#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 2.49 0.34 0.00 -4.23 -0.96 -5.01 115.64 108.27 1vhj s THR 3 Ca 0.00 -0.64 0.08 0.00 -1.18 0.00 0.00 61.69 59.95 1vhj s THR 3 Cb 0.00 -2.85 0.10 0.00 1.34 0.00 0.00 72.50 71.09 1vhj s THR 3 CO 0.00 0.00 1.81 1.55 -0.54 0.00 0.00 174.62 177.44 1vhj h PRO 4 N -0.12 0.24 -0.01 3.99 0.13 -2.02 -3.22 132.00 131.00 1vhj h PRO 4 Ca -0.40 -0.08 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 1vhj h PRO 4 Cb 1.29 -0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.40 1vhj h PRO 4 CO 0.49 0.49 -0.40 0.72 -0.23 0.00 0.00 178.00 179.07 1vhj n HIS 5 N -4.16 0.00 -3.85 1.56 8.25 -1.26 -4.92 115.22 110.84 1vhj n HIS 5 Ca -0.01 0.00 -0.26 0.00 -0.26 0.00 0.00 57.72 57.19 1vhj n HIS 5 Cb 0.37 0.00 -0.17 0.00 1.12 0.00 0.00 29.99 31.31 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 -1.85 0.79 -1.01 1.59 1.01 -1.22 -4.67 121.20 115.85 1vhj s ILE 6 Ca 0.08 -0.18 -0.02 0.00 0.00 0.00 0.00 60.65 60.53 1vhj s ILE 6 Cb 0.10 -0.89 0.30 0.00 0.01 0.00 0.00 42.46 41.98 1vhj s ILE 6 CO 0.40 0.29 1.94 -0.46 0.00 0.00 0.00 174.94 177.11 1vhj n ASN 7 N 5.01 7.44 -4.63 3.58 6.94 -1.26 -2.26 115.26 130.08 1vhj n ASN 7 Ca -0.10 -3.66 -0.30 0.00 -0.02 0.00 0.00 54.58 50.49 1vhj n ASN 7 Cb 0.50 -1.17 -0.09 0.00 -2.36 0.00 0.00 39.78 36.66 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 -3.95 3.68 0.15 -2.53 0.00 -1.26 -4.73 121.76 113.13 1vhj s ALA 8 Ca 0.43 -0.95 0.07 0.00 0.00 0.00 0.00 51.96 51.51 1vhj s ALA 8 Cb 0.24 0.19 -0.04 0.00 0.00 0.00 0.00 23.12 23.51 1vhj s ALA 8 CO -0.18 -0.10 -0.05 -0.65 0.00 0.00 0.00 175.76 174.78 1vhj s GLN 9 N -3.82 2.26 0.18 0.00 -0.21 -1.26 -0.31 119.66 116.49 1vhj s GLN 9 Ca 0.15 -1.10 -0.33 0.00 0.02 0.00 0.00 55.36 54.10 1vhj s GLN 9 Cb 0.04 -2.31 -0.15 0.00 1.00 0.00 0.00 33.01 31.59 1vhj s GLN 9 CO 0.08 0.47 1.30 -0.12 -2.12 0.00 0.00 175.29 174.90 1vhj n MET 10 N 0.18 1.51 0.00 2.91 0.00 -1.26 -0.47 117.12 119.99 1vhj n MET 10 Ca -0.11 0.54 0.00 0.00 -0.00 0.00 0.00 57.70 58.13 1vhj n MET 10 Cb 0.54 -2.13 0.00 0.00 0.00 0.00 0.00 33.22 31.63 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 2.28 3.12 0.28 -5.12 0.00 -1.26 -4.91 105.19 99.58 1vhj n GLY 11 Ca 0.15 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.07 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 0.93 -3.40 1.61 3.32 -1.14 -3.43 116.42 114.31 1vhj h ASP 12 Ca 0.00 -0.33 -0.52 0.00 0.02 0.00 0.00 57.03 56.19 1vhj h ASP 12 Cb 0.00 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.28 1vhj h ASP 12 CO 0.00 1.10 -0.09 -0.36 -1.72 0.00 0.00 179.24 178.17 1vhj s PHE 13 N -4.69 3.45 1.01 4.55 0.40 -1.26 -4.72 117.98 116.71 1vhj s PHE 13 Ca -0.11 0.83 -0.17 0.00 -0.60 0.00 0.00 56.93 56.89 1vhj s PHE 13 Cb 0.13 -2.24 0.22 0.00 0.51 0.00 0.00 43.02 41.64 1vhj s PHE 13 CO 0.86 0.18 1.29 0.00 0.70 0.00 0.00 175.22 178.25 1vhj s ALA 14 N -1.98 1.93 -0.91 5.36 0.00 -1.26 -4.95 121.76 119.96 1vhj s ALA 14 Ca 0.47 -1.18 0.26 0.00 0.00 0.00 0.00 51.96 51.51 1vhj s ALA 14 Cb -0.11 -2.79 1.03 0.00 0.00 0.00 0.00 23.12 21.26 1vhj s ALA 14 CO 0.25 -2.67 1.81 -0.40 0.00 0.00 0.00 175.76 174.75 1vhj n ASP 15 N -3.96 0.23 -4.21 0.00 3.85 -1.26 -4.64 116.55 106.56 1vhj n ASP 15 Ca 0.15 0.53 -0.32 0.00 -0.71 0.00 0.00 54.79 54.44 1vhj n ASP 15 Cb 0.59 -0.59 -0.17 0.00 -1.35 0.00 0.00 41.12 39.61 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 -3.04 2.04 -0.06 2.12 0.11 -1.26 -0.15 120.40 120.15 1vhj s VAL 16 Ca 0.12 -1.00 0.03 0.00 -2.93 0.00 0.00 61.98 58.19 1vhj s VAL 16 Cb 0.15 -1.77 0.01 0.00 -1.53 0.00 0.00 36.38 33.24 1vhj s VAL 16 CO 0.50 0.55 -0.13 -0.69 -3.33 0.00 0.00 175.10 172.00 1vhj s VAL 17 N 0.44 1.20 -0.13 2.04 1.01 0.09 -2.07 120.40 122.98 1vhj s VAL 17 Ca -0.16 -0.53 -0.15 0.00 0.00 0.00 0.00 61.98 61.14 1vhj s VAL 17 Cb -0.17 -1.09 -0.05 0.00 0.00 0.00 0.00 36.38 35.07 1vhj s VAL 17 CO 0.07 0.37 0.35 -0.76 0.00 0.00 0.00 175.10 175.12 1vhj s LEU 18 N 0.57 4.28 -0.29 3.92 1.02 0.05 -0.80 118.68 127.43 1vhj s LEU 18 Ca -0.14 0.63 -0.01 0.00 0.02 0.00 0.00 54.13 54.63 1vhj s LEU 18 Cb -0.15 -2.47 0.09 0.00 0.02 0.00 0.00 46.19 43.68 1vhj s LEU 18 CO 0.04 0.11 0.09 -0.04 0.02 0.00 0.00 176.35 176.56 1vhj s MET 19 N 0.30 0.68 0.64 1.70 -1.94 0.26 -1.26 119.30 119.69 1vhj s MET 19 Ca 0.20 -0.93 -0.11 0.00 -1.71 0.00 0.00 55.69 53.14 1vhj s MET 19 Cb -0.14 -1.95 -0.02 0.00 2.01 0.00 0.00 34.83 34.73 1vhj s MET 19 CO 0.06 -0.93 1.04 -1.25 -0.01 0.00 0.00 175.02 173.93 1vhj s PRO 20 N 1.69 3.33 0.12 2.03 0.04 -1.25 -1.37 135.00 139.59 1vhj s PRO 20 Ca 0.08 0.60 -0.09 0.00 0.04 0.00 0.00 61.00 61.63 1vhj s PRO 20 Cb -0.17 -2.08 -0.11 0.00 0.04 0.00 0.00 34.50 32.17 1vhj s PRO 20 CO -0.23 -0.71 1.31 0.78 0.04 0.00 0.00 177.00 178.19 1vhj h GLY 21 N -0.40 0.69 -5.63 0.56 0.00 -1.83 -2.42 103.07 94.04 1vhj h GLY 21 Ca -0.44 -1.06 -0.59 0.00 0.00 0.00 0.00 47.33 45.23 1vhj h GLY 21 CO 0.63 0.94 0.61 -0.35 0.00 0.00 0.00 176.54 178.37 1vhj s ASP 22 N -7.11 6.90 0.45 0.19 -1.08 -1.26 -1.89 116.67 112.86 1vhj s ASP 22 Ca -0.08 1.08 0.11 0.00 -0.52 0.00 0.00 52.55 53.14 1vhj s ASP 22 Cb 0.09 -2.48 1.01 0.00 -1.46 0.00 0.00 42.92 40.08 1vhj s ASP 22 CO 0.89 -0.63 2.07 1.55 0.52 0.00 0.00 175.17 179.57 1vhj h PRO 23 N 7.74 0.36 0.00 4.34 0.13 -1.88 0.37 132.00 143.06 1vhj h PRO 23 Ca -0.22 -0.02 -0.05 0.00 -0.87 0.00 0.00 66.00 64.84 1vhj h PRO 23 Cb 1.08 -0.08 -0.01 0.00 0.13 0.00 0.00 31.00 32.12 1vhj h PRO 23 CO 0.93 0.24 -0.24 -0.07 -0.23 0.00 0.00 178.00 178.63 1vhj h LEU 24 N 0.37 0.00 -0.41 1.56 3.38 -1.91 -1.48 115.31 116.81 1vhj h LEU 24 Ca 0.13 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 57.92 1vhj h LEU 24 Cb 0.09 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.83 1vhj h LEU 24 CO -0.03 0.24 -0.69 0.03 0.09 0.00 0.00 178.44 178.08 1vhj h ARG 25 N 0.00 0.48 -0.42 1.13 3.08 -0.68 -1.76 114.38 116.20 1vhj h ARG 25 Ca -0.00 -0.37 -0.01 0.00 0.07 0.00 0.00 59.98 59.67 1vhj h ARG 25 Cb 0.63 0.07 -0.02 0.00 0.08 0.00 0.00 29.97 30.73 1vhj h ARG 25 CO 0.03 0.99 0.21 0.00 -1.07 0.00 0.00 179.97 180.14 1vhj h ALA 26 N 0.91 0.54 -0.60 0.04 0.00 -0.72 -0.30 119.26 119.15 1vhj h ALA 26 Ca -0.02 -0.10 0.01 0.00 0.00 0.00 0.00 54.91 54.79 1vhj h ALA 26 Cb 1.26 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.85 1vhj h ALA 26 CO 0.12 0.10 0.39 -0.22 0.00 0.00 0.00 179.25 179.64 1vhj h LYS 27 N 0.54 0.77 -0.44 0.00 3.64 -1.18 -0.50 116.57 119.40 1vhj h LYS 27 Ca 0.15 -0.05 0.04 0.00 -1.27 0.00 0.00 60.65 59.52 1vhj h LYS 27 Cb 0.10 -0.17 -0.04 0.00 -0.41 0.00 0.00 32.23 31.71 1vhj h LYS 27 CO -0.02 0.51 0.20 -0.92 -2.27 0.00 0.00 179.45 176.95 1vhj h TYR 28 N 0.79 0.37 -0.43 1.91 5.03 -0.85 -1.58 116.97 122.22 1vhj h TYR 28 Ca 0.22 0.02 -0.05 0.00 2.58 0.00 0.00 58.73 61.50 1vhj h TYR 28 Cb -0.07 -0.10 -0.02 0.00 1.55 0.00 0.00 36.73 38.08 1vhj h TYR 28 CO -0.04 0.18 0.07 0.82 -1.32 0.00 0.00 178.16 177.87 1vhj h ILE 29 N 0.41 1.25 -0.55 1.81 2.04 -0.86 -1.68 117.51 119.93 1vhj h ILE 29 Ca 0.19 -0.90 0.00 0.00 1.00 0.00 0.00 64.86 65.16 1vhj h ILE 29 Cb 0.12 0.99 -0.03 0.00 -0.74 0.00 0.00 36.82 37.16 1vhj h ILE 29 CO -0.15 0.31 0.36 0.00 0.00 0.00 0.00 178.15 178.67 1vhj h ALA 30 N 0.94 0.70 -0.17 1.87 0.00 -0.89 -0.83 119.26 120.89 1vhj h ALA 30 Ca 0.13 -0.05 -0.20 0.00 0.00 0.00 0.00 54.91 54.80 1vhj h ALA 30 Cb 0.38 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1vhj h ALA 30 CO 0.01 0.15 -0.69 0.93 0.00 0.00 0.00 179.25 179.65 1vhj h GLU 31 N 0.75 0.68 0.00 0.00 5.08 -1.24 -3.14 114.58 116.71 1vhj h GLU 31 Ca 0.20 -0.51 0.00 0.00 -1.00 0.00 0.00 59.36 58.05 1vhj h GLU 31 Cb -0.07 0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.28 1vhj h GLU 31 CO -0.04 1.13 -1.72 0.09 -1.00 0.00 0.00 179.01 177.47 1vhj n ASN 32 N -3.93 0.58 -0.01 1.42 3.02 -0.64 -4.67 115.26 111.03 1vhj n ASN 32 Ca -0.05 -0.17 0.00 0.00 -0.03 0.00 0.00 54.58 54.32 1vhj n ASN 32 Cb 0.69 1.74 -0.04 0.00 -0.61 0.00 0.00 39.78 41.57 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 -2.05 0.00 -3.99 3.10 3.01 -0.33 -5.04 117.46 112.17 1vhj n PHE 33 Ca -0.02 0.00 -0.28 0.00 1.01 0.00 0.00 57.45 58.15 1vhj n PHE 33 Cb 0.47 -0.16 -0.04 0.00 -0.01 0.00 0.00 39.48 39.74 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 -3.83 4.12 -0.09 4.37 1.43 -1.15 -4.81 118.68 118.72 1vhj s LEU 34 Ca -0.02 0.09 -0.12 0.00 -1.03 0.00 0.00 54.13 53.06 1vhj s LEU 34 Cb 0.02 -2.73 -0.05 0.00 0.03 0.00 0.00 46.19 43.46 1vhj s LEU 34 CO 0.19 0.11 0.28 -1.81 0.23 0.00 0.00 176.35 175.35 1vhj s ASP 35 N -2.86 6.55 -1.59 2.29 1.01 0.10 -4.48 116.67 117.69 1vhj s ASP 35 Ca 0.33 0.65 -0.14 0.00 0.71 0.00 0.00 52.55 54.10 1vhj s ASP 35 Cb -0.12 -2.17 0.11 0.00 1.01 0.00 0.00 42.92 41.76 1vhj s ASP 35 CO 0.26 0.29 0.85 0.59 0.21 0.00 0.00 175.17 177.37 1vhj n ASN 36 N 2.42 -3.74 -4.76 0.27 3.02 -1.26 -1.73 115.26 109.47 1vhj n ASN 36 Ca -0.15 -0.90 -0.40 0.00 -0.03 0.00 0.00 54.58 53.10 1vhj n ASN 36 Cb 0.53 -3.35 -0.04 0.00 -0.61 0.00 0.00 39.78 36.31 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 -3.35 3.38 -0.04 5.41 0.00 -1.26 -4.67 121.76 121.22 1vhj s ALA 37 Ca 0.63 0.95 0.05 0.00 0.00 0.00 0.00 51.96 53.59 1vhj s ALA 37 Cb -0.33 -3.35 -0.01 0.00 0.00 0.00 0.00 23.12 19.43 1vhj s ALA 37 CO 0.88 -0.28 -0.18 0.54 0.00 0.00 0.00 175.76 176.72 1vhj s VAL 38 N -1.22 1.46 0.25 0.00 0.11 -0.40 -4.92 120.40 115.69 1vhj s VAL 38 Ca 0.47 -0.74 -0.30 0.00 -2.93 0.00 0.00 61.98 58.48 1vhj s VAL 38 Cb -0.32 -1.24 -0.11 0.00 -1.53 0.00 0.00 36.38 33.18 1vhj s VAL 38 CO 0.42 0.42 1.53 -1.58 -3.33 0.00 0.00 175.10 172.56 1vhj s GLN 39 N -0.07 4.20 0.00 1.54 0.74 -1.26 -1.28 119.66 123.53 1vhj s GLN 39 Ca -0.02 2.43 0.04 0.00 0.05 0.00 0.00 55.36 57.87 1vhj s GLN 39 Cb -0.11 -3.08 -0.04 0.00 1.10 0.00 0.00 33.01 30.88 1vhj s GLN 39 CO 0.02 -0.54 0.22 1.33 -0.55 0.00 0.00 175.29 175.76 1vhj n VAL 40 N 2.57 0.00 -3.51 1.34 0.24 0.13 -4.89 118.33 114.21 1vhj n VAL 40 Ca 0.09 -0.40 -0.13 0.00 -2.04 0.00 0.00 64.34 61.85 1vhj n VAL 40 Cb 0.39 1.01 -0.04 0.00 -1.47 0.00 0.00 33.84 33.72 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 0.40 0.00 -4.65 0.00 3.85 -1.26 -2.05 116.55 112.84 1vhj n ASP 42 Ca -0.15 -1.13 -0.45 0.00 -0.71 0.00 0.00 54.79 52.35 1vhj n ASP 42 Cb 0.60 -0.03 -0.03 0.00 -1.35 0.00 0.00 41.12 40.31 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 1.04 -2.02 2.12 0.31 -1.26 -0.97 118.33 117.55 1vhj n VAL 43 Ca 0.00 -0.26 -0.20 0.00 -0.01 0.00 0.00 64.34 63.87 1vhj n VAL 43 Cb 0.53 -1.34 -0.04 0.00 -0.91 0.00 0.00 33.84 32.07 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 1.84 -1.61 -1.47 5.55 1.74 -1.26 -0.99 116.66 120.47 1vhj n ARG 44 Ca 0.12 1.06 -0.16 0.00 -0.77 0.00 0.00 57.85 58.09 1vhj n ARG 44 Cb 0.30 -5.58 -0.07 0.00 -1.02 0.00 0.00 32.46 26.09 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 -1.65 -5.18 -4.42 0.55 3.02 -0.14 -4.90 115.26 102.54 1vhj n ASN 45 Ca -0.22 0.40 -0.45 0.00 -0.03 0.00 0.00 54.58 54.29 1vhj n ASN 45 Cb 0.67 -4.10 -0.01 0.00 -0.61 0.00 0.00 39.78 35.72 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 -3.34 3.88 0.33 3.52 1.75 -0.16 -4.83 119.30 120.45 1vhj s MET 46 Ca 0.00 -2.40 -0.29 0.00 -1.25 0.00 0.00 55.69 51.75 1vhj s MET 46 Cb 0.00 -4.85 -0.12 0.00 2.84 0.00 0.00 34.83 32.70 1vhj s MET 46 CO 0.00 -1.62 1.46 1.19 -0.65 0.00 0.00 175.02 175.40 1vhj n PHE 47 N 5.27 2.68 -4.10 4.11 0.99 -1.26 -4.21 117.46 120.93 1vhj n PHE 47 Ca 0.28 0.41 -0.15 0.00 -0.00 0.00 0.00 57.45 57.99 1vhj n PHE 47 Cb 0.45 -2.51 -0.14 0.00 -1.00 0.00 0.00 39.48 36.27 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 0.06 0.21 0.04 1.37 0.00 -0.87 -2.05 107.32 106.09 1vhj s GLY 48 Ca 0.59 -0.19 0.01 0.00 0.00 0.00 0.00 44.72 45.13 1vhj s GLY 48 CO 0.57 -0.17 -0.06 -0.19 0.00 0.00 0.00 173.10 173.26 1vhj s TYR 49 N -0.13 0.55 -0.07 1.90 1.51 0.14 0.22 117.35 121.47 1vhj s TYR 49 Ca 0.01 -0.58 0.02 0.00 -1.01 0.00 0.00 57.07 55.51 1vhj s TYR 49 Cb -0.02 -0.34 0.02 0.00 -0.11 0.00 0.00 41.96 41.50 1vhj s TYR 49 CO -0.00 -0.14 -0.11 0.99 -1.11 0.00 0.00 175.55 175.18 1vhj s THR 50 N -1.75 1.05 0.00 -0.71 2.01 -0.40 -0.36 115.64 115.48 1vhj s THR 50 Ca -0.09 -0.41 0.00 0.00 0.31 0.00 0.00 61.69 61.50 1vhj s THR 50 Cb -0.08 -0.99 0.00 0.00 0.01 0.00 0.00 72.50 71.45 1vhj s THR 50 CO -0.01 0.34 0.00 0.61 -0.69 0.00 0.00 174.62 174.87 1vhj n GLY 51 N 4.03 4.58 2.97 4.40 0.00 0.26 -1.27 105.19 120.16 1vhj n GLY 51 Ca -0.21 -1.01 -0.16 0.00 0.00 0.00 0.00 46.02 44.63 1vhj n GLY 51 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1vhj s THR 52 N -0.53 0.45 -0.26 2.61 2.01 -0.71 -0.40 115.64 118.82 1vhj s THR 52 Ca 0.00 -0.27 0.02 0.00 0.31 0.00 0.00 61.69 61.75 1vhj s THR 52 Cb 0.00 -0.39 0.06 0.00 0.01 0.00 0.00 72.50 72.19 1vhj s THR 52 CO 0.00 0.11 -0.07 -0.47 -0.69 0.00 0.00 174.62 173.50 1vhj s TYR 53 N -0.17 3.00 -1.47 4.92 6.14 -0.09 0.03 117.35 129.71 1vhj s TYR 53 Ca 0.02 -2.20 -0.09 0.00 0.64 0.00 0.00 57.07 55.44 1vhj s TYR 53 Cb -0.02 -1.90 0.06 0.00 0.42 0.00 0.00 41.96 40.51 1vhj s TYR 53 CO -0.00 -0.85 0.85 1.63 0.64 0.00 0.00 175.55 177.82 1vhj n LYS 54 N 4.50 -5.06 -0.18 4.97 5.02 -1.26 -1.14 118.16 125.01 1vhj n LYS 54 Ca -0.11 0.58 0.00 0.00 -2.02 0.00 0.00 58.31 56.75 1vhj n LYS 54 Cb 0.43 -5.31 0.00 0.00 -0.02 0.00 0.00 35.03 30.13 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 -1.67 1.92 3.59 0.72 0.00 -1.26 -5.02 105.19 103.47 1vhj n GLY 55 Ca -0.08 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.58 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 -0.25 3.93 0.08 1.61 3.00 -0.29 -5.06 118.95 121.97 1vhj s ARG 56 Ca 0.00 -0.34 -0.31 0.00 -1.00 0.00 0.00 55.73 54.09 1vhj s ARG 56 Cb 0.00 -3.50 -0.09 0.00 0.00 0.00 0.00 34.95 31.36 1vhj s ARG 56 CO 0.00 -0.05 1.75 0.50 0.00 0.00 0.00 175.30 177.51 1vhj s ARG 57 N 1.32 4.17 0.01 5.12 3.52 -1.26 -0.91 118.95 130.92 1vhj s ARG 57 Ca 0.07 2.45 0.01 0.00 -0.13 0.00 0.00 55.73 58.12 1vhj s ARG 57 Cb -0.15 -3.67 -0.01 0.00 -1.56 0.00 0.00 34.95 29.56 1vhj s ARG 57 CO 0.06 -0.80 -0.03 0.42 -0.81 0.00 0.00 175.30 174.14 1vhj s ILE 58 N 2.93 0.20 0.18 4.11 1.01 0.46 -4.75 121.20 125.34 1vhj s ILE 58 Ca 0.78 -0.50 0.10 0.00 0.00 0.00 0.00 60.65 61.02 1vhj s ILE 58 Cb -0.42 -0.25 -0.04 0.00 0.01 0.00 0.00 42.46 41.76 1vhj s ILE 58 CO 0.35 -0.20 -0.15 -0.44 0.00 0.00 0.00 174.94 174.50 1vhj s SER 59 N -0.74 3.95 -0.02 3.58 0.01 -0.88 -0.58 113.70 119.02 1vhj s SER 59 Ca -0.06 -0.68 0.01 0.00 1.31 0.00 0.00 55.95 56.53 1vhj s SER 59 Cb -0.05 -0.55 0.02 0.00 0.21 0.00 0.00 66.02 65.65 1vhj s SER 59 CO -0.00 0.11 -0.01 0.54 0.41 0.00 0.00 173.24 174.29 1vhj s VAL 60 N -1.65 0.21 -0.18 3.43 0.11 0.51 -0.77 120.40 122.06 1vhj s VAL 60 Ca 0.23 0.02 -0.19 0.00 -2.93 0.00 0.00 61.98 59.11 1vhj s VAL 60 Cb -0.09 -0.27 0.05 0.00 -1.53 0.00 0.00 36.38 34.55 1vhj s VAL 60 CO 0.13 0.13 0.52 -0.32 -3.33 0.00 0.00 175.10 172.23 1vhj s MET 61 N 0.72 0.64 0.64 1.54 1.75 -0.39 0.24 119.30 124.45 1vhj s MET 61 Ca -0.07 0.65 -0.15 0.00 -1.25 0.00 0.00 55.69 54.87 1vhj s MET 61 Cb -0.10 0.31 -0.01 0.00 2.84 0.00 0.00 34.83 37.86 1vhj s MET 61 CO -0.01 -0.09 1.09 0.20 -0.65 0.00 0.00 175.02 175.55 1vhj s GLY 62 N 0.11 2.10 0.00 2.11 0.00 -0.87 -3.77 107.32 107.00 1vhj s GLY 62 Ca -0.01 0.45 0.00 0.00 0.00 0.00 0.00 44.72 45.15 1vhj s GLY 62 CO 0.01 0.78 0.68 -2.39 0.00 0.00 0.00 173.10 172.19 1vhj n HIS 63 N -2.35 0.00 -4.41 1.90 1.44 -0.91 -4.86 115.22 106.04 1vhj n HIS 63 Ca 0.09 -0.23 0.00 0.00 -2.01 0.00 0.00 57.72 55.58 1vhj n HIS 63 Cb 0.52 -0.02 -0.00 0.00 0.12 0.00 0.00 29.99 30.61 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 -0.23 -1.51 3.66 -1.39 0.00 -0.80 -3.18 105.19 101.75 1vhj n GLY 64 Ca 0.00 -1.21 -0.35 0.00 0.00 0.00 0.00 46.02 44.46 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 -0.05 3.37 0.00 1.61 1.00 -1.26 -4.65 119.30 119.32 1vhj s MET 65 Ca 0.00 -0.38 0.00 0.00 0.00 0.00 0.00 55.69 55.31 1vhj s MET 65 Cb 0.00 -2.95 0.00 0.00 0.00 0.00 0.00 34.83 31.88 1vhj s MET 65 CO 0.00 0.54 0.00 0.41 0.00 0.00 0.00 175.02 175.97 1vhj n GLY 66 N 2.66 0.24 0.18 -0.03 0.00 -1.26 -4.40 105.19 102.58 1vhj n GLY 66 Ca -0.18 -1.76 -0.08 0.00 0.00 0.00 0.00 46.02 43.99 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 1.13 -0.45 -0.61 2.04 -1.85 -0.34 117.51 117.43 1vhj h ILE 67 Ca 0.00 -0.31 -0.05 0.00 1.00 0.00 0.00 64.86 65.50 1vhj h ILE 67 Cb 0.00 0.59 -0.02 0.00 -0.74 0.00 0.00 36.82 36.65 1vhj h ILE 67 CO 0.00 0.14 0.08 -0.65 0.00 0.00 0.00 178.15 177.71 1vhj h PRO 68 N 0.55 0.75 0.08 2.37 0.11 -1.92 0.75 132.00 134.68 1vhj h PRO 68 Ca 0.15 -0.20 -0.00 0.00 0.11 0.00 0.00 66.00 66.06 1vhj h PRO 68 Cb 0.00 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 31.03 1vhj h PRO 68 CO -0.03 0.77 -0.04 1.03 -0.21 0.00 0.00 178.00 179.52 1vhj h SER 69 N 0.61 -0.09 -0.99 -2.05 0.87 -1.72 -2.80 113.55 107.39 1vhj h SER 69 Ca 0.14 -0.18 0.06 0.00 -1.23 0.00 0.00 61.79 60.57 1vhj h SER 69 Cb 0.38 0.02 -0.06 0.00 -0.44 0.00 0.00 62.40 62.30 1vhj h SER 69 CO 0.01 0.14 0.64 0.00 -0.53 0.00 0.00 176.83 177.08 1vhj h SER 71 N 1.18 0.94 0.21 0.00 0.02 -0.82 -1.86 113.55 113.22 1vhj h SER 71 Ca 0.42 -0.16 0.00 0.00 -0.84 0.00 0.00 61.79 61.21 1vhj h SER 71 Cb 0.13 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 62.41 1vhj h SER 71 CO -0.16 0.84 -0.18 0.40 -1.14 0.00 0.00 176.83 176.59 1vhj h ILE 72 N 0.98 0.61 -0.17 3.27 2.04 -1.17 -0.42 117.51 122.66 1vhj h ILE 72 Ca 0.23 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 66.08 1vhj h ILE 72 Cb 0.17 0.61 -0.01 0.00 -0.74 0.00 0.00 36.82 36.85 1vhj h ILE 72 CO -0.02 0.00 0.05 1.88 0.00 0.00 0.00 178.15 180.06 1vhj h TYR 73 N -0.41 0.28 0.00 1.37 0.05 -1.43 -1.69 116.97 115.14 1vhj h TYR 73 Ca -0.01 -0.03 -0.11 0.00 0.05 0.00 0.00 58.73 58.64 1vhj h TYR 73 Cb 0.37 -0.08 -0.02 0.00 1.01 0.00 0.00 36.73 38.02 1vhj h TYR 73 CO -0.13 0.38 -0.52 -0.39 -1.05 0.00 0.00 178.16 176.45 1vhj h VAL 74 N 0.09 1.23 -0.19 -2.88 -1.51 -1.36 0.24 116.25 111.88 1vhj h VAL 74 Ca 0.05 -1.88 -0.02 0.00 -1.23 0.00 0.00 66.70 63.63 1vhj h VAL 74 Cb 0.23 2.05 -0.01 0.00 -2.13 0.00 0.00 31.29 31.44 1vhj h VAL 74 CO -0.00 0.51 0.05 0.74 -1.23 0.00 0.00 177.57 177.64 1vhj h THR 75 N 0.00 1.20 -0.69 7.19 2.02 -0.92 -0.75 112.91 120.97 1vhj h THR 75 Ca -0.01 -0.65 -0.07 0.00 0.77 0.00 0.00 66.41 66.46 1vhj h THR 75 Cb 1.01 1.28 -0.03 0.00 -1.74 0.00 0.00 68.15 68.68 1vhj h THR 75 CO 0.07 0.20 0.17 -0.33 0.37 0.00 0.00 175.52 176.00 1vhj h GLU 76 N 0.11 1.10 -0.68 6.66 5.08 -1.08 0.38 114.58 126.16 1vhj h GLU 76 Ca 0.06 -0.26 0.05 0.00 -1.00 0.00 0.00 59.36 58.21 1vhj h GLU 76 Cb 0.27 -0.14 -0.05 0.00 0.50 0.00 0.00 28.75 29.32 1vhj h GLU 76 CO 0.00 0.97 0.39 -0.07 -1.00 0.00 0.00 179.01 179.30 1vhj h LEU 77 N 1.03 0.60 0.01 1.33 3.38 -0.83 -0.37 115.31 120.46 1vhj h LEU 77 Ca 0.22 0.02 -0.00 0.00 0.09 0.00 0.00 57.88 58.21 1vhj h LEU 77 Cb 0.36 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.01 1vhj h LEU 77 CO 0.00 0.40 -0.00 0.40 0.09 0.00 0.00 178.44 179.33 1vhj h ILE 78 N 0.74 1.52 0.00 1.22 2.04 -0.80 -1.60 117.51 120.62 1vhj h ILE 78 Ca 0.29 -1.57 -0.11 0.00 1.00 0.00 0.00 64.86 64.47 1vhj h ILE 78 Cb 0.14 2.58 -0.02 0.00 -0.74 0.00 0.00 36.82 38.78 1vhj h ILE 78 CO -0.16 0.40 -0.68 0.07 0.00 0.00 0.00 178.15 177.79 1vhj h LYS 79 N -0.68 0.00 0.00 2.37 2.10 -0.91 -3.22 116.57 116.23 1vhj h LYS 79 Ca -0.00 0.00 -0.13 0.00 -2.00 0.00 0.00 60.65 58.52 1vhj h LYS 79 Cb 0.67 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 31.97 1vhj h LYS 79 CO 0.00 0.44 -1.69 -0.25 -2.00 0.00 0.00 179.45 175.95 1vhj n ASP 80 N -3.15 2.21 -0.74 7.07 8.00 -0.17 -4.66 116.55 125.13 1vhj n ASP 80 Ca -0.00 0.00 0.08 0.00 0.71 0.00 0.00 54.79 55.57 1vhj n ASP 80 Cb 0.75 1.07 0.14 0.00 -0.02 0.00 0.00 41.12 43.06 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 -2.23 0.33 -1.07 1.24 4.02 -0.67 -4.72 117.16 114.05 1vhj n TYR 81 Ca -0.12 -0.26 -0.02 0.00 -0.01 0.00 0.00 57.90 57.48 1vhj n TYR 81 Cb 0.66 -0.01 -0.01 0.00 -0.02 0.00 0.00 39.34 39.96 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 0.86 0.56 3.73 2.72 0.00 -1.05 -4.58 105.19 107.42 1vhj n GLY 82 Ca 0.12 -0.32 -0.42 0.00 0.00 0.00 0.00 46.02 45.41 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 -1.92 2.43 -0.17 1.61 1.01 -0.81 -4.81 120.40 117.74 1vhj s VAL 83 Ca 0.00 0.33 0.07 0.00 0.00 0.00 0.00 61.98 62.38 1vhj s VAL 83 Cb 0.00 -3.21 -0.15 0.00 0.00 0.00 0.00 36.38 33.02 1vhj s VAL 83 CO 0.00 0.03 -0.06 0.29 0.00 0.00 0.00 175.10 175.36 1vhj n LYS 84 N 3.42 1.03 -4.30 2.72 4.76 0.78 -4.58 118.16 121.98 1vhj n LYS 84 Ca 0.12 0.05 -0.20 0.00 -2.87 0.00 0.00 58.31 55.41 1vhj n LYS 84 Cb 0.38 -1.38 -0.16 0.00 -1.84 0.00 0.00 35.03 32.03 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 -2.37 0.96 -0.09 1.97 1.02 -0.70 -1.97 119.74 118.57 1vhj s LYS 85 Ca -0.16 -0.22 0.03 0.00 0.02 0.00 0.00 55.97 55.63 1vhj s LYS 85 Cb 0.05 -0.90 0.01 0.00 -0.52 0.00 0.00 37.83 36.47 1vhj s LYS 85 CO 0.52 0.02 -0.19 0.42 -0.92 0.00 0.00 175.35 175.20 1vhj s ILE 86 N 0.54 1.66 -0.29 2.17 -1.09 -0.36 -0.73 121.20 123.10 1vhj s ILE 86 Ca -0.08 -0.78 0.02 0.00 -2.23 0.00 0.00 60.65 57.58 1vhj s ILE 86 Cb -0.12 -1.46 0.07 0.00 -1.58 0.00 0.00 42.46 39.37 1vhj s ILE 86 CO 0.01 0.47 -0.05 -0.63 -1.23 0.00 0.00 174.94 173.51 1vhj s ILE 87 N 0.51 2.33 0.10 2.92 1.01 0.02 -1.01 121.20 127.07 1vhj s ILE 87 Ca -0.16 -1.80 -0.29 0.00 0.00 0.00 0.00 60.65 58.40 1vhj s ILE 87 Cb -0.17 -2.47 -0.06 0.00 0.01 0.00 0.00 42.46 39.78 1vhj s ILE 87 CO 0.06 -0.20 0.91 -0.60 0.00 0.00 0.00 174.94 175.11 1vhj s ARG 88 N 1.07 4.65 -0.04 2.79 3.52 0.16 -0.57 118.95 130.52 1vhj s ARG 88 Ca -0.03 1.36 0.05 0.00 -0.13 0.00 0.00 55.73 56.98 1vhj s ARG 88 Cb -0.20 -3.37 -0.01 0.00 -1.56 0.00 0.00 34.95 29.81 1vhj s ARG 88 CO -0.05 0.24 -0.19 0.14 -0.81 0.00 0.00 175.30 174.62 1vhj s VAL 89 N -0.04 1.61 0.02 7.11 -7.23 -0.47 -0.55 120.40 120.85 1vhj s VAL 89 Ca 0.45 -0.82 -0.03 0.00 -1.81 0.00 0.00 61.98 59.76 1vhj s VAL 89 Cb -0.23 -1.37 0.01 0.00 0.56 0.00 0.00 36.38 35.35 1vhj s VAL 89 CO 0.28 0.46 0.16 0.61 -0.31 0.00 0.00 175.10 176.29 1vhj n GLY 90 N 3.05 1.03 3.86 2.32 0.00 -1.06 -3.79 105.19 110.60 1vhj n GLY 90 Ca -0.18 -0.93 -0.25 0.00 0.00 0.00 0.00 46.02 44.66 