ASP 22 N -7.13 7.27 0.54 0.19 -1.08 -1.26 -1.76 116.67 113.44 1vhj s ASP 22 Ca -0.11 1.61 0.30 0.00 -0.52 0.00 0.00 52.55 53.83 1vhj s ASP 22 Cb 0.05 -2.56 1.53 0.00 -1.46 0.00 0.00 42.92 40.48 1vhj s ASP 22 CO 0.89 -0.39 2.08 1.55 0.52 0.00 0.00 175.17 179.82 1vhj h PRO 23 N 7.01 0.00 0.00 4.34 0.13 -1.87 -1.45 132.00 140.15 1vhj h PRO 23 Ca -0.35 0.00 -0.13 0.00 -0.87 0.00 0.00 66.00 64.65 1vhj h PRO 23 Cb 1.18 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.29 1vhj h PRO 23 CO 0.82 0.09 -0.61 -0.07 -0.23 0.00 0.00 178.00 178.00 1vhj h LEU 24 N 0.00 0.00 -0.47 1.56 3.38 -1.92 -1.97 115.31 115.89 1vhj h LEU 24 Ca -0.00 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.80 1vhj h LEU 24 Cb 0.35 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.09 1vhj h LEU 24 CO 0.01 0.61 -0.65 0.03 0.09 0.00 0.00 178.44 178.53 1vhj h ARG 25 N 0.00 0.44 -0.67 1.13 2.47 -1.68 0.10 114.38 116.16 1vhj h ARG 25 Ca -0.01 -0.33 -0.07 0.00 -1.26 0.00 0.00 59.98 58.32 1vhj h ARG 25 Cb 1.29 0.06 -0.03 0.00 -1.65 0.00 0.00 29.97 29.64 1vhj h ARG 25 CO 0.08 0.95 0.14 0.00 0.56 0.00 0.00 179.97 181.70 1vhj h ALA 26 N 0.97 0.89 -0.53 0.04 0.00 -1.19 -0.05 119.26 119.39 1vhj h ALA 26 Ca -0.02 -0.25 -0.04 0.00 0.00 0.00 0.00 54.91 54.60 1vhj h ALA 26 Cb 1.21 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.72 1vhj h ALA 26 CO 0.11 0.62 0.16 -0.22 0.00 0.00 0.00 179.25 179.93 1vhj h LYS 27 N 1.01 0.82 -0.41 0.00 3.64 -1.23 -1.07 116.57 119.33 1vhj h LYS 27 Ca 0.21 -0.18 0.01 0.00 -1.27 0.00 0.00 60.65 59.42 1vhj h LYS 27 Cb 0.39 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 32.07 1vhj h LYS 27 CO 0.01 0.76 0.26 -0.92 -2.27 0.00 0.00 179.45 177.29 1vhj h TYR 28 N 0.72 0.50 -0.22 1.91 5.03 -0.70 -1.72 116.97 122.50 1vhj h TYR 28 Ca 0.17 0.01 -0.01 0.00 2.58 0.00 0.00 58.73 61.48 1vhj h TYR 28 Cb 0.28 -0.17 -0.01 0.00 1.55 0.00 0.00 36.73 38.39 1vhj h TYR 28 CO 0.02 0.31 0.08 0.82 -1.32 0.00 0.00 178.16 178.06 1vhj h ILE 29 N 0.54 1.18 -0.80 1.81 2.04 -0.85 -0.71 117.51 120.71 1vhj h ILE 29 Ca 0.16 -0.55 0.03 0.00 1.00 0.00 0.00 64.86 65.50 1vhj h ILE 29 Cb -0.04 1.13 -0.05 0.00 -0.74 0.00 0.00 36.82 37.12 1vhj h ILE 29 CO -0.05 0.18 0.52 0.00 0.00 0.00 0.00 178.15 178.80 1vhj h ALA 30 N 0.91 1.05 0.00 1.87 0.00 -1.08 0.37 119.26 122.38 1vhj h ALA 30 Ca 0.07 -0.04 -0.22 0.00 0.00 0.00 0.00 54.91 54.73 1vhj h ALA 30 Cb 0.20 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 17.71 1vhj h ALA 30 CO -0.00 0.35 -0.92 0.93 0.00 0.00 0.00 179.25 179.60 1vhj h GLU 31 N 1.02 0.34 0.00 0.00 5.08 -1.18 -3.18 114.58 116.66 1vhj h GLU 31 Ca 0.32 -0.37 -0.02 0.00 -1.00 0.00 0.00 59.36 58.29 1vhj h GLU 31 Cb -0.02 0.11 -0.00 0.00 0.50 0.00 0.00 28.75 29.34 1vhj h GLU 31 CO -0.10 1.06 -2.00 0.09 -1.00 0.00 0.00 179.01 177.05 1vhj n ASN 32 N -3.72 0.02 -0.01 1.42 3.02 -0.28 -4.67 115.26 111.04 1vhj n ASN 32 Ca -0.06 0.01 0.01 0.00 -0.03 0.00 0.00 54.58 54.51 1vhj n ASN 32 Cb 0.83 1.92 -0.03 0.00 -0.61 0.00 0.00 39.78 41.89 1vhj n ASN 32 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 1vhj n PHE 33 N -2.29 0.00 -4.01 3.10 3.01 0.10 -5.03 117.46 112.33 1vhj n PHE 33 Ca -0.05 0.00 -0.25 0.00 1.01 0.00 0.00 57.45 58.16 1vhj n PHE 33 Cb 0.60 -0.10 -0.04 0.00 -0.01 0.00 0.00 39.48 39.93 1vhj n PHE 33 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 1vhj s LEU 34 N -3.52 4.10 -0.16 4.37 1.43 -1.16 -4.83 118.68 118.92 1vhj s LEU 34 Ca -0.01 0.01 -0.12 0.00 -1.03 0.00 0.00 54.13 52.98 1vhj s LEU 34 Cb 0.02 -2.68 -0.05 0.00 0.03 0.00 0.00 46.19 43.51 1vhj s LEU 34 CO 0.15 0.03 0.22 -1.81 0.23 0.00 0.00 176.35 175.17 1vhj s ASP 35 N -3.37 6.37 -1.38 2.29 1.01 0.71 -4.56 116.67 117.73 1vhj s ASP 35 Ca 0.33 0.43 -0.05 0.00 0.71 0.00 0.00 52.55 53.97 1vhj s ASP 35 Cb -0.10 -2.14 0.03 0.00 1.01 0.00 0.00 42.92 41.72 1vhj s ASP 35 CO 0.27 0.18 0.80 0.59 0.21 0.00 0.00 175.17 177.22 1vhj n ASN 36 N 3.25 -2.43 -4.74 0.27 3.02 -1.26 -1.65 115.26 111.72 1vhj n ASN 36 Ca -0.15 -0.80 -0.41 0.00 -0.03 0.00 0.00 54.58 53.20 1vhj n ASN 36 Cb 0.52 -4.03 -0.04 0.00 -0.61 0.00 0.00 39.78 35.62 1vhj n ASN 36 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1vhj s ALA 37 N -3.55 3.41 -0.04 5.41 0.00 -1.26 -4.55 121.76 121.19 1vhj s ALA 37 Ca 0.22 0.90 0.05 0.00 0.00 0.00 0.00 51.96 53.14 1vhj s ALA 37 Cb -0.11 -3.38 -0.01 0.00 0.00 0.00 0.00 23.12 19.62 1vhj s ALA 37 CO 0.82 -0.30 -0.20 0.54 0.00 0.00 0.00 175.76 176.62 1vhj s VAL 38 N -0.25 1.63 0.14 0.00 0.11 -0.05 -4.91 120.40 117.06 1vhj s VAL 38 Ca 0.51 -0.85 -0.31 0.00 -2.93 0.00 0.00 61.98 58.40 1vhj s VAL 38 Cb -0.32 -1.38 -0.09 0.00 -1.53 0.00 0.00 36.38 33.06 1vhj s VAL 38 CO 0.37 0.46 1.57 -1.58 -3.33 0.00 0.00 175.10 172.59 1vhj s GLN 39 N -0.18 4.22 -0.00 1.54 0.74 -1.26 -0.98 119.66 123.74 1vhj s GLN 39 Ca 0.00 2.32 0.06 0.00 0.05 0.00 0.00 55.36 57.79 1vhj s GLN 39 Cb -0.11 -3.27 -0.07 0.00 1.10 0.00 0.00 33.01 30.66 1vhj s GLN 39 CO 0.01 -0.62 0.21 1.33 -0.55 0.00 0.00 175.29 175.68 1vhj n VAL 40 N 4.15 0.00 -3.64 1.34 0.24 0.31 -4.93 118.33 115.81 1vhj n VAL 40 Ca 0.14 -0.31 -0.15 0.00 -2.04 0.00 0.00 64.34 61.98 1vhj n VAL 40 Cb 0.39 0.85 -0.07 0.00 -1.47 0.00 0.00 33.84 33.55 1vhj n VAL 40 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1vhj n ASP 42 N 0.87 0.00 -4.65 0.00 3.85 -1.26 -2.51 116.55 112.85 1vhj n ASP 42 Ca -0.20 -1.00 -0.45 0.00 -0.71 0.00 0.00 54.79 52.43 1vhj n ASP 42 Cb 0.58 0.00 -0.02 0.00 -1.35 0.00 0.00 41.12 40.32 1vhj n ASP 42 CO 0.00 0.00 0.00 0.52 -1.01 0.00 0.00 177.20 176.71 1vhj n VAL 43 N 0.00 1.28 -1.98 2.12 0.31 -1.26 -0.93 118.33 117.88 1vhj n VAL 43 Ca 0.00 -0.32 -0.14 0.00 -0.01 0.00 0.00 64.34 63.87 1vhj n VAL 43 Cb 0.39 -1.33 -0.03 0.00 -0.91 0.00 0.00 33.84 31.96 1vhj n VAL 43 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 1vhj n ARG 44 N 1.53 -1.75 -1.27 5.55 1.74 -1.26 -1.16 116.66 120.04 1vhj n ARG 44 Ca 0.11 0.76 -0.09 0.00 -0.77 0.00 0.00 57.85 57.86 1vhj n ARG 44 Cb 0.31 -5.22 -0.04 0.00 -1.02 0.00 0.00 32.46 26.49 1vhj n ARG 44 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 1vhj n ASN 45 N -1.31 -5.30 -4.46 0.55 3.02 -0.10 -4.91 115.26 102.75 1vhj n ASN 45 Ca -0.16 0.23 -0.44 0.00 -0.03 0.00 0.00 54.58 54.18 1vhj n ASN 45 Cb 0.56 -3.60 -0.00 0.00 -0.61 0.00 0.00 39.78 36.12 1vhj n ASN 45 CO 0.00 0.00 0.00 -0.32 -2.62 0.00 0.00 177.26 174.32 1vhj s MET 46 N -2.62 4.06 0.32 3.52 1.75 -0.31 -4.82 119.30 121.21 1vhj s MET 46 Ca 0.00 -2.53 -0.29 0.00 -1.25 0.00 0.00 55.69 51.62 1vhj s MET 46 Cb 0.00 -5.06 -0.12 0.00 2.84 0.00 0.00 34.83 32.50 1vhj s MET 46 CO 0.00 -1.77 1.51 1.19 -0.65 0.00 0.00 175.02 175.30 1vhj n PHE 47 N 5.72 2.78 -3.87 4.11 0.99 -1.26 -4.35 117.46 121.59 1vhj n PHE 47 Ca 0.36 0.37 -0.12 0.00 -0.00 0.00 0.00 57.45 58.06 1vhj n PHE 47 Cb 0.43 -2.54 -0.13 0.00 -1.00 0.00 0.00 39.48 36.23 1vhj n PHE 47 CO 0.00 0.00 0.00 0.20 -0.00 0.00 0.00 176.76 176.96 1vhj s GLY 48 N 0.16 0.00 0.08 1.37 0.00 -1.04 -1.90 107.32 106.00 1vhj