#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 4.06 0.28 -2.82 1.02 -1.26 -4.69 119.74 116.33 1vgq s LYS 3 Ca 0.00 0.34 0.02 0.00 0.02 0.00 0.00 55.97 56.35 1vgq s LYS 3 Cb 0.00 -3.31 0.64 0.00 -0.52 0.00 0.00 37.83 34.65 1vgq s LYS 3 CO 0.00 0.49 1.75 -1.35 -0.92 0.00 0.00 175.35 175.32 1vgq h PRO 4 N 5.56 0.59 -0.31 -1.68 0.11 -1.94 -2.61 132.00 131.72 1vgq h PRO 4 Ca -0.47 -0.04 -0.10 0.00 0.11 0.00 0.00 66.00 65.50 1vgq h PRO 4 Cb 1.20 -0.13 -0.06 0.00 0.11 0.00 0.00 31.00 32.11 1vgq h PRO 4 CO 0.67 0.39 -0.03 1.28 -0.21 0.00 0.00 178.00 180.11 1vgq n LEU 5 N -4.88 3.98 -4.62 2.35 4.77 -0.37 -5.00 117.00 113.22 1vgq n LEU 5 Ca 0.20 -3.43 -0.49 0.00 -0.03 0.00 0.00 56.01 52.26 1vgq n LEU 5 Cb 0.53 -0.59 -0.05 0.00 -2.33 0.00 0.00 43.42 40.98 1vgq n LEU 5 CO 0.19 0.99 1.03 0.47 -1.33 0.00 0.00 177.39 178.74 1vgq n ASP 6 N -0.90 2.27 0.00 -1.43 8.00 -0.99 -2.28 116.55 121.23 1vgq n ASP 6 Ca 0.28 1.10 0.00 0.00 0.71 0.00 0.00 54.79 56.88 1vgq n ASP 6 Cb 0.97 -1.29 0.00 0.00 -0.02 0.00 0.00 41.12 40.77 1vgq n ASP 6 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1vgq n GLY 7 N 2.90 0.85 3.58 0.44 0.00 -1.26 -5.00 105.19 106.70 1vgq n GLY 7 Ca 0.18 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.79 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 -3.36 5.08 -0.20 -0.61 -1.09 -0.96 -4.98 121.20 115.07 1vgq s ILE 8 Ca 0.00 0.44 -0.14 0.00 -2.23 0.00 0.00 60.65 58.73 1vgq s ILE 8 Cb 0.00 -3.86 -0.04 0.00 -1.58 0.00 0.00 42.46 36.97 1vgq s ILE 8 CO 0.00 -0.07 0.29 0.20 -1.23 0.00 0.00 174.94 174.14 1vgq s ASN 9 N 1.69 6.33 -0.22 3.58 0.01 -1.26 -1.16 114.94 123.92 1vgq s ASN 9 Ca 0.17 0.38 -0.01 0.00 -0.71 0.00 0.00 52.86 52.69 1vgq s ASN 9 Cb -0.16 -2.18 0.02 0.00 0.41 0.00 0.00 41.25 39.34 1vgq s ASN 9 CO 0.12 0.01 -0.11 -0.69 -1.51 0.00 0.00 177.10 174.92 1vgq s VAL 10 N 1.02 2.64 -0.57 1.60 1.01 0.30 -0.88 120.40 125.52 1vgq s VAL 10 Ca 0.15 -0.90 -0.23 0.00 0.00 0.00 0.00 61.98 61.00 1vgq s VAL 10 Cb -0.14 -2.23 0.05 0.00 0.00 0.00 0.00 36.38 34.06 1vgq s VAL 10 CO 0.06 0.37 0.89 -0.22 0.00 0.00 0.00 175.10 176.20 1vgq s LEU 11 N 1.34 4.34 -0.65 3.92 2.96 0.33 -1.22 118.68 129.70 1vgq s LEU 11 Ca 0.03 -0.63 -0.10 0.00 -0.22 0.00 0.00 54.13 53.21 1vgq s LEU 11 Cb -0.15 -2.65 0.17 0.00 0.50 0.00 0.00 46.19 44.06 1vgq s LEU 11 CO -0.08 -1.22 0.54 -0.62 -1.32 0.00 0.00 176.35 173.66 1vgq s ASP 12 N 3.04 6.01 0.00 3.68 2.15 0.05 -1.28 116.67 130.32 1vgq s ASP 12 Ca 0.25 -2.46 0.27 0.00 0.43 0.00 0.00 52.55 51.05 1vgq s ASP 12 Cb -0.15 -2.06 1.62 0.00 -0.30 0.00 0.00 42.92 42.04 1vgq s ASP 12 CO 0.15 -0.57 2.03 0.49 -0.17 0.00 0.00 175.17 177.10 1vgq n PHE 13 N 4.19 0.00 -2.12 -5.34 3.01 0.04 -0.78 117.46 116.47 1vgq n PHE 13 Ca 0.04 0.00 -0.32 0.00 1.01 0.00 0.00 57.45 58.18 1vgq n PHE 13 Cb 0.42 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.89 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 4.02 0.28 4.37 -4.23 -1.24 -4.66 115.64 112.19 1vgq s THR 14 Ca 0.41 0.94 0.03 0.00 -1.18 0.00 0.00 61.69 61.89 1vgq s THR 14 Cb 0.19 -3.48 -0.04 0.00 1.34 0.00 0.00 72.50 70.51 1vgq s THR 14 CO 0.31 -0.58 0.16 -1.38 -0.54 0.00 0.00 174.62 172.60 1vgq s HIS 15 N -2.53 1.53 0.00 3.99 -3.43 -1.26 -4.78 115.29 108.80 1vgq s HIS 15 Ca 0.62 -1.39 0.00 0.00 -0.80 0.00 0.00 55.06 53.49 1vgq s HIS 15 Cb -0.14 -0.78 0.00 0.00 -1.43 0.00 0.00 32.58 30.22 1vgq s HIS 15 CO 0.36 -0.57 0.00 0.28 -2.00 0.00 0.00 174.74 172.81 1vgq n VAL 16 N -0.52 0.00 0.01 -5.38 0.31 -1.26 -4.39 118.33 107.10 1vgq n VAL 16 Ca 0.02 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.35 1vgq n VAL 16 Cb 0.65 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.58 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 12.49 0.00 0.27 5.55 7.27 -1.26 -4.60 117.38 137.10 1vgq n GLN 17 Ca 0.00 0.00 -0.16 0.00 0.07 0.00 0.00 57.00 56.91 1vgq n GLN 17 Cb 0.00 -0.42 -0.08 0.00 2.41 0.00 0.00 30.24 32.15 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 -0.70 0.28 1.69 0.00 -1.79 0.72 119.26 119.46 1vgq h ALA 18 Ca 0.00 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 1vgq h ALA 18 Cb 0.71 0.33 0.00 0.00 0.00 0.00 0.00 17.79 18.84 1vgq h ALA 18 CO 0.00 -0.91 -0.14 0.78 0.00 0.00 0.00 179.25 178.99 1vgq h GLY 19 N -0.70 -0.40 1.96 0.00 0.00 -1.87 -2.95 103.07 99.12 1vgq h GLY 19 Ca -0.05 0.15 -0.00 0.00 0.00 0.00 0.00 47.33 47.42 1vgq h GLY 19 CO 0.06 -0.14 0.02 -2.55 0.00 0.00 0.00 176.54 173.93 1vgq h PRO 20 N -0.54 0.05 -0.44 4.80 0.11 -1.76 -2.32 132.00 131.91 1vgq h PRO 20 Ca -0.04 -0.00 -0.02 0.00 0.11 0.00 0.00 66.00 66.04 1vgq h PRO 20 Cb 0.40 -0.01 -0.02 0.00 0.11 0.00 0.00 31.00 31.47 1vgq h PRO 20 CO 0.06 0.04 0.18 0.00 -0.21 0.00 0.00 178.00 178.08 1vgq h ALA 21 N 1.97 0.57 0.60 -0.75 0.00 -0.80 0.31 119.26 121.15 1vgq h ALA 21 Ca 0.02 -0.14 -0.02 0.00 0.00 0.00 0.00 54.91 54.76 1vgq h ALA 21 Cb 0.01 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.62 1vgq h ALA 21 CO -0.00 0.17 -0.36 0.00 0.00 0.00 0.00 179.25 179.05 1vgq h THR 23 N -0.91 1.29 -0.43 0.00 1.35 -1.42 -1.63 112.91 111.16 1vgq h THR 23 Ca -0.07 -1.40 -0.02 0.00 -0.55 0.00 0.00 66.41 64.37 1vgq h THR 23 Cb 0.74 1.70 -0.02 0.00 -1.73 0.00 0.00 68.15 68.84 1vgq h THR 23 CO 0.08 0.41 0.20 -0.61 -0.25 0.00 0.00 175.52 175.34 1vgq h GLN 24 N 0.08 0.63 -0.36 4.72 4.15 -0.87 -0.47 115.11 122.98 1vgq h GLN 24 Ca 0.01 -0.10 -0.12 0.00 0.77 0.00 0.00 58.65 59.20 1vgq h GLN 24 Cb 0.73 -0.11 -0.01 0.00 0.21 0.00 0.00 27.48 28.30 1vgq h GLN 24 CO 0.05 0.55 -0.28 1.98 -1.93 0.00 0.00 178.83 179.21 1vgq h MET 25 N 0.56 0.75 -0.52 1.69 4.05 -0.94 0.11 114.93 120.63 1vgq h MET 25 Ca 0.15 -0.33 0.03 0.00 -0.28 0.00 0.00 59.70 59.27 1vgq h MET 25 Cb 0.14 -0.02 -0.04 0.00 -0.80 0.00 0.00 31.60 30.88 1vgq h MET 25 CO -0.02 0.94 0.30 0.52 0.23 0.00 0.00 176.91 178.89 1vgq h MET 26 N 0.64 0.58 -0.74 0.39 2.86 -1.22 -1.81 114.93 115.64 1vgq h MET 26 Ca 0.08 -0.03 0.03 0.00 -2.06 0.00 0.00 59.70 57.72 1vgq h MET 26 Cb 0.80 -0.13 -0.05 0.00 0.06 0.00 0.00 31.60 32.28 1vgq h MET 26 CO 0.07 0.38 0.46 0.78 1.06 0.00 0.00 176.91 179.66 1vgq h GLY 27 N 0.60 1.07 1.41 8.32 0.00 -0.24 -1.57 103.07 112.65 1vgq h GLY 27 Ca 0.21 -0.35 0.04 0.00 0.00 0.00 0.00 47.33 47.24 1vgq h GLY 27 CO -0.10 0.28 0.30 0.74 0.00 0.00 0.00 176.54 177.76 1vgq h PHE 28 N 0.89 0.42 -0.30 5.60 -1.00 -0.35 -1.54 116.94 120.67 1vgq h PHE 28 Ca 0.30 0.01 0.00 0.00 2.81 0.00 0.00 57.97 61.09 1vgq h PHE 28 Cb 0.04 -0.14 0.00 0.00 3.61 0.00 0.00 35.95 39.46 1vgq h PHE 28 CO -0.04 0.24 0.00 1.28 -1.61 0.00 0.00 178.31 178.18 1vgq n LEU 29 N -4.48 1.72 0.00 1.54 4.77 -0.72 -4.51 117.00 115.32 1vgq n LEU 29 Ca 0.05 -0.84 0.00 0.00 -0.03 0.00 0.00 56.01 55.19 1vgq n LEU 29 Cb 0.20 -0.20 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 1vgq n LEU 29 CO 0.35 0.42 0.00 0.61 -1.33 0.00 0.00 177.39 177.44 1vgq n GLY 30 N 1.04 0.74 3.76 -0.72 0.00 -0.58 -1.23 105.19 108.20 1vgq n GLY 30 Ca 0.12 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.77 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 2.84 -0.66 4.61 0.00 -0.67 -3.68 121.76 122.20 1vgq s ALA 31 Ca 0.00 1.06 -0.23 0.00 0.00 0.00 0.00 51.96 52.80 1vgq s ALA 31 Cb 0.00 -3.45 0.07 0.00 0.00 0.00 0.00 23.12 19.74 1vgq s ALA 31 CO 0.00 -0.97 0.97 1.21 0.00 0.00 0.00 175.76 176.97 1vgq s ASN 32 N -1.30 6.18 -0.28 0.00 3.04 -0.31 -4.40 114.94 117.87 1vgq s ASN 32 Ca 0.69 -0.97 -0.10 0.00 0.04 0.00 0.00 52.86 52.52 1vgq s ASN 32 Cb -0.32 -2.42 -0.04 0.00 -1.54 0.00 0.00 41.25 36.93 1vgq s ASN 32 CO 0.38 -1.44 0.16 -0.69 -3.04 0.00 0.00 177.10 172.47 1vgq s VAL 33 N 4.08 4.97 -0.32 -5.21 1.01 -1.26 -0.54 120.40 123.13 1vgq s VAL 33 Ca 0.22 0.00 -0.07 0.00 0.00 0.00 0.00 61.98 62.13 1vgq s VAL 33 Cb -0.17 -3.39 0.02 0.00 0.00 0.00 0.00 36.38 32.85 1vgq s VAL 33 CO 0.10 0.24 0.11 -0.63 0.00 0.00 0.00 175.10 174.93 1vgq s ILE 34 N 1.71 4.01 -0.30 2.22 1.01 -0.36 -1.64 121.20 127.85 1vgq s ILE 34 Ca 0.07 -0.86 -0.19 0.00 0.00 0.00 0.00 60.65 59.67 1vgq s ILE 34 Cb -0.16 -3.16 -0.01 0.00 0.01 0.00 0.00 42.46 39.13 1vgq s ILE 34 CO 0.09 -0.05 0.57 -0.75 0.00 0.00 0.00 174.94 174.79 1vgq s LYS 35 N 1.48 3.90 -0.14 2.79 2.20 0.10 -0.77 119.74 129.30 1vgq s LYS 35 Ca 0.01 0.22 -0.21 0.00 -0.36 0.00 0.00 55.97 55.63 1vgq s LYS 35 Cb -0.18 -3.72 -0.03 0.00 -1.51 0.00 0.00 37.83 32.39 1vgq s LYS 35 CO 0.03 -0.51 0.60 0.42 -0.36 0.00 0.00 175.35 175.53 1vgq s ILE 36 N 2.47 5.08 0.14 5.43 1.01 0.04 -1.71 121.20 133.67 1vgq s ILE 36 Ca 0.23 1.18 0.07 0.00 0.00 0.00 0.00 60.65 62.13 1vgq s ILE 36 Cb -0.15 -3.93 -0.04 0.00 0.01 0.00 0.00 42.46 38.35 1vgq s ILE 36 CO 0.11 0.21 -0.15 -1.61 0.00 0.00 0.00 174.94 173.50 1vgq s GLU 37 N 1.24 1.12 0.39 2.79 2.02 -0.51 -4.60 118.70 121.15 1vgq s GLU 37 Ca 0.30 -1.33 -0.28 0.00 0.02 0.00 0.00 54.97 53.69 1vgq s GLU 37 Cb -0.16 -1.03 -0.11 0.00 0.10 0.00 0.00 34.13 32.93 1vgq s GLU 37 CO 0.12 0.20 1.44 0.54 0.02 0.00 0.00 175.26 177.58 1vgq n ARG 38 N 0.35 2.51 -1.88 1.61 1.74 -1.26 -1.23 116.66 118.50 1vgq n ARG 38 Ca -0.14 0.88 -0.42 0.00 -0.77 0.00 0.00 57.85 57.40 1vgq n ARG 38 Cb 0.57 -2.60 -0.03 0.00 -1.02 0.00 0.00 32.46 29.38 1vgq n ARG 38 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 1vgq s ARG 39 N -2.13 4.19 0.00 5.56 0.52 -1.26 -2.02 118.95 123.81 1vgq s ARG 39 Ca 0.55 2.42 0.00 0.00 -0.52 0.00 0.00 55.73 58.18 1vgq s ARG 39 Cb -0.49 -3.27 0.00 0.00 0.52 0.00 0.00 34.95 31.72 1vgq s ARG 39 CO 0.63 -0.68 0.00 0.41 0.02 0.00 0.00 175.30 175.68 1vgq n GLY 40 N 3.88 2.45 0.09 -3.53 0.00 -1.26 -4.56 105.19 102.26 1vgq n GLY 40 Ca 0.15 -0.63 -0.09 0.00 0.00 0.00 0.00 46.02 45.45 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 3.13 0.63 -0.00 1.61 3.41 -1.26 -5.10 113.62 116.04 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 0.95 0.00 0.00 -0.26 0.00 0.00 64.21 64.90 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 1.90 -0.13 3.65 5.00 0.00 -0.86 -4.72 105.19 110.04 1vgq n GLY 42 Ca -0.29 -1.04 -0.49 0.00 0.00 0.00 0.00 46.02 44.20 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 -1.68 2.70 -0.48 1.61 -0.08 -1.26 -4.55 116.55 112.80 1vgq n ASP 43 Ca 0.00 1.07 0.40 0.00 -1.51 0.00 0.00 54.79 54.75 1vgq n ASP 43 Cb 0.00 -1.32 0.70 0.00 2.34 0.00 0.00 41.12 42.83 1vgq n ASP 43 CO 0.00 0.00 0.00 0.24 0.12 0.00 0.00 177.20 177.56 1vgq h MET 44 N 6.31 0.07 0.00 -0.67 2.86 -1.98 -0.86 114.93 120.66 1vgq h MET 44 Ca -0.46 -0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.17 1vgq h MET 44 Cb 1.29 -0.02 -0.00 0.00 0.06 0.00 0.00 31.60 32.93 1vgq h MET 44 CO 0.88 0.05 -0.03 1.79 1.06 0.00 0.00 176.91 180.66 1vgq h THR 45 N 0.08 0.11 -0.64 2.22 1.35 -1.91 -2.95 112.91 111.17 1vgq h THR 45 Ca 0.80 -0.36 0.10 0.00 -0.55 0.00 0.00 66.41 66.39 1vgq h THR 45 Cb 2.74 1.32 -0.07 0.00 -1.73 0.00 0.00 68.15 70.41 1vgq h THR 45 CO -0.26 0.03 0.26 0.03 -0.25 0.00 0.00 175.52 175.33 1vgq h ARG 46 N 0.00 0.44 -0.66 4.72 3.08 -1.47 -2.81 114.38 117.68 1vgq h ARG 46 Ca -0.00 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.02 1vgq h ARG 46 Cb 0.32 -0.10 0.00 0.00 0.08 0.00 0.00 29.97 30.27 1vgq h ARG 46 CO 0.00 0.29 0.00 0.41 -1.07 0.00 0.00 179.97 179.61 1vgq n GLY 47 N -1.30 2.73 3.42 0.04 0.00 -1.12 -2.03 105.19 106.94 1vgq n GLY 47 Ca 0.09 -0.84 -0.41 0.00 0.00 0.00 0.00 46.02 44.87 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 -1.68 3.23 -1.25 1.61 -0.11 -1.06 -4.50 118.94 115.19 1vgq s TRP 48 Ca 0.50 -0.74 -0.03 0.00 1.22 0.00 0.00 56.10 57.06 1vgq s TRP 48 Cb 0.31 -2.47 -0.01 0.00 -1.50 0.00 0.00 33.47 29.81 1vgq s TRP 48 CO 0.26 -0.57 0.75 1.28 -4.62 0.00 0.00 176.95 174.05 1vgq n LEU 49 N 5.04 -3.41 -4.77 5.86 4.77 -1.26 -4.62 117.00 118.62 1vgq n LEU 49 Ca -0.12 -0.82 -0.41 0.00 -0.03 0.00 0.00 56.01 54.64 1vgq n LEU 49 Cb 0.47 -2.72 -0.01 0.00 -2.33 0.00 0.00 43.42 38.83 1vgq n LEU 49 CO 0.37 0.38 1.04 -1.10 -1.33 0.00 0.00 177.39 176.75 1vgq s GLN 50 N -5.77 4.16 0.11 3.23 -0.21 -1.26 -4.59 119.66 115.33 1vgq s GLN 50 Ca 0.10 2.34 0.14 0.00 0.02 0.00 0.00 55.36 57.97 1vgq s GLN 50 Cb -0.03 -2.96 -0.11 0.00 1.00 0.00 0.00 33.01 30.92 1vgq s GLN 50 CO 0.80 -0.40 1.01 0.38 -2.12 0.00 0.00 175.29 174.97 1vgq h ASP 51 N 3.06 0.00 -3.87 5.90 2.03 -1.90 -3.46 116.42 118.18 1vgq h ASP 51 Ca -0.50 0.00 -0.50 0.00 -0.73 0.00 0.00 57.03 55.30 1vgq h ASP 51 Cb 1.24 0.00 -0.31 0.00 -0.83 0.00 0.00 39.33 39.43 1vgq h ASP 51 CO 0.64 0.68 -0.81 -0.54 -1.03 0.00 0.00 179.24 178.18 1vgq s LYS 52 N -2.86 1.38 0.33 4.15 1.02 -1.26 -5.13 119.74 117.37 1vgq s LYS 52 Ca -0.01 -0.46 -0.28 0.00 0.02 0.00 0.00 55.97 55.23 1vgq s LYS 52 Cb 0.08 -1.23 -0.10 0.00 -0.52 0.00 0.00 37.83 36.06 1vgq s LYS 52 CO 0.80 0.19 1.26 -1.25 -0.92 0.00 0.00 175.35 175.43 1vgq s PRO 53 N 0.10 4.37 0.00 -1.68 0.04 -1.26 -2.58 135.00 133.98 1vgq s PRO 53 Ca -0.03 2.13 0.00 0.00 0.04 0.00 0.00 61.00 63.13 1vgq s PRO 53 Cb -0.10 -3.05 0.00 0.00 0.04 0.00 0.00 34.50 31.39 1vgq s PRO 53 CO 0.01 -0.14 0.00 0.27 0.04 0.00 0.00 177.00 177.18 1vgq n ASN 54 N 0.79 0.00 -4.79 6.66 6.94 -1.26 -5.00 115.26 118.61 1vgq n ASN 54 Ca 0.00 0.00 -0.39 0.00 -0.02 0.00 0.00 54.58 54.17 1vgq n ASN 54 Cb 0.43 -0.08 -0.06 0.00 -2.36 0.00 0.00 39.78 37.71 1vgq n ASN 54 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 1vgq s VAL 55 N -0.66 4.78 0.24 3.53 1.01 -1.07 -5.02 120.40 123.20 1vgq s VAL 55 Ca 0.00 1.29 -0.31 0.00 0.00 0.00 0.00 61.98 62.95 1vgq s VAL 55 Cb 0.00 -3.94 -0.13 0.00 0.00 0.00 0.00 36.38 32.31 1vgq s VAL 55 CO 0.00 0.49 1.51 0.47 0.00 0.00 0.00 175.10 177.57 1vgq n ASP 56 N 2.16 3.20 -4.72 3.32 8.00 -1.26 -4.73 116.55 122.52 1vgq n ASP 56 Ca -0.08 1.13 -0.31 0.00 0.71 0.00 0.00 54.79 56.23 1vgq n ASP 56 Cb 0.51 -1.48 0.13 0.00 -0.02 0.00 0.00 41.12 40.25 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 0.52 3.69 0.57 -2.24 1.04 -0.86 -4.79 113.70 111.63 1vgq s SER 57 Ca 0.69 1.99 0.32 0.00 0.48 0.00 0.00 55.95 59.43 1vgq s SER 57 Cb -0.60 -2.54 1.70 0.00 0.10 0.00 0.00 66.02 64.68 1vgq s