#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vgq s LYS 3 N 0.00 4.35 0.29 -0.78 1.02 -1.26 -4.73 119.74 118.63 1vgq s LYS 3 Ca 0.00 0.73 0.04 0.00 0.02 0.00 0.00 55.97 56.77 1vgq s LYS 3 Cb 0.00 -3.38 0.73 0.00 -0.52 0.00 0.00 37.83 34.66 1vgq s LYS 3 CO 0.00 0.27 1.73 -1.35 -0.92 0.00 0.00 175.35 175.08 1vgq h PRO 4 N 6.03 0.52 -0.26 -1.68 0.11 -1.93 -2.67 132.00 132.12 1vgq h PRO 4 Ca -0.44 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1vgq h PRO 4 Cb 1.20 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.19 1vgq h PRO 4 CO 0.72 0.34 0.00 1.28 -0.21 0.00 0.00 178.00 180.13 1vgq n LEU 5 N -4.94 3.40 -4.61 2.35 4.77 -0.17 -5.00 117.00 112.79 1vgq n LEU 5 Ca 0.22 -2.65 -0.51 0.00 -0.03 0.00 0.00 56.01 53.05 1vgq n LEU 5 Cb 0.62 -0.41 -0.06 0.00 -2.33 0.00 0.00 43.42 41.24 1vgq n LEU 5 CO 0.16 0.69 0.99 -0.67 -1.33 0.00 0.00 177.39 177.23 1vgq n ASP 6 N -0.23 2.01 0.00 -1.43 -0.08 -1.01 -1.55 116.55 114.26 1vgq n ASP 6 Ca 0.17 1.11 0.00 0.00 -1.51 0.00 0.00 54.79 54.56 1vgq n ASP 6 Cb 0.70 -1.24 0.00 0.00 2.34 0.00 0.00 41.12 42.92 1vgq n ASP 6 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1vgq n GLY 7 N 2.80 1.41 3.66 0.27 0.00 -1.26 -4.99 105.19 107.09 1vgq n GLY 7 Ca 0.18 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.80 1vgq n GLY 7 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1vgq s ILE 8 N -3.28 5.00 -0.26 -0.61 -1.09 -0.60 -4.97 121.20 115.39 1vgq s ILE 8 Ca 0.00 1.23 -0.11 0.00 -2.23 0.00 0.00 60.65 59.54 1vgq s ILE 8 Cb 0.00 -3.96 -0.05 0.00 -1.58 0.00 0.00 42.46 36.87 1vgq s ILE 8 CO 0.00 0.09 0.17 0.20 -1.23 0.00 0.00 174.94 174.18 1vgq s ASN 9 N 1.22 6.04 -0.22 3.58 -0.87 -1.26 -1.14 114.94 122.28 1vgq s ASN 9 Ca 0.29 0.04 -0.03 0.00 -1.57 0.00 0.00 52.86 51.60 1vgq s ASN 9 Cb -0.16 -2.11 0.00 0.00 -0.02 0.00 0.00 41.25 38.97 1vgq s ASN 9 CO 0.10 0.00 -0.06 -0.69 -2.57 0.00 0.00 177.10 173.88 1vgq s VAL 10 N 1.43 3.10 -0.48 1.60 1.01 -0.09 -0.38 120.40 126.58 1vgq s VAL 10 Ca 0.07 -0.68 -0.20 0.00 0.00 0.00 0.00 61.98 61.18 1vgq s VAL 10 Cb -0.15 -2.44 0.04 0.00 0.00 0.00 0.00 36.38 33.83 1vgq s VAL 10 CO 0.08 0.38 0.65 -0.22 0.00 0.00 0.00 175.10 175.99 1vgq s LEU 11 N 1.42 4.70 -0.50 3.92 2.96 0.81 -1.39 118.68 130.61 1vgq s LEU 11 Ca 0.04 -0.63 -0.06 0.00 -0.22 0.00 0.00 54.13 53.26 1vgq s LEU 11 Cb -0.15 -2.58 0.13 0.00 0.50 0.00 0.00 46.19 44.09 1vgq s LEU 11 CO -0.05 -0.86 0.33 -0.62 -1.32 0.00 0.00 176.35 173.83 1vgq s ASP 12 N 2.39 5.49 0.00 3.68 2.15 0.06 -1.67 116.67 128.77 1vgq s ASP 12 Ca 0.19 -2.20 0.31 0.00 0.43 0.00 0.00 52.55 51.27 1vgq s ASP 12 Cb -0.17 -1.92 1.61 0.00 -0.30 0.00 0.00 42.92 42.15 1vgq s ASP 12 CO 0.15 -0.56 2.06 0.49 -0.17 0.00 0.00 175.17 177.14 1vgq n PHE 13 N 4.43 0.00 -1.40 -5.34 3.01 -0.09 -0.58 117.46 117.50 1vgq n PHE 13 Ca -0.01 -0.00 -0.31 0.00 1.01 0.00 0.00 57.45 58.14 1vgq n PHE 13 Cb 0.41 0.00 0.08 0.00 -0.01 0.00 0.00 39.48 39.96 1vgq n PHE 13 CO 0.00 0.00 0.00 0.95 1.01 0.00 0.00 176.76 178.72 1vgq s THR 14 N -2.00 3.50 0.24 4.37 -4.23 -1.24 -4.67 115.64 111.61 1vgq s THR 14 Ca 0.44 0.49 -0.10 0.00 -1.18 0.00 0.00 61.69 61.34 1vgq s THR 14 Cb 0.22 -3.09 -0.01 0.00 1.34 0.00 0.00 72.50 70.95 1vgq s THR 14 CO 0.36 -0.64 0.41 -1.38 -0.54 0.00 0.00 174.62 172.83 1vgq s HIS 15 N -2.98 0.55 0.00 3.99 -3.43 -1.26 -4.80 115.29 107.36 1vgq s HIS 15 Ca 0.60 -0.88 0.00 0.00 -0.80 0.00 0.00 55.06 53.98 1vgq s HIS 15 Cb -0.16 0.03 0.00 0.00 -1.43 0.00 0.00 32.58 31.02 1vgq s HIS 15 CO 0.56 -0.93 0.00 0.28 -2.00 0.00 0.00 174.74 172.64 1vgq n VAL 16 N -0.37 0.00 0.01 -5.38 0.31 -1.26 -4.36 118.33 107.28 1vgq n VAL 16 Ca -0.01 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.32 1vgq n VAL 16 Cb 0.63 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.56 1vgq n VAL 16 CO 0.00 0.00 0.00 1.67 -1.32 0.00 0.00 176.83 177.18 1vgq n GLN 17 N 13.77 0.00 0.22 5.55 7.27 -1.26 -4.57 117.38 138.36 1vgq n GLN 17 Ca 0.00 0.00 -0.15 0.00 0.07 0.00 0.00 57.00 56.92 1vgq n GLN 17 Cb 0.00 -0.49 -0.08 0.00 2.41 0.00 0.00 30.24 32.08 1vgq n GLN 17 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1vgq h ALA 18 N 0.00 -0.59 0.01 1.69 0.00 -1.78 0.36 119.26 118.94 1vgq h ALA 18 Ca 0.00 -0.11 -0.00 0.00 0.00 0.00 0.00 54.91 54.80 1vgq h ALA 18 Cb 0.81 0.32 0.00 0.00 0.00 0.00 0.00 17.79 18.91 1vgq h ALA 18 CO 0.00 -0.85 -0.00 0.78 0.00 0.00 0.00 179.25 179.18 1vgq h GLY 19 N -0.60 -0.01 1.92 0.00 0.00 -1.87 -3.05 103.07 99.46 1vgq h GLY 19 Ca -0.04 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.28 1vgq h GLY 19 CO 0.02 -0.00 -0.05 -2.55 0.00 0.00 0.00 176.54 173.96 1vgq h PRO 20 N -0.29 0.11 -0.46 4.80 0.11 -1.74 -2.30 132.00 132.22 1vgq h PRO 20 Ca -0.00 -0.01 -0.03 0.00 0.11 0.00 0.00 66.00 66.06 1vgq h PRO 20 Cb 0.29 -0.02 -0.02 0.00 0.11 0.00 0.00 31.00 31.36 1vgq h PRO 20 CO 0.00 0.17 0.17 0.00 -0.21 0.00 0.00 178.00 178.13 1vgq h ALA 21 N 1.85 0.60 0.45 -0.75 0.00 -0.91 0.39 119.26 120.89 1vgq h ALA 21 Ca 0.03 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 54.76 1vgq h ALA 21 Cb 0.16 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.77 1vgq h ALA 21 CO 0.01 0.22 -0.25 0.00 0.00 0.00 0.00 179.25 179.23 1vgq h THR 23 N -0.65 1.35 -0.47 0.00 1.35 -1.35 -1.24 112.91 111.89 1vgq h THR 23 Ca -0.06 -1.74 -0.01 0.00 -0.55 0.00 0.00 66.41 64.05 1vgq h THR 23 Cb 0.52 1.86 -0.02 0.00 -1.73 0.00 0.00 68.15 68.77 1vgq h THR 23 CO 0.08 0.51 0.25 -0.61 -0.25 0.00 0.00 175.52 175.50 1vgq h GLN 24 N 0.15 0.66 -0.20 4.72 4.15 -0.88 -0.81 115.11 122.91 1vgq h GLN 24 Ca 0.00 -0.08 -0.10 0.00 0.77 0.00 0.00 58.65 59.24 1vgq h GLN 24 Cb 0.94 -0.13 -0.01 0.00 0.21 0.00 0.00 27.48 28.49 1vgq h GLN 24 CO 0.08 0.54 -0.33 1.98 -1.93 0.00 0.00 178.83 179.16 1vgq h MET 25 N 0.62 0.40 -0.62 1.69 4.05 -0.82 -0.74 114.93 119.52 1vgq h MET 25 Ca 0.16 -0.17 -0.04 0.00 -0.28 0.00 0.00 59.70 59.37 1vgq h MET 25 Cb 0.07 -0.01 -0.03 0.00 -0.80 0.00 0.00 31.60 30.83 1vgq h MET 25 CO -0.02 0.69 0.23 0.52 0.23 0.00 0.00 176.91 178.55 1vgq h MET 26 N 0.35 0.94 -1.00 0.39 2.86 -0.97 -2.57 114.93 114.92 1vgq h MET 26 Ca 0.04 -0.18 0.01 0.00 -2.06 0.00 0.00 59.70 57.51 1vgq h MET 26 Cb 0.75 -0.15 -0.05 0.00 0.06 0.00 0.00 31.60 32.22 1vgq h MET 26 CO 0.06 0.81 0.66 0.78 1.06 0.00 0.00 176.91 180.28 1vgq h GLY 27 N 0.87 1.41 1.71 8.32 0.00 -0.62 -1.30 103.07 113.46 1vgq h GLY 27 Ca 0.20 -0.53 0.02 0.00 0.00 0.00 0.00 47.33 47.02 1vgq h GLY 27 CO -0.01 0.52 0.16 0.74 0.00 0.00 0.00 176.54 177.94 1vgq h PHE 28 N 1.36 0.22 -0.38 5.60 -1.00 -0.86 -0.98 116.94 120.90 1vgq h PHE 28 Ca 0.37 0.01 0.00 0.00 2.81 0.00 0.00 57.97 61.15 1vgq h PHE 28 Cb -0.15 -0.07 0.00 0.00 3.61 0.00 0.00 35.95 39.33 1vgq h PHE 28 CO 0.00 0.13 0.00 1.28 -1.61 0.00 0.00 178.31 178.11 1vgq n LEU 29 N -4.50 2.66 0.00 1.54 4.77 -0.55 -4.48 117.00 116.43 1vgq n LEU 29 Ca 0.01 -1.34 0.00 0.00 -0.03 0.00 0.00 56.01 54.65 1vgq n LEU 29 Cb 0.13 -0.38 0.00 0.00 -2.33 0.00 0.00 43.42 40.84 1vgq n LEU 29 CO 0.35 0.52 0.00 0.61 -1.33 0.00 0.00 177.39 177.54 1vgq n GLY 30 N 0.89 0.56 3.75 -0.72 0.00 -0.37 -1.00 105.19 108.29 1vgq n GLY 30 Ca 0.14 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.80 1vgq n GLY 30 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1vgq s ALA 31 N -2.00 2.54 -0.66 4.61 0.00 -0.85 -3.57 121.76 121.83 1vgq s ALA 31 Ca 0.00 1.06 -0.18 0.00 0.00 0.00 0.00 51.96 52.83 1vgq s ALA 31 Cb 0.00 -3.47 0.12 0.00 0.00 0.00 0.00 23.12 19.77 1vgq s ALA 31 CO 0.00 -1.23 0.77 1.21 0.00 0.00 0.00 175.76 176.51 1vgq s ASN 32 N -1.52 6.31 -0.31 0.00 3.04 -0.29 -4.39 114.94 117.78 1vgq s ASN 32 Ca 0.78 -1.65 -0.11 0.00 0.04 0.00 0.00 52.86 51.92 1vgq s ASN 32 Cb -0.32 -2.31 -0.03 0.00 -1.54 0.00 0.00 41.25 37.05 1vgq s ASN 32 CO 0.35 -1.06 0.20 -0.69 -3.04 0.00 0.00 177.10 172.86 1vgq s VAL 33 N 2.44 5.15 -0.41 -5.21 1.01 -1.26 -0.91 120.40 121.21 1vgq s VAL 33 Ca 0.15 -0.08 -0.10 0.00 0.00 0.00 0.00 61.98 61.95 1vgq s VAL 33 Cb -0.20 -3.55 0.06 0.00 0.00 0.00 0.00 36.38 32.70 1vgq s VAL 33 CO 0.03 0.13 0.24 -0.63 0.00 0.00 0.00 175.10 174.87 1vgq s ILE 34 N 1.72 4.32 -0.37 2.22 1.01 -0.49 -1.74 121.20 127.86 1vgq s ILE 34 Ca 0.06 -1.25 -0.27 0.00 0.00 0.00 0.00 60.65 59.20 1vgq s ILE 34 Cb -0.17 -3.58 0.02 0.00 0.01 0.00 0.00 42.46 38.74 1vgq s ILE 34 CO 0.10 -0.43 0.98 -0.75 0.00 0.00 0.00 174.94 174.83 1vgq s LYS 35 N 1.46 3.86 -0.00 2.79 2.20 0.35 -0.76 119.74 129.64 1vgq s LYS 35 Ca 0.02 0.66 -0.27 0.00 -0.36 0.00 0.00 55.97 56.03 1vgq s LYS 35 Cb -0.22 -3.81 -0.04 0.00 -1.51 0.00 0.00 37.83 32.25 1vgq s LYS 35 CO 0.03 -1.00 0.84 0.42 -0.36 0.00 0.00 175.35 175.28 1vgq s ILE 36 N 3.62 4.86 0.09 5.43 1.09 0.26 -1.73 121.20 134.83 1vgq s ILE 36 Ca 0.41 1.76 0.02 0.00 -1.10 0.00 0.00 60.65 61.73 1vgq s ILE 36 Cb -0.11 -4.18 -0.04 0.00 -1.06 0.00 0.00 42.46 37.07 1vgq s ILE 36 CO 0.20 0.25 -0.07 -1.61 -0.10 0.00 0.00 174.94 173.62 1vgq s GLU 37 N 0.59 0.81 0.45 2.79 2.02 -0.68 -4.61 118.70 120.06 1vgq s GLU 37 Ca 0.44 -1.29 -0.25 0.00 0.02 0.00 0.00 54.97 53.89 1vgq s GLU 37 Cb -0.20 -0.20 -0.08 0.00 0.10 0.00 0.00 34.13 33.75 1vgq s GLU 37 CO 0.24 -0.01 1.33 1.03 0.02 0.00 0.00 175.26 177.87 1vgq s ARG 38 N -3.66 3.70 0.34 1.61 0.52 -1.26 -1.41 118.95 118.79 1vgq s ARG 38 Ca 0.10 2.20 -0.29 0.00 -0.52 0.00 0.00 55.73 57.23 1vgq s ARG 38 Cb 0.04 -2.59 -0.11 0.00 0.52 0.00 0.00 34.95 32.81 1vgq s ARG 38 CO -0.04 -0.73 1.36 1.03 0.02 0.00 0.00 175.30 176.94 1vgq s ARG 39 N -2.48 4.28 0.00 3.54 0.52 -1.26 -1.55 118.95 122.00 1vgq s ARG 39 Ca 0.62 2.33 0.00 0.00 -0.52 0.00 0.00 55.73 58.15 1vgq s ARG 39 Cb -0.39 -3.04 0.00 0.00 0.52 0.00 0.00 34.95 32.04 1vgq s ARG 39 CO 0.49 -0.30 0.00 0.41 0.02 0.00 0.00 175.30 175.92 1vgq n GLY 40 N 0.71 1.99 0.04 -3.53 0.00 -1.26 -4.38 105.19 98.77 1vgq n GLY 40 Ca 0.00 -0.27 -0.04 0.00 0.00 0.00 0.00 46.02 45.72 1vgq n GLY 40 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1vgq n SER 41 N 3.14 2.59 0.00 1.61 3.41 -1.25 -5.11 113.62 118.01 1vgq n SER 41 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 1vgq n SER 41 Cb 0.00 0.83 0.00 0.00 -0.26 0.00 0.00 64.21 64.78 1vgq n SER 41 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1vgq n GLY 42 N 2.34 0.29 3.60 5.00 0.00 -0.59 -4.67 105.19 111.15 1vgq n GLY 42 Ca -0.14 -0.93 -0.51 0.00 0.00 0.00 0.00 46.02 44.44 1vgq n GLY 42 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1vgq n ASP 43 N -2.06 1.73 0.27 1.61 -0.08 -1.26 -4.47 116.55 112.29 1vgq n ASP 43 Ca 0.00 1.12 0.18 0.00 -1.51 0.00 0.00 54.79 54.58 1vgq n ASP 43 Cb 0.00 -1.22 0.96 0.00 2.34 0.00 0.00 41.12 43.20 1vgq n ASP 43 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1vgq h MET 44 N 4.40 0.00 0.00 -0.67 -0.00 -1.97 -1.64 114.93 115.06 1vgq h MET 44 Ca -0.46 0.00 -0.03 0.00 -0.00 0.00 0.00 59.70 59.20 1vgq h MET 44 Cb 1.33 0.00 -0.00 0.00 -0.00 0.00 0.00 31.60 32.92 1vgq h MET 44 CO 0.77 0.00 -0.16 1.79 -0.00 0.00 0.00 176.91 179.31 1vgq h THR 45 N 0.00 0.56 -0.51 -0.10 1.35 -1.90 -3.23 112.91 109.08 1vgq h THR 45 Ca 0.00 -0.73 0.07 0.00 -0.55 0.00 0.00 66.41 65.19 1vgq h THR 45 Cb 0.06 1.48 -0.06 0.00 -1.73 0.00 0.00 68.15 67.90 1vgq h THR 45 CO 0.00 0.15 0.20 0.03 -0.25 0.00 0.00 175.52 175.65 1vgq h ARG 46 N 0.00 0.38 -0.64 4.72 3.08 -1.60 -2.36 114.38 117.96 1vgq h ARG 46 Ca -0.00 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.03 1vgq h ARG 46 Cb 0.47 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 30.44 1vgq h ARG 46 CO 0.02 0.25 0.00 0.41 -1.07 0.00 0.00 179.97 179.58 1vgq n GLY 47 N -1.26 2.10 3.49 0.04 0.00 -1.23 -1.71 105.19 106.62 1vgq n GLY 47 Ca 0.05 -0.71 -0.43 0.00 0.00 0.00 0.00 46.02 44.94 1vgq n GLY 47 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1vgq s TRP 48 N -1.36 3.12 -1.21 1.61 -0.11 -0.89 -4.33 118.94 115.77 1vgq s TRP 48 Ca 0.43 -0.29 -0.10 0.00 1.22 0.00 0.00 56.10 57.36 1vgq s TRP 48 Cb 0.24 -3.15 -0.01 0.00 -1.50 0.00 0.00 33.47 29.05 1vgq s TRP 48 CO 0.27 -0.81 0.73 1.28 -4.62 0.00 0.00 176.95 173.80 1vgq n LEU 49 N 5.91 -3.22 -4.76 5.86 4.77 -1.26 -4.65 117.00 119.66 1vgq n LEU 49 Ca -0.05 -0.92 -0.39 0.00 -0.03 0.00 0.00 56.01 54.62 1vgq n LEU 49 Cb 0.47 -2.56 0.01 0.00 -2.33 0.00 0.00 43.42 39.01 1vgq n LEU 49 CO 0.50 0.40 0.95 -1.10 -1.33 0.00 0.00 177.39 176.81 1vgq s GLN 50 N -5.84 3.66 0.11 3.23 -0.21 -1.26 -4.68 119.66 114.67 1vgq s GLN 50 Ca 0.27 2.13 0.22 0.00 0.02 0.00 0.00 55.36 58.01 1vgq s GLN 50 Cb -0.08 -2.53 -0.11 0.00 1.00 0.00 0.00 33.01 31.29 1vgq s GLN 50 CO 0.83 -0.74 0.86 -0.40 -2.12 0.00 0.00 175.29 173.72 1vgq n ASP 51 N -0.36 0.55 -3.98 5.90 5.68 -1.26 -4.85 116.55 118.22 1vgq n ASP 51 Ca 0.06 0.18 -0.20 0.00 -0.50 0.00 0.00 54.79 54.34 1vgq n ASP 51 Cb 0.45 0.98 -0.15 0.00 -1.14 0.00 0.00 41.12 41.25 1vgq n ASP 51 CO 0.00 0.00 0.00 -0.54 -1.33 0.00 0.00 177.20 175.33 1vgq s LYS 52 N -3.40 0.86 0.40 0.11 1.02 -1.26 -5.13 119.74 112.34 1vgq s LYS 52 Ca -0.03 -0.26 -0.26 0.00 0.02 0.00 0.00 55.97 55.44 1vgq s LYS 52 Cb 0.11 -0.82 -0.10 0.00 -0.52 0.00 0.00 37.83 36.50 1vgq s LYS 52 CO 0.83 0.09 1.23 -0.35 -0.92 0.00 0.00 175.35 176.24 1vgq n PRO 53 N 3.32 1.87 -1.52 -1.68 -0.04 -1.26 -2.53 135.00 133.17 1vgq n PRO 53 Ca -0.18 0.66 -0.18 0.00 -0.04 0.00 0.00 63.50 63.76 1vgq n PRO 53 Cb 0.54 -2.31 -0.08 0.00 -0.04 0.00 0.00 33.50 31.62 1vgq n PRO 53 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 1vgq n ASN 54 N 0.37 -5.48 -4.24 3.54 5.15 -1.26 -4.97 115.26 108.38 1vgq n ASN 54 Ca 0.07 0.44 -0.30 0.00 -0.60 0.00 0.00 54.58 54.19 1vgq n ASN 54 Cb 0.39 -4.55 -0.16 0.00 -0.53 0.00 0.00 39.78 34.93 1vgq n ASN 54 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 1vgq s VAL 55 N -2.55 1.87 0.23 3.44 1.01 -1.05 -5.10 120.40 118.25 1vgq s VAL 55 Ca 0.00 -0.98 -0.31 0.00 0.00 0.00 0.00 61.98 60.69 1vgq s VAL 55 Cb 0.00 -1.58 -0.14 0.00 0.00 0.00 0.00 36.38 34.67 1vgq s VAL 55 CO 0.00 0.53 1.36 0.47 0.00 0.00 0.00 175.10 177.46 1vgq n ASP 56 N 2.86 2.49 -4.73 3.32 8.00 -1.26 -4.72 116.55 122.51 1vgq n ASP 56 Ca -0.17 1.14 -0.30 0.00 0.71 0.00 0.00 54.79 56.17 1vgq n ASP 56 Cb 0.52 -1.39 0.12 0.00 -0.02 0.00 0.00 41.12 40.36 1vgq n ASP 56 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 1vgq s SER 57 N 0.23 3.76 0.49 -2.24 1.04 -0.69 -4.81 113.70 111.48 1vgq s SER 57 Ca 0.69 1.55 0.25 