#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3gvx n ASP 2 N 0.00 -1.97 -3.82 1.96 8.00 -1.05 -4.51 116.55 115.17 3gvx n ASP 2 Ca 0.00 0.00 -0.13 0.00 0.71 0.00 0.00 54.79 55.37 3gvx n ASP 2 Cb 0.00 -0.99 -0.13 0.00 -0.02 0.00 0.00 41.12 39.98 3gvx n ASP 2 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3gvx s VAL 3 N 0.00 -0.01 -0.13 2.53 1.01 -0.46 -2.71 120.40 120.62 3gvx s VAL 3 Ca 0.00 0.04 0.00 0.00 0.00 0.00 0.00 61.98 62.03 3gvx s VAL 3 Cb 0.00 -0.17 0.02 0.00 0.00 0.00 0.00 36.38 36.23 3gvx s VAL 3 CO 0.00 0.02 -0.13 -0.47 0.00 0.00 0.00 175.10 174.52 3gvx s TYR 4 N 0.30 1.95 -0.53 5.22 5.04 0.11 -0.85 117.35 128.59 3gvx s TYR 4 Ca -0.02 -1.04 -0.19 0.00 -2.44 0.00 0.00 57.07 53.38 3gvx s TYR 4 Cb -0.03 -1.47 0.07 0.00 0.35 0.00 0.00 41.96 40.88 3gvx s TYR 4 CO -0.01 -0.59 0.67 0.08 -1.34 0.00 0.00 175.55 174.36 3gvx s VAL 5 N 1.44 4.82 -0.08 3.14 1.01 -0.62 -0.83 120.40 129.28 3gvx s VAL 5 Ca 0.03 -0.54 -0.02 0.00 0.00 0.00 0.00 61.98 61.45 3gvx s VAL 5 Cb -0.13 -4.36 -0.03 0.00 0.00 0.00 0.00 36.38 31.86 3gvx s VAL 5 CO -0.08 -0.91 2.48 -3.20 0.00 0.00 0.00 175.10 173.39 3gvx n ASN 6 N 6.33 5.59 -3.47 3.32 5.15 -0.48 -1.87 115.26 129.83 3gvx n ASN 6 Ca -0.06 -2.59 -0.10 0.00 -0.60 0.00 0.00 54.58 51.22 3gvx n ASN 6 Cb 0.45 -1.20 -0.02 0.00 -0.53 0.00 0.00 39.78 38.48 3gvx n ASN 6 CO 0.00 0.00 0.00 0.72 1.40 0.00 0.00 177.26 179.38 3gvx s PHE 7 N -0.17 -0.43 0.09 1.20 -0.71 -1.26 -4.76 117.98 111.95 3gvx s PHE 7 Ca 0.26 0.26 -0.31 0.00 -1.04 0.00 0.00 56.93 56.11 3gvx s PHE 7 Cb 0.15 0.55 -0.09 0.00 -1.21 0.00 0.00 43.02 42.42 3gvx s PHE 7 CO -0.02 -0.68 1.68 -2.14 -1.34 0.00 0.00 175.22 172.72 3gvx s PRO 8 N -3.41 4.18 0.00 1.99 0.02 -1.26 -4.35 135.00 132.17 3gvx s PRO 8 Ca 0.03 2.40 0.02 0.00 0.02 0.00 0.00 61.00 63.47 3gvx s PRO 8 Cb -0.01 -3.54 -0.01 0.00 0.02 0.00 0.00 34.50 30.96 3gvx s PRO 8 CO -0.11 -0.74 -0.07 0.00 -0.33 0.00 0.00 177.00 175.75 3gvx s ALA 9 N 2.47 0.55 0.65 -1.55 0.00 -1.26 -5.12 121.76 117.50 3gvx s ALA 9 Ca 0.75 -0.33 -0.02 0.00 0.00 0.00 0.00 51.96 52.36 3gvx s ALA 9 Cb -0.42 -0.12 0.06 0.00 0.00 0.00 0.00 23.12 22.64 3gvx s ALA 9 CO 0.33 0.12 0.39 -0.40 0.00 0.00 0.00 175.76 176.20 3gvx n ASP 10 N 2.77 0.36 0.16 0.00 5.68 -1.26 -4.82 116.55 119.43 3gvx n ASP 10 Ca -0.14 -1.34 0.03 0.00 -0.50 0.00 0.00 54.79 52.84 3gvx n ASP 10 Cb 0.57 -0.27 0.43 0.00 -1.14 0.00 0.00 41.12 40.71 3gvx n ASP 10 CO 0.00 0.00 0.00 1.23 -1.33 0.00 0.00 177.20 177.10 3gvx h GLY 11 N -0.33 0.16 0.79 6.12 0.00 -2.01 0.31 103.07 108.10 3gvx h GLY 11 Ca -0.13 -0.10 -0.02 0.00 0.00 0.00 0.00 47.33 47.08 3gvx h GLY 11 CO 0.12 0.09 -0.21 0.84 0.00 0.00 0.00 176.54 177.38 3gvx h HIS 12 N 0.14 -0.55 -0.36 5.60 6.17 -1.99 0.20 115.15 124.35 3gvx h HIS 12 Ca 0.03 -0.01 0.06 0.00 0.71 0.00 0.00 60.37 61.15 3gvx h HIS 12 Cb 0.37 0.18 -0.05 0.00 2.52 0.00 0.00 27.41 30.43 3gvx h HIS 12 CO 0.00 -0.25 0.07 0.28 0.71 0.00 0.00 177.93 178.74 3gvx h VAL 13 N -0.81 0.81 -0.70 5.26 2.07 -1.87 -2.12 116.25 118.89 3gvx h VAL 13 Ca -0.06 -0.06 0.06 0.00 0.82 0.00 0.00 66.70 67.46 3gvx h VAL 13 Cb 0.55 0.61 -0.06 0.00 -1.52 0.00 0.00 31.29 30.87 3gvx h VAL 13 CO 0.10 0.03 0.39 0.03 0.02 0.00 0.00 177.57 178.15 3gvx h ARG 14 N 0.19 0.70 0.17 1.57 3.08 -0.21 -0.80 114.38 119.08 3gvx h ARG 14 Ca 0.17 -0.04 -0.01 0.00 0.07 0.00 0.00 59.98 60.17 3gvx h ARG 14 Cb 0.20 -0.16 0.00 0.00 0.08 0.00 0.00 29.97 30.10 3gvx h ARG 14 CO -0.23 0.46 -0.08 1.49 -1.07 0.00 0.00 179.97 180.54 3gvx h GLU 15 N 0.72 -0.22 -0.60 0.04 4.81 -0.03 0.69 114.58 119.99 3gvx h GLU 15 Ca 0.31 0.01 0.12 0.00 -0.13 0.00 0.00 59.36 59.68 3gvx h GLU 15 Cb 0.19 0.05 -0.11 0.00 0.63 0.00 0.00 28.75 29.51 3gvx h GLU 15 CO -0.18 -0.08 -0.13 0.82 -0.73 0.00 0.00 179.01 178.71 3gvx h ILE 16 N -0.31 0.41 0.04 2.32 2.04 -1.13 0.12 117.51 121.01 3gvx h ILE 16 Ca -0.02 -0.01 0.02 0.00 1.00 0.00 0.00 64.86 65.85 3gvx h ILE 16 Cb 0.24 0.39 -0.03 0.00 -0.74 0.00 0.00 36.82 36.69 3gvx h ILE 16 CO 0.04 0.00 -0.15 0.00 0.00 0.00 0.00 178.15 178.04 3gvx h ALA 17 N 1.60 -0.21 -0.08 1.87 0.00 -0.73 0.10 119.26 121.81 3gvx h ALA 17 Ca 0.29 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.18 3gvx h ALA 17 Cb 0.45 0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.49 3gvx h ALA 17 CO -0.61 -0.65 -0.05 0.87 0.00 0.00 0.00 179.25 178.81 3gvx h LYS 18 N -0.27 0.11 0.05 0.00 1.57 0.63 0.43 116.57 119.10 3gvx h LYS 18 Ca 0.04 -0.01 -0.00 0.00 -1.87 0.00 0.00 60.65 58.80 3gvx h LYS 18 Cb 0.31 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.60 3gvx h LYS 18 CO -0.12 0.17 -0.02 1.15 -0.57 0.00 0.00 179.45 180.06 3gvx h THR 19 N 0.11 1.31 -0.51 -0.16 2.02 -0.18 -2.22 112.91 113.28 3gvx h THR 19 Ca 0.03 -1.55 -0.06 0.00 0.77 0.00 0.00 66.41 65.59 3gvx h THR 19 Cb 0.16 2.28 -0.02 0.00 -1.74 0.00 0.00 68.15 68.83 3gvx h THR 19 CO 0.01 0.37 0.09 0.58 0.37 0.00 0.00 175.52 176.94 3gvx h VAL 20 N -0.80 1.25 -0.87 3.16 2.07 -0.61 -3.16 116.25 117.29 3gvx h VAL 20 Ca -0.01 -0.92 -0.48 0.00 0.82 0.00 0.00 66.70 66.11 3gvx h VAL 20 Cb 0.65 0.86 -0.27 0.00 -1.52 0.00 0.00 31.29 31.02 3gvx h VAL 20 CO 0.01 0.33 0.51 0.18 0.02 0.00 0.00 177.57 178.62 3gvx n LEU 21 N -4.41 6.35 -4.64 2.57 4.77 0.15 -4.93 117.00 116.86 3gvx n LEU 21 Ca 0.01 -3.79 -0.43 0.00 -0.03 0.00 0.00 56.01 51.78 3gvx n LEU 21 Cb 0.25 -0.81 -0.03 0.00 -2.33 0.00 0.00 43.42 40.51 3gvx n LEU 21 CO 0.41 1.19 1.40 1.51 -1.33 0.00 0.00 177.39 180.57 3gvx s ASP 22 N -1.70 6.40 0.00 -1.43 1.47 -0.83 -1.70 116.67 118.88 3gvx s ASP 22 Ca 0.56 1.81 0.00 0.00 1.18 0.00 0.00 52.55 56.09 3gvx s ASP 22 Cb 0.47 -2.53 0.00 0.00 -0.34 0.00 0.00 42.92 40.52 3gvx s ASP 22 CO 0.07 -1.21 0.00 0.61 0.68 0.00 0.00 175.17 175.31 3gvx n GLY 23 N 4.59 1.40 3.13 2.12 0.00 -1.26 -5.07 105.19 110.10 3gvx n GLY 23 Ca 0.19 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.00 3gvx n GLY 23 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3gvx s PHE 24 N -2.00 1.23 0.02 1.61 0.40 -0.69 -3.53 117.98 115.02 3gvx s PHE 24 Ca 0.00 -0.32 -0.26 0.00 -0.60 0.00 0.00 56.93 55.75 3gvx s PHE 24 Cb 0.00 -0.75 -0.05 0.00 0.51 0.00 0.00 43.02 42.73 3gvx s PHE 24 CO 0.00 0.02 0.80 -0.51 0.70 0.00 0.00 175.22 176.23 3gvx s ASP 25 N -0.91 7.21 0.02 1.36 1.11 -1.26 -4.66 116.67 119.54 3gvx s ASP 25 Ca 0.03 1.45 0.03 0.00 0.18 0.00 0.00 52.55 54.24 3gvx s ASP 25 Cb -0.07 -2.48 -0.04 0.00 1.07 0.00 0.00 42.92 41.40 3gvx s ASP 25 CO 0.01 -0.07 -0.04 -0.76 1.18 0.00 0.00 175.17 175.49 3gvx s LEU 26 N 0.32 3.28 0.01 1.23 1.43 -1.26 -1.36 118.68 122.33 3gvx s LEU 26 Ca 0.41 -0.14 0.04 0.00 -1.03 0.00 0.00 54.13 53.41 3gvx s LEU 26 Cb -0.20 -1.92 -0.01 0.00 0.03 0.00 0.00 46.19 44.09 3gvx s LEU 26 CO 0.23 0.26 -0.12 -1.00 0.23 0.00 0.00 176.35 175.95 3gvx s HIS 27 N -1.08 1.04 0.01 0.29 3.76 -0.02 -4.94 115.29 114.35 3gvx s HIS 27 Ca 0.19 -0.25 0.08 0.00 -0.15 0.00 0.00 55.06 54.93 3gvx s HIS 27 Cb -0.11 -0.65 -0.02 0.00 1.11 0.00 0.00 32.58 32.90 3gvx s HIS 27 CO 0.10 -0.01 -0.23 -1.58 -0.85 0.00 0.00 174.74 172.18 3gvx s TRP 28 N -0.47 2.05 0.43 1.40 0.52 -1.26 -1.58 118.94 120.03 3gvx s TRP 28 Ca 0.03 -0.39 -0.26 0.00 0.02 0.00 0.00 56.10 55.50 3gvx s TRP 28 Cb -0.05 -1.28 -0.08 0.00 -1.15 0.00 0.00 33.47 30.90 3gvx s TRP 28 CO 0.00 0.02 1.39 -0.47 0.02 0.00 0.00 176.95 177.92 3gvx s TYR 29 N -0.65 2.57 -0.31 -1.98 5.04 -0.78 -0.07 117.35 121.17 3gvx s TYR 29 Ca 0.09 1.31 0.03 0.00 -2.44 0.00 0.00 57.07 56.05 3gvx s TYR 29 Cb -0.09 -3.85 0.45 0.00 0.35 0.00 0.00 41.96 38.82 3gvx s TYR 29 CO 0.00 -2.68 1.65 -0.35 -1.34 0.00 0.00 175.55 172.83 3gvx n PRO 30 N -0.08 1.87 -2.67 4.97 -0.04 -1.26 -4.75 135.00 133.04 3gvx n PRO 30 Ca 0.05 -2.06 -0.42 0.00 -0.04 0.00 0.00 63.50 61.02 3gvx n PRO 30 Cb 0.42 -1.81 0.01 0.00 -0.04 0.00 0.00 33.50 32.08 3gvx n PRO 30 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 3gvx n ASP 31 N -0.60 6.20 -4.34 3.54 8.00 0.89 -4.99 116.55 125.25 3gvx n ASP 31 Ca 0.41 -3.32 -0.43 0.00 0.71 0.00 0.00 54.79 52.15 3gvx n ASP 31 Cb 1.27 -1.34 -0.01 0.00 -0.02 0.00 0.00 41.12 41.03 3gvx n ASP 31 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3gvx n TYR 32 N 2.04 -1.51 -3.66 1.24 9.36 -1.26 -4.44 117.16 118.93 3gvx n TYR 32 Ca 0.35 0.70 -0.09 0.00 3.32 0.00 0.00 57.90 62.19 3gvx n TYR 32 Cb 0.33 -1.85 -0.08 0.00 -0.63 0.00 0.00 39.34 37.11 3gvx n TYR 32 CO 0.00 0.00 0.00 -0.47 0.22 0.00 0.00 176.86 176.61 3gvx s TYR 33 N -1.49 -0.88 -1.07 2.98 5.04 -1.26 -5.06 117.35 115.61 3gvx s TYR 33 Ca 0.61 1.82 -0.24 0.00 -2.44 0.00 0.00 57.07 56.82 3gvx s TYR 33 Cb -0.70 0.48 -0.09 0.00 0.35 0.00 0.00 41.96 41.99 3gvx s TYR 33 CO 0.61 -0.45 1.99 0.34 -1.34 0.00 0.00 175.55 176.69 3gvx s ASP 34 N 1.41 4.81 0.34 4.32 -1.08 -1.26 -4.78 116.67 120.44 3gvx s ASP 34 Ca -0.09 -1.21 0.07 0.00 -0.52 0.00 0.00 52.55 50.80 3gvx s ASP 34 Cb -0.06 -2.58 -0.01 0.00 -1.46 0.00 0.00 42.92 38.81 3gvx s ASP 34 CO -0.15 -3.23 0.47 0.00 0.52 0.00 0.00 175.17 172.78 3gvx s ALA 35 N 11.67 4.25 0.22 3.66 0.00 -1.26 -4.69 121.76 135.62 3gvx s ALA 35 Ca 0.72 -1.50 0.02 0.00 0.00 0.00 0.00 51.96 51.20 3gvx s ALA 35 Cb -0.04 -1.64 0.21 0.00 0.00 0.00 0.00 23.12 21.65 3gvx s ALA 35 CO 0.09 -0.06 1.54 0.93 0.00 0.00 0.00 175.76 178.27 3gvx h GLU 36 N 0.88 0.32 -6.24 0.00 5.08 -1.70 -3.25 114.58 109.69 3gvx h GLU 36 Ca -0.45 -0.22 -0.65 0.00 -1.00 0.00 0.00 59.36 57.04 3gvx h GLU 36 Cb 1.26 0.03 -0.30 0.00 0.50 0.00 0.00 28.75 30.24 3gvx h GLU 36 CO 0.52 0.82 -0.87 0.00 -1.00 0.00 0.00 179.01 178.48 3gvx s ALA 37 N -3.81 1.96 -0.06 3.43 0.00 -1.10 -1.35 121.76 