#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vg1 s LYS 6 N 0.00 3.16 -0.39 1.97 1.02 -1.26 -5.09 119.74 119.15 1vg1 s LYS 6 Ca 0.00 -0.94 -0.09 0.00 0.02 0.00 0.00 55.97 54.96 1vg1 s LYS 6 Cb 0.00 -2.73 0.06 0.00 -0.52 0.00 0.00 37.83 34.64 1vg1 s LYS 6 CO 0.00 0.35 0.22 0.08 -0.92 0.00 0.00 175.35 175.08 1vg1 s VAL 7 N -2.08 4.21 -0.21 3.17 1.01 -1.26 -5.07 120.40 120.17 1vg1 s VAL 7 Ca 0.35 -1.24 -0.06 0.00 0.00 0.00 0.00 61.98 61.04 1vg1 s VAL 7 Cb -0.08 -3.50 -0.03 0.00 0.00 0.00 0.00 36.38 32.77 1vg1 s VAL 7 CO 0.28 -0.39 0.03 -0.22 0.00 0.00 0.00 175.10 174.79 1vg1 s LEU 8 N 1.45 3.38 -0.18 3.92 2.96 -1.26 -0.88 118.68 128.07 1vg1 s LEU 8 Ca 0.02 -0.16 -0.02 0.00 -0.22 0.00 0.00 54.13 53.75 1vg1 s LEU 8 Cb -0.21 -1.87 -0.01 0.00 0.50 0.00 0.00 46.19 44.60 1vg1 s LEU 8 CO 0.03 0.06 -0.10 -0.76 -1.32 0.00 0.00 176.35 174.26 1vg1 s LEU 9 N 1.06 2.72 -0.19 -0.68 1.43 -0.09 -4.98 118.68 117.95 1vg1 s LEU 9 Ca 0.03 -0.40 -0.15 0.00 -1.03 0.00 0.00 54.13 52.58 1vg1 s LEU 9 Cb -0.14 -1.65 -0.04 0.00 0.03 0.00 0.00 46.19 44.38 1vg1 s LEU 9 CO 0.02 0.06 0.35 -0.75 0.23 0.00 0.00 176.35 176.26 1vg1 s LYS 10 N 0.98 4.20 -0.03 1.70 2.20 -1.26 -0.65 119.74 126.88 1vg1 s LYS 10 Ca -0.01 0.14 0.04 0.00 -0.36 0.00 0.00 55.97 55.78 1vg1 s LYS 10 Cb -0.15 -3.50 -0.00 0.00 -1.51 0.00 0.00 37.83 32.67 1vg1 s LYS 10 CO -0.01 0.06 -0.16 0.08 -0.36 0.00 0.00 175.35 174.96 1vg1 s VAL 11 N 1.00 1.32 0.09 4.02 1.01 -0.36 0.18 120.40 127.67 1vg1 s VAL 11 Ca 0.18 -0.67 0.09 0.00 0.00 0.00 0.00 61.98 61.58 1vg1 s VAL 11 Cb -0.14 -1.13 -0.03 0.00 0.00 0.00 0.00 36.38 35.07 1vg1 s VAL 11 CO 0.07 0.38 -0.24 0.27 0.00 0.00 0.00 175.10 175.58 1vg1 s ILE 12 N -0.03 1.98 -0.14 2.22 -4.36 -1.03 -0.15 121.20 119.69 1vg1 s ILE 12 Ca -0.02 -1.52 0.01 0.00 -0.26 0.00 0.00 60.65 58.87 1vg1 s ILE 12 Cb -0.10 -1.75 0.00 0.00 1.25 0.00 0.00 42.46 41.86 1vg1 s ILE 12 CO 0.01 0.13 -0.18 -0.63 0.24 0.00 0.00 174.94 174.52 1vg1 s ILE 13 N -0.98 2.47 0.22 8.37 1.01 -0.84 -0.36 121.20 131.09 1vg1 s ILE 13 Ca 0.10 -0.85 0.10 0.00 0.00 0.00 0.00 60.65 60.01 1vg1 s ILE 13 Cb -0.10 -2.02 -0.05 0.00 0.01 0.00 0.00 42.46 40.31 1vg1 s ILE 13 CO 0.04 0.53 -0.19 -0.76 0.00 0.00 0.00 174.94 174.55 1vg1 s LEU 14 N 0.71 2.51 0.00 2.97 1.43 0.61 -3.81 118.68 123.11 1vg1 s LEU 14 Ca -0.08 -0.95 0.00 0.00 -1.03 0.00 0.00 54.13 52.07 1vg1 s LEU 14 Cb -0.16 -0.97 0.00 0.00 0.03 0.00 0.00 46.19 45.09 1vg1 s LEU 14 CO 0.01 0.00 0.00 0.61 0.23 0.00 0.00 176.35 177.20 1vg1 n GLY 15 N -0.17 3.79 3.66 -3.19 0.00 -1.26 -1.09 105.19 106.94 1vg1 n GLY 15 Ca -0.09 -1.24 -0.35 0.00 0.00 0.00 0.00 46.02 44.34 1vg1 n GLY 15 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1vg1 n ASP 16 N 0.00 0.92 -4.74 1.61 8.00 -1.26 -4.90 116.55 116.18 1vg1 n ASP 16 Ca 0.00 0.64 -0.42 0.00 0.71 0.00 0.00 54.79 55.73 1vg1 n ASP 16 Cb 0.00 -1.47 -0.02 0.00 -0.02 0.00 0.00 41.12 39.61 1vg1 n ASP 16 CO 0.00 0.00 0.00 -0.24 -0.39 0.00 0.00 177.20 176.57 1vg1 n SER 17 N -2.47 3.75 0.00 -2.24 2.88 -1.26 -2.82 113.62 111.45 1vg1 n SER 17 Ca 0.14 1.15 0.00 0.00 -1.33 0.00 0.00 58.87 58.83 1vg1 n SER 17 Cb 0.50 -1.58 0.00 0.00 -0.75 0.00 0.00 64.21 62.38 1vg1 n SER 17 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1vg1 n GLY 18 N 2.01 0.75 0.17 0.46 0.00 -1.26 -4.94 105.19 102.39 1vg1 n GLY 18 Ca 0.08 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.19 1vg1 n GLY 18 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 1vg1 h VAL 19 N 0.00 0.26 0.00 1.61 -1.51 -1.88 -3.48 116.25 111.25 1vg1 h VAL 19 Ca 0.00 -1.39 0.00 0.00 -1.23 0.00 0.00 66.70 64.08 1vg1 h VAL 19 Cb 0.00 2.04 0.00 0.00 -2.13 0.00 0.00 31.29 31.20 1vg1 h VAL 19 CO 0.00 0.15 0.00 0.61 -1.23 0.00 0.00 177.57 177.10 1vg1 n GLY 20 N 1.16 1.95 0.31 5.19 0.00 -1.26 -4.59 105.19 107.96 1vg1 n GLY 20 Ca 0.02 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.89 1vg1 n GLY 20 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1vg1 h LYS 21 N 0.00 -0.62 -0.86 1.61 1.57 -1.92 -0.08 116.57 116.27 1vg1 h LYS 21 Ca 0.00 0.04 0.01 0.00 -1.87 0.00 0.00 60.65 58.83 1vg1 h LYS 21 Cb 0.00 0.14 -0.04 0.00 0.08 0.00 0.00 32.23 32.41 1vg1 h LYS 21 CO 0.00 -0.42 0.57 1.15 -0.57 0.00 0.00 179.45 180.18 1vg1 h THR 22 N -0.65 1.21 -0.59 -0.16 2.02 -1.97 -1.86 112.91 110.92 1vg1 h THR 22 Ca -0.04 -0.40 -0.05 0.00 0.77 0.00 0.00 66.41 66.69 1vg1 h THR 22 Cb 0.55 -0.05 -0.02 0.00 -1.74 0.00 0.00 68.15 66.89 1vg1 h THR 22 CO 0.02 0.21 0.17 0.28 0.37 0.00 0.00 175.52 176.57 1vg1 h SER 23 N 1.16 0.87 -0.70 4.18 0.02 -1.93 -1.08 113.55 116.06 1vg1 h SER 23 Ca 0.32 -0.21 -0.05 0.00 -0.84 0.00 0.00 61.79 61.00 1vg1 h SER 23 Cb -0.12 -0.23 -0.03 0.00 0.14 0.00 0.00 62.40 62.16 1vg1 h SER 23 CO -0.07 0.85 0.23 -0.07 -1.14 0.00 0.00 176.83 176.63 1vg1 h LEU 24 N 0.84 1.02 -0.29 5.07 3.38 -0.63 0.11 115.31 124.81 1vg1 h LEU 24 Ca 0.19 -0.20 -0.02 0.00 0.09 0.00 0.00 57.88 57.93 1vg1 h LEU 24 Cb 0.30 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 1vg1 h LEU 24 CO -0.00 0.95 0.10 -0.03 0.09 0.00 0.00 178.44 179.55 1vg1 h MET 25 N 1.03 0.45 -0.56 1.13 4.05 -1.05 -1.37 114.93 118.61 1vg1 h MET 25 Ca 0.23 -0.09 -0.10 0.00 -0.28 0.00 0.00 59.70 59.45 1vg1 h MET 25 Cb 0.29 -0.07 -0.02 0.00 -0.80 0.00 0.00 31.60 31.00 1vg1 h MET 25 CO -0.01 0.49 -0.05 -0.91 0.23 0.00 0.00 176.91 176.66 1vg1 h ASN 26 N 0.32 1.01 -0.44 1.39 2.35 -1.03 -1.35 115.58 117.84 1vg1 h ASN 26 Ca 0.10 -0.33 0.00 0.00 -0.55 0.00 0.00 56.30 55.52 1vg1 h ASN 26 Cb 0.22 -0.27 -0.02 0.00 0.05 0.00 0.00 38.32 38.30 1vg1 h ASN 26 CO -0.00 1.10 0.28 -0.61 -1.65 0.00 0.00 177.43 176.55 1vg1 h GLN 27 N 0.91 0.58 0.15 0.81 5.75 -0.69 0.10 115.11 122.71 1vg1 h GLN 27 Ca 0.15 -0.04 -0.01 0.00 -0.15 0.00 0.00 58.65 58.60 1vg1 h GLN 27 Cb 0.61 -0.13 0.00 0.00 1.07 0.00 0.00 27.48 29.03 1vg1 h GLN 27 CO 0.04 0.40 -0.07 -0.92 -2.65 0.00 0.00 178.83 175.63 1vg1 h TYR 28 N 0.59 -0.18 -0.06 3.99 3.20 -1.14 0.15 116.97 123.52 1vg1 h TYR 28 Ca 0.16 -0.00 -0.24 0.00 3.14 0.00 0.00 58.73 61.78 1vg1 h TYR 28 Cb -0.04 0.06 0.01 0.00 1.54 0.00 0.00 36.73 38.30 1vg1 h TYR 28 CO -0.04 0.09 -0.92 0.28 -1.64 0.00 0.00 178.16 175.93 1vg1 h VAL 29 N -0.45 1.30 -0.00 1.81 2.07 -1.23 -3.38 116.25 116.37 1vg1 h VAL 29 Ca -0.02 -2.17 0.00 0.00 0.82 0.00 0.00 66.70 65.33 1vg1 h VAL 29 Cb 0.36 2.23 0.00 0.00 -1.52 0.00 0.00 31.29 32.35 1vg1 h VAL 29 CO 0.03 0.67 -0.18 0.59 0.02 0.00 0.00 177.57 178.71 1vg1 n ASN 30 N -3.87 0.44 -3.57 0.57 3.02 0.30 -5.00 115.26 107.16 1vg1 n ASN 30 Ca -0.09 -0.72 -0.26 0.00 -0.03 0.00 0.00 54.58 53.48 1vg1 n ASN 30 Cb 0.82 0.82 0.04 0.00 -0.61 0.00 0.00 39.78 40.84 1vg1 n ASN 30 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1vg1 n LYS 31 N -0.85 -5.63 -4.31 3.52 5.02 0.51 -4.96 118.16 111.45 1vg1 n LYS 31 Ca 0.01 0.70 -0.20 0.00 -2.02 0.00 0.00 58.31 56.80 1vg1 n LYS 31 Cb 0.08 -5.60 -0.13 0.00 -0.02 0.00 0.00 35.03 29.37 1vg1 n LYS 31 CO 0.00 0.00 0.00 0.21 -0.52 0.00 0.00 177.40 177.09 1vg1 s LYS 32 N -6.27 0.92 -0.03 1.97 2.20 -1.23 -4.96 119.74 112.35 1vg1 s LYS 32 Ca 0.53 -0.82 0.04 0.00 -0.36 0.00 0.00 55.97 55.36 1vg1 s LYS 32 Cb -0.26 -0.94 -0.00 0.00 -1.51 0.00 0.00 37.83 35.12 1vg1 s LYS 32 CO 0.66 0.23 -0.14 0.12 -0.36 0.00 0.00 175.35 175.85 1vg1 s PHE 33 N -0.96 1.37 0.00 4.03 5.36 -1.26 -3.02 117.98 123.50 1vg1 s PHE 33 Ca 0.01 -0.34 0.00 0.00 -0.96 0.00 0.00 56.93 55.64 1vg1 s PHE 33 Cb -0.08 -0.92 0.00 0.00 -0.34 0.00 0.00 43.02 41.67 1vg1 s PHE 33 CO 0.02 -0.10 0.00 0.45 -1.46 0.00 0.00 175.22 174.13 1vg1 n SER 34 N 3.04 0.00 0.00 6.13 2.88 -1.26 -5.14 113.62 119.27 1vg1 n SER 34 Ca -0.17 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.37 1vg1 n SER 34 Cb 0.54 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.00 1vg1 n SER 34 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1vg1 n ALA 43 N -1.81 0.00 -2.46 -1.46 0.00 -0.89 -5.21 120.51 108.68 1vg1 n ALA 43 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 53.44 53.22 1vg1 n ALA 43 Cb 0.00 -0.20 -0.10 0.00 0.00 0.00 0.00 19.45 19.15 1vg1 n ALA 43 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.50 177.66 1vg1 s ASP 44 N -0.95 2.44 0.09 0.00 3.84 -1.26 -5.06 116.67 115.78 1vg1 s ASP 44 Ca 0.00 -1.40 -0.20 0.00 -0.00 0.00 0.00 52.55 50.95 1vg1 s ASP 44 Cb 0.00 -0.04 0.05 0.00 -1.38 0.00 0.00 42.92 41.55 1vg1 s ASP 44 CO 0.00 -0.63 0.49 0.72 -0.00 0.00 0.00 175.17 175.75 1vg1 s PHE 45 N -3.28 -0.36 0.22 2.11 -0.12 -1.26 -2.22 117.98 113.07 1vg1 s PHE 45 Ca 0.35 0.23 0.11 0.00 -0.05 0.00 0.00 56.93 57.58 1vg1 s PHE 45 Cb 0.08 0.35 -0.05 0.00 -0.63 0.00 0.00 43.02 42.78 1vg1 s PHE 45 CO 0.15 -0.70 -0.20 -0.51 -0.05 0.00 0.00 175.22 173.91 1vg1 s LEU 46 N -2.40 2.58 0.02 -1.99 1.43 -0.35 -4.93 118.68 113.04 1vg1 s LEU 46 Ca -0.01 -0.87 0.07 0.00 -1.03 0.00 0.00 54.13 52.28 1vg1 s LEU 46 Cb 0.00 -1.23 -0.02 0.00 0.03 0.00 0.00 46.19 44.97 1vg1 s LEU 46 CO -0.07 0.09 -0.20 0.42 0.23 0.00 0.00 176.35 176.81 1vg1 s THR 47 N -1.96 1.60 -0.09 5.49 -4.23 -1.26 -0.29 115.64 114.90 1vg1 s THR 47 Ca 0.25 -1.06 -0.05 0.00 -1.18 0.00 0.00 61.69 59.64 1vg1 s THR 47 Cb -0.07 -1.37 0.04 0.00 1.34 0.00 0.00 72.50 72.44 1vg1 s THR 47 CO 0.12 0.27 0.20 -0.75 -0.54 0.00 0.00 174.62 173.93 1vg1 s LYS 48 N -0.93 0.17 -0.06 3.99 2.20 -0.15 -4.98 119.74 119.99 1vg1 s LYS 48 Ca 0.07 0.43 -0.24 0.00 -0.36 0.00 0.00 55.97 55.87 1vg1 s LYS 48 Cb -0.08 -0.10 -0.04 0.00 -1.51 0.00 0.00 37.83 36.10 1vg1 s LYS 48 CO 0.01 -0.14 0.72 -1.21 -0.36 0.00 0.00 175.35 174.36 1vg1 s GLU 49 N 1.03 4.44 0.05 4.03 2.02 -1.26 -0.22 118.70 128.80 1vg1 s GLU 49 Ca -0.08 0.91 0.03 0.00 0.02 0.00 0.00 54.97 55.85 1vg1 s GLU 49 Cb -0.09 -3.44 -0.03 0.00 0.10 0.00 0.00 34.13 30.67 1vg1 s GLU 49 CO -0.06 0.07 -0.08 0.08 0.02 0.00 0.00 175.26 175.29 1vg1 s VAL 50 N 0.75 0.63 -0.16 2.63 1.01 0.26 -4.97 120.40 120.56 1vg1 s VAL 50 Ca 0.38 -1.19 -0.09 0.00 0.00 0.00 0.00 61.98 61.09 1vg1 s VAL 50 Cb -0.18 -0.76 -0.05 0.00 0.00 0.00 0.00 36.38 35.39 1vg1 s VAL 50 CO 0.19 -0.41 0.15 -0.04 0.00 0.00 0.00 175.10 174.99 1vg1 s MET 51 N -1.80 3.86 -0.32 2.72 -1.94 -1.26 -0.55 119.30 120.00 1vg1 s MET 51 Ca -0.07 -0.16 0.02 0.00 -1.71 0.00 0.00 55.69 53.77 1vg1 s MET 51 Cb -0.09 -3.32 0.08 0.00 2.01 0.00 0.00 34.83 33.52 1vg1 s MET 51 CO 0.00 0.52 0.02 0.08 -0.01 0.00 0.00 175.02 175.63 1vg1 s VAL 52 N -0.27 2.45 0.00 -6.03 1.01 0.18 -4.93 120.40 112.81 1vg1 s VAL 52 Ca 0.12 -2.01 0.00 0.00 0.00 0.00 0.00 61.98 60.09 1vg1 s VAL 52 Cb -0.12 -2.65 0.00 0.00 0.00 0.00 0.00 36.38 33.62 1vg1 s VAL 52 CO 0.01 -0.40 0.00 0.47 0.00 0.00 0.00 175.10 175.18 1vg1 n ASP 53 N 4.38 0.00 -0.10 3.32 8.00 -1.26 -1.14 116.55 129.76 1vg1 n ASP 53 Ca -0.04 0.00 0.02 0.00 0.71 0.00 0.00 54.79 55.49 1vg1 n ASP 53 Cb 0.42 0.00 0.04 0.00 -0.02 0.00 0.00 41.12 41.56 1vg1 n ASP 53 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1vg1 n ASP 54 N 10.78 2.19 -4.69 -2.24 8.00 -1.26 -4.99 116.55 124.33 1vg1 n ASP 54 Ca 0.00 -2.18 -0.35 0.00 0.71 0.00 0.00 54.79 52.96 1vg1 n ASP 54 Cb 0.00 -0.10 -0.09 0.00 -0.02 0.00 0.00 41.12 40.91 1vg1 n ASP 54 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 