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 -1.36 5.82 0.14 1.61 0.01 -1.26 -0.98 113.70 117.68 1vhj s SER 91 Ca 0.04 -0.04 -0.07 0.00 1.31 0.00 0.00 55.95 57.18 1vhj s SER 91 Cb -0.00 -1.60 -0.01 0.00 0.21 0.00 0.00 66.02 64.61 1vhj s SER 91 CO 0.01 0.04 0.22 0.00 0.41 0.00 0.00 173.24 173.92 1vhj s GLY 93 N -2.96 2.20 0.04 0.00 0.00 -0.15 -1.06 107.32 105.39 1vhj s GLY 93 Ca 0.15 -0.70 0.02 0.00 0.00 0.00 0.00 44.72 44.19 1vhj s GLY 93 CO -0.02 -0.57 0.07 0.00 0.00 0.00 0.00 173.10 172.57 1vhj s ALA 94 N -1.33 3.53 -0.05 3.20 0.00 0.16 0.83 121.76 128.11 1vhj s ALA 94 Ca 0.28 -0.95 0.06 0.00 0.00 0.00 0.00 51.96 51.35 1vhj s ALA 94 Cb -0.13 -1.47 -0.09 0.00 0.00 0.00 0.00 23.12 21.43 1vhj s ALA 94 CO 0.18 0.71 0.16 1.33 0.00 0.00 0.00 175.76 178.14 1vhj n VAL 95 N 0.86 0.00 -3.36 0.00 0.24 -1.26 -0.73 118.33 114.07 1vhj n VAL 95 Ca -0.11 -0.17 -0.36 0.00 -2.04 0.00 0.00 64.34 61.66 1vhj n VAL 95 Cb 0.52 0.44 -0.06 0.00 -1.47 0.00 0.00 33.84 33.27 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 -2.58 6.85 0.37 -1.34 3.84 -1.26 -4.63 114.94 116.19 1vhj s ASN 96 Ca -0.02 1.08 0.12 0.00 0.21 0.00 0.00 52.86 54.25 1vhj s ASN 96 Cb 0.04 -2.29 0.73 0.00 -0.55 0.00 0.00 41.25 39.18 1vhj s ASN 96 CO 0.26 0.14 1.84 1.05 -2.79 0.00 0.00 177.10 177.60 1vhj h GLU 97 N 3.73 0.07 0.00 0.43 -0.00 -1.96 -2.78 114.58 114.06 1vhj h GLU 97 Ca -0.49 -0.02 0.00 0.00 -0.00 0.00 0.00 59.36 58.85 1vhj h GLU 97 Cb 1.20 -0.01 0.00 0.00 -0.00 0.00 0.00 28.75 29.94 1vhj h GLU 97 CO 0.65 0.38 0.00 0.41 -0.00 0.00 0.00 179.01 180.45 1vhj n GLY 98 N -0.56 -1.11 3.45 1.06 0.00 -1.26 -4.72 105.19 102.05 1vhj n GLY 98 Ca -0.02 -0.09 -0.34 0.00 0.00 0.00 0.00 46.02 45.57 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 -2.73 3.66 0.25 -0.61 1.01 -1.05 -5.12 121.20 116.62 1vhj s ILE 99 Ca 0.17 -0.43 0.08 0.00 0.00 0.00 0.00 60.65 60.47 1vhj s ILE 99 Cb 0.15 -2.60 -0.04 0.00 0.01 0.00 0.00 42.46 39.97 1vhj s ILE 99 CO 0.36 0.49 0.13 -0.54 0.00 0.00 0.00 174.94 175.38 1vhj s LYS 100 N 0.54 2.72 0.41 2.79 -0.14 -1.26 -4.83 119.74 119.97 1vhj s LYS 100 Ca -0.04 -1.16 -0.26 0.00 -1.36 0.00 0.00 55.97 53.15 1vhj s LYS 100 Cb -0.15 -2.44 -0.10 0.00 -1.68 0.00 0.00 37.83 33.47 1vhj s LYS 100 CO 0.03 0.39 1.38 1.33 -0.76 0.00 0.00 175.35 177.72 1vhj n VAL 101 N -1.05 2.43 -0.51 3.17 0.24 -1.26 -1.65 118.33 119.70 1vhj n VAL 101 Ca -0.07 -0.50 0.00 0.00 -2.04 0.00 0.00 64.34 61.73 1vhj n VAL 101 Cb 0.58 -1.76 0.00 0.00 -1.47 0.00 0.00 33.84 31.19 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 0.12 0.00 -2.44 7.34 1.74 0.19 -4.96 116.66 118.65 1vhj n ARG 102 Ca 0.05 0.00 -0.36 0.00 -0.77 0.00 0.00 57.85 56.76 1vhj n ARG 102 Cb 0.40 -1.59 -0.03 0.00 -1.02 0.00 0.00 32.46 30.22 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 -3.13 6.47 -0.24 0.55 1.11 -0.66 -4.72 116.67 116.05 1vhj s ASP 103 Ca 0.00 2.11 -0.11 0.00 0.18 0.00 0.00 52.55 54.73 1vhj s ASP 103 Cb 0.00 -2.59 -0.05 0.00 1.07 0.00 0.00 42.92 41.35 1vhj s ASP 103 CO 0.00 -0.70 0.18 -0.69 1.18 0.00 0.00 175.17 175.14 1vhj s VAL 104 N -1.68 5.34 0.04 -1.27 1.01 -1.26 -0.37 120.40 122.20 1vhj s VAL 104 Ca 0.62 0.21 0.09 0.00 0.00 0.00 0.00 61.98 62.89 1vhj s VAL 104 Cb -0.23 -3.52 -0.03 0.00 0.00 0.00 0.00 36.38 32.60 1vhj s VAL 104 CO 0.28 0.32 -0.25 0.68 0.00 0.00 0.00 175.10 176.14 1vhj s VAL 105 N 1.18 2.05 -0.15 2.92 -7.23 0.20 -1.04 120.40 118.32 1vhj s VAL 105 Ca 0.08 -1.32 -0.01 0.00 -1.81 0.00 0.00 61.98 58.92 1vhj s VAL 105 Cb -0.14 -1.75 -0.01 0.00 0.56 0.00 0.00 36.38 35.04 1vhj s VAL 105 CO 0.06 0.36 -0.12 -0.63 -0.31 0.00 0.00 175.10 174.46 1vhj s ILE 106 N -0.78 3.06 -0.91 -0.62 1.01 0.10 -0.99 121.20 122.08 1vhj s ILE 106 Ca 0.11 -0.64 -0.20 0.00 0.00 0.00 0.00 60.65 59.92 1vhj s ILE 106 Cb -0.10 -2.31 0.11 0.00 0.01 0.00 0.00 42.46 40.17 1vhj s ILE 106 CO 0.02 0.50 1.16 -0.83 0.00 0.00 0.00 174.94 175.79 1vhj s GLY 107 N 0.64 1.73 0.31 6.18 0.00 -0.32 -1.66 107.32 114.20 1vhj s GLY 107 Ca -0.06 -2.54 0.05 0.00 0.00 0.00 0.00 44.72 42.17 1vhj s GLY 107 CO 0.03 2.14 1.77 1.98 0.00 0.00 0.00 173.10 179.01 1vhj h MET 108 N 9.11 0.36 -4.93 2.90 4.05 -1.21 -3.39 114.93 121.83 1vhj h MET 108 Ca 0.10 -0.13 -0.34 0.00 -0.28 0.00 0.00 59.70 59.05 1vhj h MET 108 Cb 1.03 -0.03 -0.14 0.00 -0.80 0.00 0.00 31.60 31.66 1vhj h MET 108 CO 1.17 0.60 -0.64 0.20 0.23 0.00 0.00 176.91 178.47 1vhj s GLY 109 N -4.07 1.55 -0.17 1.39 0.00 -1.17 -1.22 107.32 103.63 1vhj s GLY 109 Ca -0.06 -1.77 -0.04 0.00 0.00 0.00 0.00 44.72 42.85 1vhj s GLY 109 CO 0.77 -1.60 0.25 0.00 0.00 0.00 0.00 173.10 172.52 1vhj s ALA 110 N -3.62 -0.45 0.79 3.20 0.00 0.83 -1.51 121.76 121.00 1vhj s ALA 110 Ca 0.31 0.62 -0.12 0.00 0.00 0.00 0.00 51.96 52.77 1vhj s ALA 110 Cb 0.07 -1.19 0.07 0.00 0.00 0.00 0.00 23.12 22.06 1vhj s ALA 110 CO 0.09 -0.93 1.11 0.00 0.00 0.00 0.00 175.76 176.04 1vhj s THR 112 N -3.29 0.00 -1.46 0.00 -1.32 -1.26 -0.02 115.64 108.29 1vhj s THR 112 Ca 0.61 0.00 0.17 0.00 -1.21 0.00 0.00 61.69 61.25 1vhj s THR 112 Cb -0.13 -1.00 0.48 0.00 -1.51 0.00 0.00 72.50 70.33 1vhj s THR 112 CO 0.53 0.00 1.40 -0.90 -2.21 0.00 0.00 174.62 173.43 1vhj n ASP 113 N 0.04 3.44 -4.89 8.08 5.68 -1.20 -4.97 116.55 122.72 1vhj n ASP 113 Ca -0.14 -2.00 -0.29 0.00 -0.50 0.00 0.00 54.79 51.86 1vhj n ASP 113 Cb 0.62 -0.36 0.05 0.00 -1.14 0.00 0.00 41.12 40.29 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 -1.01 5.37 0.00 -1.12 0.15 -1.26 -4.87 113.70 110.96 1vhj s SER 114 Ca 0.36 1.01 0.16 0.00 0.70 0.00 0.00 55.95 58.18 1vhj s SER 114 Cb 0.19 -1.81 -0.07 0.00 -1.71 0.00 0.00 66.02 62.62 1vhj s SER 114 CO 0.25 -1.35 0.80 1.17 1.20 0.00 0.00 173.24 175.30 1vhj n LYS 115 N -2.96 1.68 -0.28 5.44 4.81 -1.26 -4.68 118.16 120.90 1vhj n LYS 115 Ca 0.07 -0.50 0.05 0.00 -0.87 0.00 0.00 58.31 57.06 1vhj n LYS 115 Cb 0.58 -1.28 0.19 0.00 0.02 0.00 0.00 35.03 34.54 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 1.12 0.79 0.00 3.15 -1.51 -2.00 -0.62 116.25 117.18 1vhj h VAL 116 Ca 0.00 -0.22 -0.08 0.00 -1.23 0.00 0.00 66.70 65.17 1vhj h VAL 116 Cb 0.49 0.09 -0.01 0.00 -2.13 0.00 0.00 31.29 29.73 1vhj h VAL 116 CO 0.00 0.12 -0.38 0.78 -1.23 0.00 0.00 177.57 176.86 1vhj h ASN 117 N 0.64 0.00 0.61 4.19 2.35 -1.93 -2.56 115.58 118.88 1vhj h ASN 117 Ca 0.42 0.00 -0.12 0.00 -0.55 0.00 0.00 56.30 56.05 1vhj h ASN 117 Cb 0.53 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.89 1vhj h ASN 117 CO -0.32 0.38 -0.59 0.03 -1.65 0.00 0.00 177.43 175.28 1vhj h ARG 118 N 0.00 0.00 -0.36 0.81 3.08 -1.45 0.16 114.38 116.62 1vhj h ARG 118 Ca -0.00 0.00 -0.15 0.00 0.07 0.00 0.00 59.98 59.90 1vhj h ARG 118 Cb 1.09 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.13 1vhj h ARG 118 CO 0.05 0.59 -0.37 0.82 -1.07 0.00 0.00 179.97 179.99 1vhj h ILE 119 N 0.00 1.28 0.00 2.04 2.04 -0.96 0.60 117.51 122.51 1vhj h ILE 119 Ca -0.01 -1.54 -0.13 0.00 1.00 0.00 0.00 64.86 64.19 1vhj h ILE 119 Cb 1.05 1.39 -0.02 0.00 -0.74 0.00 0.00 36.82 38.50 1vhj h ILE 119 CO 0.08 0.51 -0.61 0.03 0.00 0.00 0.00 178.15 178.16 1vhj h ARG 120 N 0.71 0.00 -0.83 2.37 3.08 -1.06 -3.36 114.38 115.28 1vhj h ARG 120 Ca 0.06 0.00 -0.57 0.00 0.07 0.00 0.00 59.98 59.54 1vhj h ARG 120 Cb 0.94 0.00 -0.41 0.00 0.08 0.00 0.00 29.97 30.58 1vhj h ARG 120 CO 0.09 0.61 -0.59 0.34 -1.07 0.00 0.00 179.97 179.35 1vhj n PHE 121 N -3.78 2.85 -3.96 3.04 7.35 0.53 -4.95 117.46 118.54 1vhj n PHE 121 Ca -0.01 -2.37 -0.31 0.00 -0.76 0.00 0.00 57.45 