s GLY 48 Ca 0.59 0.01 0.02 0.00 0.00 0.00 0.00 44.72 45.35 1vhj s GLY 48 CO 0.56 -0.01 -0.07 -0.19 0.00 0.00 0.00 173.10 173.39 1vhj s TYR 49 N -0.14 0.82 -0.06 1.90 1.51 0.10 -0.53 117.35 120.96 1vhj s TYR 49 Ca -0.02 -0.80 -0.00 0.00 -1.01 0.00 0.00 57.07 55.24 1vhj s TYR 49 Cb -0.01 -0.48 0.03 0.00 -0.11 0.00 0.00 41.96 41.38 1vhj s TYR 49 CO -0.00 -0.14 -0.02 0.99 -1.11 0.00 0.00 175.55 175.27 1vhj s THR 50 N -3.01 0.47 0.00 -0.71 2.01 -0.16 -1.23 115.64 113.02 1vhj s THR 50 Ca 0.06 -0.01 0.00 0.00 0.31 0.00 0.00 61.69 62.05 1vhj s THR 50 Cb 0.01 -0.56 0.00 0.00 0.01 0.00 0.00 72.50 71.96 1vhj s THR 50 CO -0.03 0.25 0.00 0.61 -0.69 0.00 0.00 174.62 174.75 1vhj n GLY 51 N 4.61 4.68 3.18 4.40 0.00 -0.72 -0.87 105.19 120.47 1vhj n GLY 51 Ca -0.16 -1.10 -0.17 0.00 0.00 0.00 0.00 46.02 44.59 1vhj n GLY 51 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1vhj s THR 52 N -0.68 1.07 -0.23 2.61 -4.23 -0.66 -1.47 115.64 112.06 1vhj s THR 52 Ca 0.00 -1.47 0.01 0.00 -1.18 0.00 0.00 61.69 59.05 1vhj s THR 52 Cb 0.00 -1.22 0.06 0.00 1.34 0.00 0.00 72.50 72.68 1vhj s THR 52 CO 0.00 -0.37 -0.06 -0.47 -0.54 0.00 0.00 174.62 173.18 1vhj s TYR 53 N -1.79 2.41 -1.47 3.99 6.14 0.76 -0.21 117.35 127.17 1vhj s TYR 53 Ca 0.02 -1.74 -0.11 0.00 0.64 0.00 0.00 57.07 55.88 1vhj s TYR 53 Cb -0.07 -1.59 0.06 0.00 0.42 0.00 0.00 41.96 40.78 1vhj s TYR 53 CO 0.02 -0.77 0.99 1.63 0.64 0.00 0.00 175.55 178.06 1vhj n LYS 54 N 4.67 -5.92 0.00 4.97 5.02 -1.26 -0.33 118.16 125.31 1vhj n LYS 54 Ca -0.12 0.65 0.00 0.00 -2.02 0.00 0.00 58.31 56.81 1vhj n LYS 54 Cb 0.44 -5.53 0.00 0.00 -0.02 0.00 0.00 35.03 29.92 1vhj n LYS 54 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1vhj n GLY 55 N -1.73 2.50 3.69 0.72 0.00 -1.26 -5.02 105.19 104.10 1vhj n GLY 55 Ca -0.01 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.63 1vhj n GLY 55 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1vhj s ARG 56 N -0.22 4.25 0.09 1.61 3.00 0.55 -5.01 118.95 123.22 1vhj s ARG 56 Ca 0.00 0.34 -0.31 0.00 -1.00 0.00 0.00 55.73 54.76 1vhj s ARG 56 Cb 0.00 -3.49 -0.08 0.00 0.00 0.00 0.00 34.95 31.38 1vhj s ARG 56 CO 0.00 0.04 1.44 0.50 0.00 0.00 0.00 175.30 177.28 1vhj s ARG 57 N 1.04 4.29 -0.06 5.12 3.52 -1.26 -0.17 118.95 131.42 1vhj s ARG 57 Ca 0.23 2.11 -0.06 0.00 -0.13 0.00 0.00 55.73 57.87 1vhj s ARG 57 Cb -0.15 -3.36 0.02 0.00 -1.56 0.00 0.00 34.95 29.90 1vhj s ARG 57 CO 0.09 -0.52 0.17 0.42 -0.81 0.00 0.00 175.30 174.65 1vhj s ILE 58 N 1.59 -0.00 0.29 4.11 1.01 -0.54 -4.72 121.20 122.93 1vhj s ILE 58 Ca 0.66 0.00 0.09 0.00 0.00 0.00 0.00 60.65 61.40 1vhj s ILE 58 Cb -0.37 -0.24 -0.04 0.00 0.01 0.00 0.00 42.46 41.82 1vhj s ILE 58 CO 0.30 0.00 0.09 -0.44 0.00 0.00 0.00 174.94 174.89 1vhj s SER 59 N 0.11 4.82 -0.11 3.58 0.01 -0.96 -1.76 113.70 119.40 1vhj s SER 59 Ca -0.00 -0.59 -0.05 0.00 1.31 0.00 0.00 55.95 56.62 1vhj s SER 59 Cb -0.01 -0.94 0.05 0.00 0.21 0.00 0.00 66.02 65.33 1vhj s SER 59 CO 0.00 -0.10 0.24 0.54 0.41 0.00 0.00 173.24 174.33 1vhj s VAL 60 N -2.31 -0.15 -0.15 3.43 0.11 -0.36 -0.56 120.40 120.41 1vhj s VAL 60 Ca 0.34 0.19 -0.15 0.00 -2.93 0.00 0.00 61.98 59.44 1vhj s VAL 60 Cb -0.06 -0.39 0.04 0.00 -1.53 0.00 0.00 36.38 34.45 1vhj s VAL 60 CO 0.22 0.08 0.41 -0.32 -3.33 0.00 0.00 175.10 172.16 1vhj s MET 61 N 1.61 0.50 0.72 1.54 1.75 -0.50 0.03 119.30 124.95 1vhj s MET 61 Ca -0.06 0.55 -0.13 0.00 -1.25 0.00 0.00 55.69 54.79 1vhj s MET 61 Cb -0.11 0.24 0.03 0.00 2.84 0.00 0.00 34.83 37.84 1vhj s MET 61 CO -0.08 -0.06 1.12 0.20 -0.65 0.00 0.00 175.02 175.55 1vhj s GLY 62 N 0.15 2.02 0.00 2.11 0.00 -0.80 -3.90 107.32 106.91 1vhj s GLY 62 Ca -0.01 0.53 0.00 0.00 0.00 0.00 0.00 44.72 45.24 1vhj s GLY 62 CO 0.01 0.90 0.43 -2.39 0.00 0.00 0.00 173.10 172.04 1vhj n HIS 63 N -2.92 0.00 -4.09 1.90 1.44 -0.97 -4.88 115.22 105.69 1vhj n HIS 63 Ca 0.11 -0.06 0.00 0.00 -2.01 0.00 0.00 57.72 55.76 1vhj n HIS 63 Cb 0.52 -0.01 0.00 0.00 0.12 0.00 0.00 29.99 30.62 1vhj n HIS 63 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 1vhj n GLY 64 N -0.06 -1.74 3.51 -1.39 0.00 -0.72 -3.17 105.19 101.61 1vhj n GLY 64 Ca 0.00 -1.35 -0.34 0.00 0.00 0.00 0.00 46.02 44.34 1vhj n GLY 64 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1vhj s MET 65 N 0.00 3.21 0.00 1.61 1.00 -1.26 -4.61 119.30 119.25 1vhj s MET 65 Ca 0.00 -0.57 0.00 0.00 0.00 0.00 0.00 55.69 55.12 1vhj s MET 65 Cb 0.00 -2.71 0.00 0.00 0.00 0.00 0.00 34.83 32.12 1vhj s MET 65 CO 0.00 0.42 0.00 0.41 0.00 0.00 0.00 175.02 175.85 1vhj n GLY 66 N 2.95 0.57 0.34 -0.03 0.00 -1.26 -4.45 105.19 103.31 1vhj n GLY 66 Ca -0.18 -1.75 -0.11 0.00 0.00 0.00 0.00 46.02 43.98 1vhj n GLY 66 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1vhj h ILE 67 N 0.00 0.27 -0.70 -0.61 2.04 -1.82 -1.77 117.51 114.92 1vhj h ILE 67 Ca 0.00 0.00 0.10 0.00 1.00 0.00 0.00 64.86 65.96 1vhj h ILE 67 Cb 0.00 0.27 -0.07 0.00 -0.74 0.00 0.00 36.82 36.28 1vhj h ILE 67 CO 0.00 0.00 0.34 -0.65 0.00 0.00 0.00 178.15 177.84 1vhj h PRO 68 N -0.43 0.56 -0.10 2.37 0.11 -1.92 0.85 132.00 133.44 1vhj h PRO 68 Ca 0.08 -0.03 -0.02 0.00 0.11 0.00 0.00 66.00 66.13 1vhj h PRO 68 Cb 0.56 -0.13 -0.00 0.00 0.11 0.00 0.00 31.00 31.54 1vhj h PRO 68 CO -0.33 0.37 -0.03 1.03 -0.21 0.00 0.00 178.00 178.83 1vhj h SER 69 N 0.58 0.19 -0.95 -2.05 0.87 -1.73 -2.68 113.55 107.79 1vhj h SER 69 Ca 0.35 -0.39 -0.00 0.00 -1.23 0.00 0.00 61.79 60.52 1vhj h SER 69 Cb 0.38 -0.05 -0.05 0.00 -0.44 0.00 0.00 62.40 62.24 1vhj h SER 69 CO -0.28 0.54 0.59 0.00 -0.53 0.00 0.00 176.83 177.15 1vhj h SER 71 N 1.30 1.04 0.27 0.00 0.02 -0.81 -1.02 113.55 114.36 1vhj h SER 71 Ca 0.34 -0.15 -0.01 0.00 -0.84 0.00 0.00 61.79 61.13 1vhj h SER 71 Cb -0.08 -0.27 0.00 0.00 0.14 0.00 0.00 62.40 62.20 1vhj h SER 71 CO -0.07 0.90 -0.13 0.40 -1.14 0.00 0.00 176.83 176.80 1vhj h ILE 72 N 1.11 0.74 0.16 3.27 2.04 -1.05 0.66 117.51 124.44 1vhj h ILE 72 Ca 0.26 -0.03 -0.01 0.00 1.00 0.00 0.00 64.86 66.08 1vhj h ILE 72 Cb 0.16 0.76 0.00 0.00 -0.74 0.00 0.00 36.82 37.00 1vhj h ILE 72 CO -0.03 0.01 -0.08 1.88 0.00 0.00 0.00 178.15 179.93 1vhj h TYR 73 N -0.38 -0.21 -0.42 1.37 0.05 -1.35 -0.69 116.97 115.34 1vhj h TYR 73 Ca -0.04 -0.00 -0.06 0.00 0.05 0.00 0.00 58.73 58.67 1vhj h TYR 73 Cb 0.29 0.07 -0.02 0.00 1.01 0.00 0.00 36.73 38.08 1vhj h TYR 73 CO -0.05 -0.01 -0.00 -0.39 -1.05 0.00 0.00 178.16 176.65 1vhj h VAL 74 N -0.37 1.23 -0.20 -2.88 -1.51 -1.20 -0.06 116.25 111.26 1vhj h VAL 74 Ca -0.02 -0.93 0.02 0.00 -1.23 0.00 0.00 66.70 64.54 1vhj h VAL 74 Cb 0.29 0.91 -0.02 0.00 -2.13 0.00 0.00 31.29 30.33 1vhj h VAL 74 CO 0.04 0.32 0.05 0.74 -1.23 0.00 0.00 177.57 177.49 1vhj h THR 75 N 0.65 0.92 -0.54 7.19 2.02 -0.68 -1.46 112.91 121.01 1vhj h THR 75 Ca 0.13 -0.05 -0.08 0.00 0.77 0.00 0.00 66.41 67.19 1vhj h THR 75 Cb 0.41 0.77 -0.02 0.00 -1.74 0.00 0.00 68.15 67.57 1vhj h THR 75 CO 0.02 0.02 0.03 -0.33 0.37 0.00 0.00 175.52 175.63 1vhj h GLU 76 N 0.14 0.91 -0.71 6.66 5.08 -0.64 -1.48 114.58 124.52 1vhj h