0.00 0.48 0.00 0.00 55.95 58.92 1vgq s SER 57 Cb -0.68 -2.24 1.26 0.00 0.10 0.00 0.00 66.02 64.46 1vgq s SER 57 CO 0.50 -2.47 2.00 -0.07 0.98 0.00 0.00 173.24 174.18 1vgq h LEU 58 N -1.43 0.00 -0.21 2.42 3.38 -1.86 -0.95 115.31 116.66 1vgq h LEU 58 Ca -0.48 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.49 1vgq h LEU 58 Cb 1.27 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.01 1vgq h LEU 58 CO 0.54 0.17 0.12 0.22 0.09 0.00 0.00 178.44 179.58 1vgq h TYR 59 N 0.00 0.29 0.02 1.13 -0.00 -1.83 -1.89 116.97 114.69 1vgq h TYR 59 Ca -0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 58.73 58.72 1vgq h TYR 59 Cb 0.44 -0.09 0.00 0.00 -0.00 0.00 0.00 36.73 37.08 1vgq h TYR 59 CO 0.00 0.25 -0.01 0.35 -0.00 0.00 0.00 178.16 178.75 1vgq h PHE 60 N 0.25 -0.02 -0.14 -3.82 3.04 -1.54 -3.18 116.94 111.53 1vgq h PHE 60 Ca 0.08 -0.00 -0.11 0.00 3.98 0.00 0.00 57.97 61.91 1vgq h PHE 60 Cb 0.05 0.01 -0.01 0.00 2.56 0.00 0.00 35.95 38.55 1vgq h PHE 60 CO -0.04 0.28 -0.41 1.79 -2.02 0.00 0.00 178.31 177.91 1vgq h THR 61 N -0.32 1.31 0.00 4.41 1.35 -1.11 -2.04 112.91 116.50 1vgq h THR 61 Ca -0.00 -1.53 0.00 0.00 -0.55 0.00 0.00 66.41 64.33 1vgq h THR 61 Cb 0.31 1.65 0.00 0.00 -1.73 0.00 0.00 68.15 68.38 1vgq h THR 61 CO 0.00 0.46 0.00 0.23 -0.25 0.00 0.00 175.52 175.97 1vgq n MET 62 N -4.03 0.05 -0.01 4.72 2.81 -0.72 -3.25 117.12 116.70 1vgq n MET 62 Ca -0.01 0.09 0.02 0.00 -1.81 0.00 0.00 57.70 55.98 1vgq n MET 62 Cb 0.49 -1.57 0.02 0.00 -0.71 0.00 0.00 33.22 31.45 1vgq n MET 62 CO 0.00 0.00 0.00 1.19 1.51 0.00 0.00 175.97 178.67 1vgq n PHE 63 N -1.66 0.02 -2.14 2.03 3.01 -0.96 -4.77 117.46 112.99 1vgq n PHE 63 Ca 0.06 -0.07 0.03 0.00 1.01 0.00 0.00 57.45 58.48 1vgq n PHE 63 Cb 0.32 -0.01 0.04 0.00 -0.01 0.00 0.00 39.48 39.83 1vgq n PHE 63 CO 0.00 0.00 0.00 0.09 1.01 0.00 0.00 176.76 177.86 1vgq n ASN 64 N 0.14 0.79 -4.76 4.37 3.02 -0.81 -4.40 115.26 113.61 1vgq n ASN 64 Ca 0.02 -2.24 -0.32 0.00 -0.03 0.00 0.00 54.58 52.01 1vgq n ASN 64 Cb 0.12 -0.29 0.08 0.00 -0.61 0.00 0.00 39.78 39.08 1vgq n ASN 64 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1vgq n ASN 66 N -3.18 -5.84 -4.10 0.00 4.13 -0.83 -4.73 115.26 100.70 1vgq n ASN 66 Ca 0.10 -0.48 -0.13 0.00 1.68 0.00 0.00 54.58 55.75 1vgq n ASN 66 Cb 0.52 -4.66 -0.11 0.00 -1.54 0.00 0.00 39.78 33.99 1vgq n ASN 66 CO 0.00 0.00 0.00 -0.54 0.28 0.00 0.00 177.26 177.00 1vgq s LYS 67 N -6.14 0.64 0.12 3.52 1.02 -1.25 -4.43 119.74 113.23 1vgq s LYS 67 Ca 0.49 -0.93 0.05 0.00 0.02 0.00 0.00 55.97 55.60 1vgq s LYS 67 Cb -0.23 -0.32 -0.04 0.00 -0.52 0.00 0.00 37.83 36.72 1vgq s LYS 67 CO 0.61 0.04 0.06 1.03 -0.92 0.00 0.00 175.35 176.17 1vgq s ARG 68 N -2.19 2.71 -0.13 1.68 0.52 -0.71 -4.06 118.95 116.75 1vgq s ARG 68 Ca -0.03 -0.86 0.02 0.00 -0.52 0.00 0.00 55.73 54.34 1vgq s ARG 68 Cb -0.06 -2.59 0.00 0.00 0.52 0.00 0.00 34.95 32.83 1vgq s ARG 68 CO -0.01 0.51 -0.20 0.45 0.02 0.00 0.00 175.30 176.08 1vgq s SER 69 N -2.68 3.35 -0.05 0.23 0.15 -1.26 -0.50 113.70 112.95 1vgq s SER 69 Ca 0.28 -0.53 0.07 0.00 0.70 0.00 0.00 55.95 56.47 1vgq s SER 69 Cb -0.11 -1.49 -0.01 0.00 -1.71 0.00 0.00 66.02 62.70 1vgq s SER 69 CO 0.21 0.11 -0.25 -0.51 1.20 0.00 0.00 173.24 174.00 1vgq s ILE 70 N 0.64 2.02 0.21 6.45 2.07 -0.71 -0.74 121.20 131.15 1vgq s ILE 70 Ca -0.10 -1.06 -0.20 0.00 -1.41 0.00 0.00 60.65 57.88 1vgq s ILE 70 Cb -0.16 -1.70 -0.08 0.00 0.13 0.00 0.00 42.46 40.65 1vgq s ILE 70 CO 0.02 0.56 0.71 -1.61 -1.91 0.00 0.00 174.94 172.71 1vgq s GLU 71 N -0.27 4.25 -0.27 3.50 2.02 -1.26 -1.69 118.70 124.98 1vgq s GLU 71 Ca -0.00 0.85 -0.10 0.00 0.02 0.00 0.00 54.97 55.74 1vgq s GLU 71 Cb -0.13 -2.92 0.11 0.00 0.10 0.00 0.00 34.13 31.29 1vgq s GLU 71 CO 0.02 0.42 0.60 -1.17 0.02 0.00 0.00 175.26 175.15 1vgq s LEU 72 N -1.89 -0.95 -0.69 1.80 2.96 -0.50 -4.53 118.68 114.87 1vgq s LEU 72 Ca 0.42 1.41 -0.25 0.00 -0.22 0.00 0.00 54.13 55.49 1vgq s LEU 72 Cb -0.17 2.07 0.05 0.00 0.50 0.00 0.00 46.19 48.64 1vgq s LEU 72 CO 0.21 -0.22 1.12 -0.62 -1.32 0.00 0.00 176.35 175.51 1vgq s ASP 73 N 2.54 6.18 0.17 3.68 -1.08 -0.18 -4.42 116.67 123.56 1vgq s ASP 73 Ca -0.06 -0.68 0.27 0.00 -0.52 0.00 0.00 52.55 51.56 1vgq s ASP 73 Cb -0.11 -2.49 0.88 0.00 -1.46 0.00 0.00 42.92 39.75 1vgq s ASP 73 CO -0.18 -1.62 1.80 0.23 0.52 0.00 0.00 175.17 175.93 1vgq n MET 74 N 8.50 0.22 -0.39 4.34 2.81 -1.26 -3.27 117.12 128.07 1vgq n MET 74 Ca -0.00 0.18 -0.07 0.00 -1.81 0.00 0.00 57.70 55.99 1vgq n MET 74 Cb 0.47 -1.75 0.06 0.00 -0.71 0.00 0.00 33.22 31.29 1vgq n MET 74 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 1vgq n LYS 75 N -2.13 1.41 -4.29 0.03 5.02 -1.26 -4.31 118.16 112.64 1vgq n LYS 75 Ca 0.06 -0.95 -0.22 0.00 -2.02 0.00 0.00 58.31 55.18 1vgq n LYS 75 Cb 0.41 -1.38 -0.13 0.00 -0.02 0.00 0.00 35.03 33.92 1vgq n LYS 75 CO 0.00 0.00 0.00 -0.08 -0.52 0.00 0.00 177.40 176.80 1vgq s THR 76 N -1.05 1.47 0.24 -0.18 -1.32 -1.20 -5.06 115.64 108.53 1vgq s THR 76 Ca 0.18 -1.39 -0.07 0.00 -1.21 0.00 0.00 61.69 59.20 1vgq s THR 76 Cb 0.15 -1.35 0.21 0.00 -1.51 0.00 0.00 72.50 70.01 1vgq s THR 76 CO 0.04 -0.08 1.88 -0.65 -2.21 0.00 0.00 174.62 173.59 1vgq h PRO 77 N 4.29 1.05 0.00 7.08 0.11 -1.89 -2.23 132.00 140.41 1vgq h PRO 77 Ca -0.43 -0.06 -0.10 0.00 0.11 0.00 0.00 66.00 65.52 1vgq h PRO 77 Cb 1.18 -0.24 -0.01 0.00 0.11 0.00 0.00 31.00 32.04 1vgq h PRO 77 CO 0.40 0.69 -0.45 0.93 -0.21 0.00 0.00 178.00 179.37 1vgq h GLU 78 N 1.08 0.00 -0.12 1.05 3.07 -1.96 -2.38 114.58 115.32 1vgq h GLU 78 Ca 0.35 0.00 -0.11 0.00 -0.50 0.00 0.00 59.36 59.10 1vgq h GLU 78 Cb 0.02 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.93 1vgq h GLU 78 CO -0.12 0.45 -0.37 0.78 -1.40 0.00 0.00 179.01 178.35 1vgq h GLY 79 N 2.68 0.51 0.93 -3.84 0.00 -1.67 -2.30 103.07 99.37 1vgq h GLY 79 Ca -0.00 -0.66 0.05 0.00 0.00 0.00 0.00 47.33 46.72 1vgq h GLY 79 CO 0.06 0.59 0.58 0.50 0.00 0.00 0.00 176.54 178.26 1vgq h LYS 80 N 0.05 1.00 -0.58 4.80 1.57 -1.30 -1.07 116.57 121.04 1vgq h LYS 80 Ca -0.01 -0.06 -0.10 0.00 -1.87 0.00 0.00 60.65 58.60 1vgq h LYS 80 Cb 0.99 -0.23 -0.02 0.00 0.08 0.00 0.00 32.23 33.06 1vgq h LYS 80 CO 0.08 0.66 -0.05 0.93 -0.57 0.00 0.00 179.45 180.50 1vgq h GLU 81 N 1.03 1.05 -0.52 3.15 5.08 -1.40 -2.19 114.58 120.78 1vgq h GLU 81 Ca 0.37 -0.35 -0.07 0.00 -1.00 0.00 0.00 59.36 58.30 1vgq h GLU 81 Cb 0.13 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.28 1vgq h GLU 81 CO -0.13 1.05 0.03 -0.07 -1.00 0.00 0.00 179.01 178.89 1vgq h LEU 82 N 0.94 0.82 -0.74 1.33 3.38 -0.81 -2.81 115.31 117.42 1vgq h LEU 82 Ca 0.16 -0.19 -0.07 0.00 0.09 0.00 0.00 57.88 57.87 1vgq h LEU 82 Cb 0.61 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 41.11 1vgq h LEU 82 CO 0.04 0.87 0.20 -0.07 0.09 0.00 0.00 178.44 179.56 1vgq h LEU 83 N 0.80 1.08 -0.89 1.67 3.38 -1.00 -1.32 115.31 119.04 1vgq h LEU 83 Ca 0.16 -0.22 0.04 0.00 0.09 0.00 0.00 57.88 57.95 1vgq h LEU 83 Cb 0.44 -0.28 -0.05 0.00 0.09 0.00 0.00 40.66 40.85 1vgq h LEU 83 CO 0.02 1.02 0.57 -0.33 0.09 0.00 0.00 178.44 179.81 1vgq h GLU 84 N 1.09 1.06 -0.37 1.13 5.08 -1.19 0.12 114.58 121.50 1vgq h GLU 84 Ca 0.23 -0.06 -0.16 0.00 -1.00 0.00 0.00 59.36 58.36 1vgq h GLU 84 Cb 0.35 -0.24 -0.01 0.00 0.50 0.00 0.00 28.75 29.36 1vgq h GLU 84 CO -0.00 0.70 -0.41 1.96 -1.00 0.00 0.00 179.01 180.26 1vgq h GLN 85 N 1.09 0.93 -0.26 2.33 4.20 -1.20 -2.49 115.11 119.71 1vgq h GLN 85 Ca 0.36 -0.50 -0.09 0.00 0.06 0.00 0.00 58.65 58.48 1vgq h GLN 85 Cb 0.04 0.02 -0.01 0.00 0.30 0.00 0.00 27.48 27.83 1vgq h GLN 85 CO -0.13 1.16 -0.23 0.52 -0.67 0.00 0.00 178.83 179.47 1vgq h MET 86 N 0.75 0.49 -0.25 1.46 2.86 -0.86 -2.83 114.93 116.56 1vgq h MET 86 Ca 0.06 -0.18 -0.10 0.00 -2.06 0.00 0.00 59.70 57.41 1vgq h MET 86 Cb 1.00 -0.03 -0.01 0.00 0.06 0.00 0.00 31.60 32.62 1vgq h MET 86 CO 0.10 0.70 -0.27 0.82 1.06 0.00 0.00 176.91 179.31 1vgq h ILE 87 N 0.44 1.27 0.00 -1.22 2.04 -0.82 -1.75 117.51 117.46 1vgq h ILE 87 Ca 0.07 -1.31 -0.04 0.00 1.00 0.00 0.00 64.86 64.58 1vgq h ILE 87 Cb 0.65 1.38 -0.01 0.00 -0.74 0.00 0.00 36.82 38.10 1vgq h ILE 87 CO 0.05 0.41 -0.18 0.11 0.00 0.00 0.00 178.15 178.54 1vgq h LYS 88 N 0.42 0.00 -0.02 2.37 1.57 -1.20 -2.84 116.57 116.88 1vgq h LYS 88 Ca 0.06 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.84 1vgq h LYS 88 Cb 0.70 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.01 1vgq h LYS 88 CO 0.05 0.18 -0.29 1.63 -0.57 0.00 0.00 179.45 180.46 1vgq n LYS 89 N -3.71 1.62 -3.45 3.15 5.02 -0.97 -4.99 118.16 114.83 1vgq n LYS 89 Ca -0.02 -1.31 -0.33 0.00 -2.02 0.00 0.00 58.31 54.64 1vgq n LYS 89 Cb 0.30 -1.44 -0.05 0.00 -0.02 0.00 0.00 35.03 33.81 1vgq n LYS 89 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1vgq s ALA 90 N -2.21 3.61 -0.14 7.82 0.00 -0.70 -4.78 121.76 125.36 1vgq s ALA 90 Ca 0.21 -0.29 -0.04 0.00 0.00 0.00 0.00 51.96 51.84 1vgq s ALA 90 Cb 0.18 -2.40 -0.24 0.00 0.00 0.00 0.00 23.12 20.66 1vgq s ALA 90 CO 0.45 0.52 0.27 -0.25 0.00 0.00 0.00 175.76 176.75 1vgq n ASP 91 N 0.19 2.04 -3.85 0.00 8.00 0.48 -4.54 116.55 118.88 1vgq n ASP 91 Ca -0.02 0.15 -0.12 0.00 0.71 0.00 0.00 54.79 55.51 1vgq n ASP 91 Cb 0.52 -0.74 -0.14 0.00 -0.02 0.00 0.00 41.12 40.74 1vgq n ASP 91 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1vgq s VAL 92 N -2.55 -0.01 -0.11 2.53 0.11 -0.85 -1.12 120.40 118.39 1vgq s VAL 92 Ca -0.24 0.03 -0.04 0.00 -2.93 0.00 0.00 61.98 58.80 1vgq s VAL 92 Cb 0.07 -0.05 -0.03 0.00 -1.53 0.00 0.00 36.38 34.83 1vgq s VAL 92 CO 0.74 0.01 0.03 -0.04 -3.33 0.00 0.00 175.10 172.51 1vgq s MET 93 N 0.15 3.29 -0.06 1.54 -1.94 0.90 -0.13 119.30 123.05 1vgq s MET 93 Ca -0.01 -0.37 0.02 0.00 -1.71 0.00 0.00 55.69 53.61 1vgq s MET 93 Cb -0.02 -2.93 0.02 0.00 2.01 0.00 0.00 34.83 33.91 1vgq s MET 93 CO -0.00 0.59 -0.09 0.08 -0.01 0.00 0.00 175.02 175.58 1vgq s VAL 94 N -0.55 0.91 0.02 -6.03 1.01 -0.67 -0.02 120.40 115.07 1vgq s VAL 94 Ca 0.10 -0.35 -0.02 0.00 0.00 0.00 0.00 61.98 61.71 1vgq s VAL 94 Cb -0.12 -0.87 -0.01 0.00 0.00 0.00 0.00 36.38 35.38 1vgq s VAL 94 CO 0.02 0.31 0.02 -1.83 0.00 0.00 0.00 175.10 173.62 1vgq s GLU 95 N 0.78 0.39 -0.33 2.72 4.04 -0.54 -0.91 118.70 124.85 1vgq s GLU 95 Ca -0.13 -0.59 0.16 0.00 0.04 0.00 0.00 54.97 54.45 1vgq s GLU 95 Cb -0.15 0.15 0.45 0.00 0.02 0.00 0.00 34.13 34.59 1vgq s GLU 95 CO 0.02 -0.08 1.05 0.27 -1.84 0.00 0.00 175.26 174.68 1vgq n ASN 96 N 1.43 0.73 -4.07 0.83 6.94 -1.26 -2.22 115.26 117.63 1vgq n ASN 96 Ca -0.23 -2.62 -0.30 0.00 -0.02 0.00 0.00 54.58 51.42 1vgq n ASN 96 Cb 0.56 -0.20 0.20 0.00 -2.36 0.00 0.00 39.78 37.98 1vgq n ASN 96 CO 0.00 0.00 0.00 -0.36 -1.03 0.00 0.00 177.26 175.87 1vgq s PHE 97 N -2.43 1.31 0.91 -2.53 2.99 -1.26 -4.73 117.98 112.24 1vgq s PHE 97 Ca 0.26 0.39 -0.12 0.00 0.00 0.00 0.00 56.93 57.46 1vgq s PHE 97 Cb 0.44 -3.90 0.14 0.00 0.00 0.00 0.00 43.02 39.70 1vgq s PHE 97 CO 0.01 -2.99 1.10 0.20 -0.00 0.00 0.00 175.22 173.53 1vgq s GLY 98 N -4.58 1.60 0.04 4.36 0.00 -1.26 -4.89 107.32 102.59 1vgq s GLY 98 Ca 0.73 -0.19 -0.36 0.00 0.00 0.00 0.00 44.72 44.89 1vgq s GLY 98 CO 0.54 0.33 1.50 -1.05 0.00 0.00 0.00 173.10 174.42 1vgq n PRO 99 N -3.89 1.49 -0.48 2.90 -0.02 -1.26 -2.07 135.00 131.66 1vgq n PRO 99 Ca 0.06 0.54 0.00 0.00 -2.02 0.00 0.00 63.50 62.08 1vgq n PRO 99 Cb 0.56 -2.24 0.00 0.00 -0.02 0.00 0.00 33.50 31.81 1vgq n PRO 99 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1vgq n GLY 100 N 3.14 1.71 0.16 -1.23 0.00 -1.26 -4.92 105.19 102.80 1vgq n GLY 100 Ca 0.20 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.09 1vgq n GLY 100 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1vgq h ALA 101 N 0.00 -0.20 -0.35 4.61 0.00 -1.76 0.45 119.26 122.00 1vgq h ALA 101 Ca 0.00 -0.02 -0.13 0.00 0.00 0.00 0.00 54.91 54.77 1vgq h ALA 101 Cb 0.00 0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 1vgq h ALA 101 CO 0.00 -0.64 -0.29 1.25 0.00 0.00 0.00 179.25 179.57 1vgq h LEU 102 N -0.25 0.77 -0.71 0.00 6.46 -1.90 -2.36 115.31 117.33 1vgq h LEU 102 Ca 0.02 -0.30 0.09 0.00 -0.12 0.00 0.00 57.88 57.57 1vgq h LEU 102 Cb 0.26 -0.21 -0.07 0.00 -0.73 0.00 0.00 40.66 39.90 1vgq h LEU 102 CO -0.06 1.01 0.35 0.44 -0.62 0.00 0.00 178.44 179.56 1vgq h ASP 103 N 0.64 0.45 0.87 1.25 3.32 -1.65 -2.32 116.42 118.98 1vgq h ASP 103 Ca 0.08 0.06 -0.03 0.00 0.02 0.00 0.00 57.03 57.15 1vgq h ASP 103 Cb 0.81 -0.01 -0.00 0.00 0.22 0.00 0.00 39.33 40.34 1vgq h ASP 103 CO 0.07 0.26 -0.16 0.03 -1.72 0.00 0.00 179.24 177.72 1vgq h ARG 104 N 0.59 0.00 0.00 3.56 3.08 -0.40 -0.32 114.38 120.90 1vgq h ARG 104 Ca 0.35 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.40 1vgq h ARG 104 Cb 0.37 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.42 1vgq h ARG 104 CO -0.27 0.16 0.00 -1.33 -1.07 0.00 0.00 179.97 177.46 1vgq n MET 105 N -3.35 0.63 -0.03 0.04 2.81 -0.96 -4.89 117.12 111.37 1vgq n MET 105 Ca -0.00 0.02 0.00 0.00 -1.81 0.00 0.00 57.70 55.91 1vgq n MET 105 Cb 0.37 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.38 1vgq n MET 105 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1vgq n GLY 106 N 0.79 0.37 2.70 3.03 0.00 -0.13 -4.99 105.19 106.96 1vgq n GLY 106 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.77 1vgq n GLY 106 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1vgq n PHE 107 N -2.00 2.64 -1.11 1.61 3.01 -0.91 -4.81 117.46 115.88 1vgq n PHE 107 Ca 0.00 -2.61 -0.32 0.00 1.01 0.00 0.00 57.45 55.53 1vgq n PHE 107 Cb 0.00 -1.34 0.12 0.00 -0.01 0.00 0.00 39.48 38.26 1vgq n PHE 107 CO 0.00 0.00 0.00 0.95 1.01 0.00 0.00 176.76 178.72 1vgq s THR 108 N -3.36 2.43 0.24 4.37 -4.23 -1.26 -4.16 115.64 109.66 1vgq s THR 108 Ca 0.40 0.17 -0.05 0.00 -1.18 0.00 0.00 61.69 61.02 1vgq s THR 108 Cb 0.16 -2.49 0.20 0.00 1.34 0.00 0.00 72.50 71.71 1vgq s THR 108 CO -0.07 -0.15 1.74 -0.25 -0.54 0.00 0.00 174.62 175.34 1vgq h TRP 109 N -1.08 0.51 -0.66 3.99 -0.00 -1.97 -1.14 115.95 115.59 1vgq h TRP 109 Ca -0.45 0.03 0.06 0.00 -0.00 0.00 0.00 58.89 58.53 1vgq h TRP 109 Cb 1.27 -0.11 -0.06 0.00 -0.00 0.00 0.00 29.16 30.26 1vgq h TRP 109 CO 0.51 0.09 0.37 0.93 -0.00 0.00 0.00 178.44 180.33 1vgq h GLU 110 N 0.46 0.66 -0.29 2.65 3.07 -1.97 -1.22 114.58 117.93 1vgq h GLU 110 Ca 0.39 -0.04 -0.17 0.00 -0.50 0.00 0.00 59.36 59.04 1vgq h GLU 110 Cb 0.55 -0.15 -0.00 0.00 -0.84 0.00 0.00 28.75 28.31 