120.82 3gvx s ALA 37 Ca -0.05 -1.00 0.02 0.00 0.00 0.00 0.00 51.96 50.93 3gvx s ALA 37 Cb 0.12 -0.52 0.01 0.00 0.00 0.00 0.00 23.12 22.73 3gvx s ALA 37 CO 0.81 0.46 -0.11 -1.14 0.00 0.00 0.00 175.76 175.78 3gvx s GLN 38 N -0.47 1.62 -0.17 0.00 0.74 -1.26 0.05 119.66 120.16 3gvx s GLN 38 Ca 0.07 -0.38 -0.06 0.00 0.05 0.00 0.00 55.36 55.04 3gvx s GLN 38 Cb -0.10 -1.35 -0.04 0.00 1.10 0.00 0.00 33.01 32.62 3gvx s GLN 38 CO -0.00 0.01 0.02 0.08 -0.55 0.00 0.00 175.29 174.86 3gvx s VAL 39 N 0.70 4.45 0.26 1.34 1.01 -0.01 0.30 120.40 128.44 3gvx s VAL 39 Ca -0.14 -0.16 0.02 0.00 0.00 0.00 0.00 61.98 61.70 3gvx s VAL 39 Cb -0.16 -2.98 -0.04 0.00 0.00 0.00 0.00 36.38 33.20 3gvx s VAL 39 CO 0.03 0.48 0.14 0.27 0.00 0.00 0.00 175.10 176.02 3gvx s ILE 40 N 0.31 0.29 -0.00 2.22 -4.36 0.32 -1.38 121.20 118.61 3gvx s ILE 40 Ca 0.01 -2.00 -0.01 0.00 -0.26 0.00 0.00 60.65 58.38 3gvx s ILE 40 Cb -0.13 -2.55 -0.00 0.00 1.25 0.00 0.00 42.46 41.03 3gvx s ILE 40 CO 0.01 0.00 -0.03 0.29 0.24 0.00 0.00 174.94 175.45 3gvx n LYS 41 N -0.46 0.04 -0.01 0.37 5.02 -1.26 -1.70 118.16 120.16 3gvx n LYS 41 Ca 0.01 0.02 -0.01 0.00 -2.02 0.00 0.00 58.31 56.31 3gvx n LYS 41 Cb 0.65 -0.33 -0.02 0.00 -0.02 0.00 0.00 35.03 35.32 3gvx n LYS 41 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 3gvx n ASP 42 N -2.81 4.52 -4.23 4.39 10.43 -1.26 -4.74 116.55 122.85 3gvx n ASP 42 Ca -0.01 0.00 -0.25 0.00 2.57 0.00 0.00 54.79 57.10 3gvx n ASP 42 Cb 0.04 0.57 -0.14 0.00 1.84 0.00 0.00 41.12 43.43 3gvx n ASP 42 CO 0.00 0.00 0.00 -0.13 -1.07 0.00 0.00 177.20 176.00 3gvx s ARG 43 N -2.05 1.36 0.37 -1.24 0.52 -1.26 -4.67 118.95 111.97 3gvx s ARG 43 Ca -0.01 -0.87 0.08 0.00 -0.52 0.00 0.00 55.73 54.41 3gvx s ARG 43 Cb 0.01 -1.43 -0.05 0.00 0.52 0.00 0.00 34.95 33.99 3gvx s ARG 43 CO 0.08 0.37 0.11 1.52 0.02 0.00 0.00 175.30 177.40 3gvx s TYR 44 N -0.74 2.62 -0.15 -0.53 -0.85 -1.26 -4.78 117.35 111.64 3gvx s TYR 44 Ca 0.07 -0.48 -0.02 0.00 -0.52 0.00 0.00 57.07 56.12 3gvx s TYR 44 Cb -0.08 -1.72 0.05 0.00 0.38 0.00 0.00 41.96 40.59 3gvx s TYR 44 CO 0.01 0.33 -0.00 0.08 -1.52 0.00 0.00 175.55 174.45 3gvx s VAL 45 N -2.53 0.67 0.32 -3.49 1.01 -1.26 -5.12 120.40 110.00 3gvx s VAL 45 Ca 0.38 -0.41 -0.29 0.00 0.00 0.00 0.00 61.98 61.67 3gvx s VAL 45 Cb 0.01 -0.99 -0.10 0.00 0.00 0.00 0.00 36.38 35.31 3gvx s VAL 45 CO 0.21 0.02 1.20 -0.76 0.00 0.00 0.00 175.10 175.78 3gvx s LEU 46 N 1.82 4.46 0.00 3.92 1.43 -1.26 -5.02 118.68 124.03 3gvx s LEU 46 Ca 0.01 2.48 0.00 0.00 -1.03 0.00 0.00 54.13 55.59 3gvx s LEU 46 Cb -0.15 -3.67 0.00 0.00 0.03 0.00 0.00 46.19 42.39 3gvx s LEU 46 CO -0.07 -0.38 0.00 0.61 0.23 0.00 0.00 176.35 176.74 3gvx n GLY 47 N 0.95 4.96 0.05 -3.19 0.00 -1.26 -5.05 105.19 101.65 3gvx n GLY 47 Ca -0.00 -1.85 0.10 0.00 0.00 0.00 0.00 46.02 44.27 3gvx n GLY 47 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3gvx n LYS 48 N 0.00 0.64 -0.06 1.61 5.02 -1.26 -4.28 118.16 119.83 3gvx n LYS 48 Ca 0.00 -0.07 0.07 0.00 -2.02 0.00 0.00 58.31 56.29 3gvx n LYS 48 Cb 0.00 -1.64 0.09 0.00 -0.02 0.00 0.00 35.03 33.47 3gvx n LYS 48 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 3gvx n ARG 49 N -2.44 1.44 -1.69 1.97 1.74 -1.26 -5.01 116.66 111.40 3gvx n ARG 49 Ca -0.04 -1.56 -0.44 0.00 -0.77 0.00 0.00 57.85 55.04 3gvx n ARG 49 Cb 0.59 -1.29 -0.04 0.00 -1.02 0.00 0.00 32.46 30.70 3gvx n ARG 49 CO 0.00 0.00 0.00 2.41 -1.52 0.00 0.00 177.63 178.52 3gvx n THR 50 N 0.80 0.24 -0.17 0.55 -1.04 -1.23 -4.05 114.28 109.39 3gvx n THR 50 Ca 0.10 -0.04 0.00 0.00 -2.04 0.00 0.00 64.05 62.07 3gvx n THR 50 Cb 0.39 -1.89 0.00 0.00 -1.82 0.00 0.00 70.33 67.00 3gvx n THR 50 CO 0.00 0.00 0.00 0.29 -0.64 0.00 0.00 175.07 174.72 3gvx n LYS 51 N 4.91 0.35 -3.52 -2.82 5.02 -0.46 -4.75 118.16 116.89 3gvx n LYS 51 Ca 0.18 -0.33 -0.00 0.00 -2.02 0.00 0.00 58.31 56.14 3gvx n LYS 51 Cb 0.33 -0.81 -0.05 0.00 -0.02 0.00 0.00 35.03 34.48 3gvx n LYS 51 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 3gvx s ILE 53 N -0.14 -0.32 -0.31 -0.18 1.01 0.12 -1.60 121.20 119.78 3gvx s ILE 53 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 60.65 60.62 3gvx s ILE 53 Cb 0.00 -1.00 0.05 0.00 0.01 0.00 0.00 42.46 41.52 3gvx s ILE 53 CO 0.00 0.00 0.02 -1.58 0.00 0.00 0.00 174.94 173.38 3gvx s GLN 54 N 2.01 2.47 0.39 2.79 2.00 0.15 -0.68 119.66 128.79 3gvx s GLN 54 Ca -0.06 -1.25 -0.23 0.00 -2.00 0.00 0.00 55.36 51.82 3gvx s GLN 54 Cb -0.05 -3.23 -0.10 0.00 0.80 0.00 0.00 33.01 30.42 3gvx s GLN 54 CO -0.17 -0.63 0.97 0.00 -0.50 0.00 0.00 175.29 174.97 3gvx s ALA 55 N 1.28 3.10 -1.32 1.58 0.00 -0.34 -0.52 121.76 125.54 3gvx s ALA 55 Ca -0.05 0.51 0.24 0.00 0.00 0.00 0.00 51.96 52.66 3gvx s ALA 55 Cb -0.20 -3.19 0.23 0.00 0.00 0.00 0.00 23.12 19.97 3gvx s ALA 55 CO -0.00 0.06 1.23 0.44 0.00 0.00 0.00 175.76 177.48 3gvx n ILE 56 N -0.11 0.00 -2.54 0.00 -5.35 -0.69 -3.43 119.36 107.24 3gvx n ILE 56 Ca 0.05 -0.07 -0.23 0.00 -0.27 0.00 0.00 62.75 62.23 3gvx n ILE 56 Cb 0.52 0.68 0.04 0.00 -1.74 0.00 0.00 39.64 39.14 3gvx n ILE 56 CO 0.00 0.00 0.00 -0.94 -1.76 0.00 0.00 176.55 173.85 3gvx s SER 57 N -2.82 5.25 0.14 7.28 1.04 -1.26 -4.63 113.70 118.70 3gvx s SER 57 Ca 0.14 0.22 -0.09 0.00 0.48 0.00 0.00 55.95 56.70 3gvx s SER 57 Cb 0.17 -1.10 -0.04 0.00 0.10 0.00 0.00 66.02 65.16 3gvx s SER 57 CO 0.70 -1.21 1.41 0.00 0.98 0.00 0.00 173.24 175.12 3gvx h ALA 58 N -0.10 0.50 -2.14 5.32 0.00 -1.88 0.16 119.26 121.12 3gvx h ALA 58 Ca -0.44 -0.55 -0.56 0.00 0.00 0.00 0.00 54.91 53.36 3gvx h ALA 58 Cb 1.29 -0.06 -0.10 0.00 0.00 0.00 0.00 17.79 18.92 3gvx h ALA 58 CO 0.56 0.69 -0.64 0.20 0.00 0.00 0.00 179.25 180.06 3gvx s GLY 59 N -4.08 1.75 0.00 0.00 0.00 -1.26 -4.29 107.32 99.44 3gvx s GLY 59 Ca -0.09 -1.73 0.00 0.00 0.00 0.00 0.00 44.72 42.90 3gvx s GLY 59 CO 0.88 -1.77 0.89 3.33 0.00 0.00 0.00 173.10 176.44 3gvx n VAL 60 N -0.90 0.80 0.33 1.40 0.24 -1.26 -4.74 118.33 114.19 3gvx n VAL 60 Ca -0.06 -0.88 0.21 0.00 -2.04 0.00 0.00 64.34 61.58 3gvx n VAL 60 Cb 0.60 0.61 1.15 0.00 -1.47 0.00 0.00 33.84 34.73 3gvx n VAL 60 CO 0.00 0.00 0.00 0.44 -2.14 0.00 0.00 176.83 175.13 3gvx h ASP 61 N 0.00 0.00 -0.01 -1.34 3.32 -2.02 0.24 116.42 116.62 3gvx h ASP 61 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3gvx h ASP 61 Cb 0.43 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.98 3gvx h ASP 61 CO 0.00 0.00 -0.01 0.00 -1.72 0.00 0.00 179.24 177.51 3gvx n HIS 62 N -3.12 0.00 -3.90 4.55 1.44 -1.26 -4.86 115.22 108.07 3gvx n HIS 62 Ca -0.03 0.00 -0.36 0.00 -2.01 0.00 0.00 57.72 55.32 3gvx n HIS 62 Cb 0.11 -0.00 -0.06 0.00 0.12 0.00 0.00 29.99 30.16 3gvx n HIS 62 CO 0.00 0.00 0.00 0.42 -2.81 0.00 0.00 176.34 173.95 3gvx s ILE 63 N -2.01 5.46 -0.84 0.61 1.01 0.83 -4.99 121.20 121.27 3gvx s ILE 63 Ca 0.38 0.13 -0.17 0.00 0.00 0.00 0.00 60.65 60.99 3gvx s ILE 63 Cb 0.21 -3.40 -0.12 0.00 0.01 0.00 0.00 42.46 39.15 3gvx s ILE 63 CO 0.34 0.57 1.98 -0.67 0.00 0.00 0.00 174.94 177.17 3gvx n ASP 64 N 1.81 3.18 -0.24 3.58 2.03 -1.26 -4.68 116.55 120.97 3gvx n ASP 64 Ca -0.18 -2.59 -0.02 0.00 0.52 0.00 0.00 54.79 52.51 3gvx n ASP 64 Cb 0.55 -1.13 0.09 0.00 -0.72 0.00 0.00 41.12 39.91 3gvx n ASP 64 CO 0.00 0.00 0.00 0.58 -1.92 0.00 0.00 177.20 175.86 3gvx h VAL 65 N 4.19 1.04 -0.46 5.18 2.07 -1.94 -1.75 116.25 124.58 3gvx h VAL 65 Ca 0.45 -0.27 0.13 0.00 0.82 0.00 0.00 66.70 67.83 3gvx h VAL 65 Cb 0.53 0.18 -0.02 0.00 -1.52 0.00 0.00 31.29 30.46 3gvx h VAL 65 CO 1.83 0.14 0.33 -1.13 0.02 0.00 0.00 177.57 178.76 3gvx h ASN 66 N 0.79 0.02 -0.01 0.57 -0.73 -2.00 0.56 115.58 114.78 3gvx h ASN 66 Ca 0.29 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.47 3gvx h ASN 66 Cb 0.10 -0.00 0.00 0.00 0.27 0.00 0.00 38.32 38.69 3gvx h ASN 66 CO -0.14 0.01 0.00 0.61 -0.37 0.00 0.00 177.43 177.54 3gvx n GLY 67 N -1.62 -0.72 3.64 1.57 0.00 -0.66 -4.82 105.19 102.58 3gvx n GLY 67 Ca 0.08 -0.26 -0.41 0.00 0.00 0.00 0.00 46.02 45.44 3gvx n GLY 67 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3gvx s ILE 68 N -1.99 4.98 0.50 -0.61 1.01 0.18 -5.02 121.20 120.25 3gvx s ILE 68 Ca 0.44 1.19 -0.22 0.00 0.00 0.00 0.00 60.65 62.06 3gvx s ILE 68 Cb 0.21 -3.95 -0.08 0.00 0.01 0.00 0.00 42.46 38.64 3gvx s ILE 68 CO 0.35 0.05 0.92 -2.65 0.00 0.00 0.00 174.94 173.60 3gvx n PRO 69 N 5.52 1.08 -0.34 2.79 -0.02 -1.26 -4.88 135.00 137.89 3gvx n PRO 69 Ca -0.00 0.40 0.24 0.00 -2.02 0.00 0.00 63.50 62.12 3gvx n PRO 69 Cb 0.49 -2.03 0.52 0.00 -0.02 0.00 0.00 33.50 32.46 3gvx n PRO 69 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 3gvx h GLU 70 N 1.02 0.36 0.00 -0.52 4.57 -1.97 -1.59 114.58 116.44 3gvx h GLU 70 Ca -0.46 -0.02 0.00 0.00 -1.18 0.00 0.00 59.36 57.70 3gvx h GLU 70 Cb 1.36 -0.08 0.00 0.00 -0.16 0.00 0.00 28.75 29.87 3gvx h GLU 70 CO 0.53 0.23 -0.05 0.27 -1.18 0.00 0.00 179.01 178.82 3gvx n ASN 71 N -4.67 0.29 -4.64 1.04 6.94 -1.26 -4.80 115.26 108.16 3gvx n ASN 71 Ca 0.27 0.47 -0.39 0.00 -0.02 0.00 0.00 54.58 54.91 3gvx n ASN 71 Cb 0.94 -0.53 -0.07 0.00 -2.36 0.00 0.00 39.78 37.76 3gvx n ASN 71 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 3gvx s VAL 72 N -3.04 5.09 -0.14 3.53 1.01 -0.60 -4.87 120.40 121.38 3gvx s VAL 72 Ca 0.13 0.91 -0.21 0.00 0.00 0.00 0.00 61.98 62.80 3gvx s VAL 72 Cb 0.17 -3.83 -0.03 0.00 0.00 0.00 0.00 36.38 32.69 3gvx s VAL 72 CO 0.57 0.14 0.64 -0.69 0.00 0.00 0.00 175.10 175.75 3gvx s VAL 73 N 1.93 5.05 -0.25 2.92 1.01 -0.63 -4.82 120.40 125.62 3gvx s VAL 73 Ca 0.22 1.25 -0.10 0.00 0.00 0.00 0.00 61.98 63.36 3gvx s VAL 73 Cb -0.15 -3.96 -0.04 0.00 0.00 0.00 0.00 36.38 32.22 3gvx s VAL 73 CO 0.09 0.18 