GLU 76 Ca 0.09 -0.25 0.03 0.00 -1.00 0.00 0.00 59.36 58.23 1vhj h GLU 76 Cb 0.08 -0.10 -0.04 0.00 0.50 0.00 0.00 28.75 29.18 1vhj h GLU 76 CO -0.11 0.88 0.45 -0.07 -1.00 0.00 0.00 179.01 179.16 1vhj h LEU 77 N 0.84 0.74 0.35 1.33 3.38 -0.56 -0.83 115.31 120.57 1vhj h LEU 77 Ca 0.16 -0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.11 1vhj h LEU 77 Cb 0.46 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 41.05 1vhj h LEU 77 CO 0.02 0.52 -0.17 0.40 0.09 0.00 0.00 178.44 179.30 1vhj h ILE 78 N 0.88 0.27 0.00 1.22 2.04 -1.12 -0.88 117.51 119.92 1vhj h ILE 78 Ca 0.28 -0.73 -0.05 0.00 1.00 0.00 0.00 64.86 65.36 1vhj h ILE 78 Cb 0.01 0.44 -0.01 0.00 -0.74 0.00 0.00 36.82 36.52 1vhj h ILE 78 CO -0.10 0.07 -0.26 0.07 0.00 0.00 0.00 178.15 177.92 1vhj h LYS 79 N -1.05 0.00 0.00 2.37 2.10 -1.33 -2.98 116.57 115.68 1vhj h LYS 79 Ca -0.05 0.00 -0.06 0.00 -2.00 0.00 0.00 60.65 58.54 1vhj h LYS 79 Cb 0.46 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.78 1vhj h LYS 79 CO 0.08 0.26 -1.55 -0.25 -2.00 0.00 0.00 179.45 175.98 1vhj n ASP 80 N -3.27 2.56 -0.22 7.07 8.00 -0.33 -4.70 116.55 125.66 1vhj n ASP 80 Ca 0.01 0.00 0.02 0.00 0.71 0.00 0.00 54.79 55.53 1vhj n ASP 80 Cb 0.53 1.24 0.05 0.00 -0.02 0.00 0.00 41.12 42.92 1vhj n ASP 80 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 1vhj n TYR 81 N -2.04 0.15 -2.08 1.24 4.02 -0.40 -4.68 117.16 113.37 1vhj n TYR 81 Ca -0.07 -0.46 -0.19 0.00 -0.01 0.00 0.00 57.90 57.18 1vhj n TYR 81 Cb 0.46 -0.04 -0.03 0.00 -0.02 0.00 0.00 39.34 39.71 1vhj n TYR 81 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1vhj n GLY 82 N -0.11 0.36 3.74 2.72 0.00 -0.99 -4.64 105.19 106.27 1vhj n GLY 82 Ca 0.04 -0.11 -0.41 0.00 0.00 0.00 0.00 46.02 45.54 1vhj n GLY 82 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1vhj s VAL 83 N -2.85 3.28 -0.17 1.61 1.01 -0.80 -4.80 120.40 117.68 1vhj s VAL 83 Ca 0.00 1.10 0.09 0.00 0.00 0.00 0.00 61.98 63.17 1vhj s VAL 83 Cb 0.00 -3.70 -0.17 0.00 0.00 0.00 0.00 36.38 32.51 1vhj s VAL 83 CO 0.00 0.19 -0.04 0.29 0.00 0.00 0.00 175.10 175.54 1vhj n LYS 84 N 2.24 1.07 -4.48 2.72 4.76 0.79 -4.48 118.16 120.78 1vhj n LYS 84 Ca 0.04 0.04 -0.22 0.00 -2.87 0.00 0.00 58.31 55.31 1vhj n LYS 84 Cb 0.43 -1.40 -0.16 0.00 -1.84 0.00 0.00 35.03 32.07 1vhj n LYS 84 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 1vhj s LYS 85 N -2.38 1.19 -0.11 1.97 1.02 -0.81 -1.38 119.74 119.25 1vhj s LYS 85 Ca -0.15 -0.36 0.03 0.00 0.02 0.00 0.00 55.97 55.51 1vhj s LYS 85 Cb 0.06 -1.08 0.01 0.00 -0.52 0.00 0.00 37.83 36.30 1vhj s LYS 85 CO 0.56 0.11 -0.21 0.42 -0.92 0.00 0.00 175.35 175.31 1vhj s ILE 86 N 0.28 1.87 -0.29 2.17 -1.09 -0.38 -1.19 121.20 122.57 1vhj s ILE 86 Ca -0.05 -0.89 0.02 0.00 -2.23 0.00 0.00 60.65 57.49 1vhj s ILE 86 Cb -0.10 -1.65 0.07 0.00 -1.58 0.00 0.00 42.46 39.20 1vhj s ILE 86 CO 0.01 0.52 -0.05 -0.63 -1.23 0.00 0.00 174.94 173.56 1vhj s ILE 87 N 0.59 2.38 0.12 2.92 1.01 -0.30 -1.45 121.20 126.47 1vhj s ILE 87 Ca -0.14 -1.76 -0.30 0.00 0.00 0.00 0.00 60.65 58.45 1vhj s ILE 87 Cb -0.17 -2.48 -0.06 0.00 0.01 0.00 0.00 42.46 39.76 1vhj s ILE 87 CO 0.04 -0.19 0.98 -0.60 0.00 0.00 0.00 174.94 175.17 1vhj s ARG 88 N 1.09 4.69 -0.03 2.79 3.52 0.11 -0.19 118.95 130.91 1vhj s ARG 88 Ca -0.04 1.48 0.05 0.00 -0.13 0.00 0.00 55.73 57.10 1vhj s ARG 88 Cb -0.20 -3.37 -0.01 0.00 -1.56 0.00 0.00 34.95 29.82 1vhj s ARG 88 CO -0.05 0.20 -0.17 0.14 -0.81 0.00 0.00 175.30 174.60 1vhj s VAL 89 N -0.02 1.43 0.00 7.11 -7.23 -0.35 -0.15 120.40 121.20 1vhj s VAL 89 Ca 0.47 -0.73 0.00 0.00 -1.81 0.00 0.00 61.98 59.91 1vhj s VAL 89 Cb -0.24 -1.22 0.00 0.00 0.56 0.00 0.00 36.38 35.48 1vhj s VAL 89 CO 0.30 0.41 0.00 0.61 -0.31 0.00 0.00 175.10 176.11 1vhj n GLY 90 N 3.00 0.87 3.85 2.32 0.00 -0.78 -3.92 105.19 110.52 1vhj n GLY 90 Ca -0.17 -0.80 -0.30 0.00 0.00 0.00 0.00 46.02 44.75 1vhj n GLY 90 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1vhj s SER 91 N -0.29 5.95 0.14 1.61 0.01 -1.26 -1.29 113.70 118.57 1vhj s SER 91 Ca 0.00 0.11 -0.05 0.00 1.31 0.00 0.00 55.95 57.33 1vhj s SER 91 Cb 0.00 -1.72 -0.03 0.00 0.21 0.00 0.00 66.02 64.49 1vhj s SER 91 CO 0.00 0.15 0.16 0.00 0.41 0.00 0.00 173.24 173.95 1vhj s GLY 93 N -3.00 2.04 0.04 0.00 0.00 -0.28 -0.94 107.32 105.18 1vhj s GLY 93 Ca 0.20 -0.74 0.01 0.00 0.00 0.00 0.00 44.72 44.19 1vhj s GLY 93 CO 0.00 -0.52 0.13 0.00 0.00 0.00 0.00 173.10 172.71 1vhj s ALA 94 N -1.04 3.76 0.00 3.20 0.00 0.27 0.50 121.76 128.45 1vhj s ALA 94 Ca 0.17 -0.89 0.00 0.00 0.00 0.00 0.00 51.96 51.23 1vhj s ALA 94 Cb -0.12 -1.65 0.00 0.00 0.00 0.00 0.00 23.12 21.35 1vhj s ALA 94 CO 0.06 0.76 0.00 1.33 0.00 0.00 0.00 175.76 177.91 1vhj n VAL 95 N 0.64 0.00 -4.12 0.00 0.24 -1.26 -0.82 118.33 113.01 1vhj n VAL 95 Ca -0.09 -0.40 -0.31 0.00 -2.04 0.00 0.00 64.34 61.50 1vhj n VAL 95 Cb 0.52 0.92 -0.07 0.00 -1.47 0.00 0.00 33.84 33.73 1vhj n VAL 95 CO 0.00 0.00 0.00 0.21 -2.14 0.00 0.00 176.83 174.90 1vhj s ASN 96 N -1.09 5.43 0.41 -1.34 3.84 -1.26 -4.69 114.94 116.24 1vhj s ASN 96 Ca 0.00 0.01 0.11 0.00 0.21 0.00 0.00 52.86 53.19 1vhj s ASN 96 Cb 0.00 -1.46 0.86 0.00 -0.55 0.00 0.00 41.25 40.10 1vhj s ASN 96 CO 0.00 0.22 1.95 1.05 -2.79 0.00 0.00 177.10 177.53 1vhj h GLU 97 N 3.71 0.19 -0.07 0.43 -0.00 -1.97 -2.89 114.58 113.97 1vhj h GLU 97 Ca -0.48 -0.04 0.00 0.00 -0.00 0.00 0.00 59.36 58.84 1vhj h GLU 97 Cb 1.17 -0.03 0.00 0.00 -0.00 0.00 0.00 28.75 29.89 1vhj h GLU 97 CO 0.63 0.32 0.00 0.41 -0.00 0.00 0.00 179.01 180.36 1vhj n GLY 98 N -0.96 -0.64 3.03 1.06 0.00 -1.26 -4.71 105.19 101.70 1vhj n GLY 98 Ca -0.01 -0.10 -0.28 0.00 0.00 0.00 0.00 46.02 45.64 1vhj n GLY 98 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1vhj s ILE 99 N -1.90 1.38 0.18 -0.61 1.01 -1.09 -5.14 121.20 115.02 1vhj s ILE 99 Ca 0.08 -0.56 0.07 0.00 0.00 0.00 0.00 60.65 60.24 1vhj s ILE 99 Cb 0.04 -1.28 -0.04 0.00 0.01 0.00 0.00 42.46 41.19 1vhj s ILE 99 CO 0.06 0.42 0.02 -1.59 0.00 0.00 0.00 174.94 173.85 1vhj s LYS 100 N 1.07 2.47 0.35 2.79 0.00 -1.26 -4.82 119.74 120.35 1vhj s LYS 100 Ca -0.05 -1.09 -0.27 0.00 0.00 0.00 0.00 55.97 54.56 1vhj s LYS 100 Cb -0.15 -2.39 -0.12 0.00 0.00 0.00 0.00 37.83 35.17 1vhj s LYS 100 CO -0.02 0.45 1.08 1.33 0.00 0.00 0.00 175.35 178.19 1vhj n VAL 101 N -0.21 2.17 -0.99 1.79 0.24 -1.26 -0.89 118.33 119.17 1vhj n VAL 101 Ca -0.09 -0.50 0.00 0.00 -2.04 0.00 0.00 64.34 61.71 1vhj n VAL 101 Cb 0.55 -1.20 0.00 0.00 -1.47 0.00 0.00 33.84 31.72 1vhj n VAL 101 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 1vhj n ARG 102 N 0.46 -0.00 -2.26 7.34 1.74 0.12 -4.94 116.66 119.11 1vhj n ARG 102 Ca 0.08 0.00 -0.35 0.00 -0.77 0.00 0.00 57.85 56.81 1vhj n ARG 102 Cb 0.36 -2.57 0.00 0.00 -1.02 0.00 0.00 32.46 29.23 1vhj n ARG 102 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1vhj s ASP 103 N -2.91 5.75 -0.33 0.55 1.11 -0.07 -4.64 116.67 116.13 1vhj s ASP 103 Ca 0.00 2.15 -0.12 0.00 0.18 0.00 0.00 52.55 54.76 1vhj s ASP 103 Cb 0.00 -2.58 -0.02 0.00 1.07 