#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vg3 n SER 10 N 0.00 0.00 0.00 6.41 3.41 -1.26 -2.95 113.62 119.23 1vg3 n SER 10 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 1vg3 n SER 10 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 1vg3 n SER 10 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1vg3 n TYR 11 N -0.06 0.00 0.00 7.33 9.36 -1.26 -2.19 117.16 130.34 1vg3 n TYR 11 Ca 0.00 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.22 1vg3 n TYR 11 Cb 0.00 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 38.71 1vg3 n TYR 11 CO 0.00 0.00 0.00 0.39 0.22 0.00 0.00 176.86 177.47 1vg3 n GLU 12 N 0.00 0.00 0.00 2.98 4.71 -1.15 -0.72 120.64 126.46 1vg3 n GLU 12 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.15 1vg3 n GLU 12 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 31.44 30.43 1vg3 n GLU 12 CO 0.00 0.00 0.00 -0.11 0.09 0.00 0.00 177.13 177.11 1vg3 n LEU 13 N -3.78 0.00 0.26 -4.62 7.94 -1.22 0.20 117.00 115.79 1vg3 n LEU 13 Ca 0.00 0.98 0.10 0.00 -1.11 0.00 0.00 56.01 55.98 1vg3 n LEU 13 Cb 0.00 -0.48 0.52 0.00 0.53 0.00 0.00 43.42 43.99 1vg3 n LEU 13 CO 0.00 -0.48 0.97 -0.08 -1.11 0.00 0.00 177.39 176.69 1vg3 h GLU 14 N 0.00 0.00 0.06 1.96 4.57 -0.42 0.28 114.58 121.02 1vg3 h GLU 14 Ca 0.00 0.00 -0.19 0.00 -1.18 0.00 0.00 59.36 57.99 1vg3 h GLU 14 Cb 0.00 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.58 1vg3 h GLU 14 CO 0.00 0.00 -0.97 -0.22 -1.18 0.00 0.00 179.01 176.64 1vg3 h LYS 15 N 0.00 0.12 -0.71 1.92 1.63 -0.68 -3.28 116.57 115.57 1vg3 h LYS 15 Ca 0.00 -0.21 0.02 0.00 -0.85 0.00 0.00 60.65 59.62 1vg3 h LYS 15 Cb 0.81 0.08 -0.04 0.00 -0.60 0.00 0.00 32.23 32.47 1vg3 h LYS 15 CO 0.00 1.10 0.45 0.28 -3.45 0.00 0.00 179.45 177.83 1vg3 h VAL 16 N -0.68 1.13 -0.60 2.00 2.07 0.32 -1.86 116.25 118.63 1vg3 h VAL 16 Ca -0.23 -0.31 0.12 0.00 0.82 0.00 0.00 66.70 67.10 1vg3 h VAL 16 Cb 1.44 0.15 -0.12 0.00 -1.52 0.00 0.00 31.29 31.24 1vg3 h VAL 16 CO -0.02 0.16 -0.23 0.11 0.02 0.00 0.00 177.57 177.61 1vg3 h LYS 17 N 0.90 -0.08 -0.91 1.57 1.57 -1.22 0.61 116.57 119.01 1vg3 h LYS 17 Ca 0.28 0.01 0.02 0.00 -1.87 0.00 0.00 60.65 59.08 1vg3 h LYS 17 Cb -0.02 0.02 -0.05 0.00 0.08 0.00 0.00 32.23 32.26 1vg3 h LYS 17 CO -0.09 -0.05 0.60 0.93 -0.57 0.00 0.00 179.45 180.27 1vg3 h GLU 18 N -0.08 1.18 -0.45 3.15 5.08 -1.43 -0.12 114.58 121.90 1vg3 h GLU 18 Ca 0.27 -0.07 -0.06 0.00 -1.00 0.00 0.00 59.36 58.50 1vg3 h GLU 18 Cb 0.51 -0.27 -0.02 0.00 0.50 0.00 0.00 28.75 29.47 1vg3 h GLU 18 CO -0.66 0.78 0.06 -0.09 -1.00 0.00 0.00 179.01 178.10 1vg3 h ARG 19 N 1.21 0.76 -0.61 2.33 9.65 0.05 -0.61 114.38 127.16 1vg3 h ARG 19 Ca 0.34 -0.21 -0.01 0.00 -1.10 0.00 0.00 59.98 59.00 1vg3 h ARG 19 Cb -0.10 -0.08 -0.03 0.00 -1.39 0.00 0.00 29.97 28.37 1vg3 h ARG 19 CO -0.09 0.79 0.32 0.82 2.80 0.00 0.00 179.97 184.61 1vg3 h ILE 20 N 0.62 1.19 -0.24 1.20 2.04 0.73 0.33 117.51 123.38 1vg3 h ILE 20 Ca 0.13 -0.49 -0.19 0.00 1.00 0.00 0.00 64.86 65.31 1vg3 h ILE 20 Cb 0.41 0.38 0.00 0.00 -0.74 0.00 0.00 36.82 36.87 1vg3 h ILE 20 CO 0.01 0.21 -0.60 1.05 0.00 0.00 0.00 178.15 178.83 1vg3 h GLU 21 N 0.85 0.78 -0.50 2.37 -0.00 -0.74 -2.93 114.58 114.41 1vg3 h GLU 21 Ca 0.22 -0.52 -0.08 0.00 -0.00 0.00 0.00 59.36 58.98 1vg3 h GLU 21 Cb 0.04 0.07 -0.02 0.00 -0.00 0.00 0.00 28.75 28.84 1vg3 h GLU 21 CO -0.03 1.15 0.01 0.37 -0.00 0.00 0.00 179.01 180.50 1vg3 h GLN 22 N 0.59 0.84 0.79 1.06 4.15 -0.44 -1.87 115.11 120.23 1vg3 h GLN 22 Ca -0.00 -0.23 -0.04 0.00 0.77 0.00 0.00 58.65 59.15 1vg3 h GLN 22 Cb 1.20 -0.10 0.01 0.00 0.21 0.00 0.00 27.48 28.80 1vg3 h GLN 22 CO 0.13 0.84 -0.38 0.82 -1.93 0.00 0.00 178.83 178.30 1vg3 h ILE 23 N 0.78 0.00 -0.65 2.39 2.04 -0.91 -3.16 117.51 118.01 1vg3 h ILE 23 Ca 0.15 -0.18 0.05 0.00 1.00 0.00 0.00 64.86 65.88 1vg3 h ILE 23 Cb 0.46 0.00 -0.05 0.00 -0.74 0.00 0.00 36.82 36.49 1vg3 h ILE 23 CO 0.02 0.00 0.36 -0.07 0.00 0.00 0.00 178.15 178.46 1vg3 h LEU 24 N -1.25 0.54 -1.21 1.44 3.38 -1.55 -1.07 115.31 115.58 1vg3 h LEU 24 Ca -0.11 0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.89 1vg3 h LEU 24 Cb 0.81 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.48 1vg3 h LEU 24 CO 0.18 0.35 0.09 -1.54 0.09 0.00 0.00 178.44 177.62 1vg3 n SER 25 N -4.79 0.47 0.07 -0.43 3.41 -0.70 -0.04 113.62 111.61 1vg3 n SER 25 Ca 0.08 0.69 0.02 0.00 -0.26 0.00 0.00 58.87 59.40 1vg3 n SER 25 Cb 0.16 -0.72 -0.04 0.00 -0.26 0.00 0.00 64.21 63.35 1vg3 n SER 25 CO 0.00 0.00 0.00 1.56 -0.16 0.00 0.00 175.04 176.44 1vg3 h GLN 26 N 0.00 0.00 0.00 4.33 7.50 -1.15 -3.41 115.11 122.37 1vg3 h GLN 26 Ca 0.00 0.00 -0.19 0.00 0.50 0.00 0.00 58.65 58.96 1vg3 h GLN 26 Cb 0.19 0.00 -0.03 0.00 0.05 0.00 0.00 27.48 27.69 1vg3 h GLN 26 CO 0.00 0.30 -1.58 1.19 -1.50 0.00 0.00 178.83 177.24 1vg3 n PHE 27 N -2.95 0.00 -2.49 2.96 3.72 0.94 -5.03 117.46 114.62 1vg3 n PHE 27 Ca -0.05 0.00 -0.33 0.00 -0.05 0.00 0.00 57.45 57.01 1vg3 n PHE 27 Cb 0.77 -0.65 -0.03 0.00 -0.94 0.00 0.00 39.48 38.63 1vg3 n PHE 27 CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 176.76 176.65 1vg3 s PHE 28 N -2.65 3.14 1.38 1.38 0.08 0.57 -5.05 117.98 116.83 1vg3 s PHE 28 Ca -0.30 1.55 -0.21 0.00 0.12 0.00 0.00 56.93 58.10 1vg3 s PHE 28 Cb 0.08 -2.96 0.35 0.00 -0.57 0.00 0.00 43.02 39.91 1vg3 s PHE 28 CO 0.41 -0.65 0.86 -2.30 -0.10 0.00 0.00 175.22 173.44 1vg3 n PRO 29 N -1.20 -4.10 -0.02 0.24 -0.02 -1.26 -4.70 135.00 123.94 1vg3 n PRO 29 Ca 0.08 -1.21 -0.16 0.00 -2.02 0.00 0.00 63.50 60.19 1vg3 n PRO 29 Cb 0.53 -1.96 -0.13 0.00 -0.02 0.00 0.00 33.50 31.92 1vg3 n PRO 29 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 1vg3 h GLU 30 N -3.34 0.13 -0.94 -0.52 4.57 -1.96 -3.06 114.58 109.45 1vg3 h GLU 30 Ca -0.46 -0.20 0.07 0.00 -1.18 0.00 0.00 59.36 57.59 1vg3 h GLU 30 Cb 1.31 0.07 -0.07 0.00 -0.16 0.00 0.00 28.75 29.91 1vg3 h GLU 30 CO 0.31 1.08 0.60 -0.56 -1.18 0.00 0.00 179.01 179.25 1vg3 h GLN 31 N -0.72 1.04 -0.01 1.92 3.07 -2.03 -1.32 115.11 117.06 1vg3 h GLN 31 Ca -0.05 -0.06 -0.10 0.00 0.09 0.00 0.00 58.65 58.52 1vg3 h GLN 31 Cb 1.23 -0.23 -0.01 0.00 0.08 0.00 0.00 27.48 28.54 1vg3 h GLN 31 CO 0.06 0.69 -0.48 0.97 0.09 0.00 0.00 178.83 180.16 1vg3 h ILE 32 N 1.07 1.35 0.03 1.86 6.09 -1.94 -3.29 117.51 122.67 1vg3 h ILE 32 Ca 0.41 -1.66 0.00 0.00 -1.37 0.00 0.00 64.86 62.25 1vg3 h ILE 32 Cb 0.20 1.88 -0.02 0.00 0.47 0.00 0.00 36.82 39.35 1vg3 h ILE 32 CO -0.18 0.47 -0.17 -0.03 -3.07 0.00 0.00 178.15 175.17 1vg3 h MET 33 N 0.02 -0.22 -1.46 2.19 4.05 -1.13 -2.50 114.93 115.88 1vg3 h MET 33 Ca -0.00 0.02 0.46 0.00 -0.28 0.00 0.00 59.70 59.89 1vg3 h MET 33 Cb 0.86 0.05 -0.11 0.00 -0.80 0.00 0.00 31.60 31.60 1vg3 h MET 33 CO 0.06 -0.15 0.98 1.57 0.23 0.00 0.00 176.91 179.60 1vg3 h LYS 34 N -0.23 0.05 -0.01 0.39 2.10 -1.62 0.09 116.57 117.34 1vg3 h LYS 34 Ca -0.00 -0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1vg3 h LYS 34 Cb 0.24 -0.01 0.00 0.00 -0.90 0.00 0.00 32.23 31.56 1vg3 h LYS 34 CO -0.10 0.04 -0.14 -0.25 -2.00 0.00 0.00 179.45 176.99 1vg3 n ASP 35 N -4.50 0.94 -4.73 7.07 8.00 -0.95 -4.92 116.55 117.46 1vg3 n ASP 35 Ca 0.38 -0.95 -0.42 0.00 0.71 0.00 0.00 54.79 54.51 1vg3 n ASP 35 Cb 1.56 0.04 -0.03 0.00 -0.02 0.00 0.00 41.12 42.67 1vg3 n ASP 35 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1vg3 s LEU 36 N -2.35 4.40 -0.82 0.64 1.43 0.01 -4.76 118.68 117.23 1vg3 s LEU 36 Ca 0.30 2.23 -0.26 0.00 -1.03 0.00 0.00 54.13 55.37 1vg3 s LEU 36 Cb 0.20 -3.60 -0.21 0.00 0.03 0.00 0.00 46.19 42.62 1vg3 s LEU 36 CO 0.46 -0.49 1.91 -0.81 0.23 0.00 0.00 176.35 177.65 1vg3 n PRO 37 N 3.21 0.82 -3.12 1.29 -0.04 -1.26 -4.91 135.00 131.00 1vg3 n PRO 37 Ca 0.07 -1.82 -0.39 0.00 -0.04 0.00 0.00 63.50 61.33 1vg3 n PRO 37 Cb 0.44 -3.36 -0.06 0.00 -0.04 0.00 0.00 33.50 30.49 1vg3 n PRO 37 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1vg3 s LEU 38 N 8.39 4.50 -0.19 1.53 1.43 -1.26 -4.77 118.68 128.31 1vg3 s LEU 38 Ca 0.70 1.36 -0.07 0.00 -1.03 0.00 0.00 54.13 55.10 1vg3 s LEU 38 Cb 0.05 -3.07 0.03 0.00 0.03 0.00 0.00 46.19 43.22 1vg3 s LEU 38 CO 0.19 0.15 0.13 -1.22 0.23 0.00 0.00 176.35 175.84 1vg3 n TYR 39 N 2.21 -3.56 0.00 0.29 0.53 -1.26 -5.09 117.16 110.28 1vg3 n TYR 39 Ca -0.07 1.91 0.00 0.00 -1.02 0.00 0.00 57.90 58.72 1vg3 n TYR 39 Cb 0.50 -3.53 0.00 0.00 -1.03 0.00 0.00 39.34 35.28 1vg3 n TYR 39 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 1vg3 n GLY 40 N 1.10 0.97 0.21 2.72 0.00 -1.26 -4.90 105.19 104.04 1vg3 n GLY 40 Ca -0.23 -0.57 0.08 0.00 0.00 0.00 0.00 46.02 45.30 1vg3 n GLY 40 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1vg3 h LYS 41 N 0.00 0.00 -3.50 1.61 1.57 -2.02 -3.45 116.57 110.78 1vg3 h LYS 41 Ca 0.00 0.00 -0.32 0.00 -1.87 0.00 0.00 60.65 58.46 1vg3 h LYS 41 Cb 0.00 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.30 1vg3 h LYS 41 CO 0.00 0.28 -0.41 -1.33 -0.57 0.00 0.00 179.45 177.42 1vg3 n MET 42 N -3.63 -2.02 -0.01 3.15 2.81 -1.26 -4.87 117.12 111.28 1vg3 n MET 42 Ca -0.01 0.77 -0.04 0.00 -1.81 0.00 0.00 57.70 56.61 1vg3 n MET 42 Cb 0.40 -5.40 -0.03 0.00 -0.71 0.00 0.00 33.22 27.49 1vg3 n MET 42 CO 0.00 0.00 0.00 1.25 1.51 0.00 0.00 175.97 178.73 1vg3 h LEU 43 N -0.01 -0.49 -1.99 4.03 7.12 -2.01 -2.48 115.31 119.48 1vg3 h LEU 43 Ca -0.38 0.06 0.33 0.00 0.13 0.00 0.00 57.88 58.02 1vg3 h LEU 43 Cb 1.28 0.19 -0.05 0.00 -0.53 0.00 0.00 40.66 41.56 1vg3 h LEU 43 CO 0.45 -0.13 0.83 0.03 -0.13 0.00 0.00 178.44 179.49 1vg3 h ARG 44 N -0.15 0.00 0.02 1.25 3.08 -1.97 -1.62 114.38 115.00 1vg3 h ARG 44 Ca 0.01 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.06 1vg3 h ARG 44 Cb 0.18 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.23 1vg3 h ARG 44 CO -0.13 0.00 -0.01 0.28 -1.07 0.00 0.00 179.97 179.03 1vg3 h VAL 45 N 0.00 1.38 -0.91 2.04 2.07 -1.80 -2.98 116.25 116.06 1vg3 h VAL 45 Ca 0.54 -1.32 0.11 0.00 0.82 0.00 0.00 66.70 66.85 1vg3 h VAL 45 Cb 2.19 2.26 -0.08 0.00 -1.52 0.00 0.00 31.29 34.14 1vg3 h VAL 45 CO -0.01 0.33 0.54 0.03 0.02 0.00 0.00 177.57 178.49 1vg3 h ARG 46 N -0.61 0.85 0.00 1.57 3.08 -1.12 0.65 114.38 118.80 1vg3 h ARG 46 Ca -0.00 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 60.00 1vg3 h ARG 46 Cb 0.57 -0.19 0.00 0.00 0.08 0.00 0.00 29.97 30.43 1vg3 h ARG 46 CO 0.01 0.56 0.00 -0.07 -1.07 0.00 0.00 179.97 179.40 1vg3 h LEU 47 N 0.88 0.00 0.11 3.04 3.38 -1.50 -2.54 115.31 118.68 1vg3 h LEU 47 Ca 0.45 0.00 -0.34 0.00 0.09 0.00 0.00 57.88 58.07 1vg3 h LEU 47 Cb 0.43 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.16 1vg3 h LEU 47 CO -0.26 0.00 -1.88 -0.24 0.09 0.00 0.00 178.44 176.15 1vg3 n SER 48 N -2.36 2.09 -0.33 -0.43 2.88 0.21 -2.94 113.62 112.73 1vg3 n SER 48 Ca 0.01 0.25 0.04 0.00 -1.33 0.00 0.00 58.87 57.83 1vg3 n SER 48 Cb 0.17 -0.88 0.19 0.00 -0.75 0.00 0.00 64.21 62.94 1vg3 n SER 48 CO 0.00 0.00 0.00 0.16 -1.23 0.00 0.00 175.04 173.97 1vg3 h ILE 49 N -0.11 0.96 -0.33 2.46 3.07 -0.57 -1.16 117.51 121.83 1vg3 h ILE 49 Ca -0.41 -0.33 -0.15 0.00 1.55 0.00 0.00 64.86 65.52 1vg3 h ILE 49 Cb 1.91 -0.08 -0.00 0.00 -0.27 0.00 0.00 36.82 38.38 1vg3 h ILE 49 CO 0.04 0.17 -0.38 -0.07 -1.05 0.00 0.00 178.15 176.87 1vg3 h LEU 50 N 0.96 0.91 -0.72 0.16 3.38 -1.65 -2.68 115.31 115.66 1vg3 h LEU 50 Ca 0.44 -0.48 0.13 0.00 0.09 0.00 0.00 57.88 58.05 1vg3 h LEU 50 Cb 0.34 -0.26 -0.09 0.00 0.09 0.00 0.00 40.66 40.75 1vg3 h LEU 50 CO -0.23 1.20 0.29 -1.28 0.09 0.00 0.00 178.44 178.51 1vg3 h SER 51 N 0.63 0.27 0.36 -0.43 0.87 -1.13 0.15 113.55 114.27 1vg3 h SER 51 Ca 0.05 0.10 -0.02 0.00 -1.23 0.00 0.00 61.79 60.69 1vg3 h SER 51 Cb 0.97 0.08 -0.00 0.00 -0.44 0.00 0.00 62.40 63.00 1vg3 h SER 51 CO 0.09 0.12 -0.22 -0.26 -0.53 0.00 0.00 176.83 176.03 1vg3 h PHE 52 N 0.44 -0.58 -0.76 2.24 0.04 -1.20 -2.13 116.94 115.00 1vg3 h PHE 52 Ca 0.39 -0.01 0.13 0.00 2.80 0.00 0.00 57.97 61.28 1vg3 h PHE 52 Cb 0.55 0.20 -0.13 0.00 2.20 0.00 0.00 35.95 38.78 1vg3 h PHE 52 CO -0.17 -0.32 -0.35 0.87 -0.60 0.00 0.00 178.31 177.74 1vg3 h LYS 53 N -0.54 -0.09 -0.82 1.51 1.57 -1.07 0.25 116.57 117.38 1vg3 h LYS 53 Ca -0.05 0.01 0.10 0.00 -1.87 0.00 0.00 60.65 58.84 1vg3 h LYS 53 Cb 0.43 0.02 -0.08 0.00 0.08 0.00 0.00 32.23 32.68 1vg3 h LYS 53 CO 0.05 -0.06 0.46 -0.97 -0.57 0.00 0.00 179.45 178.36 1vg3 h ASN 54 N -0.09 0.63 0.80 0.86 -0.73 -0.70 0.40 115.58 116.76 1vg3 h ASN 54 Ca 0.28 0.06 0.00 0.00 1.87 0.00 0.00 56.30 58.51 1vg3 h ASN 54 Cb 0.57 -0.06 0.00 0.00 0.27 0.00 0.00 38.32 39.10 1vg3 h ASN 54 CO -0.81 0.35 0.00 -1.14 -0.37 0.00 0.00 177.43 175.46 1vg3 n ARG 55 N -4.77 0.09 -1.32 6.67 0.63 0.31 -4.90 116.66 113.37 1vg3 n ARG 55 Ca 0.14 0.05 -0.01 0.00 -0.92 0.00 0.00 57.85 57.10 1vg3 n ARG 55 Cb 0.30 -1.50 -0.00 0.00 0.45 0.00 0.00 32.46 31.71 1vg3 n ARG 55 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1vg3 n GLY 56 N 1.13 0.43 3.83 5.14 0.00 0.14 -5.04 105.19 110.82 1vg3 n GLY 56 Ca 0.08 -0.98 -0.37 0.00 0.00 0.00 0.00 46.02 44.75 1vg3 n GLY 56 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1vg3 s VAL 57 N -2.05 5.28 0.41 1.61 1.01 -0.74 -4.97 120.40 120.95 1vg3 s VAL 57 Ca 0.00 0.53 -0.19 0.00 0.00 0.00 0.00 61.98 62.32 1vg3 s VAL 57 Cb 0.00 -3.57 -0.10 0.00 0.00 0.00 0.00 36.38 32.71 1vg3 s VAL 57 CO 0.00 0.55 0.89 -0.70 0.00 0.00 0.00 175.10 175.84 1vg3 s GLU 58 N -0.71 4.12 -0.83 2.72 2.12 -1.26 -4.04 118.70 120.82 1vg3 s GLU 58 Ca 0.19 0.96 -0.17 0.00 0.36 0.00 0.00 54.97 56.31 1vg3 s GLU 58 Cb -0.14 -2.25 0.17 0.00 0.26 0.00 0.00 34.13 32.17 1vg3 s GLU 58 CO 0.08 -0.01 0.90 0.42 -0.54 0.00 0.00 175.26 176.11 1vg3 s ILE 59 N -2.18 5.16 0.71 -3.70 1.01 -1.26 -4.95 121.20 115.99 1vg3 s ILE 59 Ca 0.59 -1.92 -0.03 0.00 0.00 0.00 0.00 60.65 59.30 1vg3 s ILE 59 Cb -0.09 -4.59 0.11 0.00 0.01 0.00 0.00 42.46 37.89 1vg3 s ILE 59 CO 0.17 -1.23 0.99 -0.83 0.00 0.00 0.00 174.94 174.04 1vg3 s GLY 60 N 2.95 1.76 0.19 6.18 0.00 -1.26 -4.75 107.32 112.40 1vg3 s GLY 60 Ca 0.23 -1.49 -0.15 0.00 0.00 0.00 0.00 44.72 43.31 1vg3 s GLY 60 CO -0.07 -0.97 1.30 1.18 0.00 0.00 0.00 173.10 174.54 1vg3 n GLU 61 N -2.86 -0.20 -0.20 2.90 1.02 -1.26 0.49 120.64 120.54 1vg3 n GLU 61 Ca 0.13 1.29 -0.00 0.00 -0.02 0.00 0.00 57.16 58.56 1vg3 n GLU 61 Cb 0.60 -1.92 0.08 0.00 -0.02 0.00 0.00 31.44 30.18 1vg3 n GLU 61 CO 0.00 0.00 0.00 -0.44 1.18 0.00 0.00 177.13 177.87 1vg3 h ASP 62 N 0.00 -0.40 0.45 1.62 3.45 -1.97 0.39 116.42 119.96 1vg3 h ASP 62 Ca 0.29 0.16 -0.01 0.00 0.43 0.00 0.00 57.03 57.90 1vg3 h ASP 62 Cb 0.50 0.31 -0.01 0.00 -0.56 0.00 0.00 39.33 39.57 1vg3 h ASP 62 CO -0.83 -0.15 -0.33 0.00 -1.57 0.00 0.00 179.24 176.35 1vg3 h ALA 63 N 1.57 -0.79 -0.43 3.45 0.00 -0.29 0.31 119.26 123.08 1vg3 h ALA 63 Ca 0.30 -0.14 0.12 0.00 0.00 0.00 0.00 54.91 55.19 1vg3 h ALA 63 Cb 0.47 0.44 -0.02 0.00 0.00 0.00 0.00 17.79 18.68 1vg3 h ALA 63 CO -0.56 -0.97 0.32 0.82 0.00 0.00 0.00 179.25 178.87 1vg3 h ILE 64 N -0.77 0.72 0.00 0.00 1.08 -0.43 0.76 117.51 118.86 1vg3 h ILE 64 Ca -0.05 0.00 -0.14 0.00 -0.39 0.00 0.00 64.86 64.29 1vg3 h ILE 64 Cb 0.66 0.77 -0.02 0.00 -3.07 0.00 0.00 36.82 35.15 1vg3 h ILE 64 CO 0.01 0.00 -0.72 0.28 -0.69 0.00 0.00 178.15 177.03 1vg3 h SER 65 N 0.00 0.00 0.82 1.72 0.02 0.74 -2.96 113.55 113.88 1vg3 h SER 65 Ca 0.20 0.00 -0.15 0.00 -0.84 0.00 0.00 61.79 61.00 1vg3 h SER 65 Cb 0.85 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 63.37 1vg3 h SER 65 CO -0.00 0.63 -1.28 0.77 -1.14 0.00 0.00 176.83 175.81 1vg3 h SER 66 N 0.00 0.00 0.80 3.07 4.64 0.26 -3.04 113.55 119.28 1vg3 h SER 66 Ca -0.03 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.29 1vg3 h SER 66 Cb 1.50 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.59 1vg3 h SER 66 CO 0.08 0.54 0.00 0.18 -0.87 0.00 0.00 176.83 176.76 1vg3 n LEU 67 N -2.92 0.00 -0.10 5.97 4.77 0.23 -2.32 117.00 122.64 1vg3 n LEU 67 Ca -0.08 0.48 -0.23 0.00 -0.03 0.00 0.00 56.01 56.15 1vg3 n LEU 67 Cb 0.81 -0.48 -0.11 0.00 -2.33 0.00 0.00 43.42 41.31 1vg3 n LEU 67 CO 0.43 -0.08 -0.74 0.00 -1.33 0.00 0.00 177.39 175.67 1vg3 n ALA 68 N -1.48 0.88 -0.30 -1.18 0.00 -1.12 -4.03 120.51 113.28 1vg3 n ALA 68 Ca 0.06 -0.62 0.06 0.00 0.00 0.00 0.00 53.44 52.95 1vg3 n ALA 68 Cb 0.28 -0.44 0.22 0.00 0.00 0.00 0.00 19.45 19.50 1vg3 n ALA 68 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1vg3 h ALA 69 N -0.52 1.28 -0.37 0.00 0.00 -1.46 0.54 119.26 118.73 1vg3 h ALA 69 Ca -0.43 0.07 0.07 0.00 0.00 0.00 0.00 54.91 54.63 1vg3 h ALA 69 Cb 1.45 -0.05 -0.09 0.00 0.00 0.00 0.00 17.79 19.09 1vg3 h ALA 69 CO -0.22 -0.03 -0.34 1.25 0.00 0.00 0.00 179.25 179.91 1vg3 h LEU 70 N 0.68 -1.11 -1.14 0.00 5.85 -1.63 0.33 115.31 118.30 1vg3 h LEU 70 Ca 0.45 0.19 -0.08 0.00 0.84 0.00 0.00 57.88 59.29 1vg3 h LEU 70 Cb 0.59 0.51 -0.01 0.00 0.37 0.00 0.00 40.66 42.12 1vg3 h LEU 70 CO -0.33 -0.33 -0.23 -0.33 -0.34 0.00 0.00 178.44 176.88 1vg3 h GLU 71 N -0.28 0.32 -0.47 1.25 4.39 -1.36 -2.21 114.58 116.23 1vg3 h GLU 71 Ca 0.16 -0.11 -0.02 0.00 0.34 0.00 0.00 59.36 59.74 1vg3 h GLU 71 Cb 0.54 -0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 29.14 1vg3 h GLU 71 CO -0.52 0.54 0.23 -0.07 -1.16 0.00 0.00 179.01 178.03 1vg3 h LEU 72 N 0.29 0.61 -0.36 1.33 3.38 0.12 0.28 115.31 120.95 1vg3 h LEU 72 Ca 0.05 -0.12 -0.00 0.00 0.09 0.00 0.00 57.88 57.90 1vg3 h LEU 72 Cb 0.57 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.15 1vg3 h LEU 72 CO 0.04 0.56 0.22 0.58 0.09 0.00 0.00 178.44 179.92 1vg3 h VAL 73 N 0.61 1.12 0.16 1.22 2.07 -0.09 0.49 116.25 121.83 1vg3 h VAL 73 Ca 0.16 -0.29 0.01 0.00 0.82 0.00 0.00 66.70 67.40 1vg3 h VAL 73 Cb 0.11 0.66 -0.02 0.00 -1.52 0.00 0.00 31.29 30.52 1vg3 h VAL 73 CO -0.02 0.12 -0.18 -0.74 0.02 0.00 0.00 177.57 176.77 1vg3 h HIS 74 N 0.47 -0.47 -0.99 1.57 -0.00 -1.00 -1.92 115.15 112.80 1vg3 h HIS 74 Ca 0.13 0.00 0.16 0.00 -0.00 0.00 0.00 60.37 60.66 1vg3 h HIS 74 Cb 0.01 0.19 -0.09 0.00 -0.00 0.00 0.00 27.41 27.51 1vg3 h HIS 74 CO -0.04 -0.27 0.62 1.25 -0.00 0.00 0.00 177.93 179.50 1vg3 h LEU 75 N -0.38 0.83 -1.01 0.26 5.85 -0.15 0.11 115.31 120.82 1vg3 h LEU 75 Ca 0.01 0.07 0.08 0.00 0.84 0.00 0.00 57.88 58.88 1vg3 h LEU 75 Cb 0.37 -0.09 -0.07 0.00 0.37 0.00 0.00 40.66 41.23 1vg3 h LEU 75 CO -0.06 0.37 0.65 0.22 -0.34 0.00 0.00 178.44 179.28 1vg3 h TYR 76 N 0.85 1.19 -0.09 1.25 3.20 -0.13 -1.12 116.97 122.13 1vg3 h TYR 76 Ca 0.53 0.03 -0.16 0.00 3.14 0.00 0.00 58.73 62.27 1vg3 h TYR 76 Cb 0.72 -0.39 -0.01 0.00 1.54 0.00 0.00 36.73 38.59 1vg3 h TYR 76 CO -0.00 0.58 -0.65 0.74 -1.64 0.00 0.00 178.16 177.19 1vg3 h PHE 77 N 1.13 0.44 -0.32 -3.82 -1.00 -0.40 -2.90 116.94 110.07 1vg3 h PHE 77 Ca 0.45 -0.18 -0.03 0.00 2.81 0.00 0.00 57.97 61.03 1vg3 h PHE 77 Cb 0.26 -0.07 -0.01 0.00 3.61 0.00 0.00 35.95 39.73 1vg3 h PHE 77 CO -0.00 0.88 0.09 -0.07 -1.61 0.00 0.00 178.31 177.61 1vg3 h LEU 78 N 0.24 0.48 -1.40 1.54 3.38 -0.56 -2.42 115.31 116.57 1vg3 h LEU 78 Ca -0.01 -0.21 0.02 0.00 0.09 0.00 0.00 57.88 57.76 1vg3 h LEU 78 Cb 1.18 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 41.77 1vg3 h LEU 78 CO 