0.14 -0.22 0.00 0.00 0.00 175.10 175.29 3gvx s LEU 74 N 1.39 3.90 0.13 3.92 2.96 -1.26 -0.70 118.68 129.01 3gvx s LEU 74 Ca 0.31 0.00 0.09 0.00 -0.22 0.00 0.00 54.13 54.32 3gvx s LEU 74 Cb -0.16 -2.05 -0.04 0.00 0.50 0.00 0.00 46.19 44.44 3gvx s LEU 74 CO 0.13 0.02 -0.19 0.00 -1.32 0.00 0.00 176.35 174.98 3gvx n SER 76 N 0.76 3.07 -3.57 0.00 3.41 -1.26 -1.20 113.62 114.82 3gvx n SER 76 Ca -0.16 -2.94 -0.28 0.00 -0.26 0.00 0.00 58.87 55.23 3gvx n SER 76 Cb 0.53 0.20 -0.11 0.00 -0.26 0.00 0.00 64.21 64.57 3gvx n SER 76 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 3gvx s ASN 77 N -3.70 2.80 0.00 4.04 2.47 0.56 -4.81 114.94 116.30 3gvx s ASN 77 Ca 0.10 -2.93 0.12 0.00 0.42 0.00 0.00 52.86 50.56 3gvx s ASN 77 Cb -0.01 -0.77 0.17 0.00 -1.45 0.00 0.00 41.25 39.19 3gvx s ASN 77 CO 0.06 -0.20 1.00 0.00 -3.72 0.00 0.00 177.10 174.23 3gvx n ALA 78 N 3.09 2.39 -0.36 1.71 0.00 -1.26 -2.88 120.51 123.19 3gvx n ALA 78 Ca 0.20 -0.77 0.05 0.00 0.00 0.00 0.00 53.44 52.91 3gvx n ALA 78 Cb 0.41 -0.41 0.21 0.00 0.00 0.00 0.00 19.45 19.65 3gvx n ALA 78 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 3gvx h GLY 79 N 2.24 1.56 0.86 0.00 0.00 -1.96 -2.82 103.07 102.95 3gvx h GLY 79 Ca 0.00 -0.45 0.08 0.00 0.00 0.00 0.00 47.33 46.96 3gvx h GLY 79 CO 0.00 0.26 0.54 0.00 0.00 0.00 0.00 176.54 177.34 3gvx h ALA 80 N 1.50 1.66 0.14 3.60 0.00 -1.94 -1.63 119.26 122.58 3gvx h ALA 80 Ca 0.46 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.35 3gvx h ALA 80 Cb 0.31 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.90 3gvx h ALA 80 CO -0.21 0.19 -0.07 -0.92 0.00 0.00 0.00 179.25 178.25 3gvx h TYR 81 N 0.84 -0.17 -0.27 0.00 3.20 -1.85 -0.25 116.97 118.47 3gvx h TYR 81 Ca 0.37 -0.00 -0.10 0.00 3.14 0.00 0.00 58.73 62.14 3gvx h TYR 81 Cb 0.33 0.06 -0.01 0.00 1.54 0.00 0.00 36.73 38.65 3gvx h TYR 81 CO -0.00 0.08 -0.24 0.66 -1.64 0.00 0.00 178.16 177.01 3gvx h SER 82 N -0.41 0.52 0.03 -2.11 4.64 -1.58 -0.12 113.55 114.52 3gvx h SER 82 Ca -0.02 -0.17 0.01 0.00 -0.47 0.00 0.00 61.79 61.14 3gvx h SER 82 Cb 0.33 -0.14 -0.01 0.00 -0.31 0.00 0.00 62.40 62.26 3gvx h SER 82 CO 0.03 0.76 -0.08 0.40 -0.87 0.00 0.00 176.83 177.06 3gvx h ILE 83 N 0.45 0.80 -0.46 0.95 2.04 -1.20 0.58 117.51 120.66 3gvx h ILE 83 Ca 0.07 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.93 3gvx h ILE 83 Cb 0.67 0.80 -0.02 0.00 -0.74 0.00 0.00 36.82 37.53 3gvx h ILE 83 CO 0.05 0.00 0.29 -1.28 0.00 0.00 0.00 178.15 177.20 3gvx h SER 84 N -0.16 0.55 -0.56 1.72 0.87 -0.83 -2.08 113.55 113.07 3gvx h SER 84 Ca 0.02 -0.05 -0.09 0.00 -1.23 0.00 0.00 61.79 60.44 3gvx h SER 84 Cb 0.18 -0.14 -0.02 0.00 -0.44 0.00 0.00 62.40 61.98 3gvx h SER 84 CO -0.06 0.43 -0.00 0.58 -0.53 0.00 0.00 176.83 177.25 3gvx h VAL 85 N 0.62 1.26 -0.67 2.23 2.07 -0.72 -1.82 116.25 119.23 3gvx h VAL 85 Ca 0.17 -1.13 -0.06 0.00 0.82 0.00 0.00 66.70 66.50 3gvx h VAL 85 Cb -0.02 0.81 -0.03 0.00 -1.52 0.00 0.00 31.29 30.53 3gvx h VAL 85 CO -0.03 0.41 0.18 0.00 0.02 0.00 0.00 177.57 178.14 3gvx h ALA 86 N 1.06 1.06 -0.45 1.67 0.00 -0.72 -1.09 119.26 120.78 3gvx h ALA 86 Ca 0.17 -0.23 -0.08 0.00 0.00 0.00 0.00 54.91 54.77 3gvx h ALA 86 Cb 0.54 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 3gvx h ALA 86 CO 0.03 0.63 -0.05 0.93 0.00 0.00 0.00 179.25 180.78 3gvx h GLU 87 N 1.00 0.76 -0.10 0.00 5.08 -1.13 -1.84 114.58 118.35 3gvx h GLU 87 Ca 0.21 -0.22 -0.14 0.00 -1.00 0.00 0.00 59.36 58.21 3gvx h GLU 87 Cb 0.32 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.48 3gvx h GLU 87 CO -0.00 0.81 -0.56 1.25 -1.00 0.00 0.00 179.01 179.51 3gvx h HIS 88 N 0.71 0.38 -0.44 4.33 2.76 -0.92 -2.16 115.15 119.80 3gvx h HIS 88 Ca 0.13 -0.13 -0.12 0.00 -2.20 0.00 0.00 60.37 58.05 3gvx h HIS 88 Cb 0.51 -0.07 -0.01 0.00 1.55 0.00 0.00 27.41 29.38 3gvx h HIS 88 CO 0.03 0.79 -0.19 0.00 -1.30 0.00 0.00 177.93 177.26 3gvx h ALA 89 N 1.18 0.62 0.00 5.26 0.00 -0.87 -2.36 119.26 123.09 3gvx h ALA 89 Ca 0.00 -0.37 -0.08 0.00 0.00 0.00 0.00 54.91 54.46 3gvx h ALA 89 Cb 1.05 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.67 3gvx h ALA 89 CO 0.09 0.58 -0.40 0.74 0.00 0.00 0.00 179.25 180.26 3gvx h PHE 90 N 0.74 0.00 -0.56 0.00 0.04 -1.25 -1.48 116.94 114.42 3gvx h PHE 90 Ca 0.10 0.00 -0.08 0.00 2.80 0.00 0.00 57.97 60.79 3gvx h PHE 90 Cb 0.75 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.88 3gvx h PHE 90 CO 0.05 0.40 0.05 0.00 -0.60 0.00 0.00 178.31 178.21 3gvx h ALA 91 N 1.60 0.75 -0.14 2.45 0.00 -1.08 0.67 119.26 123.51 3gvx h ALA 91 Ca -0.00 -0.28 -0.05 0.00 0.00 0.00 0.00 54.91 54.58 3gvx h ALA 91 Cb 0.86 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.43 3gvx h ALA 91 CO 0.05 0.54 -0.11 -0.07 0.00 0.00 0.00 179.25 179.67 3gvx h LEU 92 N 0.85 0.34 -0.20 0.00 3.38 -1.24 -1.70 115.31 116.75 3gvx h LEU 92 Ca 0.17 -0.46 0.06 0.00 0.09 0.00 0.00 57.88 57.73 3gvx h LEU 92 Cb 0.48 -0.10 -0.07 0.00 0.09 0.00 0.00 40.66 41.07 3gvx h LEU 92 CO 0.02 0.73 -0.25 0.25 0.09 0.00 0.00 178.44 179.27 3gvx h LEU 93 N -0.04 -0.80 -0.87 1.67 6.46 -1.11 -2.30 115.31 118.32 3gvx h LEU 93 Ca 0.03 0.14 -0.11 0.00 -0.12 0.00 0.00 57.88 57.81 3gvx h LEU 93 Cb 0.62 0.36 -0.02 0.00 -0.73 0.00 0.00 40.66 40.90 3gvx h LEU 93 CO 0.03 -0.29 -0.51 -0.07 -0.62 0.00 0.00 178.44 176.98 3gvx h LEU 94 N -0.28 0.00 -0.50 2.25 3.38 -0.91 -1.26 115.31 117.99 3gvx h LEU 94 Ca 0.12 0.00 0.01 0.00 0.09 0.00 0.00 57.88 58.10 3gvx h LEU 94 Cb 0.47 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.19 3gvx h LEU 94 CO -0.36 0.51 0.33 0.00 0.09 0.00 0.00 178.44 179.01 3gvx h ALA 95 N 1.49 0.64 -0.03 1.53 0.00 -0.78 -1.01 119.26 121.10 3gvx h ALA 95 Ca -0.01 -0.03 -0.10 0.00 0.00 0.00 0.00 54.91 54.78 3gvx h ALA 95 Cb 0.99 -0.19 0.01 0.00 0.00 0.00 0.00 17.79 18.59 3gvx h ALA 95 CO 0.07 0.06 -0.36 1.25 0.00 0.00 0.00 179.25 180.27 3gvx h HIS 96 N 0.66 0.42 -0.87 0.00 -0.00 -1.36 -0.46 115.15 113.54 3gvx h HIS 96 Ca 0.19 -0.21 0.06 0.00 -0.00 0.00 0.00 60.37 60.41 3gvx h HIS 96 Cb -0.06 -0.06 -0.05 0.00 -0.00 0.00 0.00 27.41 27.24 3gvx h HIS 96 CO -0.05 0.98 0.57 0.00 -0.00 0.00 0.00 177.93 179.43 3gvx h ALA 97 N 0.34 1.54 -0.65 5.26 0.00 -1.09 -2.06 119.26 122.60 3gvx h ALA 97 Ca -0.04 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.85 3gvx h ALA 97 Cb 1.06 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.59 3gvx h ALA 97 CO 0.07 0.34 0.00 1.63 0.00 0.00 0.00 179.25 181.29 3gvx n LYS 98 N -4.48 2.96 -4.11 0.00 4.76 -0.40 -0.45 118.16 116.43 3gvx n LYS 98 Ca 0.13 -2.53 -0.30 0.00 -2.87 0.00 0.00 58.31 52.73 3gvx n LYS 98 Cb 0.19 -1.66 -0.04 0.00 -1.84 0.00 0.00 35.03 31.69 3gvx n LYS 98 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 3gvx n ASN 99 N 1.32 -1.25 0.02 4.39 5.03 -0.78 -4.86 115.26 119.13 3gvx n ASN 99 Ca 0.23 -1.05 -0.10 0.00 0.87 0.00 0.00 54.58 54.53 3gvx n ASN 99 Cb 0.68 -2.72 -0.05 0.00 -1.02 0.00 0.00 39.78 36.67 3gvx n ASN 99 CO 0.00 0.00 0.00 0.40 -1.83 0.00 0.00 177.26 175.83 3gvx h ILE 100 N -1.69 0.85 -0.15 2.41 1.08 -1.34 -2.21 117.51 116.46 3gvx h ILE 100 Ca -0.62 0.00 -0.01 0.00 -0.39 0.00 0.00 64.86 63.84 3gvx h ILE 100 Cb 1.38 0.85 -0.01 0.00 -3.07 0.00 0.00 36.82 35.98 3gvx h ILE 100 CO 0.70 0.00 0.07 -0.07 -0.69 0.00 0.00 178.15 178.15 3gvx h LEU 101 N -0.06 0.20 -0.25 1.44 4.07 -1.89 -1.74 115.31 117.08 3gvx h LEU 101 Ca 0.04 -0.14 -0.02 0.00 0.08 0.00 0.00 57.88 57.84 3gvx h LEU 101 Cb 0.12 -0.05 -0.01 0.00 1.08 0.00 0.00 40.66 41.80 3gvx h LEU 101 CO -0.10 0.29 0.09 -0.33 -1.08 0.00 0.00 178.44 177.31 3gvx h GLU 102 N 0.10 0.38 -0.67 1.13 3.07 -1.94 -1.29 114.58 115.37 3gvx h GLU 102 Ca 0.05 -0.08 -0.07 0.00 -0.50 0.00 0.00 59.36 58.77 3gvx h GLU 102 Cb 0.15 -0.06 -0.03 0.00 -0.84 0.00 0.00 28.75 27.97 3gvx h GLU 102 CO -0.01 0.44 0.16 -0.91 -1.40 0.00 0.00 179.01 177.29 3gvx h ASN 103 N 0.25 1.03 -0.62 1.42 2.35 -1.42 -2.20 115.58 116.39 3gvx h ASN 103 Ca 0.08 -0.24 -0.05 0.00 -0.55 0.00 0.00 56.30 55.55 3gvx h ASN 103 Cb 0.21 -0.27 -0.03 0.00 0.05 0.00 0.00 38.32 38.28 3gvx h ASN 103 CO -0.00 1.00 0.21 -1.13 -1.65 0.00 0.00 177.43 175.85 3gvx h ASN 104 N 1.01 0.89 -0.41 5.81 -0.73 -1.21 -2.55 115.58 118.39 3gvx h ASN 104 Ca 0.21 -0.20 0.03 0.00 1.87 0.00 0.00 56.30 58.21 3gvx h ASN 104 Cb 0.38 -0.23 -0.03 0.00 0.27 0.00 0.00 38.32 38.70 3gvx h ASN 104 CO 0.00 0.85 0.21 -0.08 -0.37 0.00 0.00 177.43 178.04 3gvx h GLU 105 N 0.88 0.42 -0.92 6.67 4.81 -1.05 -1.66 114.58 123.73 3gvx h GLU 105 Ca 0.20 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.41 3gvx h GLU 105 Cb 0.26 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 29.55 3gvx h GLU 105 CO -0.01 0.28 0.00 1.28 -0.73 0.00 0.00 179.01 179.83 3gvx n LEU 106 N -4.90 0.35 0.00 1.64 4.32 -0.84 -3.25 117.00 114.32 3gvx n LEU 106 Ca 0.02 -0.18 0.00 0.00 -0.02 0.00 0.00 56.01 55.83 3gvx n LEU 106 Cb 0.09 -0.09 0.00 0.00 -1.62 0.00 0.00 43.42 41.80 3gvx n LEU 106 CO 0.31 0.07 0.00 0.29 -1.22 0.00 0.00 177.39 176.83 3gvx n LYS 108 N 0.63 0.00 -0.40 3.23 5.02 -0.63 -1.61 118.16 124.40 3gvx n LYS 108 Ca 0.00 0.00 0.09 0.00 -2.02 0.00 0.00 58.31 56.38 3gvx n LYS 108 Cb 0.07 0.00 0.29 0.00 -0.02 0.00 0.00 35.03 35.37 3gvx n LYS 108 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3gvx n ALA 109 N 0.00 2.63 -1.09 7.82 0.00 -1.20 -4.92 120.51 123.76 3gvx n ALA 109 Ca 0.00 -1.21 -0.03 0.00 0.00 0.00 0.00 53.44 52.20 3gvx n ALA 109 Cb 0.00 -0.98 -0.01 0.00 0.00 0.00 0.00 19.45 18.46 3gvx n ALA 109 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3gvx n GLY 110 N 1.34 0.61 3.42 0.00 0.00 -1.18 -5.01 105.19 104.38 3gvx n GLY 110 Ca 0.22 -0.72 -0.41 0.00 0.00 0.00 0.00 46.02 45.11 3gvx n GLY 110 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3gvx s ILE 111 N -2.07 4.85 -0.41 -0.61 1.01 -0.63 -5.04 121.20 118.29 3gvx s ILE 111 Ca 0.00 -0.68 -0.19 0.00 0.00 0.00 0.00 60.65 59.79 3gvx s ILE 111 Cb 0.00 -3.65 0.02 0.00 0.01 0.00 0.00 42.46 38.84 3gvx s ILE 111 CO 0.00 -0.19 0.54 0.12 0.00 0.00 0.00 174.94 175.40 3gvx s PHE 112 N 1.61 3.13 -0.21 3.97 5.36 -1.26 -4.75 117.98 125.83 3gvx s PHE 112 Ca 0.04 -0.12 -0.04 0.00 -0.96 0.00 0.00 56.93 55.85 3gvx s PHE 112 Cb -0.19 -3.08 0.11 0.00 -0.34 0.00 0.00 43.02 39.52 3gvx s PHE 112 CO 0.08 -0.73 0.28 0.50 -1.46 0.00 0.00 175.22 173.89 3gvx s ARG 113 N 2.47 0.25 0.39 10.12 3.52 -1.26 -5.13 118.95 129.30 3gvx s ARG 113 Ca 0.18 0.35 -0.24 0.00 -0.13 0.00 0.00 55.73 55.89 3gvx s ARG 113 Cb -0.15 -0.88 -0.10 0.00 -1.56 0.00 0.00 34.95 32.26 3gvx s ARG 113 CO 0.16 -0.63 1.00 -0.65 -0.81 0.00 0.00 175.30 174.36 3gvx s GLN 114 N 2.41 4.28 -0.02 5.12 -0.21 -1.26 -5.03 119.66 124.95 3gvx s GLN 114 Ca 0.09 1.37 -0.27 0.00 0.02 0.00 0.00 55.36 56.57 3gvx s GLN 114 Cb -0.15 -2.52 0.06 0.00 1.00 0.00 0.00 33.01 31.39 3gvx s GLN 114 CO -0.13 -0.01 0.59 0.45 -2.12 0.00 0.00 175.29 174.06 3gvx s SER 115 N -1.73 -0.54 0.63 5.90 0.15 -1.26 -5.16 113.70 111.69 3gvx s SER 115 Ca 0.57 0.50 -0.16 0.00 0.70 0.00 0.00 55.95 57.56 3gvx s SER 115 Cb -0.18 0.49 -0.02 0.00 -1.71 0.00 0.00 66.02 64.61 3gvx s SER 115 CO 0.23 -0.61 1.10 -2.16 1.20 0.00 0.00 173.24 173.00 3gvx s PRO 116 N -1.48 2.99 0.39 5.44 0.04 -1.26 -5.06 135.00 136.06 3gvx s PRO 116 Ca -0.10 1.36 0.08 0.00 0.04 0.00 0.00 61.00 62.37 3gvx s PRO 116 Cb -0.01 -1.98 -0.07 0.00 0.04 0.00 0.00 34.50 32.48 3gvx s PRO 116 CO 0.07 -1.10 -0.00 0.95 0.04 0.00 0.00 177.00 176.96 3gvx s THR 117 N -2.32 2.09 -0.07 1.26 -4.23 -1.26 -4.94 115.64 106.17 3gvx s THR 117 Ca 0.67 -2.02 -0.06 0.00 -1.18 0.00 0.00 61.69 59.09 3gvx s THR 117 Cb -0.20 -2.92 -0.04 0.00 1.34 0.00 0.00 72.50 70.68 3gvx s THR 117 CO 0.39 -0.05 0.18 -0.89 -0.54 0.00 0.00 174.62 173.71 3gvx s THR 118 N -2.68 5.44 0.03 3.99 2.01 0.40 -5.02 115.64 119.81 3gvx s THR 118 Ca 0.35 0.16 0.03 0.00 0.31 0.00 0.00 61.69 62.54 3gvx s THR 118 Cb 0.08 -3.47 -0.04 0.00 0.01 0.00 0.00 72.50 69.08 3gvx s THR 118 CO 0.18 0.52 -0.01 -0.22 -0.69 0.00 0.00 174.62 174.40 3gvx s LEU 119 N -1.32 3.44 -0.05 4.42 2.96 -1.26 -4.48 118.68 122.39 3gvx s LEU 119 Ca 0.20 -0.09 -0.05 0.00 -0.22 0.00 0.00 54.13 53.97 3gvx s LEU 119 Cb -0.13 -2.05 -0.28 0.00 0.50 0.00 0.00 46.19 44.24 3gvx s LEU 119 CO 0.09 0.24 0.66 -0.07 -1.32 0.00 0.00 176.35 175.96 3gvx h LEU 120 N 4.06 0.43 -9.15 -0.68 3.38 -1.99 -3.45 115.31 107.92 3gvx h LEU 120 Ca -0.48 -0.71 -0.74 0.00 0.09 0.00 0.00 57.88 56.03 3gvx h LEU 120 Cb 1.17 -0.14 0.03 0.00 0.09 0.00 0.00 40.66 41.81 3gvx h LEU 120 CO 0.58 1.61 0.66 0.00 0.09 0.00 0.00 178.44 181.38 3gvx n TYR 121 N -3.47 1.72 0.00 1.13 9.36 -1.25 -0.85 117.16 123.80 3gvx n TYR 121 Ca -0.23 0.69 0.00 0.00 3.32 0.00 0.00 57.90 61.68 3gvx n TYR 121 Cb 1.06 -2.36 0.00 0.00 -0.63 0.00 0.00 39.34 37.41 3gvx n TYR 121 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 3gvx n GLY 122 N 3.40 1.93 3.90 2.98 0.00 -0.94 -5.04 105.19 111.43 3gvx n GLY 122 Ca 0.24 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.98 3gvx n GLY 122 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3gvx s LYS 123 N -0.36 3.55 -0.31 1.61 1.02 -0.03 -4.70 119.74 120.51 3gvx s LYS 123 Ca 0.00 0.25 -0.17 0.00 0.02 0.00 0.00 55.97 56.07 3gvx s LYS 123 Cb 0.00 -2.35 -0.02 0.00 -0.52 0.00 0.00 37.83 34.95 3gvx s LYS 123 CO 0.00 -0.24 0.49 0.00 -0.92 0.00 0.00 175.35 174.67 3gvx s ALA 124 N -2.78 3.52 -0.33 5.17 0.00 -1.26 -0.22 121.76 125.86 3gvx s ALA 124 Ca 0.48 -0.89 -0.11 0.00 0.00 0.00 0.00 51.96 51.44 3gvx s ALA 124 Cb -0.10 -2.93 -0.01 0.00 0.00 0.00 0.00 23.12 20.08 3gvx s ALA 124 CO 0.46 -1.01 0.20 -1.17 0.00 0.00 0.00 175.76 174.24 3gvx s LEU 125 N 2.31 4.36 -0.18 0.00 2.96 0.57 -0.81 118.68 127.89 3gvx s LEU 125 Ca 0.18 -0.51 -0.17 0.00 -0.22 0.00 0.00 54.13 53.41 3gvx s LEU 125 Cb -0.16 -2.07 -0.04 0.00 0.50 0.00 0.00 46.19 44.43 3gvx s LEU 125 CO 0.12 -0.23 0.45 -0.83 -1.32 0.00 0.00 176.35 174.53 3gvx s GLY 126 N 1.66 2.17 -0.17 7.98 0.00 0.18 -0.93 107.32 118.22 3gvx s GLY 126 Ca 0.05 -0.39 -0.02 0.00 0.00 0.00 0.00 44.72 44.35 3gvx s GLY 126 CO 0.08 0.86 -0.07 -0.42 0.00 0.00 0.00 173.10 173.55 3gvx s ILE 127 N 1.17 3.42 -0.44 0.90 1.01 0.23 -0.11 121.20 127.38 3gvx s ILE 127 Ca 0.22 -0.51 -0.16 0.00 0.00 0.00 0.00 60.65 60.21 3gvx s ILE 127 Cb -0.15 -2.50 0.04 0.00 0.01 0.00 0.00 42.46 39.87 3gvx s ILE 127 CO 0.09 0.48 0.36 -0.22 0.00 0.00 0.00 174.94 175.65 3gvx s LEU 128 N 0.73 5.31 0.00 2.97 2.96 0.07 -1.02 118.68 129.70 3gvx s LEU 128 Ca -0.03 -1.07 0.00 0.00 -0.22 0.00 0.00 54.13 52.81 3gvx s LEU 128 Cb -0.15 -2.20 0.00 0.00 0.50 0.00 0.00 46.19 44.34 3gvx s LEU 128 CO 0.02 -0.56 0.00 0.61 -1.32 0.00 0.00 176.35 175.10 3gvx n GLY 129 N 5.18 -0.02 2.71 7.98 0.00 -0.35 -1.28 105.19 119.41 3gvx n GLY 129 Ca -0.11 -1.03 -0.34 0.00 0.00 0.00 0.00 46.02 44.54 3gvx n GLY 129 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 3gvx n TYR 130 N 2.23 3.16 -1.51 1.61 9.36 -1.26 -4.43 117.16 126.31 3gvx n TYR 130 Ca 0.00 -3.44 0.00 0.00 3.32 0.00 0.00 57.90 57.78 3gvx n TYR 130 Cb 0.00 -0.84 0.00 0.00 -0.63 0.00 0.00 39.34 37.87 3gvx n TYR 130 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 3gvx n GLY 131 N 0.72 2.68 0.32 2.98 0.00 -1.26 -4.73 105.19 105.90 3gvx n GLY 131 Ca 0.31 -1.93 0.06 0.00 0.00 0.00 0.00 46.02 44.45 3gvx n GLY 131 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3gvx h GLY 132 N 0.00 1.44 0.67 -0.02 0.00 -0.62 0.23 103.07 104.77 3gvx h GLY 132 Ca 0.00 -0.33 -0.07 0.00 0.00 0.00 0.00 47.33 46.93 3gvx h GLY 132 CO 0.00 0.07 -0.22 -2.22 0.00 0.00 0.00 176.54 174.17 3gvx h ILE 133 N 0.79 1.41 -0.46 2.60 2.04 -1.74 -2.50 117.51 119.65 3gvx h ILE 133 Ca 0.46 -1.55 -0.01 0.00 1.00 0.00 0.00 64.86 64.75 3gvx h ILE 133 Cb 0.52 2.19 -0.02 0.00 -0.74 0.00 0.00 36.82 38.76 3gvx h ILE 133 CO -0.30 0.44 0.23 1.23 0.00 0.00 0.00 178.15 179.75 3gvx h GLY 134 N -0.16 0.67 1.02 5.37 0.00 -1.65 0.84 103.07 109.16 3gvx h GLY 134 Ca -0.00 -0.30 -0.14 0.00 0.00 0.00 0.00 47.33 46.89 3gvx h GLY 134 CO 0.05 0.29 -0.36 3.21 0.00 0.00 0.00 176.54 179.73 3gvx h ARG 135 N 0.64 0.76 -0.43 4.80 3.08 -0.54 -1.31 114.38 121.38 3gvx h ARG 135 Ca 0.16 -0.43 -0.13 0.00 0.07 0.00 0.00 59.98 59.65 3gvx h ARG 135 Cb 0.06 0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.12 3gvx h ARG 135 CO -0.02 1.05 -0.26 -0.09 -1.07 0.00 0.00 179.97 179.58 3gvx h ARG 136 N 0.51 0.91 -0.49 0.04 9.65 -1.10 -1.90 114.38 122.00 3gvx h ARG 136 Ca 0.04 -0.40 -0.02 0.00 -1.10 0.00 0.00 59.98 58.50 3gvx h ARG 136 Cb 0.94 -0.02 -0.02 0.00 -1.39 0.00 0.00 29.97 29.48 3gvx h ARG 136 CO 0.09 1.06 0.24 0.28 2.80 0.00 0.00 179.97 184.43 3gvx h VAL 137 N 0.78 1.19 0.00 0.20 2.07 -0.80 -2.48 116.25 117.21 3gvx h VAL 137 Ca 0.09 -0.53 -0.06 0.00 0.82 0.00 0.00 66.70 67.03 3gvx h VAL 137 Cb 0.82 0.63 -0.01 0.00 -1.52 0.00 0.00 31.29 31.22 3gvx h VAL 137 CO 0.07 0.21 -0.27 0.00 0.02 0.00 0.00 177.57 177.60 3gvx h ALA 138 N 1.08 1.52 -0.33 1.67 0.00 -1.07 0.19 119.26 122.32 3gvx h ALA 138 Ca 0.17 -0.24 -0.10 0.00 0.00 0.00 0.00 54.91 54.73 3gvx h ALA 138 Cb 0.11 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 3gvx h ALA 138 CO -0.02 0.34 -0.19 1.25 0.00 0.00 0.00 179.25 180.63 3gvx h HIS 139 N 0.00 0.83 -0.38 0.00 6.17 -0.96 -1.45 115.15 119.36 3gvx h HIS 139 Ca -0.00 -0.21 -0.13 0.00 0.71 0.00 0.00 60.37 60.74 3gvx h HIS 139 Cb 0.49 -0.19 -0.01 0.00 2.52 0.00 0.00 27.41 30.22 3gvx h HIS 139 CO 0.00 0.94 -0.26 -0.07 0.71 0.00 0.00 177.93 179.24 3gvx h LEU 140 N 0.48 0.89 -0.96 0.26 3.38 -1.07 -2.85 115.31 115.45 3gvx h LEU 140 Ca 0.07 -0.43 0.02 0.00 0.09 0.00 0.00 57.88 57.63 3gvx h LEU 140 Cb 0.73 -0.25 -0.05 0.00 0.09 0.00 0.00 40.66 41.18 3gvx h LEU 140 CO 0.05 1.13 0.63 0.00 0.09 0.00 0.00 178.44 180.35 3gvx h ALA 141 N 0.78 1.24 -0.58 1.53 0.00 -0.85 -0.94 119.26 120.43 3gvx h ALA 141 Ca 0.07 -0.06 -0.07 0.00 0.00 0.00 0.00 54.91 54.86 3gvx h ALA 141 Cb 0.83 -0.37 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 3gvx h ALA 141 CO 0.07 0.56 0.07 0.87 0.00 0.00 0.00 179.25 180.83 3gvx h LYS 142 N 1.26 0.96 -0.73 0.00 1.79 -1.22 -2.37 116.57 116.25 3gvx h LYS 142 Ca 0.37 -0.25 -0.05 0.00 -2.18 0.00 0.00 60.65 58.54 3gvx h LYS 142 Cb -0.08 -0.12 -0.03 0.00 -1.58 0.00 0.00 32.23 30.42 3gvx h LYS 142 CO -0.10 0.90 0.26 0.00 -1.08 0.00 0.00 179.45 179.43 3gvx h ALA 143 N 1.17 1.07 0.00 3.86 0.00 -1.09 -1.31 119.26 122.96 3gvx h ALA 143 Ca 0.18 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.88 3gvx h ALA 143 Cb 0.43 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 17.93 3gvx h ALA 143 CO 0.01 0.64 0.00 1.19 0.00 0.00 0.00 179.25 181.10 3gvx n PHE 144 N -4.27 0.00 -1.40 0.00 3.72 -0.44 -5.12 117.46 109.96 3gvx n PHE 144 Ca 0.06 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.46 3gvx n PHE 144 Cb 0.21 -0.06 0.00 0.00 -0.94 0.00 0.00 39.48 38.69 3gvx n PHE 144 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3gvx n GLY 145 N 0.50 -0.80 3.01 1.37 0.00 -0.50 -3.84 105.19 104.94 3gvx n GLY 145 Ca 0.16 -0.16 -0.17 0.00 0.00 0.00 0.00 46.02 45.86 3gvx n GLY 145 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3gvx s ARG 147 N -0.90 0.58 -0.13 1.61 3.52 0.70 -2.20 118.95 122.13 3gvx s ARG 147 Ca 0.00 -0.36 0.02 0.00 -0.13 0.00 0.00 55.73 55.25 3gvx