0.00 0.00 42.92 41.39 1vhj s ASP 103 CO 0.00 -1.20 0.22 -0.69 1.18 0.00 0.00 175.17 174.68 1vhj s VAL 104 N -1.81 5.17 0.03 -1.27 1.01 -1.26 -0.73 120.40 121.55 1vhj s VAL 104 Ca 0.72 -0.19 0.05 0.00 0.00 0.00 0.00 61.98 62.56 1vhj s VAL 104 Cb -0.23 -3.63 -0.03 0.00 0.00 0.00 0.00 36.38 32.49 1vhj s VAL 104 CO 0.27 0.04 -0.10 0.68 0.00 0.00 0.00 175.10 175.99 1vhj s VAL 105 N 1.71 3.37 -0.14 2.92 -7.23 0.19 -0.88 120.40 120.33 1vhj s VAL 105 Ca 0.06 -0.97 0.02 0.00 -1.81 0.00 0.00 61.98 59.28 1vhj s VAL 105 Cb -0.17 -2.47 0.01 0.00 0.56 0.00 0.00 36.38 34.30 1vhj s VAL 105 CO 0.10 0.33 -0.20 -0.63 -0.31 0.00 0.00 175.10 174.39 1vhj s ILE 106 N -1.01 2.23 -0.88 -0.62 1.01 0.79 -0.41 121.20 122.31 1vhj s ILE 106 Ca 0.17 -0.93 -0.21 0.00 0.00 0.00 0.00 60.65 59.68 1vhj s ILE 106 Cb -0.11 -1.90 0.09 0.00 0.01 0.00 0.00 42.46 40.55 1vhj s ILE 106 CO 0.08 0.54 1.19 -0.83 0.00 0.00 0.00 174.94 175.92 1vhj s GLY 107 N 0.73 1.54 0.28 6.18 0.00 -0.83 -1.59 107.32 113.64 1vhj s GLY 107 Ca -0.08 -2.32 -0.01 0.00 0.00 0.00 0.00 44.72 42.31 1vhj s GLY 107 CO 0.00 2.25 1.81 1.98 0.00 0.00 0.00 173.10 179.15 1vhj h MET 108 N 9.35 0.80 -4.82 2.90 4.05 -1.53 -3.38 114.93 122.29 1vhj h MET 108 Ca 0.03 -0.17 -0.28 0.00 -0.28 0.00 0.00 59.70 58.99 1vhj h MET 108 Cb 1.03 -0.11 -0.15 0.00 -0.80 0.00 0.00 31.60 31.57 1vhj h MET 108 CO 1.22 0.74 -0.68 0.20 0.23 0.00 0.00 176.91 178.63 1vhj s GLY 109 N -3.67 1.12 -0.11 1.39 0.00 -1.16 -0.53 107.32 104.36 1vhj s GLY 109 Ca -0.09 -1.54 -0.02 0.00 0.00 0.00 0.00 44.72 43.07 1vhj s GLY 109 CO 0.80 -1.53 0.03 0.00 0.00 0.00 0.00 173.10 172.40 1vhj s ALA 110 N -3.59 0.64 0.60 3.20 0.00 0.22 -0.19 121.76 122.65 1vhj s ALA 110 Ca 0.21 -0.22 -0.12 0.00 0.00 0.00 0.00 51.96 51.83 1vhj s ALA 110 Cb 0.05 -0.86 -0.04 0.00 0.00 0.00 0.00 23.12 22.27 1vhj s ALA 110 CO 0.02 -0.72 1.02 0.00 0.00 0.00 0.00 175.76 176.08 1vhj s THR 112 N -3.07 0.02 -2.06 0.00 -1.32 -1.26 0.45 115.64 108.40 1vhj s THR 112 Ca 0.56 -0.23 0.17 0.00 -1.21 0.00 0.00 61.69 60.98 1vhj s THR 112 Cb -0.11 -1.12 0.18 0.00 -1.51 0.00 0.00 72.50 69.95 1vhj s THR 112 CO 0.50 -0.08 1.10 -0.90 -2.21 0.00 0.00 174.62 173.02 1vhj n ASP 113 N -0.34 2.58 -4.82 8.08 5.68 -1.16 -4.97 116.55 121.59 1vhj n ASP 113 Ca -0.16 -1.76 -0.31 0.00 -0.50 0.00 0.00 54.79 52.06 1vhj n ASP 113 Cb 0.64 -0.05 0.04 0.00 -1.14 0.00 0.00 41.12 40.61 1vhj n ASP 113 CO 0.00 0.00 0.00 -0.55 -1.33 0.00 0.00 177.20 175.32 1vhj s SER 114 N -1.38 5.53 0.00 -1.12 0.15 -1.26 -4.92 113.70 110.70 1vhj s SER 114 Ca 0.22 1.65 0.25 0.00 0.70 0.00 0.00 55.95 58.77 1vhj s SER 114 Cb 0.15 -2.50 0.36 0.00 -1.71 0.00 0.00 66.02 62.32 1vhj s SER 114 CO 0.22 -1.34 1.34 1.17 1.20 0.00 0.00 173.24 175.83 1vhj n LYS 115 N -2.86 1.72 -0.36 5.44 4.81 -1.26 -4.59 118.16 121.05 1vhj n LYS 115 Ca 0.08 -1.32 -0.03 0.00 -0.87 0.00 0.00 58.31 56.17 1vhj n LYS 115 Cb 0.53 -1.47 0.10 0.00 0.02 0.00 0.00 35.03 34.21 1vhj n LYS 115 CO 0.00 0.00 0.00 -0.39 1.17 0.00 0.00 177.40 178.18 1vhj h VAL 116 N 3.23 1.25 -0.02 3.15 -1.51 -1.99 -0.98 116.25 119.38 1vhj h VAL 116 Ca 0.00 -0.50 -0.15 0.00 -1.23 0.00 0.00 66.70 64.82 1vhj h VAL 116 Cb 0.78 -0.14 -0.02 0.00 -2.13 0.00 0.00 31.29 29.78 1vhj h VAL 116 CO 0.00 0.25 -0.68 0.78 -1.23 0.00 0.00 177.57 176.69 1vhj h ASN 117 N 1.31 0.11 -0.02 4.19 2.35 -1.93 -2.70 115.58 118.89 1vhj h ASN 117 Ca 0.35 -0.07 -0.08 0.00 -0.55 0.00 0.00 56.30 55.95 1vhj h ASN 117 Cb -0.12 -0.03 -0.01 0.00 0.05 0.00 0.00 38.32 38.21 1vhj h ASN 117 CO -0.07 0.75 -0.20 0.03 -1.65 0.00 0.00 177.43 176.30 1vhj h ARG 118 N 0.06 0.39 -0.00 0.81 3.08 -1.66 0.11 114.38 117.17 1vhj h ARG 118 Ca -0.01 -0.12 -0.09 0.00 0.07 0.00 0.00 59.98 59.83 1vhj h ARG 118 Cb 1.21 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 31.21 1vhj h ARG 118 CO 0.10 0.57 -0.43 0.82 -1.07 0.00 0.00 179.97 179.95 1vhj h ILE 119 N 0.35 1.31 0.02 2.04 2.04 -0.97 0.25 117.51 122.56 1vhj h ILE 119 Ca 0.06 -1.49 -0.26 0.00 1.00 0.00 0.00 64.86 64.18 1vhj h ILE 119 Cb 0.55 1.80 -0.03 0.00 -0.74 0.00 0.00 36.82 38.40 1vhj h ILE 119 CO 0.04 0.43 -1.34 0.03 0.00 0.00 0.00 178.15 177.30 1vhj h ARG 120 N 0.00 0.04 -0.73 2.37 3.08 -1.06 -3.39 114.38 114.69 1vhj h ARG 120 Ca -0.00 -0.07 -0.44 0.00 0.07 0.00 0.00 59.98 59.53 1vhj h ARG 120 Cb 0.77 0.03 -0.25 0.00 0.08 0.00 0.00 29.97 30.59 1vhj h ARG 120 CO 0.06 0.84 0.22 0.34 -1.07 0.00 0.00 179.97 180.36 1vhj n PHE 121 N -3.26 2.36 -3.94 3.04 7.35 0.32 -4.93 117.46 118.39 1vhj n PHE 121 Ca -0.09 -2.11 -0.31 0.00 -0.76 0.00 0.00 57.45 54.18 1vhj n PHE 121 Cb 1.00 -0.82 0.02 0.00 0.35 0.00 0.00 39.48 40.03 1vhj n PHE 121 CO 0.00 0.00 0.00 1.63 -0.76 0.00 0.00 176.76 177.63 1vhj n LYS 122 N -1.02 -5.30 -1.32 -4.13 5.02 -1.14 -1.96 118.16 108.30 1vhj n LYS 122 Ca 0.49 0.58 -0.11 0.00 -2.02 0.00 0.00 58.31 57.24 1vhj n LYS 122 Cb 1.10 -5.44 -0.05 0.00 -0.02 0.00 0.00 35.03 30.62 1vhj n LYS 122 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 1vhj n ASP 123 N -2.83 -4.90 -4.46 4.39 2.03 0.88 -5.00 116.55 106.66 1vhj n ASP 123 Ca 0.03 0.27 -0.16 0.00 0.52 0.00 0.00 54.79 55.45 1vhj n ASP 123 Cb 0.53 -3.38 0.06 0.00 -0.72 0.00 0.00 41.12 37.61 1vhj n ASP 123 CO 0.00 0.00 0.00 1.41 -1.92 0.00 0.00 177.20 176.69 1vhj n HIS 124 N -2.49 -2.42 -2.73 -0.67 8.25 -0.83 -5.00 115.22 109.33 1vhj n HIS 124 Ca -0.11 -1.77 -0.42 0.00 -0.26 0.00 0.00 57.72 55.16 1vhj n HIS 124 Cb 0.46 -0.46 -0.03 0.00 1.12 0.00 0.00 29.99 31.07 1vhj n HIS 124 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1vhj s ASP 125 N -4.02 6.24 -0.21 0.41 1.11 -1.26 -4.60 116.67 114.34 1vhj s ASP 125 Ca 0.51 -0.55 -0.20 0.00 0.18 0.00 0.00 52.55 52.50 1vhj s ASP 125 Cb -0.04 -2.48 -0.03 0.00 1.07 0.00 0.00 42.92 41.44 1vhj s ASP 125 CO 0.32 -1.51 0.60 0.12 1.18 0.00 0.00 175.17 175.88 1vhj s PHE 126 N 4.64 3.36 -0.67 4.23 2.19 -1.26 -5.02 117.98 125.45 1vhj s PHE 126 Ca 0.30 0.86 -0.25 0.00 0.33 0.00 0.00 56.93 58.17 1vhj s PHE 126 Cb -0.12 -2.77 0.04 0.00 -1.31 0.00 0.00 43.02 38.87 1vhj s PHE 126 CO 0.16 -0.17 1.12 0.00 1.83 0.00 0.00 175.22 178.15 1vhj s ALA 127 N 1.91 2.95 -0.37 11.12 0.00 -1.26 -4.97 121.76 131.14 1vhj s ALA 127 Ca 0.27 -1.43 -0.29 0.00 0.00 0.00 0.00 51.96 50.51 1vhj s ALA 127 Cb -0.16 -4.03 0.00 0.00 0.00 0.00 0.00 23.12 18.93 1vhj s ALA 127 CO 0.10 -2.92 1.51 0.00 0.00 0.00 0.00 175.76 174.45 1vhj s ALA 128 N 4.85 3.04 0.19 0.00 0.00 -1.26 -4.97 121.76 123.61 1vhj s ALA 128 Ca 0.31 -0.00 0.10 0.00 0.00 0.00 0.00 51.96 52.37 1vhj s ALA 128 Cb -0.11 -3.94 -0.04 0.00 0.00 0.00 0.00 23.12 19.02 1vhj s ALA 128 CO 0.15 -2.38 -0.21 0.96 0.00 0.00 0.00 175.76 174.29 1vhj s ILE 129 N 5.68 2.10 1.00 0.00 -4.36 -1.26 -0.61 121.20 123.75 1vhj s ILE 129 Ca 0.66 -2.01 -0.15 0.00 -0.26 0.00 0.00 60.65 58.89 1vhj s ILE 129 Cb -0.17 -2.00 0.19 0.00 1.25 0.00 0.00 42.46 41.73 1vhj s ILE 129 CO 0.32 -0.24 1.18 0.00 0.24 0.00 0.00 174.94 176.44 1vhj s ALA 130 N -1.94 1.62 -0.08 2.27 0.00 0.31 -4.82 121.76 119.12 1vhj