54.00 1vhj n PHE 121 Cb 0.61 -0.47 0.02 0.00 0.35 0.00 0.00 39.48 39.99 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 -0.72 -5.06 -1.18 -4.13 5.02 -1.16 -1.49 118.16 109.43 1vhj n LYS 122 Ca 0.46 0.56 -0.06 0.00 -2.02 0.00 0.00 58.31 57.24 1vhj n LYS 122 Cb 0.91 -5.39 -0.03 0.00 -0.02 0.00 0.00 35.03 30.50 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 -2.82 -5.64 -4.72 4.39 2.03 0.19 -5.00 116.55 104.98 1vhj n ASP 123 Ca 0.03 0.15 -0.23 0.00 0.52 0.00 0.00 54.79 55.26 1vhj n ASP 123 Cb 0.53 -3.69 0.10 0.00 -0.72 0.00 0.00 41.12 37.33 1vhj n ASP 123 CO 0.00 0.00 0.00 -1.00 -1.92 0.00 0.00 177.20 174.28 1vhj s HIS 124 N -1.60 1.71 -0.51 -0.67 3.76 -0.56 -4.99 115.29 112.43 1vhj s HIS 124 Ca 0.00 -0.26 -0.26 0.00 -0.15 0.00 0.00 55.06 54.39 1vhj s HIS 124 Cb 0.00 -2.95 0.03 0.00 1.11 0.00 0.00 32.58 30.78 1vhj s HIS 124 CO 0.00 -1.61 1.01 -0.51 -0.85 0.00 0.00 174.74 172.78 1vhj s ASP 125 N -4.70 6.47 -0.21 1.40 1.11 -1.26 -4.62 116.67 114.85 1vhj s ASP 125 Ca 0.65 0.04 -0.21 0.00 0.18 0.00 0.00 52.55 53.22 1vhj s ASP 125 Cb -0.06 -2.48 -0.02 0.00 1.07 0.00 0.00 42.92 41.43 1vhj s ASP 125 CO 0.44 -1.21 0.63 0.12 1.18 0.00 0.00 175.17 176.32 1vhj s PHE 126 N 4.13 3.36 -0.64 4.23 2.19 -1.26 -5.02 117.98 124.97 1vhj s PHE 126 Ca 0.38 0.90 -0.27 0.00 0.33 0.00 0.00 56.93 58.28 1vhj s PHE 126 Cb -0.10 -2.80 0.04 0.00 -1.31 0.00 0.00 43.02 38.85 1vhj s PHE 126 CO 0.25 -0.20 1.17 0.00 1.83 0.00 0.00 175.22 178.27 1vhj s ALA 127 N 2.00 2.94 -0.45 11.12 0.00 -1.26 -4.97 121.76 131.14 1vhj s ALA 127 Ca 0.28 -1.18 -0.29 0.00 0.00 0.00 0.00 51.96 50.78 1vhj s ALA 127 Cb -0.16 -4.06 0.01 0.00 0.00 0.00 0.00 23.12 18.92 1vhj s ALA 127 CO 0.10 -2.87 1.36 0.00 0.00 0.00 0.00 175.76 174.36 1vhj s ALA 128 N 5.02 3.02 0.15 0.00 0.00 -1.26 -4.98 121.76 123.71 1vhj s ALA 128 Ca 0.36 -0.30 0.07 0.00 0.00 0.00 0.00 51.96 52.09 1vhj s ALA 128 Cb -0.09 -3.96 -0.04 0.00 0.00 0.00 0.00 23.12 19.03 1vhj s ALA 128 CO 0.19 -2.47 -0.15 0.96 0.00 0.00 0.00 175.76 174.30 1vhj s ILE 129 N 5.37 1.51 0.86 0.00 -4.36 -1.26 -0.12 121.20 123.20 1vhj s ILE 129 Ca 0.57 -1.86 -0.12 0.00 -0.26 0.00 0.00 60.65 58.98 1vhj s ILE 129 Cb -0.12 -1.71 0.11 0.00 1.25 0.00 0.00 42.46 41.99 1vhj s ILE 129 CO 0.31 -0.43 1.16 0.00 0.24 0.00 0.00 174.94 176.22 1vhj s ALA 130 N -2.30 2.24 -0.02 2.27 0.00 -0.36 -4.84 121.76 118.77 1vhj s ALA 130 Ca 0.13 -0.60 -0.30 0.00 0.00 0.00 0.00 51.96 51.19 1vhj s ALA 130 Cb -0.04 -2.99 -0.03 0.00 0.00 0.00 0.00 23.12 20.05 1vhj s ALA 130 CO 0.04 -1.97 1.09 0.34 0.00 0.00 0.00 175.76 175.27 1vhj s ASP 131 N -4.33 7.20 0.19 0.00 -1.08 -0.52 -4.94 116.67 113.20 1vhj s ASP 131 Ca 0.63 1.76 -0.12 0.00 -0.52 0.00 0.00 52.55 54.30 1vhj s ASP 131 Cb -0.13 -2.57 0.21 0.00 -1.46 0.00 0.00 42.92 38.98 1vhj s ASP 131 CO 0.51 -0.42 1.72 0.22 0.52 0.00 0.00 175.17 177.72 1vhj h TYR 132 N 7.00 0.20 -0.97 -5.34 5.03 -1.95 -2.27 116.97 118.67 1vhj h TYR 132 Ca -0.38 0.03 0.01 0.00 2.58 0.00 0.00 58.73 60.97 1vhj h TYR 132 Cb 1.19 -0.01 -0.05 0.00 1.55 0.00 0.00 36.73 39.41 1vhj h TYR 132 CO 0.69 0.01 0.63 0.87 -1.32 0.00 0.00 178.16 179.04 1vhj h LYS 133 N 0.27 1.28 -0.60 1.82 1.57 -1.99 -0.75 116.57 118.18 1vhj h LYS 133 Ca 0.26 -0.09 -0.05 0.00 -1.87 0.00 0.00 60.65 58.90 1vhj h LYS 133 Cb 0.35 -0.28 -0.02 0.00 0.08 0.00 0.00 32.23 32.35 1vhj h LYS 133 CO -0.33 0.86 0.16 0.52 -0.57 0.00 0.00 179.45 180.09 1vhj h MET 134 N 1.32 0.94 -0.01 3.15 2.86 -1.85 0.50 114.93 121.85 1vhj h MET 134 Ca 0.35 -0.22 0.00 0.00 -2.06 0.00 0.00 59.70 57.77 1vhj h MET 134 Cb -0.13 -0.13 -0.00 0.00 0.06 0.00 0.00 31.60 31.40 1vhj h MET 134 CO -0.07 0.86 0.00 0.28 1.06 0.00 0.00 176.91 179.04 1vhj h VAL 135 N 0.86 1.01 -0.43 -2.22 2.07 -0.83 -1.24 116.25 115.46 1vhj h VAL 135 Ca 0.19 -0.02 0.04 0.00 0.82 0.00 0.00 66.70 67.74 1vhj h VAL 135 Cb 0.33 1.00 -0.04 0.00 -1.52 0.00 0.00 31.29 31.06 1vhj h VAL 135 CO -0.00 0.00 0.18 0.50 0.02 0.00 0.00 177.57 178.28 1vhj h LYS 136 N 0.00 0.36 -0.34 1.57 3.64 -0.97 0.45 116.57 121.29 1vhj h LYS 136 Ca 0.00 -0.02 0.01 0.00 -1.27 0.00 0.00 60.65 59.37 1vhj h LYS 136 Cb 0.00 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 31.72 1vhj h LYS 136 CO -0.00 0.24 0.21 0.00 -2.27 0.00 0.00 179.45 177.63 1vhj h ALA 137 N 1.26 0.42 -0.41 5.00 0.00 -0.69 0.10 119.26 124.94 1vhj h ALA 137 Ca 0.19 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.06 1vhj h ALA 137 Cb 0.15 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 1vhj h ALA 137 CO -0.17 -0.14 0.15 0.00 0.00 0.00 0.00 179.25 179.09 1vhj h ALA 138 N 1.14 0.54 -0.54 0.00 0.00 -0.89 0.20 119.26 119.70 1vhj h ALA 138 Ca 0.13 -0.16 -0.04 0.00 0.00 0.00 0.00 54.91 54.84 1vhj h ALA 138 Cb -0.02 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.58 1vhj h ALA 138 CO -0.05 0.16 0.16 1.49 0.00 0.00 0.00 179.25 181.02 1vhj h GLU 139 N 0.52 0.81 -0.43 0.00 4.22 -0.69 -1.02 114.58 118.00 1vhj h GLU 139 Ca 0.14 -0.15 -0.13 0.00 0.08 0.00 0.00 59.36 59.30 1vhj h GLU 139 Cb 0.23 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.34 1vhj h GLU 139 CO -0.01 0.71 -0.25 0.93 -2.18 0.00 0.00 179.01 178.22 1vhj h GLU 140 N 0.79 0.92 -0.36 1.92 4.39 -0.29 -1.78 114.58 120.17 1vhj h GLU 140 Ca 0.18 -0.42 0.01 0.00 0.34 0.00 0.00 59.36 59.47 1vhj h GLU 140 Cb 0.25 -0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 28.86 1vhj h GLU 140 CO -0.01 1.07 0.23 0.00 -1.16 0.00 0.00 179.01 179.15 1vhj h ALA 141 N 0.82 0.45 -0.41 3.43 0.00 -0.27 -1.77 119.26 121.51 1vhj h ALA 141 Ca 0.09 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.95 1vhj h ALA 141 Cb 0.82 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.46 1vhj h ALA 141 CO 0.07 -0.10 0.13 0.00 0.00 0.00 0.00 179.25 179.35 1vhj h ALA 142 N 1.14 0.53 -0.90 0.00 0.00 -1.13 -2.82 119.26 116.08 1vhj h ALA 142 Ca 0.13 -0.17 0.06 0.00 0.00 0.00 0.00 54.91 54.93 1vhj h ALA 142 Cb -0.04 -0.16 -0.06 0.00 0.00 0.00 0.00 17.79 17.53 1vhj h ALA 142 CO -0.04 0.18 0.59 -0.22 0.00 0.00 0.00 179.25 179.76 1vhj h LYS 143 N 0.52 1.01 0.00 0.00 1.63 -1.06 -0.36 116.57 118.31 1vhj h LYS 143 Ca 0.13 -0.06 0.00 0.00 -0.85 0.00 0.00 60.65 59.87 1vhj h LYS 143 Cb 0.26 -0.23 0.00 0.00 -0.60 0.00 0.00 32.23 31.67 1vhj h LYS 143 CO -0.00 0.67 0.00 0.00 -3.45 0.00 0.00 179.45 176.66 1vhj h ALA 144 N 1.51 1.00 -0.41 5.00 0.00 -1.09 -2.43 119.26 122.84 1vhj h ALA 144 Ca 0.38 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.29 1vhj h ALA 144 Cb 0.17 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.96 1vhj h ALA 144 CO -0.14 0.00 0.00 0.54 0.00 0.00 0.00 179.25 179.65 1vhj n ARG 145 N -2.31 3.03 -1.93 0.00 1.74 -0.32 -4.96 116.66 111.91 1vhj n ARG 145 Ca 0.02 -2.44 -0.15 0.00 -0.77 0.00 0.00 57.85 54.51 1vhj n ARG 145 Cb 0.23 -1.54 -0.03 0.00 -1.02 0.00 0.00 32.46 30.10 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 0.48 0.50 3.58 -0.13 0.00 -0.91 -4.99 105.19 103.72 1vhj n GLY 146 Ca 0.17 -0.27 -0.35 0.00 0.00 0.00 0.00 46.02 45.57 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 -2.68 4.61 -0.17 -0.61 1.01 -0.30 -5.02 121.20 118.04 1vhj s ILE 147 Ca 0.00 -0.09 -0.23 0.00 0.00 0.00 0.00 60.65 60.32 1vhj s ILE 147 Cb 0.00 -3.09 -0.02 0.00 0.01 0.00 0.00 42.46 39.36 1vhj s ILE 147 CO 0.00 0.43 0.74 1.51 0.00 0.00 0.00 174.94 177.63 1vhj s ASP 148 N 0.66 6.85 0.11 3.58 1.47 -1.26 -3.86 116.67 124.22 1vhj s ASP 148 Ca 0.03 1.04 0.08 0.00 1.18 0.00 0.00 52.55 54.87 1vhj s ASP 