SER 57 CO 0.46 -2.58 2.16 -0.07 0.98 0.00 0.00 173.24 174.18 1vgq h LEU 58 N -1.51 0.00 -0.03 2.42 3.38 -1.86 -1.29 115.31 116.42 1vgq h LEU 58 Ca -0.44 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.54 1vgq h LEU 58 Cb 1.25 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.00 1vgq h LEU 58 CO 0.47 0.06 0.00 0.22 0.09 0.00 0.00 178.44 179.28 1vgq h TYR 59 N 0.00 0.00 -0.03 1.13 -0.00 -1.83 -1.60 116.97 114.65 1vgq h TYR 59 Ca -0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 58.73 58.73 1vgq h TYR 59 Cb 0.23 0.00 -0.00 0.00 -0.00 0.00 0.00 36.73 36.96 1vgq h TYR 59 CO 0.00 -0.00 0.00 0.35 -0.00 0.00 0.00 178.16 178.51 1vgq h PHE 60 N 0.01 0.06 -0.38 -3.82 3.04 -1.47 -3.16 116.94 111.22 1vgq h PHE 60 Ca 0.01 -0.01 -0.07 0.00 3.98 0.00 0.00 57.97 61.88 1vgq h PHE 60 Cb 0.01 -0.02 -0.02 0.00 2.56 0.00 0.00 35.95 38.49 1vgq h PHE 60 CO -0.09 0.34 -0.07 1.79 -2.02 0.00 0.00 178.31 178.26 1vgq h THR 61 N -0.25 1.24 0.00 4.41 1.35 -1.22 -1.68 112.91 116.76 1vgq h THR 61 Ca 0.01 -1.03 0.00 0.00 -0.55 0.00 0.00 66.41 64.84 1vgq h THR 61 Cb 0.32 1.03 0.00 0.00 -1.73 0.00 0.00 68.15 67.77 1vgq h THR 61 CO 0.00 0.35 0.00 0.23 -0.25 0.00 0.00 175.52 175.85 1vgq n MET 62 N -4.20 0.12 -0.02 4.72 2.81 -0.61 -3.09 117.12 116.85 1vgq n MET 62 Ca 0.01 0.19 0.03 0.00 -1.81 0.00 0.00 57.70 56.13 1vgq n MET 62 Cb 0.32 -1.66 0.04 0.00 -0.71 0.00 0.00 33.22 31.20 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 -1.87 0.04 -1.91 2.03 3.01 -1.00 -4.76 117.46 113.00 1vgq n PHE 63 Ca 0.05 -0.08 0.02 0.00 1.01 0.00 0.00 57.45 58.45 1vgq n PHE 63 Cb 0.32 -0.01 0.03 0.00 -0.01 0.00 0.00 39.48 39.81 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 0.33 0.59 -4.72 4.37 3.02 -0.66 -4.43 115.26 113.75 1vgq n ASN 64 Ca 0.04 -2.24 -0.32 0.00 -0.03 0.00 0.00 54.58 52.03 1vgq n ASN 64 Cb 0.20 -0.26 0.12 0.00 -0.61 0.00 0.00 39.78 39.22 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 -3.52 -3.77 -3.97 0.00 4.13 -0.71 -4.73 115.26 102.71 1vgq n ASN 66 Ca 0.11 -0.74 -0.09 0.00 1.68 0.00 0.00 54.58 55.54 1vgq n ASN 66 Cb 0.52 -4.23 -0.10 0.00 -1.54 0.00 0.00 39.78 34.43 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 -6.28 0.47 0.20 3.52 1.02 -1.25 -4.43 119.74 112.99 1vgq s LYS 67 Ca 0.40 -0.73 0.06 0.00 0.02 0.00 0.00 55.97 55.73 1vgq s LYS 67 Cb -0.19 0.18 -0.04 0.00 -0.52 0.00 0.00 37.83 37.25 1vgq s LYS 67 CO 0.80 -0.10 0.13 1.03 -0.92 0.00 0.00 175.35 176.29 1vgq s ARG 68 N -2.21 2.81 -0.11 1.68 0.52 -0.65 -4.06 118.95 116.92 1vgq s ARG 68 Ca -0.09 -0.99 0.03 0.00 -0.52 0.00 0.00 55.73 54.16 1vgq s ARG 68 Cb -0.04 -2.55 0.01 0.00 0.52 0.00 0.00 34.95 32.89 1vgq s ARG 68 CO -0.03 0.45 -0.20 0.45 0.02 0.00 0.00 175.30 175.99 1vgq s SER 69 N -3.35 2.77 -0.07 0.23 0.15 -1.26 0.03 113.70 112.19 1vgq s SER 69 Ca 0.31 -0.51 0.05 0.00 0.70 0.00 0.00 55.95 56.50 1vgq s SER 69 Cb -0.09 -1.27 -0.01 0.00 -1.71 0.00 0.00 66.02 62.95 1vgq s SER 69 CO 0.23 0.08 -0.24 -0.51 1.20 0.00 0.00 173.24 174.00 1vgq s ILE 70 N 0.71 2.02 0.08 6.45 2.07 -0.69 -1.21 121.20 130.62 1vgq s ILE 70 Ca -0.11 -1.03 -0.26 0.00 -1.41 0.00 0.00 60.65 57.84 1vgq s ILE 70 Cb -0.16 -1.72 -0.06 0.00 0.13 0.00 0.00 42.46 40.65 1vgq s ILE 70 CO 0.02 0.56 0.81 -1.61 -1.91 0.00 0.00 174.94 172.80 1vgq s GLU 71 N 0.04 4.55 -0.15 3.50 2.02 -1.26 -1.43 118.70 125.97 1vgq s GLU 71 Ca -0.09 1.16 -0.08 0.00 0.02 0.00 0.00 54.97 55.97 1vgq s GLU 71 Cb -0.15 -3.35 0.06 0.00 0.10 0.00 0.00 34.13 30.78 1vgq s GLU 71 CO 0.06 0.31 0.37 -1.17 0.02 0.00 0.00 175.26 174.84 1vgq s LEU 72 N -0.21 0.05 -0.58 1.80 2.96 -0.36 -4.46 118.68 117.88 1vgq s LEU 72 Ca 0.40 0.79 -0.19 0.00 -0.22 0.00 0.00 54.13 54.91 1vgq s LEU 72 Cb -0.21 1.18 0.10 0.00 0.50 0.00 0.00 46.19 47.76 1vgq s LEU 72 CO 0.25 -0.19 0.70 -0.62 -1.32 0.00 0.00 176.35 175.17 1vgq s ASP 73 N 1.35 6.19 0.00 3.68 -1.08 -0.58 -4.12 116.67 122.10 1vgq s ASP 73 Ca -0.09 -1.39 0.28 0.00 -0.52 0.00 0.00 52.55 50.82 1vgq s ASP 73 Cb -0.09 -2.30 1.40 0.00 -1.46 0.00 0.00 42.92 40.48 1vgq s ASP 73 CO -0.12 -1.09 1.96 0.23 0.52 0.00 0.00 175.17 176.67 1vgq n MET 74 N 6.31 0.38 0.22 4.34 2.81 -1.26 -2.89 117.12 127.03 1vgq n MET 74 Ca -0.09 0.02 0.13 0.00 -1.81 0.00 0.00 57.70 55.94 1vgq n MET 74 Cb 0.43 -1.50 0.25 0.00 -0.71 0.00 0.00 33.22 31.68 1vgq n MET 74 CO 0.00 0.00 0.00 0.87 1.51 0.00 0.00 175.97 178.35 1vgq h LYS 75 N 0.00 0.00 -7.08 0.03 1.57 -1.96 -3.40 116.57 105.72 1vgq h LYS 75 Ca 0.00 0.00 -0.47 0.00 -1.87 0.00 0.00 60.65 58.31 1vgq h LYS 75 Cb 0.27 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.59 1vgq h LYS 75 CO 0.00 0.00 0.30 0.95 -0.57 0.00 0.00 179.45 180.13 1vgq s THR 76 N -3.25 4.57 0.24 -0.16 -4.23 -1.14 -4.99 115.64 106.68 1vgq s THR 76 Ca 0.07 1.12 0.15 0.00 -1.18 0.00 0.00 61.69 61.85 1vgq s THR 76 Cb 0.06 -3.70 0.07 0.00 1.34 0.00 0.00 72.50 70.27 1vgq s THR 76 CO 0.65 -0.58 1.71 1.55 -0.54 0.00 0.00 174.62 177.40 1vgq h PRO 77 N 1.19 0.00 -0.02 3.99 0.13 -1.88 -2.88 132.00 132.52 1vgq h PRO 77 Ca -0.47 0.00 -0.13 0.00 -0.87 0.00 0.00 66.00 64.53 1vgq h PRO 77 Cb 1.18 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.30 1vgq h PRO 77 CO 0.62 0.46 -0.59 0.93 -0.23 0.00 0.00 178.00 179.19 1vgq h GLU 78 N 0.00 0.08 -0.46 0.86 3.07 -1.94 -2.46 114.58 113.73 1vgq h GLU 78 Ca -0.00 -0.05 -0.12 0.00 -0.50 0.00 0.00 59.36 58.68 1vgq h GLU 78 Cb 0.93 0.01 -0.01 0.00 -0.84 0.00 0.00 28.75 28.83 1vgq h GLU 78 CO 0.06 0.65 -0.21 0.78 -1.40 0.00 0.00 179.01 178.89 1vgq h GLY 79 N 1.67 1.00 1.04 -3.84 0.00 -1.71 -2.36 103.07 98.87 1vgq h GLY 79 Ca -0.01 -0.86 -0.04 0.00 0.00 0.00 0.00 47.33 46.42 1vgq h GLY 79 CO 0.08 0.78 0.33 0.50 0.00 0.00 0.00 176.54 178.24 1vgq h LYS 80 N 0.80 1.17 -0.72 4.80 1.57 -1.40 -1.22 116.57 121.56 1vgq h LYS 80 Ca 0.11 -0.20 -0.02 0.00 -1.87 0.00 0.00 60.65 58.67 1vgq h LYS 80 Cb 0.76 -0.20 -0.03 0.00 0.08 0.00 0.00 32.23 32.84 1vgq h LYS 80 CO 0.06 0.94 0.39 0.93 -0.57 0.00 0.00 179.45 181.20 1vgq h GLU 81 N 1.14 1.01 -0.46 3.15 5.08 -1.32 -1.94 114.58 121.24 1vgq h GLU 81 Ca 0.27 -0.13 -0.05 0.00 -1.00 0.00 0.00 59.36 58.45 1vgq h GLU 81 Cb 0.19 -0.20 -0.02 0.00 0.50 0.00 0.00 28.75 29.23 1vgq h GLU 81 CO -0.02 0.77 0.09 -0.07 -1.00 0.00 0.00 179.01 178.77 1vgq h LEU 82 N 1.00 0.72 -0.85 1.33 4.07 -1.17 -2.38 115.31 118.04 1vgq h LEU 82 Ca 0.25 -0.25 0.05 0.00 0.08 0.00 0.00 57.88 58.01 1vgq h LEU 82 Cb 0.05 -0.19 -0.06 0.00 1.08 0.00 0.00 40.66 41.55 1vgq h LEU 82 CO -0.04 0.79 0.53 -0.07 -1.08 0.00 0.00 178.44 178.57 1vgq h LEU 83 N 0.63 0.86 -0.67 1.67 3.38 -1.01 -0.96 115.31 119.20 1vgq h LEU 83 Ca 0.14 0.01 -0.04 0.00 0.09 0.00 0.00 57.88 58.08 1vgq h LEU 83 Cb 0.36 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.91 1vgq h LEU 83 CO 0.01 0.57 0.25 -0.33 0.09 0.00 0.00 178.44 179.02 1vgq h GLU 84 N 1.00 1.02 -0.76 1.13 5.08 -1.11 0.88 114.58 121.82 1vgq h GLU 84 Ca 0.36 -0.20 -0.04 0.00 -1.00 0.00 0.00 59.36 58.48 1vgq h GLU 84 Cb 0.10 -0.16 -0.03 0.00 0.50 0.00 0.00 28.75 29.16 1vgq h GLU 84 CO -0.15 0.86 0.31 1.96 -1.00 0.00 0.00 179.01 180.99 1vgq h GLN 85 N 0.96 1.12 -0.13 2.33 4.20 -0.90 -2.63 115.11 120.05 1vgq h GLN 85 Ca 0.22 -0.19 -0.17 0.00 0.06 0.00 0.00 58.65 58.57 1vgq h GLN 85 Cb 0.24 -0.19 -0.01 0.00 0.30 0.00 0.00 27.48 27.83 1vgq h GLN 85 CO -0.01 0.90 -0.64 0.52 -0.67 0.00 0.00 178.83 178.93 1vgq h MET 86 N 1.10 0.48 -0.28 1.46 2.86 -0.67 -3.03 114.93 116.85 1vgq h MET 86 Ca 0.25 -0.34 -0.06 0.00 -2.06 0.00 0.00 59.70 57.49 1vgq h MET 86 Cb 0.19 0.06 -0.02 0.00 0.06 0.00 0.00 31.60 31.89 1vgq h MET 86 CO -0.02 0.96 -0.09 0.82 1.06 0.00 0.00 176.91 179.64 1vgq h ILE 87 N 0.35 1.21 0.00 -1.22 2.04 -0.71 -2.20 117.51 116.98 1vgq h ILE 87 Ca -0.01 -0.91 -0.01 0.00 1.00 0.00 0.00 64.86 64.93 1vgq h ILE 87 Cb 1.19 1.09 -0.00 0.00 -0.74 0.00 0.00 36.82 38.36 1vgq h ILE 87 CO 0.11 0.30 -0.04 0.11 0.00 0.00 0.00 178.15 178.63 1vgq h LYS 88 N 0.43 0.00 -0.01 2.37 1.57 -1.34 -2.92 116.57 116.67 1vgq h LYS 88 Ca 0.09 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.87 1vgq h LYS 88 Cb 0.42 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.73 1vgq h LYS 88 CO 0.02 0.04 -0.65 1.63 -0.57 0.00 0.00 179.45 179.92 1vgq n LYS 89 N -3.16 0.84 -3.51 3.15 5.02 -0.88 -5.00 118.16 114.64 1vgq n LYS 89 Ca 0.00 -0.64 -0.35 0.00 -2.02 0.00 0.00 58.31 55.30 1vgq n LYS 89 Cb 0.33 -1.47 -0.06 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 -2.63 3.68 0.00 7.82 0.00 -0.92 -4.78 121.76 124.93 1vgq s ALA 90 Ca 0.14 -0.29 0.07 0.00 0.00 0.00 0.00 51.96 51.88 1vgq s ALA 90 Cb 0.17 -2.35 -0.24 0.00 0.00 0.00 0.00 23.12 20.70 1vgq s ALA 90 CO 0.67 0.53 0.83 -0.44 0.00 0.00 0.00 175.76 177.35 1vgq h ASP 91 N 3.77 0.09 -3.98 0.00 3.32 -1.32 -3.41 116.42 114.89 1vgq h ASP 91 Ca -0.49 -0.15 -0.14 0.00 0.02 0.00 0.00 57.03 56.26 1vgq h ASP 91 Cb 1.20 -0.03 -0.24 0.00 0.22 0.00 0.00 39.33 40.47 1vgq h ASP 91 CO 0.66 1.13 -0.34 0.54 -1.72 0.00 0.00 179.24 179.51 1vgq s VAL 92 N -2.63 0.01 -0.11 -1.35 0.11 -0.94 -1.73 120.40 113.76 1vgq s VAL 92 Ca -0.05 -0.06 0.00 0.00 -2.93 0.00 0.00 61.98 58.94 1vgq s VAL 92 Cb 0.08 -0.46 -0.02 0.00 -1.53 0.00 0.00 36.38 34.45 1vgq s VAL 92 CO 0.83 -0.03 -0.12 -0.32 -3.33 0.00 0.00 175.10 172.12 1vgq s MET 93 N -0.01 3.23 -0.07 1.54 1.75 0.47 -0.51 119.30 125.69 1vgq s MET 93 Ca -0.02 -0.67 0.03 0.00 -1.25 0.00 0.00 55.69 53.79 1vgq s MET 93 Cb -0.03 -2.61 0.01 0.00 2.84 0.00 0.00 34.83 35.04 1vgq s MET 93 CO 0.01 0.31 -0.17 0.08 -0.65 0.00 0.00 175.02 174.60 1vgq s VAL 94 N 0.11 1.47 -0.01 10.11 1.01 -0.40 -0.47 120.40 132.22 1vgq s VAL 94 Ca -0.05 -0.68 -0.01 0.00 0.00 0.00 0.00 61.98 61.23 1vgq s VAL 94 Cb -0.15 -1.30 0.00 0.00 0.00 0.00 0.00 36.38 34.93 1vgq s VAL 94 CO 0.04 0.43 0.03 -1.83 0.00 0.00 0.00 175.10 173.77 1vgq s GLU 95 N 0.50 0.09 -0.31 2.72 4.04 -0.47 -0.78 118.70 124.50 1vgq s GLU 95 Ca -0.15 -0.05 0.17 0.00 0.04 0.00 0.00 54.97 54.97 1vgq s GLU 95 Cb -0.16 0.04 0.47 0.00 0.02 0.00 0.00 34.13 34.50 1vgq s GLU 95 CO 0.05 -0.01 1.05 0.27 -1.84 0.00 0.00 175.26 174.78 1vgq n ASN 96 N 2.82 2.26 -4.30 0.83 6.94 -1.26 -1.88 115.26 120.68 1vgq n ASN 96 Ca -0.14 -2.71 -0.30 0.00 -0.02 0.00 0.00 54.58 51.42 1vgq n ASN 96 Cb 0.59 -0.48 0.18 0.00 -2.36 0.00 0.00 39.78 37.70 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 -3.46 1.71 0.90 -2.53 2.99 -1.26 -4.71 117.98 111.62 1vgq s PHE 97 Ca 0.32 0.53 -0.10 0.00 0.00 0.00 0.00 56.93 57.68 1vgq s PHE 97 Cb 0.40 -3.73 0.14 0.00 0.00 0.00 0.00 43.02 39.83 1vgq s PHE 97 CO -0.02 -2.76 1.14 0.20 -0.00 0.00 0.00 175.22 173.78 1vgq s GLY 98 N -4.43 1.68 0.14 4.36 0.00 -1.26 -4.88 107.32 102.93 1vgq s GLY 98 Ca 0.70 0.54 -0.35 0.00 0.00 0.00 0.00 44.72 45.60 1vgq s GLY 98 CO 0.53 0.95 1.48 -1.05 0.00 0.00 0.00 173.10 175.01 1vgq n PRO 99 N -4.16 1.78 -0.52 2.90 -0.02 -1.26 -2.21 135.00 131.50 1vgq n PRO 99 Ca 0.11 0.64 0.00 0.00 -2.02 0.00 0.00 63.50 62.23 1vgq n PRO 99 Cb 0.52 -2.36 0.00 0.00 -0.02 0.00 0.00 33.50 31.64 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 3.03 1.76 0.13 -1.23 0.00 -1.26 -4.93 105.19 102.68 1vgq n GLY 100 Ca 0.17 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.06 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 -0.24 -0.85 4.61 0.00 -1.78 -1.37 119.26 119.62 1vgq h ALA 101 Ca 0.00 -0.08 0.04 0.00 0.00 0.00 0.00 54.91 54.87 1vgq h ALA 101 Cb 0.00 0.09 -0.05 0.00 0.00 0.00 0.00 17.79 17.83 1vgq h ALA 101 CO 0.00 -0.60 0.55 1.25 0.00 0.00 0.00 179.25 180.45 1vgq h LEU 102 N -0.31 0.90 -0.89 0.00 6.46 -1.89 -2.54 115.31 117.04 1vgq h LEU 102 Ca -0.02 -0.00 0.06 0.00 -0.12 0.00 0.00 57.88 57.79 1vgq h LEU 102 Cb 0.24 -0.20 -0.06 0.00 -0.73 0.00 0.00 40.66 39.91 1vgq h LEU 102 CO 0.04 0.61 0.56 0.44 -0.62 0.00 0.00 178.44 179.47 1vgq h ASP 103 N 1.05 0.89 0.46 1.25 3.45 -1.62 -2.31 116.42 119.59 1vgq h ASP 103 Ca 0.35 0.01 -0.08 0.00 0.43 0.00 0.00 57.03 57.73 1vgq h ASP 103 Cb 0.04 -0.17 -0.01 0.00 -0.56 0.00 0.00 39.33 38.62 1vgq h ASP 103 CO -0.13 0.57 -0.40 0.03 -1.57 0.00 0.00 179.24 177.74 1vgq h ARG 104 N 1.02 0.00 0.00 3.56 3.08 -0.85 -1.92 114.38 119.27 1vgq h ARG 104 Ca 0.38 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.43 1vgq h ARG 104 Cb 0.15 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.20 1vgq h ARG 104 CO -0.17 0.40 0.00 -1.33 -1.07 0.00 0.00 179.97 177.81 1vgq n MET 105 N -3.96 0.36 -0.04 0.04 2.81 -0.98 -4.86 117.12 110.50 1vgq n MET 105 Ca -0.02 0.08 0.00 0.00 -1.81 0.00 0.00 57.70 55.95 1vgq n MET 105 Cb 0.45 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.46 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 0.34 0.66 2.70 3.03 0.00 -0.72 -5.02 105.19 106.18 1vgq n GLY 106 Ca 0.11 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.79 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 -2.01 3.11 -1.34 1.61 3.72 -0.91 -4.88 117.46 116.76 1vgq n PHE 107 Ca 0.00 -3.44 -0.29 0.00 -0.05 0.00 0.00 57.45 53.67 1vgq n PHE 107 Cb 0.00 -0.85 0.13 0.00 -0.94 0.00 0.00 39.48 37.82 1vgq n PHE 107 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 176.76 177.66 1vgq s THR 108 N -2.94 2.56 0.23 4.37 -4.23 -1.26 -4.02 115.64 110.36 1vgq s THR 108 Ca 0.37 0.18 -0.06 0.00 -1.18 0.00 0.00 61.69 61.00 1vgq s THR 108 Cb 0.13 -2.78 0.20 0.00 1.34 0.00 0.00 72.50 71.39 1vgq s THR 108 CO 0.01 -0.24 1.84 -0.25 -0.54 0.00 0.00 174.62 175.44 1vgq h TRP 109 N -1.48 0.91 -0.78 3.99 -0.00 -1.97 -1.92 115.95 114.69 1vgq h TRP 109 Ca -0.50 0.03 -0.03 0.00 -0.00 0.00 0.00 58.89 58.38 1vgq h TRP 109 Cb 1.30 -0.29 -0.04 0.00 -0.00 0.00 0.00 29.16 30.13 1vgq h TRP 109 CO 0.39 0.46 0.36 1.05 -0.00 0.00 0.00 178.44 180.69 1vgq h GLU 110 N 0.90 1.14 -0.15 2.65 4.11 -1.99 -1.95 114.58 119.28 1vgq h GLU 110 Ca 0.36 -0.18 -0.16 0.00 0.07 0.00 0.00 59.36 59.45 1vgq h GLU 110 Cb 0.17 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 29.22 1vgq h GLU 110 CO -0.17 0.89 -0.58 -0.92 0.07 0.00 0.00 179.01 178.30 1vgq h TYR 111 N 1.11 0.62 -0.39 2.06 3.20 -1.83 -2.98 116.97 118.76 1vgq