1vg1 s ARG 55 N -1.32 4.12 -0.02 -1.24 0.52 -0.29 -5.08 118.95 115.64 1vg1 s ARG 55 Ca 0.08 -0.25 -0.21 0.00 -0.52 0.00 0.00 55.73 54.83 1vg1 s ARG 55 Cb 0.06 -3.44 -0.05 0.00 0.52 0.00 0.00 34.95 32.04 1vg1 s ARG 55 CO 0.02 0.21 0.60 -1.17 0.02 0.00 0.00 175.30 174.98 1vg1 s LEU 56 N 0.62 4.39 0.05 2.53 2.96 -1.26 0.49 118.68 128.46 1vg1 s LEU 56 Ca 0.07 1.14 -0.01 0.00 -0.22 0.00 0.00 54.13 55.11 1vg1 s LEU 56 Cb -0.12 -2.92 -0.04 0.00 0.50 0.00 0.00 46.19 43.61 1vg1 s LEU 56 CO 0.00 0.07 -0.03 0.68 -1.32 0.00 0.00 176.35 175.75 1vg1 s VAL 57 N -0.00 0.22 -0.20 1.68 -7.23 0.29 -4.66 120.40 110.49 1vg1 s VAL 57 Ca 0.31 -1.71 -0.03 0.00 -1.81 0.00 0.00 61.98 58.75 1vg1 s VAL 57 Cb -0.18 -1.37 -0.01 0.00 0.56 0.00 0.00 36.38 35.38 1vg1 s VAL 57 CO 0.17 -0.94 -0.07 -0.89 -0.31 0.00 0.00 175.10 173.05 1vg1 s THR 58 N -3.62 3.19 -0.16 5.32 2.01 -0.06 -0.58 115.64 121.74 1vg1 s THR 58 Ca 0.04 -0.57 -0.13 0.00 0.31 0.00 0.00 61.69 61.35 1vg1 s THR 58 Cb 0.06 -2.42 -0.05 0.00 0.01 0.00 0.00 72.50 70.10 1vg1 s THR 58 CO -0.09 0.46 0.26 -0.32 -0.69 0.00 0.00 174.62 174.24 1vg1 s MET 59 N 1.24 4.20 -0.37 4.92 1.75 0.70 -0.91 119.30 130.83 1vg1 s MET 59 Ca 0.03 0.03 -0.04 0.00 -1.25 0.00 0.00 55.69 54.46 1vg1 s MET 59 Cb -0.14 -3.41 0.08 0.00 2.84 0.00 0.00 34.83 34.19 1vg1 s MET 59 CO -0.03 0.28 0.15 -1.14 -0.65 0.00 0.00 175.02 173.63 1vg1 s GLN 60 N 0.35 2.34 -0.26 4.11 0.74 0.18 -0.97 119.66 126.15 1vg1 s GLN 60 Ca 0.15 -1.49 -0.11 0.00 0.05 0.00 0.00 55.36 53.95 1vg1 s GLN 60 Cb -0.13 -3.50 -0.05 0.00 1.10 0.00 0.00 33.01 30.44 1vg1 s GLN 60 CO 0.03 -0.86 0.21 0.42 -0.55 0.00 0.00 175.29 174.54 1vg1 s ILE 61 N 1.27 5.31 -0.19 -2.34 1.01 0.60 -1.22 121.20 125.64 1vg1 s ILE 61 Ca 0.02 0.24 -0.07 0.00 0.00 0.00 0.00 60.65 60.84 1vg1 s ILE 61 Cb -0.21 -3.55 -0.04 0.00 0.01 0.00 0.00 42.46 38.67 1vg1 s ILE 61 CO -0.01 0.27 0.05 0.26 0.00 0.00 0.00 174.94 175.51 1vg1 s TRP 62 N 1.55 3.20 -0.13 3.97 0.52 0.78 -1.21 118.94 127.63 1vg1 s TRP 62 Ca 0.09 -0.03 -0.11 0.00 0.02 0.00 0.00 56.10 56.06 1vg1 s TRP 62 Cb -0.15 -2.08 -0.05 0.00 -1.15 0.00 0.00 33.47 30.04 1vg1 s TRP 62 CO 0.09 0.07 0.23 0.34 0.02 0.00 0.00 176.95 177.69 1vg1 s ASP 63 N 0.53 6.43 0.45 2.95 3.68 -0.94 -1.98 116.67 127.79 1vg1 s ASP 63 Ca 0.02 0.51 0.07 0.00 2.13 0.00 0.00 52.55 55.28 1vg1 s ASP 63 Cb -0.13 -2.14 -0.02 0.00 -1.45 0.00 0.00 42.92 39.19 1vg1 s ASP 63 CO 0.01 0.26 0.29 0.42 0.13 0.00 0.00 175.17 176.28 1vg1 s THR 64 N -0.30 2.20 0.68 1.71 -4.23 -1.25 -2.10 115.64 112.36 1vg1 s THR 64 Ca 0.15 -1.55 -0.10 0.00 -1.18 0.00 0.00 61.69 59.01 1vg1 s THR 64 Cb -0.13 -2.75 0.01 0.00 1.34 0.00 0.00 72.50 70.97 1vg1 s THR 64 CO 0.04 0.00 1.06 -0.55 -0.54 0.00 0.00 174.62 174.63 1vg1 s SER 72 N -4.07 5.49 0.00 3.99 0.15 -1.26 -4.97 113.70 113.04 1vg1 s SER 72 Ca 0.40 1.05 0.23 0.00 0.70 0.00 0.00 55.95 58.33 1vg1 s SER 72 Cb 0.00 -1.89 0.13 0.00 -1.71 0.00 0.00 66.02 62.55 1vg1 s SER 72 CO 0.23 -1.28 1.15 0.18 1.20 0.00 0.00 173.24 174.73 1vg1 n LEU 73 N -2.92 1.03 0.00 3.45 7.99 -1.26 -5.08 117.00 120.22 1vg1 n LEU 73 Ca 0.06 -0.37 0.00 0.00 -0.01 0.00 0.00 56.01 55.69 1vg1 n LEU 73 Cb 0.57 -0.08 0.00 0.00 -0.11 0.00 0.00 43.42 43.80 1vg1 n LEU 73 CO 0.57 0.23 0.00 0.61 -1.51 0.00 0.00 177.39 177.28 1vg1 n GLY 74 N 1.47 -1.08 0.30 -0.72 0.00 -1.26 -4.48 105.19 99.41 1vg1 n GLY 74 Ca 0.06 -1.34 0.08 0.00 0.00 0.00 0.00 46.02 44.83 1vg1 n GLY 74 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1vg1 h VAL 75 N 0.00 0.27 -0.05 1.61 2.07 -1.98 -1.77 116.25 116.40 1vg1 h VAL 75 Ca 0.00 -0.04 0.01 0.00 0.82 0.00 0.00 66.70 67.50 1vg1 h VAL 75 Cb 0.00 0.16 -0.00 0.00 -1.52 0.00 0.00 31.29 29.93 1vg1 h VAL 75 CO 0.00 0.02 0.05 0.00 0.02 0.00 0.00 177.57 177.66 1vg1 h ALA 76 N 1.78 1.67 -0.46 1.67 0.00 -1.88 -0.14 119.26 121.89 1vg1 h ALA 76 Ca 0.47 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.36 1vg1 h ALA 76 Cb 0.88 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.65 1vg1 h ALA 76 CO -0.72 -0.07 0.22 0.35 0.00 0.00 0.00 179.25 179.02 1vg1 h PHE 77 N 0.00 0.67 0.12 0.00 3.57 -1.54 -2.76 116.94 117.01 1vg1 h PHE 77 Ca 0.02 -0.04 -0.25 0.00 3.53 0.00 0.00 57.97 61.24 1vg1 h PHE 77 Cb 0.12 -0.21 0.03 0.00 2.79 0.00 0.00 35.95 38.68 1vg1 h PHE 77 CO 0.00 0.55 -1.05 1.88 -2.23 0.00 0.00 178.31 177.46 1vg1 h TYR 78 N 0.61 0.82 -0.45 0.41 -1.99 -1.39 -3.33 116.97 111.65 1vg1 h TYR 78 Ca 0.16 -0.53 0.10 0.00 2.00 0.00 0.00 58.73 60.45 1vg1 h TYR 78 Cb 0.13 -0.06 -0.02 0.00 2.00 0.00 0.00 36.73 38.78 1vg1 h TYR 78 CO -0.01 1.39 0.31 -0.09 -0.00 0.00 0.00 178.16 179.76 1vg1 h ARG 79 N 0.02 0.18 -0.04 4.88 2.43 -1.03 -1.07 114.38 119.75 1vg1 h ARG 79 Ca -0.17 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 58.99 1vg1 h ARG 79 Cb 1.77 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 31.28 1vg1 h ARG 79 CO 0.20 0.12 0.00 0.41 -1.51 0.00 0.00 179.97 179.19 1vg1 n GLY 80 N -1.57 -0.60 3.76 2.80 0.00 -1.05 -4.91 105.19 103.64 1vg1 n GLY 80 Ca 0.07 -0.23 -0.39 0.00 0.00 0.00 0.00 46.02 45.47 1vg1 n GLY 80 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1vg1 s ALA 81 N -1.95 3.30 -0.39 4.61 0.00 -0.41 -4.59 121.76 122.34 1vg1 s ALA 81 Ca 0.33 0.71 0.22 0.00 0.00 0.00 0.00 51.96 53.22 1vg1 s ALA 81 Cb 0.16 -3.25 -0.18 0.00 0.00 0.00 0.00 23.12 19.85 1vg1 s ALA 81 CO 0.26 0.02 0.76 -0.25 0.00 0.00 0.00 175.76 176.56 1vg1 n ASP 82 N 0.98 0.44 -3.64 0.00 10.43 0.13 -4.95 116.55 119.94 1vg1 n ASP 82 Ca 0.00 -0.20 -0.13 0.00 2.57 0.00 0.00 54.79 57.03 1vg1 n ASP 82 Cb 0.47 1.33 -0.07 0.00 1.84 0.00 0.00 41.12 44.69 1vg1 n ASP 82 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1vg1 s VAL 85 N 1.47 5.28 -0.16 0.00 1.01 0.51 -2.07 120.40 126.44 1vg1 s VAL 85 Ca 0.04 0.61 -0.02 0.00 0.00 0.00 0.00 61.98 62.61 1vg1 s VAL 85 Cb -0.16 -3.66 -0.01 0.00 0.00 0.00 0.00 36.38 32.54 1vg1 s VAL 85 CO -0.01 0.36 -0.09 -0.76 0.00 0.00 0.00 175.10 174.60 1vg1 s LEU 86 N 0.61 2.83 -0.04 3.92 1.43 0.64 -0.28 118.68 127.78 1vg1 s LEU 86 Ca 0.18 -0.33 0.07 0.00 -1.03 0.00 0.00 54.13 53.02 1vg1 s LEU 86 Cb -0.13 -1.67 -0.02 0.00 0.03 0.00 0.00 46.19 44.40 1vg1 s LEU 86 CO 0.05 0.11 -0.24 -0.69 0.23 0.00 0.00 176.35 175.80 1vg1 s VAL 87 N 0.71 2.17 0.28 -1.59 1.01 -0.25 -0.63 120.40 122.11 1vg1 s VAL 87 Ca -0.04 -1.05 0.02 0.00 0.00 0.00 0.00 61.98 60.91 1vg1 s VAL 87 Cb -0.15 -1.78 -0.05 0.00 0.00 0.00 0.00 36.38 34.40 1vg1 s VAL 87 CO 0.02 0.58 0.10 0.72 0.00 0.00 0.00 175.10 176.52 1vg1 s PHE 88 N -0.43 1.61 -0.26 5.22 -0.12 -0.75 -4.21 117.98 119.04 1vg1 s PHE 88 Ca 0.04 -1.18 -0.06 0.00 -0.05 0.00 0.00 56.93 55.68 1vg1 s PHE 88 Cb -0.12 -0.95 -0.01 0.00 -0.63 0.00 0.00 43.02 41.32 1vg1 s PHE 88 CO 0.01 -0.32 0.05 0.34 -0.05 0.00 0.00 175.22 175.25 1vg1 s ASP 89 N -3.35 4.94 0.13 1.98 -1.08 -1.26 -1.14 116.67 116.88 1vg1 s ASP 89 Ca 0.37 -0.47 0.12 0.00 -0.52 0.00 0.00 52.55 52.05 1vg1 s ASP 89 Cb 0.07 -1.86 0.60 0.00 -1.46 0.00 0.00 42.92 40.27 1vg1 s ASP 89 CO 0.14 -0.10 1.38 1.33 0.52 0.00 0.00 175.17 178.45 1vg1 n VAL 90 N 4.87 1.36 1.09 1.11 0.24 -0.47 -0.87 118.33 125.66 1vg1 n VAL 90 Ca -0.16 0.47 0.12 0.00 -2.04 0.00 0.00 64.34 62.73 1vg1 n VAL 90 Cb 0.50 -1.41 0.14 0.00 -1.47 0.00 0.00 33.84 31.59 1vg1 n VAL 90 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 1vg1 n THR 91 N -1.82 0.00 -3.74 3.34 -2.24 -1.26 0.15 114.28 108.71 1vg1 n THR 91 Ca 0.01 -0.30 -0.30 0.00 -2.27 0.00 0.00 64.05 61.19 1vg1 n THR 91 Cb 0.08 1.10 -0.13 0.00 -2.10 0.00 0.00 70.33 69.27 1vg1 n THR 91 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1vg1 s ALA 92 N -2.32 2.19 0.48 6.98 0.00 -0.05 -4.51 121.76 124.53 1vg1 s ALA 92 Ca 0.24 -2.52 0.28 0.00 0.00 0.00 0.00 51.96 49.95 1vg1 s ALA 92 Cb 0.19 -1.88 1.35 0.00 0.00 0.00 0.00 23.12 22.78 1vg1 s ALA 92 CO 0.47 -2.00 1.80 -1.35 0.00 0.00 0.00 175.76 174.68 1vg1 h PRO 93 N 6.92 0.16 -0.28 0.00 0.11 -1.85 -0.72 132.00 136.34 1vg1 h PRO 93 Ca -0.03 -0.01 -0.03 0.00 0.11 0.00 0.00 66.00 66.04 1vg1 h PRO 93 Cb 0.94 -0.04 -0.02 0.00 0.11 0.00 0.00 31.00 32.00 1vg1 h PRO 93 CO 0.50 0.11 0.04 -2.95 -0.21 0.00 0.00 178.00 175.49 1vg1 h ASN 94 N 0.17 0.37 1.22 -2.05 -1.07 -1.94 -1.73 115.58 110.55 1vg1 h ASN 94 Ca 0.56 -0.05 -0.04 0.00 0.07 0.00 0.00 56.30 56.84 1vg1 h ASN 94 Cb 1.87 -0.10 -0.01 0.00 -2.07 0.00 0.00 38.32 38.02 1vg1 h ASN 94 CO -0.13 0.40 -0.21 0.71 0.07 0.00 0.00 177.43 178.27 1vg1 h THR 95 N 0.40 0.44 0.06 6.14 1.35 -1.44 -2.83 112.91 117.04 1vg1 h THR 95 Ca 0.10 -1.22 -0.24 0.00 -0.55 0.00 0.00 66.41 64.50 1vg1 h THR 95 Cb 0.20 1.89 -0.01 0.00 -1.73 0.00 0.00 68.15 68.50 1vg1 h THR 95 CO -0.00 0.20 -1.09 0.15 -0.25 0.00 0.00 175.52 174.54 1vg1 h PHE 96 N 0.00 0.34 0.00 4.73 3.04 -1.40 -3.31 116.94 120.34 1vg1 h PHE 96 Ca -0.00 -0.23 -0.05 0.00 3.98 0.00 0.00 57.97 61.67 1vg1 h PHE 96 Cb 0.87 -0.02 -0.01 0.00 2.56 0.00 0.00 35.95 39.35 1vg1 h PHE 96 CO 0.00 1.14 -0.25 0.87 -2.02 0.00 0.00 178.31 178.05 1vg1 h LYS 97 N 0.07 0.00 -0.00 1.11 1.57 -1.10 -2.49 116.57 115.73 1vg1 h LYS 97 Ca -0.08 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.70 1vg1 h LYS 97 Cb 1.80 0.00 0.00 0.00 0.08 0.00 0.00 32.23 34.11 1vg1 h LYS 97 CO 0.17 0.25 -0.05 0.25 -0.57 0.00 0.00 179.45 179.50 1vg1 n THR 98 N -3.91 0.00 -0.18 -0.16 -2.24 -1.13 -4.19 114.28 102.48 1vg1 n THR 98 Ca -0.02 -0.05 0.06 0.00 -2.27 0.00 0.00 64.05 61.77 1vg1 n THR 98 Cb 0.33 -0.22 0.36 0.00 -2.10 0.00 0.00 70.33 68.70 1vg1 n THR 98 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 1vg1 h LEU 99 N 0.49 0.66 -0.66 3.22 3.38 -1.59 -1.56 115.31 119.26 1vg1 h LEU 99 Ca 0.00 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.88 1vg1 h LEU 99 Cb 0.26 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.85 1vg1 h LEU 99 CO 0.00 0.43 0.05 0.44 0.09 0.00 0.00 178.44 179.45 1vg1 h ASP 100 N 0.75 1.06 -0.76 -0.43 5.19 -1.82 -1.08 116.42 119.33 1vg1 h ASP 100 Ca 0.31 -0.28 -0.02 0.00 -0.62 0.00 0.00 57.03 56.41 1vg1 h ASP 100 Cb 0.25 -0.28 -0.03 0.00 0.18 0.00 0.00 39.33 39.44 1vg1 h ASP 100 CO -0.10 1.08 0.38 0.77 -3.12 0.00 0.00 179.24 178.25 1vg1 h SER 101 N 1.01 0.98 -0.32 6.45 4.64 -1.60 0.38 113.55 125.08 1vg1 h SER 101 Ca 0.19 -0.13 -0.05 0.00 -0.47 0.00 0.00 61.79 61.33 1vg1 h SER 101 Cb 0.51 -0.25 -0.01 0.00 -0.31 0.00 0.00 62.40 62.33 1vg1 h SER 101 CO 0.02 0.83 -0.00 -0.50 -0.87 0.00 0.00 176.83 176.31 1vg1 h TRP 102 N 1.06 0.62 -0.23 4.77 4.06 -1.15 -1.22 115.95 123.86 1vg1 h TRP 102 Ca 0.26 -0.11 -0.01 0.00 2.06 0.00 0.00 58.89 61.10 1vg1 h TRP 102 Cb 0.10 -0.16 -0.01 0.00 -1.00 0.00 0.00 29.16 28.09 1vg1 h TRP 102 CO 0.01 0.69 0.12 -0.09 -3.56 0.00 0.00 178.44 175.61 1vg1 h ARG 103 N 0.37 0.33 -0.66 0.49 2.43 -0.94 -1.91 114.38 114.49 1vg1 h ARG 103 Ca 0.09 -0.04 -0.06 0.00 -0.81 0.00 0.00 59.98 59.16 1vg1 h ARG 103 Cb 0.45 -0.06 -0.03 0.00 -0.42 0.00 0.00 29.97 29.91 1vg1 h ARG 103 CO 0.02 0.32 0.18 -0.44 -1.51 0.00 0.00 179.97 178.54 1vg1 h ASP 104 N 0.25 0.99 -0.55 -3.80 3.45 -0.91 -1.13 116.42 114.72 1vg1 h ASP 104 Ca 0.08 -0.22 -0.03 0.00 0.43 0.00 0.00 57.03 57.29 1vg1 h ASP 104 Cb 0.09 -0.26 -0.02 0.00 -0.56 0.00 0.00 