148 Cb -0.13 -2.41 -0.04 0.00 -0.34 0.00 0.00 42.92 40.00 1vhj s ASP 148 CO 0.02 -0.33 -0.12 0.68 0.68 0.00 0.00 175.17 176.10 1vhj s VAL 149 N 1.97 3.25 -0.24 2.11 -7.23 -1.26 -4.40 120.40 114.58 1vhj s VAL 149 Ca 0.34 -1.35 -0.09 0.00 -1.81 0.00 0.00 61.98 59.08 1vhj s VAL 149 Cb -0.16 -2.52 -0.04 0.00 0.56 0.00 0.00 36.38 34.22 1vhj s VAL 149 CO 0.12 0.09 0.11 -1.59 -0.31 0.00 0.00 175.10 173.52 1vhj s LYS 150 N -2.24 3.83 -0.23 4.82 0.00 -0.21 -4.96 119.74 120.74 1vhj s LYS 150 Ca 0.21 -0.39 -0.07 0.00 0.00 0.00 0.00 55.97 55.72 1vhj s LYS 150 Cb -0.11 -3.42 -0.03 0.00 0.00 0.00 0.00 37.83 34.28 1vhj s LYS 150 CO 0.13 -0.08 0.05 0.08 0.00 0.00 0.00 175.35 175.53 1vhj s VAL 151 N 1.38 4.22 0.00 1.79 1.01 -1.26 0.01 120.40 127.56 1vhj s VAL 151 Ca 0.06 -0.21 0.00 0.00 0.00 0.00 0.00 61.98 61.83 1vhj s VAL 151 Cb -0.15 -2.96 0.00 0.00 0.00 0.00 0.00 36.38 33.28 1vhj s VAL 151 CO 0.05 0.37 0.00 0.61 0.00 0.00 0.00 175.10 176.13 1vhj n GLY 152 N 4.70 1.55 3.71 4.51 0.00 -0.66 -4.92 105.19 114.07 1vhj n GLY 152 Ca -0.16 -0.01 -0.36 0.00 0.00 0.00 0.00 46.02 45.49 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 6.34 0.47 1.61 0.01 -1.26 -0.66 114.94 123.45 1vhj s ASN 153 Ca 0.00 0.40 0.02 0.00 -0.71 0.00 0.00 52.86 52.57 1vhj s ASN 153 Cb 0.00 -2.16 0.01 0.00 0.41 0.00 0.00 41.25 39.51 1vhj s ASN 153 CO 0.00 0.09 0.67 -0.76 -1.51 0.00 0.00 177.10 175.59 1vhj s LEU 154 N 0.65 3.56 -0.13 0.60 1.43 -0.57 0.16 118.68 124.38 1vhj s LEU 154 Ca 0.14 0.07 0.00 0.00 -1.03 0.00 0.00 54.13 53.31 1vhj s LEU 154 Cb -0.13 -2.97 0.02 0.00 0.03 0.00 0.00 46.19 43.14 1vhj s LEU 154 CO 0.03 -0.82 -0.12 0.12 0.23 0.00 0.00 176.35 175.79 1vhj s PHE 155 N -2.56 1.88 -0.48 0.29 2.19 -0.17 -0.83 117.98 118.29 1vhj s PHE 155 Ca 0.51 -0.98 -0.16 0.00 0.33 0.00 0.00 56.93 56.63 1vhj s PHE 155 Cb -0.10 -1.43 0.07 0.00 -1.31 0.00 0.00 43.02 40.26 1vhj s PHE 155 CO 0.37 -0.57 0.44 -1.12 1.83 0.00 0.00 175.22 176.17 1vhj s SER 156 N 1.44 6.16 0.25 6.13 0.01 0.98 -0.72 113.70 127.95 1vhj s SER 156 Ca 0.02 -1.29 -0.25 0.00 1.31 0.00 0.00 55.95 55.75 1vhj s SER 156 Cb -0.13 -2.20 -0.09 0.00 0.21 0.00 0.00 66.02 63.80 1vhj s SER 156 CO -0.08 -0.71 0.85 0.00 0.41 0.00 0.00 173.24 173.72 1vhj s ALA 157 N 1.82 3.33 0.00 1.44 0.00 -0.03 -3.26 121.76 125.06 1vhj s ALA 157 Ca 0.06 0.41 -0.06 0.00 0.00 0.00 0.00 51.96 52.37 1vhj s ALA 157 Cb -0.24 -3.05 -0.29 0.00 0.00 0.00 0.00 23.12 19.54 1vhj s ALA 157 CO 0.07 0.24 0.87 0.93 0.00 0.00 0.00 175.76 177.87 1vhj h GLU 158 N 3.61 0.32 -4.74 0.00 4.39 -1.89 -3.41 114.58 112.85 1vhj h GLU 158 Ca -0.47 -0.55 -0.69 0.00 0.34 0.00 0.00 59.36 58.00 1vhj h GLU 158 Cb 1.20 0.20 -0.30 0.00 -0.10 0.00 0.00 28.75 29.75 1vhj h GLU 158 CO 0.66 1.21 -0.65 -0.51 -1.16 0.00 0.00 179.01 178.55 1vhj s LEU 159 N -7.14 4.02 0.12 1.33 1.43 -1.26 -4.97 118.68 112.20 1vhj s LEU 159 Ca -0.10 -1.11 -0.17 0.00 -1.03 0.00 0.00 54.13 51.72 1vhj s LEU 159 Cb 0.06 -1.80 -0.03 0.00 0.03 0.00 0.00 46.19 44.45 1vhj s LEU 159 CO 0.87 -0.27 1.64 0.15 0.23 0.00 0.00 176.35 178.97 1vhj h PHE 160 N 8.13 0.55 -2.31 0.29 3.04 -1.99 -3.19 116.94 121.46 1vhj h PHE 160 Ca -0.24 -0.05 -0.74 0.00 3.98 0.00 0.00 57.97 60.91 1vhj h PHE 160 Cb 1.08 -0.16 -0.19 0.00 2.56 0.00 0.00 35.95 39.24 1vhj h PHE 160 CO 0.60 0.53 1.27 0.71 -2.02 0.00 0.00 178.31 179.40 1vhj s TYR 161 N -5.43 3.59 0.24 0.41 1.51 -1.26 -5.00 117.35 111.40 1vhj s TYR 161 Ca -0.13 -2.21 -0.30 0.00 -1.01 0.00 0.00 57.07 53.42 1vhj s TYR 161 Cb 0.09 -4.27 -0.10 0.00 -0.11 0.00 0.00 41.96 37.58 1vhj s TYR 161 CO 0.75 -1.35 1.45 -0.08 -1.11 0.00 0.00 175.55 175.21 1vhj s THR 162 N 1.26 2.68 -1.35 -0.71 -1.32 -1.21 -4.90 115.64 110.09 1vhj s THR 162 Ca 0.42 0.56 0.28 0.00 -1.21 0.00 0.00 61.69 61.73 1vhj s THR 162 Cb -0.04 -3.36 0.44 0.00 -1.51 0.00 0.00 72.50 68.03 1vhj s THR 162 CO -0.01 0.08 1.93 -0.81 -2.21 0.00 0.00 174.62 173.61 1vhj n PRO 163 N 2.51 0.32 -3.54 7.08 -0.04 -1.26 -4.30 135.00 135.77 1vhj n PRO 163 Ca 0.07 0.03 -0.28 0.00 -0.04 0.00 0.00 63.50 63.28 1vhj n PRO 163 Cb 0.40 -1.50 -0.11 0.00 -0.04 0.00 0.00 33.50 32.25 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 -2.65 2.54 0.28 3.54 3.68 -1.26 -4.95 116.67 117.85 1vhj s ASP 164 Ca 0.24 -3.10 0.24 0.00 2.13 0.00 0.00 52.55 52.06 1vhj s ASP 164 Cb 0.18 -0.75 1.02 0.00 -1.45 0.00 0.00 42.92 41.93 1vhj s ASP 164 CO 0.43 -0.18 1.72 -0.81 0.13 0.00 0.00 175.17 176.47 1vhj n PRO 165 N 2.86 0.20 0.13 4.34 -0.04 -1.26 -2.52 135.00 138.71 1vhj n PRO 165 Ca 0.24 0.45 0.11 0.00 -0.04 0.00 0.00 63.50 64.26 1vhj n PRO 165 Cb 0.43 -1.90 0.50 0.00 -0.04 0.00 0.00 33.50 32.49 1vhj n PRO 165 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1vhj n SER 166 N -2.28 0.63 0.26 3.54 3.41 -1.26 -1.72 113.62 116.20 1vhj n SER 166 Ca 0.02 0.68 0.12 0.00 -0.26 0.00 0.00 58.87 59.43 1vhj n SER 166 Cb 0.21 -0.80 0.71 0.00 -0.26 0.00 0.00 64.21 64.07 1vhj n SER 166 CO 0.00 0.00 0.00 -0.03 -0.16 0.00 0.00 175.04 174.85 1vhj h MET 167 N 0.00 0.00 -0.21 4.33 -1.53 -1.94 -2.77 114.93 112.82 1vhj h MET 167 Ca 0.00 0.00 -0.07 0.00 -3.44 0.00 0.00 59.70 56.19 1vhj h MET 167 Cb 0.29 0.00 -0.01 0.00 -0.55 0.00 0.00 31.60 31.33 1vhj h MET 167 CO 0.00 0.12 -0.17 0.74 0.14 0.00 0.00 176.91 177.74 1vhj h PHE 168 N 0.00 0.39 -0.14 1.39 0.05 -1.58 -0.70 116.94 116.36 1vhj h PHE 168 Ca -0.00 -0.06 -0.18 0.00 3.82 0.00 0.00 57.97 61.55 1vhj h PHE 168 Cb 0.34 -0.10 -0.00 0.00 2.00 0.00 0.00 35.95 38.18 1vhj h PHE 168 CO 0.00 0.52 -0.65 -0.44 -0.18 0.00 0.00 178.31 177.56 1vhj h ASP 169 N 0.33 0.60 -0.62 2.17 5.19 -1.68 -1.50 116.42 120.92 1vhj h ASP 169 Ca 0.06 -0.36 -0.09 0.00 -0.62 0.00 0.00 57.03 56.02 1vhj h ASP 169 Cb 0.50 -0.17 -0.02 0.00 0.18 0.00 0.00 39.33 39.81 1vhj h ASP 169 CO 0.03 1.09 0.03 0.58 -3.12 0.00 0.00 179.24 177.85 1vhj h VAL 170 N 0.38 1.27 -0.58 -1.35 2.07 -1.46 -0.01 116.25 116.57 1vhj h VAL 170 Ca -0.01 -1.12 -0.04 0.00 0.82 0.00 0.00 66.70 66.34 1vhj h VAL 170 Cb 1.21 0.74 -0.03 0.00 -1.52 0.00 0.00 31.29 31.70 1vhj h VAL 170 CO 0.12 0.41 0.21 0.24 0.02 0.00 0.00 177.57 178.57 1vhj h MET 171 N 1.00 0.88 -0.16 1.57 2.86 -0.93 -1.50 114.93 118.65 1vhj h MET 171 Ca 0.18 -0.17 -0.00 0.00 -2.06 0.00 0.00 59.70 57.65 1vhj h MET 171 Cb 0.53 -0.14 -0.01 0.00 0.06 0.00 0.00 31.60 32.04 1vhj h MET 171 CO 0.03 0.77 0.08 0.22 1.06 0.00 0.00 176.91 179.07 1vhj h ASP 172 N 0.80 0.20 -0.82 1.22 -0.00 -1.13 0.13 116.42 116.82 1vhj h ASP 172 Ca 0.19 -0.10 0.11 0.00 -0.00 0.00 0.00 57.03 57.22 1vhj h ASP 172 Cb 0.23 -0.05 -0.06 0.00 -0.00 0.00 0.00 39.33 39.46 1vhj h ASP 172 CO -0.01 0.25 0.53 0.50 -0.00 0.00 0.00 179.24 180.51 1vhj h LYS 173 N 0.14 0.71 -0.56 0.28 3.64 -0.73 -0.99 116.57 119.06 1vhj h LYS 173 Ca 0.05 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.39 1vhj h LYS 173 Cb 0.10 -0.16 0.00 0.00 -0.41 0.00 0.00 32.23 31.76 1vhj h LYS 173 CO -0.01 0.47 0.00 0.66 -2.27 0.00 0.00 179.45 178.30 1vhj n TYR 174 N -4.52 0.85 -0.51 1.91 4.01 -0.59 -4.92 117.16 113.40 1vhj n TYR 174 Ca 0.14 -0.38 0.00 0.00 -0.16 0.00 0.00 57.90 57.51 1vhj n TYR 174 Cb 0.35 -0.09 0.00 0.00 -0.31 0.00 0.00 39.34 39.30 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 1.11 0.75 3.63 2.72 0.00 -0.38 -5.01 105.19 108.02 1vhj n GLY 175 Ca 0.18 0.00 -0.52 0.00 0.00 0.00 0.00 46.02 45.67 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 -2.30 0.10 0.05 -0.61 -0.00 -0.02 -4.54 119.36 112.04 1vhj n ILE 