h TYR 111 Ca 0.27 -0.23 -0.08 0.00 3.14 0.00 0.00 58.73 61.83 1vgq h TYR 111 Cb 0.15 -0.11 -0.02 0.00 1.54 0.00 0.00 36.73 38.28 1vgq h TYR 111 CO 0.01 0.95 -0.08 0.82 -1.64 0.00 0.00 178.16 178.22 1vgq h ILE 112 N 0.37 1.24 -0.64 1.81 2.04 -1.11 -2.53 117.51 118.69 1vgq h ILE 112 Ca 0.00 -1.04 -0.06 0.00 1.00 0.00 0.00 64.86 64.77 1vgq h ILE 112 Cb 1.12 1.03 -0.03 0.00 -0.74 0.00 0.00 36.82 38.20 1vgq h ILE 112 CO 0.10 0.35 0.18 1.56 0.00 0.00 0.00 178.15 180.34 1vgq h GLN 113 N 0.61 0.99 -0.35 2.37 4.20 -1.26 -0.86 115.11 120.81 1vgq h GLN 113 Ca 0.11 -0.21 -0.00 0.00 0.06 0.00 0.00 58.65 58.61 1vgq h GLN 113 Cb 0.49 -0.15 -0.02 0.00 0.30 0.00 0.00 27.48 28.11 1vgq h GLN 113 CO 0.03 0.87 0.21 0.93 -0.67 0.00 0.00 178.83 180.20 1vgq h GLU 114 N 0.96 0.47 -0.54 1.46 5.08 -1.36 -2.27 114.58 118.37 1vgq h GLU 114 Ca 0.21 -0.04 -0.06 0.00 -1.00 0.00 0.00 59.36 58.47 1vgq h GLU 114 Cb 0.31 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.44 1vgq h GLU 114 CO -0.00 0.35 0.11 -0.07 -1.00 0.00 0.00 179.01 178.40 1vgq h LEU 115 N 0.45 0.84 -6.37 1.33 3.38 -1.03 -3.41 115.31 110.50 1vgq h LEU 115 Ca 0.12 -0.25 -0.26 0.00 0.09 0.00 0.00 57.88 57.59 1vgq h LEU 115 Cb 0.00 -0.22 -0.30 0.00 0.09 0.00 0.00 40.66 40.23 1vgq h LEU 115 CO -0.02 0.87 -0.59 0.21 0.09 0.00 0.00 178.44 178.99 1vgq s ASN 116 N -6.24 0.86 0.00 -0.43 3.84 -0.37 -4.72 114.94 107.89 1vgq s ASN 116 Ca -0.13 -0.75 0.09 0.00 0.21 0.00 0.00 52.86 52.28 1vgq s ASN 116 Cb 0.12 0.85 0.45 0.00 -0.55 0.00 0.00 41.25 42.12 1vgq s ASN 116 CO 0.81 -0.34 1.16 -0.81 -2.79 0.00 0.00 177.10 175.13 1vgq n PRO 117 N 5.09 0.13 0.03 0.43 -0.04 -0.86 -2.47 135.00 137.30 1vgq n PRO 117 Ca 0.02 0.20 0.11 0.00 -0.04 0.00 0.00 63.50 63.79 1vgq n PRO 117 Cb 0.48 -1.50 -0.07 0.00 -0.04 0.00 0.00 33.50 32.37 1vgq n PRO 117 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1vgq n ARG 118 N -1.28 0.50 -2.62 0.54 1.74 -1.26 -1.54 116.66 112.74 1vgq n ARG 118 Ca 0.04 -0.05 -0.37 0.00 -0.77 0.00 0.00 57.85 56.70 1vgq n ARG 118 Cb 0.07 -1.62 -0.05 0.00 -1.02 0.00 0.00 32.46 29.84 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 -3.35 3.86 -0.23 1.55 0.11 -1.03 -3.69 120.40 117.61 1vgq s VAL 119 Ca -0.02 1.52 -0.08 0.00 -2.93 0.00 0.00 61.98 60.47 1vgq s VAL 119 Cb 0.13 -3.83 -0.04 0.00 -1.53 0.00 0.00 36.38 31.11 1vgq s VAL 119 CO 0.85 0.10 0.10 -0.63 -3.33 0.00 0.00 175.10 172.19 1vgq s ILE 120 N -1.58 4.80 -0.17 7.04 1.01 -0.70 -3.88 121.20 127.72 1vgq s ILE 120 Ca 0.53 -0.01 -0.15 0.00 0.00 0.00 0.00 60.65 61.02 1vgq s ILE 120 Cb -0.22 -3.22 -0.04 0.00 0.01 0.00 0.00 42.46 38.98 1vgq s ILE 120 CO 0.28 0.37 0.34 -0.22 0.00 0.00 0.00 174.94 175.71 1vgq s LEU 121 N 1.12 4.21 -0.09 2.97 2.96 -0.84 -0.40 118.68 128.61 1vgq s LEU 121 Ca 0.05 0.52 0.02 0.00 -0.22 0.00 0.00 54.13 54.50 1vgq s LEU 121 Cb -0.14 -2.44 0.01 0.00 0.50 0.00 0.00 46.19 44.12 1vgq s LEU 121 CO 0.04 0.02 -0.13 0.00 -1.32 0.00 0.00 176.35 174.96 1vgq s ALA 122 N 0.81 1.46 -0.01 5.97 0.00 0.38 -0.32 121.76 130.05 1vgq s ALA 122 Ca 0.18 -0.57 0.03 0.00 0.00 0.00 0.00 51.96 51.60 1vgq s ALA 122 Cb -0.14 -0.72 -0.00 0.00 0.00 0.00 0.00 23.12 22.26 1vgq s ALA 122 CO 0.06 -0.03 -0.09 0.45 0.00 0.00 0.00 175.76 176.15 1vgq s SER 123 N 0.93 1.08 -0.14 0.00 0.15 -0.13 -1.36 113.70 114.23 1vgq s SER 123 Ca -0.09 -0.17 -0.04 0.00 0.70 0.00 0.00 55.95 56.36 1vgq s SER 123 Cb -0.15 -0.19 -0.03 0.00 -1.71 0.00 0.00 66.02 63.94 1vgq s SER 123 CO 0.00 0.09 -0.02 -0.69 1.20 0.00 0.00 173.24 173.82 1vgq s VAL 124 N -0.04 4.09 0.21 4.45 1.01 -0.79 -1.04 120.40 128.29 1vgq s VAL 124 Ca 0.01 -0.30 0.02 0.00 0.00 0.00 0.00 61.98 61.71 1vgq s VAL 124 Cb -0.05 -2.78 -0.05 0.00 0.00 0.00 0.00 36.38 33.50 1vgq s VAL 124 CO -0.00 0.52 0.04 -0.54 0.00 0.00 0.00 175.10 175.11 1vgq s LYS 125 N 0.04 1.24 0.09 2.72 -0.14 -0.88 -4.50 119.74 118.32 1vgq s LYS 125 Ca 0.01 -1.63 -0.17 0.00 -1.36 0.00 0.00 55.97 52.82 1vgq s LYS 125 Cb -0.13 -0.29 -0.07 0.00 -1.68 0.00 0.00 37.83 35.66 1vgq s LYS 125 CO 0.02 -0.19 1.50 0.78 -0.76 0.00 0.00 175.35 176.70 1vgq h GLY 126 N 2.56 0.60 -2.86 -3.33 0.00 -1.88 0.96 103.07 99.13 1vgq h GLY 126 Ca -0.37 -0.49 -0.43 0.00 0.00 0.00 0.00 47.33 46.03 1vgq h GLY 126 CO 0.62 0.45 -0.74 -0.19 0.00 0.00 0.00 176.54 176.68 1vgq s TYR 127 N -4.80 1.61 0.58 5.60 1.51 -1.26 -2.01 117.35 118.58 1vgq s TYR 127 Ca -0.13 -0.58 -0.17 0.00 -1.01 0.00 0.00 57.07 55.17 1vgq s TYR 127 Cb 0.08 -0.78 -0.04 0.00 -0.11 0.00 0.00 41.96 41.11 1vgq s TYR 127 CO 0.77 0.28 1.07 0.00 -1.11 0.00 0.00 175.55 176.56 1vgq s ALA 128 N -2.77 2.72 0.12 3.71 0.00 -1.26 -4.76 121.76 119.51 1vgq s ALA 128 Ca 0.19 0.51 -0.31 0.00 0.00 0.00 0.00 51.96 52.34 1vgq s ALA 128 Cb -0.02 -3.26 -0.10 0.00 0.00 0.00 0.00 23.12 19.75 1vgq s ALA 128 CO 0.05 -0.78 1.69 -2.00 0.00 0.00 0.00 175.76 174.73 1vgq s GLU 129 N -3.82 4.18 0.00 0.00 2.12 -1.26 -2.12 118.70 117.79 1vgq s GLU 129 Ca 0.66 2.44 0.00 0.00 0.36 0.00 0.00 54.97 58.43 1vgq s GLU 129 Cb -0.18 -3.46 0.00 0.00 0.26 0.00 0.00 34.13 30.75 1vgq s GLU 129 CO 0.33 -0.74 0.00 0.41 -0.54 0.00 0.00 175.26 174.72 1vgq n GLY 130 N 4.02 1.30 3.79 -1.50 0.00 -1.26 -5.09 105.19 106.45 1vgq n GLY 130 Ca 0.16 0.00 -0.36 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 -2.20 3.51 0.36 1.61 5.04 -0.90 -4.96 115.29 117.76 1vgq s HIS 131 Ca 0.00 1.71 0.12 0.00 -1.54 0.00 0.00 55.06 55.35 1vgq s HIS 131 Cb 0.00 -2.93 0.92 0.00 0.04 0.00 0.00 32.58 30.61 1vgq s HIS 131 CO 0.00 -0.00 1.80 0.00 -2.34 0.00 0.00 174.74 174.20 1vgq h ALA 132 N 2.68 1.95 -0.52 1.58 0.00 -1.98 -0.58 119.26 122.40 1vgq h ALA 132 Ca -0.48 0.05 -0.09 0.00 0.00 0.00 0.00 54.91 54.40 1vgq h ALA 132 Cb 1.19 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 18.88 1vgq h ALA 132 CO 0.63 -0.30 0.11 0.09 0.00 0.00 0.00 179.25 179.79 1vgq n ASN 133 N -4.65 4.45 -0.26 0.00 3.02 -1.26 -4.63 115.26 111.93 1vgq n ASN 133 Ca 0.22 -2.84 0.25 0.00 -0.03 0.00 0.00 54.58 52.19 1vgq n ASN 133 Cb 0.67 -0.67 0.61 0.00 -0.61 0.00 0.00 39.78 39.78 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 2.59 0.21 -0.08 3.52 4.81 -1.31 -2.50 114.58 121.83 1vgq h GLU 134 Ca 0.11 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.33 1vgq h GLU 134 Cb 1.84 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 31.17 1vgq h GLU 134 CO 0.49 0.14 0.00 0.72 -0.73 0.00 0.00 179.01 179.63 1vgq n HIS 135 N -4.42 0.08 -2.84 0.92 8.25 -1.26 -4.67 115.22 111.28 1vgq n HIS 135 Ca 0.22 -0.04 -0.39 0.00 -0.26 0.00 0.00 57.72 57.24 1vgq n HIS 135 Cb 0.91 0.00 -0.06 0.00 1.12 0.00 0.00 29.99 31.96 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 -1.89 4.59 0.17 2.41 1.43 -0.94 -4.70 118.68 119.76 1vgq s LEU 136 Ca 0.34 1.82 -0.28 0.00 -1.03 0.00 0.00 54.13 54.99 1vgq s LEU 136 Cb 0.20 -3.55 -0.08 0.00 0.03 0.00 0.00 46.19 42.80 1vgq s LEU 136 CO 0.31 0.15 0.86 -0.54 0.23 0.00 0.00 176.35 177.36 1vgq s LYS 137 N -1.28 4.68 -0.02 1.70 1.02 -1.26 -4.42 119.74 120.16 1vgq s LYS 137 Ca 0.40 1.31 -0.04 0.00 0.02 0.00 0.00 55.97 57.66 1vgq s LYS 137 Cb -0.24 -3.29 0.00 0.00 -0.52 0.00 0.00 37.83 33.78 1vgq s LYS 137 CO 0.29 0.48 0.10 0.14 -0.92 0.00 0.00 175.35 175.44 1vgq s VAL 138 N -0.91 0.04 0.40 3.17 -7.23 -1.26 -5.03 120.40 109.58 1vgq s VAL 138 Ca 0.39 -0.34 0.08 0.00 -1.81 0.00 0.00 61.98 60.30 1vgq s VAL 138 Cb -0.24 -0.26 -0.04 0.00 0.56 0.00 0.00 36.38 36.40 1vgq s VAL 138 CO 0.28 -0.19 0.25 -0.31 -0.31 0.00 0.00 175.10 174.82 1vgq s TYR 139 N -0.60 2.68 0.00 2.82 2.02 -1.26 -4.87 117.35 118.14 1vgq s TYR 139 Ca -0.07 -0.50 0.00 0.00 -0.37 0.00 0.00 57.07 56.13 1vgq s TYR 139 Cb -0.04 -1.96 0.00 0.00 -0.40 0.00 0.00 41.96 39.56 1vgq s TYR 139 CO 0.00 0.11 0.05 -1.91 -1.57 0.00 0.00 175.55 172.23 1vgq n GLU 140 N -1.33 0.00 0.16 -0.62 4.07 -1.26 -1.86 120.64 119.80 1vgq n GLU 140 Ca 0.00 0.05 0.02 0.00 -0.06 0.00 0.00 57.16 57.17 1vgq n GLU 140 Cb 0.63 -0.08 0.26 0.00 -0.06 0.00 0.00 31.44 32.19 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 -0.71 4.31 2.35 -1.97 -2.05 115.58 117.51 1vgq h ASN 141 Ca 0.00 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 55.73 1vgq h ASN 141 Cb 0.00 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.34 1vgq h ASN 141 CO 0.00 0.50 0.38 0.58 -1.65 0.00 0.00 177.43 177.24 1vgq h VAL 142 N 0.00 1.22 -0.58 2.81 2.07 -1.78 -1.27 116.25 118.72 1vgq h VAL 142 Ca -0.00 -0.58 -0.08 0.00 0.82 0.00 0.00 66.70 66.86 1vgq h VAL 142 Cb 0.98 0.30 -0.02 0.00 -1.52 0.00 0.00 31.29 31.03 1vgq h VAL 142 CO 0.06 0.25 0.06 0.00 0.02 0.00 0.00 177.57 177.96 1vgq h ALA 143 N 1.19 1.00 -0.87 1.67 0.00 -1.09 -0.01 119.26 121.15 1vgq h ALA 143 Ca 0.25 -0.27 0.01 0.00 0.00 0.00 0.00 54.91 54.90 1vgq h ALA 143 Cb 0.06 -0.23 -0.04 0.00 0.00 0.00 0.00 17.79 17.58 1vgq h ALA 143 CO -0.04 0.63 0.58 1.96 0.00 0.00 0.00 179.25 182.37 1vgq h GLN 144 N 0.90 1.14 -0.25 0.00 4.20 -1.06 -0.99 115.11 119.06 1vgq h GLN 144 Ca 0.18 -0.07 -0.14 0.00 0.06 0.00 0.00 58.65 58.68 1vgq h GLN 144 Cb 0.45 -0.26 -0.00 0.00 0.30 0.00 0.00 27.48 27.97 1vgq h GLN 144 CO 0.02 0.76 -0.39 0.00 -0.67 0.00 0.00 178.83 178.55 1vgq h SER 146 N 0.44 0.00 -0.24 0.00 4.64 -0.58 -3.21 113.55 114.59 1vgq h SER 146 Ca 0.02 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.34 1vgq h SER 146 Cb 0.98 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.07 1vgq h SER 146 CO 0.09 0.45 0.00 0.61 -0.87 0.00 0.00 176.83 177.11 1vgq n GLY 147 N -0.09 1.16 0.00 -0.77 0.00 -0.41 -4.96 105.19 100.12 1vgq n GLY 147 Ca -0.01 -0.65 0.00 0.00 0.00 0.00 0.00 46.02 45.36 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 1.38 0.23 0.17 -0.02 0.00 -1.21 -3.73 105.19 102.00 1vgq n GLY 148 Ca 0.18 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.08 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 0.36 -0.62 4.61 0.00 -1.73 -2.98 119.26 118.90 1vgq h ALA 149 Ca 0.00 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 54.61 1vgq h ALA 149 Cb 0.00 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.67 1vgq h ALA 149 CO 0.00 0.20 0.36 0.00 0.00 0.00 0.00 179.25 179.81 1vgq h ALA 150 N 0.75 0.79 0.00 0.00 0.00 -1.66 -1.23 119.26 117.91 1vgq h ALA 150 Ca 0.06 -0.09 -0.03 0.00 0.00 0.00 0.00 54.91 54.85 1vgq h ALA 150 Cb 0.59 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 18.12 1vgq h ALA 150 CO 0.03 0.29 -0.15 0.00 0.00 0.00 0.00 179.25 179.42 1vgq h ALA 151 N 1.18 1.71 -0.36 0.00 0.00 -1.84 -2.64 119.26 117.29 1vgq h ALA 151 Ca 0.22 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1vgq h ALA 151 Cb 0.01 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.78 1vgq h ALA 151 CO -0.04 0.19 0.00 0.25 0.00 0.00 0.00 179.25 179.65 1vgq n THR 152 N -4.29 1.31 -5.24 0.00 -2.24 -0.92 -3.96 114.28 98.94 1vgq n THR 152 Ca -0.02 -1.19 -0.32 0.00 -2.27 0.00 0.00 64.05 60.25 1vgq n THR 152 Cb 0.22 0.33 -0.16 0.00 -2.10 0.00 0.00 70.33 68.61 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 -1.42 2.10 0.00 4.28 2.01 -0.51 -4.53 115.64 117.57 1vgq s THR 153 Ca 0.30 -1.04 0.00 0.00 0.31 0.00 0.00 61.69 61.26 1vgq s THR 153 Cb 0.18 -1.77 0.00 0.00 0.01 0.00 0.00 72.50 70.92 1vgq s THR 153 CO 0.16 0.57 0.00 0.61 -0.69 0.00 0.00 174.62 175.26 1vgq n GLY 154 N 3.09 0.00 3.48 4.40 0.00 -1.26 -2.14 105.19 112.75 1vgq n GLY 154 Ca -0.18 -2.04 -0.27 0.00 0.00 0.00 0.00 46.02 43.53 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 2.42 0.52 1.61 0.40 -1.26 -1.10 117.98 120.57 1vgq s PHE 155 Ca 0.00 -0.31 0.31 0.00 -0.60 0.00 0.00 56.93 56.33 1vgq s PHE 155 Cb 0.00 -1.19 1.75 0.00 0.51 0.00 0.00 43.02 44.08 1vgq s PHE 155 CO 0.00 0.50 2.19 0.11 0.70 0.00 0.00 175.22 178.73 1vgq h TRP 156 N 3.10 0.00 -0.47 0.36 0.09 -1.94 -2.16 115.95 114.93 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 1.21 0.00 0.00 0.00 0.08 0.00 0.00 29.16 30.45 1vgq h TRP 156 CO 0.67 0.05 0.00 -0.40 0.09 0.00 0.00 178.44 178.85 1vgq n ASP 157 N -3.65 4.11 -1.74 0.11 5.75 -1.26 -4.80 116.55 115.06 1vgq n ASP 157 Ca -0.02 -2.50 -0.03 0.00 -0.01 0.00 0.00 54.79 52.23 1vgq n ASP 157 Cb 0.15 -0.49 -0.01 0.00 -1.03 0.00 0.00 41.12 39.74 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 0.53 4.02 3.91 6.12 0.00 -0.81 -4.53 105.19 114.43 1vgq n GLY 158 Ca 0.21 -1.95 -0.28 0.00 0.00 0.00 0.00 46.02 44.00 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 -2.16 2.70 0.21 1.61 0.04 -1.26 -4.79 135.00 131.35 1vgq s PRO 159 Ca 0.02 0.08 -0.31 0.00 0.04 0.00 0.00 61.00 60.83 1vgq s PRO 159 Cb 0.00 -2.17 -0.15 0.00 0.04 0.00 0.00 34.50 32.22 1vgq s PRO 159 CO 0.01 -0.95 1.10 -2.30 0.04 0.00 0.00 177.00 174.90 1vgq n PRO 160 N -2.81 1.21 -4.90 0.56 -0.02 -1.26 -4.54 135.00 123.24 1vgq n PRO 160 Ca 0.06 0.43 -0.27 0.00 -2.02 0.00 0.00 63.50 61.70 1vgq n PRO 160 Cb 0.58 -1.87 -0.16 0.00 -0.02 0.00 0.00 33.50 32.03 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 -0.49 1.55 0.47 3.45 2.01 -0.91 -4.98 115.64 116.73 1vgq s THR 161 Ca 0.68 -0.76 -0.19 0.00 0.31 0.00 0.00 61.69 61.72 1vgq s THR 161 Cb -0.80 -1.34 -0.10 0.00 0.01 0.00 0.00 72.50 70.28 1vgq s THR 161 CO 0.55 0.44 0.97 0.68 -0.69 0.00 0.00 174.62 176.57 1vgq s VAL 162 N 0.15 4.39 0.13 3.82 -7.23 -1.26 -4.31 120.40 116.09 1vgq s VAL 162 Ca -0.07 1.36 -0.16 0.00 -1.81 0.00 0.00 61.98 61.30 1vgq s VAL 162 Cb -0.13 -3.63 -0.07 0.00 0.56 0.00 0.00 36.38 33.11 1vgq s VAL 162 CO 0.03 -0.45 0.57 -0.55 -0.31 0.00 0.00 175.10 174.39 1vgq s SER 163 N -2.49 6.90 0.39 4.85 0.15 -1.26 -4.98 113.70 117.26 1vgq s SER 163 Ca 0.61 1.15 0.08 0.00 0.70 0.00 0.00 55.95 58.50 1vgq s SER 163 Cb -0.10 -2.32 0.78 0.00 -1.71 0.00 0.00 66.02 62.68 1vgq s SER 163 CO 0.20 0.14 1.94 1.23 1.20 0.00 0.00 173.24 177.95 1vgq h GLY 164 N 3.80 0.35 -2.97 9.45 0.00 -2.06 -3.43 103.07 108.21 1vgq h GLY 164 Ca -0.49 -0.20 -0.52 0.00 0.00 0.00 0.00 47.33 46.13 1vgq h GLY 164 CO 0.65 0.18 0.53 0.00 0.00 0.00 0.00 176.54 177.90 1vgq s ALA 165 N -4.90 3.06 -1.40 3.60 0.00 -1.26 -4.91 121.76 115.95 1vgq s ALA 165 Ca -0.06 1.05 -0.13 0.00 0.00 0.00 0.00 51.96 52.82 