s ALA 130 Ca 0.19 -0.83 -0.28 0.00 0.00 0.00 0.00 51.96 51.05 1vhj s ALA 130 Cb -0.07 -2.92 -0.02 0.00 0.00 0.00 0.00 23.12 20.11 1vhj s ALA 130 CO 0.09 -2.65 0.90 0.34 0.00 0.00 0.00 175.76 174.43 1vhj s ASP 131 N -4.25 7.17 0.16 0.00 -1.08 -0.35 -4.94 116.67 113.38 1vhj s ASP 131 Ca 0.68 1.42 -0.17 0.00 -0.52 0.00 0.00 52.55 53.96 1vhj s ASP 131 Cb -0.10 -2.51 0.08 0.00 -1.46 0.00 0.00 42.92 38.93 1vhj s ASP 131 CO 0.54 -0.32 1.69 0.22 0.52 0.00 0.00 175.17 177.82 1vhj h TYR 132 N 7.00 -0.12 -0.90 -5.34 5.03 -1.95 -1.88 116.97 118.80 1vhj h TYR 132 Ca -0.35 0.03 0.02 0.00 2.58 0.00 0.00 58.73 61.01 1vhj h TYR 132 Cb 1.17 0.11 -0.05 0.00 1.55 0.00 0.00 36.73 39.52 1vhj h TYR 132 CO 0.69 -0.12 0.60 0.87 -1.32 0.00 0.00 178.16 178.88 1vhj h LYS 133 N 0.04 1.15 -0.55 1.82 1.57 -1.99 -1.33 116.57 117.27 1vhj h LYS 133 Ca 0.18 -0.07 -0.07 0.00 -1.87 0.00 0.00 60.65 58.81 1vhj h LYS 133 Cb 0.26 -0.26 -0.02 0.00 0.08 0.00 0.00 32.23 32.29 1vhj h LYS 133 CO -0.34 0.76 0.05 0.52 -0.57 0.00 0.00 179.45 179.86 1vhj h MET 134 N 1.18 0.91 -0.04 3.15 2.86 -1.82 -0.30 114.93 120.86 1vhj h MET 134 Ca 0.35 -0.24 0.00 0.00 -2.06 0.00 0.00 59.70 57.74 1vhj h MET 134 Cb -0.06 -0.11 -0.00 0.00 0.06 0.00 0.00 31.60 31.48 1vhj h MET 134 CO -0.09 0.88 0.03 0.28 1.06 0.00 0.00 176.91 179.06 1vhj h VAL 135 N 0.85 1.03 -0.49 -2.22 2.07 -0.58 -2.12 116.25 114.79 1vhj h VAL 135 Ca 0.17 -0.08 0.05 0.00 0.82 0.00 0.00 66.70 67.66 1vhj h VAL 135 Cb 0.44 1.01 -0.05 0.00 -1.52 0.00 0.00 31.29 31.17 1vhj h VAL 135 CO 0.02 0.03 0.23 0.50 0.02 0.00 0.00 177.57 178.37 1vhj h LYS 136 N 0.04 0.45 -0.74 1.57 3.64 -0.97 -0.57 116.57 119.99 1vhj h LYS 136 Ca 0.02 -0.03 0.03 0.00 -1.27 0.00 0.00 60.65 59.40 1vhj h LYS 136 Cb 0.02 -0.10 -0.04 0.00 -0.41 0.00 0.00 32.23 31.69 1vhj h LYS 136 CO -0.00 0.30 0.47 0.00 -2.27 0.00 0.00 179.45 177.94 1vhj h ALA 137 N 1.28 0.96 -0.34 5.00 0.00 -0.84 0.10 119.26 125.42 1vhj h ALA 137 Ca 0.22 -0.03 -0.17 0.00 0.00 0.00 0.00 54.91 54.93 1vhj h ALA 137 Cb 0.15 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 17.69 1vhj h ALA 137 CO -0.17 0.27 -0.45 0.00 0.00 0.00 0.00 179.25 178.90 1vhj h ALA 138 N 1.31 0.55 -0.50 0.00 0.00 -0.91 -0.00 119.26 119.70 1vhj h ALA 138 Ca 0.29 -0.48 -0.10 0.00 0.00 0.00 0.00 54.91 54.62 1vhj h ALA 138 Cb -0.00 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 1vhj h ALA 138 CO -0.10 0.68 -0.08 1.49 0.00 0.00 0.00 179.25 181.24 1vhj h GLU 139 N 0.71 0.91 -0.29 0.00 4.22 -0.74 -0.51 114.58 118.87 1vhj h GLU 139 Ca 0.04 -0.30 -0.16 0.00 0.08 0.00 0.00 59.36 59.02 1vhj h GLU 139 Cb 1.05 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 30.22 1vhj h GLU 139 CO 0.11 0.95 -0.44 0.93 -2.18 0.00 0.00 179.01 178.37 1vhj h GLU 140 N 0.82 0.75 -0.64 1.92 4.39 -0.65 -1.62 114.58 119.56 1vhj h GLU 140 Ca 0.14 -0.41 -0.04 0.00 0.34 0.00 0.00 59.36 59.39 1vhj h GLU 140 Cb 0.59 0.02 -0.03 0.00 -0.10 0.00 0.00 28.75 29.24 1vhj h GLU 140 CO 0.04 1.04 0.24 0.00 -1.16 0.00 0.00 179.01 179.17 1vhj h ALA 141 N 0.90 1.23 -0.26 3.43 0.00 -0.81 -1.77 119.26 121.97 1vhj h ALA 141 Ca 0.04 -0.17 -0.06 0.00 0.00 0.00 0.00 54.91 54.72 1vhj h ALA 141 Cb 1.00 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.53 1vhj h ALA 141 CO 0.10 0.56 -0.06 0.00 0.00 0.00 0.00 179.25 179.85 1vhj h ALA 142 N 1.34 0.36 -0.98 0.00 0.00 -0.84 -3.10 119.26 116.04 1vhj h ALA 142 Ca 0.21 -0.27 0.01 0.00 0.00 0.00 0.00 54.91 54.87 1vhj h ALA 142 Cb 0.20 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 17.85 1vhj h ALA 142 CO -0.02 0.16 0.65 1.57 0.00 0.00 0.00 179.25 181.62 1vhj h LYS 143 N 0.26 1.29 -0.37 0.00 2.10 -0.96 -0.21 116.57 118.68 1vhj h LYS 143 Ca 0.07 -0.08 0.09 0.00 -2.00 0.00 0.00 60.65 58.73 1vhj h LYS 143 Cb 0.52 -0.29 -0.02 0.00 -0.90 0.00 0.00 32.23 31.55 1vhj h LYS 143 CO 0.02 0.85 0.26 0.00 -2.00 0.00 0.00 179.45 178.59 1vhj h ALA 144 N 1.36 2.26 -0.36 0.07 0.00 -1.26 0.17 119.26 121.50 1vhj h ALA 144 Ca 0.36 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.26 1vhj h ALA 144 Cb -0.15 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.64 1vhj h ALA 144 CO -0.08 -0.36 0.00 0.54 0.00 0.00 0.00 179.25 179.36 1vhj n ARG 145 N -4.45 2.47 -2.57 0.00 1.74 -0.63 -4.96 116.66 108.26 1vhj n ARG 145 Ca 0.06 -2.25 -0.14 0.00 -0.77 0.00 0.00 57.85 54.75 1vhj n ARG 145 Cb 0.40 -1.50 0.01 0.00 -1.02 0.00 0.00 32.46 30.35 1vhj n ARG 145 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1vhj n GLY 146 N 1.46 -0.11 3.63 -0.13 0.00 0.59 -5.02 105.19 105.62 1vhj n GLY 146 Ca 0.19 -0.25 -0.34 0.00 0.00 0.00 0.00 46.02 45.61 1vhj n GLY 146 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1vhj s ILE 147 N -2.84 4.75 0.17 -0.61 1.01 -0.19 -4.99 121.20 118.50 1vhj s ILE 147 Ca 0.13 -0.05 -0.20 0.00 0.00 0.00 0.00 60.65 60.53 1vhj s ILE 147 Cb -0.06 -3.13 -0.08 0.00 0.01 0.00 0.00 42.46 39.21 1vhj s ILE 147 CO 0.15 0.47 0.68 -0.62 0.00 0.00 0.00 174.94 175.62 1vhj s ASP 148 N 0.30 7.08 0.09 3.58 2.15 -1.26 -4.06 116.67 124.55 1vhj s ASP 148 Ca 0.03 1.38 0.06 0.00 0.43 0.00 0.00 52.55 54.45 1vhj s ASP 148 Cb -0.12 -2.40 -0.03 0.00 -0.30 0.00 0.00 42.92 40.06 1vhj s ASP 148 CO 0.00 0.12 -0.17 0.68 -0.17 0.00 0.00 175.17 175.64 1vhj s VAL 149 N -1.37 1.36 -0.22 1.11 -7.23 -1.26 -4.30 120.40 108.49 1vhj s VAL 149 Ca 0.38 -1.43 -0.05 0.00 -1.81 0.00 0.00 61.98 59.07 1vhj s VAL 149 Cb -0.18 -1.29 -0.02 0.00 0.56 0.00 0.00 36.38 35.45 1vhj s VAL 149 CO 0.21 -0.18 -0.01 -0.54 -0.31 0.00 0.00 175.10 174.27 1vhj s LYS 150 N -1.88 3.51 -0.24 4.82 -0.14 -0.06 -4.98 119.74 120.76 1vhj s LYS 150 Ca 0.02 -0.56 -0.09 0.00 -1.36 0.00 0.00 55.97 53.98 1vhj s LYS 150 Cb -0.10 -3.08 -0.04 0.00 -1.68 0.00 0.00 37.83 32.93 1vhj s LYS 150 CO 0.03 -0.11 0.12 0.08 -0.76 0.00 0.00 175.35 174.71 1vhj s VAL 151 N 1.30 4.93 0.00 3.17 1.01 -1.26 -0.15 120.40 129.40 1vhj s VAL 151 Ca 0.04 0.03 0.00 0.00 0.00 0.00 0.00 61.98 62.05 1vhj s VAL 151 Cb -0.15 -3.29 0.00 0.00 0.00 0.00 0.00 36.38 32.94 1vhj s VAL 151 CO 0.00 0.35 0.00 0.61 0.00 0.00 0.00 175.10 176.06 1vhj n GLY 152 N 4.45 1.29 3.75 4.51 0.00 -0.62 -4.95 105.19 113.62 1vhj n GLY 152 Ca -0.15 -0.52 -0.40 0.00 0.00 0.00 0.00 46.02 44.95 1vhj n GLY 152 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1vhj s ASN 153 N 2.00 7.24 0.40 1.61 0.01 -1.26 -1.31 114.94 123.63 1vhj s ASN 153 Ca 0.00 1.48 0.06 0.00 -0.71 0.00 0.00 52.86 53.70 1vhj s ASN 153 Cb 0.00 -2.48 0.00 0.00 0.41 0.00 0.00 41.25 39.19 1vhj s ASN 153 CO 0.00 0.02 0.56 -0.76 -1.51 0.00 0.00 177.10 175.41 1vhj s LEU 154 N -0.13 3.74 -0.14 0.60 1.43 0.74 -0.47 118.68 124.46 1vhj s LEU 154 Ca 0.39 -0.26 0.01 0.00 -1.03 0.00 0.00 54.13 53.23 1vhj s LEU 154 Cb -0.21 -2.74 0.02 0.00 0.03 0.00 0.00 46.19 43.29 1vhj s LEU 154 CO 0.24 -0.67 -0.14 0.12 0.23 0.00 0.00 176.35 176.13 1vhj s PHE 155 N -2.33 2.05 -0.57 0.29 2.19 0.25 0.19 117.98 120.04 1vhj s PHE 155 Ca 0.51 -1.11 -0.19 0.00 0.33 0.00 0.00 56.93 56.48 1vhj s PHE 155 Cb -0.10 -1.52 0.10 