#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fvt s ALA 2 N 0.00 3.60 0.38 -5.12 0.00 -1.26 -5.00 121.76 114.35 2fvt s ALA 2 Ca 0.00 -1.14 0.39 0.00 0.00 0.00 0.00 51.96 51.21 2fvt s ALA 2 Cb 0.00 -1.42 1.88 0.00 0.00 0.00 0.00 23.12 23.59 2fvt s ALA 2 CO 0.00 0.59 2.18 -0.56 0.00 0.00 0.00 175.76 177.96 2fvt h GLN 3 N 2.68 0.00 -4.10 0.00 3.07 -2.09 -3.33 115.11 111.33 2fvt h GLN 3 Ca -0.47 0.00 -0.68 0.00 0.09 0.00 0.00 58.65 57.58 2fvt h GLN 3 Cb 1.19 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 28.74 2fvt h GLN 3 CO 0.64 0.00 2.89 -2.13 0.09 0.00 0.00 178.83 180.33 2fvt n ARG 4 N -3.10 2.44 -0.09 0.06 0.63 -1.26 -4.26 116.66 111.07 2fvt n ARG 4 Ca -0.01 -2.31 -0.14 0.00 -0.92 0.00 0.00 57.85 54.46 2fvt n ARG 4 Cb 0.19 -3.13 -0.05 0.00 0.45 0.00 0.00 32.46 29.93 2fvt n ARG 4 CO 0.00 0.00 0.00 0.43 -2.51 0.00 0.00 177.63 175.55 2fvt n SER 5 N 6.39 1.86 -1.07 6.15 7.64 -1.25 -5.13 113.62 128.20 2fvt n SER 5 Ca 0.52 0.32 0.00 0.00 1.01 0.00 0.00 58.87 60.72 2fvt n SER 5 Cb 0.38 -0.72 0.00 0.00 -1.01 0.00 0.00 64.21 62.86 2fvt n SER 5 CO 0.00 0.00 0.00 1.21 -3.01 0.00 0.00 175.04 173.24 2fvt n GLU 6 N -4.32 -3.01 -2.35 1.43 4.07 -1.26 -5.00 120.64 110.20 2fvt n GLU 6 Ca -0.24 2.18 -0.04 0.00 -0.06 0.00 0.00 57.16 59.01 2fvt n GLU 6 Cb 0.59 -2.41 -0.03 0.00 -0.06 0.00 0.00 31.44 29.53 2fvt n GLU 6 CO 0.00 0.00 0.00 -0.89 -0.06 0.00 0.00 177.13 176.18 2fvt n ILE 7 N -0.01-10.43 1.34 6.31 5.41 -1.26 -4.84 119.36 115.89 2fvt n ILE 7 Ca 0.00 2.01 0.00 0.00 1.00 0.00 0.00 62.75 65.76 2fvt n ILE 7 Cb 0.00 -5.91 0.00 0.00 -0.71 0.00 0.00 39.64 33.02 2fvt n ILE 7 CO 0.00 0.00 0.00 -2.65 0.00 0.00 0.00 176.55 173.90 2fvt n PRO 8 N 1.16 0.75 -3.93 0.38 -0.02 -1.26 -4.79 135.00 127.29 2fvt n PRO 8 Ca -0.27 0.00 -0.11 0.00 -2.02 0.00 0.00 63.50 61.10 2fvt n PRO 8 Cb 0.42 -1.07 -0.01 0.00 -0.02 0.00 0.00 33.50 32.81 2fvt n PRO 8 CO 0.00 0.00 0.00 -1.01 1.98 0.00 0.00 175.50 176.47 2fvt s HIS 9 N -1.80 0.44 -0.68 6.00 3.76 -1.26 -5.10 115.29 116.65 2fvt s HIS 9 Ca 0.00 -0.91 0.05 0.00 -0.15 0.00 0.00 55.06 54.05 2fvt s HIS 9 Cb 0.00 0.43 0.18 0.00 1.11 0.00 0.00 32.58 34.30 2fvt s HIS 9 CO 0.00 -1.32 0.52 1.19 -0.85 0.00 0.00 174.74 174.28 2fvt n PHE 10 N -0.52 3.06 -2.99 1.40 3.72 -1.26 -5.07 117.46 115.80 2fvt n PHE 10 Ca -0.04 -4.24 -0.43 0.00 -0.05 0.00 0.00 57.45 52.69 2fvt n PHE 10 Cb 0.61 -0.57 -0.05 0.00 -0.94 0.00 0.00 39.48 38.52 2fvt n PHE 10 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 176.76 175.46 2fvt s