s ARG 147 Cb 0.00 -0.53 -0.00 0.00 -1.56 0.00 0.00 34.95 32.85 3gvx s ARG 147 CO 0.00 0.14 -0.19 0.08 -0.81 0.00 0.00 175.30 174.52 3gvx s VAL 148 N -0.40 2.47 -0.12 7.11 1.01 -1.26 -0.32 120.40 128.89 3gvx s VAL 148 Ca 0.01 -0.86 0.02 0.00 0.00 0.00 0.00 61.98 61.15 3gvx s VAL 148 Cb -0.04 -2.00 -0.01 0.00 0.00 0.00 0.00 36.38 34.32 3gvx s VAL 148 CO -0.00 0.54 -0.17 -0.63 0.00 0.00 0.00 175.10 174.83 3gvx s ILE 149 N 0.56 2.66 0.01 2.22 1.01 -0.11 -0.48 121.20 127.08 3gvx s ILE 149 Ca -0.11 -0.80 0.07 0.00 0.00 0.00 0.00 60.65 59.80 3gvx s ILE 149 Cb -0.16 -2.08 -0.02 0.00 0.01 0.00 0.00 42.46 40.20 3gvx s ILE 149 CO 0.04 0.54 -0.21 0.00 0.00 0.00 0.00 174.94 175.31 3gvx s ALA 150 N 0.33 1.72 -0.25 9.38 0.00 0.11 0.77 121.76 133.83 3gvx s ALA 150 Ca -0.14 -0.96 0.02 0.00 0.00 0.00 0.00 51.96 50.88 3gvx s ALA 150 Cb -0.17 -0.39 0.05 0.00 0.00 0.00 0.00 23.12 22.61 3gvx s ALA 150 CO 0.07 0.41 -0.12 -0.47 0.00 0.00 0.00 175.76 175.65 3gvx s TYR 151 N -0.63 3.15 0.09 0.00 5.04 -0.19 -0.60 117.35 124.22 3gvx s TYR 151 Ca 0.08 -2.10 -0.12 0.00 -2.44 0.00 0.00 57.07 52.49 3gvx s TYR 151 Cb -0.08 -1.95 0.01 0.00 0.35 0.00 0.00 41.96 40.29 3gvx s TYR 151 CO 0.00 -0.85 0.28 -0.08 -1.34 0.00 0.00 175.55 173.56 3gvx s THR 152 N 1.17 0.11 -1.19 4.34 -1.32 -1.26 -1.21 115.64 116.28 3gvx s THR 152 Ca -0.05 -0.89 -0.18 0.00 -1.21 0.00 0.00 61.69 59.36 3gvx s THR 152 Cb -0.18 -1.20 0.10 0.00 -1.51 0.00 0.00 72.50 69.70 3gvx s THR 152 CO -0.06 -0.49 1.55 -0.13 -2.21 0.00 0.00 174.62 173.27 3gvx s ARG 153 N -3.58 3.91 0.00 7.08 1.81 -1.26 -4.82 118.95 122.08 3gvx s ARG 153 Ca 0.02 -1.98 0.00 0.00 -1.72 0.00 0.00 55.73 52.05 3gvx s ARG 153 Cb 0.03 -5.32 0.00 0.00 -0.45 0.00 0.00 34.95 29.21 3gvx s ARG 153 CO -0.10 -2.07 0.00 0.45 -0.68 0.00 0.00 175.30 172.90 3gvx n SER 154 N 7.55 0.00 -0.35 0.23 2.88 -1.26 -5.00 113.62 117.68 3gvx n SER 154 Ca 0.40 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.94 3gvx n SER 154 Cb 0.46 -1.27 0.00 0.00 -0.75 0.00 0.00 64.21 62.65 3gvx n SER 154 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 3gvx n SER 155 N -1.12 -0.74 -4.28 -3.46 2.88 -1.26 -5.04 113.62 100.60 3gvx n SER 155 Ca 0.00 0.00 -0.15 0.00 -1.33 0.00 0.00 58.87 57.39 3gvx n SER 155 Cb 0.00 -0.37 -0.10 0.00 -0.75 0.00 0.00 64.21 62.99 3gvx n SER 155 CO 0.00 0.00 0.00 0.68 -1.23 0.00 0.00 175.04 174.49 3gvx s VAL 156 N 0.00 0.57 0.00 2.46 -7.23 -1.26 -4.88 120.40 110.05 3gvx s VAL 156 Ca 0.00 -1.99 0.00 0.00 -1.81 0.00 0.00 61.98 58.18 3gvx s VAL 156 Cb 0.00 -2.42 0.00 0.00 0.56 0.00 0.00 36.38 34.52 3gvx s VAL 156 CO 0.00 -0.19 0.00 -0.90 -0.31 0.00 0.00 175.10 173.70 3gvx n ASP 157 N -0.36 1.84 0.20 4.85 5.68 -1.26 -5.01 116.55 122.48 3gvx n ASP 157 Ca -0.02 -0.09 0.15 0.00 -0.50 0.00 0.00 54.79 54.32 3gvx n ASP 157 Cb 0.65 0.00 0.58 0.00 -1.14 0.00 0.00 41.12 41.21 3gvx n ASP 157 CO 0.00 0.00 0.00 0.06 -1.33 0.00 0.00 177.20 175.93 3gvx h GLN 158 N 0.00 0.00 -0.62 0.11 3.07 -2.02 -3.07 115.11 112.58 3gvx h GLN 158 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.74 3gvx h GLN 158 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.56 3gvx h GLN 158 CO 0.00 0.00 0.00 0.09 0.09 0.00 0.00 178.83 179.01 3gvx n ASN 159 N -2.65 2.16 -4.34 0.06 3.02 -1.26 -4.77 115.26 107.48 3gvx n ASN 159 Ca 0.01 -2.20 -0.34 0.00 -0.03 0.00 0.00 54.58 52.03 3gvx n ASN 159 Cb 0.27 -0.41 -0.14 0.00 -0.61 0.00 0.00 39.78 38.89 3gvx n ASN 159 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 3gvx s VAL 160 N -1.63 3.24 -0.12 2.41 1.01 -1.16 -4.61 120.40 119.53 3gvx s VAL 160 Ca 0.18 -0.56 0.18 0.00 0.00 0.00 0.00 61.98 61.78 3gvx s VAL 160 Cb 0.12 -2.43 -0.19 0.00 0.00 0.00 0.00 36.38 33.88 3gvx s VAL 160 CO 0.08 0.47 0.60 0.47 0.00 0.00 0.00 175.10 176.73 3gvx n ASP 161 N 4.22 0.55 -3.77 3.32 8.00 0.37 -4.92 116.55 124.31 3gvx n ASP 161 Ca -0.18 0.24 -0.14 0.00 0.71 0.00 0.00 54.79 55.42 3gvx n ASP 161 Cb 0.52 0.59 -0.15 0.00 -0.02 0.00 0.00 41.12 42.06 3gvx n ASP 161 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3gvx s VAL 162 N -2.90 -0.05 -0.24 2.53 1.01 -0.58 -5.01 120.40 115.16 3gvx s VAL 162 Ca -0.05 0.17 -0.09 0.00 0.00 0.00 0.00 61.98 62.01 3gvx s VAL 162 Cb 0.09 -0.17 -0.04 0.00 0.00 0.00 0.00 36.38 36.26 3gvx s VAL 162 CO 0.83 0.07 0.13 -0.63 0.00 0.00 0.00 175.10 175.50 3gvx s ILE 163 N 1.00 5.02 0.60 2.22 1.01 -1.26 0.10 121.20 129.88 3gvx s ILE 163 Ca -0.08 0.06 -0.03 0.00 0.00 0.00 0.00 60.65 60.61 3gvx s ILE 163 Cb -0.11 -3.34 0.03 0.00 0.01 0.00 0.00 42.46 39.06 3gvx s ILE 163 CO -0.04 0.34 0.86 -0.94 0.00 0.00 0.00 174.94 175.16 3gvx s SER 164 N 1.24 5.24 -0.04 3.58 1.04 0.23 -4.94 113.70 120.05 3gvx s SER 164 Ca 0.06 0.30 0.19 0.00 0.48 0.00 0.00 55.95 56.98 3gvx s SER 164 Cb -0.14 -1.17 -0.22 0.00 0.10 0.00 0.00 66.02 64.59 3gvx s SER 164 CO 0.05 -1.23 0.51 -0.62 0.98 0.00 0.00 173.24 172.93 3gvx n GLU 165 N -2.55 0.65 -3.75 4.02 1.02 -1.26 -4.74 120.64 114.03 3gvx n GLU 165 Ca 0.07 0.03 -0.09 0.00 -0.02 0.00 0.00 57.16 57.15 3gvx n GLU 165 Cb 0.59 -1.64 -0.03 0.00 -0.02 0.00 0.00 31.44 30.34 3gvx n GLU 165 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 3gvx s SER 166 N -5.32 -0.31 0.30 1.62 1.04 -1.26 -5.00 113.70 104.78 3gvx s SER 166 Ca -0.06 -0.48 0.01 0.00 0.48 0.00 0.00 55.95 55.90 3gvx s SER 166 Cb 0.09 0.65 0.47 0.00 0.10 0.00 0.00 66.02 67.33 3gvx s SER 166 CO 0.84 -1.17 1.83 -0.65 0.98 0.00 0.00 173.24 175.07 3gvx h PRO 167 N 2.08 0.69 -0.71 4.02 0.11 -1.98 -1.06 132.00 135.14 3gvx h PRO 167 Ca -0.25 -0.15 -0.07 0.00 0.11 0.00 0.00 66.00 65.63 3gvx h PRO 167 Cb 1.27 -0.10 -0.03 0.00 0.11 0.00 0.00 31.00 32.25 3gvx h PRO 167 CO 0.31 0.68 0.16 0.00 -0.21 0.00 0.00 178.00 178.94 3gvx h ALA 168 N 1.39 0.94 -0.34 -0.75 0.00 -1.96 -0.54 119.26 118.00 3gvx h ALA 168 Ca 0.14 -0.26 -0.06 0.00 0.00 0.00 0.00 54.91 54.73 3gvx h ALA 168 Cb 0.35 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 3gvx h ALA 168 CO 0.01 0.67 -0.06 0.22 0.00 0.00 0.00 179.25 180.09 3gvx h ASP 169 N 1.08 0.53 0.03 0.00 3.58 -1.80 -1.81 116.42 118.03 3gvx h ASP 169 Ca 0.22 -0.12 -0.00 0.00 0.42 0.00 0.00 57.03 57.55 3gvx h ASP 169 Cb 0.39 -0.14 0.00 0.00 1.72 0.00 0.00 39.33 41.30 3gvx h ASP 169 CO 0.01 0.64 -0.02 0.25 -2.88 0.00 0.00 179.24 177.24 3gvx h LEU 170 N 0.52 -0.04 -1.38 2.28 5.85 -0.49 -2.85 115.31 119.20 3gvx h LEU 170 Ca 0.10 -0.28 0.10 0.00 0.84 0.00 0.00 57.88 58.64 3gvx h LEU 170 Cb 0.43 0.01 -0.05 0.00 0.37 0.00 0.00 40.66 41.42 3gvx h LEU 170 CO 0.02 0.26 0.51 -0.26 -0.34 0.00 0.00 178.44 178.63 3gvx h PHE 171 N -0.34 0.74 0.00 1.25 -1.00 -0.94 -1.42 116.94 115.23 3gvx h PHE 171 Ca -0.00 0.02 -0.04 0.00 2.81 0.00 0.00 57.97 60.76 3gvx h PHE 171 Cb 0.32 -0.24 -0.01 0.00 3.61 0.00 0.00 35.95 39.63 3gvx h PHE 171 CO 0.02 0.34 -0.17 0.00 -1.61 0.00 0.00 178.31 176.90 3gvx h ARG 172 N 0.69 0.00 -0.35 1.51 3.08 -1.11 -2.77 114.38 115.42 3gvx h ARG 172 Ca 0.36 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.41 3gvx h ARG 172 Cb 0.48 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.53 3gvx h ARG 172 CO -0.14 0.17 0.00 1.04 -1.07 0.00 0.00 179.97 179.97 3gvx n GLN 173 N -3.68 2.30 -4.52 0.04 6.02 -0.58 -4.93 117.38 112.04 3gvx n GLN 173 Ca -0.01 -2.06 -0.31 0.00 -0.01 0.00 0.00 57.00 54.60 3gvx n GLN 173 Cb 0.29 -1.39 -0.11 0.00 1.02 0.00 0.00 30.24 30.05 3gvx n GLN 173 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 177.06 174.93 3gvx s SER 174 N -1.16 4.31 -0.13 1.08 0.01 -0.92 -4.76 113.70 112.13 3gvx s SER 174 Ca 0.30 -0.26 0.19 0.00 1.31 0.00 0.00 55.95 57.49 3gvx s SER 174 Cb 0.17 -0.89 -0.27 0.00 0.21 0.00 0.00 66.02 65.24 3gvx s SER 174 CO 0.23 0.27 0.25 0.47 0.41 0.00 0.00 173.24 174.87 3gvx n ASP 175 N 1.49 0.06 -3.95 2.44 8.00 0.01 -4.50 116.55 120.11 3gvx n ASP 175 Ca -0.15 0.03 -0.16 0.00 0.71 0.00 0.00 54.79 55.22 3gvx n ASP 175 Cb 0.52 1.24 -0.14 0.00 -0.02 0.00 0.00 41.12 42.72 3gvx n ASP 175 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 3gvx s PHE 176 N -2.83 0.43 -0.08 1.24 0.08 -1.03 -2.52 117.98 113.28 3gvx s PHE 176 Ca -0.09 -0.08 0.01 0.00 0.12 0.00 0.00 56.93 56.89 3gvx s PHE 176 Cb 0.09 -0.28 0.02 0.00 -0.57 0.00 0.00 43.02 42.27 3gvx s PHE 176 CO 0.85 -0.01 -0.10 0.08 -0.10 0.00 0.00 175.22 175.94 3gvx s VAL 177 N -0.08 1.04 -0.15 -0.44 1.01 -0.33 0.51 120.40 121.96 3gvx s VAL 177 Ca 0.01 -0.38 -0.03 0.00 0.00 0.00 0.00 61.98 61.58 3gvx s VAL 177 Cb -0.02 -0.99 -0.03 0.00 0.00 0.00 0.00 36.38 35.35 3gvx s VAL 177 CO -0.00 0.34 -0.05 -0.22 0.00 0.00 0.00 175.10 175.18 3gvx s LEU 178 N 0.98 3.20 -0.34 3.92 2.96 0.84 -0.26 118.68 129.99 3gvx s LEU 178 Ca -0.09 -0.14 -0.12 0.00 -0.22 0.00 0.00 54.13 53.56 3gvx s LEU 178 Cb -0.15 -1.77 -0.01 0.00 0.50 0.00 0.00 46.19 44.77 3gvx s LEU 178 CO -0.00 0.17 0.21 -0.63 -1.32 0.00 0.00 176.35 174.79 3gvx s ILE 179 N 0.32 5.00 -0.37 6.68 1.01 0.17 -0.75 121.20 133.26 3gvx s ILE 179 Ca -0.04 -0.38 0.13 0.00 0.00 0.00 0.00 60.65 60.36 3gvx s ILE 179 Cb -0.14 -3.60 0.37 0.00 0.01 0.00 0.00 42.46 39.10 3gvx s ILE 179 CO 0.03 -0.03 0.82 0.00 0.00 0.00 0.00 174.94 175.76 3gvx n ALA 180 N 5.06 2.08 -2.39 9.38 0.00 -0.40 -1.63 120.51 132.60 3gvx n ALA 180 Ca -0.13 -3.15 -0.29 0.00 0.00 0.00 0.00 53.44 49.88 3gvx n ALA 180 Cb 0.49 -0.95 -0.15 0.00 0.00 0.00 0.00 19.45 18.84 3gvx n ALA 180 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.50 176.00 3gvx s ILE 181 N -2.31 1.95 0.51 0.00 2.07 -1.15 -4.39 121.20 117.87 3gvx s ILE 181 Ca 0.35 -1.26 -0.22 0.00 -1.41 0.00 0.00 60.65 58.11 3gvx s ILE 181 Cb 0.37 -1.66 -0.06 0.00 0.13 0.00 0.00 