0.11 0.56 0.42 -0.07 0.09 0.00 0.00 178.44 179.55 1vg3 h LEU 79 N 0.37 0.69 -0.03 1.67 3.38 -1.21 -1.07 115.31 119.10 1vg3 h LEU 79 Ca 0.10 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.06 1vg3 h LEU 79 Cb 0.26 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 40.85 1vg3 h LEU 79 CO -0.00 0.49 0.00 0.45 0.09 0.00 0.00 178.44 179.47 1vg3 h HIS 80 N 0.81 0.00 0.08 1.13 3.86 -1.30 -3.00 115.15 116.74 1vg3 h HIS 80 Ca 0.25 0.00 -0.34 0.00 -1.16 0.00 0.00 60.37 59.12 1vg3 h HIS 80 Cb -0.01 0.00 -0.03 0.00 1.06 0.00 0.00 27.41 28.44 1vg3 h HIS 80 CO -0.00 0.00 -1.87 -0.25 0.86 0.00 0.00 177.93 176.67 1vg3 n ASP 81 N -2.54 2.05 0.05 2.45 10.43 -0.89 -3.86 116.55 124.23 1vg3 n ASP 81 Ca 0.05 0.24 -0.11 0.00 2.57 0.00 0.00 54.79 57.55 1vg3 n ASP 81 Cb 0.46 -0.86 -0.04 0.00 1.84 0.00 0.00 41.12 42.51 1vg3 n ASP 81 CO 0.00 0.00 0.00 0.44 -1.07 0.00 0.00 177.20 176.57 1vg3 h ASP 82 N -0.23 -0.68 -0.79 -2.24 5.19 -1.29 0.46 116.42 116.84 1vg3 h ASP 82 Ca -0.43 0.10 0.22 0.00 -0.62 0.00 0.00 57.03 56.30 1vg3 h ASP 82 Cb 1.84 0.29 -0.04 0.00 0.18 0.00 0.00 39.33 41.59 1vg3 h ASP 82 CO -0.01 -0.29 0.56 1.62 -3.12 0.00 0.00 179.24 178.00 1vg3 h VAL 83 N -0.34 0.63 0.09 -1.35 3.04 -1.71 0.63 116.25 117.24 1vg3 h VAL 83 Ca 0.07 -0.03 -0.27 0.00 -1.01 0.00 0.00 66.70 65.46 1vg3 h VAL 83 Cb 0.44 0.54 -0.01 0.00 -2.01 0.00 0.00 31.29 30.24 1vg3 h VAL 83 CO -0.23 0.02 -1.41 0.40 -1.01 0.00 0.00 177.57 175.34 1vg3 h ILE 84 N 0.09 0.97 0.00 3.17 2.04 -1.28 -3.29 117.51 119.20 1vg3 h ILE 84 Ca 0.38 -2.34 0.00 0.00 1.00 0.00 0.00 64.86 63.90 1vg3 h ILE 84 Cb 1.40 2.61 0.00 0.00 -0.74 0.00 0.00 36.82 40.08 1vg3 h ILE 84 CO -0.04 0.65 0.00 0.47 0.00 0.00 0.00 178.15 179.23 1vg3 n ASP 85 N -3.99 0.00 0.00 1.72 8.00 0.15 -4.84 116.55 117.59 1vg3 n ASP 85 Ca -0.27 -0.58 0.00 0.00 0.71 0.00 0.00 54.79 54.65 1vg3 n ASP 85 Cb 0.86 -0.09 0.00 0.00 -0.02 0.00 0.00 41.12 41.87 1vg3 n ASP 85 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1vg3 n GLY 86 N 0.69 0.00 3.56 0.44 0.00 0.21 -4.85 105.19 105.25 1vg3 n GLY 86 Ca 0.17 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.72 1vg3 n GLY 86 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1vg3 n ALA 87 N 0.63 -0.87 -0.02 4.61 0.00 -1.18 -4.92 120.51 118.75 1vg3 n ALA 87 Ca 0.00 0.44 -0.18 0.00 0.00 0.00 0.00 53.44 53.70 1vg3 n ALA 87 Cb 0.28 -1.97 -0.14 0.00 0.00 0.00 0.00 19.45 17.62 1vg3 n ALA 87 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 1vg3 h ARG 88 N 2.58 0.13 -5.86 0.00 2.43 -1.93 -3.44 114.38 108.30 1vg3 h ARG 88 Ca -0.40 -0.23 -0.67 0.00 -0.81 0.00 0.00 59.98 57.87 1vg3 h ARG 88 Cb 1.35 0.08 -0.10 0.00 -0.42 0.00 0.00 29.97 30.88 1vg3 h ARG 88 CO 0.65 1.11 -0.56 -0.06 -1.51 0.00 0.00 179.97 179.60 1vg3 s PHE 89 N -2.33 3.36 -0.80 2.20 0.40 -1.26 0.31 117.98 119.86 1vg3 s PHE 89 Ca -0.18 0.32 0.02 0.00 -0.60 0.00 0.00 56.93 56.49 1vg3 s PHE 89 Cb -0.00 -1.83 0.19 0.00 0.51 0.00 0.00 43.02 41.89 1vg3 s PHE 89 CO 0.74 0.59 0.64 0.50 0.70 0.00 0.00 175.22 178.39 1vg3 s ARG 90 N -1.20 2.87 -0.41 0.44 6.06 0.56 -4.76 118.95 122.52 1vg3 s ARG 90 Ca 0.17 -3.34 -0.28 0.00 -2.50 0.00 0.00 55.73 49.79 1vg3 s ARG 90 Cb -0.12 -3.69 0.04 0.00 0.06 0.00 0.00 34.95 31.25 1vg3 s ARG 90 CO 0.07 -1.28 0.58 0.54 -2.50 0.00 0.00 175.30 172.70 1vg3 n ARG 91 N 2.11 -2.04 0.00 5.12 1.74 -1.26 -2.74 116.66 119.60 1vg3 n ARG 91 Ca 0.21 1.67 0.00 0.00 -0.77 0.00 0.00 57.85 58.96 1vg3 n ARG 91 Cb 0.36 -3.30 0.00 0.00 -1.02 0.00 0.00 32.46 28.50 1vg3 n ARG 91 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1vg3 n GLY 92 N -0.09 2.95 3.45 -0.13 0.00 -1.26 -4.99 105.19 105.12 1vg3 n GLY 92 Ca -0.01 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.78 1vg3 n GLY 92 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1vg3 s LYS 93 N -0.11 1.61 -0.16 1.61 2.47 -1.11 -5.13 119.74 118.93 1vg3 s LYS 93 Ca 0.00 -1.77 -0.19 0.00 -1.56 0.00 0.00 55.97 52.45 1vg3 s LYS 93 Cb 0.00 -1.50 -0.04 0.00 -1.46 0.00 0.00 37.83 34.84 1vg3 s LYS 93 CO 0.00 0.20 0.52 -1.21 0.16 0.00 0.00 175.35 175.02 1vg3 s GLU 94 N -3.60 4.27 0.66 4.03 2.02 -1.26 0.21 118.70 125.02 1vg3 s GLU 94 Ca 0.29 0.47 -0.17 0.00 0.02 0.00 0.00 54.97 55.58 1vg3 s GLU 94 Cb -0.01 -3.50 -0.02 0.00 0.10 0.00 0.00 34.13 30.70 1vg3 s GLU 94 CO 0.13 -0.02 1.06 0.25 0.02 0.00 0.00 175.26 176.70 1vg3 n THR 95 N 4.15 3.82 -0.14 3.63 -2.24 0.15 -4.77 114.28 118.87 1vg3 n THR 95 Ca -0.05 -0.46 -0.11 0.00 -2.27 0.00 0.00 64.05 61.16 1vg3 n THR 95 Cb 0.51 -1.23 -0.02 0.00 -2.10 0.00 0.00 70.33 67.50 1vg3 n THR 95 CO 0.00 0.00 0.00 0.40 -0.57 0.00 0.00 175.07 174.90 1vg3 h ILE 96 N 0.23 1.28 -0.66 2.28 2.04 -1.88 -2.20 117.51 118.60 1vg3 h ILE 96 Ca -0.49 -1.25 0.14 0.00 1.00 0.00 0.00 64.86 64.27 1vg3 h ILE 96 Cb 1.35 1.23 -0.04 0.00 -0.74 0.00 0.00 36.82 38.62 1vg3 h ILE 96 CO 0.50 0.42 0.45 -0.55 0.00 0.00 0.00 178.15 178.97 1vg3 h ASN 97 N 0.62 0.26 0.01 1.72 7.08 -1.92 1.00 115.58 124.35 1vg3 h ASN 97 Ca 0.10 0.01 -0.07 0.00 -3.08 0.00 0.00 56.30 53.26 1vg3 h ASN 97 Cb 0.68 -0.04 0.01 0.00 -2.08 0.00 0.00 38.32 36.88 1vg3 h ASN 97 CO 0.05 0.14 -0.28 0.15 -2.08 0.00 0.00 177.43 175.41 1vg3 h PHE 98 N 0.28 0.26 0.00 4.14 3.57 -1.79 0.27 116.94 123.67 1vg3 h PHE 98 Ca 0.32 -0.15 0.00 0.00 3.53 0.00 0.00 57.97 61.67 1vg3 h PHE 98 Cb 0.86 -0.03 0.00 0.00 2.79 0.00 0.00 35.95 39.58 1vg3 h PHE 98 CO -0.00 0.98 0.00 0.52 -2.23 0.00 0.00 178.31 177.58 1vg3 h MET 99 N -0.53 0.00 0.00 1.11 2.86 -0.55 -3.37 114.93 114.45 1vg3 h MET 99 Ca -0.04 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.60 1vg3 h MET 99 Cb 1.06 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.72 1vg3 h MET 99 CO 0.05 0.00 -0.05 0.66 1.06 0.00 0.00 176.91 178.63 1vg3 n TYR 100 N -2.78 0.00 0.00 -0.22 4.02 0.33 -5.06 117.16 113.45 1vg3 n TYR 100 Ca 0.02 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.91 1vg3 n TYR 100 Cb 0.31 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.63 1vg3 n TYR 100 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1vg3 n GLY 101 N 0.20 2.51 0.32 2.72 0.00 0.93 -4.56 105.19 107.31 1vg3 n GLY 101 Ca 0.00 -1.60 0.10 0.00 0.00 0.00 0.00 46.02 44.52 1vg3 n GLY 101 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1vg3 h ASP 102 N 0.00 -0.50 -0.96 1.61 3.45 -1.90 0.12 116.42 118.24 1vg3 h ASP 102 Ca 0.00 0.26 0.10 0.00 0.43 0.00 0.00 57.03 57.82 1vg3 h ASP 102 Cb 0.00 0.46 -0.07 0.00 -0.56 0.00 0.00 39.33 39.16 1vg3 h ASP 102 CO 0.00 -0.29 0.62 0.50 -1.57 0.00 0.00 179.24 178.49 1vg3 h LYS 103 N 0.04 0.96 -0.12 3.56 3.11 -1.93 -0.20 116.57 121.99 1vg3 h LYS 103 Ca 0.52 -0.06 -0.19 0.00 -2.81 0.00 0.00 60.65 58.12 1vg3 h LYS 103 Cb 0.99 -0.22 -0.00 0.00 -1.00 0.00 0.00 32.23 32.00 1vg3 h LYS 103 CO -0.85 0.64 -0.69 0.00 -2.81 0.00 0.00 179.45 175.73 1vg3 h ALA 104 N 1.53 0.57 0.16 5.00 0.00 -1.03 -1.98 119.26 123.50 1vg3 h ALA 104 Ca 0.45 -0.58 -0.01 0.00 0.00 0.00 0.00 54.91 54.77 1vg3 h ALA 104 Cb 0.40 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.13 1vg3 h ALA 104 CO -0.21 0.73 -0.08 0.00 0.00 0.00 0.00 179.25 179.69 1vg3 h ALA 105 N 0.87 -0.21 -0.72 0.00 0.00 -0.41 -0.93 119.26 117.86 1vg3 h ALA 105 Ca -0.02 -0.08 0.01 0.00 0.00 0.00 0.00 54.91 54.82 1vg3 h ALA 105 Cb 1.27 0.08 -0.04 0.00 0.00 0.00 0.00 17.79 19.10 1vg3 h ALA 105 CO 0.13 -0.58 0.47 0.28 0.00 0.00 0.00 179.25 179.55 1vg3 h VAL 106 N -0.29 1.17 0.12 0.00 2.07 -1.11 0.47 116.25 118.67 1vg3 h VAL 106 Ca -0.02 -0.33 0.00 0.00 0.82 0.00 0.00 66.70 67.17 1vg3 h VAL 106 Cb 0.23 0.13 -0.03 0.00 -1.52 0.00 0.00 31.29 30.10 1vg3 h VAL 106 CO 0.04 0.17 -0.33 0.00 0.02 0.00 0.00 177.57 177.47 1vg3 h ALA 107 N 1.27 -0.87 0.00 1.67 0.00 -1.05 0.20 119.26 120.49 1vg3 h ALA 107 Ca 0.27 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 55.10 1vg3 h ALA 107 Cb -0.08 0.69 -0.00 0.00 0.00 0.00 0.00 17.79 18.40 1vg3 h ALA 107 CO -0.07 -0.93 -0.01 0.00 0.00 0.00 0.00 179.25 178.24 1vg3 h ALA 108 N -0.99 1.58 0.50 0.00 0.00 -0.99 -0.85 119.26 118.51 1vg3 h ALA 108 Ca -0.01 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 1vg3 h ALA 108 Cb 0.49 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.28 1vg3 h ALA 108 CO -0.15 0.01 -0.24 0.78 0.00 0.00 0.00 179.25 179.65 1vg3 h GLY 109 N 0.04 -0.71 2.00 0.00 0.00 0.20 -1.96 103.07 102.65 1vg3 h GLY 109 Ca -0.00 0.26 0.00 0.00 0.00 0.00 0.00 47.33 47.59 1vg3 h GLY 109 CO 0.00 -0.26 0.00 -0.55 0.00 0.00 0.00 176.54 175.73 1vg3 h ASP 110 N -0.92 0.00 0.56 0.19 3.32 -0.41 -2.82 116.42 116.34 1vg3 h ASP 110 Ca -0.07 0.00 -0.24 0.00 0.02 0.00 0.00 57.03 56.74 1vg3 h ASP 110 Cb 0.60 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.15 1vg3 h ASP 110 CO 0.11 0.00 -1.07 0.25 -1.72 0.00 0.00 179.24 176.82 1vg3 h LEU 111 N 0.00 0.39 -0.43 1.55 5.85 -1.06 -2.92 115.31 118.69 1vg3 h LEU 111 Ca 0.00 -0.37 -0.07 0.00 0.84 0.00 0.00 57.88 58.28 1vg3 h LEU 111 Cb 0.49 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 41.38 1vg3 h LEU 111 CO 0.00 1.22 -0.01 0.58 -0.34 0.00 0.00 178.44 179.90 1vg3 h VAL 112 N 0.12 1.26 -0.64 1.05 2.07 -1.09 -1.85 116.25 117.16 1vg3 h VAL 112 Ca -0.09 -1.04 0.10 0.00 0.82 0.00 0.00 66.70 66.48 1vg3 h VAL 112 Cb 1.75 1.08 -0.04 0.00 -1.52 0.00 0.00 31.29 32.56 1vg3 h VAL 112 CO 0.17 0.36 0.43 0.25 0.02 0.00 0.00 177.57 178.80 1vg3 h LEU 113 N 0.61 0.44 -0.22 2.57 5.85 -1.53 -0.18 115.31 122.83 1vg3 h LEU 113 Ca 0.12 0.01 -0.06 0.00 0.84 0.00 0.00 57.88 58.79 1vg3 h LEU 113 Cb 0.50 