0.00 -1.31 0.00 0.00 43.02 40.19 1vhj s PHE 155 CO 0.33 -0.61 0.67 -1.12 1.83 0.00 0.00 175.22 176.31 1vhj s SER 156 N 1.41 6.19 0.25 6.13 0.01 0.17 -1.32 113.70 126.55 1vhj s SER 156 Ca 0.03 -1.39 -0.23 0.00 1.31 0.00 0.00 55.95 55.67 1vhj s SER 156 Cb -0.13 -2.29 -0.09 0.00 0.21 0.00 0.00 66.02 63.72 1vhj s SER 156 CO -0.09 -1.05 0.81 0.00 0.41 0.00 0.00 173.24 173.32 1vhj s ALA 157 N 2.56 3.35 0.02 1.44 0.00 -0.76 -2.99 121.76 125.37 1vhj s ALA 157 Ca 0.11 0.32 0.08 0.00 0.00 0.00 0.00 51.96 52.47 1vhj s ALA 157 Cb -0.24 -2.97 -0.23 0.00 0.00 0.00 0.00 23.12 19.68 1vhj s ALA 157 CO 0.07 0.27 0.89 0.93 0.00 0.00 0.00 175.76 177.92 1vhj h GLU 158 N 3.46 0.05 -4.72 0.00 4.39 -1.90 -3.42 114.58 112.44 1vhj h GLU 158 Ca -0.47 -0.08 -0.68 0.00 0.34 0.00 0.00 59.36 58.47 1vhj h GLU 158 Cb 1.19 0.03 -0.34 0.00 -0.10 0.00 0.00 28.75 29.53 1vhj h GLU 158 CO 0.65 0.78 -0.69 -0.51 -1.16 0.00 0.00 179.01 178.09 1vhj s LEU 159 N -6.47 4.19 0.17 1.33 1.43 -1.26 -4.98 118.68 113.09 1vhj s LEU 159 Ca -0.04 -1.53 -0.15 0.00 -1.03 0.00 0.00 54.13 51.38 1vhj s LEU 159 Cb 0.08 -1.71 0.11 0.00 0.03 0.00 0.00 46.19 44.71 1vhj s LEU 159 CO 0.83 -0.32 1.72 0.15 0.23 0.00 0.00 176.35 178.96 1vhj h PHE 160 N 7.94 0.09 -2.47 0.29 3.04 -1.99 -3.16 116.94 120.68 1vhj h PHE 160 Ca -0.17 0.03 -0.74 0.00 3.98 0.00 0.00 57.97 61.06 1vhj h PHE 160 Cb 1.05 0.02 -0.20 0.00 2.56 0.00 0.00 35.95 39.39 1vhj h PHE 160 CO 0.59 -0.01 1.12 0.71 -2.02 0.00 0.00 178.31 178.70 1vhj s TYR 161 N -6.16 3.60 0.25 0.41 1.51 -1.26 -5.01 117.35 110.68 1vhj s TYR 161 Ca -0.13 -2.16 -0.30 0.00 -1.01 0.00 0.00 57.07 53.48 1vhj s TYR 161 Cb 0.13 -4.22 -0.09 0.00 -0.11 0.00 0.00 41.96 37.67 1vhj s TYR 161 CO 0.71 -1.32 1.28 -0.08 -1.11 0.00 0.00 175.55 175.03 1vhj s THR 162 N 1.17 3.11 -0.81 -0.71 -1.32 -1.20 -4.91 115.64 110.98 1vhj s THR 162 Ca 0.39 0.99 0.27 0.00 -1.21 0.00 0.00 61.69 62.13 1vhj s THR 162 Cb -0.04 -3.63 0.27 0.00 -1.51 0.00 0.00 72.50 67.59 1vhj s THR 162 CO -0.02 0.19 1.82 -0.81 -2.21 0.00 0.00 174.62 173.58 1vhj n PRO 163 N 1.87 0.19 -3.82 7.08 -0.04 -1.26 -4.38 135.00 134.63 1vhj n PRO 163 Ca 0.03 0.16 -0.28 0.00 -0.04 0.00 0.00 63.50 63.37 1vhj n PRO 163 Cb 0.43 -1.72 -0.12 0.00 -0.04 0.00 0.00 33.50 32.05 1vhj n PRO 163 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 1vhj s ASP 164 N -4.10 4.25 0.59 3.54 3.68 -1.26 -4.94 116.67 118.43 1vhj s ASP 164 Ca 0.12 -3.65 0.37 0.00 2.13 0.00 0.00 52.55 51.52 1vhj s ASP 164 Cb 0.14 -1.44 1.74 0.00 -1.45 0.00 0.00 42.92 41.91 1vhj s ASP 164 CO 0.58 -0.11 2.12 -0.65 0.13 0.00 0.00 175.17 177.23 1vhj h PRO 165 N 5.54 0.00 0.00 4.34 0.11 -2.01 -2.63 132.00 137.35 1vhj h PRO 165 Ca 0.15 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.26 1vhj h PRO 165 Cb 0.79 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.90 1vhj h PRO 165 CO 0.66 0.00 0.00 0.66 -0.21 0.00 0.00 178.00 179.11 1vhj h SER 166 N 0.00 0.00 0.45 -2.05 4.64 -1.98 -1.92 113.55 112.69 1vhj h SER 166 Ca 0.00 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 1vhj h SER 166 Cb 0.33 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.42 1vhj h SER 166 CO 0.00 0.00 -0.05 -0.03 -0.87 0.00 0.00 176.83 175.88 1vhj h MET 167 N 0.00 0.00 0.00 4.77 -1.53 -1.91 -2.72 114.93 113.54 1vhj h MET 167 Ca 0.00 0.00 -0.06 0.00 -3.44 0.00 0.00 59.70 56.20 1vhj h MET 167 Cb 0.30 0.00 -0.01 0.00 -0.55 0.00 0.00 31.60 31.34 1vhj h MET 167 CO 0.00 0.05 -0.29 0.74 0.14 0.00 0.00 176.91 177.56 1vhj h PHE 168 N 0.00 0.00 0.00 1.39 0.05 -1.58 -1.42 116.94 115.38 1vhj h PHE 168 Ca -0.00 0.00 -0.20 0.00 3.82 0.00 0.00 57.97 61.59 1vhj h PHE 168 Cb 0.29 0.00 -0.01 0.00 2.00 0.00 0.00 35.95 38.23 1vhj h PHE 168 CO 0.00 0.29 -0.88 -0.44 -0.18 0.00 0.00 178.31 177.09 1vhj h ASP 169 N 0.00 0.31 -0.16 2.17 5.19 -1.67 -1.64 116.42 120.62 1vhj h ASP 169 Ca -0.00 -0.25 -0.04 0.00 -0.62 0.00 0.00 57.03 56.11 1vhj h ASP 169 Cb 0.70 -0.10 -0.00 0.00 0.18 0.00 0.00 39.33 40.11 1vhj h ASP 169 CO 0.04 1.05 -0.07 0.58 -3.12 0.00 0.00 179.24 177.72 1vhj h VAL 170 N 0.14 1.31 -0.20 -1.35 2.07 -1.47 -2.37 116.25 114.37 1vhj h VAL 170 Ca -0.05 -1.09 0.05 0.00 0.82 0.00 0.00 66.70 66.43 1vhj h VAL 170 Cb 1.51 1.70 -0.06 0.00 -1.52 0.00 0.00 31.29 32.92 1vhj h VAL 170 CO 0.14 0.32 -0.16 0.24 0.02 0.00 0.00 177.57 178.13 1vhj h MET 171 N 0.00 -0.16 -0.17 1.57 2.86 -1.18 -1.55 114.93 116.31 1vhj h MET 171 Ca 0.04 0.01 0.05 0.00 -2.06 0.00 0.00 59.70 57.74 1vhj h MET 171 Cb 0.53 0.04 -0.07 0.00 0.06 0.00 0.00 31.60 32.16 1vhj h MET 171 CO 0.02 -0.11 -0.31 0.22 1.06 0.00 0.00 176.91 177.80 1vhj h ASP 172 N -0.16 -0.96 -0.34 1.22 -0.00 -1.28 -1.08 116.42 113.82 1vhj h ASP 172 Ca 0.12 0.15 0.07 0.00 -0.00 0.00 0.00 57.03 57.37 1vhj h ASP 172 Cb 0.34 0.42 -0.02 0.00 -0.00 0.00 0.00 39.33 40.07 1vhj h ASP 172 CO -0.30 -0.34 0.24 0.50 -0.00 0.00 0.00 179.24 179.34 1vhj h LYS 173 N -0.36 0.12 -0.60 0.28 3.64 -1.08 -1.63 116.57 116.95 1vhj h LYS 173 Ca 0.11 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.48 1vhj h LYS 173 Cb 0.53 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.32 1vhj h LYS 173 CO -0.37 0.08 0.00 0.66 -2.27 0.00 0.00 179.45 177.55 1vhj n TYR 174 N -4.46 1.00 -1.00 1.91 4.01 -0.61 -4.94 117.16 113.07 1vhj n TYR 174 Ca 0.04 -0.41 -0.00 0.00 -0.16 0.00 0.00 57.90 57.37 1vhj n TYR 174 Cb 0.32 -0.15 -0.00 0.00 -0.31 0.00 0.00 39.34 39.20 1vhj n TYR 174 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1vhj n GLY 175 N 0.99 0.48 3.66 2.72 0.00 -0.61 -4.99 105.19 107.44 1vhj n GLY 175 Ca 0.18 -0.08 -0.47 0.00 0.00 0.00 0.00 46.02 45.65 1vhj n GLY 175 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1vhj n ILE 176 N -2.96 0.05 0.06 -0.61 -0.00 -0.51 -4.51 119.36 110.88 1vhj n ILE 176 Ca -0.00 -0.01 0.02 0.00 -0.00 0.00 0.00 62.75 62.76 1vhj n ILE 176 Cb 0.02 -1.44 -0.05 0.00 -0.00 0.00 0.00 39.64 38.16 1vhj n ILE 176 CO 0.00 0.00 0.00 -0.37 -0.00 0.00 0.00 176.55 176.18 1vhj h VAL 177 N 3.73 0.49 -1.80 1.39 -1.51 -1.12 -3.41 116.25 114.02 1vhj h VAL 177 Ca -0.46 -1.90 0.05 0.00 -1.23 0.00 0.00 66.70 63.16 1vhj h VAL 177 Cb 1.27 2.03 -0.21 0.00 -2.13 0.00 0.00 31.29 32.25 1vhj h VAL 177 CO 0.88 0.28 0.45 -0.83 -1.23 0.00 0.00 177.57 177.11 1vhj s GLY 178 N -4.68 -0.38 -0.19 5.19 0.00 -1.24 -4.63 107.32 101.39 1vhj s GLY 178 Ca -0.01 1.68 -0.02 0.00 0.00 0.00 0.00 44.72 46.37 1vhj s GLY 178 CO 0.80 0.90 -0.09 0.54 0.00 0.00 0.00 173.10 175.24 1vhj s VAL 179 N -1.47 3.09 0.00 1.40 0.11 0.18 -0.59 120.40 123.13 1vhj s VAL 179 Ca -0.03 -0.61 0.00 0.00 -2.93 0.00 0.00 61.98 58.41 1vhj s VAL 179 Cb -0.00 -2.36 0.00 0.00 -1.53 0.00 0.00 36.38 32.48 1vhj s VAL 179 CO 0.02 0.47 0.00 -1.84 -3.33 0.00 0.00 175.10 170.42 1vhj n GLU 180 N 4.37 1.26 0.00 1.54 -0.00 -0.43 -1.12 120.64 126.26 1vhj n GLU 180 Ca -0.19 0.00 0.00 0.00 -0.00 0.00 0.00 57.16 56.97 1vhj n GLU 180 Cb 0.51 0.00 0.00 0.00 -0.00 0.00 0.00 31.44 31.95 1vhj n GLU 180 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.13 