PRO 11 N -1.50 3.27 -1.67 -1.08 0.05 -1.26 -0.45 135.00 132.35 2fvt s PRO 11 Ca 0.27 -0.46 0.00 0.00 0.05 0.00 0.00 61.00 60.86 2fvt s PRO 11 Cb -0.01 -4.04 0.00 0.00 0.05 0.00 0.00 34.50 30.50 2fvt s PRO 11 CO -0.16 -1.29 0.00 0.54 0.05 0.00 0.00 177.00 176.15 2fvt n ARG 12 N 6.79 -1.34 -3.23 4.56 1.74 -0.77 -4.95 116.66 119.47 2fvt n ARG 12 Ca -0.01 0.97 -0.39 0.00 -0.77 0.00 0.00 57.85 57.65 2fvt n ARG 12 Cb 0.47 -5.36 -0.06 0.00 -1.02 0.00 0.00 32.46 26.49 2fvt n ARG 12 CO 0.00 0.00 0.00 -0.08 -1.52 0.00 0.00 177.63 176.03 2fvt s THR 13 N -2.79 5.13 -0.40 0.55 -1.32 -1.26 -5.00 115.64 110.56 2fvt s THR 13 Ca 0.00 1.09 0.01 0.00 -1.21 0.00 0.00 61.69 61.58 2fvt s THR 13 Cb 0.00 -3.88 0.13 0.00 -1.51 0.00 0.00 72.50 67.23 2fvt s THR 13 CO 0.00 0.28 0.19 0.00 -2.21 0.00 0.00 174.62 172.88 2fvt s ALA 14 N 0.87 1.91 -0.27 11.08 0.00 -1.26 -4.93 121.76 129.16 2fvt s ALA 14 Ca 0.29 -2.29 -0.01 0.00 0.00 0.00 0.00 51.96 49.95 2fvt s ALA 14 Cb -0.16 -1.80 0.13 0.00 0.00 0.00 0.00 23.12 21.30 2fvt s ALA 14 CO 0.12 -1.96 0.31 0.00 0.00 0.00 0.00 175.76 174.24 2fvt s ALA 15 N 0.76 -0.63 -0.42 0.00 0.00 -1.26 -5.08 121.76 115.13 2fvt s ALA 15 Ca 0.15 -0.01 -0.16 0.00 0.00 0.00 0.00 51.96 51.94 2fvt s ALA 15 Cb -0.22 -1.77 0.02 0.00 0.00 0.00 0.00 23.12 21.15 2fvt s ALA 15 CO -0.06 -1.60 0.38 0.42 0.00 0.00 0.00 175.76 174.90 2fvt s ILE 16 N 2.41 5.16 -0.17 0.00 -1.09 -1.26 -4.30 121.20 121.95 2fvt s ILE 16 Ca 0.10 -0.50 -0.23 0.00 -2.23 0.00 0.00 60.65 57.79 2fvt s ILE 16 Cb -0.14 -4.00 -0.23 0.00 -1.58 0.00 0.00 42.46 36.52 2fvt s ILE 16 CO -0.28 -0.38 0.45 -0.78 -1.23 0.00 0.00 174.94 172.72 2fvt h ASP 17 N 8.69 0.07 -3.99 3.58 3.58 -1.62 -3.47 116.42 123.26 2fvt h ASP 17 Ca -0.27 -0.72 -0.50 0.00 0.42 0.00 0.00 57.03 55.96 2fvt h ASP 17 Cb 1.11 -0.02 -0.30 0.00 1.72 0.00 0.00 39.33 41.84 2fvt h ASP 17 CO 0.77 1.36 -0.82 0.00 -2.88 0.00 0.00 179.24 177.67 2fvt s ALA 18 N -2.34 1.24 -0.00 -0.78 0.00 -0.99 -5.04 121.76 113.85 2fvt s ALA 18 Ca -0.24 -0.57 0.00 0.00 0.00 0.00 0.00 51.96 51.15 2fvt s ALA 18 Cb 0.03 -0.39 -0.00 0.00 0.00 0.00 0.00 23.12 22.76 2fvt s ALA 18 CO 0.65 0.25 -0.01 -0.47 0.00 0.00 0.00 175.76 176.18 2fvt s TYR 19 N -0.04 0.08 0.00 0.00 5.04 -1.26 -1.82 117.35 119.35 2fvt s TYR 19 Ca -0.00 -0.01 0.00 0.00 -2.44 0.00 0.00 57.07 54.61 2fvt s TYR 19 Cb -0.09 -0.05 0.00 0.00 0.35 0.00 0.00 41.96 42.17 2fvt s TYR 19 CO 0.01 -0.00 0.00 0.41 -1.34 0.00 0.00 175.55 174.63 2fvt n GLY 20 N 3.06 1.03 3.42 8.97 0.00 -1.25 -5.07 