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.44 1vg3 h LEU 113 CO 0.02 0.26 -0.10 0.58 -0.34 0.00 0.00 178.44 178.86 1vg3 h VAL 114 N 0.48 1.30 -0.19 1.05 2.07 -1.22 -1.41 116.25 118.33 1vg3 h VAL 114 Ca 0.30 -1.17 0.06 0.00 0.82 0.00 0.00 66.70 66.70 1vg3 h VAL 114 Cb 0.52 1.60 -0.01 0.00 -1.52 0.00 0.00 31.29 31.88 1vg3 h VAL 114 CO -0.09 0.36 0.17 0.77 0.02 0.00 0.00 177.57 178.80 1vg3 h SER 115 N 0.17 0.00 0.14 0.57 4.64 -0.30 0.33 113.55 119.10 1vg3 h SER 115 Ca 0.05 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.36 1vg3 h SER 115 Cb 0.60 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.69 1vg3 h SER 115 CO 0.03 0.00 -0.07 0.00 -0.87 0.00 0.00 176.83 175.93 1vg3 h ALA 116 N 1.84 -0.41 -1.02 5.18 0.00 -0.52 -2.41 119.26 121.92 1vg3 h ALA 116 Ca 0.09 -0.04 0.26 0.00 0.00 0.00 0.00 54.91 55.22 1vg3 h ALA 116 Cb 0.44 0.07 -0.08 0.00 0.00 0.00 0.00 17.79 18.21 1vg3 h ALA 116 CO -0.00 -0.40 0.67 0.74 0.00 0.00 0.00 179.25 180.26 1vg3 h PHE 117 N -0.42 0.55 -0.12 0.00 0.05 -0.90 -0.40 116.94 115.71 1vg3 h PHE 117 Ca -0.02 0.02 -0.01 0.00 3.82 0.00 0.00 57.97 61.78 1vg3 h PHE 117 Cb 0.14 -0.16 -0.01 0.00 2.00 0.00 0.00 35.95 37.92 1vg3 h PHE 117 CO 0.05 0.07 0.04 1.25 -0.18 0.00 0.00 178.31 179.54 1vg3 h HIS 118 N 0.35 0.19 -0.07 -0.55 2.76 -0.40 -1.77 115.15 115.65 1vg3 h HIS 118 Ca 0.56 -0.02 0.02 0.00 -2.20 0.00 0.00 60.37 58.73 1vg3 h HIS 118 Cb 1.52 -0.06 -0.02 0.00 1.55 0.00 0.00 27.41 30.41 1vg3 h HIS 118 CO -0.00 0.32 -0.03 1.15 -1.30 0.00 0.00 177.93 178.07 1vg3 h THR 119 N 0.01 0.90 -0.31 6.26 2.02 -0.55 -1.13 112.91 120.10 1vg3 h THR 119 Ca 0.04 0.00 0.07 0.00 0.77 0.00 0.00 66.41 67.28 1vg3 h THR 119 Cb 0.22 0.90 -0.02 0.00 -1.74 0.00 0.00 68.15 67.51 1vg3 h THR 119 CO -0.00 0.00 0.22 0.58 0.37 0.00 0.00 175.52 176.69 1vg3 h VAL 120 N -0.02 0.91 -0.30 3.16 2.07 -1.34 -0.69 116.25 120.04 1vg3 h VAL 120 Ca 0.04 -0.05 -0.09 0.00 0.82 0.00 0.00 66.70 67.42 1vg3 h VAL 120 Cb 0.07 0.77 -0.01 0.00 -1.52 0.00 0.00 31.29 30.60 1vg3 h VAL 120 CO -0.09 0.02 -0.18 -0.08 0.02 0.00 0.00 177.57 177.27 1vg3 h GLU 121 N 0.13 0.65 -0.25 1.57 4.57 -0.34 -2.82 114.58 118.09 1vg3 h GLU 121 Ca 0.14 -0.30 0.00 0.00 -1.18 0.00 0.00 59.36 58.02 1vg3 h GLU 121 Cb 0.40 -0.01 0.00 0.00 -0.16 0.00 0.00 28.75 28.98 1vg3 h GLU 121 CO -0.02 0.89 0.00 0.39 -1.18 0.00 0.00 179.01 179.09 1vg3 n GLU 122 N -4.36 0.82 -0.02 1.92 -0.58 -0.29 -1.94 120.64 116.19 1vg3 n GLU 122 Ca -0.03 0.00 0.04 0.00 -0.42 0.00 0.00 57.16 56.75 1vg3 n GLU 122 Cb 0.40 -1.13 -0.11 0.00 -0.57 0.00 0.00 31.44 30.03 1vg3 n GLU 122 CO 0.00 0.00 0.00 -0.89 -0.48 0.00 0.00 177.13 175.76 1vg3 n ILE 123 N -0.32 0.19 -3.30 -3.67 5.41 -1.07 -5.05 119.36 111.55 1vg3 n ILE 123 Ca 0.00 -0.37 -0.10 0.00 1.00 0.00 0.00 62.75 63.28 1vg3 n ILE 123 Cb 0.06 -0.00 0.01 0.00 -0.71 0.00 0.00 39.64 39.00 1vg3 n ILE 123 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1vg3 n GLY 124 N 1.81 -1.23 2.52 7.39 0.00 -0.82 -5.01 105.19 109.86 1vg3 n GLY 124 Ca -0.07 0.51 -0.26 0.00 0.00 0.00 0.00 46.02 46.21 1vg3 n GLY 124 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1vg3 s ASN 125 N -3.06 2.24 0.18 1.61 3.84 -1.26 -5.04 114.94 113.45 1vg3 s ASN 125 Ca 0.07 -2.17 -0.27 0.00 0.21 0.00 0.00 52.86 50.70 1vg3 s ASN 125 Cb -0.02 -0.14 0.01 0.00 -0.55 0.00 0.00 41.25 40.55 1vg3 s ASN 125 CO 0.79 -0.27 1.53 0.59 -2.79 0.00 0.00 177.10 176.95 1vg3 n ASN 126 N 3.89 -0.95 0.30 -4.21 4.13 -1.26 0.12 115.26 117.28 1vg3 n ASN 126 Ca 0.15 1.76 0.20 0.00 1.68 0.00 0.00 54.58 58.37 1vg3 n ASN 126 Cb 0.41 -0.27 1.07 0.00 -1.54 0.00 0.00 39.78 39.45 1vg3 n ASN 126 CO 0.00 0.00 0.00 0.11 0.28 0.00 0.00 177.26 177.65 1vg3 h LYS 127 N 0.00 0.00 0.07 3.52 1.57 -1.96 -2.43 116.57 117.34 1vg3 h LYS 127 Ca 0.21 0.00 -0.17 0.00 -1.87 0.00 0.00 60.65 58.82 1vg3 h LYS 127 Cb 0.46 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.76 1vg3 h LYS 127 CO -0.95 0.00 -0.83 1.25 -0.57 0.00 0.00 179.45 178.35 1vg3 h LEU 128 N 0.00 0.23 0.20 2.94 5.85 0.55 -3.31 115.31 121.77 1vg3 h LEU 128 Ca 0.00 -0.86 0.01 0.00 0.84 0.00 0.00 57.88 57.86 1vg3 h LEU 128 Cb 0.00 -0.08 -0.04 0.00 0.37 0.00 0.00 40.66 40.92 1vg3 h LEU 128 CO 0.00 1.36 -0.51 0.03 -0.34 0.00 0.00 178.44 178.98 1vg3 h ARG 129 N -0.64 -0.77 -0.16 1.25 3.08 -0.68 -0.92 114.38 115.54 1vg3 h ARG 129 Ca -0.18 0.05 0.05 0.00 0.07 0.00 0.00 59.98 59.97 1vg3 h ARG 129 Cb 1.44 0.17 -0.01 0.00 0.08 0.00 0.00 29.97 31.65 1vg3 h ARG 129 CO 0.02 -0.51 0.68 0.00 -1.07 0.00 0.00 179.97 179.09 1vg3 h ARG 130 N -0.80 0.00 0.00 0.04 3.08 -1.68 0.13 114.38 115.15 1vg3 h ARG 130 Ca -0.01 0.00 -0.10 0.00 0.07 0.00 0.00 59.98 59.94 1vg3 h ARG 130 Cb 0.78 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.81 1vg3 h ARG 130 CO -0.23 0.00 -0.81 0.00 -1.07 0.00 0.00 179.97 177.85 1vg3 h ALA 131 N 0.80 0.11 -0.30 0.04 0.00 -1.30 -2.30 119.26 116.33 1vg3 h ALA 131 Ca 0.08 -0.80 0.09 0.00 0.00 0.00 0.00 54.91 54.28 1vg3 h ALA 131 Cb 1.43 0.59 -0.01 0.00 0.00 0.00 0.00 17.79 19.80 1vg3 h ALA 131 CO -0.00 0.57 0.33 0.35 0.00 0.00 0.00 179.25 180.50 1vg3 h PHE 132 N -1.00 0.00 0.00 0.00 3.57 -0.33 0.78 116.94 119.97 1vg3 h PHE 132 Ca -0.15 0.00 -0.04 0.00 3.53 0.00 0.00 57.97 61.31 1vg3 h PHE 132 Cb 0.84 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.58 1vg3 h PHE 132 CO -0.07 0.00 -0.24 1.25 -2.23 0.00 0.00 178.31 177.02 1vg3 h LEU 133 N 0.00 0.00 -2.54 0.59 5.85 -0.93 -3.11 115.31 115.18 1vg3 h LEU 133 Ca 0.14 -0.61 0.01 0.00 0.84 0.00 0.00 57.88 58.26 1vg3 h LEU 133 Cb 0.80 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.82 1vg3 h LEU 133 CO -0.00 0.94 0.12 -1.13 -0.34 0.00 0.00 178.44 178.03 1vg3 h ASN 134 N -1.00 0.00 0.06 1.25 -1.24 -0.67 -2.00 115.58 111.98 1vg3 h ASN 134 Ca -0.06 0.00 -0.00 0.00 0.71 0.00 0.00 56.30 56.95 1vg3 h ASN 134 Cb 0.77 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.83 1vg3 h ASN 134 CO -0.03 0.00 -0.03 0.58 -1.29 0.00 0.00 177.43 176.66 1vg3 h VAL 135 N 0.00 0.42 0.00 2.57 2.07 -0.99 -2.83 116.25 117.48 1vg3 h VAL 135 Ca 0.02 -1.22 0.00 0.00 0.82 0.00 0.00 66.70 66.32 1vg3 h VAL 135 Cb 0.26 0.77 0.00 0.00 -1.52 0.00 0.00 31.29 30.80 1vg3 h VAL 135 CO -0.00 0.13 0.08 -0.38 0.02 0.00 0.00 177.57 177.42 1vg3 n ILE 136 N -4.80 1.41 0.03 4.57 5.41 -0.96 -0.69 119.36 124.33 1vg3 n ILE 136 Ca -0.03 0.60 -0.22 0.00 1.00 0.00 0.00 62.75 64.09 1vg3 n ILE 136 Cb 0.14 -1.60 -0.14 0.00 -0.71 0.00 0.00 39.64 37.33 1vg3 n ILE 136 CO 0.00 0.00 0.00 1.23 0.00 0.00 0.00 176.55 177.78 1vg3 h GLY 137 N 0.00 0.34 2.00 7.39 0.00 -1.41 -3.08 103.07 108.32 1vg3 h GLY 137 Ca 0.00 -0.88 -0.11 0.00 0.00 0.00 0.00 47.33 46.35 1vg3 h GLY 137 CO 0.00 0.77 -0.50 0.50 0.00 0.00 0.00 176.54 177.31 1vg3 h LYS 138 N -0.05 0.00 -0.10 4.80 1.57 -0.65 -2.09 116.57 120.04 1vg3 h LYS 138 Ca -0.36 0.00 -0.07 0.00 -1.87 0.00 0.00 60.65 58.35 1vg3 h LYS 138 Cb 1.96 0.00 0.00 0.00 0.08 0.00 0.00 32.23 34.27 1vg3 h LYS 138 CO 0.10 0.50 -0.22 0.52 -0.57 0.00 0.00 179.45 179.78 1vg3 h MET 139 N 0.00 0.32 0.00 3.15 2.86 -0.87 -2.76 114.93 117.64 1vg3 h MET 139 Ca -0.01 -0.22 -0.04 0.00 -2.06 0.00 0.00 59.70 57.37 1vg3 h MET 139 Cb 1.03 0.03 -0.01 0.00 0.06 0.00 0.00 31.60 32.71 1vg3 h MET 139 CO 0.07 0.82 -0.21 0.77 1.06 0.00 0.00 176.91 179.42 1vg3 h SER 140 N -0.13 0.00 0.05 1.22 0.02 -1.52 -2.31 113.55 110.88 1vg3 h SER 140 Ca -0.00 0.00 -0.25 0.00 -0.84 0.00 0.00 61.79 60.70 1vg3 h SER 140 Cb 0.82 0.00 0.02 0.00 0.14 0.00 0.00 62.40 63.38 1vg3 h SER 140 CO 0.05 0.21 -1.01 -0.08 -1.14 0.00 0.00 176.83 174.86 1vg3 h GLU 141 N 0.00 0.60 0.13 3.45 4.81 -1.41 -3.05 114.58 119.10 1vg3 h GLU 141 Ca -0.00 -0.71 -0.01 0.00 -0.13 0.00 0.00 59.36 58.51 1vg3 h GLU 141 Cb 0.82 0.22 0.00 0.00 0.63 0.00 0.00 28.75 30.42 1vg3 h GLU 141 CO 0.03 1.30 -0.06 0.00 -0.73 0.00 0.00 179.01 179.54 1vg3 h ALA 142 N 0.33 -0.17 -1.04 2.92 0.00 -1.44 0.39 119.26 120.24 1vg3 h ALA 142 Ca -0.14 -0.15 0.28 0.00 0.00 0.00 0.00 54.91 54.90 1vg3 h ALA 142 Cb 1.69 0.07 -0.07 0.00 0.00 0.00 0.00 17.79 19.48 1vg3 h ALA 142 CO 0.20 -0.46 0.71 1.49 0.00 0.00 0.00 179.25 181.18 1vg3 h GLU 143 N -0.44 0.19 0.02 0.00 4.57 -1.51 0.63 114.58 118.04 1vg3 h GLU 143 Ca -0.02 -0.01 -0.00 0.00 -1.18 0.00 0.00 59.36 58.15 1vg3 h GLU 143 Cb 0.35 -0.04 0.00 0.00 -0.16 0.00 0.00 28.75 28.90 1vg3 h GLU 143 CO 0.03 0.13 -0.01 1.25 -1.18 0.00 0.00 179.01 179.23 1vg3 h LEU 144 N 0.20 -0.02 -2.49 1.64 5.85 -1.36 -2.88 115.31 116.24 1vg3 h LEU 144 Ca 0.54 -0.55 0.01 0.00 0.84 0.00 0.00 57.88 58.72 1vg3 h LEU 144 Cb 1.74 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.77 1vg3 h LEU 144 CO -0.14 0.74 0.06 0.40 -0.34 0.00 0.00 178.44 179.17 1vg3 h ILE 145 N -0.98 0.39 -0.03 4.05 2.04 0.14 0.56 117.51 123.68 1vg3 h ILE 145 Ca -0.00 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.83 1vg3 h ILE 145 Cb 0.57 0.95 0.00 0.00 -0.74 0.00 0.00 36.82 37.60 1vg3 h ILE 145 CO 0.00 0.00 -0.07 -0.08 0.00 0.00 0.00 178.15 178.00 1vg3 h GLU 146 N 0.00 0.10 -0.14 2.37 4.81 0.17 -3.14 114.58 118.75 1vg3 h GLU 146 Ca 0.02 -0.07 -0.06 0.00 -0.13 0.00 0.00 59.36 59.12 1vg3 h GLU 146 Cb 0.15 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.53 1vg3 h GLU 146 CO -0.00 0.68 -0.19 1.96 -0.73 0.00 0.00 179.01 180.73 1vg3 h GLN 147 N -0.47 0.23 0.00 1.92 1.08 -0.95 -1.07 115.11 115.85 1vg3 h GLN 147 Ca -0.00 -0.06 0.00 0.00 -1.45 0.00 0.00 58.65 57.14 1vg3 h GLN 147 Cb 0.68 -0.03 0.00 0.00 -0.05 0.00 0.00 27.48 28.09 1vg3 h GLN 