42.46 41.24 3gvx s ILE 181 CO -0.05 0.35 1.27 -2.84 -1.91 0.00 0.00 174.94 171.75 3gvx s PRO 182 N -1.10 3.43 -0.42 3.50 0.02 -1.26 -4.57 135.00 134.59 3gvx s PRO 182 Ca 0.10 2.02 -0.25 0.00 0.02 0.00 0.00 61.00 62.89 3gvx s PRO 182 Cb -0.09 -2.33 0.02 0.00 0.02 0.00 0.00 34.50 32.12 3gvx s PRO 182 CO 0.01 -0.89 0.89 -1.17 -0.33 0.00 0.00 177.00 175.50 3gvx s LEU 183 N -3.29 4.05 0.00 -5.54 2.96 -1.26 -4.78 118.68 110.82 3gvx s LEU 183 Ca 0.68 0.23 0.04 0.00 -0.22 0.00 0.00 54.13 54.85 3gvx s LEU 183 Cb -0.35 -3.15 -0.01 0.00 0.50 0.00 0.00 46.19 43.17 3gvx s LEU 183 CO 0.42 -0.94 0.13 0.35 -1.32 0.00 0.00 176.35 174.99 3gvx n THR 184 N 6.19 0.00 0.14 3.68 -2.24 -1.26 -4.97 114.28 115.82 3gvx n THR 184 Ca 0.05 -1.56 0.06 0.00 -2.27 0.00 0.00 64.05 60.34 3gvx n THR 184 Cb 0.48 0.66 0.53 0.00 -2.10 0.00 0.00 70.33 69.90 3gvx n THR 184 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 3gvx h ASP 185 N 1.18 0.21 0.66 3.42 3.45 -1.95 0.11 116.42 123.49 3gvx h ASP 185 Ca -0.18 -0.01 0.00 0.00 0.43 0.00 0.00 57.03 57.27 3gvx h ASP 185 Cb 0.78 -0.05 0.00 0.00 -0.56 0.00 0.00 39.33 39.50 3gvx h ASP 185 CO 0.28 0.17 -0.85 0.29 -1.57 0.00 0.00 179.24 177.57 3gvx n LYS 186 N -4.48 0.31 0.03 3.56 5.02 -1.26 -4.00 118.16 117.33 3gvx n LYS 186 Ca -0.00 0.04 0.11 0.00 -2.02 0.00 0.00 58.31 56.44 3gvx n LYS 186 Cb 0.10 -1.65 -0.10 0.00 -0.02 0.00 0.00 35.03 33.35 3gvx n LYS 186 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 3gvx n THR 187 N -2.08 0.21 -1.71 -0.18 -2.24 -0.96 -4.91 114.28 102.41 3gvx n THR 187 Ca 0.02 -0.49 -0.43 0.00 -2.27 0.00 0.00 64.05 60.88 3gvx n THR 187 Cb 0.45 -0.08 -0.03 0.00 -2.10 0.00 0.00 70.33 68.56 3gvx n THR 187 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 3gvx n ARG 188 N -2.37 2.71 -2.30 -0.78 0.63 -0.01 -4.48 116.66 110.05 3gvx n ARG 188 Ca -0.02 0.98 -0.04 0.00 -0.92 0.00 0.00 57.85 57.84 3gvx n ARG 188 Cb 0.55 -2.82 0.00 0.00 0.45 0.00 0.00 32.46 30.65 3gvx n ARG 188 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 3gvx n GLY 189 N 3.94 -1.58 0.04 5.14 0.00 0.05 -4.97 105.19 107.82 3gvx n GLY 189 Ca 0.16 0.62 0.00 0.00 0.00 0.00 0.00 46.02 46.81 3gvx n GLY 189 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3gvx n VAL 191 N -0.23 0.00 -4.46 1.61 0.31 -0.52 -4.38 118.33 110.66 3gvx n VAL 191 Ca 0.06 0.00 -0.22 0.00 -0.01 0.00 0.00 64.34 64.17 3gvx n VAL 191 Cb 0.23 0.00 -0.10 0.00 -0.91 0.00 0.00 33.84 33.05 3gvx n VAL 191 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 3gvx s ASN 192 N 0.00 2.44 0.24 4.52 2.20 -1.26 -2.27 114.94 120.81 3gvx s ASN 192 Ca 0.00 -1.39 -0.00 0.00 -0.94 0.00 0.00 52.86 50.52 3gvx s ASN 192 Cb 0.00 -0.06 0.56 0.00 -2.00 0.00 0.00 41.25 39.75 3gvx s ASN 192 CO 0.00 -0.62 1.25 -1.20 -2.94 0.00 0.00 177.10 173.58 3gvx n SER 193 N -0.73 -0.13 -0.22 3.54 7.64 -1.26 0.90 113.62 123.36 3gvx n SER 193 Ca -0.03 1.36 -0.08 0.00 1.01 0.00 0.00 58.87 61.13 3gvx n SER 193 Cb 0.67 -0.48 0.03 0.00 -1.01 0.00 0.00 64.21 63.42 3gvx n SER 193 CO 0.00 0.00 0.00 -0.09 -3.01 0.00 0.00 175.04 171.94 3gvx h ARG 194 N 0.00 0.97 -0.17 1.43 2.43 -1.98 -2.49 114.38 114.56 3gvx h ARG 194 Ca 0.46 -0.23 -0.13 0.00 -0.81 0.00 0.00 59.98 59.27 3gvx h ARG 194 Cb 0.91 -0.13 0.00 0.00 -0.42 0.00 0.00 29.97 30.33 3gvx h ARG 194 CO -0.76 0.88 -0.40 1.25 -1.51 0.00 0.00 179.97 179.42 3gvx h LEU 195 N 0.88 0.66 -1.70 3.80 5.85 0.13 -3.26 115.31 121.67 3gvx h LEU 195 Ca 0.19 -0.57 0.08 0.00 0.84 0.00 0.00 57.88 58.43 3gvx h LEU 195 Cb 0.34 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 41.15 3gvx h LEU 195 CO 0.00 1.10 0.35 -0.07 -0.34 0.00 0.00 178.44 179.48 3gvx h LEU 196 N 0.24 0.32 -0.93 2.25 3.38 -0.63 -1.67 115.31 118.28 3gvx h LEU 196 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3gvx h LEU 196 Cb 1.01 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.70 3gvx h LEU 196 CO 0.09 0.20 0.12 0.00 0.09 0.00 0.00 178.44 178.93 3gvx n ALA 197 N -2.53 0.86 0.94 1.53 0.00 -0.94 -0.26 120.51 120.10 3gvx n ALA 197 Ca 0.08 0.13 0.13 0.00 0.00 0.00 0.00 53.44 53.78 3gvx n ALA 197 Cb 0.33 -1.03 0.43 0.00 0.00 0.00 0.00 19.45 19.17 3gvx n ALA 197 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3gvx n ASN 198 N -2.00 0.30 -4.68 0.00 3.02 -0.63 -4.92 115.26 106.36 3gvx n ASN 198 Ca -0.01 0.19 -0.47 0.00 -0.03 0.00 0.00 54.58 54.26 3gvx n ASN 198 Cb 0.14 -0.19 -0.04 0.00 -0.61 0.00 0.00 39.78 39.08 3gvx n ASN 198 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3gvx n ALA 199 N -1.55 1.17 -0.90 5.41 0.00 0.64 -4.24 120.51 121.04 3gvx n ALA 199 Ca 0.06 0.35 -0.29 0.00 0.00 0.00 0.00 53.44 53.56 3gvx n ALA 199 Cb 0.35 -2.44 0.19 0.00 0.00 0.00 0.00 19.45 17.55 3gvx n ALA 199 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 3gvx s ARG 200 N 2.64 0.35 0.22 0.00 0.52 -1.26 -4.92 118.95 116.49 3gvx s ARG 200 Ca 0.86 0.89 -0.30 0.00 -0.52 0.00 0.00 55.73 56.65 3gvx s ARG 200 Cb -0.67 -1.70 -0.10 0.00 0.52 0.00 0.00 34.95 33.01 3gvx s ARG 200 CO 0.45 -2.88 1.45 0.21 0.02 0.00 0.00 175.30 174.54 3gvx s LYS 201 N -4.74 4.27 -0.93 3.54 2.47 -1.26 -2.61 119.74 120.49 3gvx s LYS 201 Ca 0.66 2.28 0.00 0.00 -1.56 0.00 0.00 55.97 57.34 3gvx s LYS 201 Cb -0.21 -3.14 0.00 0.00 -1.46 0.00 0.00 37.83 33.02 3gvx s LYS 201 CO 0.60 -0.45 0.00 0.09 0.16 0.00 0.00 175.35 175.75 3gvx n ASN 202 N 2.84 -3.88 -4.77 1.43 3.02 -1.26 -4.99 115.26 107.65 3gvx n ASN 202 Ca 0.09 0.17 -0.41 0.00 -0.03 0.00 0.00 54.58 54.40 3gvx n ASN 202 Cb 0.40 -2.41 -0.00 0.00 -0.61 0.00 0.00 39.78 37.16 3gvx n ASN 202 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 3gvx s LEU 203 N -2.21 4.28 -0.14 3.41 2.96 -1.07 -4.84 118.68 121.07 3gvx s LEU 203 Ca 0.00 2.95 0.02 0.00 -0.22 0.00 0.00 54.13 56.88 3gvx s LEU 203 Cb 0.00 -3.74 0.00 0.00 0.50 0.00 0.00 46.19 42.95 3gvx s LEU 203 CO 0.00 -0.89 -0.19 -0.89 -1.32 0.00 0.00 176.35 173.06 3gvx s THR 204 N -1.15 2.34 -0.13 3.68 2.01 -1.05 -2.16 115.64 119.18 3gvx s THR 204 Ca 0.54 -0.89 -0.02 0.00 0.31 0.00 0.00 61.69 61.63 3gvx s THR 204 Cb -0.44 -1.95 -0.03 0.00 0.01 0.00 0.00 72.50 70.09 3gvx s THR 204 CO 0.59 0.54 -0.05 -0.63 -0.69 0.00 0.00 174.62 174.38 3gvx s ILE 205 N 0.70 3.78 -0.13 1.82 1.01 -0.26 -1.19 121.20 126.93 3gvx s ILE 205 Ca -0.09 -0.41 0.03 0.00 0.00 0.00 0.00 60.65 60.18 3gvx s ILE 205 Cb -0.16 -2.63 0.01 0.00 0.01 0.00 0.00 42.46 39.69 3gvx s ILE 205 CO 0.01 0.52 -0.22 -0.69 0.00 0.00 0.00 174.94 174.57 3gvx s VAL 206 N 0.09 2.01 -0.30 2.92 1.01 0.64 0.70 120.40 127.46 3gvx s VAL 206 Ca -0.01 -0.96 -0.03 0.00 0.00 0.00 0.00 61.98 60.98 3gvx s VAL 206 Cb -0.14 -1.78 0.04 0.00 0.00 0.00 0.00 36.38 34.51 3gvx s VAL 206 CO 0.03 0.54 0.03 0.21 0.00 0.00 0.00 175.10 175.91 3gvx s ASN 207 N 0.78 4.96 -0.14 3.32 3.84 0.71 0.43 114.94 128.84 3gvx s ASN 207 Ca -0.08 -1.16 0.15 0.00 0.21 0.00 0.00 52.86 51.98 3gvx s ASN 207 Cb -0.16 -1.76 0.32 0.00 -0.55 0.00 0.00 41.25 39.10 3gvx s ASN 207 CO -0.01 -0.26 1.16 1.33 -2.79 0.00 0.00 177.10 176.54 3gvx n VAL 208 N 4.69 1.78 0.00 -5.21 0.24 -0.65 -1.67 118.33 117.52 3gvx n VAL 208 Ca -0.13 -2.37 0.00 0.00 -2.04 0.00 0.00 64.34 59.80 3gvx n VAL 208 Cb 0.44 -0.13 0.00 0.00 -1.47 0.00 0.00 33.84 32.68 3gvx n VAL 208 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3gvx n ALA 209 N -1.15 0.00 -2.88 2.33 0.00 -1.10 -4.85 120.51 112.86 3gvx n ALA 209 Ca 0.15 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.48 3gvx n ALA 209 Cb 0.68 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 20.00 3gvx n ALA 209 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 3gvx s ARG 210 N 1.19 0.18 0.30 0.00 1.81 -1.26 -4.92 118.95 116.25 3gvx s ARG 210 Ca 0.00 -0.25 -0.00 0.00 -1.72 0.00 0.00 55.73 53.76 3gvx s ARG 210 Cb 0.00 -0.05 0.50 0.00 -0.45 0.00 0.00 34.95 34.95 3gvx s ARG 210 CO 0.00 0.01 1.92 0.00 -0.68 0.00 0.00 175.30 176.55 3gvx h ALA 211 N 5.61 1.48 0.00 2.13 0.00 -1.82 -2.43 119.26 124.23 3gvx h ALA 211 Ca -0.28 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.60 3gvx h ALA 211 Cb 1.21 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.71 3gvx h ALA 211 CO 0.47 0.40 0.00 -0.25 0.00 0.00 0.00 179.25 179.87 3gvx n ASP 212 N -4.47 0.00 0.03 0.00 8.00 -1.26 -0.73 116.55 118.11 3gvx n ASP 212 Ca 0.13 0.21 0.12 0.00 0.71 0.00 0.00 54.79 55.96 3gvx n ASP 212 Cb 0.17 -0.35 0.49 0.00 -0.02 0.00 0.00 41.12 41.40 3gvx n ASP 212 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 3gvx n VAL 213 N -1.35 0.44 -5.06 2.53 0.31 -0.91 -0.77 118.33 113.52 3gvx n VAL 213 Ca 0.06 0.05 -0.32 0.00 -0.01 0.00 0.00 64.34 64.11 3gvx n VAL 213 Cb 0.13 -0.71 -0.15 0.00 -0.91 0.00 0.00 33.84 32.19 3gvx n VAL 213 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 3gvx s VAL 214 N -3.04 2.50 -0.32 2.52 1.01 0.09 -1.44 120.40 121.72 3gvx s VAL 214 Ca 0.11 -0.89 -0.29 0.00 0.00 0.00 0.00 61.98 60.91 3gvx s VAL 214 Cb 0.14 -1.98 -0.01 0.00 0.00 0.00 0.00 36.38 34.54 3gvx s VAL 214 CO 0.45 0.56 1.57 -0.55 0.00 0.00 0.00 175.10 177.13 3gvx s SER 215 N 0.02 6.26 0.11 3.32 0.15 -0.96 -4.71 113.70 117.89 3gvx s SER 215 Ca -0.07 1.25 -0.26 0.00 0.70 0.00 0.00 55.95 57.57 3gvx s SER 215 Cb -0.15 -2.53 -0.08 0.00 -1.71 0.00 0.00 66.02 61.55 3gvx s SER 215 CO 0.05 -1.42 1.65 0.50 1.20 0.00 0.00 173.24 175.22 3gvx h LYS 216 N 11.18 -0.40 -0.26 5.44 3.64 -1.89 -2.81 116.57 131.45 3gvx h LYS 216 Ca -0.31 0.03 -0.05 0.00 -1.27 0.00 0.00 60.65 59.05 3gvx h LYS 216 Cb 1.14 0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 33.03 3gvx h LYS 216 CO 1.04 -0.27 -0.04 -1.35 -2.27 0.00 0.00 179.45 176.56 3gvx h PRO 217 N -0.42 0.40 -0.32 1.90 0.11 -1.99 -1.99 132.00 129.69 3gvx h PRO 217 Ca 0.04 -0.08 0.00 0.00 0.11 0.00 0.00 66.00 66.06 3gvx h PRO 217 Cb 0.46 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 31.51 3gvx h PRO 217 CO -0.15 0.46 0.00 -0.25 -0.21 0.00 0.00 178.00 177.85 3gvx n ASP 218 N -4.29 0.32 0.00 -2.05 9.92 -1.06 -1.08 116.55 118.30 3gvx n ASP 218 Ca 0.01 -0.67 0.00 0.00 -0.53 0.00 0.00 54.79 53.59 3gvx n ASP 218 Cb 0.24 -0.16 0.00 0.00 -0.64 0.00 0.00 41.12 40.56 3gvx n ASP 218 CO 0.00 0.00 0.00 -0.38 0.13 0.00 0.00 177.20 176.95 3gvx n ILE 220 N 0.29 0.00 0.10 0.53 5.41 -0.75 -0.80 119.36 124.14 3gvx n ILE 220 Ca 0.00 0.00 -0.20 0.00 1.00 0.00 0.00 62.75 63.55 3gvx n ILE 220 Cb 0.08 0.00 -0.12 0.00 -0.71 0.00 0.00 39.64 38.89 3gvx n ILE 220 CO 0.00 0.00 0.00 1.23 0.00 0.00 0.00 176.55 177.78 3gvx h GLY 221 N 0.00 0.58 2.00 7.39 0.00 -1.35 -3.26 103.07 108.43 3gvx h GLY 221 Ca 0.00 -1.25 -0.08 0.00 0.00 0.00 0.00 47.33 46.00 3gvx h GLY 221 CO 0.00 1.10 -0.37 -2.75 0.00 0.00 0.00 176.54 174.52 3gvx h PHE 222 N 0.22 0.00 0.00 5.60 3.57 -1.20 -2.81 116.94 122.32 3gvx h PHE 222 Ca -0.17 0.00 -0.05 0.00 3.53 0.00 0.00 57.97 61.28 3gvx h PHE 222 Cb 1.90 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 40.63 3gvx h PHE 222 CO 0.10 0.37 -0.26 -0.07 -2.23 0.00 0.00 178.31 176.22 3gvx h LEU 223 N 0.00 0.00 0.15 0.59 3.38 -1.81 -0.23 115.31 117.39 3gvx h LEU 223 Ca -0.00 0.00 -0.20 0.00 0.09 0.00 0.00 57.88 57.77 3gvx h LEU 223 Cb 0.72 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.49 3gvx h LEU 223 CO 0.05 0.26 -0.86 0.11 0.09 0.00 0.00 178.44 178.08 3gvx h LYS 224 N 0.00 0.32 0.60 1.13 1.79 -1.55 -3.26 116.57 115.60 3gvx h LYS 224 Ca -0.00 -0.54 -0.03 0.00 -2.18 0.00 0.00 60.65 57.90 3gvx h LYS 224 Cb 0.86 0.20 0.01 0.00 -1.58 0.00 0.00 32.23 31.72 3gvx h LYS 224 CO 0.03 1.26 -0.29 0.93 -1.08 0.00 0.00 179.45 180.30 3gvx h GLU 225 N -0.34 -0.78 -3.45 3.15 5.08 -1.44 -3.35 114.58 113.45 3gvx h GLU 225 Ca -0.15 0.05 -0.76 0.00 -1.00 0.00 0.00 59.36 57.50 3gvx h GLU 225 Cb 1.68 0.18 -0.17 0.00 0.50 0.00 0.00 28.75 30.94 3gvx h GLU 225 CO 0.16 -0.52 1.87 -2.13 -1.00 0.00 0.00 179.01 177.39 3gvx n ARG 226 N -4.76 3.72 0.00 2.33 3.00 -0.11 -4.88 116.66 115.97 3gvx n ARG 226 Ca -0.10 -3.65 0.02 0.00 -0.00 0.00 0.00 57.85 54.12 3gvx n ARG 226 Cb 0.32 -2.88 0.10 0.00 0.00 0.00 0.00 32.46 30.01 3gvx n ARG 226 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.63 176.50 3gvx n SER 227 N 3.59 0.00 0.09 6.15 3.41 -1.23 -1.91 113.62 123.72 3gvx n SER 227 Ca 0.38 0.27 0.12 0.00 -0.26 0.00 0.00 58.87 59.38 3gvx n SER 227 Cb 0.36 -0.32 0.12 0.00 -0.26 0.00 0.00 64.21 64.11 3gvx n SER 227 CO 0.00 0.00 0.00 -2.24 -0.16 0.00 0.00 175.04 172.64 3gvx h ASP 228 N 0.00 0.00 -3.39 4.04 2.03 -1.89 -3.46 116.42 113.74 3gvx h ASP 228 Ca 0.00 -0.12 -0.55 0.00 -0.73 0.00 0.00 57.03 55.63 3gvx h ASP 228 Cb 0.04 0.00 -0.04 0.00 -0.83 0.00 0.00 39.33 38.50 3gvx h ASP 228 CO 0.00 0.06 0.10 -0.69 -1.03 0.00 0.00 179.24 177.68 3gvx s VAL 229 N -3.24 4.71 0.17 4.15 1.01 -0.80 -4.29 120.40 122.11 3gvx s VAL 229 Ca 0.04 1.51 0.09 0.00 0.00 0.00 0.00 61.98 63.62 3gvx s VAL 229 Cb 0.11 -4.05 -0.04 0.00 0.00 0.00 0.00 36.38 32.40 3gvx s VAL 229 CO 0.74 0.43 -0.14 0.26 0.00 0.00 0.00 175.10 176.38 3gvx s TRP 230 N -0.40 2.55 -0.20 5.22 0.52 -0.92 -4.86 118.94 120.84 3gvx s TRP 230 Ca 0.35 -0.26 -0.00 0.00 0.02 0.00 0.00 56.10 56.22 3gvx s TRP 230 Cb -0.20 -1.27 0.05 0.00 -1.15 0.00 0.00 33.47 30.90 3gvx s TRP 230 CO 0.22 0.48 -0.05 -0.47 0.02 0.00 0.00 176.95 177.15 3gvx s TYR 231 N -1.58 2.04 -0.22 -1.98 5.04 -0.88 -1.10 117.35 118.67 3gvx s TYR 231 Ca 0.23 -1.43 -0.05 0.00 -2.44 0.00 0.00 57.07 53.37 3gvx s TYR 231 Cb -0.09 -1.45 -0.02 0.00 0.35 0.00 0.00 41.96 40.75 3gvx s TYR 231 CO 0.13 -0.70 0.01 -0.51 -1.34 0.00 0.00 175.55 173.14 3gvx s LEU 232 N 1.52 3.21 0.02 6.97 1.43 0.22 -2.86 118.68 129.19 3gvx s LEU 232 Ca -0.03 -0.26 0.01 0.00 -1.03 0.00 0.00 54.13 52.82 3gvx s LEU 232 Cb -0.17 -1.83 -0.02 0.00 0.03 0.00 0.00 46.19 44.20 3gvx s LEU 232 CO -0.07 0.01 -0.04 -0.55 0.23 0.00 0.00 176.35 175.93 3gvx s SER 233 N 1.35 0.38 0.00 2.29 0.15 -0.72 -0.20 113.70 116.95 3gvx s SER 233 Ca 0.04 -0.37 0.21 0.00 0.70 0.00 0.00 55.95 56.54 3gvx s SER 233 Cb -0.15 0.05 0.17 0.00 -1.71 0.00 0.00 66.02 64.38 3gvx s SER 233 CO 0.01 -0.18 1.17 -0.67 1.20 0.00 0.00 173.24 174.77 3gvx n ASP 234 N 2.00 2.77 -3.88 5.45 2.03 -0.67 -0.84 116.55 123.41 3gvx n ASP 234 Ca -0.20 -1.89 -0.17 0.00 0.52 0.00 0.00 54.79 53.05 3gvx n ASP 234 Cb 0.56 -0.00 -0.16 0.00 -0.72 0.00 0.00 41.12 40.81 3gvx n ASP 234 CO 0.00 0.00 0.00 0.68 -1.92 0.00 0.00 177.20 175.96 3gvx s VAL 235 N -1.77 0.34 0.30 5.18 -7.23 -1.25 0.90 120.40 116.86 3gvx s VAL 235 Ca 0.25 -0.07 0.11 0.00 -1.81 0.00 0.00 61.98 60.46 3gvx s VAL 235 Cb 0.18 -0.36 -0.05 0.00 0.56 0.00 0.00 36.38 36.70 3gvx s VAL 235 CO 0.27 0.15 -0.14 0.86 -0.31 0.00 0.00 175.10 175.92 3gvx s TRP 236 N 0.61 2.37 0.49 2.82 -0.11 -1.26 -4.51 118.94 119.35 3gvx s TRP 236 Ca -0.07 -0.37 -0.21 0.00 1.22 0.00 0.00 56.10 56.67 3gvx s TRP 236 Cb -0.10 -1.14 -0.07 0.00 -1.50 0.00 0.00 33.47 30.66 3gvx s TRP 236 CO -0.01 0.66 1.12 -1.58 -4.62 0.00 0.00 176.95 172.53 3gvx s TRP 237 N -2.52 2.85 0.00 5.86 0.51 -1.26 -4.16 118.94 120.22 3gvx s TRP 237 Ca 0.31 1.56 0.00 0.00 -2.12 0.00 0.00 56.10 55.85 3gvx s TRP 237 Cb -0.03 -3.27 0.00 0.00 -0.81 0.00 0.00 33.47 29.36 3gvx s TRP 237 CO 0.16 -1.34 0.00 0.09 -0.51 0.00 0.00 176.95 175.35 3gvx n ASN 238 N -0.84 0.00 -1.84 2.95 3.02 -1.26 -4.51 115.26 112.78 3gvx n ASN 238 Ca 0.09 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.64 3gvx n ASN 238 Cb 0.50 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.67 3gvx n ASN 238 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3gvx n GLU 239 N 0.00 -2.75 0.00 3.52 1.02 -1.26 -4.69 120.64 116.48 3gvx n GLU 239 Ca 0.00 1.94 0.14 0.00 -0.02 0.00 0.00 57.16 59.22 3gvx n GLU 239 Cb 0.00 -2.39 0.62 0.00 -0.02 0.00 0.00 31.44 29.65 3gvx n GLU 239 CO 0.00 0.00 0.00 -0.35 1.18 0.00 0.00 177.13 177.96 3gvx n PRO 240 N 1.76 0.87 -1.11 3.49 -0.04 -1.26 -4.96 135.00 133.74 3gvx n PRO 240 Ca 0.00 -0.32 -0.33 0.00 -0.04 0.00 0.00 63.50 62.80 3gvx n PRO 240 Cb 0.00 -1.49 -0.03 0.00 -0.04 0.00 0.00 33.50 31.94 3gvx n PRO 240 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 3gvx n GLU 241 N -0.78 2.53 -2.32 0.54 1.02 -1.26 -4.90 120.64 115.46 3gvx n GLU 241 Ca 0.16 -1.90 -0.41 0.00 -0.02 0.00 0.00 57.16 54.99 3gvx n GLU 241 Cb 0.27 -2.75 -0.03 0.00 -0.02 0.00 0.00 31.44 28.91 3gvx n GLU 241 CO 0.00 0.00 0.00 0.96 1.18 0.00 0.00 177.13 179.27 3gvx s ILE 242 N 3.33 3.50 0.06 -3.67 -4.36 -1.26 -4.80 121.20 113.99 3gvx s ILE 242 Ca 0.52 1.22 0.04 0.00 -0.26 0.00 0.00 60.65 62.17 3gvx s ILE 242 Cb 0.14 -3.78 -0.03 0.00 1.25 0.00 0.00 42.46 40.04 3gvx s ILE 242 CO -0.02 0.18 -0.11 0.42 0.24 0.00 0.00 174.94 175.64 3gvx s THR 243 N 0.16 0.84 0.00 8.37 -4.23 -1.26 -4.81 115.64 114.70 3gvx s THR 243 Ca 0.55 -1.18 0.00 0.00 -1.18 0.00 0.00 61.69 59.88 3gvx s THR 243 Cb -0.34 -0.85 0.00 0.00 1.34 0.00 0.00 72.50 72.66 3gvx s THR 243 CO 0.36 -0.29 0.00 1.21 -0.54 0.00 0.00 174.62 175.36 3gvx n GLU 244 N 1.39 0.00 0.29 3.99 2.13 -1.26 -4.88 120.64 122.30 3gvx n GLU 244 Ca -0.22 0.00 0.16 0.00 0.66 0.00 0.00 57.16 57.77 3gvx n GLU 244 Cb 0.54 -1.82 0.89 0.00 0.27 0.00 0.00 31.44 31.33 3gvx n GLU 244 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 3gvx h THR 245 N 0.00 0.34 -0.30 6.31 1.03 -2.02 -3.40 112.91 114.89 3gvx h THR 245 Ca 0.00 -0.28 -0.72 0.00 -0.01 0.00 0.00 66.41 65.40 3gvx h THR 245 Cb 0.00 1.20 -0.06 0.00 -1.07 0.00 0.00 68.15 68.22 3gvx h THR 245 CO 0.00 0.05 2.90 -3.20 -0.01 0.00 0.00 175.52 175.25 3gvx n ASN 246 N -3.47 4.14 -4.88 0.00 2.85 -1.26 -4.95 115.26 107.69 3gvx n ASN 246 Ca -0.02 -2.89 -0.34 0.00 -0.11 0.00 0.00 54.58 51.21 3gvx n ASN 246 Cb 0.17 -1.63 -0.05 0.00 1.24 0.00 0.00 39.78 39.51 3gvx n ASN 246 CO 0.00 0.00 0.00 -0.76 -2.11 0.00 0.00 177.26 174.39 3gvx s LEU 247 N 1.80 4.33 -0.01 1.20 1.43 -1.26 -5.04 118.68 121.13 3gvx s LEU 247 Ca 0.46 0.71 -0.04 0.00 -1.03 0.00 0.00 54.13 54.23 3gvx s LEU 247 Cb 0.13 -3.00 -0.02 0.00 0.03 0.00 0.00 46.19 43.33 3gvx s LEU 247 CO -0.07 0.16 0.43 -0.09 0.23 0.00 0.00 176.35 177.01 3gvx h ARG 248 N 3.58 -0.14 -3.23 1.70 2.43 -1.98 -3.36 114.38 113.38 3gvx h ARG 248 Ca -0.49 0.01 -0.39 0.00 -0.81 0.00 0.00 59.98 58.30 3gvx h ARG 248 Cb 1.19 0.03 0.01 0.00 -0.42 0.00 0.00 29.97 30.78 3gvx h ARG 248 CO 0.68 -0.09 2.49 0.27 -1.51 0.00 0.00 179.97 181.80 3gvx n ASN 249 N -2.90 5.40 -3.50 -3.80 2.04 -1.26 -4.77 115.26 106.47 3gvx n ASN 249 Ca -0.02 -2.34 -0.17 0.00 -0.44 0.00 0.00 54.58 51.61 3gvx n ASN 249 Cb 0.06 -1.15 -0.05 0.00 -2.53 0.00 0.00 39.78 36.10 3gvx n ASN 249 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 3gvx s ALA 250 N 2.98 -1.73 -0.06 -2.53 0.00 -1.26 -2.07 121.76 117.09 3gvx s ALA 250 Ca 0.45 1.16 0.01 0.00 0.00 0.00 0.00 51.96 53.59 3gvx s ALA 250 Cb 0.13 0.16 0.02 0.00 0.00 0.00 0.00 23.12 23.43 3gvx s ALA 250 CO -0.03 -0.44 -0.07 0.42 0.00 0.00 0.00 175.76 175.64 3gvx s ILE 251 N -1.64 0.76 0.17 0.00 1.01 -1.13 -4.94 121.20 115.41 3gvx s ILE 251 Ca -0.09 -0.23 0.08 0.00 0.00 0.00 0.00 60.65 60.41 3gvx s ILE 251 Cb -0.00 -0.75 -0.04 0.00 0.01 0.00 0.00 42.46 41.68 3gvx s ILE 251 CO 0.06 0.28 -0.17 -0.76 0.00 0.00 0.00 174.94 174.35 3gvx s LEU 252 N 0.97 2.46 0.00 2.97 1.43 -1.26 -1.76 118.68 123.49 3gvx s LEU 252 Ca -0.10 -0.88 -0.03 0.00 -1.03 0.00 0.00 54.13 52.09 