1vgq s ALA 165 Cb 0.16 -3.42 0.08 0.00 0.00 0.00 0.00 23.12 19.93 1vgq s ALA 165 CO 0.74 -0.73 2.11 0.00 0.00 0.00 0.00 175.76 177.87 1vgq n ALA 166 N -0.27 5.44 0.24 0.00 0.00 -1.26 -4.72 120.51 119.93 1vgq n ALA 166 Ca 0.06 -4.01 0.07 0.00 0.00 0.00 0.00 53.44 49.55 1vgq n ALA 166 Cb 0.46 -3.37 0.58 0.00 0.00 0.00 0.00 19.45 17.12 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 9.40 0.02 0.10 0.00 3.38 -1.91 -1.96 115.31 124.34 1vgq h LEU 167 Ca 0.51 -0.00 -0.28 0.00 0.09 0.00 0.00 57.88 58.20 1vgq h LEU 167 Cb 0.64 -0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.38 1vgq h LEU 167 CO 1.80 0.09 -1.48 1.23 0.09 0.00 0.00 178.44 180.16 1vgq h GLY 168 N 0.24 0.24 0.00 0.83 0.00 -1.85 -3.38 103.07 99.15 1vgq h GLY 168 Ca 0.00 -0.62 0.00 0.00 0.00 0.00 0.00 47.33 46.72 1vgq h GLY 168 CO 0.01 0.54 0.00 0.00 0.00 0.00 0.00 176.54 177.09 1vgq n ALA 169 N -3.03 0.00 -0.26 3.60 0.00 -1.17 -3.34 120.51 116.31 1vgq n ALA 169 Ca -0.27 -0.07 0.05 0.00 0.00 0.00 0.00 53.44 53.15 1vgq n ALA 169 Cb 0.89 0.00 0.29 0.00 0.00 0.00 0.00 19.45 20.63 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 0.81 -0.68 0.00 0.02 -1.79 -1.49 113.55 110.42 1vgq h SER 170 Ca 0.00 0.01 -0.01 0.00 -0.84 0.00 0.00 61.79 60.95 1vgq h SER 170 Cb 0.00 -0.17 -0.03 0.00 0.14 0.00 0.00 62.40 62.34 1vgq h SER 170 CO 0.00 0.52 0.39 -1.13 -1.14 0.00 0.00 176.83 175.47 1vgq h ASN 171 N 0.92 0.83 -0.66 3.07 -1.24 -1.56 0.06 115.58 116.99 1vgq h ASN 171 Ca 0.36 -0.08 -0.02 0.00 0.71 0.00 0.00 56.30 57.27 1vgq h ASN 171 Cb 0.23 -0.21 -0.03 0.00 0.73 0.00 0.00 38.32 39.04 1vgq h ASN 171 CO -0.13 0.67 0.34 0.28 -1.29 0.00 0.00 177.43 177.30 1vgq h SER 172 N 0.93 0.85 -0.83 1.15 0.02 -1.31 -1.48 113.55 112.88 1vgq h SER 172 Ca 0.24 -0.12 0.00 0.00 -0.84 0.00 0.00 61.79 61.08 1vgq h SER 172 Cb 0.01 -0.22 -0.04 0.00 0.14 0.00 0.00 62.40 62.29 1vgq h SER 172 CO -0.04 0.73 0.53 1.23 -1.14 0.00 0.00 176.83 178.14 1vgq h GLY 173 N 0.91 1.18 1.08 -3.77 0.00 -0.65 0.22 103.07 102.05 1vgq h GLY 173 Ca 0.23 -0.46 -0.11 0.00 0.00 0.00 0.00 47.33 46.99 1vgq h GLY 173 CO -0.03 0.45 -0.09 -0.33 0.00 0.00 0.00 176.54 176.53 1vgq h MET 174 N 1.13 1.01 -0.77 4.80 2.07 -0.74 -1.21 114.93 121.22 1vgq h MET 174 Ca 0.30 -0.37 -0.02 0.00 -2.07 0.00 0.00 59.70 57.54 1vgq h MET 174 Cb -0.10 -0.07 -0.04 0.00 -1.87 0.00 0.00 31.60 29.53 1vgq h MET 174 CO -0.06 1.05 0.40 0.45 1.07 0.00 0.00 176.91 179.82 1vgq h HIS 175 N 0.89 1.09 -0.60 -0.22 3.86 -1.03 -2.26 115.15 116.87 1vgq h HIS 175 Ca 0.14 -0.04 -0.02 0.00 -1.16 0.00 0.00 60.37 59.29 1vgq h HIS 175 Cb 0.66 -0.34 -0.03 0.00 1.06 0.00 0.00 27.41 28.76 1vgq h HIS 175 CO 0.05 0.78 0.28 1.25 0.86 0.00 0.00 177.93 181.15 1vgq h LEU 176 N 1.08 0.77 -1.00 2.43 5.85 -0.67 -1.80 115.31 121.97 1vgq h LEU 176 Ca 0.27 -0.08 -0.01 0.00 0.84 0.00 0.00 57.88 58.90 1vgq h LEU 176 Cb 0.07 -0.20 -0.04 0.00 0.37 0.00 0.00 40.66 40.86 1vgq h LEU 176 CO -0.04 0.66 0.50 -0.03 -0.34 0.00 0.00 178.44 179.19 1vgq h MET 177 N 0.85 1.19 -0.45 1.25 4.05 -0.67 0.25 114.93 121.39 1vgq h MET 177 Ca 0.21 -0.12 0.02 0.00 -0.28 0.00 0.00 59.70 59.53 1vgq h MET 177 Cb 0.10 -0.24 -0.03 0.00 -0.80 0.00 0.00 31.60 30.63 1vgq h MET 177 CO -0.03 0.85 0.28 0.82 0.23 0.00 0.00 176.91 179.06 1vgq h ILE 178 N 1.21 1.06 -0.53 1.77 2.04 -0.88 -1.27 117.51 120.90 1vgq h ILE 178 Ca 0.31 -0.19 0.01 0.00 1.00 0.00 0.00 64.86 65.98 1vgq h ILE 178 Cb -0.01 0.46 -0.03 0.00 -0.74 0.00 0.00 36.82 36.50 1vgq h ILE 178 CO -0.05 0.10 0.35 1.23 0.00 0.00 0.00 178.15 179.78 1vgq h GLY 179 N 0.56 0.75 0.87 5.37 0.00 -0.32 0.43 103.07 110.72 1vgq h GLY 179 Ca 0.18 -0.28 -0.00 0.00 0.00 0.00 0.00 47.33 47.23 1vgq h GLY 179 CO -0.07 0.27 0.03 -2.22 0.00 0.00 0.00 176.54 174.55 1vgq h ILE 180 N 0.72 1.13 -0.46 2.60 2.04 -0.42 -0.87 117.51 122.25 1vgq h ILE 180 Ca 0.20 -0.39 -0.03 0.00 1.00 0.00 0.00 64.86 65.64 1vgq h ILE 180 Cb -0.08 1.25 -0.02 0.00 -0.74 0.00 0.00 36.82 37.23 1vgq h ILE 180 CO -0.04 0.11 0.17 -0.07 0.00 0.00 0.00 178.15 178.33 1vgq h LEU 181 N -0.02 0.60 -0.37 1.44 3.38 -1.05 -0.13 115.31 119.16 1vgq h LEU 181 Ca 0.03 -0.07 -0.03 0.00 0.09 0.00 0.00 57.88 57.89 1vgq h LEU 181 Cb 0.15 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.73 1vgq h LEU 181 CO -0.00 0.56 0.10 0.00 0.09 0.00 0.00 178.44 179.18 1vgq h ALA 182 N 1.54 0.49 -0.39 1.53 0.00 -0.69 -2.27 119.26 119.47 1vgq h ALA 182 Ca 0.16 -0.18 -0.04 0.00 0.00 0.00 0.00 54.91 54.85 1vgq h ALA 182 Cb 0.15 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 1vgq h ALA 182 CO -0.01 0.16 0.09 0.00 0.00 0.00 0.00 179.25 179.48 1vgq h ALA 183 N 0.94 1.43 -0.08 0.00 0.00 -0.47 -0.90 119.26 120.18 1vgq h ALA 183 Ca 0.12 -0.16 -0.09 0.00 0.00 0.00 0.00 54.91 54.78 1vgq h ALA 183 Cb 0.29 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 1vgq h ALA 183 CO -0.00 0.42 -0.35 -0.07 0.00 0.00 0.00 179.25 179.24 1vgq h LEU 184 N 0.56 0.15 -0.19 0.00 3.38 -0.86 -1.87 115.31 116.48 1vgq h LEU 184 Ca 0.13 -0.06 -0.17 0.00 0.09 0.00 0.00 57.88 57.87 1vgq h LEU 184 Cb 0.23 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 40.94 1vgq h LEU 184 CO -0.00 0.50 -0.56 -0.08 0.09 0.00 0.00 178.44 178.39 1vgq h GLU 185 N 0.13 0.72 -0.76 1.13 4.57 -0.72 -2.88 114.58 116.78 1vgq h GLU 185 Ca 0.02 -0.52 0.13 0.00 -1.18 0.00 0.00 59.36 57.81 1vgq h GLU 185 Cb 0.69 0.08 -0.09 0.00 -0.16 0.00 0.00 28.75 29.28 1vgq h GLU 185 CO 0.05 1.14 0.34 0.82 -1.18 0.00 0.00 179.01 180.18 1vgq h ILE 186 N 0.43 0.73 -0.22 2.32 2.04 -1.02 -3.00 117.51 118.78 1vgq h ILE 186 Ca -0.01 -0.18 -0.08 0.00 1.00 0.00 0.00 64.86 65.59 1vgq h ILE 186 Cb 1.18 0.16 -0.01 0.00 -0.74 0.00 0.00 36.82 37.41 1vgq h ILE 186 CO 0.12 0.09 -0.21 -0.09 0.00 0.00 0.00 178.15 178.07 1vgq h ARG 187 N 0.52 0.40 -0.33 2.37 2.43 -1.14 -0.90 114.38 117.73 1vgq h ARG 187 Ca 0.40 -0.13 0.09 0.00 -0.81 0.00 0.00 59.98 59.54 1vgq h ARG 187 Cb 0.55 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 30.05 1vgq h ARG 187 CO -0.35 0.59 0.24 0.45 -1.51 0.00 0.00 179.97 179.38 1vgq h HIS 188 N 0.36 0.01 0.07 2.20 3.86 -1.36 -0.18 115.15 120.11 1vgq h HIS 188 Ca 0.06 0.00 -0.35 0.00 -1.16 0.00 0.00 60.37 58.92 1vgq h HIS 188 Cb 0.57 -0.00 -0.04 0.00 1.06 0.00 0.00 27.41 29.00 1vgq h HIS 188 CO 0.02 0.00 -1.99 1.63 0.86 0.00 0.00 177.93 178.44 1vgq n LYS 189 N -4.44 0.71 -0.00 2.45 5.02 -0.42 -4.56 118.16 116.91 1vgq n LYS 189 Ca 0.05 0.24 0.07 0.00 -2.02 0.00 0.00 58.31 56.65 1vgq n LYS 189 Cb 0.41 -1.70 -0.09 0.00 -0.02 0.00 0.00 35.03 33.63 1vgq n LYS 189 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 1vgq n THR 190 N -3.28 0.00 -1.10 -0.18 -2.24 -0.72 -4.98 114.28 101.78 1vgq n THR 190 Ca -0.29 -0.16 -0.03 0.00 -2.27 0.00 0.00 64.05 61.30 1vgq n THR 190 Cb 1.05 0.95 -0.01 0.00 -2.10 0.00 0.00 70.33 70.22 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 1.37 0.36 3.35 3.38 0.00 -0.08 -4.98 105.19 108.58 1vgq n GLY 191 Ca 0.03 -0.01 -0.27 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 -2.16 1.30 0.47 1.61 1.81 -1.26 -4.60 118.95 116.12 1vgq s ARG 192 Ca 0.00 -1.29 -0.05 0.00 -1.72 0.00 0.00 55.73 52.67 1vgq s ARG 192 Cb 0.00 -1.69 -0.04 0.00 -0.45 0.00 0.00 34.95 32.77 1vgq s ARG 192 CO 0.00 0.40 0.77 0.20 -0.68 0.00 0.00 175.30 175.99 1vgq s GLY 193 N -2.04 1.53 0.19 -3.53 0.00 -0.59 -4.20 107.32 98.68 1vgq s GLY 193 Ca 0.11 -0.50 0.04 0.00 0.00 0.00 0.00 44.72 44.37 1vgq s GLY 193 CO 0.06 -0.34 -0.05 1.20 0.00 0.00 0.00 173.10 173.97 1vgq s GLN 194 N -4.65 1.19 -0.05 2.90 -0.21 -1.25 -4.92 119.66 112.67 1vgq s GLN 194 Ca 0.47 -1.56 -0.22 0.00 0.02 0.00 0.00 55.36 54.07 1vgq s GLN 194 Cb -0.10 -0.58 -0.04 0.00 1.00 0.00 0.00 33.01 33.29 1vgq s GLN 194 CO 0.43 -0.03 0.64 0.21 -2.12 0.00 0.00 175.29 174.43 1vgq s LYS 195 N -3.82 4.40 -0.00 2.91 2.20 -1.26 -1.98 119.74 122.18 1vgq s LYS 195 Ca 0.23 0.79 0.07 0.00 -0.36 0.00 0.00 55.97 56.70 1vgq s LYS 195 Cb 0.04 -3.41 -0.02 0.00 -1.51 0.00 0.00 37.83 32.94 1vgq s LYS 195 CO 0.05 0.19 -0.22 0.08 -0.36 0.00 0.00 175.35 175.08 1vgq s VAL 196 N 0.41 1.77 0.00 4.02 1.01 0.56 -4.96 120.40 123.21 1vgq s VAL 196 Ca 0.34 -1.03 0.00 0.00 0.00 0.00 0.00 61.98 61.29 1vgq s VAL 196 Cb -0.18 -1.49 -0.00 0.00 0.00 0.00 0.00 36.38 34.71 1vgq s VAL 196 CO 0.17 0.43 -0.01 0.00 0.00 0.00 0.00 175.10 175.69 1vgq s ALA 197 N -0.60 0.09 -0.08 5.51 0.00 -1.26 -0.95 121.76 124.47 1vgq s ALA 197 Ca 0.09 -0.09 0.03 0.00 0.00 0.00 0.00 51.96 51.98 1vgq s ALA 197 Cb -0.09 -0.01 0.01 0.00 0.00 0.00 0.00 23.12 23.03 1vgq s ALA 197 CO -0.00 0.01 -0.16 0.08 0.00 0.00 0.00 175.76 175.69 1vgq s VAL 198 N -0.14 1.47 0.10 0.00 1.01 -0.21 -4.95 120.40 117.67 1vgq s VAL 198 Ca -0.01 -0.66 -0.16 0.00 0.00 0.00 0.00 61.98 61.15 1vgq s VAL 198 Cb -0.01 -1.31 -0.07 0.00 0.00 0.00 0.00 36.38 34.99 1vgq s VAL 198 CO -0.00 0.43 0.53 0.00 0.00 0.00 0.00 175.10 176.05 1vgq s ALA 199 N 0.65 3.61 0.23 5.51 0.00 -1.26 -2.07 121.76 128.43 1vgq s ALA 199 Ca -0.14 -0.11 -0.06 0.00 0.00 0.00 0.00 51.96 51.65 1vgq s ALA 199 Cb -0.16 -2.52 0.22 0.00 0.00 0.00 0.00 23.12 20.65 1vgq s ALA 199 CO 0.04 0.45 1.79 0.52 0.00 0.00 0.00 175.76 178.56 1vgq h MET 200 N 4.04 1.12 -0.74 0.00 2.86 -0.54 -1.56 114.93 120.10 1vgq h MET 200 Ca -0.49 -0.21 0.03 0.00 -2.06 0.00 0.00 59.70 56.97 1vgq h MET 200 Cb 1.20 -0.18 -0.04 0.00 0.06 0.00 0.00 31.60 32.64 1vgq h MET 200 CO 0.64 0.92 0.47 0.37 1.06 0.00 0.00 176.91 180.38 1vgq h GLN 201 N 1.09 0.91 -0.19 1.72 4.15 -1.67 -1.83 115.11 119.30 1vgq h GLN 201 Ca 0.25 -0.05 -0.13 0.00 0.77 0.00 0.00 58.65 59.48 1vgq h GLN 201 Cb 0.23 -0.20 -0.01 0.00 0.21 0.00 0.00 27.48 27.70 1vgq h GLN 201 CO -0.02 0.60 -0.45 -0.44 -1.93 0.00 0.00 178.83 176.59 1vgq h ASP 202 N 0.93 0.50 -0.10 -0.69 5.19 -1.67 0.02 116.42 120.62 1vgq h ASP 202 Ca 0.29 -0.23 -0.16 0.00 -0.62 0.00 0.00 57.03 56.31 1vgq h ASP 202 Cb -0.01 -0.14 -0.01 0.00 0.18 0.00 0.00 39.33 39.35 1vgq h ASP 202 CO -0.10 0.88 -0.49 0.00 -3.12 0.00 0.00 179.24 176.41 1vgq h ALA 203 N 1.14 0.68 -0.07 3.45 0.00 -1.05 -0.87 119.26 122.54 1vgq h ALA 203 Ca 0.03 -0.49 -0.01 0.00 0.00 0.00 0.00 54.91 54.43 1vgq h ALA 203 Cb 0.94 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.63 1vgq h ALA 203 CO 0.08 0.68 -0.01 0.28 0.00 0.00 0.00 179.25 180.28 1vgq h VAL 204 N 0.52 1.28 -0.43 0.00 2.07 -1.24 -3.03 116.25 115.43 1vgq h VAL 204 Ca 0.02 -0.89 -0.02 0.00 0.82 0.00 0.00 66.70 66.64 1vgq h VAL 204 Cb 1.04 1.74 -0.02 0.00 -1.52 0.00 0.00 31.29 32.53 1vgq h VAL 204 CO 0.10 0.24 0.18 0.25 0.02 0.00 0.00 177.57 178.37 1vgq h LEU 205 N -0.20 0.54 -0.84 2.57 5.85 -0.85 -1.35 115.31 121.04 1vgq h LEU 205 Ca 0.02 -0.05 0.01 0.00 0.84 0.00 0.00 57.88 58.70 1vgq h LEU 205 Cb 0.39 -0.14 -0.04 0.00 0.37 0.00 0.00 40.66 41.24 1vgq h LEU 205 CO 0.01 0.48 0.55 -1.13 -0.34 0.00 0.00 178.44 178.01 1vgq h ASN 206 N 0.60 0.96 0.86 1.25 -1.24 -1.13 -0.99 115.58 115.89 1vgq h ASN 206 Ca 0.15 -0.02 -0.04 0.00 0.71 0.00 0.00 56.30 57.09 1vgq h ASN 206 Cb 0.10 -0.24 -0.01 0.00 0.73 0.00 0.00 38.32 38.91 1vgq h ASN 206 CO -0.02 0.69 -0.21 -0.07 -1.29 0.00 0.00 177.43 176.54 1vgq h LEU 207 N 1.13 0.00 -2.53 0.34 3.38 -1.22 -2.98 115.31 113.43 1vgq h LEU 207 Ca 0.31 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.28 1vgq h LEU 207 Cb -0.12 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.63 1vgq h LEU 207 CO -0.07 0.21 0.00 0.52 0.09 0.00 0.00 178.44 179.19 1vgq n VAL 208 N -3.40 1.48 -0.31 1.22 0.31 -0.49 -4.43 118.33 112.71 1vgq n VAL 208 Ca -0.00 -0.91 0.09 0.00 -0.01 0.00 0.00 64.34 63.51 1vgq n VAL 208 Cb 0.40 -0.02 0.25 0.00 -0.91 0.00 0.00 33.84 33.56 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 3.10 0.64 -0.25 5.55 2.43 -1.09 -0.12 114.38 124.64 1vgq h ARG 209 Ca 0.00 -0.04 0.03 0.00 -0.81 0.00 0.00 59.98 59.16 1vgq h ARG 209 Cb 1.23 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 30.62 1vgq h ARG 209 CO 0.21 0.42 0.17 0.97 -1.51 0.00 0.00 179.97 180.23 1vgq h ILE 210 N 0.66 0.98 0.00 1.20 6.09 -1.86 -1.03 117.51 123.55 1vgq h ILE 210 Ca 0.50 -0.07 -0.06 0.00 -1.37 0.00 0.00 64.86 63.87 1vgq h ILE 210 Cb 0.73 0.77 -0.01 0.00 0.47 0.00 0.00 36.82 38.78 1vgq h ILE 210 CO -0.37 0.04 -0.26 0.11 -3.07 0.00 0.00 178.15 174.59 1vgq h LYS 211 N 0.19 0.00 -0.02 2.19 1.79 -1.36 -2.30 116.57 117.06 1vgq h LYS 211 Ca 0.10 0.00 -0.16 0.00 -2.18 0.00 0.00 60.65 58.41 1vgq h LYS 211 Cb 0.18 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 30.81 1vgq h LYS 211 CO -0.02 0.26 -0.73 1.25 -1.08 0.00 0.00 179.45 179.14 1vgq h LEU 212 N 0.00 0.14 -0.17 2.94 5.85 -0.97 -0.41 115.31 122.68 1vgq h LEU 212 Ca -0.00 -0.09 0.02 0.00 0.84 0.00 0.00 57.88 58.64 1vgq h LEU 212 Cb 1.15 -0.04 -0.02 0.00 0.37 0.00 0.00 40.66 42.12 1vgq h LEU 212 CO 0.03 0.81 0.03 -0.09 -0.34 0.00 0.00 178.44 178.89 1vgq h ARG 213 N 0.07 0.10 -0.61 1.25 2.43 -1.25 -2.73 114.38 113.65 1vgq h ARG 213 Ca -0.02 -0.01 -0.06 0.00 -0.81 0.00 0.00 59.98 59.09 1vgq h ARG 213 Cb 1.28 -0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 30.78 1vgq h ARG 213 CO 0.10 0.07 0.13 -0.44 -1.51 0.00 0.00 179.97 178.32 1vgq h ASP 214 N 0.10 0.90 -0.78 -3.80 3.32 -1.11 -1.41 116.42 113.64 1vgq h ASP 214 Ca 0.08 -0.18 -0.03 0.00 0.02 0.00 0.00 57.03 56.91 1vgq h ASP 214 Cb 0.07 -0.24 -0.04 0.00 0.22 0.00 0.00 39.33 39.35 1vgq h ASP 214 CO -0.10 0.89 0.37 -0.61 -1.72 0.00 0.00 179.24 178.06 1vgq h GLN 215 N 0.91 1.14 -0.13 3.56 5.75 -0.95 0.15 115.11 125.53 1vgq h GLN 215 Ca 0.19 -0.17 -0.19 0.00 -0.15 0.00 0.00 58.65 58.33 1vgq h GLN 215 Cb 0.35 -0.20 0.01 0.00 1.07 0.00 0.00 27.48 28.71 1vgq h GLN 215 CO 0.00 0.88 -0.65 1.96 -2.65 0.00 0.00 178.83 178.37 1vgq h GLN 216 N 1.13 0.68 -0.74 1.69 4.20 -1.21 -1.23 115.11 119.63 1vgq h GLN 216 Ca 0.27 -0.55 0.09 0.00 0.06 0.00 0.00 58.65 58.52 1vgq h GLN 216 Cb 0.13 0.11 -0.07 0.00 0.30 0.00 0.00 27.48 27.96 1vgq h GLN 216 CO -0.03 1.17 0.39 0.00 -0.67 0.00 0.00 178.83 179.69 1vgq h ARG 217 N 0.36 0.65 -0.61 1.46 3.08 -1.00 -0.16 114.38 118.16 1vgq h ARG 217 Ca -0.04 -0.04 -0.09 0.00 0.07 0.00 0.00 59.98 59.88 1vgq h ARG 217 Cb 1.29 -0.15 -0.02 0.00 0.08 0.00 0.00 29.97 31.17 1vgq h ARG 217 CO 0.14 0.43 0.04 1.25 -1.07 0.00 0.00 179.97 180.75 1vgq h LEU 218 N 0.67 1.02 -0.50 3.04 5.85 -0.46 -0.78 115.31 124.15 1vgq h LEU 218 Ca 0.36 -0.29 -0.09 0.00 0.84 0.00 0.00 57.88 58.69 1vgq h LEU 218 Cb 0.34 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 41.08 1vgq h LEU 218 CO -0.25 1.06 -0.05 -0.33 -0.34 0.00 0.00 178.44 178.52 1vgq h GLU 219 N 0.95 0.91 -0.06 1.25 5.08 -0.75 -1.40 114.58 120.56 1vgq h GLU 219 Ca 0.18 -0.32 -0.21 0.00 -1.00 0.00 0.00 59.36 58.01 1vgq h GLU 219 Cb 0.51 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.70 1vgq h GLU 219 CO 0.02 0.97 -0.83 0.00 -1.00 0.00 0.00 179.01 178.17 1vgq h ARG 220 N 0.77 0.49 0.00 2.33 3.08 -0.91 -3.40 114.38 116.74 1vgq h ARG 220 Ca 0.13 -0.45 0.00 0.00 0.07 0.00 0.00 59.98 59.73 1vgq h ARG 220 Cb 0.59 0.11 0.00 0.00 0.08 0.00 0.00 29.97 30.75 1vgq h ARG 220 CO 0.04 1.09 -0.89 0.25 -1.07 0.00 0.00 179.97 179.38 1vgq n THR 221 N -3.82 0.00 -0.72 2.04 -2.24 -0.31 -5.03 114.28 104.20 1vgq n THR 221 Ca -0.06 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.72 1vgq n THR 221 Cb 0.77 0.33 0.00 0.00 -2.10 0.00 0.00 70.33 69.33 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 2.28 0.80 3.26 3.38 0.00 -0.53 -5.02 105.19 109.36 1vgq n GLY 222 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.88 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 -3.04 0.04 -0.46 -0.61 2.07 -1.26 -4.53 121.20 113.41 1vgq s ILE 223 Ca 0.00 -0.36 0.04 0.00 -1.41 0.00 0.00 60.65 58.91 1vgq s ILE 223 Cb 0.00 -0.63 0.12 0.00 0.13 0.00 0.00 42.46 42.08 1vgq s ILE 223 CO 0.00 -0.20 0.20 -0.76 -1.91 0.00 0.00 174.94 172.27 1vgq s LEU 224 N -1.07 4.14 0.57 8.50 1.43 -1.26 -4.53 118.68 126.45 1vgq s LEU 224 Ca -0.11 -2.70 0.37 0.00 -1.03 0.00 0.00 54.13 50.66 1vgq s LEU 224 Cb -0.04 -1.53 1.82 0.00 0.03 0.00 0.00 46.19 46.47 1vgq s LEU 224 CO 0.04 -0.28 2.12 0.00 0.23 0.00 0.00 176.35 178.46 1vgq h ALA 225 N 6.86 1.00 -0.01 4.21 0.00 -1.98 -1.81 119.26 127.53 1vgq h ALA 225 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1vgq h ALA 225 Cb 0.93 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.72 1vgq h ALA 225 CO 0.61 0.00 -0.06 -0.85 0.00 0.00 0.00 179.25 178.96 1vgq n GLU 226 N -2.96 1.14 -3.47 0.00 0.00 -1.26 -4.83 120.64 109.26 1vgq n GLU 226 Ca -0.01 -0.47 -0.32 0.00 0.00 0.00 0.00 57.16 56.37 1vgq n GLU 226 Cb 0.17 -1.49 -0.05 0.00 0.00 0.00 0.00 31.44 30.07 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 -2.19 3.44 0.42 -1.84 1.51 -0.68 -4.75 117.35 113.26 1vgq s TYR 227 Ca 0.37 0.78 0.13 0.00 -1.01 0.00 0.00 57.07 57.34 1vgq s TYR 227 Cb 0.21 -2.19 0.98 0.00 -0.11 0.00 0.00 41.96 40.85 1vgq s TYR 227 CO 0.40 0.30 1.95 -1.35 -1.11 0.00 0.00 175.55 175.74 1vgq h PRO 228 N 2.54 0.47 0.00 -1.71 0.11 -1.88 -1.83 132.00 129.69 1vgq h PRO 228 Ca -0.47 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.61 1vgq h PRO 228 Cb 1.17 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.17 1vgq h PRO 228 CO 0.70 0.31 0.00 1.96 -0.21 0.00 0.00 178.00 180.76 1vgq h GLN 229 N 0.48 0.00 0.00 1.05 7.50 -1.90 -1.52 115.11 120.72 1vgq h GLN 229 Ca 0.33 0.00 -0.01 0.00 0.50 0.00 0.00 58.65 59.47 1vgq h GLN 229 Cb 0.61 0.00 -0.00 0.00 0.05 0.00 0.00 27.48 28.14 1vgq h GLN 229 CO -0.10 0.00 -0.04 0.00 -1.50 0.00 0.00 178.83 177.18 1vgq h ALA 230 N 2.00 1.00 -2.02 3.87 0.00 -1.57 -3.40 119.26 119.15 1vgq h ALA 230 Ca 0.00 -0.04 -0.57 0.00 0.00 0.00 0.00 54.91 54.30 1vgq h ALA 230 Cb 0.22 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 17.95 1vgq h ALA 230 CO 0.00 0.05 0.96 -1.14 0.00 0.00 0.00 179.25 179.13 1vgq s GLN 231 N -3.63 4.00 0.19 0.00 0.74 -0.57 -4.68 119.66 115.71 1vgq s GLN 231 Ca 0.02 1.40 -0.33 0.00 0.05 0.00 0.00 55.36 56.49 1vgq s GLN 231 Cb 0.09 -3.86 -0.14 0.00 1.10 0.00 0.00 33.01 30.20 1vgq s GLN 231 CO 0.57 -1.02 1.42 -2.30 -0.55 0.00 0.00 175.29 173.41 1vgq n PRO 232 N 7.14 1.87 -3.12 1.67 -0.02 -1.26 -2.62 135.00 138.67 1vgq n PRO 232 Ca 0.15 0.67 -0.22 0.00 -2.02 0.00 0.00 63.50 62.08 1vgq n PRO 232 Cb 0.46 -2.34 0.01 0.00 -0.02 0.00 0.00 33.50 31.62 1vgq n PRO 232 CO 0.00 0.00 0.00 0.27 1.98 0.00 0.00 175.50 177.75 1vgq n ASN 233 N 2.52 -4.91 -0.11 2.55 0.23 -1.26 -4.89 115.26 109.38 1vgq n ASN 233 Ca 0.14 -0.29 -0.24 0.00 -0.53 0.00 0.00 54.58 53.66 1vgq n ASN 233 Cb 0.29 -4.02 -0.11 0.00 -2.08 0.00 0.00 39.78 33.86 1vgq n ASN 233 CO 0.00 0.00 0.00 0.33 -0.93 0.00 0.00 177.26 176.66 1vgq n PHE 234 N -4.18 0.31 -4.26 -2.53 7.35 -1.08 -5.00 117.46 108.08 1vgq n PHE 234 Ca -0.08 0.10 -0.35 0.00 -0.76 0.00 0.00 57.45 56.36 1vgq n PHE 234 Cb 0.59 -1.04 -0.09 0.00 0.35 0.00 0.00 39.48 39.29 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 -2.50 3.42 0.01 3.13 0.00 -1.26 -5.06 121.76 119.50 1vgq s ALA 235 Ca -0.34 -0.77 0.00 0.00 0.00 0.00 0.00 51.96 50.85 1vgq s ALA 235 Cb 0.11 -1.59 -0.01 0.00 0.00 0.00 0.00 23.12 21.63 1vgq s ALA 235 CO 0.57 0.60 -0.02 -0.06 0.00 0.00 0.00 175.76 176.85 1vgq s PHE 236 N -0.92 0.16 0.41 0.00 0.40 -1.26 -1.08 117.98 115.69 1vgq s PHE 236 Ca 0.14 -0.22 -0.07 0.00 -0.60 0.00 0.00 56.93 56.18 1vgq s PHE 236 Cb -0.11 -0.11 0.10 0.00 0.51 0.00 0.00 43.02 43.40 1vgq s PHE 236 CO 0.03 -0.07 0.49 -0.40 0.70 0.00 0.00 175.22 175.97 1vgq n ASP 237 N 2.47 -0.35 0.20 1.36 5.68 -0.54 -4.45 116.55 120.92 1vgq n ASP 237 Ca -0.17 -1.07 0.14 0.00 -0.50 0.00 0.00 54.79 53.18 1vgq n ASP 237 Cb 0.58 -0.40 0.39 0.00 -1.14 0.00 0.00 41.12 40.56 1vgq n ASP 237 CO 0.00 0.00 0.00 0.08 -1.33 0.00 0.00 177.20 175.95 1vgq h ARG 238 N 0.00 0.00 -0.08 0.11 0.11 -1.89 -1.69 114.38 110.94 1vgq h ARG 238 Ca -0.17 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.91 1vgq h ARG 238 Cb 0.47 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.55 1vgq h ARG 238 CO 0.11 0.00 0.00 -0.25 0.10 0.00 0.00 179.97 179.93 1vgq n ASP 239 N -2.80 1.30 0.00 0.08 8.00 -1.26 -4.95 116.55 116.92 1vgq n ASP 239 Ca 0.03 -1.53 0.00 0.00 0.71 0.00 0.00 54.79 54.00 1vgq n ASP 239 Cb 0.41 -0.04 0.00 0.00 -0.02 0.00 0.00 41.12 41.47 1vgq n ASP 239 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1vgq n GLY 240 N 1.11 0.50 3.75 0.44 0.00 -0.64 -5.04 105.19 105.31 1vgq n GLY 240 Ca 0.18 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.79 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 -2.03 7.29 0.40 1.61 0.01 -1.26 -4.77 114.94 116.19 1vgq s ASN 241 Ca 0.00 2.18 -0.26 0.00 -0.71 0.00 0.00 52.86 54.07 1vgq s ASN 241 Cb 0.00 -2.62 -0.09 0.00 0.41 0.00 0.00 41.25 38.96 1vgq s ASN 241 CO 0.00 -0.15 1.23 -2.16 -1.51 0.00 0.00 177.10 174.51 1vgq s PRO 242 N -1.02 4.05 -0.23 -0.60 0.04 -1.26 -1.47 135.00 134.50 1vgq s PRO 242 Ca 0.46 1.98 -0.04 0.00 0.04 0.00 0.00 61.00 63.45 1vgq s PRO 242 Cb -0.31 -2.74 -0.00 0.00 0.04 0.00 0.00 34.50 31.49 1vgq s PRO 242 CO 0.38 -0.37 -0.04 -0.51 0.04 0.00 0.00 177.00 176.50 1vgq s LEU 243 N -2.40 2.98 0.24 -3.56 1.43 -0.24 -4.85 118.68 112.26 1vgq s LEU 243 Ca 0.56 -0.50 0.01 0.00 -1.03 0.00 0.00 54.13 53.17 1vgq s LEU 243 Cb -0.34 -1.73 -0.05 0.00 0.03 0.00 0.00 46.19 44.10 1vgq s LEU 243 CO 0.43 -0.05 0.09 -0.94 0.23 0.00 0.00 176.35 176.12 1vgq s SER 244 N 1.45 1.00 0.00 2.29 1.04 -1.26 -4.51 113.70 113.71 1vgq s SER 244 Ca 0.05 -1.36 0.28 0.00 0.48 0.00 0.00 55.95 55.40 1vgq s SER 244 Cb -0.15 0.20 1.28 0.00 0.10 0.00 0.00 66.02 67.45 1vgq s SER 244 CO -0.03 -0.73 1.93 0.49 0.98 0.00 0.00 173.24 175.88 1vgq n PHE 245 N -0.40 0.00 -0.34 5.02 3.01 -1.26 -2.82 117.46 120.67 1vgq n PHE 245 Ca -0.01 0.00 0.18 0.00 1.01 0.00 0.00 57.45 58.64 1vgq n PHE 245 Cb 0.66 -0.43 0.40 0.00 -0.01 0.00 0.00 39.48 40.10 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 0.00 0.66 -0.08 4.37 3.32 -1.97 -3.10 116.42 119.62 1vgq h ASP 246 Ca 0.00 0.14 0.00 0.00 0.02 0.00 0.00 57.03 57.19 1vgq h ASP 246 Cb 0.41 0.04 0.00 0.00 0.22 0.00 0.00 39.33 40.00 1vgq h ASP 246 CO 0.00 0.08 0.00 0.59 -1.72 0.00 0.00 179.24 178.19 1vgq n ASN 247 N -4.89 2.56 -4.44 6.45 3.02 -1.13 -4.97 115.26 111.86 1vgq n ASN 247 Ca 0.27 -2.63 -0.35 0.00 -0.03 0.00 0.00 54.58 51.84 1vgq n ASN 247 Cb 0.77 -0.30 -0.13 0.00 -0.61 0.00 0.00 39.78 39.52 1vgq n ASN 247 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1vgq s ILE 248 N -2.10 4.05 -0.24 2.41 1.01 -1.17 -4.96 121.20 120.19 1vgq s ILE 248 Ca 0.23 -0.27 0.05 0.00 0.00 0.00 0.00 60.65 60.66 1vgq s ILE 248 Cb 0.19 -2.85 -0.05 0.00 0.01 0.00 0.00 42.46 39.76 1vgq s ILE 248 CO 0.04 0.40 0.22 0.35 0.00 0.00 0.00 174.94 175.96 1vgq n THR 249 N 4.48 0.00 -4.60 2.92 -2.24 -1.26 -4.93 114.28 108.65 1vgq n THR 249 Ca -0.17 -0.40 -0.22 0.00 -2.27 0.00 0.00 64.05 60.99 1vgq n THR 249 Cb 0.52 1.01 -0.15 0.00 -2.10 0.00 0.00 70.33 69.60 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 -1.39 1.75 -0.18 3.42 0.15 -1.26 -4.89 113.70 111.30 1vgq s SER 250 Ca 0.02 -0.33 -0.39 0.00 0.70 0.00 0.00 55.95 55.95 1vgq s SER 250 Cb 0.04 -0.17 -0.16 0.00 -1.71 0.00 0.00 66.02 64.01 1vgq s SER 250 CO 0.19 0.14 1.62 0.52 1.20 0.00 0.00 173.24 176.91 1vgq n VAL 251 N 2.47 0.21 -2.50 4.45 0.31 -1.26 -4.93 118.33 117.09 1vgq n VAL 251 Ca -0.15 -0.04 -0.23 0.00 -0.01 0.00 0.00 64.34 63.91 1vgq n VAL 251 Cb 0.55 -1.07 0.05 0.00 -0.91 0.00 0.00 33.84 32.45 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 2.66 2.46 0.19 5.55 0.04 -1.26 -4.74 135.00 139.90 1vgq s PRO 252 Ca 0.95 -0.56 -0.30 0.00 0.04 0.00 0.00 61.00 61.12 1vgq s PRO 252 Cb -1.06 -2.37 -0.09 0.00 0.04 0.00 0.00 34.50 31.02 1vgq s PRO 252 CO 0.61 -0.87 1.38 1.03 0.04 0.00 0.00 177.00 179.19 1vgq s ARG 253 N -4.93 4.33 -0.13 4.56 0.52 -1.25 -4.79 118.95 117.25 1vgq s ARG 253 Ca 0.58 2.15 0.18 0.00 -0.52 0.00 0.00 55.73 58.12 1vgq s ARG 253 Cb -0.10 -3.18 0.32 0.00 0.52 0.00 0.00 34.95 32.51 1vgq s ARG 253 CO 0.41 -0.36 1.20 0.41 0.02 0.00 0.00 175.30 176.97 1vgq n GLY 254 N 2.64 4.65 7.00 -3.53 0.00 -1.25 -3.76 105.19 110.94 1vgq n GLY 254 Ca 0.08 -1.08 0.00 0.00 0.00 0.00 0.00 46.02 45.02 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 -1.22 3.40 1.97 -0.02 0.00 -0.26 -2.14 105.19 106.93 1vgq n GLY 255 Ca 0.16 -0.11 -0.18 0.00 0.00 0.00 0.00 46.02 45.90 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 6.64 3.61 -4.61 1.61 3.02 -1.26 -4.63 115.26 119.63 1vgq n ASN 256 Ca 0.00 -3.60 -0.29 0.00 -0.03 0.00 0.00 54.58 50.66 1vgq n ASN 256 Cb 0.00 -0.78 0.20 0.00 -0.61 0.00 0.00 39.78 38.59 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 -3.25 0.49 -0.30 5.41 0.00 -0.91 -3.90 121.76 119.30 1vgq s ALA 257 Ca 0.54 -0.18 0.27 0.00 0.00 0.00 0.00 51.96 52.59 1vgq s ALA 257 Cb 0.46 -3.19 1.04 0.00 0.00 0.00 0.00 23.12 21.42 1vgq s ALA 257 CO 0.09 -3.17 1.81 0.78 0.00 0.00 0.00 175.76 175.27 1vgq h GLY 258 N -2.14 0.00 0.00 0.00 0.00 -1.80 -3.46 103.07 95.67 1vgq h GLY 258 Ca -0.56 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.77 1vgq h GLY 258 CO 0.54 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.69 1vgq n GLY 259 N 0.29 2.75 0.03 4.60 0.00 -1.26 -1.53 105.19 110.07 1vgq n GLY 259 Ca 0.02 -0.29 0.15 0.00 0.00 0.00 0.00 46.02 45.89 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 -1.18 3.92 -0.02 0.00 -1.26 -4.79 105.19 101.86 1vgq n GLY 260 Ca 0.00 -0.18 -0.30 0.00 0.00 0.00 0.00 46.02 45.54 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 -2.53 1.73 0.78 -0.02 0.00 -0.58 -5.06 107.32 101.63 1vgq s GLY 261 Ca 0.29 -1.04 -0.12 0.00 0.00 0.00 0.00 44.72 43.85 1vgq s GLY 261 CO 0.47 -0.35 1.12 1.20 0.00 0.00 0.00 173.10 175.54 1vgq s GLN 262 N -5.79 2.02 0.25 2.90 -1.52 -1.26 -4.79 119.66 111.47 1vgq s GLN 262 Ca 0.71 1.38 -0.29 0.00 -1.95 0.00 0.00 55.36 55.20 1vgq s GLN 262 Cb -0.06 -1.86 -0.15 0.00 -0.22 0.00 0.00 33.01 30.73 1vgq s GLN 262 CO 0.52 -1.85 1.00 -2.30 -0.25 0.00 0.00 175.29 172.41 1vgq n PRO 263 N -3.41 1.17 -3.82 2.91 -0.02 -1.26 -4.54 135.00 126.04 1vgq n PRO 263 Ca 0.11 0.41 -0.09 0.00 -2.02 0.00 0.00 63.50 61.91 1vgq n PRO 263 Cb 0.52 -1.78 0.02 0.00 -0.02 0.00 0.00 33.50 32.24 1vgq n PRO 263 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 1vgq s GLY 264 N -0.47 0.40 0.15 -1.23 0.00 -1.26 0.04 107.32 104.95 1vgq s GLY 264 Ca 0.63 -0.77 -0.20 0.00 0.00 0.00 0.00 44.72 44.38 1vgq s GLY 264 CO 0.58 -0.33 0.52 0.86 0.00 0.00 0.00 173.10 174.72 1vgq s TRP 265 N -2.41 -0.38 -0.43 1.90 -0.11 -0.74 -3.91 118.94 112.86 1vgq s TRP 265 Ca 0.16 0.12 -0.23 0.00 1.22 0.00 0.00 56.10 57.37 1vgq s TRP 265 Cb -0.05 0.43 0.02 0.00 -1.50 0.00 0.00 33.47 32.38 1vgq s TRP 265 CO 0.12 -0.80 0.76 1.41 -4.62 0.00 0.00 176.95 173.82 1vgq s MET 266 N -3.78 3.44 -0.10 5.86 -2.45 -1.26 -1.57 119.30 119.44 1vgq s MET 266 Ca 0.02 -0.09 -0.00 0.00 -1.25 0.00 0.00 55.69 54.37 1vgq s MET 266 Cb 0.00 -3.92 -0.03 0.00 1.25 0.00 0.00 34.83 32.13 1vgq s MET 266 CO -0.12 -1.06 -0.07 -0.51 1.05 0.00 0.00 175.02 174.32 1vgq s LEU 267 N 3.18 3.14 0.36 4.11 1.43 0.14 -4.95 118.68 126.09 1vgq s LEU 267 Ca 0.29 -0.08 -0.28 0.00 -1.03 0.00 0.00 54.13 53.03 1vgq s LEU 267 Cb -0.13 -1.71 -0.10 0.00 0.03 0.00 0.00 46.19 44.29 1vgq s LEU 267 CO 0.21 0.29 1.33 -0.54 0.23 0.00 0.00 176.35 177.87 1vgq s LYS 268 N -0.37 4.21 0.49 1.70 1.02 -1.26 -1.10 119.74 124.42 1vgq s LYS 268 Ca 0.05 2.25 0.04 0.00 0.02 0.00 0.00 55.97 58.34 1vgq s LYS 268 Cb -0.12 -2.96 -0.01 0.00 -0.52 0.00 0.00 37.83 34.21 1vgq s LYS 268 CO 0.02 -0.33 0.16 0.00 -0.92 0.00 0.00 175.35 174.28 1vgq n LYS 270 N -1.37 1.38 -0.51 0.00 4.81 -0.21 -2.46 118.16 119.80 1vgq n LYS 270 Ca -0.09 0.49 0.00 0.00 -0.87 0.00 0.00 58.31 57.85 1vgq n LYS 270 Cb 0.66 -2.09 0.00 0.00 0.02 0.00 0.00 35.03 33.62 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 2.35 0.75 0.33 3.14 0.00 -1.26 -4.72 105.19 105.78 1vgq n GLY 271 Ca 0.16 0.00 0.17 0.00 0.00 0.00 0.00 46.02 46.35 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 -0.09 1.61 5.08 -1.67 0.98 115.95 121.86 1vgq h TRP 272 Ca 0.00 0.00 -0.11 0.00 1.08 0.00 0.00 58.89 