147 CO 0.02 0.42 0.00 1.28 -0.95 0.00 0.00 178.83 179.59 1vg3 n LEU 148 N -4.22 0.00 -0.60 1.46 4.77 0.05 -2.83 117.00 115.63 1vg3 n LEU 148 Ca -0.01 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.97 1vg3 n LEU 148 Cb 0.31 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.40 1vg3 n LEU 148 CO 0.39 0.00 0.23 -1.20 -1.33 0.00 0.00 177.39 175.48 1vg3 n SER 149 N -0.56 0.08 0.15 -1.43 7.64 -0.44 -4.88 113.62 114.19 1vg3 n SER 149 Ca 0.02 -1.88 0.13 0.00 1.01 0.00 0.00 58.87 58.15 1vg3 n SER 149 Cb 0.01 -0.18 0.46 0.00 -1.01 0.00 0.00 64.21 63.49 1vg3 n SER 149 CO 0.00 0.00 0.00 0.08 -3.01 0.00 0.00 175.04 172.11 1vg3 h ARG 150 N 0.10 0.00 -0.03 1.43 0.11 -1.30 -3.15 114.38 111.54 1vg3 h ARG 150 Ca -0.03 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.05 1vg3 h ARG 150 Cb 1.40 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.48 1vg3 h ARG 150 CO 0.01 0.00 0.00 0.66 0.10 0.00 0.00 179.97 180.74 1vg3 n TYR 151 N -2.47 0.03 -5.22 4.08 0.53 -1.26 -4.20 117.16 108.65 1vg3 n TYR 151 Ca 0.03 -0.20 -0.32 0.00 -1.02 0.00 0.00 57.90 56.39 1vg3 n TYR 151 Cb 0.34 -0.02 -0.17 0.00 -1.03 0.00 0.00 39.34 38.46 1vg3 n TYR 151 CO 0.00 0.00 0.00 0.15 -1.02 0.00 0.00 176.86 175.99 1vg3 s LYS 152 N -0.50 2.98 0.02 -0.72 1.02 -1.19 -5.00 119.74 116.35 1vg3 s LYS 152 Ca 0.03 -0.88 -0.30 0.00 0.02 0.00 0.00 55.97 54.84 1vg3 s LYS 152 Cb 0.02 -2.28 -0.06 0.00 -0.52 0.00 0.00 37.83 34.99 1vg3 s LYS 152 CO 0.03 0.20 1.46 -1.25 -0.92 0.00 0.00 175.35 174.87 1vg3 s PRO 153 N 0.28 4.26 0.38 -1.68 0.04 -1.26 -4.88 135.00 132.14 1vg3 s PRO 153 Ca -0.17 2.06 0.05 0.00 0.04 0.00 0.00 61.00 62.98 1vg3 s PRO 153 Cb -0.17 -3.56 -0.00 0.00 0.04 0.00 0.00 34.50 30.80 1vg3 s PRO 153 CO 0.08 -0.61 0.54 0.96 0.04 0.00 0.00 177.00 178.02 1vg3 s ILE 154 N 2.40 3.91 0.50 0.56 -4.36 -1.26 -5.12 121.20 117.82 1vg3 s ILE 154 Ca 0.66 -0.86 -0.03 0.00 -0.26 0.00 0.00 60.65 60.16 1vg3 s ILE 154 Cb -0.34 -3.38 0.10 0.00 1.25 0.00 0.00 42.46 40.10 1vg3 s ILE 154 CO 0.28 -0.18 0.68 0.35 0.24 0.00 0.00 174.94 176.31 1vg3 n THR 155 N -1.80 0.00 0.08 8.37 -2.24 -1.26 -4.85 114.28 112.58 1vg3 n THR 155 Ca 0.01 -0.85 -0.05 0.00 -2.27 0.00 0.00 64.05 60.89 1vg3 n THR 155 Cb 0.58 -1.27 0.14 0.00 -2.10 0.00 0.00 70.33 67.68 1vg3 n THR 155 CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 1vg3 h LYS 156 N 0.00 0.27 -0.01 -0.78 1.63 -2.00 -2.38 116.57 113.31 1vg3 h LYS 156 Ca -0.22 -0.17 -0.00 0.00 -0.85 0.00 0.00 60.65 59.41 1vg3 h LYS 156 Cb 0.74 0.02 -0.00 0.00 -0.60 0.00 0.00 32.23 32.39 1vg3 h LYS 156 CO 0.21 0.75 -0.01 0.93 -3.45 0.00 0.00 179.45 177.88 1vg3 h GLU 157 N 0.21 0.02 -0.49 1.90 3.07 -2.00 -2.73 114.58 114.55 1vg3 h GLU 157 Ca 0.00 -0.01 0.03 0.00 -0.50 0.00 0.00 59.36 58.88 1vg3 h GLU 157 Cb 1.03 0.00 -0.03 0.00 -0.84 0.00 0.00 28.75 28.91 1vg3 h GLU 157 CO 0.09 0.51 0.33 0.93 -1.40 0.00 0.00 179.01 179.47 1vg3 h GLU 158 N -0.48 0.56 0.66 2.33 5.08 -1.93 -1.88 114.58 118.93 1vg3 h GLU 158 Ca 0.00 -0.03 -0.03 0.00 -1.00 0.00 0.00 59.36 58.30 1vg3 h GLU 158 Cb 0.51 -0.13 0.01 0.00 0.50 0.00 0.00 28.75 29.64 1vg3 h GLU 158 CO 0.00 0.37 -0.32 -0.92 -1.00 0.00 0.00 179.01 177.15 1vg3 h TYR 159 N 0.58 -0.82 -0.07 4.33 3.20 -1.42 -3.15 116.97 119.63 1vg3 h TYR 159 Ca 0.19 -0.02 0.03 0.00 3.14 0.00 0.00 58.73 62.07 1vg3 h TYR 159 Cb 0.06 0.27 -0.06 0.00 1.54 0.00 0.00 36.73 38.54 1vg3 h TYR 159 CO -0.00 -0.51 -0.52 -0.07 -1.64 0.00 0.00 178.16 175.42 1vg3 h LEU 160 N -1.16 -1.62 0.00 2.82 3.38 -1.33 0.67 115.31 118.08 1vg3 h LEU 160 Ca -0.09 0.19 0.00 0.00 0.09 0.00 0.00 57.88 58.07 1vg3 h LEU 160 Cb 0.68 0.63 0.00 0.00 0.09 0.00 0.00 40.66 42.05 1vg3 h LEU 160 CO 0.15 -0.49 0.08 0.54 0.09 0.00 0.00 178.44 178.80 1vg3 n ARG 161 N -5.45 0.00 -0.13 1.13 1.74 -0.72 0.67 116.66 113.90 1vg3 n ARG 161 Ca -0.06 0.22 -0.24 0.00 -0.77 0.00 0.00 57.85 57.00 1vg3 n ARG 161 Cb 0.39 -1.58 -0.10 0.00 -1.02 0.00 0.00 32.46 30.15 1vg3 n ARG 161 CO 0.00 0.00 0.00 -0.89 -1.52 0.00 0.00 177.63 175.22 1vg3 n ILE 162 N -1.17 1.44 -0.08 0.55 5.41 0.10 -4.03 119.36 121.58 1vg3 n ILE 162 Ca 0.00 -0.44 -0.14 0.00 1.00 0.00 0.00 62.75 63.16 1vg3 n ILE 162 Cb 0.08 -1.66 -0.03 0.00 -0.71 0.00 0.00 39.64 37.32 1vg3 n ILE 162 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 176.55 176.18 1vg3 h VAL 163 N -0.55 1.27 0.00 1.39 -1.51 0.56 0.41 116.25 117.82 1vg3 h VAL 163 Ca -0.62 -1.70 -0.01 0.00 -1.23 0.00 0.00 66.70 63.14 1vg3 h VAL 163 Cb 1.70 1.59 -0.00 0.00 -2.13 0.00 0.00 31.29 32.45 1vg3 h VAL 163 CO -0.27 0.56 -0.02 -0.33 -1.23 0.00 0.00 177.57 176.27 1vg3 h GLU 164 N 0.68 0.00 0.00 5.19 5.08 0.01 0.42 114.58 125.96 1vg3 h GLU 164 Ca 0.02 0.00 -0.34 0.00 -1.00 0.00 0.00 59.36 58.04 1vg3 h GLU 164 Cb 1.13 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 30.32 1vg3 h GLU 164 CO 0.12 0.02 -2.30 0.41 -1.00 0.00 0.00 179.01 176.26 1vg3 n GLY 165 N -0.81 -0.47 0.12 -3.84 0.00 -1.06 -1.42 105.19 97.71 1vg3 n GLY 165 Ca -0.02 -0.19 -0.20 0.00 0.00 0.00 0.00 46.02 45.61 1vg3 n GLY 165 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1vg3 h LYS 166 N 0.00 0.38 0.00 1.61 3.64 -0.03 -2.94 116.57 119.23 1vg3 h LYS 166 Ca -0.51 -0.64 -0.11 0.00 -1.27 0.00 0.00 60.65 58.12 1vg3 h LYS 166 Cb 1.89 0.24 -0.02 0.00 -0.41 0.00 0.00 32.23 33.93 1vg3 h LYS 166 CO -0.05 1.30 -1.39 0.45 -2.27 0.00 0.00 179.45 177.49 1vg3 n SER 167 N -3.60 2.52 -0.05 4.20 2.88 0.12 -4.80 113.62 114.90 1vg3 n SER 167 Ca -0.13 0.00 -0.11 0.00 -1.33 0.00 0.00 58.87 57.31 1vg3 n SER 167 Cb 1.06 -0.14 -0.04 0.00 -0.75 0.00 0.00 64.21 64.34 1vg3 n SER 167 CO 0.00 0.00 0.00 1.23 -1.23 0.00 0.00 175.04 175.04 1vg3 h GLY 168 N 0.27 0.29 -0.86 0.46 0.00 -0.89 -3.23 103.07 99.11 1vg3 h GLY 168 Ca -0.16 -0.15 0.18 0.00 0.00 0.00 0.00 47.33 47.19 1vg3 h GLY 168 CO -0.05 0.14 -0.27 0.00 0.00 0.00 0.00 176.54 176.37 1vg3 h ALA 169 N 0.94 0.49 0.00 3.60 0.00 -1.41 0.46 119.26 123.34 1vg3 h ALA 169 Ca 0.06 0.34 -0.03 0.00 0.00 0.00 0.00 54.91 55.28 1vg3 h ALA 169 Cb 0.14 0.77 -0.00 0.00 0.00 0.00 0.00 17.79 18.70 1vg3 h ALA 169 CO -0.01 -0.45 -0.14 1.25 0.00 0.00 0.00 179.25 179.91 1vg3 h LEU 170 N -0.01 0.00 0.00 0.00 5.85 -1.85 -1.79 115.31 117.52 1vg3 h LEU 170 Ca 0.42 0.00 -0.25 0.00 0.84 0.00 0.00 57.88 58.89 1vg3 h LEU 170 Cb 0.66 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 41.65 1vg3 h LEU 170 CO -0.95 0.14 -1.30 -0.26 -0.34 0.00 0.00 178.44 175.73 1vg3 h PHE 171 N 0.00 0.02 -0.07 1.25 0.04 -0.28 -2.10 116.94 115.80 1vg3 h PHE 171 Ca -0.00 -0.01 -0.03 0.00 2.80 0.00 0.00 57.97 60.73 1vg3 h PHE 171 Cb 0.62 -0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.77 1vg3 h PHE 171 CO 0.00 1.01 -0.07 0.78 -0.60 0.00 0.00 178.31 179.43 1vg3 h GLY 172 N 3.15 0.19 1.22 -1.45 0.00 -0.39 -2.31 103.07 103.48 1vg3 h GLY 172 Ca -0.13 -0.19 0.04 0.00 0.00 0.00 0.00 47.33 47.05 1vg3 h GLY 172 CO 0.11 0.18 0.43 -2.00 0.00 0.00 0.00 176.54 175.26 1vg3 h LEU 173 N -0.26 0.66 -0.16 3.11 5.85 -1.42 0.29 115.31 123.38 1vg3 h LEU 173 Ca 0.01 -0.01 0.04 0.00 0.84 0.00 0.00 57.88 58.76 1vg3 h LEU 173 Cb 0.58 -0.15 -0.04 0.00 0.37 0.00 0.00 40.66 41.42 1vg3 h LEU 173 CO 0.02 0.45 -0.09 0.00 -0.34 0.00 0.00 178.44 178.48 1vg3 h ALA 174 N 1.62 0.05 0.01 1.25 0.00 -1.05 -1.41 119.26 119.74 1vg3 h ALA 174 Ca 0.27 0.07 -0.17 0.00 0.00 0.00 0.00 54.91 55.07 1vg3 h ALA 174 Cb 0.10 0.21 0.01 0.00 0.00 0.00 0.00 17.79 18.12 1vg3 h ALA 174 CO -0.08 -0.53 -0.69 -0.07 0.00 0.00 0.00 179.25 177.89 1vg3 h LEU 175 N -0.08 0.58 0.00 0.00 3.38 -0.84 -3.25 115.31 115.10 1vg3 h LEU 175 Ca 0.09 -0.78 0.00 0.00 0.09 0.00 0.00 57.88 57.29 1vg3 h LEU 175 Cb 0.22 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.79 1vg3 h LEU 175 CO -0.22 1.29 0.00 1.67 0.09 0.00 0.00 178.44 181.27 1vg3 n GLN 176 N -4.16 0.08 0.14 1.13 7.27 0.96 -3.90 117.38 118.92 1vg3 n GLN 176 Ca -0.11 0.24 -0.15 0.00 0.07 0.00 0.00 57.00 57.04 1vg3 n GLN 176 Cb 0.72 -1.50 -0.09 0.00 2.41 0.00 0.00 30.24 31.78 1vg3 n GLN 176 CO 0.00 0.00 0.00 -0.07 0.07 0.00 0.00 177.06 177.06 1vg3 h LEU 177 N 0.00 -1.40 -0.93 1.69 3.38 -1.29 -2.17 115.31 114.58 1vg3 h LEU 177 Ca 0.00 0.14 0.10 0.00 0.09 0.00 0.00 57.88 58.21 1vg3 h LEU 177 Cb 0.06 0.50 -0.08 0.00 0.09 0.00 0.00 40.66 41.24 1vg3 h LEU 177 CO 0.00 -0.53 0.57 1.55 0.09 0.00 0.00 178.44 180.12 1vg3 h PRO 178 N -0.75 0.91 -0.13 1.13 0.13 -1.85 -2.47 132.00 128.97 1vg3 h PRO 178 Ca -0.02 -0.05 0.03 0.00 -0.87 0.00 0.00 66.00 65.09 1vg3 h PRO 178 Cb 0.72 -0.21 -0.04 0.00 0.13 0.00 0.00 31.00 31.61 1vg3 h PRO 178 CO -0.21 0.60 -0.09 0.00 -0.23 0.00 0.00 178.00 178.08 1vg3 h ALA 179 N 1.50 0.02 -0.90 -0.56 0.00 -1.74 -2.40 119.26 115.17 1vg3 h ALA 179 Ca 0.45 0.05 0.06 0.00 0.00 0.00 0.00 54.91 55.48 1vg3 h ALA 179 Cb 0.40 0.19 -0.06 0.00 0.00 0.00 0.00 17.79 18.33 1vg3 h ALA 179 CO -0.25 -0.53 0.59 -0.07 0.00 0.00 0.00 179.25 178.98 1vg3 h LEU 180 N -0.09 0.90 -1.28 0.00 3.38 -0.93 0.94 115.31 118.23 1vg3 h LEU 180 Ca 0.08 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.06 1vg3 h LEU 180 Cb 0.21 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 40.77 1vg3 h LEU 180 CO -0.19 0.58 0.00 -0.07 0.09 0.00 0.00 178.44 178.85 1vg3 h LEU 181 N 1.02 0.00 -1.44 1.67 3.38 -1.26 -0.02 115.31 118.67 1vg3 h LEU 181 Ca 0.39 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.36 1vg3 h LEU 181 Cb 0.20 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.95 1vg3 h LEU 181 CO -0.15 0.00 0.00 -0.62 0.09 0.00 0.00 178.44 