175.80 1vhj n MET 181 N 0.00 -0.08 0.00 3.44 2.81 -1.26 -1.83 117.12 120.20 1vhj n MET 181 Ca 0.00 -0.25 0.00 0.00 -1.81 0.00 0.00 57.70 55.64 1vhj n MET 181 Cb 0.00 -0.64 0.00 0.00 -0.71 0.00 0.00 33.22 31.87 1vhj n MET 181 CO 0.00 0.00 0.00 -0.85 1.51 0.00 0.00 175.97 176.63 1vhj n GLU 182 N -0.03 3.02 -0.18 0.03 0.00 -1.26 -2.63 120.64 119.59 1vhj n GLU 182 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 57.16 57.15 1vhj n GLU 182 Cb 0.22 -0.37 0.09 0.00 0.00 0.00 0.00 31.44 31.38 1vhj n GLU 182 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1vhj h ALA 183 N 0.00 0.68 -0.31 -1.84 0.00 -1.93 -1.04 119.26 114.82 1vhj h ALA 183 Ca 0.00 0.11 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 1vhj h ALA 183 Cb 0.00 0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 1vhj h ALA 183 CO 0.00 -0.27 0.19 0.00 0.00 0.00 0.00 179.25 179.17 1vhj h ALA 184 N 1.42 1.75 -0.25 0.00 0.00 -1.84 -1.36 119.26 118.98 1vhj h ALA 184 Ca 0.29 -0.03 -0.15 0.00 0.00 0.00 0.00 54.91 55.01 1vhj h ALA 184 Cb 0.39 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.05 1vhj h ALA 184 CO -0.34 0.22 -0.43 0.78 0.00 0.00 0.00 179.25 179.48 1vhj h GLY 185 N 0.45 0.81 0.92 0.00 0.00 -1.57 -2.09 103.07 101.60 1vhj h GLY 185 Ca 0.11 -0.92 -0.02 0.00 0.00 0.00 0.00 47.33 46.50 1vhj h GLY 185 CO -0.02 0.83 0.12 -2.22 0.00 0.00 0.00 176.54 175.25 1vhj h ILE 186 N 0.47 1.19 -0.54 2.60 2.04 -0.62 -0.49 117.51 122.16 1vhj h ILE 186 Ca 0.02 -0.59 -0.03 0.00 1.00 0.00 0.00 64.86 65.26 1vhj h ILE 186 Cb 1.03 0.97 -0.03 0.00 -0.74 0.00 0.00 36.82 38.05 1vhj h ILE 186 CO 0.10 0.20 0.22 1.88 0.00 0.00 0.00 178.15 180.56 1vhj h TYR 187 N 0.38 0.77 -0.35 1.37 0.99 -1.33 -0.03 116.97 118.78 1vhj h TYR 187 Ca 0.11 -0.03 -0.09 0.00 2.00 0.00 0.00 58.73 60.71 1vhj h TYR 187 Cb 0.20 -0.24 -0.01 0.00 1.00 0.00 0.00 36.73 37.68 1vhj h TYR 187 CO -0.00 0.60 -0.15 0.78 -0.00 0.00 0.00 178.16 179.39 1vhj h GLY 188 N 0.90 0.78 0.94 3.88 0.00 -0.94 -2.20 103.07 106.43 1vhj h GLY 188 Ca 0.19 -0.69 -0.07 0.00 0.00 0.00 0.00 47.33 46.77 1vhj h GLY 188 CO -0.02 0.62 -0.02 -2.08 0.00 0.00 0.00 176.54 175.05 1vhj h VAL 189 N 0.50 1.26 -0.67 4.60 2.07 -0.62 -1.80 116.25 121.60 1vhj h VAL 189 Ca 0.08 -1.03 0.00 0.00 0.82 0.00 0.00 66.70 66.57 1vhj h VAL 189 Cb 0.68 1.17 -0.03 0.00 -1.52 0.00 0.00 31.29 31.58 1vhj h VAL 189 CO 0.05 0.35 0.42 0.00 0.02 0.00 0.00 177.57 178.40 1vhj h ALA 190 N 0.87 1.49 -0.04 1.67 0.00 -0.95 -0.91 119.26 121.39 1vhj h ALA 190 Ca 0.11 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 1vhj h ALA 190 Cb 0.49 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 18.01 1vhj h ALA 190 CO 0.02 0.46 -0.04 0.00 0.00 0.00 0.00 179.25 179.69 1vhj h ALA 191 N 1.56 0.06 -0.83 0.00 0.00 -1.24 0.27 119.26 119.09 1vhj h ALA 191 Ca 0.24 -0.26 0.08 0.00 0.00 0.00 0.00 54.91 54.96 1vhj h ALA 191 Cb -0.07 -0.01 -0.07 0.00 0.00 0.00 0.00 17.79 17.64 1vhj h ALA 191 CO -0.05 -0.16 0.50 1.49 0.00 0.00 0.00 179.25 181.03 1vhj h GLU 192 N -0.35 0.85 -0.71 0.00 4.81 -1.09 -2.94 114.58 115.15 1vhj h GLU 192 Ca 0.01 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.19 1vhj h GLU 192 Cb 0.54 -0.19 0.00 0.00 0.63 0.00 0.00 28.75 29.73 1vhj h GLU 192 CO 0.01 0.56 0.00 0.66 -0.73 0.00 0.00 179.01 179.51 1vhj n TYR 193 N -4.68 1.11 -3.22 0.92 4.01 -0.37 -4.98 117.16 109.96 1vhj n TYR 193 Ca 0.13 -0.53 -0.17 0.00 -0.16 0.00 0.00 57.90 57.16 1vhj n TYR 193 Cb 0.22 -0.07 0.05 0.00 -0.31 0.00 0.00 39.34 39.24 1vhj n TYR 193 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1vhj n GLY 194 N 1.50 -0.13 2.09 2.72 0.00 -0.57 -4.99 105.19 105.81 1vhj n GLY 194 Ca 0.25 -0.02 -0.18 0.00 0.00 0.00 0.00 46.02 46.06 1vhj n GLY 194 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1vhj n ALA 195 N -4.13 0.27 -2.75 4.61 0.00 0.86 -5.03 120.51 114.34 1vhj n ALA 195 Ca -0.01 -1.30 -0.28 0.00 0.00 0.00 0.00 53.44 51.85 1vhj n ALA 195 Cb 0.55 0.69 -0.16 0.00 0.00 0.00 0.00 19.45 20.53 1vhj n ALA 195 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1vhj s LYS 196 N -3.07 2.08 0.14 0.00 1.02 -0.48 -4.48 119.74 114.95 1vhj s LYS 196 Ca 0.02 -0.75 0.04 0.00 0.02 0.00 0.00 55.97 55.29 1vhj s LYS 196 Cb -0.00 -1.81 -0.04 0.00 -0.52 0.00 0.00 37.83 35.45 1vhj s LYS 196 CO 0.01 0.34 -0.08 0.00 -0.92 0.00 0.00 175.35 174.70 1vhj s ALA 197 N -0.14 1.33 -0.16 5.17 0.00 -1.26 -1.25 121.76 125.46 1vhj s ALA 197 Ca -0.02 -1.47 -0.14 0.00 0.00 0.00 0.00 51.96 50.34 1vhj s ALA 197 Cb -0.12 0.12 0.04 0.00 0.00 0.00 0.00 23.12 23.16 1vhj s ALA 197 CO 0.02 -0.15 0.42 -1.17 0.00 0.00 0.00 175.76 174.88 1vhj s LEU 198 N -3.14 0.30 -0.16 0.00 2.96 -0.53 -1.21 118.68 116.90 1vhj s LEU 198 Ca 0.16 0.86 -0.01 0.00 -0.22 0.00 0.00 54.13 54.92 1vhj s LEU 198 Cb 0.04 1.43 -0.01 0.00 0.50 0.00 0.00 46.19 48.14 1vhj s LEU 198 CO -0.00 -0.16 -0.11 0.00 -1.32 0.00 0.00 176.35 174.76 1vhj s ALA 199 N 0.45 2.68 -0.10 5.97 0.00 -1.26 0.05 121.76 129.55 1vhj s ALA 199 Ca -0.02 -0.97 0.03 0.00 0.00 0.00 0.00 51.96 51.00 1vhj s ALA 199 Cb -0.04 -1.36 -0.01 0.00 0.00 0.00 0.00 23.12 21.71 1vhj s ALA 199 CO -0.02 0.04 -0.21 0.42 0.00 0.00 0.00 175.76 175.99 1vhj s ILE 200 N 0.69 2.37 0.16 0.00 1.01 0.79 -1.96 121.20 124.27 1vhj s ILE 200 Ca -0.05 -0.92 0.06 0.00 0.00 0.00 0.00 60.65 59.74 1vhj s ILE 200 Cb -0.15 -1.93 -0.04 0.00 0.01 0.00 0.00 42.46 40.35 1vhj s ILE 200 CO 0.02 0.55 -0.13 0.00 0.00 0.00 0.00 174.94 175.39 1vhj s THR 202 N -2.88 2.90 -0.28 0.00 -1.32 -0.41 0.52 115.64 114.17 1vhj s THR 202 Ca 0.17 -0.71 -0.29 0.00 -1.21 0.00 0.00 61.69 59.65 1vhj s THR 202 Cb -0.01 -2.21 -0.02 0.00 -1.51 0.00 0.00 72.50 68.75 1vhj s THR 202 CO 0.03 0.52 1.72 -0.69 -2.21 0.00 0.00 174.62 173.99 1vhj s VAL 203 N 0.49 3.57 -0.11 5.08 1.01 0.09 -1.47 120.40 129.05 1vhj s VAL 203 Ca -0.10 0.60 0.21 0.00 0.00 0.00 0.00 61.98 62.70 1vhj s VAL 203 Cb -0.16 -3.68 -0.21 0.00 0.00 0.00 0.00 36.38 32.33 1vhj s VAL 203 CO 0.04 -0.37 0.65 -1.54 0.00 0.00 0.00 175.10 173.89 1vhj n SER 204 N 9.45 0.33 -3.78 3.32 3.41 -0.12 0.13 113.62 126.37 1vhj n SER 204 Ca 0.21 0.13 -0.13 0.00 -0.26 0.00 0.00 58.87 58.82 1vhj n SER 204 Cb 0.46 1.30 -0.09 0.00 -0.26 0.00 0.00 64.21 65.62 1vhj n SER 204 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 1vhj s ASP 205 N -4.95 -0.19 -0.43 4.04 1.11 -1.22 -4.88 116.67 110.15 1vhj s ASP 205 Ca -0.05 0.15 -0.12 0.00 0.18 0.00 0.00 52.55 52.71 1vhj s ASP 205 Cb 0.12 0.36 0.07 0.00 1.07 0.00 0.00 42.92 44.53 1vhj s ASP 205 CO 0.86 -0.38 0.29 -2.28 1.18 0.00 0.00 175.17 174.85 1vhj s HIS 206 N -1.06 3.29 0.18 4.23 2.46 -1.12 -0.56 115.29 122.71 1vhj s HIS 206 Ca -0.11 -1.24 -0.13 0.00 0.47 0.00 0.00 55.06 54.05 1vhj s HIS 206 Cb -0.05 -2.94 0.10 0.00 -0.13 0.00 0.00 32.58 29.56 1vhj s HIS 206 CO 0.03 -0.80 1.84 0.82 -2.47 0.00 0.00 174.74 174.17 1vhj h ILE 207 N 5.94 1.13 0.00 0.89 2.04 -1.31 0.75 117.51 126.95 1vhj h ILE 207 Ca -0.25 -0.26 0.00 0.00 1.00 0.00 0.00 64.86 65.35 1vhj h ILE 207 Cb 1.10 0.30 0.00 