59.86 1vgq h TRP 272 Cb 0.00 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 26.15 1vgq h TRP 272 CO 0.00 0.00 -0.42 0.93 -1.28 0.00 0.00 178.44 177.67 1vgq h GLU 273 N 0.00 0.21 0.00 0.12 3.07 -1.93 -3.31 114.58 112.74 1vgq h GLU 273 Ca 0.08 -0.10 -0.24 0.00 -0.50 0.00 0.00 59.36 58.60 1vgq h GLU 273 Cb 0.45 -0.00 -0.05 0.00 -0.84 0.00 0.00 28.75 28.32 1vgq h GLU 273 CO -0.00 0.60 -2.06 2.41 -1.40 0.00 0.00 179.01 178.56 1vgq n THR 274 N -4.02 0.91 -4.02 1.13 -1.04 -0.82 -4.92 114.28 101.51 1vgq n THR 274 Ca -0.02 -0.64 -0.33 0.00 -2.04 0.00 0.00 64.05 61.03 1vgq n THR 274 Cb 0.48 -0.44 -0.15 0.00 -1.82 0.00 0.00 70.33 68.40 1vgq n THR 274 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1vgq s ASP 275 N -4.83 4.59 0.62 8.00 2.15 0.28 -4.99 116.67 122.49 1vgq s ASP 275 Ca -0.08 -1.45 0.34 0.00 0.43 0.00 0.00 52.55 51.80 1vgq s ASP 275 Cb 0.06 -1.60 1.96 0.00 -0.30 0.00 0.00 42.92 43.04 1vgq s ASP 275 CO 0.68 -0.23 2.22 0.00 -0.17 0.00 0.00 175.17 177.67 1vgq h ALA 276 N 7.81 1.42 -0.29 3.66 0.00 -1.86 -2.62 119.26 127.38 1vgq h ALA 276 Ca -0.18 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.73 1vgq h ALA 276 Cb 1.04 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.84 1vgq h ALA 276 CO 0.49 -0.11 0.00 -0.25 0.00 0.00 0.00 179.25 179.38 1vgq n ASP 277 N -3.50 3.29 -3.84 0.00 8.00 -1.26 -4.83 116.55 114.41 1vgq n ASP 277 Ca -0.02 -2.45 -0.42 0.00 0.71 0.00 0.00 54.79 52.62 1vgq n ASP 277 Cb 0.17 -0.36 0.00 0.00 -0.02 0.00 0.00 41.12 40.91 1vgq n ASP 277 CO 0.00 0.00 0.00 -0.24 -0.39 0.00 0.00 177.20 176.57 1vgq n SER 278 N 0.02 4.44 -3.95 -2.24 2.88 -0.99 -4.43 113.62 109.35 1vgq n SER 278 Ca 0.15 -2.96 -0.08 0.00 -1.33 0.00 0.00 58.87 54.65 1vgq n SER 278 Cb 0.62 -1.59 -0.09 0.00 -0.75 0.00 0.00 64.21 62.41 1vgq n SER 278 CO 0.00 0.00 0.00 -0.31 -1.23 0.00 0.00 175.04 173.50 1vgq s TYR 279 N 2.06 0.28 0.20 0.66 1.51 -1.26 -0.89 117.35 119.90 1vgq s TYR 279 Ca 0.44 -0.71 0.11 0.00 -1.01 0.00 0.00 57.07 55.89 1vgq s TYR 279 Cb 0.11 -0.19 -0.04 0.00 -0.11 0.00 0.00 41.96 41.73 1vgq s TYR 279 CO -0.04 -0.45 -0.21 0.14 -1.11 0.00 0.00 175.55 173.88 1vgq s VAL 280 N -3.55 2.20 -0.16 0.71 -7.23 -0.26 -1.73 120.40 110.38 1vgq s VAL 280 Ca 0.03 -2.06 -0.15 0.00 -1.81 0.00 0.00 61.98 57.99 1vgq s VAL 280 Cb 0.04 -2.07 -0.04 0.00 0.56 0.00 0.00 36.38 34.87 1vgq s VAL 280 CO -0.09 -0.23 0.35 -0.47 -0.31 0.00 0.00 175.10 174.34 1vgq s TYR 281 N -1.95 3.46 -0.10 2.82 5.04 0.45 -0.68 117.35 126.39 1vgq s TYR 281 Ca 0.21 0.65 0.01 0.00 -2.44 0.00 0.00 57.07 55.50 1vgq s TYR 281 Cb -0.07 -2.41 0.02 0.00 0.35 0.00 0.00 41.96 39.85 1vgq s TYR 281 CO 0.10 0.18 -0.12 0.12 -1.34 0.00 0.00 175.55 174.49 1vgq s PHE 282 N 0.64 1.66 -0.16 4.97 5.36 -0.61 -2.06 117.98 127.78 1vgq s PHE 282 Ca 0.19 -0.75 -0.07 0.00 -0.96 0.00 0.00 56.93 55.34 1vgq s PHE 282 Cb -0.14 -1.25 -0.04 0.00 -0.34 0.00 0.00 43.02 41.25 1vgq s PHE 282 CO 0.06 -0.43 0.07 0.99 -1.46 0.00 0.00 175.22 174.45 1vgq s THR 283 N 1.11 4.91 -0.79 0.12 2.01 -0.92 -1.78 115.64 120.30 1vgq s THR 283 Ca -0.05 0.00 -0.08 0.00 0.31 0.00 0.00 61.69 61.87 1vgq s THR 283 Cb -0.14 -3.19 0.20 0.00 0.01 0.00 0.00 72.50 69.38 1vgq s THR 283 CO -0.02 0.50 0.68 -0.63 -0.69 0.00 0.00 174.62 174.46 1vgq s ILE 284 N -0.01 4.78 0.39 1.82 1.01 0.11 -4.72 121.20 124.57 1vgq s ILE 284 Ca 0.07 -2.95 -0.20 0.00 0.00 0.00 0.00 60.65 57.56 1vgq s ILE 284 Cb -0.12 -3.99 -0.10 0.00 0.01 0.00 0.00 42.46 38.26 1vgq s ILE 284 CO 0.01 -1.00 0.90 0.00 0.00 0.00 0.00 174.94 174.85 1vgq s ALA 285 N -0.29 3.13 0.41 9.38 0.00 -1.26 -3.99 121.76 129.14 1vgq s ALA 285 Ca 0.20 0.33 0.08 0.00 0.00 0.00 0.00 51.96 52.58 1vgq s ALA 285 Cb -0.13 -3.06 0.88 0.00 0.00 0.00 0.00 23.12 20.80 1vgq s ALA 285 CO -0.07 0.18 2.03 0.00 0.00 0.00 0.00 175.76 177.90 1vgq h ALA 286 N 2.18 1.77 -0.06 0.00 0.00 -1.98 -2.05 119.26 119.12 1vgq h ALA 286 Ca -0.48 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.40 1vgq h ALA 286 Cb 1.18 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.82 1vgq h ALA 286 CO 0.62 0.18 0.00 0.27 0.00 0.00 0.00 179.25 180.32 1vgq n ASN 287 N -4.47 0.73 -0.05 0.00 6.94 -1.26 -4.26 115.26 112.89 1vgq n ASN 287 Ca 0.05 -1.50 0.05 0.00 -0.02 0.00 0.00 54.58 53.16 1vgq n ASN 287 Cb 0.14 -0.04 0.07 0.00 -2.36 0.00 0.00 39.78 37.59 1vgq n ASN 287 CO 0.00 0.00 0.00 0.23 -1.03 0.00 0.00 177.26 176.46 1vgq n MET 288 N -0.32 1.99 -0.01 -3.83 2.81 -0.77 -4.80 117.12 112.19 1vgq n MET 288 Ca 0.16 -2.01 -0.11 0.00 -1.81 0.00 0.00 57.70 53.92 1vgq n MET 288 Cb 0.19 -1.23 -0.06 0.00 -0.71 0.00 0.00 33.22 31.41 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 0.00 0.12 -0.95 2.03 2.91 -1.74 -1.56 115.95 116.76 1vgq h TRP 289 Ca 0.00 -0.00 0.08 0.00 1.13 0.00 0.00 58.89 60.10 1vgq h TRP 289 Cb 0.78 -0.04 -0.07 0.00 -0.51 0.00 0.00 29.16 29.33 1vgq h TRP 289 CO 0.00 0.18 0.60 -1.35 -1.03 0.00 0.00 178.44 176.84 1vgq h PRO 290 N 0.03 1.00 -0.48 2.65 0.11 -1.91 -0.78 132.00 132.61 1vgq h PRO 290 Ca 0.03 -0.06 -0.03 0.00 0.11 0.00 0.00 66.00 66.05 1vgq h PRO 290 Cb 0.10 -0.23 -0.02 0.00 0.11 0.00 0.00 31.00 30.96 1vgq h PRO 290 CO -0.00 0.66 0.20 1.96 -0.21 0.00 0.00 178.00 180.60 1vgq h GLN 291 N 1.03 0.72 -0.27 1.05 7.50 -1.86 -2.05 115.11 121.23 1vgq h GLN 291 Ca 0.44 -0.13 -0.00 0.00 0.50 0.00 0.00 58.65 59.46 1vgq h GLN 291 Cb 0.29 -0.12 -0.01 0.00 0.05 0.00 0.00 27.48 27.69 1vgq h GLN 291 CO -0.21 0.64 0.16 0.82 -1.50 0.00 0.00 178.83 178.74 1vgq h ILE 292 N 0.64 1.10 -0.97 2.54 2.04 -0.61 -1.21 117.51 121.04 1vgq h ILE 292 Ca 0.16 -0.24 0.11 0.00 1.00 0.00 0.00 64.86 65.90 1vgq h ILE 292 Cb 0.19 0.78 -0.08 0.00 -0.74 0.00 0.00 36.82 36.97 1vgq h ILE 292 CO -0.01 0.10 0.62 0.00 0.00 0.00 0.00 178.15 178.85 1vgq h ASP 294 N 0.97 0.18 -0.85 0.00 5.19 -0.87 -0.06 116.42 120.98 1vgq h ASP 294 Ca 0.47 -0.33 0.10 0.00 -0.62 0.00 0.00 57.03 56.64 1vgq h ASP 294 Cb 0.46 -0.05 -0.07 0.00 0.18 0.00 0.00 39.33 39.84 1vgq h ASP 294 CO -0.23 0.47 0.49 -0.03 -3.12 0.00 0.00 179.24 176.82 1vgq h MET 295 N -0.11 0.80 -0.53 3.56 4.05 -0.71 -2.64 114.93 119.35 1vgq h MET 295 Ca 0.03 -0.05 0.00 0.00 -0.28 0.00 0.00 59.70 59.40 1vgq h MET 295 Cb 0.38 -0.18 0.00 0.00 -0.80 0.00 0.00 31.60 31.00 1vgq h MET 295 CO 0.01 0.53 0.00 0.44 0.23 0.00 0.00 176.91 178.12 1vgq n ILE 296 N -4.72 0.70 -3.67 1.77 -5.35 -0.68 -4.97 119.36 102.44 1vgq n ILE 296 Ca 0.14 -0.83 -0.26 0.00 -0.27 0.00 0.00 62.75 61.54 1vgq n ILE 296 Cb 0.28 0.71 0.04 0.00 -1.74 0.00 0.00 39.64 38.93 1vgq n ILE 296 CO 0.00 0.00 0.00 0.47 -1.76 0.00 0.00 176.55 175.26 1vgq n ASP 297 N 1.49 -3.63 -3.13 7.28 10.43 -0.69 -4.97 116.55 123.33 1vgq n ASP 297 Ca 0.21 -0.92 -0.26 0.00 2.57 0.00 0.00 54.79 56.39 1vgq n ASP 297 Cb 0.59 -3.77 -0.05 0.00 1.84 0.00 0.00 41.12 39.73 1vgq n ASP 297 CO 0.00 0.00 0.00 0.29 -1.07 0.00 0.00 177.20 176.42 1vgq n LYS 298 N -4.11 2.64 -0.23 -1.24 4.76 -0.12 -4.92 118.16 114.94 1vgq n LYS 298 Ca -0.18 -4.56 0.06 0.00 -2.87 0.00 0.00 58.31 50.76 1vgq n LYS 298 Cb 0.63 -2.13 0.32 0.00 -1.84 0.00 0.00 35.03 32.01 1vgq n LYS 298 CO 0.00 0.00 0.00 -1.00 -1.37 0.00 0.00 177.40 175.03 1vgq h PRO 299 N 3.41 0.82 0.00 1.97 0.13 -1.94 -1.43 132.00 134.96 1vgq h PRO 299 Ca 0.14 -0.05 -0.00 0.00 -0.87 0.00 0.00 66.00 65.23 1vgq h PRO 299 Cb 0.62 -0.18 -0.00 0.00 0.13 0.00 0.00 31.00 31.57 1vgq h PRO 299 CO 0.77 0.54 -0.00 1.05 -0.23 0.00 0.00 178.00 180.13 1vgq h GLU 300 N 0.84 0.00 0.00 0.86 9.09 -1.95 -1.64 114.58 121.78 1vgq h GLU 300 Ca 0.35 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.76 1vgq h GLU 300 Cb 0.27 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.37 1vgq h GLU 300 CO -0.12 0.00 -0.14 -1.49 0.05 0.00 0.00 179.01 177.30 1vgq h TRP 301 N 0.00 0.00 -0.30 2.06 6.55 -1.65 -3.38 115.95 119.23 1vgq h TRP 301 Ca -0.00 0.00 0.00 0.00 0.95 0.00 0.00 58.89 59.84 1vgq h TRP 301 Cb 0.01 0.00 -0.02 0.00 -0.86 0.00 0.00 29.16 28.29 1vgq h TRP 301 CO 0.00 0.00 0.20 0.87 -1.05 0.00 0.00 178.44 178.46 1vgq h LYS 302 N 0.00 0.39 -0.44 0.49 1.57 -1.40 -3.22 116.57 113.97 1vgq h LYS 302 Ca 0.00 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.76 1vgq h LYS 302 Cb 0.76 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.98 1vgq h LYS 302 CO 0.00 0.26 0.00 -0.25 -0.57 0.00 0.00 179.45 178.89 1vgq n ASP 303 N -4.88 3.20 -4.58 0.86 8.00 -1.26 -4.70 116.55 113.18 1vgq n ASP 303 Ca -0.01 -1.98 -0.41 0.00 0.71 0.00 0.00 54.79 53.10 1vgq n ASP 303 Cb 0.03 -0.29 -0.07 0.00 -0.02 0.00 0.00 41.12 40.77 1vgq n ASP 303 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1vgq s ASP 304 N -1.02 6.46 0.61 -2.24 -1.08 -1.21 -4.96 116.67 113.23 1vgq s ASP 304 Ca 0.31 0.29 0.41 0.00 -0.52 0.00 0.00 52.55 53.03 1vgq s ASP 304 Cb 0.16 -2.33 2.18 0.00 -1.46 0.00 0.00 42.92 41.48 1vgq s ASP 304 CO 0.21 -0.53 2.25 1.55 0.52 0.00 0.00 175.17 179.17 1vgq h PRO 305 N 8.32 0.00 0.00 4.34 0.13 -1.91 0.33 132.00 143.21 1vgq h PRO 305 Ca -0.27 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.86 1vgq h PRO 305 Cb 1.11 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.24 1vgq h PRO 305 CO 0.82 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 178.59 1vgq h ALA 306 N 2.00 1.00 0.00 -0.56 0.00 -1.93 -3.35 119.26 116.42 1vgq h ALA 306 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1vgq h ALA 306 Cb 0.05 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.84 1vgq h ALA 306 CO 0.00 0.00 -0.88 0.66 0.00 0.00 0.00 179.25 179.03 1vgq n TYR 307 N -2.91 0.00 0.73 0.00 4.02 -0.01 -3.87 117.16 115.12 1vgq n TYR 307 Ca -0.01 0.00 0.12 0.00 -0.01 0.00 0.00 57.90 58.00 1vgq n TYR 307 Cb 0.18 0.00 0.23 0.00 -0.02 0.00 0.00 39.34 39.73 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 -1.57 2.92 -4.43 7.72 0.23 -0.51 -4.70 115.26 114.93 1vgq n ASN 308 Ca 0.00 -1.92 -0.23 0.00 -0.53 0.00 0.00 54.58 51.90 1vgq n ASN 308 Cb 0.22 -0.14 -0.10 0.00 -2.08 0.00 0.00 39.78 37.67 1vgq n ASN 308 CO 0.00 0.00 0.00 0.42 -0.93 0.00 0.00 177.26 176.75 1vgq s THR 309 N -1.72 2.27 0.28 5.53 -4.23 -1.26 -4.97 115.64 111.54 1vgq s THR 309 Ca 0.35 -2.27 0.01 0.00 -1.18 0.00 0.00 61.69 58.60 1vgq s THR 309 Cb 0.21 -2.19 0.28 0.00 1.34 0.00 0.00 72.50 72.15 1vgq s THR 309 CO 0.31 -0.38 1.85 0.15 -0.54 0.00 0.00 174.62 176.00 1vgq h PHE 310 N 2.56 1.15 -0.29 3.99 3.57 -1.92 -2.00 116.94 124.01 1vgq h PHE 310 Ca -0.41 0.03 -0.17 0.00 3.53 0.00 0.00 57.97 60.95 1vgq h PHE 310 Cb 1.24 -0.37 -0.00 0.00 2.79 0.00 0.00 35.95 39.61 1vgq h PHE 310 CO 0.76 0.48 -0.49 0.93 -2.23 0.00 0.00 178.31 177.76 1vgq h GLU 311 N 1.03 0.81 0.00 1.11 3.07 -1.95 -2.49 114.58 116.15 1vgq h GLU 311 Ca 0.49 -0.48 -0.08 0.00 -0.50 0.00 0.00 59.36 58.79 1vgq h GLU 311 Cb 0.43 0.04 -0.01 0.00 -0.84 0.00 0.00 28.75 28.38 1vgq h GLU 311 CO -0.25 1.11 -0.38 0.78 -1.40 0.00 0.00 179.01 178.88 1vgq h GLY 312 N 0.82 0.00 1.77 -3.84 0.00 -1.69 -3.02 103.07 97.11 1vgq h GLY 312 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.36 1vgq h GLY 312 CO 0.11 0.00 -0.13 0.54 0.00 0.00 0.00 176.54 177.05 1vgq n ARG 313 N -4.06 0.10 -0.22 4.80 1.74 -0.78 -4.15 116.66 114.10 1vgq n ARG 313 Ca -0.02 0.07 0.00 0.00 -0.77 0.00 0.00 57.85 57.14 1vgq n ARG 313 Cb 0.41 -1.61 0.12 0.00 -1.02 0.00 0.00 32.46 30.37 1vgq n ARG 313 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 1vgq h VAL 314 N 0.00 0.82 0.00 1.55 2.07 -1.33 0.11 116.25 119.47 1vgq h VAL 314 Ca 0.00 -0.17 0.00 0.00 0.82 0.00 0.00 66.70 67.35 1vgq h VAL 314 Cb 0.59 0.27 0.00 0.00 -1.52 0.00 0.00 31.29 30.63 1vgq h VAL 314 CO 0.00 0.09 0.00 -0.90 0.02 0.00 0.00 177.57 176.78 1vgq n ASP 315 N -4.93 0.00 -0.03 0.57 5.68 -1.26 -3.78 116.55 112.81 1vgq n ASP 315 Ca 0.10 -0.85 0.00 0.00 -0.50 0.00 0.00 54.79 53.54 1vgq n ASP 315 Cb 0.27 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.25 1vgq n ASP 315 CO 0.00 0.00 0.00 2.29 -1.33 0.00 0.00 177.20 178.16 1vgq n LYS 316 N -0.98 0.00 -0.31 0.11 2.85 -0.41 -4.56 118.16 114.85 1vgq n LYS 316 Ca 0.19 -0.25 -0.03 0.00 -1.05 0.00 0.00 58.31 57.17 1vgq n LYS 316 Cb 0.09 -0.23 0.09 0.00 -0.65 0.00 0.00 35.03 34.32 1vgq n LYS 316 CO 0.00 0.00 0.00 1.25 -0.05 0.00 0.00 177.40 178.60 1vgq h LEU 317 N 0.00 0.96 -1.20 -5.58 5.85 -0.97 -1.11 115.31 113.25 1vgq h LEU 317 Ca 0.00 -0.02 -0.05 0.00 0.84 0.00 0.00 57.88 58.66 1vgq h LEU 317 Cb 1.01 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 41.79 1vgq h LEU 317 CO 0.00 0.68 0.06 0.24 -0.34 0.00 0.00 178.44 179.08 1vgq h MET 318 N 1.13 0.62 -0.68 1.25 2.86 -1.89 -0.70 114.93 117.52 1vgq h MET 318 Ca 0.32 -0.12 -0.08 0.00 -2.06 0.00 0.00 59.70 57.76 1vgq h MET 318 Cb -0.09 -0.10 -0.03 0.00 0.06 0.00 0.00 31.60 31.45 1vgq h MET 318 CO -0.08 0.60 0.12 -0.44 1.06 0.00 0.00 176.91 178.16 1vgq h ASP 319 N 0.60 1.07 -0.29 1.22 3.32 -1.62 -1.77 116.42 118.95 1vgq h ASP 319 Ca 0.13 -0.25 -0.02 0.00 0.02 0.00 0.00 57.03 56.92 1vgq h ASP 319 Cb 0.29 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.54 1vgq h ASP 319 CO 0.00 1.05 0.12 0.40 -1.72 0.00 0.00 179.24 179.09 1vgq h ILE 320 N 1.04 1.17 -0.77 0.35 2.04 -0.80 -1.38 117.51 119.17 1vgq h ILE 320 Ca 0.21 -0.52 0.01 0.00 1.00 0.00 0.00 64.86 65.55 1vgq h ILE 320 Cb 0.43 0.99 -0.04 0.00 -0.74 0.00 0.00 36.82 37.46 1vgq h ILE 320 CO 0.01 0.18 0.51 -0.26 0.00 0.00 0.00 178.15 178.59 1vgq h PHE 321 N 0.31 0.96 -0.61 1.37 0.04 -1.08 -0.09 116.94 117.85 1vgq h PHE 321 Ca 0.10 0.02 -0.05 0.00 2.80 0.00 0.00 57.97 60.84 1vgq h PHE 321 Cb 0.17 -0.32 -0.03 0.00 2.20 0.00 0.00 35.95 37.97 1vgq h PHE 321 CO -0.01 0.60 0.19 1.03 -0.60 0.00 0.00 178.31 179.52 1vgq h SER 322 N 1.03 0.85 -0.23 2.17 0.87 -1.13 -1.03 113.55 116.08 1vgq h SER 322 Ca 0.28 -0.14 -0.18 0.00 -1.23 0.00 0.00 61.79 60.52 1vgq h SER 322 Cb -0.11 -0.22 0.00 0.00 -0.44 0.00 0.00 62.40 61.63 1vgq h SER 322 CO -0.06 0.80 -0.57 0.15 -0.53 0.00 0.00 176.83 176.62 1vgq h PHE 323 N 0.89 1.01 -0.63 2.24 3.57 -0.60 -3.04 116.94 120.38 1vgq h PHE 323 Ca 0.20 -0.39 0.02 0.00 3.53 0.00 0.00 57.97 61.34 1vgq h PHE 323 Cb 0.26 -0.18 -0.04 0.00 2.79 0.00 0.00 35.95 38.78 1vgq h PHE 323 CO 0.02 1.21 0.39 0.82 -2.23 0.00 0.00 178.31 178.51 1vgq h ILE 324 N 0.53 1.09 -0.97 1.41 2.04 -0.74 -2.58 117.51 118.29 1vgq h ILE 324 Ca -0.01 -0.26 0.16 0.00 1.00 0.00 0.00 64.86 65.75 1vgq h ILE 324 Cb 1.19 0.25 -0.09 0.00 -0.74 0.00 0.00 36.82 37.43 1vgq h ILE 324 CO 0.12 0.14 0.61 -0.08 0.00 0.00 0.00 178.15 178.95 1vgq h GLU 325 N 0.77 0.77 -1.04 2.37 4.81 -1.15 -1.20 114.58 119.92 1vgq h GLU 325 Ca 0.25 -0.05 0.26 0.00 -0.13 0.00 0.00 59.36 59.70 1vgq h GLU 325 Cb 0.01 -0.17 -0.10 0.00 0.63 0.00 0.00 28.75 29.11 1vgq h GLU 325 CO -0.10 0.51 0.66 1.15 -0.73 0.00 0.00 179.01 180.51 1vgq h THR 326 N 0.80 0.53 0.00 0.32 2.02 -1.35 -1.04 112.91 114.19 1vgq h THR 326 Ca 0.52 -0.15 0.00 0.00 0.77 0.00 0.00 66.41 67.55 1vgq h THR 326 Cb 0.75 0.06 0.00 0.00 -1.74 0.00 0.00 68.15 67.22 1vgq h THR 326 CO -0.29 0.08 0.00 0.29 0.37 0.00 0.00 175.52 175.97 1vgq n LYS 327 N -4.67 0.09 0.00 6.66 4.76 -0.45 -3.26 118.16 121.29 1vgq n LYS 327 Ca 0.26 0.13 0.09 0.00 -2.87 0.00 0.00 58.31 55.91 1vgq n LYS 327 Cb 0.86 -1.50 0.07 0.00 -1.84 0.00 0.00 35.03 32.61 1vgq n LYS 327 CO 0.00 0.00 0.00 1.19 -1.37 0.00 0.00 177.40 177.22 1vgq n PHE 328 N -1.43 0.00 -0.26 2.13 3.72 -0.39 -4.64 117.46 116.58 1vgq n PHE 328 Ca 0.06 0.00 0.19 0.00 -0.05 0.00 0.00 57.45 57.66 1vgq n PHE 328 Cb 0.22 0.00 0.50 0.00 -0.94 0.00 0.00 39.48 39.26 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 3.50 2.19 -0.34 4.37 0.00 -1.57 -2.51 119.26 124.90 1vgq h ALA 329 Ca 0.00 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1vgq h ALA 329 Cb 0.74 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.51 1vgq h ALA 329 CO 0.00 -0.50 0.00 -0.25 0.00 0.00 0.00 179.25 178.50 1vgq n ASP 330 N -4.53 3.43 -4.16 0.00 8.00 -1.26 -3.70 116.55 114.32 1vgq n ASP 330 Ca 0.20 -2.41 -0.26 0.00 0.71 0.00 0.00 54.79 53.04 1vgq n ASP 330 Cb 0.72 -0.37 -0.16 0.00 -0.02 0.00 0.00 41.12 41.29 1vgq n ASP 330 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 1vgq s LYS 331 N -1.73 1.63 0.94 -1.24 1.02 -0.95 -4.91 119.74 114.50 1vgq s LYS 331 Ca 0.32 -0.64 -0.13 0.00 0.02 0.00 0.00 55.97 55.54 1vgq s LYS 331 Cb 0.22 -1.50 0.16 0.00 -0.52 0.00 0.00 37.83 36.19 1vgq s LYS 331 CO 0.14 0.33 1.13 0.16 -0.92 0.00 0.00 175.35 176.20 1vgq s ASP 332 N -0.24 3.19 0.49 2.83 1.47 -1.26 -1.04 116.67 122.10 1vgq s ASP 332 Ca 0.03 0.97 0.18 0.00 1.18 0.00 0.00 52.55 54.91 1vgq s ASP 332 Cb -0.09 -1.54 1.19 0.00 -0.34 0.00 0.00 42.92 42.14 1vgq s ASP 332 CO 0.01 -2.75 2.06 0.07 0.68 0.00 0.00 175.17 175.23 1vgq h LYS 333 N -1.64 0.00 0.02 2.11 2.10 -1.88 -1.79 116.57 115.50 1vgq h LYS 333 Ca -0.51 0.00 -0.25 0.00 -2.00 0.00 0.00 60.65 57.89 1vgq h LYS 333 Cb 1.33 0.00 0.02 0.00 -0.90 0.00 0.00 32.23 32.68 1vgq h LYS 333 CO 0.59 0.12 -1.00 0.74 -2.00 0.00 0.00 179.45 177.91 1vgq h PHE 334 N 0.00 0.96 -0.74 0.07 -1.00 -1.94 -1.87 116.94 112.42 1vgq h PHE 334 Ca -0.00 -0.54 -0.01 0.00 2.81 0.00 0.00 57.97 60.23 1vgq h PHE 334 Cb 0.23 -0.10 -0.04 0.00 3.61 0.00 0.00 35.95 39.65 1vgq h PHE 334 CO 0.00 1.38 0.43 0.93 -1.61 0.00 0.00 178.31 179.44 1vgq h GLU 335 N 0.27 1.01 -0.46 1.51 5.08 -1.83 -1.39 114.58 118.77 1vgq h GLU 335 Ca -0.13 -0.10 -0.09 0.00 -1.00 0.00 0.00 59.36 58.04 1vgq h GLU 335 Cb 1.67 -0.21 -0.02 0.00 0.50 0.00 0.00 28.75 30.70 1vgq h GLU 335 CO 0.20 0.73 -0.06 0.28 -1.00 0.00 0.00 179.01 179.15 1vgq h VAL 336 N 1.01 1.27 -0.73 3.13 2.07 -1.37 -0.62 116.25 121.01 1vgq h VAL 336 Ca 0.26 -1.16 0.03 0.00 0.82 0.00 0.00 66.70 66.66 1vgq h VAL 336 Cb -0.01 1.09 -0.05 0.00 -1.52 0.00 0.00 31.29 30.81 1vgq h VAL 336 CO -0.05 0.40 0.46 0.74 0.02 0.00 0.00 177.57 179.14 1vgq h THR 337 N 0.69 1.09 -0.30 2.57 2.02 -1.11 -0.22 112.91 117.64 1vgq h THR 337 Ca 0.12 -0.30 -0.14 0.00 0.77 0.00 0.00 66.41 66.85 1vgq h THR 337 Cb 0.59 0.13 -0.00 0.00 -1.74 0.00 0.00 68.15 67.12 1vgq h THR 337 CO 0.04 0.16 -0.37 -0.33 0.37 0.00 0.00 175.52 175.39 1vgq h GLU 338 N 0.89 0.78 -0.03 6.66 4.39 -1.06 -1.28 114.58 124.92 1vgq h GLU 338 Ca 0.30 -0.44 0.00 0.00 0.34 0.00 0.00 59.36 59.56 1vgq h GLU 338 Cb 0.03 0.03 -0.00 0.00 -0.10 0.00 0.00 28.75 28.71 1vgq h GLU 338 CO -0.12 1.07 0.01 2.35 -1.16 0.00 0.00 179.01 181.16 1vgq h TRP 339 N 0.55 0.01 -0.52 4.33 7.01 -0.87 -2.56 115.95 123.91 1vgq h TRP 339 Ca 0.04 0.00 -0.04 0.00 2.11 0.00 0.00 58.89 61.01 1vgq h TRP 339 Cb 0.95 0.00 -0.02 0.00 -2.10 0.00 0.00 29.16 27.99 1vgq h TRP 339 CO 0.07 0.00 0.17 0.00 -2.79 0.00 0.00 178.44 175.90 1vgq h ALA 340 N 1.02 1.33 -0.53 2.65 0.00 -1.00 -2.63 119.26 120.10 1vgq h ALA 340 Ca 0.01 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 1vgq h ALA 340 Cb 0.01 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.56 1vgq h ALA 340 CO -0.02 0.49 0.31 0.00 0.00 0.00 0.00 179.25 180.02 1vgq h ALA 341 N 1.44 1.54 -0.79 0.00 0.00 -0.88 -1.83 119.26 118.74 1vgq h ALA 341 Ca 0.17 -0.07 0.16 0.00 0.00 0.00 0.00 54.91 55.18 1vgq h ALA 341 Cb 0.21 -0.22 -0.05 0.00 0.00 0.00 0.00 17.79 17.73 1vgq h ALA 341 CO -0.01 0.39 0.53 1.96 0.00 0.00 0.00 179.25 182.12 1vgq h GLN 342 N 0.73 0.38 -0.01 0.00 4.20 -1.07 -1.28 115.11 118.06 1vgq h GLN 342 Ca 0.19 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.88 1vgq h GLN 342 Cb -0.01 -0.09 0.00 0.00 0.30 0.00 0.00 27.48 27.69 1vgq h GLN 342 CO -0.03 0.25 -0.19 0.66 -0.67 0.00 0.00 178.83 178.85 1vgq n TYR 343 N -4.48 0.00 -1.05 2.96 4.01 -0.74 -4.96 117.16 112.91 1vgq n TYR 343 Ca 0.15 0.00 -0.02 0.00 -0.16 0.00 0.00 57.90 57.88 1vgq n TYR 343 Cb 0.58 -0.08 -0.01 0.00 -0.31 0.00 0.00 39.34 39.53 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 1.30 0.53 3.66 2.72 0.00 -0.48 -4.99 105.19 107.93 1vgq n GLY 344 Ca 0.14 -0.46 -0.42 0.00 0.00 0.00 0.00 46.02 45.28 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 -1.98 4.83 -0.11 -0.61 1.01 -0.91 -4.97 121.20 118.45 1vgq s ILE 345 Ca 0.00 1.72 -0.31 0.00 0.00 0.00 0.00 60.65 62.06 1vgq s ILE 345 Cb 0.00 -4.18 -0.09 0.00 0.01 0.00 0.00 42.46 38.20 1vgq s ILE 345 CO 0.00 -0.03 2.04 -2.65 0.00 0.00 0.00 174.94 174.30 1vgq n PRO 346 N 5.58 2.22 -3.64 2.79 -0.02 -1.26 -4.38 135.00 136.29 1vgq n PRO 346 Ca 0.06 0.75 -0.05 0.00 -2.02 0.00 0.00 63.50 62.25 1vgq n PRO 346 Cb 0.48 -2.91 -0.07 0.00 -0.02 0.00 0.00 33.50 30.98 1vgq n PRO 346 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1vgq s GLY 348 N 0.94 -0.30 0.53 0.00 0.00 -0.87 -4.89 107.32 102.73 1vgq s GLY 348 Ca -0.05 0.04 -0.16 0.00 0.00 0.00 0.00 44.72 44.55 1vgq s GLY 348 CO -0.12 -0.13 1.00 2.56 0.00 0.00 0.00 173.10 176.41 1vgq s PRO 349 N -3.82 3.85 -0.58 2.90 0.04 -1.26 -0.41 135.00 135.72 1vgq s PRO 349 Ca 0.05 0.96 -0.28 0.00 0.04 0.00 0.00 61.00 61.77 1vgq s PRO 349 Cb -0.01 -2.12 0.02 0.00 0.04 0.00 0.00 34.50 32.43 1vgq s PRO 349 CO -0.07 -0.35 1.37 0.08 0.04 0.00 0.00 177.00 178.07 1vgq s VAL 350 N -2.67 3.81 -0.08 -0.36 1.01 -0.71 -4.81 120.40 116.59 1vgq s VAL 350 Ca 0.59 0.67 -0.30 0.00 0.00 0.00 0.00 61.98 62.94 1vgq s VAL 350 Cb -0.11 -4.53 -0.02 0.00 0.00 0.00 0.00 36.38 31.73 1vgq s VAL 350 CO 0.34 -1.26 1.06 -0.04 0.00 0.00 0.00 175.10 175.20 1vgq s MET 351 N 5.48 4.41 0.60 2.72 -1.94 -1.26 -4.77 119.30 124.55 1vgq s MET 351 Ca 0.49 1.48 -0.15 0.00 -1.71 0.00 0.00 55.69 55.80 1vgq s MET 351 Cb -0.10 -3.53 -0.03 0.00 2.01 0.00 0.00 34.83 33.17 1vgq s MET 351 CO 0.24 -0.33 1.05 -1.54 -0.01 0.00 0.00 175.02 174.43 1vgq s SER 352 N 1.19 5.81 0.42 3.03 1.04 -1.26 -4.89 113.70 119.04 1vgq s SER 352 Ca 0.51 1.74 0.08 0.00 0.48 0.00 0.00 55.95 58.76 1vgq s SER 352 Cb -0.20 -2.52 0.91 0.00 0.10 0.00 0.00 66.02 64.30 1vgq s SER 352 CO 0.20 -1.15 2.07 0.24 0.98 0.00 0.00 173.24 175.58 1vgq h MET 353 N 0.26 0.48 0.02 4.02 2.86 -1.99 -0.43 114.93 120.16 1vgq h MET 353 Ca -0.46 -0.03 -0.00 0.00 -2.06 0.00 0.00 59.70 57.15 1vgq h MET 353 Cb 1.21 -0.11 0.00 0.00 0.06 0.00 0.00 31.60 32.77 1vgq h MET 353 CO 0.58 0.32 -0.01 -0.22 1.06 0.00 0.00 176.91 178.63 1vgq h LYS 354 N 0.49 -0.03 -0.89 1.72 3.64 -1.99 -0.66 116.57 118.85 1vgq h LYS 354 Ca 0.13 0.00 0.09 0.00 -1.27 0.00 0.00 60.65 59.60 1vgq h LYS 354 Cb -0.05 0.01 -0.07 0.00 -0.41 0.00 0.00 32.23 31.70 1vgq h LYS 354 CO -0.03 0.15 0.54 0.93 -2.27 0.00 0.00 179.45 178.77 1vgq h GLU 355 N -0.21 0.89 -0.39 1.90 5.08 -1.86 -2.80 114.58 117.18 1vgq h GLU 355 Ca -0.00 -0.05 -0.15 0.00 -1.00 0.00 0.00 59.36 58.15 1vgq h GLU 355 Cb 0.20 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 1vgq h GLU 355 CO 0.01 0.59 -0.36 -0.07 -1.00 0.00 0.00 179.01 178.18 1vgq h LEU 356 N 0.91 0.98 -1.90 1.33 4.07 -0.81 -1.39 115.31 118.51 1vgq h LEU 356 Ca 0.42 -0.44 -0.02 0.00 0.08 0.00 0.00 57.88 57.92 1vgq h LEU 356 Cb 0.32 -0.28 -0.00 0.00 1.08 0.00 0.00 40.66 41.78 1vgq h LEU 356 CO -0.23 1.23 -0.10 0.00 -1.08 0.00 0.00 178.44 178.26 1vgq h ALA 357 N 0.82 1.66 -0.07 1.53 0.00 -0.86 -3.02 119.26 119.31 1vgq h ALA 357 Ca 0.07 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1vgq h ALA 357 Cb 0.94 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.72 1vgq h ALA 357 CO 0.09 0.13 0.00 0.72 0.00 0.00 0.00 179.25 180.19 1vgq n HIS 358 N -4.17 0.13 -2.01 0.00 8.25 -1.15 -5.02 115.22 111.25 1vgq n HIS 358 Ca -0.03 -0.60 -0.42 0.00 -0.26 0.00 0.00 57.72 56.41 1vgq n HIS 358 Cb 0.18 -0.08 -0.03 0.00 1.12 0.00 0.00 29.99 31.19 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 -1.36 6.65 0.32 0.41 2.15 -0.53 -4.93 116.67 119.39 1vgq s ASP 359 Ca 0.11 2.21 -0.00 0.00 0.43 0.00 0.00 52.55 55.31 1vgq s ASP 359 Cb 0.08 -2.53 0.53 0.00 -0.30 0.00 0.00 42.92 40.70 1vgq s ASP 359 CO 0.04 -0.94 1.97 -0.65 -0.17 0.00 0.00 175.17 175.42 1vgq h PRO 360 N 9.59 0.94 -0.31 4.34 0.11 -1.92 -2.98 132.00 141.77 1vgq h PRO 360 Ca -0.39 -0.07 -0.00 0.00 0.11 0.00 0.00 66.00 65.64 1vgq h PRO 360 Cb 1.18 -0.21 -0.02 0.00 0.11 0.00 0.00 31.00 32.07 1vgq h PRO 360 CO 0.96 0.65 0.18 0.77 -0.21 0.00 0.00 178.00 180.34 1vgq h SER 361 N 0.96 0.39 0.23 -2.05 0.02 -1.98 -0.87 113.55 110.25 1vgq h SER 361 Ca 0.26 -0.07 -0.09 0.00 -0.84 0.00 0.00 61.79 61.05 1vgq h SER 361 Cb -0.07 -0.10 -0.01 0.00 0.14 0.00 0.00 62.40 62.36 1vgq h SER 361 CO -0.05 0.34 -0.34 -0.07 -1.14 0.00 0.00 176.83 175.57 1vgq h LEU 362 N 0.40 0.16 -0.26 5.07 3.38 -1.90 -1.24 115.31 120.92 1vgq h LEU 362 Ca 0.11 -0.06 -0.17 0.00 0.09 0.00 0.00 57.88 57.85 1vgq h LEU 362 Cb 0.04 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 40.74 1vgq h LEU 362 CO -0.02 0.50 -0.52 1.56 0.09 0.00 0.00 178.44 180.06 1vgq h GLN 363 N 0.14 0.82 -0.89 1.13 4.20 -1.37 -0.57 115.11 118.58 1vgq h GLN 363 Ca 0.02 -0.53 -0.01 0.00 0.06 0.00 0.00 58.65 58.19 1vgq h GLN 363 Cb 0.68 0.06 -0.04 0.00 0.30 0.00 0.00 27.48 28.48 1vgq h GLN 363 CO 0.05 1.16 0.53 -0.22 -0.67 0.00 0.00 178.83 179.67 1vgq h LYS 364 N 0.58 1.21 -0.01 1.46 3.64 -0.57 -2.49 116.57 120.39 1vgq h LYS 364 Ca 0.01 -0.12 0.00 0.00 -1.27 0.00 0.00 60.65 59.27 1vgq h LYS 364 Cb 1.13 -0.25 0.00 0.00 -0.41 0.00 0.00 32.23 32.70 1vgq h LYS 364 CO 0.12 0.86 -0.09 1.33 -2.27 0.00 0.00 179.45 179.40 1vgq n VAL 365 N -4.39 0.00 -1.34 2.00 0.24 -0.52 -4.92 118.33 109.40 1vgq n VAL 365 Ca 0.09 -0.15 -0.01 0.00 -2.04 0.00 0.00 64.34 62.23 1vgq n VAL 365 Cb 0.07 0.22 -0.00 0.00 -1.47 0.00 0.00 33.84 32.65 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 1.22 0.42 0.13 7.63 0.00 -0.94 -4.95 105.19 108.69 1vgq n GLY 366 Ca 0.17 -0.98 -0.19 0.00 0.00 0.00 0.00 46.02 45.02 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 -3.29 1.68 -3.76 2.61 -1.04 -0.27 -4.14 114.28 106.08 1vgq n THR 367 Ca -0.01 -0.66 -0.37 0.00 -2.04 0.00 0.00 64.05 60.97 1vgq n THR 367 Cb 0.18 -1.52 -0.11 0.00 -1.82 0.00 0.00 70.33 67.06 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 -2.55 4.71 -0.05 12.58 1.01 -0.88 -0.42 120.40 134.79 1vgq s VAL 368 Ca -0.22 -0.04 0.04 0.00 0.00 0.00 0.00 61.98 61.76 1vgq s VAL 368 Cb 0.07 -3.20 -0.00 0.00 0.00 0.00 0.00 36.38 33.25 1vgq s VAL 368 CO 0.74 0.34 -0.17 -0.69 0.00 0.00 0.00 175.10 175.32 1vgq s VAL 369 N 1.40 1.41 -0.37 2.92 1.01 -0.02 -3.97 120.40 122.77 1vgq s VAL 369 Ca 0.06 -0.69 -0.28 0.00 0.00 0.00 0.00 61.98 61.07 1vgq s VAL 369 Cb -0.15 -1.22 0.02 0.00 0.00 0.00 0.00 36.38 35.03 1vgq s VAL 369 CO 0.05 0.41 1.03 -0.70 0.00 0.00 0.00 175.10 175.89 1vgq s GLU 370 N 0.16 3.91 -0.07 2.72 2.12 -1.26 -0.71 118.70 125.57 1vgq s GLU 370 Ca -0.07 0.78 -0.26 0.00 0.36 0.00 0.00 54.97 55.78 1vgq s GLU 370 Cb -0.13 -3.80 -0.03 0.00 0.26 0.00 0.00 34.13 30.44 1vgq s GLU 370 CO 0.03 -1.01 0.84 0.08 -0.54 0.00 0.00 175.26 174.65 1vgq s VAL 371 N 3.74 4.94 -0.32 3.70 1.01 0.77 -4.95 120.40 129.28 1vgq s VAL 371 Ca 0.43 1.72 -0.29 0.00 0.00 0.00 0.00 61.98 63.84 1vgq s VAL 371 Cb -0.11 -4.17 0.01 0.00 0.00 0.00 0.00 36.38 32.11 1vgq s VAL 371 CO 0.20 0.15 1.24 -0.69 0.00 0.00 0.00 175.10 176.00 1vgq s VAL 372 N 1.26 4.22 -0.32 2.92 1.01 -1.26 -2.56 120.40 125.67 1vgq s VAL 372 Ca 0.43 1.37 -0.01 0.00 0.00 0.00 0.00 61.98 63.77 1vgq s VAL 372 Cb -0.18 -4.25 0.11 0.00 0.00 0.00 0.00 36.38 32.05 1vgq s VAL 372 CO 0.20 -0.52 0.13 -0.62 0.00 0.00 0.00 175.10 174.28 1vgq s ASP 373 N 2.55 3.75 0.44 3.32 -1.08 -1.26 -4.22 116.67 120.17 1vgq s ASP 373 Ca 0.53 -1.66 0.24 0.00 -0.52 0.00 0.00 52.55 51.14 1vgq s ASP 373 Cb -0.15 -0.67 0.91 0.00 -1.46 0.00 0.00 42.92 41.55 1vgq s ASP 373 CO 0.22 -0.40 1.82 -0.33 0.52 0.00 0.00 175.17 177.00 1vgq h GLU 374 N 7.97 0.00 0.07 4.34 4.39 -1.94 0.06 114.58 129.47 1vgq h GLU 374 Ca -0.13 0.00 -0.13 0.00 0.34 0.00 0.00 59.36 59.45 1vgq h GLU 374 Cb 1.00 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 29.66 1vgq h GLU 374 CO 0.44 0.22 -0.54 0.82 -1.16 0.00 0.00 179.01 178.79 1vgq h ILE 375 N 0.00 1.56 -0.01 3.13 2.04 -2.01 -3.38 117.51 118.84 1vgq h ILE 375 Ca -0.00 -2.33 0.00 0.00 1.00 0.00 0.00 64.86 63.53 1vgq h ILE 375 Cb 0.75 3.06 0.00 0.00 -0.74 0.00 0.00 36.82 39.90 1vgq h ILE 375 CO 0.03 0.65 -0.61 0.54 0.00 0.00 0.00 178.15 178.76 1vgq n ARG 376 N -4.29 1.51 0.00 2.37 1.74 -1.23 -5.09 116.66 111.68 1vgq n ARG 376 Ca -0.12 -0.38 0.00 0.00 -0.77 0.00 0.00 57.85 56.59 1vgq n ARG 376 Cb 0.68 -1.31 0.00 0.00 -1.02 0.00 0.00 32.46 30.82 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 1.32 -0.84 3.71 -0.13 0.00 -0.00 -5.01 105.19 104.23 1vgq n GLY 377 Ca 0.05 -1.46 -0.36 0.00 0.00 0.00 0.00 46.02 44.26 1vgq n GLY 377 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1vgq n ASN 378 N -0.87 1.60 -3.96 1.61 4.13 -1.18 -4.42 115.26 112.18 1vgq n ASN 378 Ca 0.00 0.73 -0.09 0.00 1.68 0.00 0.00 54.58 56.90 1vgq n ASN 378 Cb 0.00 -1.53 -0.08 0.00 -1.54 0.00 0.00 39.78 36.63 1vgq n ASN 378 CO 0.00 0.00 0.00 -1.38 0.28 0.00 0.00 177.26 176.16 1vgq s HIS 379 N -1.69 0.38 0.25 3.10 -3.43 -1.06 -4.95 115.29 107.89 1vgq s HIS 379 Ca 0.79 -0.77 -0.12 0.00 -0.80 0.00 0.00 55.06 54.15 1vgq s HIS 379 Cb -0.34 -0.12 -0.08 0.00 -1.43 0.00 0.00 32.58 30.61 1vgq s HIS 379 CO 0.45 -0.63 0.61 -0.51 -2.00 0.00 0.00 174.74 172.65 1vgq s LEU 380 N -2.94 4.16 0.22 5.38 1.43 -1.26 -0.16 118.68 125.50 1vgq s LEU 380 Ca 0.14 1.06 -0.03 0.00 -1.03 0.00 0.00 54.13 54.27 1vgq s LEU 380 Cb 0.04 -3.76 -0.03 0.00 0.03 0.00 0.00 46.19 42.47 1vgq s LEU 380 CO -0.03 -0.09 0.21 0.28 0.23 0.00 0.00 176.35 176.95 1vgq s THR 381 N -1.83 0.00 -0.05 5.49 -1.32 0.11 -4.89 115.64 113.16 1vgq s THR 381 Ca 0.48 -1.88 -0.22 0.00 -1.21 0.00 0.00 61.69 58.86 1vgq s THR 381 Cb -0.11 -2.45 -0.04 0.00 -1.51 0.00 0.00 72.50 68.38 1vgq s THR 381 CO 0.20 0.00 0.65 -0.69 -2.21 0.00 0.00 174.62 172.57 1vgq s VAL 382 N -4.06 5.00 0.00 5.08 1.01 -1.26 -0.85 120.40 125.33 1vgq s VAL 382 Ca 0.36 1.35 0.00 0.00 0.00 0.00 0.00 61.98 63.69 1vgq s VAL 382 Cb 0.05 -3.99 0.00 0.00 0.00 0.00 0.00 36.38 32.44 1vgq s VAL 382 CO 0.13 0.31 0.00 0.61 0.00 0.00 0.00 175.10 176.15 1vgq n GLY 383 N 2.90 0.57 3.68 4.51 0.00 0.44 -4.90 105.19 112.39 1vgq n GLY 383 Ca -0.03 -1.74 -0.42 0.00 0.00 0.00 0.00 46.02 43.82 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 -3.35 3.59 -1.41 4.61 0.00 -1.26 -4.91 121.76 119.02 1vgq s ALA 384 Ca 0.00 0.65 0.27 0.00 0.00 0.00 0.00 51.96 52.89 1vgq s ALA 384 Cb 0.00 -3.59 1.37 0.00 0.00 0.00 0.00 23.12 20.90 1vgq s ALA 384 CO 0.00 -1.00 1.93 -0.35 0.00 0.00 0.00 175.76 176.34 1vgq n PRO 385 N 5.91 0.37 -4.19 0.00 -0.04 -1.26 -4.65 135.00 131.14 1vgq n PRO 385 Ca 0.13 0.03 -0.34 0.00 -0.04 0.00 0.00 63.50 63.28 1vgq n PRO 385 Cb 0.45 -1.50 -0.11 0.00 -0.04 0.00 0.00 33.50 32.30 1vgq n PRO 385 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 1vgq s PHE 386 N -2.59 3.11 -0.17 0.54 0.40 -1.26 -5.10 117.98 112.92 1vgq s PHE 386 Ca 0.25 -0.18 -0.05 0.00 -0.60 0.00 0.00 56.93 56.36 1vgq s PHE 386 Cb 0.18 -2.03 -0.03 0.00 0.51 0.00 0.00 43.02 41.66 1vgq s PHE 386 CO 0.42 0.00 -0.01 0.15 0.70 0.00 0.00 175.22 176.48 1vgq s LYS 387 N 0.48 3.73 0.03 0.44 -0.14 -1.26 -5.06 119.74 117.97 1vgq s LYS 387 Ca -0.01 -0.48 0.06 0.00 -1.36 0.00 0.00 55.97 54.19 1vgq s LYS 387 Cb -0.14 -3.01 -0.03 0.00 -1.68 0.00 0.00 37.83 32.97 1vgq s LYS 387 CO 0.02 0.21 -0.15 -0.06 -0.76 0.00 0.00 175.35 174.61 1vgq s PHE 388 N 0.47 2.65 0.26 3.18 0.40 -1.26 -5.04 117.98 118.64 1vgq s PHE 388 Ca -0.02 -0.20 0.20 0.00 -0.60 0.00 0.00 56.93 56.31 1vgq s PHE 388 Cb -0.14 -1.50 0.87 0.00 0.51 0.00 0.00 43.02 42.76 1vgq s PHE 388 CO 0.02 0.29 1.83 0.66 0.70 0.00 0.00 175.22 178.72 1vgq h SER 389 N 4.52 0.00 -0.35 1.36 4.64 -2.03 -3.30 113.55 118.39 1vgq h SER 389 Ca -0.48 0.00 -0.27 0.00 -0.47 0.00 0.00 61.79 60.57 1vgq h SER 389 Cb 1.16 0.00 -0.27 0.00 -0.31 0.00 0.00 62.40 62.98 1vgq h SER 389 CO 0.49 0.31 -0.77 0.61 -0.87 0.00 0.00 176.83 176.60 1vgq n GLY 390 N -0.12 4.67 3.64 -0.77 0.00 -1.26 -5.03 105.19 106.32 1vgq n GLY 390 Ca -0.01 -1.75 -0.03 0.00 0.00 0.00 0.00 46.02 44.23 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 -3.06 -0.39 -0.10 1.61 5.36 -1.25 -4.69 117.98 115.48 1vgq s PHE 391 Ca 0.41 0.82 0.03 0.00 -0.96 0.00 0.00 56.93 57.23 1vgq s PHE 391 Cb 0.38 0.31 0.01 0.00 -0.34 0.00 0.00 43.02 43.38 1vgq s PHE 391 CO -0.04 -0.19 -0.19 -0.65 -1.46 0.00 0.00 175.22 172.70 1vgq s GLN 392 N 0.84 2.50 0.53 10.12 -1.52 -1.26 -4.24 119.66 126.63 1vgq s GLN 392 Ca -0.04 -0.68 -0.21 0.00 -1.95 0.00 0.00 55.36 52.49 1vgq s GLN 392 Cb -0.04 -1.98 -0.06 0.00 -0.22 0.00 0.00 33.01 30.71 1vgq s GLN 392 CO -0.12 0.06 1.20 -2.14 -0.25 0.00 0.00 175.29 174.04 1vgq s PRO 393 N 0.63 3.35 -0.32 2.91 0.02 -1.26 -5.02 135.00 135.30 1vgq s PRO 393 Ca -0.14 1.83 0.03 0.00 0.02 0.00 0.00 61.00 62.75 1vgq s PRO 393 Cb -0.16 -2.16 0.09 0.00 0.02 0.00 0.00 34.50 32.29 1vgq s PRO 393 CO 0.04 -0.91 0.02 -1.21 -0.33 0.00 0.00 177.00 174.62 1vgq s GLU 394 N -3.04 1.54 -0.16 5.54 2.02 -1.26 -5.10 118.70 118.24 1vgq s GLU 394 Ca 0.71 -1.68 -0.22 0.00 0.02 0.00 0.00 54.97 53.80 1vgq s GLU 394 Cb -0.30 -3.02 -0.03 0.00 0.10 0.00 0.00 34.13 30.88 1vgq s GLU 394 CO 0.35 -0.87 0.66 0.42 0.02 0.00 0.00 175.26 175.83 1vgq s ILE 395 N 1.02 5.02 0.21 -1.63 1.01 -1.26 -4.97 121.20 120.61 1vgq s ILE 395 Ca 0.07 1.27 0.11 0.00 0.00 0.00 0.00 60.65 62.10 1vgq s ILE 395 Cb -0.19 -3.98 -0.04 0.00 0.01 0.00 0.00 42.46 38.26 1vgq s ILE 395 CO -0.09 0.14 -0.18 0.42 0.00 0.00 0.00 174.94 175.23 1vgq s THR 396 N 1.63 2.64 0.61 2.92 -4.23 -1.26 -4.73 115.64 113.22 1vgq s THR 396 Ca 0.31 -2.03 -0.19 0.00 -1.18 0.00 0.00 61.69 58.61 1vgq s THR 396 Cb -0.16 -2.31 -0.03 0.00 1.34 0.00 0.00 72.50 71.34 1vgq s THR 396 CO 0.12 -0.20 1.23 0.00 -0.54 0.00 0.00 174.62 175.24 1vgq s ARG 397 N -2.96 2.84 0.51 3.99 1.70 -1.26 -1.73 118.95 122.04 1vgq s ARG 397 Ca 0.24 1.90 -0.22 0.00 -0.47 0.00 0.00 55.73 57.18 1vgq s ARG 397 Cb -0.07 -1.90 -0.06 0.00 -0.57 0.00 0.00 34.95 32.34 1vgq s ARG 397 CO 0.13 -1.33 1.30 0.00 -1.08 0.00 0.00 175.30 174.32 1vgq s ALA 398 N -1.54 2.89 0.52 7.88 0.00 -1.26 -4.31 121.76 125.94 1vgq s ALA 398 Ca 0.79 1.21 -0.19 0.00 0.00 0.00 0.00 51.96 53.77 1vgq s ALA 398 Cb -0.32 -3.51 -0.07 0.00 0.00 0.00 0.00 23.12 19.22 1vgq s ALA 398 CO 0.35 -1.13 1.04 -1.25 0.00 0.00 0.00 175.76 174.77 1vgq s PRO 399 N -2.81 3.65 0.70 0.00 0.04 -1.26 -4.98 135.00 130.34 1vgq s PRO 399 Ca 0.68 1.30 -0.11 0.00 0.04 0.00 0.00 61.00 62.91 1vgq s PRO 399 Cb -0.37 -2.08 0.01 0.00 0.04 0.00 0.00 34.50 32.11 1vgq s PRO 399 CO 0.44 -0.55 1.07 -0.51 0.04 0.00 0.00 177.00 177.49 1vgq s LEU 400 N -3.82 3.16 -0.02 -3.56 1.43 -1.26 -4.95 118.68 109.66 1vgq s LEU 400 Ca 0.66 1.68 -0.30 0.00 -1.03 0.00 0.00 54.13 55.14 1vgq s LEU 400 Cb -0.16 -4.51 -0.07 0.00 0.03 0.00 0.00 46.19 41.49 1vgq s LEU 400 CO 0.26 -1.52 1.75 -0.22 0.23 0.00 0.00 176.35 176.85 1vgq s LEU 401 N -5.48 4.36 -0.25 1.79 2.96 -1.26 -2.15 118.68 118.65 1vgq s LEU 401 Ca 0.59 2.38 0.00 0.00 -0.22 0.00 0.00 54.13 56.89 1vgq s LEU 401 Cb -0.15 -3.53 0.00 0.00 0.50 0.00 0.00 46.19 43.01 1vgq s LEU 401 CO 0.53 -0.96 0.00 0.61 -1.32 0.00 0.00 176.35 175.20 1vgq n GLY 402 N 4.26 0.57 0.31 7.98 0.00 -1.26 -4.92 105.19 112.13 1vgq n GLY 402 Ca 0.18 -0.50 0.04 0.00 0.00 0.00 0.00 46.02 45.74 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 0.35 0.55 -0.16 1.61 4.81 -1.34 -2.63 114.58 117.77 1vgq h GLU 403 Ca -0.05 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.15 1vgq h GLU 403 Cb 0.24 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 29.50 1vgq h GLU 403 CO 0.07 0.37 0.00 0.72 -0.73 0.00 0.00 179.01 179.44 1vgq n HIS 404 N -4.47 0.22 -0.20 0.92 8.25 -0.35 -4.72 115.22 114.87 1vgq n HIS 404 Ca 0.03 -0.51 -0.06 0.00 -0.26 0.00 0.00 57.72 56.92 1vgq n HIS 404 Cb 0.06 -0.05 0.00 0.00 1.12 0.00 0.00 29.99 31.13 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 0.93 0.17 -0.17 1.59 2.02 -1.22 0.14 112.91 116.37 1vgq h THR 405 Ca 0.00 0.00 -0.16 0.00 0.77 0.00 0.00 66.41 67.02 1vgq h THR 405 Cb 0.63 0.17 0.00 0.00 -1.74 0.00 0.00 68.15 67.21 1vgq h THR 405 CO 0.00 0.00 -0.54 0.44 0.37 0.00 0.00 175.52 175.80 1vgq h ASP 406 N -0.17 0.77 -0.79 4.18 3.32 -1.84 -1.93 116.42 119.95 1vgq h ASP 406 Ca 0.22 -0.59 0.16 0.00 0.02 0.00 0.00 57.03 56.84 1vgq h ASP 406 Cb 0.55 -0.22 -0.11 0.00 0.22 0.00 0.00 39.33 39.77 1vgq h ASP 406 CO -0.67 1.23 0.30 -0.08 -1.72 0.00 0.00 179.24 178.29 1vgq h GLU 407 N 0.35 0.39 0.08 3.56 4.81 -1.80 -1.51 114.58 120.46 1vgq h GLU 407 Ca -0.02 -0.02 -0.23 0.00 -0.13 0.00 0.00 59.36 58.96 1vgq h GLU 407 Cb 1.16 -0.09 0.02 0.00 0.63 0.00 0.00 28.75 30.47 1vgq h GLU 407 CO 0.11 0.26 -0.93 0.28 -0.73 0.00 0.00 179.01 178.00 1vgq h VAL 408 N 0.40 1.38 -0.99 0.32 2.07 -0.82 -2.78 116.25 115.82 1vgq h VAL 408 Ca 0.45 -2.34 0.04 0.00 0.82 0.00 0.00 66.70 65.67 1vgq h VAL 408 Cb 0.75 2.76 -0.06 0.00 -1.52 0.00 0.00 31.29 33.22 1vgq h VAL 408 CO -0.46 0.69 0.65 -0.07 0.02 0.00 0.00 177.57 178.40 1vgq h LEU 409 N 0.01 1.07 -1.07 2.57 3.38 -1.23 -2.51 115.31 117.53 1vgq h LEU 409 Ca -0.14 -0.01 -0.05 0.00 0.09 0.00 0.00 57.88 57.78 1vgq h LEU 409 Cb 1.65 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 42.14 1vgq h LEU 409 CO 0.18 0.72 0.13 0.11 0.09 0.00 0.00 178.44 179.67 1vgq h LYS 410 N 1.23 0.79 0.00 1.13 1.57 -1.22 -2.57 116.57 117.50 1vgq h LYS 410 Ca 0.40 -0.16 -0.05 0.00 -1.87 0.00 0.00 60.65 58.98 1vgq h LYS 410 Cb 0.05 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.23 1vgq h LYS 410 CO -0.13 0.71 -0.22 0.93 -0.57 0.00 0.00 179.45 180.17 1vgq h GLU 411 N 0.77 0.00 -0.00 3.15 5.08 -1.17 -2.61 114.58 119.79 1vgq h GLU 411 Ca 0.17 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.53 1vgq h GLU 411 Cb 0.28 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.53 1vgq h GLU 411 CO -0.00 0.22 -0.04 1.28 -1.00 0.00 0.00 179.01 179.47 1vgq n LEU 412 N -3.68 0.13 0.00 1.33 4.77 -0.98 -4.92 117.00 113.65 1vgq n LEU 412 Ca -0.01 0.23 0.00 0.00 -0.03 0.00 0.00 56.01 56.19 1vgq n LEU 412 Cb 0.34 -0.28 0.00 0.00 -2.33 0.00 0.00 43.42 41.16 1vgq n LEU 412 CO 0.33 0.03 0.00 0.61 -1.33 0.00 0.00 177.39 177.03 1vgq n GLY 413 N 1.31 0.97 3.75 -0.72 0.00 -0.98 -5.08 105.19 104.43 1vgq n GLY 413 Ca 0.13 -0.02 -0.40 0.00 0.00 0.00 0.00 46.02 45.74 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 4.62 0.59 0.99 1.02 -1.16 -5.05 118.68 119.68 1vgq s LEU 414 Ca 0.00 1.99 -0.08 0.00 0.02 0.00 0.00 54.13 56.06 1vgq s LEU 414 Cb 0.00 -3.61 -0.01 0.00 0.02 0.00 0.00 46.19 42.59 1vgq s LEU 414 CO 0.00 0.09 0.93 1.51 0.02 0.00 0.00 176.35 178.90 1vgq s ASP 415 N -1.01 5.87 0.42 2.29 1.47 -1.26 -4.57 116.67 119.88 1vgq s ASP 415 Ca 0.42 0.98 0.22 0.00 1.18 0.00 0.00 52.55 55.35 1vgq s ASP 415 Cb -0.27 -2.04 1.21 0.00 -0.34 0.00 0.00 42.92 41.48 1vgq s ASP 415 CO 0.33 -0.95 1.76 0.44 0.68 0.00 0.00 175.17 177.44 1vgq h ASP 416 N -0.18 0.35 -0.25 2.11 5.19 -2.00 -2.16 116.42 119.49 1vgq h ASP 416 Ca -0.45 0.07 -0.14 0.00 -0.62 0.00 0.00 57.03 55.89 1vgq h ASP 416 Cb 1.23 0.02 -0.00 0.00 0.18 0.00 0.00 39.33 40.76 1vgq h ASP 416 CO 0.62 0.05 -0.38 0.00 -3.12 0.00 0.00 179.24 176.41 1vgq h ALA 417 N 1.59 0.38 0.00 3.45 0.00 -2.00 -2.85 119.26 119.82 1vgq h ALA 417 Ca 0.61 -0.44 -0.06 0.00 0.00 0.00 0.00 54.91 55.01 1vgq h ALA 417 Cb 1.72 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 19.43 1vgq h ALA 417 CO -0.26 0.46 -0.30 -0.22 0.00 0.00 0.00 179.25 178.92 1vgq h LYS 418 N 0.41 0.00 -0.27 0.00 3.64 -1.78 -2.19 116.57 116.38 1vgq h LYS 418 Ca 0.02 0.00 -0.09 0.00 -1.27 0.00 0.00 60.65 59.31 1vgq h LYS 418 Cb 0.97 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.78 1vgq h LYS 418 CO 0.09 0.30 -0.20 0.82 -2.27 0.00 0.00 179.45 178.19 1vgq h ILE 419 N 0.00 1.30 -0.86 2.00 2.04 -1.48 -1.88 117.51 118.64 1vgq h ILE 419 Ca -0.00 -1.33 0.03 0.00 1.00 0.00 0.00 64.86 64.56 1vgq h ILE 419 Cb 0.81 1.57 -0.05 0.00 -0.74 0.00 0.00 36.82 38.42 1vgq h ILE 419 CO 0.04 0.42 0.56 0.50 0.00 0.00 0.00 178.15 179.67 1vgq h LYS 420 N 0.34 1.04 -0.57 2.37 3.64 -1.38 -2.42 116.57 119.59 1vgq h LYS 420 Ca 0.05 -0.06 -0.09 0.00 -1.27 0.00 0.00 60.65 59.27 1vgq h LYS 420 Cb 0.74 -0.24 -0.02 0.00 -0.41 0.00 0.00 32.23 32.30 1vgq h LYS 420 CO 0.05 0.69 -0.02 1.49 -2.27 0.00 0.00 179.45 179.40 1vgq h GLU 421 N 1.08 1.01 -0.17 1.90 4.81 -1.21 -2.29 114.58 119.71 1vgq h GLU 421 Ca 0.34 -0.32 -0.17 0.00 -0.13 0.00 0.00 59.36 59.08 1vgq h GLU 421 Cb 0.01 -0.09 -0.00 0.00 0.63 0.00 0.00 28.75 29.29 1vgq h GLU 421 CO -0.10 1.00 -0.61 -0.07 -0.73 0.00 0.00 179.01 178.50 1vgq h LEU 422 N 0.92 0.65 -0.52 1.64 3.38 -1.10 -1.76 115.31 118.52 1vgq h LEU 422 Ca 0.16 -0.37 0.01 0.00 0.09 0.00 0.00 57.88 57.78 1vgq h LEU 422 Cb 0.56 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 41.09 1vgq h LEU 422 CO 0.03 1.10 0.33 0.45 0.09 0.00 0.00 178.44 180.45 1vgq h HIS 423 N 0.42 0.62 -0.42 1.13 3.86 -1.29 -2.29 115.15 117.19 1vgq h HIS 423 Ca -0.01 0.02 -0.08 0.00 -1.16 0.00 0.00 60.37 59.14 1vgq h HIS 423 Cb 1.18 -0.21 -0.01 0.00 1.06 0.00 0.00 27.41 29.42 1vgq h HIS 423 CO 0.05 0.38 -0.05 0.00 0.86 0.00 0.00 177.93 179.17 1vgq h ALA 424 N 1.21 0.57 0.00 2.45 0.00 -1.24 -2.82 119.26 119.44 1vgq h ALA 424 Ca 0.20 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1vgq h ALA 424 Cb -0.04 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.60 1vgq h ALA 424 CO -0.06 0.40 0.00 1.63 0.00 0.00 0.00 179.25 181.22 1vgq n LYS 425 N -4.36 0.41 -2.68 0.00 5.02 -0.68 -4.89 118.16 110.98 1vgq n LYS 425 Ca -0.01 0.06 -0.15 0.00 -2.02 0.00 0.00 58.31 56.19 1vgq n LYS 425 Cb 0.33 -1.50 0.02 0.00 -0.02 0.00 0.00 35.03 33.86 1vgq n LYS 425 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 1vgq n GLN 426 N -1.21 -2.95 0.10 1.97 6.02 -0.98 -4.90 117.38 115.43 1vgq n GLN 426 Ca 0.12 0.65 0.05 0.00 -0.01 0.00 0.00 57.00 57.81 1vgq n GLN 426 Cb 0.15 -4.94 -0.01 0.00 1.02 0.00 0.00 30.24 26.46 1vgq n GLN 426 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.06 176.33 1vgq h VAL 427 N -0.77 0.42 0.00 5.09 2.07 -1.68 -3.43 116.25 117.94 1vgq h VAL 427 Ca -0.36 -1.71 0.00 0.00 0.82 0.00 0.00 66.70 65.45 1vgq h VAL 427 Cb 1.25 2.00 0.00 0.00 -1.52 0.00 0.00 31.29 33.02 1vgq h VAL 427 CO 0.40 0.24 0.00 0.55 0.02 0.00 0.00 177.57 178.78