177.76 1vg3 n GLU 182 N -2.91 1.92 0.00 1.13 -0.58 0.28 -4.87 120.64 115.60 1vg3 n GLU 182 Ca 0.01 -1.41 0.00 0.00 -0.42 0.00 0.00 57.16 55.34 1vg3 n GLU 182 Cb 0.29 -1.36 0.00 0.00 -0.57 0.00 0.00 31.44 29.80 1vg3 n GLU 182 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1vg3 n GLY 183 N 1.18 1.73 3.72 0.62 0.00 -0.02 -4.94 105.19 107.47 1vg3 n GLY 183 Ca 0.15 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.85 1vg3 n GLY 183 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1vg3 s GLU 184 N 0.00 1.78 -0.08 1.61 2.02 -0.91 -4.91 118.70 118.21 1vg3 s GLU 184 Ca 0.00 1.53 -0.22 0.00 0.02 0.00 0.00 54.97 56.30 1vg3 s GLU 184 Cb 0.00 -1.81 -0.18 0.00 0.10 0.00 0.00 34.13 32.23 1vg3 s GLU 184 CO 0.00 -2.06 0.80 -0.07 0.02 0.00 0.00 175.26 173.95 1vg3 h LEU 185 N -1.05 -0.07 -1.75 1.80 4.07 -1.92 -3.30 115.31 113.08 1vg3 h LEU 185 Ca -0.45 -0.56 -0.46 0.00 0.08 0.00 0.00 57.88 56.49 1vg3 h LEU 185 Cb 1.27 0.02 -0.01 0.00 1.08 0.00 0.00 40.66 43.02 1vg3 h LEU 185 CO 0.47 0.62 -0.85 0.61 -1.08 0.00 0.00 178.44 178.21 1vg3 n GLY 186 N 1.03 -0.28 0.00 0.83 0.00 -1.26 -4.69 105.19 100.82 1vg3 n GLY 186 Ca -0.08 0.14 0.08 0.00 0.00 0.00 0.00 46.02 46.16 1vg3 n GLY 186 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1vg3 n GLU 187 N -4.36 0.09 -0.06 1.61 4.71 -1.26 -2.97 120.64 118.39 1vg3 n GLU 187 Ca -0.27 0.19 -0.14 0.00 -0.01 0.00 0.00 57.16 56.92 1vg3 n GLU 187 Cb 0.66 -1.50 -0.13 0.00 -1.01 0.00 0.00 31.44 29.46 1vg3 n GLU 187 CO 0.00 0.00 0.00 -0.44 0.09 0.00 0.00 177.13 176.78 1vg3 h ASP 188 N 0.00 0.04 -0.32 1.62 3.45 -2.00 -2.96 116.42 116.25 1vg3 h ASP 188 Ca 0.00 -0.98 0.06 0.00 0.43 0.00 0.00 57.03 56.54 1vg3 h ASP 188 Cb 0.24 -0.01 -0.05 0.00 -0.56 0.00 0.00 39.33 38.94 1vg3 h ASP 188 CO 0.00 1.01 -0.00 -0.07 -1.57 0.00 0.00 179.24 178.61 1vg3 h LEU 189 N -0.93 -0.13 -0.39 1.55 3.38 -1.90 -1.39 115.31 115.48 1vg3 h LEU 189 Ca -0.01 0.07 0.08 0.00 0.09 0.00 0.00 57.88 58.11 1vg3 h LEU 189 Cb 1.03 0.13 -0.09 0.00 0.09 0.00 0.00 40.66 41.82 1vg3 h LEU 189 CO 0.01 -0.03 -0.27 0.22 0.09 0.00 0.00 178.44 178.46 1vg3 h TYR 190 N 0.09 -0.73 0.00 1.13 3.20 -1.66 0.24 116.97 119.23 1vg3 h TYR 190 Ca 0.15 0.05 -0.03 0.00 3.14 0.00 0.00 58.73 62.05 1vg3 h TYR 190 Cb 0.21 0.38 -0.00 0.00 1.54 0.00 0.00 36.73 38.86 1vg3 h TYR 190 CO -0.23 -0.34 -0.12 -0.91 -1.64 0.00 0.00 178.16 174.91 1vg3 h ASN 191 N -0.21 0.00 0.13 -2.11 -0.26 -1.25 0.47 115.58 112.35 1vg3 h ASN 191 Ca 0.18 0.00 -0.26 0.00 -0.56 0.00 0.00 56.30 55.67 1vg3 h ASN 191 Cb 0.50 0.00 0.02 0.00 -1.06 0.00 0.00 38.32 37.78 1vg3 h ASN 191 CO -0.51 0.12 -1.02 0.25 -1.06 0.00 0.00 177.43 175.20 1vg3 h LEU 192 N 0.00 0.78 -0.67 1.61 5.85 0.05 -2.19 115.31 120.74 1vg3 h LEU 192 Ca -0.00 -0.63 -0.10 0.00 0.84 0.00 0.00 57.88 57.99 1vg3 h LEU 192 Cb 0.25 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 41.02 1vg3 h LEU 192 CO 0.02 1.43 -0.06 1.23 -0.34 0.00 0.00 178.44 180.72 1vg3 h GLY 193 N 0.69 1.05 1.44 3.75 0.00 0.48 0.25 103.07 110.73 1vg3 h GLY 193 Ca -0.12 -0.79 -0.01 0.00 0.00 0.00 0.00 47.33 46.42 1vg3 h GLY 193 CO 0.19 0.73 0.32 -2.08 0.00 0.00 0.00 176.54 175.70 1vg3 h VAL 194 N 0.88 1.16 -0.02 4.60 2.07 -0.04 0.30 116.25 125.20 1vg3 h VAL 194 Ca 0.15 -0.37 -0.16 0.00 0.82 0.00 0.00 66.70 67.13 1vg3 h VAL 194 Cb 0.59 0.40 0.01 0.00 -1.52 0.00 0.00 31.29 30.78 1vg3 h VAL 194 CO 0.04 0.17 -0.63 0.74 0.02 0.00 0.00 177.57 177.91 1vg3 h THR 195 N 0.75 1.40 -0.66 2.57 2.02 -0.73 -2.41 112.91 115.86 1vg3 h THR 195 Ca 0.20 -2.04 -0.01 0.00 0.77 0.00 0.00 66.41 65.32 1vg3 h THR 195 Cb -0.01 2.48 -0.03 0.00 -1.74 0.00 0.00 68.15 68.85 1vg3 h THR 195 CO -0.04 0.60 0.36 0.40 0.37 0.00 0.00 175.52 177.21 1vg3 h ILE 196 N -0.00 1.20 -0.30 3.11 2.04 -0.00 -0.52 117.51 123.03 1vg3 h ILE 196 Ca -0.07 -0.50 -0.10 0.00 1.00 0.00 0.00 64.86 65.19 1vg3 h ILE 196 Cb 1.32 0.32 -0.01 0.00 -0.74 0.00 0.00 36.82 37.70 1vg3 h ILE 196 CO 0.12 0.22 -0.25 1.23 0.00 0.00 0.00 178.15 179.48 1vg3 h GLY 197 N 0.97 0.64 0.71 5.37 0.00 -0.41 -1.95 103.07 108.40 1vg3 h GLY 197 Ca 0.23 -0.54 -0.02 0.00 0.00 0.00 0.00 47.33 47.01 1vg3 h GLY 197 CO -0.04 0.49 -0.02 -0.84 0.00 0.00 0.00 176.54 176.13 1vg3 h THR 198 N 0.52 1.29 -0.32 4.70 2.02 -0.77 -2.34 112.91 118.01 1vg3 h THR 198 Ca 0.07 -0.93 0.06 0.00 0.77 0.00 0.00 66.41 66.38 1vg3 h THR 198 Cb 0.70 1.73 -0.05 0.00 -1.74 0.00 0.00 68.15 68.79 1vg3 h THR 198 CO 0.05 0.26 0.00 0.40 0.37 0.00 0.00 175.52 176.61 1vg3 h ILE 199 N -0.15 0.77 -0.53 3.11 2.04 -1.05 0.10 117.51 121.80 1vg3 h ILE 199 Ca 0.02 -0.03 0.06 0.00 1.00 0.00 0.00 64.86 65.91 1vg3 h ILE 199 Cb 0.42 0.67 -0.03 0.00 -0.74 0.00 0.00 36.82 37.14 1vg3 h ILE 199 CO 0.01 0.02 0.35 0.22 0.00 0.00 0.00 178.15 178.75 1vg3 h TYR 200 N 0.09 0.49 0.03 1.37 5.03 -1.31 0.93 116.97 123.61 1vg3 h TYR 200 Ca 0.15 0.01 -0.19 0.00 2.58 0.00 0.00 58.73 61.29 1vg3 h TYR 200 Cb 0.21 -0.16 0.02 0.00 1.55 0.00 0.00 36.73 38.34 1vg3 h TYR 200 CO -0.23 0.27 -0.75 0.37 -1.32 0.00 0.00 178.16 176.50 1vg3 h GLN 201 N 0.49 0.46 -0.27 1.82 5.75 -0.73 -1.95 115.11 120.68 1vg3 h GLN 201 Ca 0.23 -0.53 -0.04 0.00 -0.15 0.00 0.00 58.65 58.16 1vg3 h GLN 201 Cb 0.27 0.16 -0.02 0.00 1.07 0.00 0.00 27.48 28.96 1vg3 h GLN 201 CO -0.06 1.18 0.01 0.52 -2.65 0.00 0.00 178.83 177.82 1vg3 h MET 202 N -0.04 0.40 -0.23 1.69 2.86 -0.50 0.55 114.93 119.66 1vg3 h MET 202 Ca -0.10 -0.07 -0.05 0.00 -2.06 0.00 0.00 59.70 57.41 1vg3 h MET 202 Cb 1.46 -0.07 -0.01 0.00 0.06 0.00 0.00 31.60 33.05 1vg3 h MET 202 CO 0.15 0.42 -0.06 0.35 1.06 0.00 0.00 176.91 178.83 1vg3 h PHE 203 N 0.39 0.51 -0.15 -0.22 3.57 -0.81 -2.56 116.94 117.67 1vg3 h PHE 203 Ca 0.09 -0.11 -0.11 0.00 3.53 0.00 0.00 57.97 61.37 1vg3 h PHE 203 Cb 0.25 -0.12 -0.01 0.00 2.79 0.00 0.00 35.95 38.86 1vg3 h PHE 203 CO 0.01 0.69 -0.39 0.22 -2.23 0.00 0.00 178.31 176.60 1vg3 h ASP 204 N 0.19 0.34 -0.74 0.41 3.58 -0.57 -1.86 116.42 117.77 1vg3 h ASP 204 Ca 0.06 -0.14 -0.05 0.00 0.42 0.00 0.00 57.03 57.31 1vg3 h ASP 204 Cb 0.53 -0.10 -0.03 0.00 1.72 0.00 0.00 39.33 41.45 1vg3 h ASP 204 CO 0.02 0.71 0.25 0.44 -2.88 0.00 0.00 179.24 177.78 1vg3 h ASP 205 N 0.28 1.06 0.01 2.28 3.45 0.21 -0.33 116.42 123.37 1vg3 h ASP 205 Ca 0.03 -0.19 -0.22 0.00 0.43 0.00 0.00 57.03 57.08 1vg3 h ASP 205 Cb 0.82 -0.28 0.01 0.00 -0.56 0.00 0.00 39.33 39.32 1vg3 h ASP 205 CO 0.06 0.97 -0.80 0.40 -1.57 0.00 0.00 179.24 178.30 1vg3 h ILE 206 N 1.10 1.31 -0.75 0.35 2.04 -1.28 -1.20 117.51 119.07 1vg3 h ILE 206 Ca 0.24 -2.08 -0.06 0.00 1.00 0.00 0.00 64.86 63.96 1vg3 h ILE 206 Cb 0.27 2.08 -0.03 0.00 -0.74 0.00 0.00 36.82 38.41 1vg3 h ILE 206 CO -0.01 0.65 0.24 0.24 0.00 0.00 0.00 178.15 179.26 1vg3 h MET 207 N 0.43 1.17 -0.03 2.37 2.86 -1.14 0.87 114.93 121.47 1vg3 h MET 207 Ca -0.06 -0.25 -0.15 0.00 -2.06 0.00 0.00 59.70 57.18 1vg3 h MET 207 Cb 1.42 -0.17 -0.02 0.00 0.06 0.00 0.00 31.60 32.89 1vg3 h MET 207 CO 0.16 0.99 -0.67 0.22 1.06 0.00 0.00 176.91 178.67 1vg3 h ASP 208 N 1.12 0.15 0.26 1.22 3.58 -1.02 -2.19 116.42 119.55 1vg3 h ASP 208 Ca 0.24 -0.10 -0.01 0.00 0.42 0.00 0.00 57.03 57.58 1vg3 h ASP 208 Cb 0.31 -0.04 0.00 0.00 1.72 0.00 0.00 39.33 41.31 1vg3 h ASP 208 CO -0.01 0.77 -0.13 0.15 -2.88 0.00 0.00 179.24 177.15 1vg3 h PHE 209 N 0.09 -0.33 -0.14 0.28 3.57 -0.83 -2.85 116.94 116.73 1vg3 h PHE 209 Ca -0.01 -0.01 0.04 0.00 3.53 0.00 0.00 57.97 61.52 1vg3 h PHE 209 Cb 1.19 0.11 -0.01 0.00 2.79 0.00 0.00 35.95 40.03 1vg3 h PHE 209 CO 0.01 -0.20 0.22 0.00 -2.23 0.00 0.00 178.31 176.11 1vg3 h ALA 210 N -1.14 1.62 0.00 2.41 0.00 -0.95 -0.05 119.26 121.15 1vg3 h ALA 210 Ca -0.04 -0.00 -0.05 0.00 0.00 0.00 0.00 54.91 54.81 1vg3 h ALA 210 Cb 0.27 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 1vg3 h ALA 210 CO 0.06 -0.29 -0.49 0.78 0.00 0.00 0.00 179.25 179.31 1vg3 h GLY 211 N 0.00 0.00 -2.45 0.00 0.00 -1.43 -3.48 103.07 95.71 1vg3 h GLY 211 Ca 0.07 0.00 -0.33 0.00 0.00 0.00 0.00 47.33 47.07 1vg3 h GLY 211 CO -0.00 0.00 -0.18 1.03 0.00 0.00 0.00 176.54 177.38 1vg3 n MET 212 N -3.05 0.00 -0.00 4.80 2.00 -0.03 -4.94 117.12 115.89 1vg3 n MET 212 Ca 0.01 0.00 -0.02 0.00 0.00 0.00 0.00 57.70 57.70 1vg3 n MET 212 Cb 0.64 -0.52 -0.01 0.00 0.00 0.00 0.00 33.22 33.33 1vg3 n MET 212 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 175.97 176.36 1vg3 n GLU 213 N 0.52 0.09 -1.39 0.03 -0.58 -1.26 -5.10 120.64 112.96 1vg3 n GLU 213 Ca 0.09 0.04 0.00 0.00 -0.42 0.00 0.00 57.16 56.86 1vg3 n GLU 213 Cb 0.10 -0.49 0.00 0.00 -0.57 0.00 0.00 31.44 30.48 1vg3 n GLU 213 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 1vg3 n LYS 214 N -3.05 2.05 -3.16 3.49 5.02 -1.26 -5.13 118.16 116.12 1vg3 n LYS 214 Ca -0.02 0.00 -0.33 0.00 -2.02 0.00 0.00 58.31 55.94 1vg3 n LYS 214 Cb 0.09 0.00 -0.06 0.00 -0.02 0.00 0.00 35.03 35.04 1vg3 n LYS 214 CO 0.00 0.00 0.00 -1.50 -0.52 0.00 0.00 177.40 175.38 1vg3 s ILE 215 N -0.67 4.68 0.06 -0.18 1.10 -1.26 -4.08 121.20 120.86 1vg3 s ILE 215 Ca 0.00 0.96 -0.31 0.00 -0.51 0.00 0.00 60.65 60.79 1vg3 s ILE 215 Cb 0.00 -3.64 -0.06 0.00 0.15 0.00 0.00 42.46 38.90 1vg3 s ILE 215 CO 0.00 -0.12 1.29 -0.83 -2.11 0.00 0.00 174.94 173.17 1vg3 s GLY 216 N -2.19 2.18 0.44 1.50 0.00 0.10 -4.80 107.32 104.55 1vg3 s GLY 216 Ca 0.52 0.93 0.19 0.00 0.00 0.00 0.00 44.72 46.36 1vg3 s GLY 216 CO 0.18 2.21 1.53 0.50 0.00 0.00 0.00 173.10 177.52 1vg3 h LYS 217 N 6.97 0.00 0.00 2.90 1.57 -1.95 0.16 116.57 126.23 1vg3 h LYS 217 Ca -0.41 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.37 