0.00 -0.74 0.00 0.00 36.82 37.47 1vhj h ILE 207 CO 0.78 0.14 0.00 0.29 0.00 0.00 0.00 178.15 179.36 1vhj n LYS 208 N -4.70 0.00 0.00 2.37 5.02 -1.24 -3.83 118.16 115.78 1vhj n LYS 208 Ca 0.04 0.48 0.08 0.00 -2.02 0.00 0.00 58.31 56.90 1vhj n LYS 208 Cb 0.04 -1.29 0.39 0.00 -0.02 0.00 0.00 35.03 34.15 1vhj n LYS 208 CO 0.00 0.00 0.00 -2.37 -0.52 0.00 0.00 177.40 174.51 1vhj n THR 209 N -1.95 0.71 -1.07 -0.18 5.66 -1.25 -4.88 114.28 111.31 1vhj n THR 209 Ca 0.00 0.18 -0.02 0.00 -3.05 0.00 0.00 64.05 61.15 1vhj n THR 209 Cb 0.00 -0.89 -0.01 0.00 -1.55 0.00 0.00 70.33 67.88 1vhj n THR 209 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1vhj n GLY 210 N 0.21 0.51 0.31 1.09 0.00 0.25 -5.02 105.19 102.55 1vhj n GLY 210 Ca 0.06 -0.19 -0.03 0.00 0.00 0.00 0.00 46.02 45.86 1vhj n GLY 210 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1vhj n GLU 211 N -1.80 -1.81 0.00 1.61 -0.58 -1.18 -4.78 120.64 112.11 1vhj n GLU 211 Ca -0.02 -0.13 0.00 0.00 -0.42 0.00 0.00 57.16 56.59 1vhj n GLU 211 Cb 0.22 -0.18 0.00 0.00 -0.57 0.00 0.00 31.44 30.91 1vhj n GLU 211 CO 0.00 0.00 0.00 -1.91 -0.48 0.00 0.00 177.13 174.74 1vhj n GLU 217 N -2.08 0.00 -0.12 3.49 2.13 -1.26 -2.79 120.64 120.02 1vhj n GLU 217 Ca 0.01 0.00 -0.06 0.00 0.66 0.00 0.00 57.16 57.78 1vhj n GLU 217 Cb 0.05 0.00 0.02 0.00 0.27 0.00 0.00 31.44 31.79 1vhj n GLU 217 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1vhj h ARG 218 N 0.00 0.27 -0.24 5.31 -0.00 -2.00 0.17 114.38 117.89 1vhj h ARG 218 Ca 0.00 -0.02 -0.01 0.00 -0.50 0.00 0.00 59.98 59.45 1vhj h ARG 218 Cb 0.00 -0.06 -0.01 0.00 0.00 0.00 0.00 29.97 29.90 1vhj h ARG 218 CO 0.00 0.18 0.11 0.37 0.00 0.00 0.00 179.97 180.62 1vhj h GLN 219 N 0.28 0.36 -0.62 0.04 5.75 -2.05 0.39 115.11 119.26 1vhj h GLN 219 Ca 0.18 -0.06 -0.04 0.00 -0.15 0.00 0.00 58.65 58.58 1vhj h GLN 219 Cb 0.17 -0.06 -0.03 0.00 1.07 0.00 0.00 27.48 28.63 1vhj h GLN 219 CO -0.19 0.38 0.24 -0.91 -2.65 0.00 0.00 178.83 175.70 1vhj h ASN 220 N 0.25 0.83 0.82 -0.69 -0.26 -1.92 -0.98 115.58 113.62 1vhj h ASN 220 Ca 0.08 -0.11 -0.14 0.00 -0.56 0.00 0.00 56.30 55.57 1vhj h ASN 220 Cb 0.15 -0.21 -0.02 0.00 -1.06 0.00 0.00 38.32 37.18 1vhj h ASN 220 CO -0.01 0.75 -0.66 0.00 -1.06 0.00 0.00 177.43 176.45 1vhj h THR 221 N 0.89 1.37 -0.61 2.81 1.03 -0.41 -2.76 112.91 115.23 1vhj h THR 221 Ca 0.21 -2.34 -0.06 0.00 -0.01 0.00 0.00 66.41 64.21 1vhj h THR 221 Cb 0.19 2.30 -0.02 0.00 -1.07 0.00 0.00 68.15 69.54 1vhj h THR 221 CO -0.02 0.65 0.14 0.15 -0.01 0.00 0.00 175.52 176.43 1vhj h PHE 222 N 0.00 1.03 -0.54 0.00 3.57 -0.25 -2.12 116.94 118.63 1vhj h PHE 222 Ca -0.01 -0.13 -0.05 0.00 3.53 0.00 0.00 57.97 61.32 1vhj h PHE 222 Cb 1.24 -0.29 -0.03 0.00 2.79 0.00 0.00 35.95 39.67 1vhj h PHE 222 CO 0.00 0.87 0.15 -0.91 -2.23 0.00 0.00 178.31 176.20 1vhj h ASN 223 N 0.89 0.76 -0.62 0.41 2.35 -1.02 -1.44 115.58 116.92 1vhj h ASN 223 Ca 0.19 -0.12 -0.10 0.00 -0.55 0.00 0.00 56.30 55.72 1vhj h ASN 223 Cb 0.37 -0.20 -0.02 0.00 0.05 0.00 0.00 38.32 38.52 1vhj h ASN 223 CO 0.00 0.73 -0.00 -0.33 -1.65 0.00 0.00 177.43 176.18 1vhj h GLU 224 N 0.79 1.09 -0.34 0.81 3.07 -1.18 0.10 114.58 118.92 1vhj h GLU 224 Ca 0.18 -0.35 -0.00 0.00 -0.50 0.00 0.00 59.36 58.69 1vhj h GLU 224 Cb 0.26 -0.10 -0.02 0.00 -0.84 0.00 0.00 28.75 28.05 1vhj h GLU 224 CO -0.01 1.06 0.21 1.98 -1.40 0.00 0.00 179.01 180.85 1vhj h MET 225 N 0.99 0.46 -0.58 2.33 1.85 -0.89 -0.42 114.93 118.67 1vhj h MET 225 Ca 0.17 -0.04 -0.07 0.00 -0.61 0.00 0.00 59.70 59.16 1vhj h MET 225 Cb 0.57 -0.10 -0.02 0.00 0.43 0.00 0.00 31.60 32.48 1vhj h MET 225 CO 0.03 0.34 0.09 0.82 -0.40 0.00 0.00 176.91 177.80 1vhj h ILE 226 N 0.44 1.26 -0.59 1.77 1.08 -0.95 -1.17 117.51 119.36 1vhj h ILE 226 Ca 0.12 -0.98 -0.08 0.00 -0.39 0.00 0.00 64.86 63.53 1vhj h ILE 226 Cb -0.00 0.77 -0.02 0.00 -3.07 0.00 0.00 36.82 34.49 1vhj h ILE 226 CO -0.02 0.36 0.05 -0.33 -0.69 0.00 0.00 178.15 177.52 1vhj h GLU 227 N 0.86 0.98 -0.25 2.37 5.08 -0.52 -0.57 114.58 122.52 1vhj h GLU 227 Ca 0.18 -0.27 -0.00 0.00 -1.00 0.00 0.00 59.36 58.27 1vhj h GLU 227 Cb 0.42 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.55 1vhj h GLU 227 CO 0.01 0.93 0.15 0.82 -1.00 0.00 0.00 179.01 179.92 1vhj h ILE 228 N 0.91 1.10 -0.20 3.13 2.04 -0.85 0.25 117.51 123.90 1vhj h ILE 228 Ca 0.18 -0.25 -0.01 0.00 1.00 0.00 0.00 64.86 65.78 1vhj h ILE 228 Cb 0.46 0.82 -0.01 0.00 -0.74 0.00 0.00 36.82 37.35 1vhj h ILE 228 CO 0.02 0.10 0.10 0.00 0.00 0.00 0.00 178.15 178.37 1vhj h ALA 229 N 1.04 0.26 -0.43 1.87 0.00 -0.89 0.27 119.26 121.38 1vhj h ALA 229 Ca 0.09 -0.08 -0.07 0.00 0.00 0.00 0.00 54.91 54.85 1vhj h ALA 229 Cb 0.03 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 1vhj h ALA 229 CO -0.02 -0.19 -0.02 -0.07 0.00 0.00 0.00 179.25 178.95 1vhj h LEU 230 N 0.20 0.76 -1.59 0.00 3.38 -0.94 -2.69 115.31 114.44 1vhj h LEU 230 Ca 0.07 -0.32 -0.04 0.00 0.09 0.00 0.00 57.88 57.68 1vhj h LEU 230 Cb 0.11 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 1vhj h LEU 230 CO -0.01 0.90 -0.14 0.44 0.09 0.00 0.00 178.44 179.73 1vhj h ASP 231 N 0.61 0.08 0.45 -0.43 3.32 -0.33 -2.02 116.42 118.10 1vhj h ASP 231 Ca 0.12 -0.01 -0.06 0.00 0.02 0.00 0.00 57.03 57.10 1vhj h ASP 231 Cb 0.52 -0.02 -0.01 0.00 0.22 0.00 0.00 39.33 40.04 1vhj h ASP 231 CO 0.03 0.23 -0.27 0.77 -1.72 0.00 0.00 179.24 178.28 1vhj h SER 232 N 0.09 0.00 -0.30 6.45 4.64 -0.62 -1.96 113.55 121.85 1vhj h SER 232 Ca 0.02 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.31 1vhj h SER 232 Cb 0.30 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.38 1vhj h SER 232 CO 0.02 0.27 0.07 0.58 -0.87 0.00 0.00 176.83 176.90 1vhj h VAL 233 N 0.00 1.22 -0.34 0.95 2.07 -1.13 0.19 116.25 119.22 1vhj h VAL 233 Ca -0.00 -0.75 -0.12 0.00 0.82 0.00 0.00 66.70 66.64 1vhj h VAL 233 Cb 0.57 1.13 -0.01 0.00 -1.52 0.00 0.00 31.29 31.47 1vhj h VAL 233 CO 0.04 0.25 -0.27 -0.07 0.02 0.00 0.00 177.57 177.54 1vhj h LEU 234 N 0.33 0.83 -0.65 2.57 3.38 -1.46 -2.60 115.31 117.71 1vhj h LEU 234 Ca 0.09 -0.45 -0.00 0.00 0.09 0.00 0.00 57.88 57.62 1vhj h LEU 234 Cb 0.31 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.80 1vhj h LEU 234 CO 0.00 1.10 0.40 0.40 0.09 0.00 0.00 178.44 180.43 1vhj h ILE 235 N 0.56 1.18 0.00 1.22 2.04 -1.25 -2.41 117.51 118.85 1vhj h ILE 235 Ca 0.06 -0.39 -0.00 0.00 1.00 0.00 0.00 64.86 65.53 1vhj h ILE 235 Cb 0.84 0.28 -0.00 0.00 -0.74 0.00 0.00 36.82 37.19 1vhj h ILE 235 CO 0.07 0.18 -0.02 1.23 0.00 0.00 0.00 178.15 179.62 1vhj h GLY 236 N 0.88 0.00 2.00 5.37 0.00 -0.49 -2.17 103.07 108.65 1vhj h GLY 236 Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.56 1vhj h GLY 236 CO -0.05 0.00 0.00 -0.55 0.00 0.00 0.00 176.54 175.94 1vhj h ASP 237 N 0.00 0.00 -0.00 0.19 3.32 -1.03 -3.51 116.42 115.39 1vhj h ASP 237 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1vhj h ASP 237 Cb 0.04 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.59 1vhj h ASP 237 CO 0.00 0.00 0.00 0.00 -1.72 0.00 0.00 179.24 177.52