39.33 38.58 1vg1 h ASP 104 CO -0.01 0.95 0.21 -0.08 -1.57 0.00 0.00 179.24 178.74 1vg1 h GLU 105 N 0.97 0.82 -0.56 3.56 4.81 -1.16 -0.93 114.58 122.09 1vg1 h GLU 105 Ca 0.21 -0.15 -0.02 0.00 -0.13 0.00 0.00 59.36 59.27 1vg1 h GLU 105 Cb 0.34 -0.13 -0.03 0.00 0.63 0.00 0.00 28.75 29.56 1vg1 h GLU 105 CO -0.00 0.72 0.27 0.35 -0.73 0.00 0.00 179.01 179.62 1vg1 h PHE 106 N 0.75 0.80 -0.90 0.92 3.57 -1.08 -0.65 116.94 120.34 1vg1 h PHE 106 Ca 0.18 -0.04 0.03 0.00 3.53 0.00 0.00 57.97 61.68 1vg1 h PHE 106 Cb 0.21 -0.25 -0.05 0.00 2.79 0.00 0.00 35.95 38.65 1vg1 h PHE 106 CO 0.01 0.61 0.58 -0.07 -2.23 0.00 0.00 178.31 177.21 1vg1 h LEU 107 N 0.76 0.97 -0.39 0.59 3.38 -0.78 0.91 115.31 120.75 1vg1 h LEU 107 Ca 0.19 -0.01 -0.07 0.00 0.09 0.00 0.00 57.88 58.08 1vg1 h LEU 107 Cb 0.11 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.63 1vg1 h LEU 107 CO -0.03 0.67 -0.05 0.40 0.09 0.00 0.00 178.44 179.52 1vg1 h ILE 108 N 1.13 1.27 -0.04 1.22 2.04 -0.79 0.22 117.51 122.56 1vg1 h ILE 108 Ca 0.36 -1.10 -0.17 0.00 1.00 0.00 0.00 64.86 64.95 1vg1 h ILE 108 Cb 0.00 1.19 0.01 0.00 -0.74 0.00 0.00 36.82 37.29 1vg1 h ILE 108 CO -0.12 0.37 -0.65 1.56 0.00 0.00 0.00 178.15 179.31 1vg1 h GLN 109 N 0.54 0.51 0.00 2.37 1.08 -0.77 -3.33 115.11 115.51 1vg1 h GLN 109 Ca 0.10 -0.49 -0.07 0.00 -1.45 0.00 0.00 58.65 56.74 1vg1 h GLN 109 Cb 0.55 0.13 -0.01 0.00 -0.05 0.00 0.00 27.48 28.09 1vg1 h GLN 109 CO 0.03 1.13 -0.57 0.00 -0.95 0.00 0.00 178.83 178.47 1vg1 h ALA 110 N 0.39 0.74 -6.62 3.87 0.00 -0.87 -3.41 119.26 113.36 1vg1 h ALA 110 Ca -0.07 -0.32 -0.52 0.00 0.00 0.00 0.00 54.91 54.00 1vg1 h ALA 110 Cb 1.33 0.01 -0.08 0.00 0.00 0.00 0.00 17.79 19.05 1vg1 h ALA 110 CO 0.13 0.40 -0.91 0.43 0.00 0.00 0.00 179.25 179.30 1vg1 n SER 111 N -3.06 -0.42 -4.75 0.00 7.64 0.77 -4.63 113.62 109.17 1vg1 n SER 111 Ca 0.01 -1.07 -0.37 0.00 1.01 0.00 0.00 58.87 58.44 1vg1 n SER 111 Cb 0.67 -2.72 0.04 0.00 -1.01 0.00 0.00 64.21 61.19 1vg1 n SER 111 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 1vg1 s PRO 112 N -6.72 3.01 0.42 1.43 0.04 -1.26 -4.92 135.00 126.99 1vg1 s PRO 112 Ca 0.04 2.07 0.21 0.00 0.04 0.00 0.00 61.00 63.36 1vg1 s PRO 112 Cb -0.02 -2.10 0.90 0.00 0.04 0.00 0.00 34.50 33.32 1vg1 s PRO 112 CO 0.91 -1.24 1.84 0.07 0.04 0.00 0.00 177.00 178.62 1vg1 h ARG 113 N 1.16 0.00 -2.37 4.56 0.11 -2.00 -3.33 114.38 112.52 1vg1 h ARG 113 Ca -0.51 0.00 -0.59 0.00 0.10 0.00 0.00 59.98 58.98 1vg1 h ARG 113 Cb 1.30 0.00 -0.40 0.00 1.11 0.00 0.00 29.97 31.98 1vg1 h ARG 113 CO 0.56 0.29 -0.85 -3.47 0.10 0.00 0.00 179.97 176.60 1vg1 n ASP 114 N -3.61 1.39 -0.30 0.08 4.64 -1.26 -4.99 116.55 112.50 1vg1 n ASP 114 Ca -0.01 -2.88 0.15 0.00 -1.38 0.00 0.00 54.79 50.67 1vg1 n ASP 114 Cb 0.42 -0.65 0.32 0.00 -1.04 0.00 0.00 41.12 40.17 1vg1 n ASP 114 CO 0.00 0.00 0.00 -0.65 -0.82 0.00 0.00 177.20 175.73 1vg1 h PRO 115 N 4.77 0.22 0.00 -0.67 0.11 -1.97 0.09 132.00 134.55 1vg1 h PRO 115 Ca 0.17 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.27 1vg1 h PRO 115 Cb 0.81 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 31.87 1vg1 h PRO 115 CO 0.57 0.15 0.00 0.39 -0.21 0.00 0.00 178.00 178.90 1vg1 n GLU 116 N -5.20 0.08 0.00 1.05 -0.58 -1.26 -3.32 120.64 111.41 1vg1 n GLU 116 Ca 0.23 0.05 0.02 0.00 -0.42 0.00 0.00 57.16 57.04 1vg1 n GLU 116 Cb 0.73 -1.50 -0.00 0.00 -0.57 0.00 0.00 31.44 30.10 1vg1 n GLU 116 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 1vg1 n ASN 117 N -1.45 0.72 -4.75 1.62 3.02 -0.11 -4.80 115.26 109.50 1vg1 n ASN 117 Ca 0.08 -0.86 -0.42 0.00 -0.03 0.00 0.00 54.58 53.35 1vg1 n ASN 117 Cb 0.28 0.50 -0.01 0.00 -0.61 0.00 0.00 39.78 39.95 1vg1 n ASN 117 CO 0.00 0.00 0.00 0.33 -2.62 0.00 0.00 177.26 174.97 1vg1 n PHE 118 N -0.44 2.84 -2.40 3.10 7.35 -0.45 -4.88 117.46 122.58 1vg1 n PHE 118 Ca 0.01 0.38 -0.43 0.00 -0.76 0.00 0.00 57.45 56.66 1vg1 n PHE 118 Cb 0.07 -2.54 -0.02 0.00 0.35 0.00 0.00 39.48 37.33 1vg1 n PHE 118 CO 0.00 0.00 0.00 -1.25 -0.76 0.00 0.00 176.76 174.75 1vg1 s PRO 119 N -1.41 3.84 0.12 -7.13 0.04 -1.26 -5.01 135.00 124.18 1vg1 s PRO 119 Ca 0.58 1.19 0.06 0.00 0.04 0.00 0.00 61.00 62.87 1vg1 s PRO 119 Cb -0.50 -3.92 -0.04 0.00 0.04 0.00 0.00 34.50 30.08 1vg1 s PRO 119 CO 0.57 -1.22 -0.02 -0.06 0.04 0.00 0.00 177.00 176.31 1vg1 s PHE 120 N 4.63 2.89 -0.04 0.56 0.40 -1.26 -1.72 117.98 123.43 1vg1 s PHE 120 Ca 0.58 -0.09 0.00 0.00 -0.60 0.00 0.00 56.93 56.82 1vg1 s PHE 120 Cb -0.16 -1.47 0.02 0.00 0.51 0.00 0.00 43.02 41.92 1vg1 s PHE 120 CO 0.25 0.48 -0.02 0.08 0.70 0.00 0.00 175.22 176.71 1vg1 s VAL 121 N -1.40 0.39 -0.15 -0.44 1.01 -0.88 -3.93 120.40 115.00 1vg1 s VAL 121 Ca 0.25 -0.01 -0.05 0.00 0.00 0.00 0.00 61.98 62.17 1vg1 s VAL 121 Cb -0.11 -0.46 -0.04 0.00 0.00 0.00 0.00 36.38 35.77 1vg1 s VAL 121 CO 0.17 0.21 0.03 -0.69 0.00 0.00 0.00 175.10 174.82 1vg1 s VAL 122 N 1.14 4.55 -0.21 2.92 1.01 -0.67 -0.26 120.40 128.88 1vg1 s VAL 122 Ca -0.08 -0.13 -0.01 0.00 0.00 0.00 0.00 61.98 61.76 1vg1 s VAL 122 Cb -0.14 -3.01 0.01 0.00 0.00 0.00 0.00 36.38 33.24 1vg1 s VAL 122 CO -0.01 0.51 -0.12 -0.76 0.00 0.00 0.00 175.10 174.71 1vg1 s LEU 123 N 0.03 2.57 -0.56 3.92 1.43 0.20 -1.38 118.68 124.88 1vg1 s LEU 123 Ca 0.04 -0.60 -0.20 0.00 -1.03 0.00 0.00 54.13 52.35 1vg1 s LEU 123 Cb -0.12 -1.60 0.08 0.00 0.03 0.00 0.00 46.19 44.57 1vg1 s LEU 123 CO 0.01 -0.03 0.71 -0.83 0.23 0.00 0.00 176.35 176.44 1vg1 s GLY 124 N 1.36 1.72 0.39 -3.19 0.00 0.37 -1.81 107.32 106.16 1vg1 s GLY 124 Ca 0.04 -1.96 0.01 0.00 0.00 0.00 0.00 44.72 42.82 1vg1 s GLY 124 CO -0.08 1.60 