176 Ca 0.00 -0.02 -0.02 0.00 -0.00 0.00 0.00 62.75 62.71 1vhj n ILE 176 Cb 0.00 -1.07 -0.07 0.00 -0.00 0.00 0.00 39.64 38.50 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 3.88 0.89 -1.87 1.39 -1.51 -0.63 -3.40 116.25 115.00 1vhj h VAL 177 Ca -0.47 -2.47 -0.02 0.00 -1.23 0.00 0.00 66.70 62.51 1vhj h VAL 177 Cb 1.32 2.36 -0.20 0.00 -2.13 0.00 0.00 31.29 32.64 1vhj h VAL 177 CO 0.84 0.51 0.29 -0.83 -1.23 0.00 0.00 177.57 177.15 1vhj s GLY 178 N -4.75 -0.48 -0.17 5.19 0.00 -1.23 -4.67 107.32 101.20 1vhj s GLY 178 Ca -0.01 1.59 -0.03 0.00 0.00 0.00 0.00 44.72 46.27 1vhj s GLY 178 CO 0.80 1.04 -0.07 0.54 0.00 0.00 0.00 173.10 175.42 1vhj s VAL 179 N -1.05 3.44 0.00 1.40 0.11 0.24 -1.00 120.40 123.55 1vhj s VAL 179 Ca -0.08 -0.50 0.00 0.00 -2.93 0.00 0.00 61.98 58.47 1vhj s VAL 179 Cb -0.01 -2.51 0.00 0.00 -1.53 0.00 0.00 36.38 32.33 1vhj s VAL 179 CO 0.07 0.47 0.00 -1.84 -3.33 0.00 0.00 175.10 170.47 1vhj n GLU 180 N 4.02 0.00 0.00 1.54 -0.00 0.11 -0.98 120.64 125.33 1vhj n GLU 180 Ca -0.18 0.00 0.00 0.00 -0.00 0.00 0.00 57.16 56.98 1vhj n GLU 180 Cb 0.52 0.00 0.00 0.00 -0.00 0.00 0.00 31.44 31.96 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 -0.06 0.00 3.44 2.81 -1.26 -0.85 117.12 121.20 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 -0.63 0.00 0.00 -0.71 0.00 0.00 33.22 31.88 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 -0.02 1.19 -0.21 0.03 0.00 -1.26 -2.97 120.64 117.39 1vhj n GLU 182 Ca 0.00 -0.01 0.03 0.00 0.00 0.00 0.00 57.16 57.19 1vhj n GLU 182 Cb 0.23 -0.12 0.29 0.00 0.00 0.00 0.00 31.44 31.84 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 1.56 -0.08 -1.84 0.00 -1.93 -1.60 119.26 115.37 1vhj h ALA 183 Ca 0.00 -0.04 -0.09 0.00 0.00 0.00 0.00 54.91 54.78 1vhj h ALA 183 Cb 0.02 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.55 1vhj h ALA 183 CO 0.00 0.36 -0.37 0.00 0.00 0.00 0.00 179.25 179.24 1vhj h ALA 184 N 1.56 1.24 -0.16 0.00 0.00 -1.83 -1.54 119.26 118.54 1vhj h ALA 184 Ca 0.30 -0.37 -0.22 0.00 0.00 0.00 0.00 54.91 54.62 1vhj h ALA 184 Cb 0.06 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 17.78 1vhj h ALA 184 CO -0.09 0.53 -0.77 0.78 0.00 0.00 0.00 179.25 179.70 1vhj h GLY 185 N 1.15 0.88 0.92 0.00 0.00 -1.67 -1.31 103.07 103.04 1vhj h GLY 185 Ca 0.02 -1.23 -0.04 0.00 0.00 0.00 0.00 47.33 46.07 1vhj h GLY 185 CO 0.05 1.10 0.06 -2.22 0.00 0.00 0.00 176.54 175.53 1vhj h ILE 186 N 0.55 1.24 -0.55 2.60 2.04 -1.17 -0.82 117.51 121.39 1vhj h ILE 186 Ca -0.05 -0.83 -0.06 0.00 1.00 0.00 0.00 64.86 64.92 1vhj h ILE 186 Cb 1.40 1.08 -0.02 0.00 -0.74 0.00 0.00 36.82 38.53 1vhj h ILE 186 CO 0.16 0.28 0.12 1.88 0.00 0.00 0.00 178.15 180.59 1vhj h TYR 187 N 0.44 0.89 -0.41 1.37 0.99 -1.29 0.80 116.97 119.76 1vhj h TYR 187 Ca 0.11 -0.09 -0.12 0.00 2.00 0.00 0.00 58.73 60.63 1vhj h TYR 187 Cb 0.35 -0.26 -0.01 0.00 1.00 0.00 0.00 36.73 37.81 1vhj h TYR 187 CO 0.02 0.76 -0.24 0.78 -0.00 0.00 0.00 178.16 179.48 1vhj h GLY 188 N 0.99 0.92 1.06 3.88 0.00 -0.85 -1.14 103.07 107.93 1vhj h GLY 188 Ca 0.18 -0.81 -0.13 0.00 0.00 0.00 0.00 47.33 46.57 1vhj h GLY 188 CO 0.00 0.74 -0.25 -2.08 0.00 0.00 0.00 176.54 174.95 1vhj h VAL 189 N 0.73 1.28 -0.81 4.60 2.07 -0.94 -0.73 116.25 122.45 1vhj h VAL 189 Ca 0.09 -1.40 -0.00 0.00 0.82 0.00 0.00 66.70 66.21 1vhj h VAL 189 Cb 0.78 1.30 -0.04 0.00 -1.52 0.00 0.00 31.29 31.81 1vhj h VAL 189 CO 0.06 0.47 0.50 0.00 0.02 0.00 0.00 177.57 178.63 1vhj h ALA 190 N 0.80 1.03 -0.37 1.67 0.00 -0.57 -0.45 119.26 121.38 1vhj h ALA 190 Ca 0.08 -0.08 -0.10 0.00 0.00 0.00 0.00 54.91 54.81 1vhj h ALA 190 Cb 0.82 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 1vhj h ALA 190 CO 0.07 0.48 -0.18 0.00 0.00 0.00 0.00 179.25 179.63 1vhj h ALA 191 N 1.27 0.51 -0.71 0.00 0.00 -1.07 0.99 119.26 120.25 1vhj h ALA 191 Ca 0.29 -0.35 -0.06 0.00 0.00 0.00 0.00 54.91 54.79 1vhj h ALA 191 Cb -0.06 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.57 1vhj h ALA 191 CO -0.06 0.45 0.23 1.49 0.00 0.00 0.00 179.25 181.36 1vhj h GLU 192 N 0.56 1.10 -0.59 0.00 4.81 -0.79 -3.07 114.58 116.60 1vhj h GLU 192 Ca 0.08 -0.23 0.00 0.00 -0.13 0.00 0.00 59.36 59.08 1vhj h GLU 192 Cb 0.72 -0.16 0.00 0.00 0.63 0.00 0.00 28.75 29.94 1vhj h GLU 192 CO 0.05 0.93 0.00 0.66 -0.73 0.00 0.00 179.01 179.93 1vhj n TYR 193 N -4.26 1.14 -3.39 0.92 4.01 -0.21 -4.97 117.16 110.41 1vhj n TYR 193 Ca 0.06 -0.59 -0.20 0.00 -0.16 0.00 0.00 57.90 57.01 1vhj n TYR 193 Cb 0.22 -0.15 0.07 0.00 -0.31 0.00 0.00 39.34 39.17 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 1.02 -0.33 3.05 2.72 0.00 -0.44 -5.02 105.19 106.19 1vhj n GLY 194 Ca 0.23 0.11 -0.22 0.00 0.00 0.00 0.00 46.02 46.14 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 -4.54 0.61 -2.36 4.61 0.00 0.21 -5.03 120.51 114.02 1vhj n ALA 195 Ca -0.00 -1.80 -0.31 0.00 0.00 0.00 0.00 53.44 51.33 1vhj n ALA 195 Cb 0.56 0.80 -0.16 0.00 0.00 0.00 0.00 19.45 20.64 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 -3.75 2.14 0.08 0.00 1.02 -0.83 -4.50 119.74 113.89 1vhj s LYS 196 Ca 0.20 -0.92 -0.08 0.00 0.02 0.00 0.00 55.97 55.19 1vhj s LYS 196 Cb -0.02 -2.03 -0.01 0.00 -0.52 0.00 0.00 37.83 35.26 1vhj s LYS 196 CO 0.13 0.53 0.16 0.00 -0.92 0.00 0.00 175.35 175.25 1vhj s ALA 197 N -0.55 -0.16 -0.11 5.17 0.00 -1.26 -1.22 121.76 123.62 1vhj s ALA 197 Ca 0.08 -0.64 -0.12 0.00 0.00 0.00 0.00 51.96 51.28 1vhj s ALA 197 Cb -0.10 0.44 0.03 0.00 0.00 0.00 0.00 23.12 23.48 1vhj s ALA 197 CO -0.00 -0.47 0.34 -1.17 0.00 0.00 0.00 175.76 174.45 1vhj s LEU 198 N -2.77 0.71 -0.18 0.00 2.96 -0.18 -1.43 118.68 117.79 1vhj s LEU 198 Ca 0.04 0.60 -0.01 0.00 -0.22 0.00 0.00 54.13 54.54 1vhj s LEU 198 Cb 0.04 1.20 0.00 0.00 0.50 0.00 0.00 46.19 47.93 1vhj s LEU 198 CO -0.10 -0.17 -0.13 0.00 -1.32 0.00 0.00 176.35 174.63 1vhj s ALA 199 N -0.05 2.56 -0.05 5.97 0.00 -1.26 0.35 121.76 129.29 1vhj s ALA 199 Ca -0.02 -1.12 0.06 0.00 0.00 0.00 0.00 51.96 50.88 1vhj s ALA 199 Cb -0.03 -1.36 -0.02 0.00 0.00 0.00 0.00 23.12 21.72 1vhj s ALA 199 CO 0.01 -0.21 -0.22 0.42 0.00 0.00 0.00 175.76 175.75 1vhj s ILE 200 N 1.10 2.33 0.05 0.00 1.01 0.28 -1.17 121.20 124.81 1vhj s ILE 200 Ca 0.00 -0.98 -0.02 0.00 0.00 0.00 0.00 60.65 59.65 1vhj s ILE 200 Cb -0.14 -1.86 -0.03 0.00 0.01 0.00 0.00 42.46 40.44 1vhj s ILE 200 CO -0.04 0.58 -0.00 0.00 0.00 0.00 0.00 174.94 175.47 1vhj s THR 202 N -3.65 2.77 -0.35 0.00 -1.32 -0.15 -0.63 115.64 112.30 1vhj s THR 202 Ca 0.04 -0.75 -0.28 0.00 -1.21 0.00 0.00 61.69 59.49 1vhj s THR 202 Cb 0.06 -2.15 -0.02 0.00 -1.51 0.00 0.00 72.50 68.87 1vhj s THR 202 CO -0.09 0.52 1.85 -0.69 -2.21 0.00 0.00 174.62 174.01 1vhj s VAL 203 N 0.53 3.42 -0.44 5.08 1.01 0.50 -0.90 120.40 129.60 1vhj s VAL 203 Ca -0.10 0.41 0.22 0.00 0.00 0.00 0.00 61.98 62.51 1vhj s VAL 203 Cb -0.16 -3.61 -0.21 0.00 0.00 0.00 0.00 36.38 32.41 1vhj s VAL 203 CO 0.04 -0.41 0.80 -1.54 0.00 0.00 0.00 175.10 173.99 1vhj n SER 204 N 10.76 0.48 -3.70 3.32 3.41 -0.22 0.54 113.62 128.20 1vhj n SER 204 Ca 0.24 -0.23 -0.14 0.00 -0.26 0.00 0.00 58.87 58.47 1vhj n SER 204 Cb 0.47 1.25 -0.09 0.00 -0.26 0.00 0.00 64.21 65.58 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 -4.10 -0.38 -0.44 4.04 -0.00 -1.22 -4.90 116.67 109.66 1vhj s ASP 205 Ca -0.00 0.53 -0.13 0.00 -0.00 0.00 0.00 52.55 52.95 1vhj s ASP 205 Cb 0.14 0.60 0.07 0.00 -0.00 0.00 0.00 42.92 43.73 1vhj s ASP 205 CO 0.85 -0.36 0.32 -2.28 -0.00 0.00 0.00 175.17 173.71 1vhj