3gvx s LEU 252 Cb -0.14 -0.75 -0.01 0.00 0.03 0.00 0.00 46.19 45.32 3gvx s LEU 252 CO 0.00 -0.08 0.05 -0.94 0.23 0.00 0.00 176.35 175.61 3gvx s SER 253 N -2.76 0.08 -1.21 2.29 1.04 -0.02 -4.97 113.70 108.14 3gvx s SER 253 Ca 0.16 -0.21 -0.08 0.00 0.48 0.00 0.00 55.95 56.30 3gvx s SER 253 Cb -0.05 0.14 -0.07 0.00 0.10 0.00 0.00 66.02 66.15 3gvx s SER 253 CO 0.06 -0.23 2.45 -0.81 0.98 0.00 0.00 173.24 175.69 3gvx n PRO 254 N 2.05 2.73 -3.91 4.02 -0.04 -1.26 -3.92 135.00 134.66 3gvx n PRO 254 Ca -0.20 -1.81 -0.25 0.00 -0.04 0.00 0.00 63.50 61.20 3gvx n PRO 254 Cb 0.57 -2.64 -0.01 0.00 -0.04 0.00 0.00 33.50 31.38 3gvx n PRO 254 CO 0.00 0.00 0.00 1.58 -0.04 0.00 0.00 175.50 177.04 3gvx n HIS 255 N 4.16 -1.75 0.04 0.54 -0.00 0.26 -4.87 115.22 113.61 3gvx n HIS 255 Ca 0.59 0.78 0.03 0.00 0.46 0.00 0.00 57.72 59.58 3gvx n HIS 255 Cb 0.19 -3.85 0.06 0.00 -0.12 0.00 0.00 29.99 26.27 3gvx n HIS 255 CO 0.00 0.00 0.00 1.33 0.46 0.00 0.00 176.34 178.13 3gvx n VAL 256 N -4.39 0.60 -0.22 3.57 0.24 -1.26 -4.74 118.33 112.13 3gvx n VAL 256 Ca -0.27 -0.80 -0.00 0.00 -2.04 0.00 0.00 64.34 61.23 3gvx n VAL 256 Cb 0.66 0.75 0.11 0.00 -1.47 0.00 0.00 33.84 33.89 3gvx n VAL 256 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3gvx h ALA 257 N 1.16 0.87 -0.77 2.33 0.00 -1.89 -2.08 119.26 118.88 3gvx h ALA 257 Ca 0.00 0.05 -0.33 0.00 0.00 0.00 0.00 54.91 54.63 3gvx h ALA 257 Cb 0.48 -0.04 -0.20 0.00 0.00 0.00 0.00 17.79 18.03 3gvx h ALA 257 CO 0.00 -0.07 0.42 0.41 0.00 0.00 0.00 179.25 180.01 3gvx n GLY 258 N -1.29 3.81 1.24 0.00 0.00 -1.26 -3.19 105.19 104.49 3gvx n GLY 258 Ca 0.09 -0.91 0.00 0.00 0.00 0.00 0.00 46.02 45.20 3gvx n GLY 258 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3gvx n GLY 259 N -0.54 1.09 0.00 -0.02 0.00 -0.78 -4.92 105.19 100.03 3gvx n GLY 259 Ca 0.45 -0.92 0.00 0.00 0.00 0.00 0.00 46.02 45.54 3gvx n GLY 259 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3gvx n SER 261 N 1.68 0.00 -2.69 1.61 3.41 -1.26 -4.28 113.62 112.10 3gvx n SER 261 Ca 0.00 0.00 -0.37 0.00 -0.26 0.00 0.00 58.87 58.24 3gvx n SER 261 Cb 0.00 0.00 0.05 0.00 -0.26 0.00 0.00 64.21 64.00 3gvx n SER 261 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3gvx n GLY 262 N 0.00 5.68 3.75 5.00 0.00 -1.26 -4.99 105.19 113.36 3gvx n GLY 262 Ca 0.00 -2.44 -0.41 0.00 0.00 0.00 0.00 46.02 43.17 3gvx n GLY 262 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3gvx s GLU 263 N -3.97 4.44 0.00 1.61 2.12 -1.26 -5.24 118.70 116.41 3gvx s GLU 263 Ca 0.56 2.00 0.00 0.00 0.36 0.00 0.00 54.97 57.89 3gvx s GLU 263 Cb 0.46 -3.19 0.00 0.00 0.26 0.00 0.00 34.13 31.66 3gvx s GLU 263 CO -0.27 -0.14 0.00 -0.89 -0.54 0.00 0.00 175.26 173.42 3gvx n ILE 264 N 2.12 0.00 0.10 -3.70 -0.00 -1.26 -5.08 119.36 111.54 3gvx n ILE 264 Ca 0.04 0.00 0.05 0.00 -0.00 0.00 0.00 62.75 62.83 3gvx n ILE 264 Cb 0.43 -0.39 -0.07 0.00 -0.00 0.00 0.00 39.64 39.61 3gvx n ILE 264 CO 0.00 0.00 0.00 0.47 -0.00 0.00 0.00 176.55 177.02 3gvx n ASP 266 N -1.29 2.28 0.16 4.38 8.00 -1.26 -4.99 116.55 123.82 3gvx n ASP 266 Ca 0.00 -0.18 0.08 0.00 0.71 0.00 0.00 54.79 55.40 3gvx n ASP 266 Cb 0.00 1.32 0.08 0.00 -0.02 0.00 0.00 41.12 42.50 3gvx n ASP 266 CO 0.00 0.00 0.00 0.40 -0.39 0.00 0.00 177.20 177.21 3gvx h ILE 267 N 0.00 0.29 -0.32 0.53 1.08 -2.02 -3.36 117.51 113.72 3gvx h ILE 267 Ca 0.00 -1.44 0.04 0.00 -0.39 0.00 0.00 64.86 63.07 3gvx h ILE 267 Cb 0.37 2.05 -0.04 0.00 -3.07 0.00 0.00 36.82 36.13 3gvx h ILE 267 CO 0.00 0.17 0.11 0.00 -0.69 0.00 0.00 178.15 177.73 3gvx h ALA 268 N 1.81 0.37 -0.75 1.87 0.00 -1.94 -2.25 119.26 118.36 3gvx h ALA 268 Ca -0.01 0.04 0.02 0.00 0.00 0.00 0.00 54.91 54.95 3gvx h ALA 268 Cb 1.16 0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.93 3gvx h ALA 268 CO 0.02 -0.29 0.50 0.97 0.00 0.00 0.00 179.25 180.45 3gvx h ILE 269 N 0.24 1.17 -0.34 0.00 6.09 -1.87 -1.18 117.51 121.62 3gvx h ILE 269 Ca 0.15 -0.34 -0.10 0.00 -1.37 0.00 0.00 64.86 63.19 3gvx h ILE 269 Cb 0.12 0.09 -0.01 0.00 0.47 0.00 0.00 36.82 37.49 3gvx h ILE 269 CO -0.15 0.18 -0.19 -0.61 -3.07 0.00 0.00 178.15 174.31 3gvx h GLN 270 N 0.99 0.73 -0.45 2.19 4.15 -1.66 -2.59 115.11 118.47 3gvx h GLN 270 Ca 0.28 -0.33 -0.02 0.00 0.77 0.00 0.00 58.65 59.36 3gvx h GLN 270 Cb -0.07 -0.02 -0.02 0.00 0.21 0.00 0.00 27.48 27.59 3gvx h GLN 270 CO -0.07 0.94 0.19 -0.07 -1.93 0.00 0.00 178.83 177.89 3gvx h LEU 271 N 0.50 0.56 0.08 -2.39 3.38 -0.93 -0.78 115.31 115.73 3gvx h LEU 271 Ca 0.07 -0.05 -0.00 0.00 0.09 0.00 0.00 57.88 57.98 3gvx h LEU 271 Cb 0.73 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.34 3gvx h LEU 271 CO 0.05 0.50 -0.04 0.00 0.09 0.00 0.00 178.44 179.05 3gvx h ALA 272 N 1.59 -0.11 -0.46 1.53 0.00 -0.97 -0.78 119.26 120.06 3gvx h ALA 272 Ca 0.16 -0.05 -0.07 0.00 0.00 0.00 0.00 54.91 54.94 3gvx h ALA 272 Cb 0.10 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 3gvx h ALA 272 CO -0.02 -0.53 -0.02 0.74 0.00 0.00 0.00 179.25 179.42 3gvx h PHE 273 N -0.17 0.82 -0.85 0.00 0.04 -1.12 -2.69 116.94 112.97 3gvx h PHE 273 Ca -0.01 -0.12 -0.02 0.00 2.80 0.00 0.00 57.97 60.62 3gvx h PHE 273 Cb 0.14 -0.22 -0.04 0.00 2.20 0.00 0.00 35.95 38.02 3gvx h PHE 273 CO -0.05 0.77 0.45 0.93 -0.60 0.00 0.00 178.31 179.81 3gvx h GLU 274 N 0.72 1.20 -0.03 1.51 5.08 -0.92 -1.31 114.58 120.83 3gvx h GLU 274 Ca 0.14 -0.15 -0.04 0.00 -1.00 0.00 0.00 59.36 58.30 3gvx h GLU 274 Cb 0.46 -0.23 -0.01 0.00 0.50 0.00 0.00 28.75 29.48 3gvx h GLU 274 CO 0.02 0.90 -0.18 -0.97 -1.00 0.00 0.00 179.01 177.78 3gvx h ASN 275 N 1.20 0.05 -0.33 1.42 -0.00 -0.82 -0.07 115.58 117.04 3gvx h ASN 275 Ca 0.30 -0.01 -0.04 0.00 -0.00 0.00 0.00 56.30 56.55 3gvx h ASN 275 Cb 0.06 -0.01 -0.01 0.00 -0.00 0.00 0.00 38.32 38.35 3gvx h ASN 275 CO -0.04 0.23 0.06 0.58 -0.00 0.00 0.00 177.43 178.26 3gvx h VAL 276 N 0.05 1.23 -0.61 2.57 2.07 -1.06 0.20 116.25 120.72 3gvx h VAL 276 Ca 0.01 -0.81 -0.06 0.00 0.82 0.00 0.00 66.70 66.66 3gvx h VAL 276 Cb 0.35 1.12 -0.03 0.00 -1.52 0.00 0.00 31.29 31.21 3gvx h VAL 276 CO 0.02 0.27 0.16 -0.09 0.02 0.00 0.00 177.57 177.95 3gvx h ARG 277 N 0.39 0.96 -0.28 1.57 2.43 -0.79 -2.52 114.38 116.14 3gvx h ARG 277 Ca 0.10 -0.23 -0.13 0.00 -0.81 0.00 0.00 59.98 58.92 3gvx h ARG 277 Cb 0.34 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 29.75 3gvx h ARG 277 CO 0.01 0.88 -0.36 -0.91 -1.51 0.00 0.00 179.97 178.07 3gvx h ASN 278 N 0.88 0.66 -0.98 -3.80 -0.26 -0.86 -2.79 115.58 108.42 3gvx h ASN 278 Ca 0.19 -0.28 0.01 0.00 -0.56 0.00 0.00 56.30 55.66 3gvx h ASN 278 Cb 0.34 -0.18 -0.05 0.00 -1.06 0.00 0.00 38.32 37.36 3gvx h ASN 278 CO -0.00 0.96 0.64 0.15 -1.06 0.00 0.00 177.43 178.12 3gvx h PHE 279 N 0.53 1.25 -0.00 1.19 3.57 -0.38 1.59 116.94 124.68 3gvx h PHE 279 Ca 0.05 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.57 3gvx h PHE 279 Cb 0.87 -0.42 0.00 0.00 2.79 0.00 0.00 35.95 39.19 3gvx h PHE 279 CO 0.04 0.80 -0.05 1.19 -2.23 0.00 0.00 178.31 178.06 3gvx n PHE 280 N -4.38 0.00 0.16 0.41 3.01 -0.97 -1.75 117.46 113.94 3gvx n PHE 280 Ca 0.11 0.00 0.12 0.00 1.01 0.00 0.00 57.45 58.69 3gvx n PHE 280 Cb 0.02 -0.21 0.01 0.00 -0.01 0.00 0.00 39.48 39.29 3gvx n PHE 280 CO 0.00 0.00 0.00 0.39 1.01 0.00 0.00 176.76 178.16 3gvx n GLU 281 N -1.12 0.56 0.00 -1.08 -0.58 -0.93 -4.92 120.64 112.57 3gvx n GLU 281 Ca 0.15 0.10 0.00 0.00 -0.42 0.00 0.00 57.16 57.00 3gvx n GLU 281 Cb 0.24 -1.79 0.00 0.00 -0.57 0.00 0.00 31.44 29.32 3gvx n GLU 281 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3gvx n GLY 282 N 1.21 1.34 2.73 0.62 0.00 -0.72 -5.07 105.19 105.30 3gvx n GLY 282 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.98 3gvx n GLY 282 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3gvx n GLU 283 N -0.29 1.38 -0.54 1.61 1.02 0.54 -4.97 120.64 119.40 3gvx n GLU 283 Ca 0.00 -2.74 -0.29 0.00 -0.02 0.00 0.00 57.16 54.11 3gvx n GLU 283 Cb 0.00 -0.87 0.23 0.00 -0.02 0.00 0.00 31.44 30.78 3gvx n GLU 283 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3gvx n GLY 284 N -0.59 -1.87 3.83 0.62 0.00 -1.19 -4.50 105.19 101.49 3gvx n GLY 284 Ca 0.02 -1.05 -0.32 0.00 0.00 0.00 0.00 46.02 44.66 3gvx n GLY 284 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 3gvx s HIS 285 N -2.41 3.27 -0.02 1.61 -3.43 -1.26 -4.94 115.29 108.11 3gvx s HIS 285 Ca 0.66 1.49 -0.25 0.00 -0.80 0.00 0.00 55.06 56.17 3gvx s HIS 285 Cb -0.23 -2.88 -0.04 0.00 -1.43 0.00 0.00 32.58 28.00 3gvx s HIS 285 CO 0.65 -0.63 0.76 -1.01 -2.00 0.00 0.00 174.74 172.50 3gvx s HIS 286 N -2.53 3.64 -1.47 0.38 3.76 -1.26 -4.96 115.29 112.85 3gvx s HIS 286 Ca 0.61 1.38 -0.13 0.00 -0.15 0.00 0.00 55.06 56.77 3gvx s HIS 286 Cb -0.12 -2.85 0.03 0.00 1.11 0.00 0.00 32.58 30.75 3gvx s HIS 286 CO 0.32 0.14 2.30 0.72 -0.85 0.00 0.00 174.74 177.38 3gvx n HIS 287 N 3.46 3.40 -2.30 1.40 8.25 -1.26 -4.98 115.22 123.20 3gvx n HIS 287 Ca -0.01 -2.99 -0.41 0.00 -0.26 0.00 0.00 57.72 54.06 3gvx n HIS 287 Cb 0.51 -2.54 -0.03 0.00 1.12 0.00 0.00 29.99 29.05 3gvx n HIS 287 CO 0.00 0.00 0.00 -1.01 0.64 0.00 0.00 176.34 175.97 3gvx s HIS 288 N 3.02 3.33 0.62 4.41 3.76 -1.26 -5.00 115.29 124.17 3gvx s HIS 288 Ca 0.49 1.47 -0.17 0.00 -0.15 0.00 0.00 55.06 56.70 3gvx s HIS 288 Cb 0.14 -3.49 -0.02 0.00 1.11 0.00 0.00 32.58 30.32 3gvx s HIS 288 CO -0.08 -1.33 1.16 -1.01 -0.85 0.00 0.00 174.74 172.62 3gvx s HIS 289 N -0.69 2.47 -1.89 1.40 3.76 -1.26 -4.46 115.29 114.61 3gvx s HIS 289 Ca 0.50 1.55 0.00 0.00 -0.15 0.00 0.00 55.06 56.95 3gvx s HIS 289 Cb -0.35 -3.34 0.00 0.00 1.11 0.00 0.00 32.58 29.99 3gvx s HIS 289 CO 0.43 -1.97 0.47 0.72 -0.85 0.00 0.00 174.74 173.54