0.59 0.21 0.00 0.00 0.00 173.10 175.42 1vg1 s ASN 125 N 3.23 6.04 -0.34 1.64 2.47 -0.30 -0.78 114.94 126.90 1vg1 s ASN 125 Ca 0.15 0.29 -0.00 0.00 0.42 0.00 0.00 52.86 53.71 1vg1 s ASN 125 Cb -0.21 -1.70 0.00 0.00 -1.45 0.00 0.00 41.25 37.89 1vg1 s ASN 125 CO 0.09 -0.49 0.01 0.29 -3.72 0.00 0.00 177.10 173.28 1vg1 n LYS 126 N -1.89 -0.39 0.07 0.43 5.02 -0.32 -1.37 118.16 119.72 1vg1 n LYS 126 Ca -0.02 0.20 0.07 0.00 -2.02 0.00 0.00 58.31 56.54 1vg1 n LYS 126 Cb 0.57 -3.89 0.33 0.00 -0.02 0.00 0.00 35.03 32.03 1vg1 n LYS 126 CO 0.00 0.00 0.00 0.44 -0.52 0.00 0.00 177.40 177.32 1vg1 n ILE 127 N -3.95 1.28 0.31 -0.18 -5.35 -0.93 -1.33 119.36 109.21 1vg1 n ILE 127 Ca -0.05 0.46 0.15 0.00 -0.27 0.00 0.00 62.75 63.04 1vg1 n ILE 127 Cb 0.54 -1.40 0.66 0.00 -1.74 0.00 0.00 39.64 37.70 1vg1 n ILE 127 CO 0.00 0.00 0.00 -2.24 -1.76 0.00 0.00 176.55 172.55 1vg1 h ASP 128 N 0.00 0.00 -2.58 7.28 3.04 -1.93 -3.37 116.42 118.86 1vg1 h ASP 128 Ca 0.00 0.00 -0.65 0.00 -3.24 0.00 0.00 57.03 53.14 1vg1 h ASP 128 Cb 0.13 0.00 -0.16 0.00 -1.04 0.00 0.00 39.33 38.26 1vg1 h ASP 128 CO 0.00 0.00 0.60 -0.76 -2.04 0.00 0.00 179.24 177.04 1vg1 s LEU 129 N -5.14 4.65 0.41 0.15 1.43 -0.44 -4.93 118.68 114.82 1vg1 s LEU 129 Ca 0.01 -1.34 0.23 0.00 -1.03 0.00 0.00 54.13 52.00 1vg1 s LEU 129 Cb 0.09 -2.40 1.25 0.00 0.03 0.00 0.00 46.19 45.15 1vg1 s LEU 129 CO 0.39 -1.31 1.69 1.05 0.23 0.00 0.00 176.35 178.41 1vg1 h GLU 130 N 9.33 0.24 -2.66 1.70 4.11 -1.87 -3.17 114.58 122.27 1vg1 h GLU 130 Ca -0.15 -0.01 -0.56 0.00 0.07 0.00 0.00 59.36 58.70 1vg1 h GLU 130 Cb 1.06 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 30.23 1vg1 h GLU 130 CO 1.16 0.16 2.48 0.09 0.07 0.00 0.00 179.01 182.96 1vg1 n ASN 131 N -4.70 7.74 -4.73 3.06 3.02 -1.26 -4.96 115.26 113.42 1vg1 n ASN 131 Ca 0.31 -2.67 -0.37 0.00 -0.03 0.00 0.00 54.58 51.82 1vg1 n ASN 131 Cb 1.14 -1.48 0.07 0.00 -0.61 0.00 0.00 39.78 38.89 1vg1 n ASN 131 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1vg1 s ARG 132 N 1.17 2.61 -0.01 3.52 1.70 -1.20 -4.83 118.95 121.92 1vg1 s ARG 132 Ca 0.66 2.11 0.10 0.00 -0.47 0.00 0.00 55.73 58.12 1vg1 s ARG 132 Cb 0.22 -1.90 -0.14 0.00 -0.57 0.00 0.00 34.95 32.57 1vg1 s ARG 132 CO -0.06 -1.56 0.25 1.04 -1.08 0.00 0.00 175.30 173.89 1vg1 n GLN 133 N -1.79 1.18 -4.21 3.89 1.13 0.12 -4.94 117.38 112.76 1vg1 n GLN 133 Ca 0.15 -0.07 -0.34 0.00 -1.94 0.00 0.00 57.00 54.80 1vg1 n GLN 133 Cb 0.48 -1.16 -0.12 0.00 0.11 0.00 0.00 30.24 29.55 1vg1 n GLN 133 CO 0.00 0.00 0.00 0.08 -1.44 0.00 0.00 177.06 175.70 1vg1 s VAL 134 N -2.47 3.91 0.34 5.09 1.01 -0.09 -4.85 120.40 123.34 1vg1 s VAL 134 Ca -0.02 -0.34 -0.27 0.00 0.00 0.00 0.00 61.98 61.36 1vg1 s VAL 134 Cb 0.06 -2.74 -0.09 0.00 0.00 0.00 0.00 36.38 33.61 1vg1 s VAL 134 CO 0.39 0.46 1.08 0.00 0.00 0.00 0.00 175.10 177.03 1vg1 s ALA 135 N 0.73 3.24 0.17 5.51 0.00 -1.26 -4.95 121.76 125.19 1vg1 s ALA 135 Ca -0.01 0.81 -0.14 0.00 0.00 0.00 0.00 51.96 52.62 1vg1 s ALA 135 Cb -0.14 -3.31 0.10 0.00 0.00 0.00 0.00 23.12 19.77 1vg1 s ALA 135 CO 0.02 -0.22 1.77 1.15 0.00 0.00 0.00 175.76 178.49 1vg1 h THR 136 N 2.62 0.94 -0.69 0.00 2.02 -2.00 -2.38 112.91 113.42 1vg1 h THR 136 Ca -0.48 -0.14 0.06 0.00 0.77 0.00 0.00 66.41 66.62 1vg1 h THR 136 Cb 1.22 0.49 -0.04 0.00 -1.74 0.00 0.00 68.15 68.08 1vg1 h THR 136 CO 0.64 0.08 0.46 0.50 0.37 0.00 0.00 175.52 177.57 1vg1 h LYS 137 N 0.41 0.72 -0.24 6.66 3.64 -1.99 0.94 116.57 126.71 1vg1 h LYS 137 Ca 0.19 -0.04 -0.09 0.00 -1.27 0.00 0.00 60.65 59.44 1vg1 h LYS 137 Cb 0.12 -0.16 -0.00 0.00 -0.41 0.00 0.00 32.23 31.78 1vg1 h LYS 137 CO -0.15 0.47 -0.19 -0.09 -2.27 0.00 0.00 179.45 177.22 1vg1 h ARG 138 N 0.74 0.55 -0.42 1.90 2.43 -1.83 -0.80 114.38 116.94 1vg1 h ARG 138 Ca 0.29 -0.27 -0.13 0.00 -0.81 0.00 0.00 59.98 59.06 1vg1 h ARG 138 Cb 0.22 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.76 1vg1 h ARG 138 CO -0.09 0.85 -0.23 0.00 -1.51 0.00 0.00 179.97 178.99 1vg1 h ALA 139 N 0.69 0.60 -0.55 2.80 0.00 -0.98 -2.22 119.26 119.59 1vg1 h ALA 139 Ca 0.04 -0.39 -0.03 0.00 0.00 0.00 0.00 54.91 54.54 1vg1 h ALA 139 Cb 0.73 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.35 1vg1 h ALA 139 CO 0.05 0.59 0.24 1.96 0.00 0.00 0.00 179.25 182.09 1vg1 h GLN 140 N 0.73 0.78 -0.46 0.00 4.20 -0.72 -2.09 115.11 117.55 1vg1 h GLN 140 Ca 0.09 -0.11 -0.08 0.00 0.06 0.00 0.00 58.65 58.61 1vg1 h GLN 140 Cb 0.80 -0.14 -0.02 0.00 0.30 0.00 0.00 27.48 28.42 1vg1 h GLN 140 CO 0.07 0.63 -0.04 0.00 -0.67 0.00 0.00 178.83 178.82 1vg1 h ALA 141 N 1.48 0.63 -0.47 3.87 0.00 -1.00 0.10 119.26 123.88 1vg1 h ALA 141 Ca 0.19 -0.30 0.02 0.00 0.00 0.00 0.00 54.91 54.82 1vg1 h ALA 141 Cb 0.12 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 1vg1 h ALA 141 CO -0.02 0.46 0.28 2.35 0.00 0.00 0.00 179.25 182.31 1vg1 h TRP 142 N 0.69 0.52 -0.45 0.00 7.01 -1.07 -0.89 115.95 121.76 1vg1 h TRP 142 Ca 0.13 0.02 -0.08 0.00 2.11 0.00 0.00 58.89 61.06 1vg1 h TRP 142 Cb 0.56 -0.17 -0.02 0.00 -2.10 0.00 0.00 29.16 27.44 1vg1 h TRP 142 CO 0.04 0.30 -0.03 0.00 -2.79 0.00 0.00 178.44 175.96 1vg1 h TYR 144 N 0.66 1.10 0.00 0.00 3.20 -0.49 -1.36 116.97 120.07 1vg1 h TYR 144 Ca 0.12 0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.00 1vg1 h TYR 144 Cb 0.54 -0.37 0.00 0.00 1.54 0.00 0.00 36.73 38.44 1vg1 h TYR 144 CO 0.04 0.72 0.00 -1.13 -1.64 0.00 0.00 178.16 176.15 1vg1 n SER 145 N -4.38 0.00 -2.67 -2.11 3.41 -0.37 -1.88 113.62 105.62 1vg1 n SER 145 Ca 0.09 -0.19 -0.30 0.00 -0.26 0.00 0.00 58.87 58.21 1vg1 n SER 145 Cb 0.05 -0.19 0.00 0.00 -0.26 0.00 0.00 