1vg3 h LYS 217 Cb 1.20 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.51 1vg3 h LYS 217 CO 0.84 0.00 -0.51 -0.40 -0.57 0.00 0.00 179.45 178.81 1vg3 n ASP 218 N -2.36 0.72 0.00 0.86 5.75 -1.26 -4.94 116.55 115.32 1vg3 n ASP 218 Ca -0.01 0.20 0.00 0.00 -0.01 0.00 0.00 54.79 54.96 1vg3 n ASP 218 Cb 0.33 -0.01 0.00 0.00 -1.03 0.00 0.00 41.12 40.41 1vg3 n ASP 218 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1vg3 n GLY 219 N 1.33 0.94 1.15 6.12 0.00 0.57 -5.11 105.19 110.19 1vg3 n GLY 219 Ca 0.04 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.96 1vg3 n GLY 219 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1vg3 n PHE 220 N -0.34 0.29 -1.97 1.61 3.01 -1.24 -4.94 117.46 113.88 1vg3 n PHE 220 Ca 0.00 -0.82 -0.34 0.00 1.01 0.00 0.00 57.45 57.30 1vg3 n PHE 220 Cb 0.00 -0.08 0.03 0.00 -0.01 0.00 0.00 39.48 39.42 1vg3 n PHE 220 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 1vg3 s LEU 221 N 0.00 3.56 -1.20 4.37 1.43 -1.26 0.00 118.68 125.57 1vg3 s LEU 221 Ca 0.02 2.12 -0.18 0.00 -1.03 0.00 0.00 54.13 55.05 1vg3 s LEU 221 Cb 0.00 -4.57 0.09 0.00 0.03 0.00 0.00 46.19 41.74 1vg3 s LEU 221 CO 0.01 -1.49 1.59 -0.62 0.23 0.00 0.00 176.35 176.08 1vg3 s ASP 222 N -2.14 6.80 -0.26 2.29 2.15 -1.26 -4.46 116.67 119.80 1vg3 s ASP 222 Ca 0.70 -2.32 -0.01 0.00 0.43 0.00 0.00 52.55 51.35 1vg3 s ASP 222 Cb -0.23 -2.54 0.08 0.00 -0.30 0.00 0.00 42.92 39.93 1vg3 s ASP 222 CO 0.35 -1.16 0.04 -0.76 -0.17 0.00 0.00 175.17 173.48 1vg3 s LEU 223 N 3.81 2.05 0.51 -1.34 1.43 -1.26 -4.78 118.68 119.10 1vg3 s LEU 223 Ca 0.49 -1.29 0.44 0.00 -1.03 0.00 0.00 54.13 52.74 1vg3 s LEU 223 Cb 0.01 -0.87 1.65 0.00 0.03 0.00 0.00 46.19 47.02 1vg3 s LEU 223 CO 0.02 -0.34 1.57 2.29 0.23 0.00 0.00 176.35 180.12 1vg3 n LYS 224 N 4.86 -0.01 -0.42 1.70 2.85 -1.26 0.63 118.16 126.50 1vg3 n LYS 224 Ca -0.06 1.16 0.08 0.00 -1.05 0.00 0.00 58.31 58.44 1vg3 n LYS 224 Cb 0.44 -2.51 0.27 0.00 -0.65 0.00 0.00 35.03 32.58 1vg3 n LYS 224 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 1vg3 n ASN 225 N -4.25 3.94 0.00 -5.58 3.02 -1.26 -5.07 115.26 106.07 1vg3 n ASN 225 Ca 0.43 -2.35 0.00 0.00 -0.03 0.00 0.00 54.58 52.63 1vg3 n ASN 225 Cb 1.86 -0.45 0.00 0.00 -0.61 0.00 0.00 39.78 40.58 1vg3 n ASN 225 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1vg3 n GLY 226 N 0.71 2.52 0.17 7.41 0.00 0.20 -2.58 105.19 113.64 1vg3 n GLY 226 Ca 0.20 -0.31 0.14 0.00 0.00 0.00 0.00 46.02 46.05 1vg3 n GLY 226 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1vg3 h VAL 227 N 0.00 0.00 0.00 1.61 2.07 -1.81 -3.35 116.25 114.76 1vg3 h VAL 227 Ca 0.00 -0.46 -0.43 0.00 0.82 0.00 0.00 66.70 66.62 1vg3 h VAL 227 Cb 0.00 1.36 0.02 0.00 -1.52 0.00 0.00 31.29 31.15 1vg3 h VAL 227 CO 0.00 0.00 2.79 0.00 0.02 0.00 0.00 177.57 180.38 1vg3 n ALA 228 N -1.90 5.08 -3.79 1.67 0.00 -1.07 -4.46 120.51 116.05 1vg3 n ALA 228 Ca 0.03 -2.29 -0.31 0.00 0.00 0.00 0.00 53.44 50.87 1vg3 n ALA 228 Cb 0.34 -3.08 -0.16 0.00 0.00 0.00 0.00 19.45 16.54 1vg3 n ALA 228 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1vg3 s SER 229 N 3.29 2.80 0.16 0.00 0.15 -1.26 -4.84 113.70 114.00 1vg3 s SER 229 Ca 0.45 -0.53 -0.20 0.00 0.70 0.00 0.00 55.95 56.37 1vg3 s SER 229 Cb 0.11 -1.28 0.08 0.00 -1.71 0.00 0.00 66.02 63.23 1vg3 s SER 229 CO -0.03 0.02 1.63 0.15 1.20 0.00 0.00 173.24 176.21 1vg3 h PHE 230 N 7.58 -0.53 -0.39 3.44 3.57 -1.88 0.51 116.94 129.23 1vg3 h PHE 230 Ca -0.35 0.04 -0.06 0.00 3.53 0.00 0.00 57.97 61.14 1vg3 h PHE 230 Cb 1.17 0.29 -0.02 0.00 2.79 0.00 0.00 35.95 40.18 1vg3 h PHE 230 CO 0.47 -0.29 0.01 -1.00 -2.23 0.00 0.00 178.31 175.27 1vg3 h PRO 231 N -0.16 0.62 0.39 6.41 0.13 -1.92 0.85 132.00 138.32 1vg3 h PRO 231 Ca 0.18 -0.14 -0.02 0.00 -0.87 0.00 0.00 66.00 65.15 1vg3 h PRO 231 Cb 0.43 -0.08 0.00 0.00 0.13 0.00 0.00 31.00 31.48 1vg3 h PRO 231 CO -0.45 0.64 -0.19 1.25 -0.23 0.00 0.00 178.00 179.02 1vg3 h LEU 232 N 0.59 -0.44 -0.77 1.56 5.85 -1.60 -2.35 115.31 118.14 1vg3 h LEU 232 Ca 0.12 -0.13 0.03 0.00 0.84 0.00 0.00 57.88 58.75 1vg3 h LEU 232 Cb 0.37 0.12 -0.05 0.00 0.37 0.00 0.00 40.66 41.46 1vg3 h LEU 232 CO 0.01 -0.05 0.49 0.58 -0.34 0.00 0.00 178.44 179.14 1vg3 h VAL 233 N -0.92 1.11 -0.45 1.05 2.07 0.01 -1.34 116.25 117.77 1vg3 h VAL 233 Ca -0.05 -0.33 0.07 0.00 0.82 0.00 0.00 66.70 67.21 1vg3 h VAL 233 Cb 0.55 0.07 -0.06 0.00 -1.52 0.00 0.00 31.29 30.33 1vg3 h VAL 233 CO 0.09 0.17 0.11 0.74 0.02 0.00 0.00 177.57 178.70 1vg3 h THR 234 N 0.95 0.78 -0.10 2.57 2.02 -0.84 -0.64 112.91 117.65 1vg3 h THR 234 Ca 0.31 -0.09 -0.02 0.00 0.77 0.00 0.00 66.41 67.39 1vg3 h THR 234 Cb 0.02 0.51 -0.00 0.00 -1.74 0.00 0.00 68.15 66.93 1vg3 h THR 234 CO -0.11 0.05 0.00 0.00 0.37 0.00 0.00 175.52 175.82 1vg3 h ALA 235 N 1.34 0.14 0.00 6.16 0.00 -0.84 -2.97 119.26 123.07 1vg3 h ALA 235 Ca 0.22 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1vg3 h ALA 235 Cb 0.27 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.02 1vg3 h ALA 235 CO -0.27 -0.18 0.00 0.52 0.00 0.00 0.00 179.25 179.32 1vg3 h MET 236 N -0.10 0.00 0.05 0.00 2.86 -1.02 -0.15 114.93 116.56 1vg3 h MET 236 Ca 0.03 0.00 -0.21 0.00 -2.06 0.00 0.00 59.70 57.46 1vg3 h MET 236 Cb 0.35 0.00 0.02 0.00 0.06 0.00 0.00 31.60 32.03 1vg3 h MET 236 CO 0.01 0.00 -0.83 0.93 1.06 0.00 0.00 176.91 178.07 1vg3 h GLU 237 N 0.00 0.48 0.16 1.72 4.39 -0.97 -3.36 114.58 116.99 1vg3 h GLU 237 Ca 0.00 -0.58 -0.32 0.00 0.34 0.00 0.00 59.36 58.81 1vg3 h GLU 237 Cb 0.27 0.18 0.01 0.00 -0.10 0.00 0.00 28.75 29.11 1vg3 h GLU 237 CO 0.00 1.22 -1.51 0.87 -1.16 0.00 0.00 179.01 178.43 1vg3 h LYS 238 N -0.00 0.34 -4.96 2.33 1.57 -1.34 -3.45 116.57 111.05 1vg3 h LYS 238 Ca -0.12 -0.58 -0.67 0.00 -1.87 0.00 0.00 60.65 57.41 1vg3 h LYS 238 Cb 1.55 0.22 -0.32 0.00 0.08 0.00 0.00 32.23 33.75 1vg3 h LYS 238 CO 0.16 1.24 -0.78 -0.06 -0.57 0.00 0.00 179.45 179.44 1vg3 s PHE 239 N -2.61 2.98 -0.26 -1.35 0.08 -0.10 -4.96 117.98 111.76 1vg3 s PHE 239 Ca -0.09 -1.54 0.27 0.00 0.12 0.00 0.00 56.93 55.69 1vg3 s PHE 239 Cb 0.06 -2.02 1.15 0.00 -0.57 0.00 0.00 43.02 41.64 1vg3 s PHE 239 CO 0.88 -0.73 1.81 -1.35 -0.10 0.00 0.00 175.22 175.72 1vg3 h PRO 240 N 7.99 0.00 -0.28 0.24 0.11 -1.86 -1.89 132.00 136.31 1vg3 h PRO 240 Ca -0.37 0.00 -0.11 0.00 0.11 0.00 0.00 66.00 65.63 1vg3 h PRO 240 Cb 1.12 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.23 1vg3 h PRO 240 CO 0.59 0.00 -0.24 0.93 -0.21 0.00 0.00 178.00 179.06 1vg3 h GLU 241 N 0.00 0.66 -0.62 1.05 5.08 -1.93 -0.12 114.58 118.71 1vg3 h GLU 241 Ca 0.00 -0.34 -0.05 0.00 -1.00 0.00 0.00 59.36 57.97 1vg3 h GLU 241 Cb 0.37 0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.60 1vg3 h GLU 241 CO 0.00 0.94 0.20 0.00 -1.00 0.00 0.00 179.01 179.15 1vg3 h ALA 242 N 0.71 0.81 -0.39 3.43 0.00 -1.66 0.28 119.26 122.44 1vg3 h ALA 242 Ca 0.05 -0.20 0.01 0.00 0.00 0.00 0.00 54.91 54.77 1vg3 h ALA 242 Cb 0.80 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.33 1vg3 h ALA 242 CO 0.06 0.48 0.24 -0.09 0.00 0.00 0.00 179.25 179.94 1vg3 h ARG 243 N 0.88 0.47 0.73 0.00 2.43 -1.28 -1.66 114.38 115.96 1vg3 h ARG 243 Ca 0.20 -0.03 -0.04 0.00 -0.81 0.00 0.00 59.98 59.31 1vg3 h ARG 243 Cb 0.29 -0.11 0.01 0.00 -0.42 0.00 0.00 29.97 29.74 1vg3 h ARG 243 CO -0.01 0.31 -0.35 0.37 -1.51 0.00 0.00 179.97 178.78 1vg3 h GLN 244 N 0.48 -0.95 -1.08 0.20 5.75 -0.63 -2.95 115.11 115.92 1vg3 h GLN 244 Ca 0.15 0.06 0.31 0.00 -0.15 0.00 0.00 58.65 59.03 1vg3 h GLN 244 Cb -0.01 0.22 -0.12 0.00 1.07 0.00 0.00 27.48 28.64 1vg3 h GLN 244 CO -0.06 -0.61 0.67 0.52 -2.65 0.00 0.00 178.83 176.69 1vg3 h MET 245 N -1.15 0.33 0.85 1.69 2.86 -0.87 -0.78 114.93 117.87 1vg3 h MET 245 Ca -0.10 -0.02 -0.04 0.00 -2.06 0.00 0.00 59.70 57.48 1vg3 h MET 245 Cb 0.78 -0.08 0.00 0.00 0.06 0.00 0.00 31.60 32.37 1vg3 h MET 245 CO 0.17 0.22 -0.45 0.35 1.06 0.00 0.00 176.91 178.25 1vg3 h PHE 246 N 0.34 -1.19 -0.37 -0.22 3.57 -1.16 -0.55 116.94 117.36 1vg3 h PHE 246 Ca 0.69 -0.02 0.11 0.00 3.53 0.00 0.00 57.97 62.27 1vg3 h PHE 246 Cb 1.72 0.41 -0.01 0.00 2.79 0.00 0.00 35.95 40.85 1vg3 h PHE 246 CO -0.01 -0.71 0.27 0.93 -2.23 0.00 0.00 178.31 176.57 1vg3 h GLU 247 N -1.20 0.00 -0.63 1.11 5.08 -1.02 0.22 114.58 118.14 1vg3 h GLU 247 Ca -0.11 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.25 1vg3 h GLU 247 Cb 0.94 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.19 1vg3 h GLU 247 CO 0.16 0.00 0.00 0.09 -1.00 0.00 0.00 179.01 178.26 1vg3 n ASN 248 N -4.38 2.67 -4.07 1.42 4.13 -0.62 -4.90 115.26 109.51 1vg3 n ASN 248 Ca 0.06 -2.26 -0.34 0.00 1.68 0.00 0.00 54.58 53.72 1vg3 n ASN 248 Cb 0.46 -0.45 -0.04 0.00 -1.54 0.00 0.00 39.78 38.21 1vg3 n ASN 248 CO 0.00 0.00 0.00 0.54 0.28 0.00 0.00 177.26 178.08 1vg3 n ARG 249 N 0.38 -2.35 -2.71 3.52 5.12 0.78 -4.83 116.66 116.56 1vg3 n ARG 249 Ca 0.12 0.28 -0.43 0.00 -1.93 0.00 0.00 57.85 55.89 1vg3 n ARG 249 Cb 0.53 -4.94 0.01 0.00 -1.16 0.00 0.00 32.46 26.90 1vg3 n ARG 249 CO 0.00 0.00 0.00 -3.47 -1.93 0.00 0.00 177.63 172.23 1vg3 n ASP 250 N -2.44 5.61 0.31 0.55 2.03 -0.24 -4.80 116.55 117.57 1vg3 n ASP 250 Ca 0.07 -3.20 0.18 0.00 0.52 0.00 0.00 54.79 52.37 1vg3 n ASP 250 Cb 0.48 -1.41 1.03 0.00 -0.72 0.00 0.00 41.12 40.50 1vg3 n ASP 250 CO 0.00 0.00 0.00 -0.50 -1.92 0.00 0.00 177.20 174.78 1vg3 h TRP 251 N 5.84 0.00 0.08 -0.67 -0.00 -1.88 -1.25 115.95 118.07 1vg3 h TRP 251 Ca 0.30 0.00 -0.00 0.00 -0.00 0.00 0.00 58.89 59.19 1vg3 h TRP 251 Cb 0.67 0.00 0.00 0.00 -0.00 0.00 