105.19 115.36 2fvt n GLY 20 Ca -0.12 -0.30 -0.36 0.00 0.00 0.00 0.00 46.02 45.24 2fvt n GLY 20 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2fvt s LYS 21 N 0.00 3.59 0.00 1.61 2.20 -1.26 -4.32 119.74 121.56 2fvt s LYS 21 Ca 0.00 -0.52 0.00 0.00 -0.36 0.00 0.00 55.97 55.09 2fvt s LYS 21 Cb 0.00 -3.20 0.00 0.00 -1.51 0.00 0.00 37.83 33.12 2fvt s LYS 21 CO 0.00 -0.14 0.00 0.41 -0.36 0.00 0.00 175.35 175.26 2fvt n GLY 22 N 4.71 0.80 0.00 5.54 0.00 -1.26 -4.97 105.19 110.01 2fvt n GLY 22 Ca -0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.85 2fvt n GLY 22 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2fvt n GLY 23 N -0.89 0.26 3.44 -0.02 0.00 -1.26 -4.40 105.19 102.32 2fvt n GLY 23 Ca 0.00 -1.77 -0.28 0.00 0.00 0.00 0.00 46.02 43.98 2fvt n GLY 23 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2fvt s PHE 24 N 0.00 2.36 -0.22 1.61 0.08 -1.18 -3.80 117.98 116.82 2fvt s PHE 24 Ca 0.00 -0.34 -0.02 0.00 0.12 0.00 0.00 56.93 56.69 2fvt s PHE 24 Cb 0.00 -1.20 0.06 0.00 -0.57 0.00 0.00 43.02 41.32 2fvt s PHE 24 CO 0.00 0.46 0.02 -0.47 -0.10 0.00 0.00 175.22 175.13 2fvt s TYR 25 N -1.50 1.40 0.51 0.36 5.04 -0.75 -4.08 117.35 118.33 2fvt s TYR 25 Ca 0.19 -1.15 0.04 0.00 -2.44 0.00 0.00 57.07 53.72 2fvt s TYR 25 Cb -0.09 -1.22 0.01 0.00 0.35 0.00 0.00 41.96 41.01 2fvt s TYR 25 CO 0.10 -0.68 0.24 -0.59 -1.34 0.00 0.00 175.55 173.28 2fvt s PHE 26 N 1.73 1.86 -0.87 4.97 -0.12 -1.25 -1.48 117.98 122.82 2fvt s PHE 26 Ca -0.01 -0.83 -0.25 0.00 -0.05 0.00 0.00 56.93 55.79 2fvt s PHE 26 Cb -0.17 -1.83 -0.03 0.00 -0.63 0.00 0.00 43.02 40.36 2fvt s PHE 26 CO -0.10 -0.15 1.86 0.00 -0.05 0.00 0.00 175.22 176.78 2fvt s ALA 27 N -2.78 1.89 0.00 1.99 0.00 -1.26 -3.94 121.76 117.66 2fvt s ALA 27 Ca 0.26 -1.46 0.00 0.00 0.00 0.00 0.00 51.96 50.76 2fvt s ALA 27 Cb -0.00 -4.51 0.00 0.00 0.00 0.00 0.00 23.12 18.61 2fvt s ALA 27 CO 0.16 -4.49 0.00 0.41 0.00 0.00 0.00 175.76 171.84 2fvt n GLY 28 N 6.64 0.16 3.29 0.00 0.00 -1.26 -5.12 105.19 108.90 2fvt n GLY 28 Ca 0.35 0.04 -0.22 0.00 0.00 0.00 0.00 46.02 46.19 2fvt n GLY 28 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2fvt s MET 29 N 0.00 1.15 0.00 1.61 -2.45 -1.25 -5.15 119.30 113.21 2fvt s MET 29 Ca 0.00 -1.26 0.00 0.00 -1.25 0.00 0.00 55.69 53.18 2fvt s MET 29 Cb 0.00 -1.25 0.00 0.00 1.25 0.00 0.00 34.83 34.83 2fvt s MET 29 CO 0.00 0.27 0.00 0.45 1.05 0.00 0.00 175.02 176.79 2fvt n SER 30 N 0.68 0.00 -0.77 1.11 2.88 -1.26 -3.83 113.62 112.42 2fvt n SER 30 Ca -0.16 -0.79 -0.08 