1vgq h GLU 110 CO -0.37 0.44 -0.50 -0.92 -1.40 0.00 0.00 179.01 176.25 1vgq h TYR 111 N 0.68 1.01 -0.90 4.33 3.20 -1.75 -3.15 116.97 120.39 1vgq h TYR 111 Ca 0.30 -0.34 0.02 0.00 3.14 0.00 0.00 58.73 61.84 1vgq h TYR 111 Cb 0.19 -0.20 -0.05 0.00 1.54 0.00 0.00 36.73 38.22 1vgq h TYR 111 CO -0.08 1.15 0.59 0.82 -1.64 0.00 0.00 178.16 179.00 1vgq h ILE 112 N 0.64 1.21 -0.45 1.81 2.04 -0.52 -2.08 117.51 120.16 1vgq h ILE 112 Ca 0.03 -0.41 -0.01 0.00 1.00 0.00 0.00 64.86 65.47 1vgq h ILE 112 Cb 1.09 -0.09 -0.02 0.00 -0.74 0.00 0.00 36.82 37.06 1vgq h ILE 112 CO 0.11 0.22 0.26 1.56 0.00 0.00 0.00 178.15 180.29 1vgq h GLN 113 N 1.19 0.63 -0.73 2.37 4.20 -1.25 -1.80 115.11 119.72 1vgq h GLN 113 Ca 0.34 -0.07 0.02 0.00 0.06 0.00 0.00 58.65 59.00 1vgq h GLN 113 Cb -0.09 -0.13 -0.04 0.00 0.30 0.00 0.00 27.48 27.52 1vgq h GLN 113 CO -0.08 0.49 0.47 1.49 -0.67 0.00 0.00 178.83 180.52 1vgq h GLU 114 N 0.60 0.90 -0.36 1.46 4.81 -1.43 -2.28 114.58 118.28 1vgq h GLU 114 Ca 0.16 -0.05 -0.09 0.00 -0.13 0.00 0.00 59.36 59.24 1vgq h GLU 114 Cb 0.04 -0.20 -0.02 0.00 0.63 0.00 0.00 28.75 29.20 1vgq h GLU 114 CO -0.03 0.60 -0.16 -0.07 -0.73 0.00 0.00 179.01 178.62 1vgq h LEU 115 N 0.93 0.65 -6.07 1.64 3.38 -1.01 -3.41 115.31 111.41 1vgq h LEU 115 Ca 0.28 -0.20 -0.03 0.00 0.09 0.00 0.00 57.88 58.02 1vgq h LEU 115 Cb -0.03 -0.18 -0.23 0.00 0.09 0.00 0.00 40.66 40.31 1vgq h LEU 115 CO -0.09 0.83 -0.42 0.21 0.09 0.00 0.00 178.44 179.05 1vgq s ASN 116 N -6.74 -1.15 0.14 -0.43 3.84 -0.71 -4.64 114.94 105.24 1vgq s ASN 116 Ca -0.08 -0.03 0.15 0.00 0.21 0.00 0.00 52.86 53.10 1vgq s ASN 116 Cb 0.14 1.81 0.68 0.00 -0.55 0.00 0.00 41.25 43.33 1vgq s ASN 116 CO 0.81 -0.30 1.45 -0.81 -2.79 0.00 0.00 177.10 175.46 1vgq n PRO 117 N 5.32 0.08 0.08 0.43 -0.05 -0.87 -2.27 135.00 137.71 1vgq n PRO 117 Ca 0.05 0.45 0.12 0.00 -0.05 0.00 0.00 63.50 64.06 1vgq n PRO 117 Cb 0.53 -1.70 0.06 0.00 -0.05 0.00 0.00 33.50 32.34 1vgq n PRO 117 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 175.50 175.99 1vgq n ARG 118 N -1.86 0.45 -2.54 0.54 1.74 -1.26 -1.75 116.66 111.98 1vgq n ARG 118 Ca 0.01 0.09 -0.38 0.00 -0.77 0.00 0.00 57.85 56.80 1vgq n ARG 118 Cb 0.11 -1.74 -0.04 0.00 -1.02 0.00 0.00 32.46 29.77 1vgq n ARG 118 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1vgq s VAL 119 N -3.27 3.67 -0.20 1.55 0.11 -0.96 -3.66 120.40 117.64 1vgq s VAL 119 Ca 0.02 1.41 -0.10 0.00 -2.93 0.00 0.00 61.98 60.38 1vgq s VAL 119 Cb 0.12 -3.80 -0.05 0.00 -1.53 0.00 0.00 36.38 31.12 1vgq s VAL 119 CO 0.77 0.14 0.15 -0.63 -3.33 0.00 0.00 175.10 172.19 1vgq s ILE 120 N -1.49 5.39 -0.22 7.04 1.01 -0.28 -3.98 121.20 128.68 1vgq s ILE 120 Ca 0.53 0.21 -0.10 0.00 0.00 0.00 0.00 60.65 61.30 1vgq s ILE 120 Cb -0.25 -3.49 -0.05 0.00 0.01 0.00 0.00 42.46 38.69 1vgq s ILE 120 CO 0.32 0.42 0.13 -0.22 0.00 0.00 0.00 174.94 175.59 1vgq s LEU 121 N 0.50 4.02 -0.07 2.97 2.96 -0.67 -0.07 118.68 128.32 1vgq s LEU 121 Ca 0.09 0.10 0.03 0.00 -0.22 0.00 0.00 54.13 54.13 1vgq s LEU 121 Cb -0.12 -2.06 0.00 0.00 0.50 0.00 0.00 46.19 44.51 1vgq s LEU 121 CO -0.00 0.09 -0.17 0.00 -1.32 0.00 0.00 176.35 174.95 1vgq s ALA 122 N 0.88 1.62 -0.02 5.97 0.00 0.97 -0.57 121.76 130.61 1vgq s ALA 122 Ca 0.07 -0.66 -0.01 0.00 0.00 0.00 0.00 51.96 51.35 1vgq s ALA 122 Cb -0.13 -0.63 0.01 0.00 0.00 0.00 0.00 23.12 22.37 1vgq s ALA 122 CO 0.03 0.22 0.05 0.45 0.00 0.00 0.00 175.76 176.50 1vgq s SER 123 N 0.39 -0.03 -0.15 0.00 0.15 -0.44 -1.46 113.70 112.16 1vgq s SER 123 Ca -0.13 0.09 -0.05 0.00 0.70 0.00 0.00 55.95 56.56 1vgq s SER 123 Cb -0.15 0.07 -0.03 0.00 -1.71 0.00 0.00 66.02 64.19 1vgq s SER 123 CO 0.05 -0.04 0.01 -0.69 1.20 0.00 0.00 173.24 173.77 1vgq s VAL 124 N 0.23 4.35 0.32 4.45 1.01 -0.94 -1.54 120.40 128.29 1vgq s VAL 124 Ca -0.02 -0.20 0.03 0.00 0.00 0.00 0.00 61.98 61.80 1vgq s VAL 124 Cb -0.03 -2.92 -0.06 0.00 0.00 0.00 0.00 36.38 33.38 1vgq s VAL 124 CO -0.01 0.50 0.08 -0.54 0.00 0.00 0.00 175.10 175.13 1vgq s LYS 125 N 0.12 1.64 0.05 2.72 -0.14 -0.80 -4.53 119.74 118.81 1vgq s LYS 125 Ca 0.02 -1.92 -0.19 0.00 -1.36 0.00 0.00 55.97 52.52 1vgq s LYS 125 Cb -0.13 -0.71 -0.13 0.00 -1.68 0.00 0.00 37.83 35.18 1vgq s LYS 125 CO 0.02 -0.25 1.35 0.78 -0.76 0.00 0.00 175.35 176.49 1vgq h GLY 126 N 2.12 0.50 -3.10 -3.33 0.00 -1.88 0.25 103.07 97.64 1vgq h GLY 126 Ca -0.40 -0.53 -0.42 0.00 0.00 0.00 0.00 47.33 45.99 1vgq h GLY 126 CO 0.66 0.47 -0.74 -0.19 0.00 0.00 0.00 176.54 176.74 1vgq s TYR 127 N -4.26 1.51 0.61 5.60 1.51 -1.26 -1.96 117.35 119.10 1vgq s TYR 127 Ca -0.14 -0.59 -0.18 0.00 -1.01 0.00 0.00 57.07 55.16 1vgq s TYR 127 Cb 0.06 -0.75 -0.03 0.00 -0.11 0.00 0.00 41.96 41.13 1vgq s TYR 127 CO 0.78 0.22 1.15 0.00 -1.11 0.00 0.00 175.55 176.59 1vgq s ALA 128 N -2.62 2.53 0.18 3.71 0.00 -1.26 -4.78 121.76 119.51 1vgq s ALA 128 Ca 0.15 0.81 -0.32 0.00 0.00 0.00 0.00 51.96 52.60 1vgq s ALA 128 Cb -0.02 -3.39 -0.11 0.00 0.00 0.00 0.00 23.12 19.60 1vgq s ALA 128 CO 0.04 -1.14 1.66 -2.00 0.00 0.00 0.00 175.76 174.32 1vgq s GLU 129 N -3.59 4.17 0.00 0.00 2.12 -1.26 -2.01 118.70 118.13 1vgq s GLU 129 Ca 0.73 2.49 0.00 0.00 0.36 0.00 0.00 54.97 58.54 1vgq s GLU 129 Cb -0.25 -3.16 0.00 0.00 0.26 0.00 0.00 34.13 30.98 1vgq s GLU 129 CO 0.35 -0.69 0.00 0.41 -0.54 0.00 0.00 175.26 174.78 1vgq n GLY 130 N 3.89 2.66 3.76 -1.50 0.00 -1.26 -5.08 105.19 107.67 1vgq n GLY 130 Ca 0.15 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.82 1vgq n GLY 130 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1vgq s HIS 131 N -2.69 2.54 0.59 1.61 5.04 -0.85 -4.92 115.29 116.61 1vgq s HIS 131 Ca 0.00 1.54 0.30 0.00 -1.54 0.00 0.00 55.06 55.35 1vgq s HIS 131 Cb 0.00 -3.36 1.79 0.00 0.04 0.00 0.00 32.58 31.05 1vgq s HIS 131 CO 0.00 -1.87 2.21 0.00 -2.34 0.00 0.00 174.74 172.74 1vgq h ALA 132 N 0.92 1.60 -0.37 1.58 0.00 -1.98 -2.30 119.26 118.70 1vgq h ALA 132 Ca -0.50 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.41 1vgq h ALA 132 Cb 1.28 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.07 1vgq h ALA 132 CO 0.56 -0.09 0.00 0.09 0.00 0.00 0.00 179.25 179.80 1vgq n ASN 133 N -3.81 4.00 -0.46 0.00 3.02 -1.26 -4.71 115.26 112.03 1vgq n ASN 133 Ca -0.02 -2.69 0.38 0.00 -0.03 0.00 0.00 54.58 52.22 1vgq n ASN 133 Cb 0.16 -0.49 0.68 0.00 -0.61 0.00 0.00 39.78 39.51 1vgq n ASN 133 CO 0.00 0.00 0.00 -0.08 -2.62 0.00 0.00 177.26 174.56 1vgq h GLU 134 N 2.43 0.09 -0.43 3.52 4.81 -1.64 -1.86 114.58 121.50 1vgq h GLU 134 Ca 0.00 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.22 1vgq h GLU 134 Cb 1.34 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 30.70 1vgq h GLU 134 CO 0.20 0.06 0.00 0.72 -0.73 0.00 0.00 179.01 179.26 1vgq n HIS 135 N -4.48 0.56 -3.43 0.92 8.25 -1.26 -4.71 115.22 111.08 1vgq n HIS 135 Ca 0.35 -0.28 -0.33 0.00 -0.26 0.00 0.00 57.72 57.20 1vgq n HIS 135 Cb 1.44 0.00 -0.05 0.00 1.12 0.00 0.00 29.99 32.50 1vgq n HIS 135 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1vgq s LEU 136 N -1.32 4.26 0.08 2.41 1.43 -0.70 -4.74 118.68 120.10 1vgq s LEU 136 Ca 0.38 0.94 -0.22 0.00 -1.03 0.00 0.00 54.13 54.21 1vgq s LEU 136 Cb 0.21 -3.41 -0.07 0.00 0.03 0.00 0.00 46.19 42.95 1vgq s LEU 136 CO 0.29 0.03 0.64 -0.54 0.23 0.00 0.00 176.35 177.01 1vgq s LYS 137 N -2.37 4.34 -0.03 1.70 1.02 -1.26 -4.46 119.74 118.68 1vgq s LYS 137 Ca 0.41 0.87 -0.01 0.00 0.02 0.00 0.00 55.97 57.27 1vgq s LYS 137 Cb -0.13 -3.27 0.03 0.00 -0.52 0.00 0.00 37.83 33.94 1vgq s LYS 137 CO 0.20 0.54 0.05 0.08 -0.92 0.00 0.00 175.35 175.30 1vgq s VAL 138 N -0.85 -0.06 0.25 3.17 1.01 -1.26 -5.04 120.40 117.61 1vgq s VAL 138 Ca 0.32 0.23 0.08 0.00 0.00 0.00 0.00 61.98 62.60 1vgq s VAL 138 Cb -0.20 -0.11 -0.04 0.00 0.00 0.00 0.00 36.38 36.03 1vgq s VAL 138 CO 0.21 0.09 0.13 -0.31 0.00 0.00 0.00 175.10 175.22 1vgq s TYR 139 N 1.15 2.98 0.00 5.22 1.51 -1.26 -4.88 117.35 122.08 1vgq s TYR 139 Ca -0.08 -0.14 0.00 0.00 -1.01 0.00 0.00 57.07 55.84 1vgq s TYR 139 Cb -0.13 -1.34 0.00 0.00 -0.11 0.00 0.00 41.96 40.38 1vgq s TYR 139 CO -0.03 0.55 0.00 -1.91 -1.11 0.00 0.00 175.55 173.05 1vgq n GLU 140 N -1.04 0.00 0.20 -0.62 4.07 -1.26 -1.45 120.64 120.54 1vgq n GLU 140 Ca -0.07 0.00 0.08 0.00 -0.06 0.00 0.00 57.16 57.11 1vgq n GLU 140 Cb 0.58 0.00 0.37 0.00 -0.06 0.00 0.00 31.44 32.33 1vgq n GLU 140 CO 0.00 0.00 0.00 -0.91 -0.06 0.00 0.00 177.13 176.16 1vgq h ASN 141 N 0.00 0.00 -1.00 4.31 2.35 -1.97 -2.22 115.58 117.05 1vgq h ASN 141 Ca 0.00 0.00 0.02 0.00 -0.55 0.00 0.00 56.30 55.77 1vgq h ASN 141 Cb 0.00 0.00 -0.05 0.00 0.05 0.00 0.00 38.32 38.32 1vgq h ASN 141 CO 0.00 0.29 0.66 0.58 -1.65 0.00 0.00 177.43 177.31 1vgq h VAL 142 N 0.00 1.23 -0.03 2.81 2.07 -1.66 -1.55 116.25 119.11 1vgq h VAL 142 Ca -0.00 -0.45 -0.20 0.00 0.82 0.00 0.00 66.70 66.87 1vgq h VAL 142 Cb 0.86 -0.21 -0.00 0.00 -1.52 0.00 0.00 31.29 30.42 1vgq h VAL 142 CO 0.04 0.24 -0.83 0.00 0.02 0.00 0.00 177.57 177.04 1vgq h ALA 143 N 1.38 0.52 -0.79 1.67 0.00 -1.35 -1.49 119.26 119.20 1vgq h ALA 143 Ca 0.38 -0.67 0.07 0.00 0.00 0.00 0.00 54.91 54.69 1vgq h ALA 143 Cb -0.10 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 17.58 1vgq h ALA 143 CO -0.09 0.82 0.52 1.96 0.00 0.00 0.00 179.25 182.45 1vgq h GLN 144 N 0.21 0.81 -0.05 0.00 4.20 -1.15 -1.19 115.11 117.94 1vgq h GLN 144 Ca -0.05 -0.05 -0.18 0.00 0.06 0.00 0.00 58.65 58.43 1vgq h GLN 144 Cb 1.43 -0.18 0.01 0.00 0.30 0.00 0.00 27.48 29.04 1vgq h GLN 144 CO 0.14 0.54 -0.68 0.00 -0.67 0.00 0.00 178.83 178.15 1vgq h SER 146 N 0.16 0.00 -0.30 0.00 4.64 -1.04 -3.19 113.55 113.82 1vgq h SER 146 Ca -0.07 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.25 1vgq h SER 146 Cb 1.35 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.44 1vgq h SER 146 CO 0.14 0.27 0.00 0.61 -0.87 0.00 0.00 176.83 176.98 1vgq n GLY 147 N -0.10 1.26 0.51 -0.77 0.00 -0.47 -4.95 105.19 100.67 1vgq n GLY 147 Ca -0.01 -0.65 0.00 0.00 0.00 0.00 0.00 46.02 45.37 1vgq n GLY 147 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1vgq n GLY 148 N 1.39 0.51 0.12 -0.02 0.00 -1.20 -3.68 105.19 102.30 1vgq n GLY 148 Ca 0.18 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.07 1vgq n GLY 148 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1vgq h ALA 149 N 0.00 0.18 -0.77 4.61 0.00 -1.74 -3.17 119.26 118.36 1vgq h ALA 149 Ca 0.00 -0.28 0.03 0.00 0.00 0.00 0.00 54.91 54.66 1vgq h ALA 149 Cb 0.00 -0.04 -0.05 0.00 0.00 0.00 0.00 17.79 17.70 1vgq h ALA 149 CO 0.00 -0.01 0.49 0.00 0.00 0.00 0.00 179.25 179.73 1vgq h ALA 150 N 0.63 1.02 0.00 0.00 0.00 -1.63 -1.53 119.26 117.75 1vgq h ALA 150 Ca 0.03 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 1vgq h ALA 150 Cb 0.57 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 18.10 1vgq h ALA 150 CO 0.02 0.30 -0.08 0.00 0.00 0.00 0.00 179.25 179.49 1vgq h ALA 151 N 1.33 1.68 -0.33 0.00 0.00 -1.85 -2.48 119.26 117.61 1vgq h ALA 151 Ca 0.31 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.15 1vgq h ALA 151 Cb 0.01 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1vgq h ALA 151 CO -0.11 0.10 0.00 0.25 0.00 0.00 0.00 179.25 179.49 1vgq n THR 152 N -4.17 1.09 -5.20 0.00 -2.24 -0.91 -4.04 114.28 98.80 1vgq n THR 152 Ca -0.03 -1.06 -0.30 0.00 -2.27 0.00 0.00 64.05 60.39 1vgq n THR 152 Cb 0.16 0.45 -0.16 0.00 -2.10 0.00 0.00 70.33 68.68 1vgq n THR 152 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1vgq s THR 153 N -1.12 1.94 0.00 4.28 2.01 -0.62 -4.55 115.64 117.58 1vgq s THR 153 Ca 0.24 -1.02 0.00 0.00 0.31 0.00 0.00 61.69 61.22 1vgq s THR 153 Cb 0.13 -1.63 0.00 0.00 0.01 0.00 0.00 72.50 71.01 1vgq s THR 153 CO 0.15 0.54 0.00 0.61 -0.69 0.00 0.00 174.62 175.23 1vgq n GLY 154 N 2.80 -0.30 3.53 4.40 0.00 -1.26 -2.07 105.19 112.28 1vgq n GLY 154 Ca -0.17 -1.97 -0.26 0.00 0.00 0.00 0.00 46.02 43.62 1vgq n GLY 154 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1vgq s PHE 155 N 0.00 2.51 0.50 1.61 0.08 -1.26 -0.78 117.98 120.64 1vgq s PHE 155 Ca 0.00 -0.27 0.20 0.00 0.12 0.00 0.00 56.93 56.98 1vgq s PHE 155 Cb 0.00 -1.20 1.34 0.00 -0.57 0.00 0.00 43.02 42.59 1vgq s PHE 155 CO 0.00 0.54 2.12 0.11 -0.10 0.00 0.00 175.22 177.89 1vgq h TRP 156 N 2.82 0.00 -0.45 0.36 0.09 -1.95 -2.27 115.95 114.54 1vgq h TRP 156 Ca -0.46 0.00 0.00 0.00 0.09 0.00 0.00 58.89 58.52 1vgq h TRP 156 Cb 1.22 0.00 0.00 0.00 0.08 0.00 0.00 29.16 30.46 1vgq h TRP 156 CO 0.68 0.07 0.00 -0.40 0.09 0.00 0.00 178.44 178.88 1vgq n ASP 157 N -4.21 4.35 -2.96 0.11 5.75 -1.26 -4.90 116.55 113.42 1vgq n ASP 157 Ca -0.03 -2.65 -0.15 0.00 -0.01 0.00 0.00 54.79 51.94 1vgq n ASP 157 Cb 0.15 -0.53 -0.04 0.00 -1.03 0.00 0.00 41.12 39.67 1vgq n ASP 157 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1vgq n GLY 158 N 0.38 3.61 3.83 6.12 0.00 -0.85 -4.80 105.19 113.48 1vgq n GLY 158 Ca 0.22 -2.06 -0.30 0.00 0.00 0.00 0.00 46.02 43.89 1vgq n GLY 158 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1vgq s PRO 159 N -2.94 2.03 0.37 1.61 0.04 -1.26 -4.74 135.00 130.11 1vgq s PRO 159 Ca 0.11 0.44 -0.26 0.00 0.04 0.00 0.00 61.00 61.33 1vgq s PRO 159 Cb 0.01 -1.93 -0.12 0.00 0.04 0.00 0.00 34.50 32.50 1vgq s PRO 159 CO 0.08 -1.61 1.16 -2.30 0.04 0.00 0.00 177.00 174.37 1vgq n PRO 160 N -3.39 1.74 -4.50 0.56 -0.02 -1.26 -4.53 135.00 123.59 1vgq n PRO 160 Ca 0.07 0.62 -0.22 0.00 -2.02 0.00 0.00 63.50 61.94 1vgq n PRO 160 Cb 0.58 -2.18 -0.16 0.00 -0.02 0.00 0.00 33.50 31.72 1vgq n PRO 160 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 1vgq s THR 161 N -1.16 0.96 0.38 3.45 2.01 -0.88 -4.98 115.64 115.42 1vgq s THR 161 Ca 0.59 -0.44 -0.20 0.00 0.31 0.00 0.00 61.69 61.95 1vgq s THR 161 Cb -0.57 -0.85 -0.10 0.00 0.01 0.00 0.00 72.50 70.98 1vgq s THR 161 CO 0.59 0.30 0.89 0.68 -0.69 0.00 0.00 174.62 176.39 1vgq s VAL 162 N 0.26 4.45 0.29 3.82 -7.23 -1.26 -4.18 120.40 116.55 1vgq s VAL 162 Ca -0.05 1.37 -0.26 0.00 -1.81 0.00 0.00 61.98 61.23 1vgq s VAL 162 Cb -0.10 -3.65 -0.09 0.00 0.56 0.00 0.00 36.38 33.09 1vgq s VAL 162 CO 0.01 -0.22 0.91 -0.55 -0.31 0.00 0.00 175.10 174.94 1vgq s SER 163 N -2.13 7.34 0.42 4.85 0.15 -1.26 -4.96 113.70 118.11 1vgq s SER 163 Ca 0.58 1.79 0.12 0.00 0.70 0.00 0.00 55.95 59.14 1vgq s SER 163 Cb -0.11 -2.56 0.90 0.00 -1.71 0.00 0.00 66.02 62.54 1vgq s SER 163 CO 0.15 -0.01 1.95 1.23 1.20 0.00 0.00 173.24 177.76 1vgq h GLY 164 N 3.38 0.09 -2.75 9.45 0.00 -2.06 -3.43 103.07 107.74 1vgq h GLY 164 Ca -0.47 -0.06 -0.51 0.00 0.00 0.00 0.00 47.33 46.30 1vgq h GLY 164 CO 0.65 0.05 0.50 0.00 0.00 0.00 0.00 176.54 177.74 1vgq s ALA 165 N -4.63 2.97 -1.40 3.60 0.00 -1.26 -4.90 121.76 116.14 1vgq s ALA 165 Ca -0.04 0.97 -0.13 0.00 0.00 0.00 0.00 51.96 52.76 1vgq s ALA 165 Cb 0.15 -3.40 0.08 0.00 0.00 0.00 0.00 23.12 19.95 1vgq s ALA 165 CO 0.71 -0.72 2.11 0.00 0.00 0.00 0.00 175.76 177.86 1vgq n ALA 166 N -0.52 5.44 -0.05 0.00 0.00 -1.26 -4.69 120.51 119.42 1vgq n ALA 166 Ca 0.07 -4.01 0.11 0.00 0.00 0.00 0.00 53.44 49.62 1vgq n ALA 166 Cb 0.48 -3.37 0.51 0.00 0.00 0.00 0.00 19.45 17.07 1vgq n ALA 166 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1vgq h LEU 167 N 9.42 0.34 0.04 0.00 3.38 -1.90 -1.75 115.31 124.83 1vgq h LEU 167 Ca 0.51 0.01 -0.21 0.00 0.09 0.00 0.00 57.88 58.28 1vgq h LEU 167 Cb 0.64 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 41.31 1vgq h LEU 167 CO 1.80 0.21 -1.13 1.23 0.09 0.00 0.00 178.44 180.63 1vgq h GLY 168 N 0.38 0.09 0.00 0.83 0.00 -1.84 -3.38 103.07 99.15 1vgq h GLY 168 Ca 0.25 -0.23 0.00 0.00 0.00 0.00 0.00 47.33 47.35 1vgq h GLY 168 CO -0.06 0.20 0.00 0.00 0.00 0.00 0.00 176.54 176.68 1vgq n ALA 169 N -3.14 0.00 0.05 3.60 0.00 -1.18 -3.28 120.51 116.56 1vgq n ALA 169 Ca -0.27 -0.04 0.04 0.00 0.00 0.00 0.00 53.44 53.17 1vgq n ALA 169 Cb 0.73 0.00 0.42 0.00 0.00 0.00 0.00 19.45 20.60 1vgq n ALA 169 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 1vgq h SER 170 N 0.00 0.39 -0.48 0.00 0.02 -1.80 -1.65 113.55 110.03 1vgq h SER 170 Ca 0.00 -0.03 -0.02 0.00 -0.84 0.00 0.00 61.79 60.91 1vgq h SER 170 Cb 0.00 -0.10 -0.02 0.00 0.14 0.00 0.00 62.40 62.42 1vgq h SER 170 CO 0.00 0.34 0.24 -1.13 -1.14 0.00 0.00 176.83 175.14 1vgq h ASN 171 N 0.44 0.63 -0.71 3.07 -1.24 -1.52 -0.35 115.58 115.90 1vgq h ASN 171 Ca 0.11 -0.12 -0.00 0.00 0.71 0.00 0.00 56.30 57.00 1vgq h ASN 171 Cb 0.06 -0.16 -0.03 0.00 0.73 0.00 0.00 38.32 38.92 1vgq h ASN 171 CO -0.01 0.57 0.44 0.28 -1.29 0.00 0.00 177.43 177.42 1vgq h SER 172 N 0.64 0.84 -0.44 1.15 0.02 -1.34 -1.59 113.55 112.84 1vgq h SER 172 Ca 0.17 -0.04 -0.04 0.00 -0.84 0.00 0.00 61.79 61.03 1vgq h SER 172 Cb 0.11 -0.21 -0.02 0.00 0.14 0.00 0.00 62.40 62.42 1vgq h SER 172 CO -0.02 0.64 0.11 1.23 -1.14 0.00 0.00 176.83 177.65 1vgq h GLY 173 N 1.00 0.75 1.09 -3.77 0.00 -0.56 0.40 103.07 101.98 1vgq h GLY 173 Ca 0.26 -0.46 -0.11 0.00 0.00 0.00 0.00 47.33 47.02 1vgq h GLY 173 CO -0.05 0.43 -0.05 -0.33 0.00 0.00 0.00 176.54 176.54 1vgq h MET 174 N 0.57 1.06 -0.81 4.80 2.07 -0.95 -1.43 114.93 120.24 1vgq h MET 174 Ca 0.14 -0.36 -0.03 0.00 -2.07 0.00 0.00 59.70 57.37 1vgq h MET 174 Cb 0.31 -0.08 -0.04 0.00 -1.87 0.00 0.00 31.60 29.92 1vgq h MET 174 CO 0.00 1.06 0.37 0.45 1.07 0.00 0.00 176.91 179.87 1vgq h HIS 175 N 0.95 1.19 -0.46 -0.22 3.86 -1.08 -2.33 115.15 117.06 1vgq h HIS 175 Ca 0.16 -0.07 -0.05 0.00 -1.16 0.00 0.00 60.37 59.26 1vgq h HIS 175 Cb 0.62 -0.36 -0.02 0.00 1.06 0.00 0.00 27.41 28.70 1vgq h HIS 175 CO 0.04 0.87 0.10 1.25 0.86 0.00 0.00 177.93 181.05 1vgq h LEU 176 N 1.16 0.65 -1.00 2.43 5.85 -0.64 -1.73 115.31 122.03 1vgq h LEU 176 Ca 0.28 -0.11 -0.00 0.00 0.84 0.00 0.00 57.88 58.89 1vgq h LEU 176 Cb 0.14 -0.17 -0.05 0.00 0.37 0.00 0.00 40.66 40.96 1vgq h LEU 176 CO -0.03 0.66 0.58 -0.03 -0.34 0.00 0.00 178.44 179.28 1vgq h MET 177 N 0.68 1.27 -0.07 1.25 4.05 -0.75 0.10 114.93 121.46 1vgq h MET 177 Ca 0.15 -0.10 0.01 0.00 -0.28 0.00 0.00 59.70 59.48 1vgq h MET 177 Cb 0.28 -0.27 -0.01 0.00 -0.80 0.00 0.00 31.60 30.80 1vgq h MET 177 CO -0.00 0.87 -0.00 0.82 0.23 0.00 0.00 176.91 178.83 1vgq h ILE 178 N 1.29 0.95 -0.86 1.77 2.04 -0.93 -1.87 117.51 119.91 1vgq h ILE 178 Ca 0.34 -0.01 0.11 0.00 1.00 0.00 0.00 64.86 66.31 1vgq h ILE 178 Cb -0.08 0.93 -0.08 0.00 -0.74 0.00 0.00 36.82 36.84 1vgq h ILE 178 CO -0.07 0.00 0.49 1.23 0.00 0.00 0.00 178.15 179.80 1vgq h GLY 179 N 0.02 1.37 0.93 5.37 0.00 -0.45 0.42 103.07 110.73 1vgq h GLY 179 Ca 0.03 -0.31 -0.12 0.00 0.00 0.00 0.00 47.33 46.93 1vgq h GLY 179 CO -0.06 0.09 -0.34 -2.22 0.00 0.00 0.00 176.54 174.01 1vgq h ILE 180 N 0.77 1.32 -0.23 2.60 2.04 -0.67 -1.77 117.51 121.58 1vgq h ILE 180 Ca 0.43 -1.54 -0.12 0.00 1.00 0.00 0.00 64.86 64.63 1vgq h ILE 180 Cb 0.47 1.77 -0.01 0.00 -0.74 0.00 0.00 36.82 38.31 1vgq h ILE 180 CO -0.28 0.48 -0.36 -0.07 0.00 0.00 0.00 178.15 177.92 1vgq h LEU 181 N 0.32 0.53 -0.87 1.44 3.38 -1.03 -0.87 115.31 118.22 1vgq h LEU 181 Ca 0.02 -0.22 -0.01 0.00 0.09 0.00 0.00 57.88 57.76 1vgq h LEU 181 Cb 0.92 -0.15 -0.04 0.00 0.09 0.00 0.00 40.66 41.48 1vgq h LEU 181 CO 0.08 0.85 0.51 0.00 0.09 0.00 0.00 178.44 179.97 1vgq h ALA 182 N 1.18 1.10 -0.06 1.53 0.00 -0.88 -2.28 119.26 119.86 1vgq h ALA 182 Ca 0.04 -0.10 -0.10 0.00 0.00 0.00 0.00 54.91 54.75 1vgq h ALA 182 Cb 0.83 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 1vgq h ALA 182 CO 0.07 0.58 -0.44 0.00 0.00 0.00 0.00 179.25 179.46 1vgq h ALA 183 N 1.28 1.15 -0.11 0.00 0.00 -0.62 -1.03 119.26 119.92 1vgq h ALA 183 Ca 0.31 -0.42 -0.12 0.00 0.00 0.00 0.00 54.91 54.68 1vgq h ALA 183 Cb -0.03 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 1vgq h ALA 183 CO -0.06 0.59 -0.46 -0.07 0.00 0.00 0.00 179.25 179.25 1vgq h LEU 184 N 0.12 0.30 -0.24 0.00 3.38 -0.89 -1.66 115.31 116.32 1vgq h LEU 184 Ca 0.01 -0.14 -0.15 0.00 0.09 0.00 0.00 57.88 57.69 1vgq h LEU 184 Cb 0.83 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.49 1vgq h LEU 184 CO 0.06 0.72 -0.43 -0.08 0.09 0.00 0.00 178.44 178.80 1vgq h GLU 185 N 0.23 0.71 -0.72 1.13 4.57 -1.00 -2.73 114.58 116.77 1vgq h GLU 185 Ca 0.01 -0.45 0.12 0.00 -1.18 0.00 0.00 59.36 57.87 1vgq h GLU 185 Cb 0.90 0.05 -0.08 0.00 -0.16 0.00 0.00 28.75 29.46 1vgq h GLU 185 CO 0.07 1.07 0.31 0.82 -1.18 0.00 0.00 179.01 180.10 1vgq h ILE 186 N 0.44 0.74 -0.27 2.32 2.04 -1.01 -2.92 117.51 118.85 1vgq h ILE 186 Ca 0.01 -0.17 -0.09 0.00 1.00 0.00 0.00 64.86 65.61 1vgq h ILE 186 Cb 1.03 0.20 -0.01 0.00 -0.74 0.00 0.00 36.82 37.30 1vgq h ILE 186 CO 0.10 0.09 -0.24 -0.09 0.00 0.00 0.00 178.15 178.01 1vgq h ARG 187 N 0.49 0.50 -0.97 2.37 2.43 -1.12 -1.28 114.38 116.80 1vgq h ARG 187 Ca 0.38 -0.19 0.14 0.00 -0.81 0.00 0.00 59.98 59.50 1vgq h ARG 187 Cb 0.50 -0.03 -0.09 0.00 -0.42 0.00 0.00 29.97 29.94 1vgq h ARG 187 CO -0.34 0.70 0.61 0.45 -1.51 0.00 0.00 179.97 179.88 1vgq h HIS 188 N 0.45 1.04 0.28 2.20 3.86 -1.28 0.74 115.15 122.43 1vgq h HIS 188 Ca 0.07 0.03 -0.01 0.00 -1.16 0.00 0.00 60.37 59.29 1vgq h HIS 188 Cb 0.65 -0.32 0.00 0.00 1.06 0.00 0.00 27.41 28.80 1vgq h HIS 188 CO 0.02 0.37 -0.14 -0.22 0.86 0.00 0.00 177.93 178.82 1vgq h LYS 189 N 0.86 -0.37 0.00 2.45 3.64 -1.31 -3.39 116.57 118.46 1vgq h LYS 189 Ca 0.50 0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.91 1vgq h LYS 189 Cb 0.65 0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.55 1vgq h LYS 189 CO -0.27 -0.11 -0.56 0.25 -2.27 0.00 0.00 179.45 176.49 1vgq n THR 190 N -5.03 0.05 -1.26 1.00 -2.24 -0.69 -4.95 114.28 101.15 1vgq n THR 190 Ca -0.07 -0.04 -0.09 0.00 -2.27 0.00 0.00 64.05 61.58 1vgq n THR 190 Cb 0.22 0.23 -0.04 0.00 -2.10 0.00 0.00 70.33 68.64 1vgq n THR 190 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1vgq n GLY 191 N 1.48 0.95 3.18 3.38 0.00 0.24 -5.00 105.19 109.42 1vgq n GLY 191 Ca 0.05 -0.13 -0.18 0.00 0.00 0.00 0.00 46.02 45.76 1vgq n GLY 191 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1vgq s ARG 192 N -2.57 0.84 0.41 1.61 1.81 -1.25 -4.58 118.95 115.21 1vgq s ARG 192 Ca 0.00 -1.00 -0.04 0.00 -1.72 0.00 0.00 55.73 52.97 1vgq s ARG 192 Cb 0.00 -0.79 -0.04 0.00 -0.45 0.00 0.00 34.95 33.67 1vgq s ARG 192 CO 0.00 0.17 0.68 0.20 -0.68 0.00 0.00 175.30 175.67 1vgq s GLY 193 N -1.88 1.50 0.27 -3.53 0.00 -0.72 -4.13 107.32 98.83 1vgq s GLY 193 Ca -0.00 -0.63 0.05 0.00 0.00 0.00 0.00 44.72 44.14 1vgq s GLY 193 CO 0.02 -0.50 -0.02 1.20 0.00 0.00 0.00 173.10 173.80 1vgq s GLN 194 N -4.44 1.48 -0.04 2.90 -0.21 -1.26 -4.92 119.66 113.18 1vgq s GLN 194 Ca 0.45 -1.76 -0.19 0.00 0.02 0.00 0.00 55.36 53.87 1vgq s GLN 194 Cb -0.10 -0.89 -0.05 0.00 1.00 0.00 0.00 33.01 32.97 1vgq s GLN 194 CO 0.40 -0.05 0.55 0.21 -2.12 0.00 0.00 175.29 174.27 1vgq s LYS 195 N -3.81 4.29 -0.03 2.91 2.20 -1.26 -1.67 119.74 122.37 1vgq s LYS 195 Ca 0.30 0.63 0.06 0.00 -0.36 0.00 0.00 55.97 56.60 1vgq s LYS 195 Cb 0.05 -3.36 -0.01 0.00 -1.51 0.00 0.00 37.83 33.00 1vgq s LYS 195 CO 0.11 0.32 -0.20 0.08 -0.36 0.00 0.00 175.35 175.30 1vgq s VAL 196 N 0.01 1.65 0.02 4.02 1.01 0.26 -4.96 120.40 122.40 1vgq s VAL 196 Ca 0.29 -0.87 0.02 0.00 0.00 0.00 0.00 61.98 61.43 1vgq s VAL 196 Cb -0.17 -1.39 -0.01 0.00 0.00 0.00 0.00 36.38 34.81 1vgq s VAL 196 CO 0.15 0.47 -0.07 0.00 0.00 0.00 0.00 175.10 175.65 1vgq s ALA 197 N -0.27 0.53 -0.11 5.51 0.00 -1.26 -1.32 121.76 124.84 1vgq s ALA 197 Ca 0.02 -0.47 0.01 0.00 0.00 0.00 0.00 51.96 51.52 1vgq s ALA 197 Cb -0.10 -0.06 0.02 0.00 0.00 0.00 0.00 23.12 22.98 1vgq s ALA 197 CO 0.01 0.06 -0.14 0.08 0.00 0.00 0.00 175.76 175.78 1vgq s VAL 198 N -0.65 1.41 0.10 0.00 1.01 -0.59 -4.98 120.40 116.70 1vgq s VAL 198 Ca -0.03 -0.57 -0.23 0.00 0.00 0.00 0.00 61.98 61.16 1vgq s VAL 198 Cb -0.05 -1.31 -0.07 0.00 0.00 0.00 0.00 36.38 34.95 1vgq s VAL 198 CO 0.00 0.43 0.68 0.00 0.00 0.00 0.00 175.10 176.21 1vgq s ALA 199 N 1.16 3.49 0.23 5.51 0.00 -1.26 -1.91 121.76 128.99 1vgq s ALA 199 Ca -0.03 0.20 -0.07 0.00 0.00 0.00 0.00 51.96 52.05 1vgq s ALA 199 Cb -0.14 -2.82 0.20 0.00 0.00 0.00 0.00 23.12 20.36 1vgq s ALA 199 CO -0.04 0.28 1.86 0.52 0.00 0.00 0.00 175.76 178.39 1vgq h MET 200 N 4.73 1.23 -0.62 0.00 2.86 -0.27 -1.11 114.93 121.75 1vgq h MET 200 Ca -0.47 -0.13 0.10 0.00 -2.06 0.00 0.00 59.70 57.13 1vgq h MET 200 Cb 1.21 -0.25 -0.07 0.00 0.06 0.00 0.00 31.60 32.55 1vgq h MET 200 CO 0.66 0.88 0.24 0.37 1.06 0.00 0.00 176.91 180.12 1vgq h GLN 201 N 1.23 0.40 -0.18 1.72 4.15 -1.65 -1.95 115.11 118.84 1vgq h GLN 201 Ca 0.31 -0.02 -0.15 0.00 0.77 0.00 0.00 58.65 59.56 1vgq h GLN 201 Cb -0.00 -0.09 -0.01 0.00 0.21 0.00 0.00 27.48 27.59 1vgq h GLN 201 CO -0.05 0.27 -0.52 -0.44 -1.93 0.00 0.00 178.83 176.16 1vgq h ASP 202 N 0.42 0.56 -0.39 -0.69 5.19 -1.54 -0.85 116.42 119.13 1vgq h ASP 202 Ca 0.32 -0.29 -0.14 0.00 -0.62 0.00 0.00 57.03 56.30 1vgq h ASP 202 Cb 0.40 -0.16 -0.01 0.00 0.18 0.00 0.00 39.33 39.74 1vgq h ASP 202 CO -0.31 0.98 -0.27 0.00 -3.12 0.00 0.00 179.24 176.52 1vgq h ALA 203 N 1.04 0.72 0.08 3.45 0.00 -0.97 -1.43 119.26 122.14 1vgq h ALA 203 Ca 0.01 -0.41 -0.00 0.00 0.00 0.00 0.00 54.91 54.51 1vgq h ALA 203 Cb 1.04 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.68 1vgq h ALA 203 CO 0.10 0.67 -0.04 0.28 0.00 0.00 0.00 179.25 180.25 1vgq h VAL 204 N 0.78 0.98 -0.93 0.00 2.07 -1.25 -3.12 116.25 114.77 1vgq h VAL 204 Ca 0.09 -0.21 0.12 0.00 0.82 0.00 0.00 66.70 67.52 1vgq h VAL 204 Cb 0.83 1.11 -0.07 0.00 -1.52 0.00 0.00 31.29 31.64 1vgq h VAL 204 CO 0.07 0.05 0.60 0.25 0.02 0.00 0.00 177.57 178.56 1vgq h LEU 205 N -0.21 0.81 -1.07 2.57 6.46 -0.98 -1.19 115.31 121.71 1vgq h LEU 205 Ca -0.01 0.04 0.00 0.00 -0.12 0.00 0.00 57.88 57.79 1vgq h LEU 205 Cb 0.17 -0.13 -0.04 0.00 -0.73 0.00 0.00 40.66 39.93 1vgq h LEU 205 CO 0.02 0.45 0.57 -1.13 -0.62 0.00 0.00 178.44 177.72 1vgq h ASN 206 N 0.88 1.06 1.72 1.25 -0.00 -1.21 -1.16 115.58 118.11 1vgq h ASN 206 Ca 0.45 -0.05 -0.01 0.00 -0.00 0.00 0.00 56.30 56.70 1vgq h ASN 206 Cb 0.51 -0.27 -0.00 0.00 -0.00 0.00 0.00 38.32 38.56 1vgq h ASN 206 CO -0.21 0.79 -0.03 -0.07 -0.00 0.00 0.00 177.43 177.91 1vgq h LEU 207 N 1.23 0.00 -2.22 0.34 3.38 -1.20 -3.07 115.31 113.77 1vgq h LEU 207 Ca 0.33 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.30 1vgq h LEU 207 Cb -0.10 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.65 1vgq h LEU 207 CO -0.07 0.03 0.00 0.52 0.09 0.00 0.00 178.44 179.01 1vgq n VAL 208 N -3.11 1.16 -0.31 1.22 0.31 -0.53 -4.51 118.33 112.57 1vgq n VAL 208 Ca 0.03 -0.79 0.10 0.00 -0.01 0.00 0.00 64.34 63.67 1vgq n VAL 208 Cb 0.48 0.06 0.26 0.00 -0.91 0.00 0.00 33.84 33.74 1vgq n VAL 208 CO 0.00 0.00 0.00 -0.09 -1.32 0.00 0.00 176.83 175.42 1vgq h ARG 209 N 2.87 0.58 0.00 5.55 2.43 -1.22 -0.43 114.38 124.16 1vgq h ARG 209 Ca 0.00 -0.03 -0.01 0.00 -0.81 0.00 0.00 59.98 59.13 1vgq h ARG 209 Cb 1.01 -0.13 -0.00 0.00 -0.42 0.00 0.00 29.97 30.43 1vgq h ARG 209 CO 0.14 0.38 -0.03 -0.84 -1.51 0.00 0.00 179.97 178.10 1vgq h ILE 210 N 0.60 0.75 0.00 1.20 3.07 -1.87 -1.35 117.51 119.91 1vgq h ILE 210 Ca 0.51 -0.13 -0.12 0.00 1.55 0.00 0.00 64.86 66.67 1vgq h ILE 210 Cb 0.80 1.08 -0.02 0.00 -0.27 0.00 0.00 36.82 38.41 1vgq h ILE 210 CO -0.40 0.03 -0.63 0.11 -1.05 0.00 0.00 178.15 176.21 1vgq h LYS 211 N 0.00 0.00 -0.06 0.16 1.79 -1.42 -1.99 116.57 115.05 1vgq h LYS 211 Ca -0.00 0.00 -0.16 0.00 -2.18 0.00 0.00 60.65 58.31 1vgq h LYS 211 Cb 0.07 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.71 1vgq h LYS 211 CO 0.00 0.49 -0.67 1.25 -1.08 0.00 0.00 179.45 179.45 1vgq h LEU 212 N 0.00 0.29 -0.23 2.94 5.85 -1.18 0.03 115.31 123.01 1vgq h LEU 212 Ca -0.02 -0.18 0.05 0.00 0.84 0.00 0.00 57.88 58.57 1vgq h LEU 212 Cb 1.42 -0.09 -0.05 0.00 0.37 0.00 0.00 40.66 42.31 1vgq h LEU 212 CO 0.06 0.87 -0.12 -0.09 -0.34 0.00 0.00 178.44 178.83 1vgq h ARG 213 N 0.18 -0.09 -0.59 1.25 2.43 -1.18 -2.61 114.38 113.77 1vgq h ARG 213 Ca -0.02 0.01 -0.04 0.00 -0.81 0.00 0.00 59.98 59.12 1vgq h ARG 213 Cb 1.20 0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 30.75 1vgq h ARG 213 CO 0.10 -0.06 0.18 -0.44 -1.51 0.00 0.00 179.97 178.25 1vgq h ASP 214 N -0.10 0.81 -0.72 -3.80 3.32 -1.13 -1.51 116.42 113.30 1vgq h ASP 214 Ca 0.12 -0.13 -0.06 0.00 0.02 0.00 0.00 57.03 56.98 1vgq h ASP 214 Cb 0.28 -0.21 -0.03 0.00 0.22 0.00 0.00 39.33 39.59 1vgq h ASP 214 CO -0.29 0.77 0.22 -0.61 -1.72 0.00 0.00 179.24 177.61 1vgq h GLN 215 N 0.85 1.13 -0.18 3.56 5.75 -0.81 -0.55 115.11 124.86 1vgq h GLN 215 Ca 0.19 -0.24 -0.17 0.00 -0.15 0.00 0.00 58.65 58.28 1vgq h GLN 215 Cb 0.25 -0.16 -0.00 0.00 1.07 0.00 0.00 27.48 28.63 1vgq h GLN 215 CO -0.01 0.96 -0.58 1.96 -2.65 0.00 0.00 178.83 178.51 1vgq h GLN 216 N 1.08 0.58 -0.69 1.69 4.20 -1.19 -1.20 115.11 119.57 1vgq h GLN 216 Ca 0.23 -0.38 -0.02 0.00 0.06 0.00 0.00 58.65 58.54 1vgq h GLN 216 Cb 0.31 