s HIS 206 N -0.67 3.28 0.44 4.23 5.65 -0.90 -0.67 115.29 126.65 1vhj s HIS 206 Ca -0.08 -1.14 0.12 0.00 0.25 0.00 0.00 55.06 54.21 1vhj s HIS 206 Cb -0.03 -3.00 0.97 0.00 -1.18 0.00 0.00 32.58 29.33 1vhj s HIS 206 CO 0.04 -0.80 2.02 0.82 -0.65 0.00 0.00 174.74 176.17 1vhj h ILE 207 N 5.88 1.11 0.00 0.89 2.04 -1.25 0.19 117.51 126.37 1vhj h ILE 207 Ca -0.26 -0.44 -0.07 0.00 1.00 0.00 0.00 64.86 65.09 1vhj h ILE 207 Cb 1.10 1.05 -0.01 0.00 -0.74 0.00 0.00 36.82 38.22 1vhj h ILE 207 CO 0.81 0.14 -0.60 0.11 0.00 0.00 0.00 178.15 178.61 1vhj h LYS 208 N 0.18 0.00 0.00 2.37 1.57 -1.82 -3.38 116.57 115.49 1vhj h LYS 208 Ca 0.04 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.82 1vhj h LYS 208 Cb 0.19 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.50 1vhj h LYS 208 CO 0.01 0.43 0.00 1.79 -0.57 0.00 0.00 179.45 181.11 1vhj h THR 209 N -1.00 0.00 0.00 -0.16 1.35 -1.90 -3.47 112.91 107.73 1vhj h THR 209 Ca -0.11 -0.65 0.00 0.00 -0.55 0.00 0.00 66.41 65.10 1vhj h THR 209 Cb 0.73 1.63 0.00 0.00 -1.73 0.00 0.00 68.15 68.78 1vhj h THR 209 CO -0.07 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.81 1vhj n GLY 210 N 1.11 1.99 1.38 5.82 0.00 0.66 -5.04 105.19 111.11 1vhj n GLY 210 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 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 -2.00 1.94 0.00 1.61 -0.58 -1.23 -4.68 120.64 115.70 1vhj n GLU 211 Ca 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.74 1vhj n GLU 211 Cb 0.00 -0.50 0.00 0.00 -0.57 0.00 0.00 31.44 30.37 1vhj n GLU 211 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 1vhj n GLU 217 N 1.51 0.00 -0.09 3.49 1.02 -1.26 -2.13 120.64 123.18 1vhj n GLU 217 Ca 0.00 0.00 -0.11 0.00 -0.02 0.00 0.00 57.16 57.03 1vhj n GLU 217 Cb 0.00 0.00 -0.04 0.00 -0.02 0.00 0.00 31.44 31.38 1vhj n GLU 217 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1vhj h ARG 218 N 0.00 0.47 -0.20 3.49 3.08 -1.99 -0.61 114.38 118.63 1vhj h ARG 218 Ca 0.00 -0.17 0.02 0.00 0.07 0.00 0.00 59.98 59.90 1vhj h ARG 218 Cb 0.00 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.00 1vhj h ARG 218 CO 0.00 0.67 0.08 0.37 -1.07 0.00 0.00 179.97 180.02 1vhj h GLN 219 N 0.23 0.17 -0.52 0.04 5.75 -2.04 0.20 115.11 118.95 1vhj h GLN 219 Ca 0.07 -0.01 0.07 0.00 -0.15 0.00 0.00 58.65 58.62 1vhj h GLN 219 Cb 0.48 -0.04 -0.06 0.00 1.07 0.00 0.00 27.48 28.93 1vhj h GLN 219 CO 0.02 0.12 0.21 -0.91 -2.65 0.00 0.00 178.83 175.61 1vhj h ASN 220 N 0.18 0.24 0.63 -0.69 4.21 -1.97 0.54 115.58 118.71 1vhj h ASN 220 Ca 0.08 0.05 -0.12 0.00 1.21 0.00 0.00 56.30 57.53 1vhj h ASN 220 Cb 0.04 0.02 -0.02 0.00 -1.12 0.00 0.00 38.32 37.25 1vhj h ASN 220 CO -0.07 0.16 -0.55 0.00 -1.29 0.00 0.00 177.43 175.68 1vhj h THR 221 N 0.40 1.33 -0.52 2.81 1.03 -0.74 -2.46 112.91 114.76 1vhj h THR 221 Ca 0.25 -1.93 -0.06 0.00 -0.01 0.00 0.00 66.41 64.66 1vhj h THR 221 Cb 0.24 2.06 -0.02 0.00 -1.07 0.00 0.00 68.15 69.36 1vhj h THR 221 CO -0.23 0.54 0.07 0.15 -0.01 0.00 0.00 175.52 176.04 1vhj h PHE 222 N 0.00 0.93 -0.43 0.00 3.57 0.55 -1.88 116.94 119.68 1vhj h PHE 222 Ca -0.01 -0.13 -0.03 0.00 3.53 0.00 0.00 57.97 61.33 1vhj h PHE 222 Cb 1.01 -0.25 -0.02 0.00 2.79 0.00 0.00 35.95 39.48 1vhj h PHE 222 CO 0.00 0.84 0.15 -0.91 -2.23 0.00 0.00 178.31 176.16 1vhj h ASN 223 N 0.75 0.57 -0.25 0.41 2.35 -0.71 -1.44 115.58 117.26 1vhj h ASN 223 Ca 0.16 -0.07 -0.01 0.00 -0.55 0.00 0.00 56.30 55.83 1vhj h ASN 223 Cb 0.42 -0.15 -0.01 0.00 0.05 0.00 0.00 38.32 38.63 1vhj h ASN 223 CO 0.01 0.54 0.12 -0.33 -1.65 0.00 0.00 177.43 176.12 1vhj h GLU 224 N 0.62 0.36 -0.50 0.81 5.08 -0.97 -2.01 114.58 117.97 1vhj h GLU 224 Ca 0.15 -0.05 -0.02 0.00 -1.00 0.00 0.00 59.36 58.44 1vhj h GLU 224 Cb 0.16 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.32 1vhj h GLU 224 CO -0.01 0.35 0.23 1.98 -1.00 0.00 0.00 179.01 180.56 1vhj h MET 225 N 0.28 0.70 -0.24 2.33 4.05 -0.80 -1.96 114.93 119.28 1vhj h MET 225 Ca 0.09 -0.09 -0.13 0.00 -0.28 0.00 0.00 59.70 59.29 1vhj h MET 225 Cb 0.11 -0.14 -0.00 0.00 -0.80 0.00 0.00 31.60 30.77 1vhj h MET 225 CO -0.01 0.56 -0.37 0.82 0.23 0.00 0.00 176.91 178.14 1vhj h ILE 226 N 0.70 1.31 -0.75 1.77 1.08 -0.95 -2.47 117.51 118.21 1vhj h ILE 226 Ca 0.17 -1.57 -0.05 0.00 -0.39 0.00 0.00 64.86 63.02 1vhj h ILE 226 Cb 0.10 1.74 -0.03 0.00 -3.07 0.00 0.00 36.82 35.55 1vhj h ILE 226 CO -0.02 0.50 0.27 -0.33 -0.69 0.00 0.00 178.15 177.87 1vhj h GLU 227 N 0.39 1.14 -0.24 2.37 5.08 -1.20 -0.69 114.58 121.42 1vhj h GLU 227 Ca 0.02 -0.22 -0.00 0.00 -1.00 0.00 0.00 59.36 58.16 1vhj h GLU 227 Cb 0.96 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 30.02 1vhj h GLU 227 CO 0.09 0.95 0.14 0.82 -1.00 0.00 0.00 179.01 180.00 1vhj h ILE 228 N 1.09 1.10 -0.16 3.13 2.04 -1.33 0.18 117.51 123.55 1vhj h ILE 228 Ca 0.25 -0.25 0.03 0.00 1.00 0.00 0.00 64.86 65.89 1vhj h ILE 228 Cb 0.26 0.84 -0.03 0.00 -0.74 0.00 0.00 36.82 37.15 1vhj h ILE 228 CO -0.01 0.10 -0.00 0.00 0.00 0.00 0.00 178.15 178.23 1vhj h ALA 229 N 1.03 0.14 -0.55 1.87 0.00 -1.00 0.20 119.26 120.95 1vhj h ALA 229 Ca 0.08 0.05 -0.10 0.00 0.00 0.00 0.00 54.91 54.94 1vhj h ALA 229 Cb 0.03 0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 1vhj h ALA 229 CO -0.02 -0.44 -0.05 -0.07 0.00 0.00 0.00 179.25 178.67 1vhj h LEU 230 N 0.05 0.98 -1.21 0.00 3.38 -0.83 -2.24 115.31 115.43 1vhj h LEU 230 Ca 0.08 -0.29 -0.08 0.00 0.09 0.00 0.00 57.88 57.67 1vhj h LEU 230 Cb 0.09 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.57 1vhj h LEU 230 CO -0.13 1.06 -0.39 0.44 0.09 0.00 0.00 178.44 179.51 1vhj h ASP 231 N 0.90 0.00 0.13 -0.43 3.32 -0.35 -2.61 116.42 117.38 1vhj h ASP 231 Ca 0.15 0.00 -0.09 0.00 0.02 0.00 0.00 57.03 57.12 1vhj h ASP 231 Cb 0.59 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.13 1vhj h ASP 231 CO 0.04 0.39 -0.30 0.77 -1.72 0.00 0.00 179.24 178.42 1vhj h SER 232 N 0.00 0.27 -0.61 6.45 4.64 -0.02 -1.27 113.55 123.01 1vhj h SER 232 Ca -0.00 -0.09 -0.00 0.00 -0.47 0.00 0.00 61.79 61.23 1vhj h SER 232 Cb 0.71 -0.07 -0.03 0.00 -0.31 0.00 0.00 62.40 62.70 1vhj h SER 232 CO 0.05 0.56 0.38 0.58 -0.87 0.00 0.00 176.83 177.53 1vhj h VAL 233 N 0.24 1.17 -0.26 0.95 2.07 -1.09 0.40 116.25 119.73 1vhj h VAL 233 Ca 0.03 -0.37 -0.18 0.00 0.82 0.00 0.00 66.70 67.01 1vhj h VAL 233 Cb 0.65 0.32 0.00 0.00 -1.52 0.00 0.00 31.29 30.74 1vhj h VAL 233 CO 0.05 0.18 -0.52 -0.07 0.02 0.00 0.00 177.57 177.22 1vhj h LEU 234 N 0.82 0.91 -0.91 2.57 3.38 -1.42 -1.67 115.31 119.00 1vhj h LEU 234 Ca 0.22 -0.54 -0.04 0.00 0.09 0.00 0.00 57.88 57.61 1vhj h LEU 234 Cb -0.04 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.41 1vhj h LEU 234 CO -0.04 1.28 0.29 0.40 0.09 0.00 0.00 178.44 180.46 1vhj h ILE 235 N 0.58 1.25 0.00 1.22 2.04 -1.13 -2.67 117.51 118.80 1vhj h ILE 235 Ca 0.01 -0.77 -0.02 0.00 1.00 0.00 0.00 64.86 65.07 1vhj h ILE 235 Cb 1.13 0.37 -0.00 0.00 -0.74 0.00 0.00 36.82 37.58 1vhj h ILE 235 CO 0.12 0.31 -0.10 1.23 0.00 0.00 0.00 178.15 179.71 1vhj h GLY 236 N 1.11 0.00 2.00 5.37 0.00 0.09 -2.61 103.07 109.03 1vhj h GLY 236 Ca 0.25 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.54 1vhj h GLY 236 CO -0.02 0.00 -0.18 -0.55 0.00 0.00 0.00 176.54 175.78 1vhj h ASP 237 N 0.00 0.00 0.00 0.19 3.32 -0.94 -3.51 116.42 115.49 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 0.37 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.92 1vhj h ASP 237 CO 0.01 0.18 0.00 0.00 -1.72 0.00 0.00 179.24 177.72