64.21 63.81 1vg1 n SER 145 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1vg1 n LYS 146 N -1.19 3.36 -3.59 4.33 4.76 -0.74 -4.85 118.16 120.25 1vg1 n LYS 146 Ca 0.11 -4.38 -0.23 0.00 -2.87 0.00 0.00 58.31 50.93 1vg1 n LYS 146 Cb 0.12 -2.26 0.08 0.00 -1.84 0.00 0.00 35.03 31.12 1vg1 n LYS 146 CO 0.00 0.00 0.00 -1.71 -1.37 0.00 0.00 177.40 174.32 1vg1 n ASN 147 N -0.44 -5.29 -2.63 4.39 5.15 -1.15 -3.95 115.26 111.33 1vg1 n ASN 147 Ca 0.41 -0.58 -0.11 0.00 -0.60 0.00 0.00 54.58 53.70 1vg1 n ASN 147 Cb 0.53 -4.95 0.06 0.00 -0.53 0.00 0.00 39.78 34.89 1vg1 n ASN 147 CO 0.00 0.00 0.00 -3.20 1.40 0.00 0.00 177.26 175.46 1vg1 n ASN 148 N -3.03 -2.25 -4.75 1.20 4.05 -0.79 -4.97 115.26 104.73 1vg1 n ASN 148 Ca -0.06 -0.42 -0.41 0.00 0.45 0.00 0.00 54.58 54.14 1vg1 n ASN 148 Cb 0.58 -3.60 -0.02 0.00 1.23 0.00 0.00 39.78 37.96 1vg1 n ASN 148 CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 177.26 173.58 1vg1 s ILE 149 N -3.24 2.78 0.39 -1.44 1.01 -0.59 -4.92 121.20 115.19 1vg1 s ILE 149 Ca 0.02 0.67 -0.27 0.00 0.00 0.00 0.00 60.65 61.08 1vg1 s ILE 149 Cb -0.00 -3.43 -0.09 0.00 0.01 0.00 0.00 42.46 38.95 1vg1 s ILE 149 CO 0.49 0.11 1.33 -2.84 0.00 0.00 0.00 174.94 174.04 1vg1 s PRO 150 N -0.55 4.02 -0.04 2.79 0.02 -1.25 -4.52 135.00 135.47 1vg1 s PRO 150 Ca 0.57 2.24 0.04 0.00 0.02 0.00 0.00 61.00 63.87 1vg1 s PRO 150 Cb -0.40 -2.82 -0.00 0.00 0.02 0.00 0.00 34.50 31.29 1vg1 s PRO 150 CO 0.44 -0.48 -0.18 -0.47 -0.33 0.00 0.00 177.00 175.99 1vg1 s TYR 151 N -1.22 1.76 -0.00 6.54 5.04 -1.26 -1.67 117.35 126.53 1vg1 s TYR 151 Ca 0.55 -0.50 0.02 0.00 -2.44 0.00 0.00 57.07 54.71 1vg1 s TYR 151 Cb -0.40 -1.18 -0.01 0.00 0.35 0.00 0.00 41.96 40.73 1vg1 s TYR 151 CO 0.52 -0.17 -0.08 -0.06 -1.34 0.00 0.00 175.55 174.43 1vg1 s PHE 152 N 0.02 0.68 -0.19 4.97 0.40 -0.48 -4.99 117.98 118.38 1vg1 s PHE 152 Ca -0.04 -0.16 -0.07 0.00 -0.60 0.00 0.00 56.93 56.07 1vg1 s PHE 152 Cb -0.12 -0.44 -0.03 0.00 0.51 0.00 0.00 43.02 42.94 1vg1 s PHE 152 CO 0.02 -0.01 0.04 -1.21 0.70 0.00 0.00 175.22 174.76 1vg1 s GLU 153 N -0.31 3.82 0.22 0.44 2.02 -1.26 -0.47 118.70 123.16 1vg1 s GLU 153 Ca 0.02 -0.42 0.03 0.00 0.02 0.00 0.00 54.97 54.62 1vg1 s GLU 153 Cb -0.04 -3.18 -0.05 0.00 0.10 0.00 0.00 34.13 30.97 1vg1 s GLU 153 CO -0.00 0.15 -0.01 0.95 0.02 0.00 0.00 175.26 176.37 1vg1 s THR 154 N 0.69 1.02 -0.24 3.63 -4.23 0.04 -4.62 115.64 111.94 1vg1 s THR 154 Ca 0.02 -2.03 -0.03 0.00 -1.18 0.00 0.00 61.69 58.47 1vg1 s THR 154 Cb -0.14 -2.31 0.08 0.00 1.34 0.00 0.00 72.50 71.48 1vg1 s THR 154 CO 0.02 -0.35 0.08 -0.55 -0.54 0.00 0.00 174.62 173.27 1vg1 s SER 155 N -3.29 3.20 0.32 3.99 0.15 -0.73 -1.17 113.70 116.18 1vg1 s SER 155 Ca 0.28 -1.07 0.07 0.00 0.70 0.00 0.00 55.95 55.93 1vg1 s SER 155 Cb 0.05 -0.54 0.55 0.00 -1.71 0.00 0.00 66.02 64.37 1vg1 s SER 155 CO 0.08 -0.37 1.77 0.00 1.20 0.00 0.00 173.24 175.92 1vg1 h ALA 156 N 8.27 1.23 -0.33 5.45 0.00 -1.91 0.29 119.26 132.25 1vg1 h ALA 156 Ca -0.16 -0.35 -0.02 0.00 0.00 0.00 0.00 54.91 54.38 1vg1 h ALA 156 Cb 1.08 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.76 1vg1 h ALA 156 CO 0.38 0.52 0.12 -0.22 0.00 0.00 0.00 179.25 180.04 1vg1 h LYS 157 N 0.22 0.51 -0.61 0.00 3.64 -1.94 -3.17 116.57 115.22 1vg1 h LYS 157 Ca 0.03 -0.10 0.00 0.00 -1.27 0.00 0.00 60.65 59.31 1vg1 h LYS 157 Cb 0.67 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.42 1vg1 h LYS 157 CO 0.05 0.53 0.00 0.39 -2.27 0.00 0.00 179.45 178.15 1vg1 n GLU 158 N -4.68 2.87 -3.66 1.90 1.02 -1.18 -4.96 120.64 111.95 1vg1 n GLU 158 Ca -0.01 -2.51 -0.23 0.00 -0.02 0.00 0.00 57.16 54.39 1vg1 n GLU 158 Cb 0.16 -1.51 0.06 0.00 -0.02 0.00 0.00 31.44 30.12 1vg1 n GLU 158 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1vg1 n ALA 159 N 1.23 -1.67 -2.68 0.62 0.00 -0.01 -4.97 120.51 113.04 1vg1 n ALA 159 Ca 0.21 0.09 -0.36 0.00 0.00 0.00 0.00 53.44 53.37 1vg1 n ALA 159 Cb 0.59 -3.55 -0.09 0.00 0.00 0.00 0.00 19.45 16.40 1vg1 n ALA 159 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1vg1 s ILE 160 N -3.42 5.32 -0.63 0.00 1.01 -0.61 -4.45 121.20 118.43 1vg1 s ILE 160 Ca 0.30 0.17 0.00 0.00 0.00 0.00 0.00 60.65 61.12 1vg1 s ILE 160 Cb -0.14 -3.48 0.00 0.00 0.01 0.00 0.00 42.46 38.85 1vg1 s ILE 160 CO 0.78 0.36 0.00 0.59 0.00 0.00 0.00 174.94 176.66 1vg1 n ASN 161 N 4.21 -5.11 -0.06 3.58 3.02 -1.26 -1.77 115.26 117.86 1vg1 n ASN 161 Ca -0.15 0.15 -0.14 0.00 -0.03 0.00 0.00 54.58 54.41 1vg1 n ASN 161 Cb 0.52 -3.51 -0.07 0.00 -0.61 0.00 0.00 39.78 36.11 1vg1 n ASN 161 CO 0.00 0.00 0.00 0.58 -2.62 0.00 0.00 177.26 175.22 1vg1 h VAL 162 N 0.00 1.34 -0.55 2.41 2.07 -1.87 -1.17 116.25 118.48 1vg1 h VAL 162 Ca -0.12 -1.43 -0.09 0.00 0.82 0.00 0.00 66.70 65.88 1vg1 h VAL 162 Cb 0.98 1.86 -0.02 0.00 -1.52 0.00 0.00 31.29 32.59 1vg1 h VAL 162 CO 0.18 0.43 0.00 -0.33 0.02 0.00 0.00 177.57 177.87 1vg1 h GLU 163 N 0.11 0.95 -0.43 1.57 4.39 -1.89 -1.81 114.58 117.47 1vg1 h GLU 163 Ca 0.02 -0.28 -0.01 0.00 0.34 0.00 0.00 59.36 59.43 1vg1 h GLU 163 Cb 0.79 -0.10 -0.02 0.00 -0.10 0.00 0.00 28.75 29.32 1vg1 h GLU 163 CO 0.05 0.94 0.24 0.37 -1.16 0.00 0.00 179.01 179.45 1vg1 h GLN 164 N 0.87 0.59 -0.09 2.33 4.15 -1.94 -1.49 115.11 119.54 1vg1 h GLN 164 Ca 0.16 -0.06 -0.00 0.00 0.77 0.00 0.00 58.65 59.51 1vg1 h GLN 164 Cb 0.51 -0.12 -0.00 0.00 0.21 0.00 0.00 27.48 28.08 1vg1 h GLN 164 CO 0.03 0.46 0.04 0.00 -1.93 0.00 0.00 178.83 177.42 1vg1 h ALA 165 N 1.10 0.12 0.00 3.38 0.00 -1.05 -2.82 119.26 119.99 1vg1 h ALA 165 Ca 0.15 -0.09 -0.03 0.00 0.00 0.00 0.00 54.91 54.94 1vg1 h ALA 165 Cb 0.03 