0.05 -0.03 0.00 0.30 0.00 0.00 27.48 28.11 1vgq h GLN 216 CO -0.01 0.99 0.35 0.00 -0.67 0.00 0.00 178.83 179.50 1vgq h ARG 217 N 0.44 0.99 -0.38 1.46 3.08 -0.86 -1.45 114.38 117.65 1vgq h ARG 217 Ca 0.00 -0.13 -0.05 0.00 0.07 0.00 0.00 59.98 59.87 1vgq h ARG 217 Cb 1.14 -0.18 -0.01 0.00 0.08 0.00 0.00 29.97 30.99 1vgq h ARG 217 CO 0.11 0.77 0.05 1.25 -1.07 0.00 0.00 179.97 181.08 1vgq h LEU 218 N 0.96 0.61 -1.06 3.04 5.85 -1.02 -1.05 115.31 122.64 1vgq h LEU 218 Ca 0.24 -0.27 -0.03 0.00 0.84 0.00 0.00 57.88 58.67 1vgq h LEU 218 Cb 0.09 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 40.92 1vgq h LEU 218 CO -0.03 0.72 0.33 -0.33 -0.34 0.00 0.00 178.44 178.79 1vgq h GLU 219 N 0.48 0.99 0.00 1.25 5.08 -0.99 -0.52 114.58 120.88 1vgq h GLU 219 Ca 0.11 -0.14 -0.20 0.00 -1.00 0.00 0.00 59.36 58.13 1vgq h GLU 219 Cb 0.38 -0.18 -0.03 0.00 0.50 0.00 0.00 28.75 29.41 1vgq h GLU 219 CO 0.01 0.77 -0.97 0.00 -1.00 0.00 0.00 179.01 177.82 1vgq h ARG 220 N 0.99 0.00 0.00 2.33 3.08 -1.04 -3.40 114.38 116.34 1vgq h ARG 220 Ca 0.24 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.29 1vgq h ARG 220 Cb 0.11 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.16 1vgq h ARG 220 CO -0.03 0.97 -0.17 0.25 -1.07 0.00 0.00 179.97 179.92 1vgq n THR 221 N -3.35 0.00 -1.02 2.04 -2.24 -0.42 -5.03 114.28 104.26 1vgq n THR 221 Ca 0.00 -0.22 -0.01 0.00 -2.27 0.00 0.00 64.05 61.55 1vgq n THR 221 Cb 0.93 0.81 -0.00 0.00 -2.10 0.00 0.00 70.33 69.96 1vgq n THR 221 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1vgq n GLY 222 N 0.87 0.39 3.46 3.38 0.00 -0.21 -5.00 105.19 108.08 1vgq n GLY 222 Ca 0.00 -0.07 -0.16 0.00 0.00 0.00 0.00 46.02 45.79 1vgq n GLY 222 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1vgq s ILE 223 N -1.71 0.01 -0.36 -0.61 2.07 -1.26 -4.66 121.20 114.68 1vgq s ILE 223 Ca 0.00 -0.10 0.03 0.00 -1.41 0.00 0.00 60.65 59.16 1vgq s ILE 223 Cb 0.00 -0.87 0.11 0.00 0.13 0.00 0.00 42.46 41.83 1vgq s ILE 223 CO 0.00 -0.06 0.10 -0.76 -1.91 0.00 0.00 174.94 172.31 1vgq s LEU 224 N -0.77 3.89 0.52 8.50 1.43 -1.26 -4.45 118.68 126.54 1vgq s LEU 224 Ca -0.08 -2.15 0.30 0.00 -1.03 0.00 0.00 54.13 51.16 1vgq s LEU 224 Cb -0.02 -1.38 1.33 0.00 0.03 0.00 0.00 46.19 46.14 1vgq s LEU 224 CO 0.06 -0.36 1.99 0.00 0.23 0.00 0.00 176.35 178.26 1vgq h ALA 225 N 7.55 1.08 -0.00 4.21 0.00 -1.99 -2.16 119.26 127.94 1vgq h ALA 225 Ca -0.07 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.74 1vgq h ALA 225 Cb 1.00 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.77 1vgq h ALA 225 CO 0.52 0.13 -0.26 -0.85 0.00 0.00 0.00 179.25 178.80 1vgq n GLU 226 N -3.33 0.10 -3.01 0.00 0.00 -1.26 -4.78 120.64 108.35 1vgq n GLU 226 Ca -0.00 -0.04 -0.35 0.00 0.00 0.00 0.00 57.16 56.77 1vgq n GLU 226 Cb 0.31 -1.50 -0.06 0.00 0.00 0.00 0.00 31.44 30.19 1vgq n GLU 226 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.13 177.84 1vgq s TYR 227 N -2.93 3.54 0.35 -1.84 1.51 -0.81 -4.86 117.35 112.31 1vgq s TYR 227 Ca 0.15 1.45 0.10 0.00 -1.01 0.00 0.00 57.07 57.75 1vgq s TYR 227 Cb 0.18 -2.68 0.86 0.00 -0.11 0.00 0.00 41.96 40.21 1vgq s TYR 227 CO 0.60 0.19 1.81 -1.35 -1.11 0.00 0.00 175.55 175.69 1vgq h PRO 228 N 2.87 0.63 -0.01 -1.71 0.11 -1.87 -1.62 132.00 130.39 1vgq h PRO 228 Ca -0.48 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.60 1vgq h PRO 228 Cb 1.19 -0.14 -0.00 0.00 0.11 0.00 0.00 31.00 32.15 1vgq h PRO 228 CO 0.65 0.41 0.02 1.96 -0.21 0.00 0.00 178.00 180.83 1vgq h GLN 229 N 0.65 0.00 -0.00 1.05 7.50 -1.90 -1.53 115.11 120.88 1vgq h GLN 229 Ca 0.53 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.68 1vgq h GLN 229 Cb 0.98 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.51 1vgq h GLN 229 CO -0.30 0.00 -0.24 0.00 -1.50 0.00 0.00 178.83 176.79 1vgq n ALA 230 N -2.19 2.92 -2.66 3.87 0.00 -0.61 -4.05 120.51 117.78 1vgq n ALA 230 Ca -0.03 -0.22 -0.43 0.00 0.00 0.00 0.00 53.44 52.77 1vgq n ALA 230 Cb 0.10 -1.30 -0.03 0.00 0.00 0.00 0.00 19.45 18.22 1vgq n ALA 230 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 1vgq s GLN 231 N -3.00 4.24 0.13 0.00 0.74 -0.58 -4.82 119.66 116.37 1vgq s GLN 231 Ca 0.13 1.25 -0.33 0.00 0.05 0.00 0.00 55.36 56.46 1vgq s GLN 231 Cb 0.18 -3.64 -0.13 0.00 1.10 0.00 0.00 33.01 30.52 1vgq s GLN 231 CO 0.61 -0.61 1.67 -2.30 -0.55 0.00 0.00 175.29 174.12 1vgq n PRO 232 N 6.25 2.32 -3.42 1.67 -0.02 -1.26 -3.12 135.00 137.42 1vgq n PRO 232 Ca 0.10 0.84 -0.25 0.00 -2.02 0.00 0.00 63.50 62.18 1vgq n PRO 232 Cb 0.46 -2.65 0.03 0.00 -0.02 0.00 0.00 33.50 31.33 1vgq n PRO 232 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1vgq n ASN 233 N 4.23 -5.29 -0.12 2.55 5.03 -1.26 -4.88 115.26 115.52 1vgq n ASN 233 Ca 0.18 -0.47 -0.25 0.00 0.87 0.00 0.00 54.58 54.90 1vgq n ASN 233 Cb 0.31 -4.25 -0.09 0.00 -1.02 0.00 0.00 39.78 34.73 1vgq n ASN 233 CO 0.00 0.00 0.00 0.33 -1.83 0.00 0.00 177.26 175.76 1vgq n PHE 234 N -4.50 0.00 -3.64 3.10 7.35 -1.18 -5.03 117.46 113.56 1vgq n PHE 234 Ca -0.03 0.00 -0.34 0.00 -0.76 0.00 0.00 57.45 56.32 1vgq n PHE 234 Cb 0.57 -0.86 -0.05 0.00 0.35 0.00 0.00 39.48 39.49 1vgq n PHE 234 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1vgq s ALA 235 N -2.44 3.77 0.01 3.13 0.00 -1.26 -5.04 121.76 119.93 1vgq s ALA 235 Ca -0.33 -0.46 0.00 0.00 0.00 0.00 0.00 51.96 51.17 1vgq s ALA 235 Cb 0.13 -2.19 -0.01 0.00 0.00 0.00 0.00 23.12 21.04 1vgq s ALA 235 CO 0.43 0.61 -0.02 -0.06 0.00 0.00 0.00 175.76 176.72 1vgq s PHE 236 N -1.42 0.15 1.04 0.00 0.40 -1.26 -1.24 117.98 115.66 1vgq s PHE 236 Ca 0.33 -0.28 -0.18 0.00 -0.60 0.00 0.00 56.93 56.20 1vgq s PHE 236 Cb -0.13 -0.11 0.25 0.00 0.51 0.00 0.00 43.02 43.53 1vgq s PHE 236 CO 0.19 -0.10 1.25 -0.40 0.70 0.00 0.00 175.22 176.86 1vgq n ASP 237 N 2.29 -0.52 -0.30 1.36 5.68 -0.98 -4.63 116.55 119.44 1vgq n ASP 237 Ca -0.18 -1.39 0.21 0.00 -0.50 0.00 0.00 54.79 52.93 1vgq n ASP 237 Cb 0.57 -1.01 0.50 0.00 -1.14 0.00 0.00 41.12 40.05 1vgq n ASP 237 CO 0.00 0.00 0.00 0.03 -1.33 0.00 0.00 177.20 175.90 1vgq h ARG 238 N 0.00 0.41 -4.60 0.11 3.08 -1.90 -3.26 114.38 108.21 1vgq h ARG 238 Ca -0.42 -0.02 -0.73 0.00 0.07 0.00 0.00 59.98 58.88 1vgq h ARG 238 Cb 1.19 -0.09 -0.21 0.00 0.08 0.00 0.00 29.97 30.95 1vgq h ARG 238 CO 0.29 0.27 0.56 -0.51 -1.07 0.00 0.00 179.97 179.51 1vgq s ASP 239 N -5.38 6.67 0.00 7.04 1.11 -1.26 -4.95 116.67 119.89 1vgq s ASP 239 Ca -0.09 -2.26 0.00 0.00 0.18 0.00 0.00 52.55 50.38 1vgq s ASP 239 Cb 0.24 -2.33 0.00 0.00 1.07 0.00 0.00 42.92 41.90 1vgq s ASP 239 CO 0.79 -0.89 0.00 0.61 1.18 0.00 0.00 175.17 176.86 1vgq n GLY 240 N 4.95 0.00 3.63 0.21 0.00 -1.23 -4.80 105.19 107.96 1vgq n GLY 240 Ca 0.20 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.10 1vgq n GLY 240 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1vgq s ASN 241 N 0.00 -0.67 0.32 1.61 0.02 -1.26 -4.98 114.94 109.98 1vgq s ASN 241 Ca 0.00 1.27 -0.28 0.00 -1.02 0.00 0.00 52.86 52.83 1vgq s ASN 241 Cb 0.00 1.28 -0.13 0.00 0.02 0.00 0.00 41.25 42.42 1vgq s ASN 241 CO 0.00 -0.22 1.07 -2.65 0.02 0.00 0.00 177.10 175.32 1vgq n PRO 242 N 2.72 1.53 -4.49 -0.60 -0.02 -1.26 -2.31 135.00 130.57 1vgq n PRO 242 Ca -0.14 0.54 -0.34 0.00 -2.02 0.00 0.00 63.50 61.54 1vgq n PRO 242 Cb 0.56 -1.98 -0.10 0.00 -0.02 0.00 0.00 33.50 31.96 1vgq n PRO 242 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1vgq s LEU 243 N 0.01 3.31 0.32 2.45 1.43 -0.37 -4.72 118.68 121.10 1vgq s LEU 243 Ca 0.58 -0.01 -0.05 0.00 -1.03 0.00 0.00 54.13 53.63 1vgq s LEU 243 Cb -0.65 -1.79 0.00 0.00 0.03 0.00 0.00 46.19 43.78 1vgq s LEU 243 CO 0.60 0.34 0.46 -0.94 0.23 0.00 0.00 176.35 177.04 1vgq s SER 244 N -1.06 0.65 0.00 2.29 1.04 -1.26 -4.68 113.70 110.68 1vgq s SER 244 Ca 0.15 -1.36 0.31 0.00 0.48 0.00 0.00 55.95 55.52 1vgq s SER 244 Cb -0.11 0.64 1.68 0.00 0.10 0.00 0.00 66.02 68.32 1vgq s SER 244 CO 0.04 -1.25 2.11 0.49 0.98 0.00 0.00 173.24 175.61 1vgq n PHE 245 N -0.51 0.00 -0.23 5.02 3.01 -1.26 -4.18 117.46 119.31 1vgq n PHE 245 Ca 0.00 0.00 0.01 0.00 1.01 0.00 0.00 57.45 58.47 1vgq n PHE 245 Cb 0.62 -0.08 0.08 0.00 -0.01 0.00 0.00 39.48 40.09 1vgq n PHE 245 CO 0.00 0.00 0.00 -0.44 1.01 0.00 0.00 176.76 177.33 1vgq h ASP 246 N 0.26 -0.58 -0.26 4.37 5.19 -1.96 -2.40 116.42 121.04 1vgq h ASP 246 Ca 0.00 0.20 -0.11 0.00 -0.62 0.00 0.00 57.03 56.50 1vgq h ASP 246 Cb 0.14 0.40 -0.06 0.00 0.18 0.00 0.00 39.33 39.99 1vgq h ASP 246 CO 0.00 -0.21 -0.11 0.59 -3.12 0.00 0.00 179.24 176.39 1vgq n ASN 247 N -5.43 2.64 -4.40 6.45 5.03 -1.26 -4.94 115.26 113.35 1vgq n ASN 247 Ca 0.09 -3.58 -0.38 0.00 0.87 0.00 0.00 54.58 51.58 1vgq n ASN 247 Cb 0.36 -0.59 -0.12 0.00 -1.02 0.00 0.00 39.78 38.41 1vgq n ASN 247 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 1vgq s ILE 248 N -3.13 4.29 -0.59 2.41 1.01 -0.90 -4.95 121.20 119.33 1vgq s ILE 248 Ca 0.42 -0.52 0.10 0.00 0.00 0.00 0.00 60.65 60.64 1vgq s ILE 248 Cb 0.38 -3.18 -0.08 0.00 0.01 0.00 0.00 42.46 39.59 1vgq s ILE 248 CO 0.01 0.10 0.47 0.35 0.00 0.00 0.00 174.94 175.87 1vgq n THR 249 N 4.92 0.00 -4.55 2.92 -2.24 -1.26 -4.95 114.28 109.12 1vgq n THR 249 Ca -0.14 -0.30 -0.22 0.00 -2.27 0.00 0.00 64.05 61.11 1vgq n THR 249 Cb 0.49 1.03 -0.14 0.00 -2.10 0.00 0.00 70.33 69.61 1vgq n THR 249 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1vgq s SER 250 N -1.77 1.71 -0.18 3.42 0.15 -1.26 -4.84 113.70 110.92 1vgq s SER 250 Ca 0.05 -0.34 -0.39 0.00 0.70 0.00 0.00 55.95 55.97 1vgq s SER 250 Cb 0.08 -0.16 -0.16 0.00 -1.71 0.00 0.00 66.02 64.07 1vgq s SER 250 CO 0.36 0.13 1.66 0.52 1.20 0.00 0.00 173.24 177.11 1vgq n VAL 251 N 2.41 0.25 -2.43 4.45 0.31 -1.26 -4.93 118.33 117.13 1vgq n VAL 251 Ca -0.16 -0.04 -0.24 0.00 -0.01 0.00 0.00 64.34 63.89 1vgq n VAL 251 Cb 0.55 -1.17 0.07 0.00 -0.91 0.00 0.00 33.84 32.38 1vgq n VAL 251 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 1vgq s PRO 252 N 2.85 2.13 0.20 5.55 0.04 -1.26 -4.74 135.00 139.77 1vgq s PRO 252 Ca 0.95 -0.64 -0.30 0.00 0.04 0.00 0.00 61.00 61.05 1vgq s PRO 252 Cb -1.02 -2.30 -0.08 0.00 0.04 0.00 0.00 34.50 31.13 1vgq s PRO 252 CO 0.60 -1.15 1.12 1.03 0.04 0.00 0.00 177.00 178.64 1vgq s ARG 253 N -5.08 4.58 -0.18 4.56 0.52 -1.26 -4.78 118.95 117.31 1vgq s ARG 253 Ca 0.61 1.77 0.14 0.00 -0.52 0.00 0.00 55.73 57.72 1vgq s ARG 253 Cb -0.09 -3.25 0.38 0.00 0.52 0.00 0.00 34.95 32.51 1vgq s ARG 253 CO 0.43 0.07 1.20 0.41 0.02 0.00 0.00 175.30 177.42 1vgq n GLY 254 N 1.90 4.92 7.00 -3.53 0.00 -1.24 -3.68 105.19 110.57 1vgq n GLY 254 Ca 0.02 -1.24 0.00 0.00 0.00 0.00 0.00 46.02 44.81 1vgq n GLY 254 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1vgq n GLY 255 N -1.16 3.13 2.05 -0.02 0.00 0.04 -1.86 105.19 107.38 1vgq n GLY 255 Ca 0.18 0.17 -0.20 0.00 0.00 0.00 0.00 46.02 46.17 1vgq n GLY 255 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1vgq n ASN 256 N 4.57 3.61 -4.66 1.61 3.02 -1.26 -4.68 115.26 117.47 1vgq n ASN 256 Ca 0.00 -3.61 -0.30 0.00 -0.03 0.00 0.00 54.58 50.64 1vgq n ASN 256 Cb 0.00 -0.80 0.17 0.00 -0.61 0.00 0.00 39.78 38.53 1vgq n ASN 256 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1vgq s ALA 257 N -3.27 1.12 0.38 5.41 0.00 -0.78 -3.95 121.76 120.67 1vgq s ALA 257 Ca 0.55 0.07 0.33 0.00 0.00 0.00 0.00 51.96 52.91 1vgq s ALA 257 Cb 0.47 -3.26 1.65 0.00 0.00 0.00 0.00 23.12 21.97 1vgq s ALA 257 CO 0.09 -2.74 2.11 0.78 0.00 0.00 0.00 175.76 176.00 1vgq h GLY 258 N -1.84 0.00 0.00 0.00 0.00 -1.81 -3.46 103.07 95.96 1vgq h GLY 258 Ca -0.51 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.82 1vgq h GLY 258 CO 0.51 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.66 1vgq n GLY 259 N -0.56 3.59 0.05 4.60 0.00 -1.26 -2.07 105.19 109.53 1vgq n GLY 259 Ca -0.01 -0.07 0.12 0.00 0.00 0.00 0.00 46.02 46.06 1vgq n GLY 259 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1vgq n GLY 260 N 0.00 -1.12 3.87 -0.02 0.00 -1.26 -4.80 105.19 101.86 1vgq n GLY 260 Ca 0.00 -0.36 -0.29 0.00 0.00 0.00 0.00 46.02 45.37 1vgq n GLY 260 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1vgq s GLY 261 N -2.90 1.59 0.87 -0.02 0.00 -0.88 -5.07 107.32 100.92 1vgq s GLY 261 Ca 0.14 -0.56 -0.11 0.00 0.00 0.00 0.00 44.72 44.19 1vgq s GLY 261 CO 0.66 -0.07 1.16 1.20 0.00 0.00 0.00 173.10 176.05 1vgq s GLN 262 N -5.46 1.30 0.16 2.90 -1.52 -1.26 -4.75 119.66 111.03 1vgq s GLN 262 Ca 0.62 1.57 -0.32 0.00 -1.95 0.00 0.00 55.36 55.27 1vgq s GLN 262 Cb -0.12 -1.76 -0.16 0.00 -0.22 0.00 0.00 33.01 30.75 1vgq s GLN 262 CO 0.51 -2.43 1.01 -2.30 -0.25 0.00 0.00 175.29 171.83 1vgq n PRO 263 N -3.91 0.79 -3.85 2.91 -0.02 -1.25 -4.59 135.00 125.07 1vgq n PRO 263 Ca 0.12 0.28 -0.12 0.00 -2.02 0.00 0.00 63.50 61.76 1vgq n PRO 263 Cb 0.52 -1.67 0.00 0.00 -0.02 0.00 0.00 33.50 32.33 1vgq n PRO 263 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1vgq n GLY 264 N 1.85 1.52 3.61 -1.23 0.00 -1.26 -0.03 105.19 109.65 1vgq n GLY 264 Ca 0.16 -1.42 -0.09 0.00 0.00 0.00 0.00 46.02 44.66 1vgq n GLY 264 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1vgq s TRP 265 N -2.58 -0.10 -0.38 1.61 -0.11 -1.00 -4.01 118.94 112.36 1vgq s TRP 265 Ca 0.22 -0.27 -0.17 0.00 1.22 0.00 0.00 56.10 57.11 1vgq s TRP 265 Cb -0.03 0.46 0.01 0.00 -1.50 0.00 0.00 33.47 32.41 1vgq s TRP 265 CO 0.16 -1.01 0.42 1.41 -4.62 0.00 0.00 176.95 173.31 1vgq s MET 266 N -3.90 3.32 -0.13 5.86 -2.45 -1.26 -1.83 119.30 118.92 1vgq s MET 266 Ca 0.11 -0.57 -0.01 0.00 -1.25 0.00 0.00 55.69 53.97 1vgq s MET 266 Cb -0.02 -3.89 -0.02 0.00 1.25 0.00 0.00 34.83 32.14 1vgq s MET 266 CO 0.01 -0.71 -0.08 -0.51 1.05 0.00 0.00 175.02 174.78 1vgq s LEU 267 N 2.12 3.00 0.47 4.11 1.43 0.39 -4.96 118.68 125.24 1vgq s LEU 267 Ca 0.13 -0.19 -0.24 0.00 -1.03 0.00 0.00 54.13 52.79 1vgq s LEU 267 Cb -0.17 -1.69 -0.07 0.00 0.03 0.00 0.00 46.19 44.29 1vgq s LEU 267 CO 0.13 0.21 1.37 -0.54 0.23 0.00 0.00 176.35 177.74 1vgq s LYS 268 N 0.12 3.60 0.46 1.70 1.02 -1.26 -1.45 119.74 123.92 1vgq s LYS 268 Ca -0.04 2.28 0.03 0.00 0.02 0.00 0.00 55.97 58.26 1vgq s LYS 268 Cb -0.14 -2.55 -0.03 0.00 -0.52 0.00 0.00 37.83 34.59 1vgq s LYS 268 CO 0.04 -0.84 0.04 0.00 -0.92 0.00 0.00 175.35 173.67 1vgq n LYS 270 N -1.09 1.98 -0.05 0.00 4.81 -1.07 -2.96 118.16 119.79 1vgq n LYS 270 Ca -0.12 0.72 0.00 0.00 -0.87 0.00 0.00 58.31 58.03 1vgq n LYS 270 Cb 0.66 -2.48 0.00 0.00 0.02 0.00 0.00 35.03 33.24 