0.00 29.16 29.83 1vg3 h TRP 251 CO 1.12 0.00 -0.04 0.77 -0.00 0.00 0.00 178.44 180.29 1vg3 h SER 252 N 0.00 -0.09 0.10 -3.49 0.02 -1.97 -2.89 113.55 105.23 1vg3 h SER 252 Ca -0.00 -0.19 -0.02 0.00 -0.84 0.00 0.00 61.79 60.74 1vg3 h SER 252 Cb 0.01 0.02 -0.00 0.00 0.14 0.00 0.00 62.40 62.57 1vg3 h SER 252 CO 0.00 0.48 -0.11 1.23 -1.14 0.00 0.00 176.83 177.30 1vg3 h GLY 253 N -1.01 0.01 0.78 -3.77 0.00 -1.95 -2.60 103.07 94.52 1vg3 h GLY 253 Ca -0.01 -0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.29 1vg3 h GLY 253 CO 0.02 0.00 -0.26 -2.00 0.00 0.00 0.00 176.54 174.30 1vg3 h LEU 254 N 0.01 -0.62 0.07 3.11 5.85 -1.34 -1.27 115.31 121.12 1vg3 h LEU 254 Ca 0.00 -0.05 0.02 0.00 0.84 0.00 0.00 57.88 58.69 1vg3 h LEU 254 Cb 0.19 0.16 -0.05 0.00 0.37 0.00 0.00 40.66 41.33 1vg3 h LEU 254 CO 0.01 -0.29 -0.43 0.24 -0.34 0.00 0.00 178.44 177.63 1vg3 h MET 255 N -0.97 -0.61 -0.90 1.25 2.86 -1.33 -0.90 114.93 114.33 1vg3 h MET 255 Ca -0.08 0.04 0.13 0.00 -2.06 0.00 0.00 59.70 57.74 1vg3 h MET 255 Cb 0.63 0.14 -0.07 0.00 0.06 0.00 0.00 31.60 32.36 1vg3 h MET 255 CO 0.12 -0.41 0.58 0.66 1.06 0.00 0.00 176.91 178.93 1vg3 h SER 256 N -0.63 0.72 -0.62 1.22 4.64 -1.53 -1.00 113.55 116.34 1vg3 h SER 256 Ca 0.03 0.04 -0.03 0.00 -0.47 0.00 0.00 61.79 61.36 1vg3 h SER 256 Cb 0.68 -0.11 -0.03 0.00 -0.31 0.00 0.00 62.40 62.63 1vg3 h SER 256 CO -0.28 0.38 0.28 0.15 -0.87 0.00 0.00 176.83 176.49 1vg3 h PHE 257 N 0.77 0.92 -0.31 4.77 3.57 -0.12 0.62 116.94 127.15 1vg3 h PHE 257 Ca 0.44 -0.06 -0.10 0.00 3.53 0.00 0.00 57.97 61.79 1vg3 h PHE 257 Cb 0.61 -0.28 -0.01 0.00 2.79 0.00 0.00 35.95 39.07 1vg3 h PHE 257 CO -0.00 0.71 -0.20 0.52 -2.23 0.00 0.00 178.31 177.11 1vg3 h MET 258 N 0.86 0.68 -0.02 1.11 2.86 -0.13 -1.06 114.93 119.23 1vg3 h MET 258 Ca 0.21 -0.32 -0.03 0.00 -2.06 0.00 0.00 59.70 57.50 1vg3 h MET 258 Cb 0.16 -0.01 -0.01 0.00 0.06 0.00 0.00 31.60 31.80 1vg3 h MET 258 CO -0.02 0.92 -0.13 -0.09 1.06 0.00 0.00 176.91 178.65 1vg3 h ARG 259 N 0.44 0.03 -0.10 1.72 1.12 -1.07 -0.97 114.38 115.56 1vg3 h ARG 259 Ca 0.06 -0.01 -0.05 0.00 -1.11 0.00 0.00 59.98 58.88 1vg3 h ARG 259 Cb 0.75 -0.01 -0.00 0.00 -0.01 0.00 0.00 29.97 30.70 1vg3 h ARG 259 CO 0.06 0.16 -0.12 1.49 -3.11 0.00 0.00 179.97 178.45 1vg3 h GLU 260 N 0.03 0.25 -0.40 0.20 4.81 -0.46 -3.15 114.58 115.86 1vg3 h GLU 260 Ca 0.01 -0.14 0.00 0.00 -0.13 0.00 0.00 59.36 59.10 1vg3 h GLU 260 Cb 0.25 0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.64 1vg3 h GLU 260 CO 0.02 0.69 0.00 1.63 -0.73 0.00 0.00 179.01 180.62 1vg3 n LYS 261 N -4.63 1.84 -4.17 1.92 4.76 -0.44 -4.93 118.16 112.52 1vg3 n LYS 261 Ca -0.07 -1.09 -0.29 0.00 -2.87 0.00 0.00 58.31 53.99 1vg3 n LYS 261 Cb 0.35 -1.34 -0.06 0.00 -1.84 0.00 0.00 35.03 32.13 1vg3 n LYS 261 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1vg3 n GLY 262 N 0.82 -0.18 0.16 0.72 0.00 -0.41 -4.87 105.19 101.43 1vg3 n GLY 262 Ca 0.10 0.16 -0.13 0.00 0.00 0.00 0.00 46.02 46.15 1vg3 n GLY 262 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1vg3 h ILE 263 N -1.77 1.32 0.00 -0.61 1.08 -1.76 -1.84 117.51 113.95 1vg3 h ILE 263 Ca -0.64 -1.30 -0.02 0.00 -0.39 0.00 0.00 64.86 62.50 1vg3 h ILE 263 Cb 1.39 1.74 -0.00 0.00 -3.07 0.00 0.00 36.82 36.87 1vg3 h ILE 263 CO 0.68 0.40 -0.09 0.25 -0.69 0.00 0.00 178.15 178.70 1vg3 h LEU 264 N 0.14 0.00 0.19 1.44 5.85 -1.89 0.26 115.31 121.29 1vg3 h LEU 264 Ca 0.04 0.00 -0.34 0.00 0.84 0.00 0.00 57.88 58.42 1vg3 h LEU 264 Cb 0.70 0.00 0.01 0.00 0.37 0.00 0.00 40.66 41.74 1vg3 h LEU 264 CO 0.04 0.09 -1.61 0.11 -0.34 0.00 0.00 178.44 176.74 1vg3 h LYS 265 N 0.00 0.41 0.55 1.25 6.56 -1.93 -2.76 116.57 120.66 1vg3 h LYS 265 Ca -0.00 -0.69 -0.03 0.00 -1.06 0.00 0.00 60.65 58.87 1vg3 h LYS 265 Cb 0.24 0.26 0.01 0.00 -0.57 0.00 0.00 32.23 32.16 1vg3 h LYS 265 CO 0.01 1.31 -0.27 1.49 -2.06 0.00 0.00 179.45 179.94 1vg3 h GLU 266 N 0.11 -0.72 -0.52 3.15 4.81 -0.46 0.28 114.58 121.24 1vg3 h GLU 266 Ca -0.29 0.05 0.12 0.00 -0.13 0.00 0.00 59.36 59.10 1vg3 h GLU 266 Cb 2.10 0.16 -0.03 0.00 0.63 0.00 0.00 28.75 31.62 1vg3 h GLU 266 CO 0.21 -0.45 0.36 0.00 -0.73 0.00 0.00 179.01 178.40 1vg3 h GLU 268 N 0.20 0.26 -0.38 0.00 4.81 -1.07 -2.03 114.58 116.37 1vg3 h GLU 268 Ca 0.25 -0.08 -0.11 0.00 -0.13 0.00 0.00 59.36 59.28 1vg3 h GLU 268 Cb 0.71 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 30.04 1vg3 h GLU 268 CO -0.04 0.46 -0.23 0.93 -0.73 0.00 0.00 179.01 179.41 1vg3 h GLU 269 N 0.03 0.75 -0.54 1.92 4.39 0.69 -2.81 114.58 119.00 1vg3 h GLU 269 Ca 0.05 -0.30 0.02 0.00 0.34 0.00 0.00 59.36 59.46 1vg3 h GLU 269 Cb 0.34 -0.04 -0.03 0.00 -0.10 0.00 0.00 28.75 28.92 1vg3 h GLU 269 CO 0.01 0.91 0.34 1.15 -1.16 0.00 0.00 179.01 180.25 1vg3 h THR 270 N 0.66 1.08 -0.76 1.13 2.02 -0.66 -2.02 112.91 114.37 1vg3 h THR 270 Ca 0.09 -0.23 -0.00 0.00 0.77 0.00 0.00 66.41 67.04 1vg3 h THR 270 Cb 0.73 0.35 -0.04 0.00 -1.74 0.00 0.00 68.15 67.45 1vg3 h THR 270 CO 0.06 0.12 0.46 0.25 0.37 0.00 0.00 175.52 176.78 1vg3 h LEU 271 N 0.67 0.91 -0.24 2.58 5.85 -1.23 -2.82 115.31 121.03 1vg3 h LEU 271 Ca 0.21 -0.05 0.04 0.00 0.84 0.00 0.00 57.88 58.92 1vg3 h LEU 271 Cb -0.01 -0.23 -0.04 0.00 0.37 0.00 0.00 40.66 40.75 1vg3 h LEU 271 CO -0.08 0.69 0.01 0.11 -0.34 0.00 0.00 178.44 178.83 1vg3 h LYS 272 N 1.05 0.08 -0.55 1.25 1.79 -1.11 -0.60 116.57 118.47 1vg3 h LYS 272 Ca 0.27 -0.00 0.01 0.00 -2.18 0.00 0.00 60.65 58.75 1vg3 h LYS 272 Cb -0.05 -0.02 -0.03 0.00 -1.58 0.00 0.00 32.23 30.55 1vg3 h LYS 272 CO -0.05 0.05 0.35 0.28 -1.08 0.00 0.00 179.45 179.00 1vg3 h VAL 273 N 0.08 1.11 -0.45 0.50 2.07 -1.31 -1.20 116.25 117.06 1vg3 h VAL 273 Ca 0.11 -0.25 0.04 0.00 0.82 0.00 0.00 66.70 67.43 1vg3 h VAL 273 Cb 0.14 0.34 -0.04 0.00 -1.52 0.00 0.00 31.29 30.21 1vg3 h VAL 273 CO -0.19 0.13 0.23 -0.07 0.02 0.00 0.00 177.57 177.69 1vg3 h LEU 274 N 0.72 0.33 -0.00 2.57 3.38 -1.16 -0.53 115.31 120.61 1vg3 h LEU 274 Ca 0.21 0.02 -0.00 0.00 0.09 0.00 0.00 57.88 58.20 1vg3 h LEU 274 Cb -0.05 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 40.66 1vg3 h LEU 274 CO -0.06 0.23 -0.00 0.58 0.09 0.00 0.00 178.44 179.28 1vg3 h VAL 275 N 0.45 1.28 0.13 1.22 2.07 -0.91 -2.62 116.25 117.87 1vg3 h VAL 275 Ca 0.20 -0.83 0.02 0.00 0.82 0.00 0.00 66.70 66.91 1vg3 h VAL 275 Cb 0.10 1.84 -0.04 0.00 -1.52 0.00 0.00 31.29 31.67 1vg3 h VAL 275 CO -0.14 0.22 -0.35 0.11 0.02 0.00 0.00 177.57 177.43 1vg3 h LYS 276 N -0.34 -0.56 -0.48 1.57 1.57 -1.07 -2.20 116.57 115.06 1vg3 h LYS 276 Ca 0.00 0.04 0.10 0.00 -1.87 0.00 0.00 60.65 58.92 1vg3 h LYS 276 Cb 0.35 0.13 -0.09 0.00 0.08 0.00 0.00 32.23 32.70 1vg3 h LYS 276 CO 0.00 -0.37 -0.12 -0.97 -0.57 0.00 0.00 179.45 177.42 1vg3 h ASN 277 N -0.58 -0.44 -0.90 0.86 -0.73 -1.15 0.49 115.58 113.14 1vg3 h ASN 277 Ca 0.03 0.14 0.16 0.00 1.87 0.00 0.00 56.30 58.50 1vg3 h ASN 277 Cb 0.61 0.30 -0.10 0.00 0.27 0.00 0.00 38.32 39.39 1vg3 h ASN 277 CO -0.20 -0.16 0.48 0.58 -0.37 0.00 0.00 177.43 177.77 1vg3 h VAL 278 N 0.00 0.72 0.86 2.57 2.07 -1.09 -1.11 116.25 120.27 1vg3 h VAL 278 Ca 0.23 -0.23 -0.04 0.00 0.82 0.00 0.00 66.70 67.49 1vg3 h VAL 278 Cb 0.35 -0.00 0.01 0.00 -1.52 0.00 0.00 31.29 30.13 1vg3 h VAL 278 CO -0.49 0.12 -0.41 0.40 0.02 0.00 0.00 177.57 177.20 1vg3 h ILE 279 N 0.66 0.00 -0.72 4.57 1.08 -0.36 -1.20 117.51 121.54 1vg3 h ILE 279 Ca 0.50 -0.16 0.07 0.00 -0.39 0.00 0.00 64.86 64.88 1vg3 h ILE 279 Cb 0.73 0.00 -0.09 0.00 -3.07 0.00 0.00 36.82 34.39 1vg3 h ILE 279 CO -0.37 0.00 -0.48 0.40 -0.69 0.00 0.00 178.15 177.00 1vg3 h ILE 280 N -1.31 0.00 0.00 -0.67 2.04 -0.37 0.95 117.51 118.16 1vg3 h ILE 280 Ca -0.12 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.74 1vg3 h ILE 280 Cb 0.88 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 36.96 1vg3 h ILE 280 CO 0.19 0.00 0.00 -0.62 0.00 0.00 0.00 178.15 177.72 1vg3 n GLU 281 N -4.88 0.18 -3.20 2.37 1.02 -0.49 -3.83 120.64 111.80 1vg3 n GLU 281 Ca 0.01 0.36 -0.24 0.00 -0.02 0.00 0.00 57.16 57.27 1vg3 n GLU 281 Cb 0.23 -1.81 -0.06 0.00 -0.02 0.00 0.00 31.44 29.79 1vg3 n GLU 281 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1vg3 n ASN 282 N -2.13 1.72 -0.47 1.62 3.02 0.25 -4.96 115.26 114.30 1vg3 n ASN 282 Ca 0.03 -3.08 0.39 0.00 -0.03 0.00 0.00 54.58 51.89 1vg3 n ASN 282 Cb 0.25 -0.63 0.67 0.00 -0.61 0.00 0.00 39.78 39.46 1vg3 n ASN 282 CO 0.00 0.00 0.00 0.77 -2.62 0.00 0.00 177.26 175.41 1vg3 h SER 283 N 3.63 0.21 0.00 6.41 4.64 -1.44 0.28 113.55 127.28 1vg3 h SER 283 Ca 0.11 0.14 0.00 0.00 -0.47 0.00 0.00 61.79 61.57 1vg3 h SER 283 Cb 0.80 0.13 0.00 0.00 -0.31 0.00 0.00 62.40 63.03 1vg3 h SER 283 CO 0.60 -0.20 0.00 -2.67 -0.87 0.00 0.00 176.83 173.69 1vg3 n TRP 284 N -4.67 0.00 -0.21 4.77 4.27 -1.26 -2.29 117.44 118.05 1vg3 n TRP 284 Ca 0.39 0.00 0.10 0.00 -3.89 0.00 0.00 57.50 54.10 1vg3 n TRP 284 Cb 1.52 0.00 0.26 0.00 -1.36 0.00 0.00 31.31 31.73 1vg3 n TRP 284 CO 0.00 0.00 0.00 1.28 -2.29 0.00 0.00 177.69 176.68 1vg3 n LEU 285 N -0.91 3.58 -0.64 5.67 4.32 0.98 -4.71 117.00 125.28 1vg3 n LEU 285 Ca 0.08 -1.91 0.49 0.00 -0.02 0.00 0.00 56.01 54.64 1vg3 n LEU 285 Cb 0.03 -0.38 0.75 0.00 -1.62 0.00 0.00 43.42 42.20 1vg3 n LEU 285 CO 0.06 0.88 1.37 0.54 -1.22 0.00 0.00 177.39 179.01 1vg3 n ARG 286 N 1.31 0.00 0.00 3.23 5.12 -0.97 -4.97 116.66 120.38 1vg3 n ARG 286 Ca 0.20 1.00 0.05 0.00 -1.93 0.00 0.00 57.85 57.17 1vg3 n ARG 286 Cb 0.56 -2.32 0.31 0.00 -1.16 0.00 0.00 32.46 29.85 1vg3 n ARG 286 CO 0.00 0.00 0.00 -0.25 -1.93 0.00 0.00 177.63 175.45