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 17.78 1vg1 h ALA 165 CO -0.03 -0.30 -0.15 0.74 0.00 0.00 0.00 179.25 179.51 1vg1 h PHE 166 N -0.01 0.00 -0.51 0.00 -1.00 -1.25 -0.93 116.94 113.24 1vg1 h PHE 166 Ca 0.03 0.00 -0.11 0.00 2.81 0.00 0.00 57.97 60.70 1vg1 h PHE 166 Cb 0.16 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 39.70 1vg1 h PHE 166 CO -0.02 0.15 -0.12 1.96 -1.61 0.00 0.00 178.31 178.67 1vg1 h GLN 167 N 0.00 0.96 -0.15 1.51 1.08 -1.03 0.14 115.11 117.62 1vg1 h GLN 167 Ca -0.00 -0.35 -0.21 0.00 -1.45 0.00 0.00 58.65 56.64 1vg1 h GLN 167 Cb 0.55 -0.06 0.00 0.00 -0.05 0.00 0.00 27.48 27.92 1vg1 h GLN 167 CO 0.02 1.02 -0.73 1.15 -0.95 0.00 0.00 178.83 179.34 1vg1 h THR 168 N 0.85 1.31 -0.40 -0.54 2.02 -1.22 -1.61 112.91 113.32 1vg1 h THR 168 Ca 0.13 -1.98 0.03 0.00 0.77 0.00 0.00 66.41 65.36 1vg1 h THR 168 Cb 0.67 1.96 -0.04 0.00 -1.74 0.00 0.00 68.15 69.01 1vg1 h THR 168 CO 0.05 0.62 0.19 0.40 0.37 0.00 0.00 175.52 177.15 1vg1 h ILE 169 N 0.48 0.96 -0.26 3.11 2.04 -0.80 -0.34 117.51 122.70 1vg1 h ILE 169 Ca -0.04 -0.13 0.01 0.00 1.00 0.00 0.00 64.86 65.70 1vg1 h ILE 169 Cb 1.33 0.54 -0.02 0.00 -0.74 0.00 0.00 36.82 37.94 1vg1 h ILE 169 CO 0.14 0.07 0.15 0.00 0.00 0.00 0.00 178.15 178.52 1vg1 h ALA 170 N 1.22 0.32 -0.76 1.87 0.00 -0.63 -0.21 119.26 121.07 1vg1 h ALA 170 Ca 0.17 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 55.04 1vg1 h ALA 170 Cb 0.09 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.77 1vg1 h ALA 170 CO -0.13 -0.23 0.32 -0.09 0.00 0.00 0.00 179.25 179.12 1vg1 h ARG 171 N 0.31 1.13 0.00 0.00 2.43 -0.95 -0.70 114.38 116.61 1vg1 h ARG 171 Ca 0.10 -0.20 -0.19 0.00 -0.81 0.00 0.00 59.98 58.89 1vg1 h ARG 171 Cb -0.01 -0.19 -0.02 0.00 -0.42 0.00 0.00 29.97 29.34 1vg1 h ARG 171 CO -0.05 0.91 -0.86 -0.91 -1.51 0.00 0.00 179.97 177.56 1vg1 h ASN 172 N 1.10 0.13 -0.54 -3.80 2.35 -0.90 -1.58 115.58 112.32 1vg1 h ASN 172 Ca 0.26 -0.10 -0.11 0.00 -0.55 0.00 0.00 56.30 55.79 1vg1 h ASN 172 Cb 0.19 -0.04 -0.02 0.00 0.05 0.00 0.00 38.32 38.51 1vg1 h ASN 172 CO -0.02 0.92 -0.08 0.00 -1.65 0.00 0.00 177.43 176.60 1vg1 h ALA 173 N 1.07 0.81 -0.68 -0.83 0.00 -0.90 -2.13 119.26 116.59 1vg1 h ALA 173 Ca -0.03 -0.34 -0.03 0.00 0.00 0.00 0.00 54.91 54.51 1vg1 h ALA 173 Cb 1.49 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 19.05 1vg1 h ALA 173 CO 0.12 0.67 0.30 1.25 0.00 0.00 0.00 179.25 181.58 1vg1 h LEU 174 N 0.92 0.92 -0.64 0.00 5.85 -0.87 0.95 115.31 122.44 1vg1 h LEU 174 Ca 0.15 -0.16 -0.00 0.00 0.84 0.00 0.00 57.88 58.71 1vg1 h LEU 174 Cb 0.64 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 41.40 1vg1 h LEU 174 CO 0.04 0.82 0.40 0.11 -0.34 0.00 0.00 178.44 179.47 1vg1 h LYS 175 N 0.96 0.86 -0.23 1.25 1.57 -1.17 0.71 116.57 120.53 1vg1 h LYS 175 Ca 0.23 -0.07 -0.05 0.00 -1.87 0.00 0.00 60.65 58.89 1vg1 h LYS 175 Cb 0.17 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.29 1vg1 h LYS 175 CO -0.02 0.61 -0.06 0.37 -0.57 0.00 0.00 179.45 179.78 1vg1 h GLN 176 N 0.87 0.44 -0.84 3.15 5.75 -0.98 -2.08 115.11 121.42 1vg1 h GLN 176 Ca 0.23 -0.17 0.00 0.00 -0.15 0.00 0.00 58.65 58.56 1vg1 h GLN 176 Cb -0.04 -0.02 -0.04 0.00 1.07 0.00 0.00 27.48 28.44 1vg1 h GLN 176 CO -0.05 0.68 0.54 1.49 -2.65 0.00 0.00 178.83 178.84 1vg1 h GLU 177 N 0.18 1.12 -0.25 1.69 4.57 -0.62 -1.21 114.58 120.06 1vg1 h GLU 177 Ca 0.06 -0.08 -0.01 0.00 -1.18 0.00 0.00 59.36 58.14 1vg1 h GLU 177 Cb 0.52 -0.25 -0.01 0.00 -0.16 0.00 0.00 28.75 28.85 1vg1 h GLU 177 CO 0.02 0.76 0.11 1.15 -1.18 0.00 0.00 179.01 179.87 1vg1 h THR 178 N 1.15 1.16 -0.44 0.32 2.02 -0.75 -0.56 112.91 115.80 1vg1 h THR 178 Ca 0.31 -0.47 0.07 0.00 0.77 0.00 0.00 66.41 67.10 1vg1 h THR 178 Cb -0.10 1.01 -0.06 0.00 -1.74 0.00 0.00 68.15 67.26 1vg1 h THR 178 CO -0.06 0.16 0.07 -0.08 0.37 0.00 0.00 175.52 175.98 1vg1 h GLU 179 N 0.25 0.19 -0.33 6.66 4.57 -0.91 0.18 114.58 125.20 1vg1 h GLU 179 Ca 0.08 -0.01 -0.01 0.00 -1.18 0.00 0.00 59.36 58.24 1vg1 h GLU 179 Cb 0.15 -0.04 -0.02 0.00 -0.16 0.00 0.00 28.75 28.68 1vg1 h GLU 179 CO -0.01 0.13 0.18 0.28 -1.18 0.00 0.00 179.01 178.40 1vg1 h VAL 180 N 0.20 1.14 -0.36 0.32 2.07 -0.95 -2.51 116.25 116.16 1vg1 h VAL 180 Ca 0.22 -0.38 -0.13 0.00 0.82 0.00 0.00 66.70 67.23 1vg1 h VAL 180 Cb 0.29 0.79 -0.01 0.00 -1.52 0.00 0.00 31.29 30.84 1vg1 h VAL 180 CO -0.30 0.14 -0.28 -0.33 0.02 0.00 0.00 177.57 176.83 1vg1 h GLU 181 N 0.41 0.83 0.00 1.57 5.08 -0.76 0.25 114.58 121.96 1vg1 h GLU 181 Ca 0.12 -0.41 -0.09 0.00 -1.00 0.00 0.00 59.36 57.99 1vg1 h GLU 181 Cb 0.07 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.31 1vg1 h GLU 181 CO -0.02 1.04 -0.41 -0.07 -1.00 0.00 0.00 179.01 178.56 1vg1 h LEU 182 N 0.62 0.00 -3.02 1.33 3.38 -0.63 -3.11 115.31 113.88 1vg1 h LEU 182 Ca 0.07 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.04 1vg1 h LEU 182 Cb 0.85 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.60 1vg1 h LEU 182 CO 0.07 0.41 0.00 -1.22 0.09 0.00 0.00 178.44 177.79 1vg1 n TYR 183 N -3.91 0.28 -4.07 1.13 4.02 -0.95 -4.99 117.16 108.67 1vg1 n TYR 183 Ca -0.01 -0.69 -0.42 0.00 -0.01 0.00 0.00 57.90 56.77 1vg1 n TYR 183 Cb 0.46 -0.12 0.01 0.00 -0.02 0.00 0.00 39.34 39.67 1vg1 n TYR 183 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 176.86 174.14 1vg1 n ASN 184 N -0.48 -3.36 -0.15 7.72 5.15 -0.28 -5.02 115.26 118.84 1vg1 n ASN 184 Ca 0.10 -1.18 0.15 0.00 -0.60 0.00 0.00 54.58 53.05 1vg1 n ASN 184 Cb 0.50 -1.42 0.82 0.00 -0.53 0.00 0.00 39.78 39.15 1vg1 n ASN 184 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04