1vgq n LYS 270 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1vgq n GLY 271 N 3.47 0.97 0.24 3.14 0.00 -1.26 -4.71 105.19 107.03 1vgq n GLY 271 Ca 0.18 -0.02 0.11 0.00 0.00 0.00 0.00 46.02 46.29 1vgq n GLY 271 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 173.32 173.43 1vgq h TRP 272 N 0.00 0.00 -0.06 1.61 5.08 -1.74 -0.10 115.95 120.74 1vgq h TRP 272 Ca 0.00 0.00 -0.22 0.00 1.08 0.00 0.00 58.89 59.75 1vgq h TRP 272 Cb 0.00 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.16 1vgq h TRP 272 CO 0.00 0.19 -0.84 0.93 -1.28 0.00 0.00 178.44 177.43 1vgq h GLU 273 N 0.00 0.54 0.00 0.12 3.07 -1.95 -3.31 114.58 113.05 1vgq h GLU 273 Ca -0.00 -0.50 0.00 0.00 -0.50 0.00 0.00 59.36 58.36 1vgq h GLU 273 Cb 0.61 0.12 0.00 0.00 -0.84 0.00 0.00 28.75 28.64 1vgq h GLU 273 CO 0.02 1.13 -1.06 0.25 -1.40 0.00 0.00 179.01 177.95 1vgq n THR 274 N -3.84 0.36 -3.86 1.13 -2.24 -1.06 -4.84 114.28 99.92 1vgq n THR 274 Ca -0.07 -0.40 -0.29 0.00 -2.27 0.00 0.00 64.05 61.03 1vgq n THR 274 Cb 0.78 -0.08 -0.16 0.00 -2.10 0.00 0.00 70.33 68.76 1vgq n THR 274 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1vgq s ASP 275 N -4.60 3.31 0.60 3.42 -1.08 -0.07 -5.01 116.67 113.24 1vgq s ASP 275 Ca 0.01 -0.95 0.35 0.00 -0.52 0.00 0.00 52.55 51.45 1vgq s ASP 275 Cb 0.12 -0.92 1.95 0.00 -1.46 0.00 0.00 42.92 42.61 1vgq s ASP 275 CO 0.80 -0.25 2.24 0.00 0.52 0.00 0.00 175.17 178.48 1vgq h ALA 276 N 8.09 1.23 -0.31 3.66 0.00 -1.86 -2.55 119.26 127.52 1vgq h ALA 276 Ca -0.19 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.70 1vgq h ALA 276 Cb 1.10 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.88 1vgq h ALA 276 CO 0.38 0.03 0.00 -0.25 0.00 0.00 0.00 179.25 179.42 1vgq n ASP 277 N -3.45 3.99 -4.29 0.00 8.00 -1.26 -4.86 116.55 114.68 1vgq n ASP 277 Ca -0.02 -2.90 -0.43 0.00 0.71 0.00 0.00 54.79 52.15 1vgq n ASP 277 Cb 0.13 -0.53 0.00 0.00 -0.02 0.00 0.00 41.12 40.70 1vgq n ASP 277 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1vgq n SER 278 N -0.26 4.98 -3.80 -2.24 7.64 -0.96 -4.48 113.62 114.50 1vgq n SER 278 Ca 0.21 -2.98 -0.11 0.00 1.01 0.00 0.00 58.87 57.01 1vgq n SER 278 Cb 0.88 -1.61 -0.08 0.00 -1.01 0.00 0.00 64.21 62.39 1vgq n SER 278 CO 0.00 0.00 0.00 -0.31 -3.01 0.00 0.00 175.04 171.72 1vgq s TYR 279 N 2.15 -0.02 0.21 1.43 1.51 -1.26 -1.57 117.35 119.81 1vgq s TYR 279 Ca 0.45 -0.19 0.11 0.00 -1.01 0.00 0.00 57.07 56.44 1vgq s TYR 279 Cb 0.03 0.03 -0.05 0.00 -0.11 0.00 0.00 41.96 41.87 1vgq s TYR 279 CO 0.01 -0.48 -0.22 0.14 -1.11 0.00 0.00 175.55 173.88 1vgq s VAL 280 N -2.73 2.33 -0.08 0.71 -7.23 -0.53 -1.18 120.40 111.68 1vgq s VAL 280 Ca -0.04 -2.12 -0.12 0.00 -1.81 0.00 0.00 61.98 57.90 1vgq s VAL 280 Cb -0.00 -2.14 -0.05 0.00 0.56 0.00 0.00 36.38 34.75 1vgq s VAL 280 CO -0.05 -0.21 0.29 -0.47 -0.31 0.00 0.00 175.10 174.35 1vgq s TYR 281 N -1.93 3.62 -0.11 2.82 6.14 -0.34 -0.46 117.35 127.09 1vgq s TYR 281 Ca 0.23 0.74 0.00 0.00 0.64 0.00 0.00 57.07 58.67 1vgq s TYR 281 Cb -0.07 -2.19 0.02 0.00 0.42 0.00 0.00 41.96 40.15 1vgq s TYR 281 CO 0.11 0.57 -0.09 0.12 0.64 0.00 0.00 175.55 176.90 1vgq s PHE 282 N -0.67 1.55 -0.25 4.97 2.19 -0.76 -2.37 117.98 122.63 1vgq s PHE 282 Ca 0.19 -0.76 -0.11 0.00 0.33 0.00 0.00 56.93 56.58 1vgq s PHE 282 Cb -0.14 -1.24 -0.05 0.00 -1.31 0.00 0.00 43.02 40.27 1vgq s PHE 282 CO 0.08 -0.50 0.19 0.99 1.83 0.00 0.00 175.22 177.81 1vgq s THR 283 N 1.54 5.33 -1.02 0.12 2.01 -0.60 -2.38 115.64 120.63 1vgq s THR 283 Ca 0.02 0.22 -0.14 0.00 0.31 0.00 0.00 61.69 62.10 1vgq s THR 283 Cb -0.13 -3.53 0.20 0.00 0.01 0.00 0.00 72.50 69.05 1vgq s THR 283 CO -0.07 0.30 1.11 -0.63 -0.69 0.00 0.00 174.62 174.64 1vgq s ILE 284 N 1.38 5.36 0.09 1.82 1.01 0.95 -4.63 121.20 127.17 1vgq s ILE 284 Ca 0.08 -2.54 -0.30 0.00 0.00 0.00 0.00 60.65 57.89 1vgq s ILE 284 Cb -0.15 -4.69 -0.05 0.00 0.01 0.00 0.00 42.46 37.58 1vgq s ILE 284 CO 0.07 -1.33 1.04 0.00 0.00 0.00 0.00 174.94 174.72 1vgq s ALA 285 N 0.76 3.28 0.19 9.38 0.00 -1.26 -3.91 121.76 130.19 1vgq s ALA 285 Ca 0.31 0.67 -0.12 0.00 0.00 0.00 0.00 51.96 52.82 1vgq s ALA 285 Cb -0.07 -3.34 0.21 0.00 0.00 0.00 0.00 23.12 19.92 1vgq s ALA 285 CO -0.07 -0.19 1.73 0.00 0.00 0.00 0.00 175.76 177.24 1vgq h ALA 286 N 6.00 0.64 -0.74 0.00 0.00 -1.96 -1.58 119.26 121.62 1vgq h ALA 286 Ca -0.42 0.09 0.30 0.00 0.00 0.00 0.00 54.91 54.87 1vgq h ALA 286 Cb 1.21 0.09 -0.12 0.00 0.00 0.00 0.00 17.79 18.97 1vgq h ALA 286 CO 0.74 -0.25 0.41 0.09 0.00 0.00 0.00 179.25 180.25 1vgq n ASN 287 N -5.05 0.23 -1.33 0.00 4.13 -1.26 -3.00 115.26 108.97 1vgq n ASN 287 Ca 0.06 1.12 -0.03 0.00 1.68 0.00 0.00 54.58 57.42 1vgq n ASN 287 Cb 0.24 -0.55 0.11 0.00 -1.54 0.00 0.00 39.78 38.05 1vgq n ASN 287 CO 0.00 0.00 0.00 0.23 0.28 0.00 0.00 177.26 177.77 1vgq n MET 288 N -4.49 1.91 -0.18 3.52 2.81 -0.60 -4.84 117.12 115.25 1vgq n MET 288 Ca 0.27 -3.36 -0.07 0.00 -1.81 0.00 0.00 57.70 52.72 1vgq n MET 288 Cb 0.93 -1.55 0.07 0.00 -0.71 0.00 0.00 33.22 31.97 1vgq n MET 288 CO 0.00 0.00 0.00 2.35 1.51 0.00 0.00 175.97 179.83 1vgq h TRP 289 N 1.47 1.06 -0.72 2.03 2.91 -1.55 -2.59 115.95 118.55 1vgq h TRP 289 Ca 0.05 -0.17 -0.07 0.00 1.13 0.00 0.00 58.89 59.83 1vgq h TRP 289 Cb 1.31 -0.28 -0.03 0.00 -0.51 0.00 0.00 29.16 29.65 1vgq h TRP 289 CO 0.67 0.95 0.20 -1.35 -1.03 0.00 0.00 178.44 177.87 1vgq h PRO 290 N 0.90 1.14 -0.02 2.65 0.11 -1.89 -2.32 132.00 132.58 1vgq h PRO 290 Ca 0.16 -0.26 -0.02 0.00 0.11 0.00 0.00 66.00 65.99 1vgq h PRO 290 Cb 0.53 -0.16 -0.00 0.00 0.11 0.00 0.00 31.00 31.48 1vgq h PRO 290 CO 0.03 0.99 -0.08 1.96 -0.21 0.00 0.00 178.00 180.69 1vgq h GLN 291 N 1.08 0.03 -0.03 1.05 7.50 -1.89 -2.93 115.11 119.92 1vgq h GLN 291 Ca 0.23 -0.00 -0.17 0.00 0.50 0.00 0.00 58.65 59.21 1vgq h GLN 291 Cb 0.35 -0.01 0.01 0.00 0.05 0.00 0.00 27.48 27.89 1vgq h GLN 291 CO -0.00 0.11 -0.63 0.82 -1.50 0.00 0.00 178.83 177.62 1vgq h ILE 292 N 0.03 1.39 0.00 2.54 2.04 -1.20 -3.30 117.51 119.01 1vgq h ILE 292 Ca 0.01 -2.04 -0.01 0.00 1.00 0.00 0.00 64.86 63.82 1vgq h ILE 292 Cb 0.16 2.47 -0.00 0.00 -0.74 0.00 0.00 36.82 38.71 1vgq h ILE 292 CO 0.01 0.60 -0.04 0.00 0.00 0.00 0.00 178.15 178.72 1vgq h ASP 294 N 0.00 0.98 0.90 0.00 3.32 -1.62 -2.55 116.42 117.45 1vgq h ASP 294 Ca -0.00 -0.53 -0.14 0.00 0.02 0.00 0.00 57.03 56.38 1vgq h ASP 294 Cb 0.08 -0.28 -0.02 0.00 0.22 0.00 0.00 39.33 39.33 1vgq h ASP 294 CO 0.01 1.32 -0.68 -0.03 -1.72 0.00 0.00 179.24 178.14 1vgq h MET 295 N 0.68 0.00 0.00 3.56 1.85 -1.51 -3.07 114.93 116.43 1vgq h MET 295 Ca 0.02 0.00 0.00 0.00 -0.61 0.00 0.00 59.70 59.11 1vgq h MET 295 Cb 1.14 0.00 0.00 0.00 0.43 0.00 0.00 31.60 33.17 1vgq h MET 295 CO 0.12 0.68 0.00 -0.89 -0.40 0.00 0.00 176.91 176.42 1vgq n ILE 296 N -3.53 0.73 -1.23 1.77 2.08 -0.84 -4.88 119.36 113.46 1vgq n ILE 296 Ca -0.00 0.06 -0.08 0.00 0.56 0.00 0.00 62.75 63.29 1vgq n ILE 296 Cb 0.72 -0.95 -0.03 0.00 -0.75 0.00 0.00 39.64 38.62 1vgq n ILE 296 CO 0.00 0.00 0.00 0.47 0.56 0.00 0.00 176.55 177.58 1vgq n ASP 297 N -2.19 -4.07 -3.79 4.38 8.00 -1.16 -4.99 116.55 112.72 1vgq n ASP 297 Ca 0.03 0.19 -0.29 0.00 0.71 0.00 0.00 54.79 55.44 1vgq n ASP 297 Cb 0.30 -2.26 -0.13 0.00 -0.02 0.00 0.00 41.12 39.00 1vgq n ASP 297 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 1vgq s LYS 298 N -2.55 1.61 0.00 -1.24 1.02 -0.97 -4.95 119.74 112.66 1vgq s LYS 298 Ca 0.00 -2.34 0.30 0.00 0.02 0.00 0.00 55.97 53.94 1vgq s LYS 298 Cb 0.00 -2.72 1.43 0.00 -0.52 0.00 0.00 37.83 36.02 1vgq s LYS 298 CO 0.00 -1.17 1.96 -0.35 -0.92 0.00 0.00 175.35 174.88 1vgq n PRO 299 N 3.21 1.16 0.21 -1.68 -0.04 -1.25 -3.87 135.00 132.74 1vgq n PRO 299 Ca 0.09 -0.40 0.06 0.00 -0.04 0.00 0.00 63.50 63.22 1vgq n PRO 299 Cb 0.34 -1.49 0.47 0.00 -0.04 0.00 0.00 33.50 32.78 1vgq n PRO 299 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 1vgq h GLU 300 N 0.98 0.00 0.00 0.54 3.07 -1.92 -3.11 114.58 114.14 1vgq h GLU 300 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1vgq h GLU 300 Cb 0.27 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.18 1vgq h GLU 300 CO 0.00 0.28 0.00 0.91 -1.40 0.00 0.00 179.01 178.80 1vgq n TRP 301 N -3.85 0.30 -0.19 4.33 8.01 -1.25 -3.73 117.44 121.06 1vgq n TRP 301 Ca -0.02 0.09 -0.03 0.00 -1.31 0.00 0.00 57.50 56.24 1vgq n TRP 301 Cb 0.37 -0.65 0.07 0.00 -2.01 0.00 0.00 31.31 29.09 1vgq n TRP 301 CO 0.00 0.00 0.00 0.87 -1.01 0.00 0.00 177.69 177.55 1vgq h LYS 302 N 0.00 0.54 0.00 -0.99 1.57 -1.81 -3.30 116.57 112.58 1vgq h LYS 302 Ca 0.00 -0.03 -0.29 0.00 -1.87 0.00 0.00 60.65 58.46 1vgq h LYS 302 Cb 0.53 -0.12 -0.05 0.00 0.08 0.00 0.00 32.23 32.67 1vgq h LYS 302 CO 0.00 0.36 -2.11 -0.25 -0.57 0.00 0.00 179.45 176.88 1vgq n ASP 303 N -4.86 0.25 -4.66 0.86 8.00 -1.25 -4.79 116.55 110.10 1vgq n ASP 303 Ca 0.06 0.12 -0.47 0.00 0.71 0.00 0.00 54.79 55.21 1vgq n ASP 303 Cb 0.16 0.83 -0.04 0.00 -0.02 0.00 0.00 41.12 42.05 1vgq n ASP 303 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 1vgq n ASP 304 N -2.76 3.56 0.00 -2.24 -0.08 -1.24 -4.86 116.55 108.93 1vgq n ASP 304 Ca -0.24 0.88 0.13 0.00 -1.51 0.00 0.00 54.79 54.05 1vgq n ASP 304 Cb 1.03 -1.42 0.57 0.00 2.34 0.00 0.00 41.12 43.65 1vgq n ASP 304 CO 0.00 0.00 0.00 -0.81 0.12 0.00 0.00 177.20 176.51 1vgq n PRO 305 N 7.08 0.07 0.05 -0.67 -0.04 -1.26 -1.87 135.00 138.36 1vgq n PRO 305 Ca 0.23 0.05 0.13 0.00 -0.04 0.00 0.00 63.50 63.88 1vgq n PRO 305 Cb 0.33 -1.50 0.51 0.00 -0.04 0.00 0.00 33.50 32.79 1vgq n PRO 305 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1vgq n ALA 306 N -1.46 2.36 0.03 0.55 0.00 -1.26 -4.14 120.51 116.58 1vgq n ALA 306 Ca 0.07 -0.08 0.01 0.00 0.00 0.00 0.00 53.44 53.44 1vgq n ALA 306 Cb 0.29 -1.45 -0.01 0.00 0.00 0.00 0.00 19.45 18.28 1vgq n ALA 306 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1vgq n TYR 307 N -1.84 0.00 0.26 0.00 4.02 -0.99 -3.78 117.16 114.82 1vgq n TYR 307 Ca 0.06 0.00 0.06 0.00 -0.01 0.00 0.00 57.90 58.01 1vgq n TYR 307 Cb 0.38 -0.02 0.09 0.00 -0.02 0.00 0.00 39.34 39.77 1vgq n TYR 307 CO 0.00 0.00 0.00 0.27 -1.01 0.00 0.00 176.86 176.12 1vgq n ASN 308 N -1.36 2.37 -4.53 7.72 6.94 -0.78 -4.83 115.26 120.78 1vgq n ASN 308 Ca -0.00 -1.68 -0.24 0.00 -0.02 0.00 0.00 54.58 52.64 1vgq n ASN 308 Cb 0.03 -0.09 -0.09 0.00 -2.36 0.00 0.00 39.78 37.27 1vgq n ASN 308 CO 0.00 0.00 0.00 -0.89 -1.03 0.00 0.00 177.26 175.34 1vgq s THR 309 N -1.01 2.76 0.21 5.53 2.01 -1.26 -5.03 115.64 118.86 1vgq s THR 309 Ca 0.18 -2.25 -0.08 0.00 0.31 0.00 0.00 61.69 59.85 1vgq s THR 309 Cb 0.11 -2.48 0.16 0.00 0.01 0.00 0.00 72.50 70.30 1vgq s THR 309 CO 0.16 -0.38 1.79 0.15 -0.69 0.00 0.00 174.62 175.65 1vgq h PHE 310 N 2.14 1.17 -0.08 4.92 3.57 -1.96 -2.82 116.94 123.88 1vgq h PHE 310 Ca -0.41 -0.07 -0.08 0.00 3.53 0.00 0.00 57.97 60.94 1vgq h PHE 310 Cb 1.26 -0.36 -0.01 0.00 2.79 0.00 0.00 35.95 39.63 1vgq h PHE 310 CO 0.77 0.87 -0.32 1.49 -2.23 0.00 0.00 178.31 178.88 1vgq h GLU 311 N 1.14 0.15 0.00 1.11 4.81 -1.96 -2.70 114.58 117.13 1vgq h GLU 311 Ca 0.27 -0.05 -0.07 0.00 -0.13 0.00 0.00 59.36 59.38 1vgq h GLU 311 Cb 0.16 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.52 1vgq h GLU 311 CO -0.03 0.46 -0.32 0.78 -0.73 0.00 0.00 179.01 179.17 1vgq h GLY 312 N 1.05 0.00 1.17 1.92 0.00 -1.76 -3.35 103.07 102.10 1vgq h GLY 312 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.35 1vgq h GLY 312 CO 0.05 0.00 -0.60 0.54 0.00 0.00 0.00 176.54 176.53 1vgq n ARG 313 N -3.31 0.27 0.09 4.80 1.74 -1.02 -4.39 116.66 114.83 1vgq n ARG 313 Ca 0.01 0.08 -0.01 0.00 -0.77 0.00 0.00 57.85 57.16 1vgq n ARG 313 Cb 0.56 -1.68 0.26 0.00 -1.02 0.00 0.00 32.46 30.59 1vgq n ARG 313 CO 0.00 0.00 0.00 -0.39 -1.52 0.00 0.00 177.63 175.72 1vgq h VAL 314 N 0.00 1.27 0.00 1.55 -1.51 -1.69 -0.45 116.25 115.43 1vgq h VAL 314 Ca 0.00 -1.30 0.00 0.00 -1.23 0.00 0.00 66.70 64.17 1vgq h VAL 314 Cb 0.73 1.52 0.00 0.00 -2.13 0.00 0.00 31.29 31.41 1vgq h VAL 314 CO 0.00 0.39 0.00 -0.90 -1.23 0.00 0.00 177.57 175.83 1vgq n ASP 315 N -4.10 0.00 -2.10 4.19 5.75 -1.26 -3.78 116.55 115.25 1vgq n ASP 315 Ca -0.01 -0.48 -0.03 0.00 -0.01 0.00 0.00 54.79 54.26 1vgq n ASP 315 Cb 0.41 -0.12 0.06 0.00 -1.03 0.00 0.00 41.12 40.44 1vgq n ASP 315 CO 0.00 0.00 0.00 2.29 -0.11 0.00 0.00 177.20 179.38 1vgq n LYS 316 N -1.12 0.90 -0.30 0.11 -0.00 -1.08 -4.66 118.16 112.01 1vgq n LYS 316 Ca 0.16 -1.27 0.00 0.00 -0.00 0.00 0.00 58.31 57.21 1vgq n LYS 316 Cb 0.13 0.35 0.13 0.00 -0.00 0.00 0.00 35.03 35.65 1vgq n LYS 316 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.40 178.65 1vgq h LEU 317 N 0.75 0.78 -0.77 -5.58 6.46 -1.18 -2.45 115.31 113.32 1vgq h LEU 317 Ca -0.47 0.02 -0.07 0.00 -0.12 0.00 0.00 57.88 57.24 1vgq h LEU 317 Cb 1.35 -0.14 -0.01 0.00 -0.73 0.00 0.00 40.66 41.13 1vgq h LEU 317 CO -0.20 0.50 -0.34 0.24 -0.62 0.00 0.00 178.44 178.02 1vgq h MET 318 N 0.91 0.00 -0.46 1.25 2.86 -1.89 -2.44 114.93 115.16 1vgq h MET 318 Ca 0.36 0.00 -0.12 0.00 -2.06 0.00 0.00 59.70 57.88 1vgq h MET 318 Cb 0.18 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.83 1vgq h MET 318 CO -0.18 0.34 -0.19 -0.44 1.06 0.00 0.00 176.91 177.49 1vgq h ASP 319 N 0.00 0.97 -0.49 1.22 3.32 -1.84 -1.64 116.42 117.97 1vgq h ASP 319 Ca -0.00 -0.39 -0.08 0.00 0.02 0.00 0.00 57.03 56.58 1vgq h ASP 319 Cb 0.95 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 40.21 1vgq h ASP 319 CO 0.04 1.15 0.02 0.40 -1.72 0.00 0.00 179.24 179.13 1vgq h ILE 320 N 0.79 1.25 -0.29 0.35 2.04 -1.31 -2.17 117.51 118.18 1vgq h ILE 320 Ca 0.11 -1.04 -0.12 0.00 1.00 0.00 0.00 64.86 64.80 1vgq h ILE 320 Cb 0.77 0.81 -0.01 0.00 -0.74 0.00 0.00 36.82 37.65 1vgq h ILE 320 CO 0.06 0.37 -0.33 -0.26 0.00 0.00 0.00 178.15 178.00 1vgq h PHE 321 N 0.84 0.74 -0.49 1.37 0.05 -1.35 -0.66 116.94 117.44 1vgq h PHE 321 Ca 0.16 -0.19 -0.05 0.00 3.82 0.00 0.00 57.97 61.71 1vgq h PHE 321 Cb 0.47 -0.17 -0.02 0.00 2.00 0.00 0.00 35.95 38.23 1vgq h PHE 321 CO 0.03 0.88 0.09 0.77 -0.18 0.00 0.00 178.31 179.90 1vgq h SER 322 N 0.54 0.71 -0.03 2.17 0.02 -1.12 -1.39 113.55 114.45 1vgq h SER 322 Ca 0.06 -0.13 -0.02 0.00 -0.84 0.00 0.00 61.79 60.86 1vgq h SER 322 Cb 0.83 -0.19 0.00 0.00 0.14 0.00 0.00 62.40 63.18 1vgq h SER 322 CO 0.07 0.72 -0.06 0.15 -1.14 0.00 0.00 176.83 176.57 1vgq h PHE 323 N 0.73 0.12 -0.61 3.45 3.57 -1.03 -2.79 116.94 120.38 1vgq h PHE 323 Ca 0.16 -0.04 0.10 0.00 3.53 0.00 0.00 57.97 61.72 1vgq h PHE 323 Cb 0.31 -0.02 -0.04 0.00 2.79 0.00 0.00 35.95 38.99 1vgq h PHE 323 CO 0.02 0.64 0.41 0.82 -2.23 0.00 0.00 178.31 177.97 1vgq h ILE 324 N -0.44 0.89 -0.35 1.41 2.04 -1.08 -2.28 117.51 117.70 1vgq h ILE 324 Ca 0.00 -0.14 -0.12 0.00 1.00 0.00 0.00 64.86 65.61 1vgq h ILE 324 Cb 0.63 0.45 -0.01 0.00 -0.74 0.00 0.00 36.82 37.15 1vgq h ILE 324 CO 0.01 0.07 -0.26 -0.08 0.00 0.00 0.00 178.15 177.90 1vgq h GLU 325 N 0.41 0.71 0.00 2.37 4.81 -1.14 -2.94 114.58 118.80 1vgq h GLU 325 Ca 0.28 -0.30 -0.05 0.00 -0.13 0.00 0.00 59.36 59.17 1vgq h GLU 325 Cb 0.57 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.92 1vgq h GLU 325 CO -0.08 0.90 -0.22 1.79 -0.73 0.00 0.00 179.01 180.67 1vgq h THR 326 N 0.62 0.75 0.00 0.32 1.35 -1.13 -2.11 112.91 112.70 1vgq h THR 326 Ca 0.08 -0.90 0.00 0.00 -0.55 0.00 0.00 66.41 65.04 1vgq h THR 326 Cb 0.76 1.55 0.00 0.00 -1.73 0.00 0.00 68.15 68.73 1vgq h THR 326 CO 0.06 0.21 0.00 0.11 -0.25 0.00 0.00 175.52 175.65 1vgq h LYS 327 N 0.00 0.00 -0.02 4.72 1.79 -1.52 -3.03 116.57 118.52 1vgq h LYS 327 Ca -0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1vgq h LYS 327 Cb 0.54 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.19 1vgq h LYS 327 CO 0.03 0.00 -0.31 1.19 -1.08 0.00 0.00 179.45 179.27 1vgq n PHE 328 N -2.41 0.00 0.31 -1.35 3.72 -0.80 -4.65 117.46 112.27 1vgq n PHE 328 Ca 0.03 0.00 0.18 0.00 -0.05 0.00 0.00 57.45 57.60 1vgq n PHE 328 Cb 0.29 -0.02 1.00 0.00 -0.94 0.00 0.00 39.48 39.81 1vgq n PHE 328 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1vgq h ALA 329 N 4.07 1.31 -0.32 4.37 0.00 -1.47 -2.48 119.26 124.74 1vgq h ALA 329 Ca 0.00 -0.01 -0.25 0.00 0.00 0.00 0.00 54.91 54.65 1vgq h ALA 329 Cb 0.77 -0.00 -0.27 0.00 0.00 0.00 0.00 17.79 18.28 1vgq h ALA 329 CO 0.00 0.02 -0.79 -3.47 0.00 0.00 0.00 179.25 175.01 1vgq n ASP 330 N -3.54 2.66 -3.93 0.00 2.03 -1.26 -4.02 116.55 108.48 1vgq n ASP 330 Ca -0.03 -3.26 -0.19 0.00 0.52 0.00 0.00 54.79 51.83 1vgq n ASP 330 Cb 0.10 -0.42 -0.16 0.00 -0.72 0.00 0.00 41.12 39.92 1vgq n ASP 330 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 1vgq s LYS 331 N -2.93 0.77 0.94 -0.67 1.02 -0.94 -4.96 119.74 112.98 1vgq s LYS 331 Ca 0.40 -0.16 -0.12 0.00 0.02 0.00 0.00 55.97 56.10 1vgq s LYS 331 Cb 0.38 -0.76 0.15 0.00 -0.52 0.00 0.00 37.83 37.08 1vgq s LYS 331 CO -0.04 0.00 1.12 0.16 -0.92 0.00 0.00 175.35 175.66 1vgq s ASP 332 N 0.54 3.23 0.17 2.83 1.47 -1.26 -2.61 116.67 121.04 1vgq s ASP 332 Ca -0.07 1.08 -0.16 0.00 1.18 0.00 0.00 52.55 54.58 1vgq s ASP 332 Cb -0.11 -1.71 0.14 0.00 -0.34 0.00 0.00 42.92 40.91 1vgq s ASP 332 CO 0.00 -2.74 1.22 0.29 0.68 0.00 0.00 175.17 174.63 1vgq n LYS 333 N -3.90 -0.22 0.08 2.11 5.02 -1.26 -1.87 118.16 118.12 1vgq n LYS 333 Ca 0.06 1.21 -0.11 0.00 -2.02 0.00 0.00 58.31 57.45 1vgq n LYS 333 Cb 0.58 -1.79 -0.04 0.00 -0.02 0.00 0.00 35.03 33.76 1vgq n LYS 333 CO 0.00 0.00 0.00 0.74 -0.52 0.00 0.00 177.40 177.62 1vgq h PHE 334 N 0.00 0.44 -0.23 2.13 0.04 -1.95 -1.63 116.94 115.74 1vgq h PHE 334 Ca 0.25 -0.25 -0.01 0.00 2.80 0.00 0.00 57.97 60.76 1vgq h PHE 334 Cb 0.44 -0.05 -0.01 0.00 2.20 0.00 0.00 35.95 38.54 1vgq h PHE 334 CO -0.72 1.07 0.11 0.93 -0.60 0.00 0.00 178.31 179.11 1vgq h GLU 335 N 0.16 0.32 -0.88 1.51 5.08 -1.73 -1.37 114.58 117.68 1vgq h GLU 335 Ca -0.07 -0.05 -0.00 0.00 -1.00 0.00 0.00 59.36 58.25 1vgq h GLU 335 Cb 1.58 -0.06 -0.04 0.00 0.50 0.00 0.00 28.75 30.72 1vgq h GLU 335 CO 0.15 0.33 0.55 0.28 -1.00 0.00 0.00 179.01 179.32 1vgq h VAL 336 N 0.24 1.24 -0.61 3.13 2.07 -1.23 -1.10 116.25 119.98 1vgq h VAL 336 Ca 0.08 -0.49 -0.09 0.00 0.82 0.00 0.00 66.70 67.02 1vgq h VAL 336 Cb 0.11 -0.02 -0.02 0.00 -1.52 0.00 0.00 31.29 29.84 1vgq h VAL 336 CO -0.01 0.24 0.03 0.74 0.02 0.00 0.00 177.57 178.60 1vgq h THR 337 N 1.20 1.26 -0.38 2.57 2.02 -1.04 -1.01 112.91 117.54 1vgq h THR 337 Ca 0.32 -1.10 -0.15 0.00 0.77 0.00 0.00 66.41 66.25 1vgq h THR 337 Cb -0.08 0.76 -0.01 0.00 -1.74 0.00 0.00 68.15 67.08 1vgq h THR 337 CO -0.06 0.40 -0.35 -0.08 0.37 0.00 0.00 175.52 175.80 1vgq h GLU 338 N 0.96 0.88 -0.29 6.66 4.81 -0.93 -1.65 114.58 125.02 1vgq h GLU 338 Ca 0.18 -0.44 0.04 0.00 -0.13 0.00 0.00 59.36 59.01 1vgq h GLU 338 Cb 0.51 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.85 1vgq h GLU 338 CO 0.02 1.09 0.07 2.35 -0.73 0.00 0.00 179.01 181.81 1vgq h TRP 339 N 0.73 0.13 0.00 0.92 7.01 -1.00 -2.90 115.95 120.84 1vgq h TRP 339 Ca 0.07 0.02 -0.10 0.00 2.11 0.00 0.00 58.89 60.99 1vgq h TRP 339 Cb 0.92 -0.02 -0.01 0.00 -2.10 0.00 0.00 29.16 27.95 1vgq h TRP 339 CO 0.06 0.05 -0.47 0.00 -2.79 0.00 0.00 178.44 175.28 1vgq h ALA 340 N 1.20 1.15 0.00 2.65 0.00 -1.04 -2.98 119.26 120.24 1vgq h ALA 340 Ca 0.13 -0.43 -0.06 0.00 0.00 0.00 0.00 54.91 54.56 1vgq h ALA 340 Cb 0.12 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 1vgq h ALA 340 CO -0.16 0.59 -0.26 0.00 0.00 0.00 0.00 179.25 179.42 1vgq h ALA 341 N 1.53 1.45 -1.00 0.00 0.00 -1.10 -2.59 119.26 117.55 1vgq h ALA 341 Ca -0.00 -0.24 0.08 0.00 0.00 0.00 0.00 54.91 54.75 1vgq h ALA 341 Cb 0.87 -0.04 -0.07 0.00 0.00 0.00 0.00 17.79 18.54 1vgq h ALA 341 CO 0.06 0.33 0.64 1.96 0.00 0.00 0.00 179.25 182.24 1vgq h GLN 342 N 0.00 1.08 -0.04 0.00 4.20 -1.45 -2.72 115.11 116.19 1vgq h GLN 342 Ca -0.00 -0.07 0.00 0.00 0.06 0.00 0.00 58.65 58.64 1vgq h GLN 342 Cb 0.50 -0.24 0.00 0.00 0.30 0.00 0.00 27.48 28.03 1vgq h GLN 342 CO 0.03 0.72 0.00 0.66 -0.67 0.00 0.00 178.83 179.57 1vgq n TYR 343 N -4.54 0.02 -1.88 2.96 4.01 -1.01 -4.97 117.16 111.75 1vgq n TYR 343 Ca 0.16 -0.01 -0.08 0.00 -0.16 0.00 0.00 57.90 57.81 1vgq n TYR 343 Cb 0.24 0.00 -0.01 0.00 -0.31 0.00 0.00 39.34 39.25 1vgq n TYR 343 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1vgq n GLY 344 N 1.29 0.33 3.68 2.72 0.00 -1.03 -4.93 105.19 107.25 1vgq n GLY 344 Ca 0.16 -0.57 -0.40 0.00 0.00 0.00 0.00 46.02 45.21 1vgq n GLY 344 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1vgq s ILE 345 N -2.39 5.05 -0.36 -0.61 1.01 -1.01 -5.00 121.20 117.89 1vgq s ILE 345 Ca 0.00 1.24 -0.27 0.00 0.00 0.00 0.00 60.65 61.62 1vgq s ILE 345 Cb 0.00 -3.96 -0.05 0.00 0.01 0.00 0.00 42.46 38.46 1vgq s ILE 345 CO 0.00 0.18 2.24 -2.84 0.00 0.00 0.00 174.94 174.52 1vgq s PRO 346 N 1.43 2.70 -0.27 2.79 0.02 -1.26 -4.56 135.00 135.86 1vgq s PRO 346 Ca 0.31 1.65 -0.14 0.00 0.02 0.00 0.00 61.00 62.84 1vgq s PRO 346 Cb -0.16 -4.45 0.08 0.00 0.02 0.00 0.00 34.50 30.00 1vgq s PRO 346 CO 0.12 -2.60 0.65 0.00 -0.33 0.00 0.00 177.00 174.85 1vgq s GLY 348 N 1.78 0.11 0.40 0.00 0.00 -1.00 -4.81 107.32 103.79 1vgq s GLY 348 Ca -0.09 -0.45 -0.19 0.00 0.00 0.00 0.00 44.72 43.98 1vgq s GLY 348 CO -0.19 -0.44 0.89 2.56 0.00 0.00 0.00 173.10 175.92 1vgq s PRO 349 N -3.91 4.17 -0.43 2.90 0.04 -1.26 -1.19 135.00 135.32 1vgq s PRO 349 Ca 0.12 1.00 -0.28 0.00 0.04 0.00 0.00 61.00 61.88 1vgq s PRO 349 Cb 0.00 -2.26 -0.00 0.00 0.04 0.00 0.00 34.50 32.28 1vgq s PRO 349 CO -0.01 0.02 1.57 0.08 0.04 0.00 0.00 177.00 178.71 1vgq s VAL 350 N -2.12 3.70 -0.14 -0.36 1.01 -0.33 -4.84 120.40 117.33 1vgq s VAL 350 Ca 0.60 0.68 -0.27 0.00 0.00 0.00 0.00 61.98 62.99 1vgq s VAL 350 Cb -0.09 -4.04 -0.01 0.00 0.00 0.00 0.00 36.38 32.23 1vgq s VAL 350 CO 0.14 -0.73 0.89 -0.04 0.00 0.00 0.00 175.10 175.37 1vgq s MET 351 N 5.43 4.35 0.61 2.72 -1.94 -1.26 -4.75 119.30 124.46 1vgq s MET 351 Ca 0.66 1.15 -0.14 0.00 -1.71 0.00 0.00 55.69 55.66 1vgq s MET 351 Cb -0.16 -3.56 -0.04 0.00 2.01 0.00 0.00 34.83 33.09 1vgq s MET 351 CO 0.31 -0.30 1.04 -1.54 -0.01 0.00 0.00 175.02 174.51 1vgq s SER 352 N 1.11 5.97 0.50 3.03 1.04 -1.26 -4.91 113.70 119.18 1vgq s SER 352 Ca 0.42 1.62 0.14 0.00 0.48 0.00 0.00 55.95 58.61 1vgq s SER 352 Cb -0.17 -2.50 1.18 0.00 0.10 0.00 0.00 66.02 64.62 1vgq s SER 352 CO 0.15 -1.04 2.12 0.24 0.98 0.00 0.00 173.24 175.69 1vgq h MET 353 N 0.09 0.10 -0.16 4.02 2.86 -1.98 -1.21 114.93 118.64 1vgq h MET 353 Ca -0.45 -0.01 -0.02 0.00 -2.06 0.00 0.00 59.70 57.16 1vgq h MET 353 Cb 1.20 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 32.83 1vgq h MET 353 CO 0.59 0.08 0.03 -0.22 1.06 0.00 0.00 176.91 178.45 1vgq h LYS 354 N 0.11 0.27 -0.56 1.72 3.64 -1.99 -0.04 116.57 119.72 1vgq h LYS 354 Ca 0.03 -0.07 -0.06 0.00 -1.27 0.00 0.00 60.65 59.28 1vgq h LYS 354 Cb 0.00 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 31.77 1vgq h LYS 354 CO -0.01 0.43 0.11 0.93 -2.27 0.00 0.00 179.45 178.65 1vgq h GLU 355 N 0.06 0.87 -0.02 1.90 5.08 -1.82 -3.12 114.58 117.53 1vgq h GLU 355 Ca 0.05 -0.19 -0.25 0.00 -1.00 0.00 0.00 59.36 57.97 1vgq h GLU 355 Cb 0.29 -0.12 0.02 0.00 0.50 0.00 0.00 28.75 29.43 1vgq h GLU 355 CO 0.00 0.80 -0.98 -0.07 -1.00 0.00 0.00 179.01 177.76 1vgq h LEU 356 N 0.83 0.83 -2.12 1.33 3.38 -1.10 -1.44 115.31 117.02 1vgq h LEU 356 Ca 0.18 -0.64 -0.01 0.00 0.09 0.00 0.00 57.88 57.49 1vgq h LEU 356 Cb 0.33 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 40.83 1vgq h LEU 356 CO 0.00 1.44 -0.06 0.00 0.09 0.00 0.00 178.44 179.92 1vgq h ALA 357 N 0.51 1.60 0.00 1.53 0.00 -0.97 -3.09 119.26 118.85 1vgq h ALA 357 Ca -0.11 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.75 1vgq h ALA 357 Cb 1.62 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.40 1vgq h ALA 357 CO 0.19 0.07 -0.05 0.72 0.00 0.00 0.00 179.25 180.18 1vgq n HIS 358 N -4.03 0.00 -2.08 0.00 8.25 -1.19 -5.04 115.22 111.13 1vgq n HIS 358 Ca -0.03 -0.58 -0.42 0.00 -0.26 0.00 0.00 57.72 56.42 1vgq n HIS 358 Cb 0.14 -0.08 -0.03 0.00 1.12 0.00 0.00 29.99 31.14 1vgq n HIS 358 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1vgq s ASP 359 N -1.60 6.72 0.29 0.41 2.15 -0.55 -4.93 116.67 119.16 1vgq s ASP 359 Ca 0.12 2.16 0.01 0.00 0.43 0.00 0.00 52.55 55.27 1vgq s ASP 359 Cb 0.11 -2.54 0.53 0.00 -0.30 0.00 0.00 42.92 40.72 1vgq s ASP 359 CO 0.01 -0.88 1.87 1.55 -0.17 0.00 0.00 175.17 177.55 1vgq h PRO 360 N 9.11 1.00 -0.58 4.34 0.13 -1.92 -2.99 132.00 141.09 1vgq h PRO 360 Ca -0.37 -0.06 -0.02 0.00 -0.87 0.00 0.00 66.00 64.67 1vgq h PRO 360 Cb 1.17 -0.23 -0.03 0.00 0.13 0.00 0.00 31.00 32.05 1vgq h PRO 360 CO 0.95 0.66 0.28 0.77 -0.23 0.00 0.00 178.00 180.43 1vgq h SER 361 N 1.03 0.76 0.33 1.44 0.02 -1.99 -1.02 113.55 114.12 1vgq h SER 361 Ca 0.45 -0.13 -0.09 0.00 -0.84 0.00 0.00 61.79 61.17 1vgq h SER 361 Cb 0.34 -0.20 -0.01 0.00 0.14 0.00 0.00 62.40 62.67 1vgq h SER 361 CO -0.20 0.68 -0.41 -0.07 -1.14 0.00 0.00 176.83 175.69 1vgq h LEU 362 N 0.79 0.11 -0.22 5.07 3.38 -1.89 -1.65 115.31 120.89 1vgq h LEU 362 Ca 0.20 -0.04 -0.22 0.00 0.09 0.00 0.00 57.88 57.91 1vgq h LEU 362 Cb 0.12 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 40.84 1vgq h LEU 362 CO -0.02 0.51 -0.88 1.56 0.09 0.00 0.00 178.44 179.69 1vgq h GLN 363 N 0.09 0.46 -0.73 1.13 4.20 -1.36 -0.18 115.11 118.71 1vgq h GLN 363 Ca 0.01 -0.45 -0.06 0.00 0.06 0.00 0.00 58.65 58.21 1vgq h GLN 363 Cb 0.76 0.12 -0.03 0.00 0.30 0.00 0.00 27.48 28.63 1vgq h GLN 363 CO 0.06 1.10 0.24 0.87 -0.67 0.00 0.00 178.83 180.42 1vgq h LYS 364 N 0.28 1.12 -0.15 1.46 1.57 -0.77 -2.86 116.57 117.22 1vgq h LYS 364 Ca -0.07 -0.23 0.00 0.00 -1.87 0.00 0.00 60.65 58.48 1vgq h LYS 364 Cb 1.50 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 33.64 1vgq h LYS 364 CO 0.16 0.95 0.00 1.33 -0.57 0.00 0.00 179.45 181.31 1vgq n VAL 365 N -4.26 0.19 -1.03 0.50 0.24 -0.66 -4.92 118.33 108.38 1vgq n VAL 365 Ca 0.06 -0.35 -0.01 0.00 -2.04 0.00 0.00 64.34 62.00 1vgq n VAL 365 Cb 0.22 0.43 -0.00 0.00 -1.47 0.00 0.00 33.84 33.02 1vgq n VAL 365 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1vgq n GLY 366 N 1.16 0.48 0.12 7.63 0.00 -1.08 -4.94 105.19 108.55 1vgq n GLY 366 Ca 0.17 -0.81 -0.17 0.00 0.00 0.00 0.00 46.02 45.22 1vgq n GLY 366 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1vgq n THR 367 N -2.96 1.71 -4.12 2.61 -1.04 -0.17 -4.10 114.28 106.22 1vgq n THR 367 Ca -0.01 -0.71 -0.35 0.00 -2.04 0.00 0.00 64.05 60.94 1vgq n THR 367 Cb 0.04 -1.46 -0.12 0.00 -1.82 0.00 0.00 70.33 66.97 1vgq n THR 367 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 1vgq s VAL 368 N -2.57 4.01 -0.07 12.58 1.01 -0.66 -0.66 120.40 134.03 1vgq s VAL 368 Ca -0.16 -0.30 0.03 0.00 0.00 0.00 0.00 61.98 61.55 1vgq s VAL 368 Cb 0.07 -2.80 0.01 0.00 0.00 0.00 0.00 36.38 33.65 1vgq s VAL 368 CO 0.79 0.44 -0.17 -0.69 0.00 0.00 0.00 175.10 175.47 1vgq s VAL 369 N 0.87 1.46 -0.31 2.92 1.01 0.11 -4.01 120.40 122.45 1vgq s VAL 369 Ca 0.01 -0.68 -0.29 0.00 0.00 0.00 0.00 61.98 61.02 1vgq s VAL 369 Cb -0.14 -1.29 0.02 0.00 0.00 0.00 0.00 36.38 34.96 1vgq s VAL 369 CO 0.02 0.43 1.09 -0.70 0.00 0.00 0.00 175.10 175.93 1vgq s GLU 370 N 0.44 4.08 -0.14 2.72 2.12 -1.26 -0.91 118.70 125.75 1vgq s GLU 370 Ca -0.14 1.12 -0.23 0.00 0.36 0.00 0.00 54.97 56.09 1vgq s GLU 370 Cb -0.16 -3.74 -0.03 0.00 0.26 0.00 0.00 34.13 30.47 1vgq s GLU 370 CO 0.05 -0.88 0.70 0.08 -0.54 0.00 0.00 175.26 174.66 1vgq s VAL 371 N 3.64 5.01 -0.54 3.70 1.01 0.38 -4.98 120.40 128.61 1vgq s VAL 371 Ca 0.46 1.38 -0.28 0.00 0.00 0.00 0.00 61.98 63.53 1vgq s VAL 371 Cb -0.13 -4.02 0.03 0.00 0.00 0.00 0.00 36.38 32.26 1vgq s VAL 371 CO 0.15 0.15 1.19 -0.69 0.00 0.00 0.00 175.10 175.90 1vgq s VAL 372 N 1.49 4.06 -0.30 2.92 1.01 -1.26 -2.84 120.40 125.49 1vgq s VAL 372 Ca 0.34 1.00 0.02 0.00 0.00 0.00 0.00 61.98 63.34 1vgq s VAL 372 Cb -0.17 -4.67 0.09 0.00 0.00 0.00 0.00 36.38 31.63 1vgq s VAL 372 CO 0.14 -1.22 0.03 -0.62 0.00 0.00 0.00 175.10 173.43 1vgq s ASP 373 N 2.88 4.31 0.22 3.32 -1.08 -1.26 -4.36 116.67 120.69 1vgq s ASP 373 Ca 0.45 -1.73 0.26 0.00 -0.52 0.00 0.00 52.55 51.02 1vgq s ASP 373 Cb -0.08 -1.29 0.82 0.00 -1.46 0.00 0.00 42.92 40.92 1vgq s ASP 373 CO 0.28 -0.35 1.77 -1.84 0.52 0.00 0.00 175.17 175.55 1vgq n GLU 374 N 4.54 0.26 -0.05 4.34 0.00 -1.26 -0.81 120.64 127.65 1vgq n GLU 374 Ca -0.03 0.23 -0.17 0.00 0.00 0.00 0.00 57.16 57.19 1vgq n GLU 374 Cb 0.43 -1.81 -0.13 0.00 0.00 0.00 0.00 31.44 29.92 1vgq n GLU 374 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.13 177.95 1vgq h ILE 375 N 0.00 1.48 0.00 3.84 1.08 -2.00 -3.41 117.51 118.50 1vgq h ILE 375 Ca 0.00 -2.34 0.00 0.00 -0.39 0.00 0.00 64.86 62.13 1vgq h ILE 375 Cb 0.71 3.03 0.00 0.00 -3.07 0.00 0.00 36.82 37.49 1vgq h ILE 375 CO 0.00 0.56 -0.99 0.54 -0.69 0.00 0.00 178.15 177.57 1vgq n ARG 376 N -4.44 1.47 0.00 2.37 1.74 -1.23 -5.10 116.66 111.47 1vgq n ARG 376 Ca -0.17 -0.04 0.00 0.00 -0.77 0.00 0.00 57.85 56.87 1vgq n ARG 376 Cb 0.61 -1.28 0.00 0.00 -1.02 0.00 0.00 32.46 30.77 1vgq n ARG 376 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1vgq n GLY 377 N 1.42 0.15 3.74 -0.13 0.00 0.01 -5.01 105.19 105.37 1vgq n GLY 377 Ca 0.01 -1.59 -0.35 0.00 0.00 0.00 0.00 46.02 44.09 1vgq n GLY 377 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1vgq s ASN 378 N -1.32 4.72 0.14 1.61 0.02 -1.22 -4.39 114.94 114.50 1vgq s ASN 378 Ca 0.00 2.39 -0.03 0.00 -1.02 0.00 0.00 52.86 54.20 1vgq s ASN 378 Cb 0.00 -2.60 -0.03 0.00 0.02 0.00 0.00 41.25 38.64 1vgq s ASN 378 CO 0.00 -1.91 0.11 -1.38 0.02 0.00 0.00 177.10 173.93 1vgq s HIS 379 N -1.75 0.74 0.40 2.20 -3.43 -1.13 -4.95 115.29 107.37 1vgq s HIS 379 Ca 0.76 -1.12 -0.04 0.00 -0.80 0.00 0.00 55.06 53.87 1vgq s HIS 379 Cb -0.30 -0.38 -0.04 0.00 -1.43 0.00 0.00 32.58 30.43 1vgq s HIS 379 CO 0.39 -0.56 0.68 -0.51 -2.00 0.00 0.00 174.74 172.74 1vgq s LEU 380 N -3.02 3.83 0.25 5.38 1.43 -1.26 -0.47 118.68 124.80 1vgq s LEU 380 Ca 0.22 0.79 -0.16 0.00 -1.03 0.00 0.00 54.13 53.95 1vgq s LEU 380 Cb 0.06 -3.69 0.01 0.00 0.03 0.00 0.00 46.19 42.60 1vgq s LEU 380 CO 0.01 -0.42 0.56 0.28 0.23 0.00 0.00 176.35 177.01 1vgq s THR 381 N -2.47 0.01 -0.06 5.49 -1.32 -0.09 -4.89 115.64 112.31 1vgq s THR 381 Ca 0.45 -1.16 -0.21 0.00 -1.21 0.00 0.00 61.69 59.56 1vgq s THR 381 Cb -0.10 -2.02 -0.04 0.00 -1.51 0.00 0.00 72.50 68.82 1vgq s THR 381 CO 0.38 -0.02 0.61 -0.69 -2.21 0.00 0.00 174.62 172.69 1vgq s VAL 382 N -3.96 5.04 0.00 5.08 1.01 -1.26 -0.71 120.40 125.60 1vgq s VAL 382 Ca 0.16 1.25 0.00 0.00 0.00 0.00 0.00 61.98 63.39 1vgq s VAL 382 Cb -0.02 -3.95 0.00 0.00 0.00 0.00 0.00 36.38 32.41 1vgq s VAL 382 CO 0.06 0.32 0.00 0.61 0.00 0.00 0.00 175.10 176.09 1vgq n GLY 383 N 2.95 0.23 3.67 4.51 0.00 0.16 -4.89 105.19 111.83 1vgq n GLY 383 Ca -0.05 -1.70 -0.43 0.00 0.00 0.00 0.00 46.02 43.85 1vgq n GLY 383 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1vgq s ALA 384 N -3.55 3.58 -2.04 4.61 0.00 -1.26 -4.92 121.76 118.19 1vgq s ALA 384 Ca 0.00 0.46 0.27 0.00 0.00 0.00 0.00 51.96 52.69 1vgq s ALA 384 Cb 0.00 -3.55 1.57 0.00 0.00 0.00 0.00 23.12 21.14 1vgq s ALA 384 CO 0.00 -0.95 2.02 -0.35 0.00 0.00 0.00 175.76 176.47 1vgq n PRO 385 N 5.91 1.06 -4.38 0.00 -0.04 -1.26 -4.64 135.00 131.65 1vgq n PRO 385 Ca 0.12 -0.09 -0.34 0.00 -0.04 0.00 0.00 63.50 63.15 1vgq n PRO 385 Cb 0.46 -1.43 -0.14 0.00 -0.04 0.00 0.00 33.50 32.35 1vgq n PRO 385 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 1vgq s PHE 386 N -1.99 2.92 -0.20 0.54 -0.12 -1.26 -5.11 117.98 112.76 1vgq s PHE 386 Ca 0.41 -0.65 -0.06 0.00 -0.05 0.00 0.00 56.93 56.58 1vgq s PHE 386 Cb 0.19 -1.96 -0.03 0.00 -0.63 0.00 0.00 43.02 40.59 1vgq s PHE 386 CO 0.32 -0.27 0.03 0.15 -0.05 0.00 0.00 175.22 175.39 1vgq s LYS 387 N 0.73 3.74 0.02 1.99 -0.14 -1.26 -5.06 119.74 119.76 1vgq s LYS 387 Ca -0.04 -0.46 0.05 0.00 -1.36 0.00 0.00 55.97 54.17 1vgq s LYS 387 Cb -0.15 -3.16 -0.03 0.00 -1.68 0.00 0.00 37.83 32.81 1vgq s LYS 387 CO 0.02 0.07 -0.11 -0.06 -0.76 0.00 0.00 175.35 174.52 1vgq s PHE 388 N 0.88 2.77 0.34 3.18 0.40 -1.26 -5.04 117.98 119.25 1vgq s PHE 388 Ca 0.02 -0.12 0.05 0.00 -0.60 0.00 0.00 56.93 56.28 1vgq s PHE 388 Cb -0.14 -1.55 0.62 0.00 0.51 0.00 0.00 43.02 42.46 1vgq s PHE 388 CO 0.02 0.34 1.87 0.66 0.70 0.00 0.00 175.22 178.81 1vgq h SER 389 N 4.47 0.45 -0.04 1.36 4.64 -2.03 -3.28 113.55 119.11 1vgq h SER 389 Ca -0.48 -0.09 -0.02 0.00 -0.47 0.00 0.00 61.79 60.73 1vgq h SER 389 Cb 1.16 -0.12 -0.01 0.00 -0.31 0.00 0.00 62.40 63.13 1vgq h SER 389 CO 0.52 0.54 -0.36 0.61 -0.87 0.00 0.00 176.83 177.27 1vgq n GLY 390 N -0.85 5.06 3.64 -0.77 0.00 -1.26 -5.01 105.19 106.00 1vgq n GLY 390 Ca 0.01 -1.27 -0.09 0.00 0.00 0.00 0.00 46.02 44.68 1vgq n GLY 390 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1vgq s PHE 391 N -3.17 -0.84 -0.11 1.61 5.36 -1.24 -3.37 117.98 116.23 1vgq s PHE 391 Ca 0.38 1.81 0.03 0.00 -0.96 0.00 0.00 56.93 58.18 1vgq s PHE 391 Cb 0.36 0.45 0.01 0.00 -0.34 0.00 0.00 43.02 43.49 1vgq s PHE 391 CO -0.04 -0.41 -0.20 -0.65 -1.46 0.00 0.00 175.22 172.46 1vgq s GLN 392 N 1.04 2.69 0.49 10.12 -1.52 -1.26 -4.27 119.66 126.96 1vgq s GLN 392 Ca -0.05 -0.75 -0.22 0.00 -1.95 0.00 0.00 55.36 52.39 1vgq s GLN 392 Cb -0.05 -2.14 -0.06 0.00 -0.22 0.00 0.00 33.01 30.54 1vgq s GLN 392 CO -0.11 0.05 1.23 -2.14 -0.25 0.00 0.00 175.29 174.07 1vgq s PRO 393 N 0.66 3.52 -0.33 2.91 0.02 -1.26 -5.01 135.00 135.50 1vgq s PRO 393 Ca -0.12 1.93 0.04 0.00 0.02 0.00 0.00 61.00 62.86 1vgq s PRO 393 Cb -0.16 -2.34 0.10 0.00 0.02 0.00 0.00 34.50 32.12 1vgq s PRO 393 CO 0.03 -0.79 0.04 -1.21 -0.33 0.00 0.00 177.00 174.74 1vgq s GLU 394 N -2.80 1.54 -0.11 5.54 2.02 -1.26 -5.09 118.70 118.54 1vgq s GLU 394 Ca 0.67 -1.84 -0.26 0.00 0.02 0.00 0.00 54.97 53.56 1vgq s GLU 394 Cb -0.32 -3.19 -0.02 0.00 0.10 0.00 0.00 34.13 30.70 1vgq s GLU 394 CO 0.39 -0.91 0.86 0.42 0.02 0.00 0.00 175.26 176.04 1vgq s ILE 395 N 0.92 4.89 0.19 -1.63 1.01 -1.26 -4.97 121.20 120.35 1vgq s ILE 395 Ca 0.09 1.74 0.11 0.00 0.00 0.00 0.00 60.65 62.59 1vgq s ILE 395 Cb -0.19 -4.18 -0.04 0.00 0.01 0.00 0.00 42.46 38.06 1vgq s ILE 395 CO -0.08 0.09 -0.23 0.42 0.00 0.00 0.00 174.94 175.14 1vgq s THR 396 N 1.68 2.25 0.74 2.92 -4.23 -1.26 -4.79 115.64 112.96 1vgq s THR 396 Ca 0.42 -2.00 -0.15 0.00 -1.18 0.00 0.00 61.69 58.79 1vgq s THR 396 Cb -0.18 -2.07 0.05 0.00 1.34 0.00 0.00 72.50 71.64 1vgq s THR 396 CO 0.17 -0.14 1.21 0.00 -0.54 0.00 0.00 174.62 175.31 1vgq s ARG 397 N -2.66 2.06 0.45 3.99 1.70 -1.26 -1.97 118.95 121.26 1vgq s ARG 397 Ca 0.19 1.76 -0.25 0.00 -0.47 0.00 0.00 55.73 56.97 1vgq s ARG 397 Cb -0.08 -1.82 -0.08 0.00 -0.57 0.00 0.00 34.95 32.40 1vgq s ARG 397 CO 0.09 -1.90 1.31 0.00 -1.08 0.00 0.00 175.30 173.73 1vgq s ALA 398 N -2.01 3.12 0.39 7.88 0.00 -1.26 -4.29 121.76 125.59 1vgq s ALA 398 Ca 0.74 1.25 -0.24 0.00 0.00 0.00 0.00 51.96 53.71 1vgq s ALA 398 Cb -0.29 -3.50 -0.09 0.00 0.00 0.00 0.00 23.12 19.23 1vgq s ALA 398 CO 0.46 -0.97 1.02 -1.25 0.00 0.00 0.00 175.76 175.02 1vgq s PRO 399 N -2.48 4.23 0.69 0.00 0.04 -1.26 -5.00 135.00 131.22 1vgq s PRO 399 Ca 0.62 1.41 -0.14 0.00 0.04 0.00 0.00 61.00 62.93 1vgq s PRO 399 Cb -0.38 -2.51 0.02 0.00 0.04 0.00 0.00 34.50 31.67 1vgq s PRO 399 CO 0.48 -0.07 1.12 -0.51 0.04 0.00 0.00 177.00 178.06 1vgq s LEU 400 N -2.66 3.32 0.05 -3.56 1.43 -1.26 -4.93 118.68 111.07 1vgq s LEU 400 Ca 0.58 2.04 -0.30 0.00 -1.03 0.00 0.00 54.13 55.41 1vgq s LEU 400 Cb -0.19 -4.55 -0.09 0.00 0.03 0.00 0.00 46.19 41.38 1vgq s LEU 400 CO 0.24 -1.83 1.92 -0.22 0.23 0.00 0.00 176.35 176.70 1vgq s LEU 401 N -5.10 4.42 -1.91 1.79 2.96 -1.26 -1.51 118.68 118.07 1vgq s LEU 401 Ca 0.67 2.68 0.00 0.00 -0.22 0.00 0.00 54.13 57.26 1vgq s LEU 401 Cb -0.21 -3.54 0.00 0.00 0.50 0.00 0.00 46.19 42.94 1vgq s LEU 401 CO 0.44 -1.04 0.00 0.61 -1.32 0.00 0.00 176.35 175.05 1vgq n GLY 402 N 4.46 1.52 0.28 7.98 0.00 -1.25 -4.89 105.19 113.29 1vgq n GLY 402 Ca 0.19 -0.13 0.08 0.00 0.00 0.00 0.00 46.02 46.16 1vgq n GLY 402 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1vgq h GLU 403 N 0.00 0.15 -0.34 1.61 4.81 -1.17 -2.64 114.58 116.98 1vgq h GLU 403 Ca -0.39 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 58.83 1vgq h GLU 403 Cb 1.22 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 30.57 1vgq h GLU 403 CO 0.55 0.10 0.00 0.72 -0.73 0.00 0.00 179.01 179.65 1vgq n HIS 404 N -4.51 0.54 0.10 0.92 8.25 0.08 -4.76 115.22 115.84 1vgq n HIS 404 Ca -0.00 -0.55 -0.16 0.00 -0.26 0.00 0.00 57.72 56.75 1vgq n HIS 404 Cb 0.12 -0.06 -0.09 0.00 1.12 0.00 0.00 29.99 31.07 1vgq n HIS 404 CO 0.00 0.00 0.00 1.15 0.64 0.00 0.00 176.34 178.13 1vgq h THR 405 N 2.05 0.03 -0.59 1.59 2.02 -1.17 -0.15 112.91 116.69 1vgq h THR 405 Ca 0.00 0.00 -0.09 0.00 0.77 0.00 0.00 66.41 67.09 1vgq h THR 405 Cb 0.83 0.03 -0.02 0.00 -1.74 0.00 0.00 68.15 67.25 1vgq h THR 405 CO 0.03 0.00 0.02 0.44 0.37 0.00 0.00 175.52 176.38 1vgq h ASP 406 N -0.71 1.01 -0.83 4.18 3.32 -1.86 -1.09 116.42 120.44 1vgq h ASP 406 Ca 0.01 -0.30 0.04 0.00 0.02 0.00 0.00 57.03 56.80 1vgq h ASP 406 Cb 0.74 -0.27 -0.05 0.00 0.22 0.00 0.00 39.33 39.97 1vgq h ASP 406 CO -0.30 1.06 0.53 -0.08 -1.72 0.00 0.00 179.24 178.73 1vgq h GLU 407 N 0.93 1.00 -0.22 3.56 4.81 -1.86 -0.94 114.58 121.85 1vgq h GLU 407 Ca 0.17 -0.06 -0.21 0.00 -0.13 0.00 0.00 59.36 59.14 1vgq h GLU 407 Cb 0.53 -0.23 0.01 0.00 0.63 0.00 0.00 28.75 29.69 1vgq h GLU 407 CO 0.03 0.66 -0.66 0.28 -0.73 0.00 0.00 179.01 178.58 1vgq h VAL 408 N 1.03 1.27 0.00 0.32 2.07 -0.65 -2.74 116.25 117.55 1vgq h VAL 408 Ca 0.34 -1.85 -0.05 0.00 0.82 0.00 0.00 66.70 65.96 1vgq h VAL 408 Cb 0.03 1.80 -0.01 0.00 -1.52 0.00 0.00 31.29 31.59 1vgq h VAL 408 CO -0.12 0.60 -0.24 -0.07 0.02 0.00 0.00 177.57 177.75 1vgq h LEU 409 N 0.61 0.00 -0.22 2.57 3.38 -0.99 -2.83 115.31 117.82 1vgq h LEU 409 Ca -0.02 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 57.75 1vgq h LEU 409 Cb 1.28 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.02 1vgq h LEU 409 CO 0.14 0.24 -0.92 0.11 0.09 0.00 0.00 178.44 178.11 1vgq h LYS 410 N 0.00 0.19 0.00 1.13 1.57 -1.02 -3.01 116.57 115.43 1vgq h LYS 410 Ca -0.00 -0.22 -0.00 0.00 -1.87 0.00 0.00 60.65 58.55 1vgq h LYS 410 Cb 0.47 0.07 -0.00 0.00 0.08 0.00 0.00 32.23 32.84 1vgq h LYS 410 CO 0.03 0.98 -0.02 0.93 -0.57 0.00 0.00 179.45 180.80 1vgq h GLU 411 N 0.10 0.00 -0.02 3.15 5.08 -1.24 -2.07 114.58 119.57 1vgq h GLU 411 Ca -0.05 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.31 1vgq h GLU 411 Cb 1.57 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.82 1vgq h GLU 411 CO 0.14 0.02 0.00 1.28 -1.00 0.00 0.00 179.01 179.45 1vgq n LEU 412 N -3.15 0.91 0.00 1.33 4.77 -1.14 -4.94 117.00 114.78 1vgq n LEU 412 Ca -0.01 -0.32 0.00 0.00 -0.03 0.00 0.00 56.01 55.65 1vgq n LEU 412 Cb 0.23 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.31 1vgq n LEU 412 CO 0.25 0.16 0.00 0.61 -1.33 0.00 0.00 177.39 177.08 1vgq n GLY 413 N 1.09 0.56 3.81 -0.72 0.00 -0.78 -5.05 105.19 104.10 1vgq n GLY 413 Ca 0.20 -0.61 -0.38 0.00 0.00 0.00 0.00 46.02 45.23 1vgq n GLY 413 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1vgq s LEU 414 N 0.00 4.50 0.76 0.99 1.43 -1.20 -5.07 118.68 120.09 1vgq s LEU 414 Ca 0.00 1.25 -0.12 0.00 -1.03 0.00 0.00 54.13 54.24 1vgq s LEU 414 Cb 0.00 -2.98 0.05 0.00 0.03 0.00 0.00 46.19 43.29 1vgq s LEU 414 CO 0.00 0.24 1.14 1.51 0.23 0.00 0.00 176.35 179.47 1vgq s ASP 415 N -1.21 4.91 0.40 2.29 -4.77 -1.26 -4.60 116.67 112.42 1vgq s ASP 415 Ca 0.31 0.91 0.13 0.00 -3.30 0.00 0.00 52.55 50.61 1vgq s ASP 415 Cb -0.19 -1.54 0.84 0.00 -1.09 0.00 0.00 42.92 40.94 1vgq s ASP 415 CO 0.19 -1.66 1.89 0.44 0.70 0.00 0.00 175.17 176.74 1vgq h ASP 416 N -0.87 0.00 0.38 2.11 5.19 -2.00 -2.83 116.42 118.40 1vgq h ASP 416 Ca -0.46 0.00 -0.24 0.00 -0.62 0.00 0.00 57.03 55.72 1vgq h ASP 416 Cb 1.30 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.81 1vgq h ASP 416 CO 0.65 0.29 -1.02 0.00 -3.12 0.00 0.00 179.24 176.05 1vgq h ALA 417 N 1.71 0.29 -0.17 3.45 0.00 -2.00 -2.94 119.26 119.60 1vgq h ALA 417 Ca -0.00 -0.75 -0.08 0.00 0.00 0.00 0.00 54.91 54.08 1vgq h ALA 417 Cb 0.52 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 1vgq h ALA 417 CO 0.04 0.84 -0.24 -0.22 0.00 0.00 0.00 179.25 179.67 1vgq h LYS 418 N 0.20 0.30 -0.47 0.00 3.64 -1.90 -2.52 116.57 115.82 1vgq h LYS 418 Ca -0.10 -0.10 -0.09 0.00 -1.27 0.00 0.00 60.65 59.10 1vgq h LYS 418 Cb 1.67 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 33.45 1vgq h LYS 418 CO 0.18 0.52 -0.05 0.82 -2.27 0.00 0.00 179.45 178.65 1vgq h ILE 419 N 0.27 1.25 -0.16 2.00 2.04 -1.46 -2.27 117.51 119.19 1vgq h ILE 419 Ca 0.04 -1.10 -0.10 0.00 1.00 0.00 0.00 64.86 64.71 1vgq h ILE 419 Cb 0.57 0.94 -0.01 0.00 -0.74 0.00 0.00 36.82 37.58 1vgq h ILE 419 CO 0.04 0.38 -0.32 0.11 0.00 0.00 0.00 178.15 178.36 1vgq h LYS 420 N 0.75 0.32 -0.44 2.37 1.57 -1.32 -2.56 116.57 117.27 1vgq h LYS 420 Ca 0.14 -0.13 -0.11 0.00 -1.87 0.00 0.00 60.65 58.68 1vgq h LYS 420 Cb 0.53 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.81 1vgq h LYS 420 CO 0.03 0.61 -0.17 1.49 -0.57 0.00 0.00 179.45 180.84 1vgq h GLU 421 N 0.28 0.89 -0.62 3.15 4.81 -1.12 -1.75 114.58 120.22 1vgq h GLU 421 Ca 0.04 -0.37 -0.09 0.00 -0.13 0.00 0.00 59.36 58.80 1vgq h GLU 421 Cb 0.70 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 30.03 1vgq h GLU 421 CO 0.05 1.02 0.03 -0.07 -0.73 0.00 0.00 179.01 179.31 1vgq h LEU 422 N 0.72 1.05 -0.63 1.64 3.38 -1.35 0.37 115.31 120.49 1vgq h LEU 422 Ca 0.10 -0.29 0.03 0.00 0.09 0.00 0.00 57.88 57.81 1vgq h LEU 422 Cb 0.73 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 41.16 1vgq h LEU 422 CO 0.06 1.09 0.38 0.45 0.09 0.00 0.00 178.44 180.50 1vgq h HIS 423 N 0.98 0.70 0.00 1.13 3.86 -1.35 -2.27 115.15 118.21 1vgq h HIS 423 Ca 0.18 0.02 -0.18 0.00 -1.16 0.00 0.00 60.37 59.24 1vgq h HIS 423 Cb 0.53 -0.22 -0.03 0.00 1.06 0.00 0.00 27.41 28.75 1vgq h HIS 423 CO 0.04 0.39 -0.84 0.00 0.86 0.00 0.00 177.93 178.38 1vgq h ALA 424 N 1.29 0.60 0.00 2.45 0.00 -0.90 -2.89 119.26 119.81 1vgq h ALA 424 Ca 0.26 -0.76 0.00 0.00 0.00 0.00 0.00 54.91 54.41 1vgq h ALA 424 Cb 0.06 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.71 1vgq h ALA 424 CO -0.12 1.05 0.00 1.63 0.00 0.00 0.00 179.25 181.81 1vgq n LYS 425 N -3.52 0.12 -1.51 0.00 5.02 0.13 -4.92 118.16 113.49 1vgq n LYS 425 Ca -0.00 0.08 -0.05 0.00 -2.02 0.00 0.00 58.31 56.31 1vgq n LYS 425 Cb 0.81 -1.50 -0.01 0.00 -0.02 0.00 0.00 35.03 34.30 1vgq n LYS 425 CO 0.00 0.00 0.00 0.94 -0.52 0.00 0.00 177.40 177.82 1vgq n GLN 426 N -1.42 -0.38 0.01 1.97 -0.06 -0.89 -4.90 117.38 111.71 1vgq n GLN 426 Ca 0.08 0.52 0.11 0.00 -2.00 0.00 0.00 57.00 55.71 1vgq n GLN 426 Cb 0.25 -4.26 0.07 0.00 -4.06 0.00 0.00 30.24 22.24 1vgq n GLN 426 CO 0.00 0.00 0.00 1.33 -0.20 0.00 0.00 177.06 178.19 1vgq n VAL 427 N -3.29 0.09 -1.22 1.69 0.24 -0.97 -4.70 118.33 110.17 1vgq n VAL 427 Ca -0.06 -0.12 0.00 0.00 -2.04 0.00 0.00 64.34 62.13 1vgq n VAL 427 Cb 0.31 0.37 0.00 0.00 -1.47 0.00 0.00 33.84 33.05 1vgq n VAL 427 CO 0.00 0.00 0.00 0.52 -2.14 0.00 0.00 176.83 175.21