0.00 -1.33 0.00 0.00 58.87 56.50 2fvt n SER 30 Cb 0.56 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 64.00 2fvt n SER 30 CO 0.00 0.00 0.00 1.41 -1.23 0.00 0.00 175.04 175.22 2fvt n HIS 31 N 0.00 -0.19 -4.35 0.66 8.25 -1.26 -5.03 115.22 113.30 2fvt n HIS 31 Ca 0.00 0.00 -0.28 0.00 -0.26 0.00 0.00 57.72 57.18 2fvt n HIS 31 Cb 0.00 -1.91 -0.12 0.00 1.12 0.00 0.00 29.99 29.09 2fvt n HIS 31 CO 0.00 0.00 0.00 1.14 0.64 0.00 0.00 176.34 178.12 2fvt s GLN 32 N -3.53 1.65 0.00 -0.41 0.00 -1.26 -5.04 119.66 111.07 2fvt s GLN 32 Ca 0.00 -1.32 0.06 0.00 -0.00 0.00 0.00 55.36 54.10 2fvt s GLN 32 Cb 0.00 -2.00 0.16 0.00 0.00 0.00 0.00 33.01 31.17 2fvt s GLN 32 CO 0.00 0.45 1.07 0.41 0.00 0.00 0.00 175.29 177.22 2fvt n GLY 33 N 0.60 2.21 2.90 2.60 0.00 -1.26 -3.13 105.19 109.12 2fvt n GLY 33 Ca -0.15 -0.21 -0.14 0.00 0.00 0.00 0.00 46.02 45.51 2fvt n GLY 33 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2fvt s SER 34 N -0.92 0.71 -0.01 1.61 0.01 -1.26 0.03 113.70 113.86 2fvt s SER 34 Ca 0.12 0.24 0.02 0.00 1.31 0.00 0.00 55.95 57.64 2fvt s SER 34 Cb 0.07 0.66 0.00 0.00 0.21 0.00 0.00 66.02 66.96 2fvt s SER 34 CO 0.09 -0.28 -0.05 -0.76 0.41 0.00 0.00 173.24 172.65 2fvt s LEU 35 N 2.41 1.81 -0.44 2.44 1.43 -0.54 -1.96 118.68 123.84 2fvt s LEU 35 Ca 0.05 -0.10 -0.06 0.00 -1.03 0.00 0.00 54.13 52.99 2fvt s LEU 35 Cb -0.14 -0.32 0.11 0.00 0.03 0.00 0.00 46.19 45.87 2fvt s LEU 35 CO -0.11 0.03 0.27 -0.76 0.23 0.00 0.00 176.35 176.01 2fvt s LEU 36 N 0.15 5.41 -0.84 1.79 1.43 0.42 -1.40 118.68 125.64 2fvt s LEU 36 Ca -0.01 -1.90 -0.19 0.00 -1.03 0.00 0.00 54.13 51.00 2fvt s LEU 36 Cb -0.06 -1.93 0.13 0.00 0.03 0.00 0.00 46.19 44.37 2fvt s LEU 36 CO -0.00 -0.60 1.02 -0.36 0.23 0.00 0.00 176.35 176.64 2fvt s PHE 37 N 1.28 3.10 0.28 0.29 0.08 0.10 -0.87 117.98 122.24 2fvt s PHE 37 Ca 0.06 -1.28 0.01 0.00 0.12 0.00 0.00 56.93 55.85 2fvt s PHE 37 Cb -0.24 -4.21 -0.03 0.00 -0.57 0.00 0.00 43.02 37.96 2fvt s PHE 37 CO -0.02 -1.45 0.46 -0.51 -0.10 0.00 0.00 175.22 173.61 2fvt s LEU 38 N 2.65 4.14 0.00 -0.37 1.43 -0.89 -0.38 118.68 125.26 2fvt s LEU 38 Ca 0.27 0.35 0.05 0.00 -1.03 0.00 0.00 54.13 53.77 2fvt s LEU 38 Cb -0.09 -3.17 0.29 0.00 0.03 0.00 0.00 46.19 43.24 2fvt s LEU 38 CO -0.05 -0.18 0.80 -2.65 0.23 0.00 0.00 176.35 174.51 2fvt n PRO 39 N -1.40 0.56 0.04 1.29 -0.02 -1.25 -3.45 135.00 130.77 2fvt n PRO 39 Ca -0.06 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.42 2fvt n PRO 39 Cb 0.56 -1.13 0.00 0.00 -0.02 0.00 0.00 33.50 32.90 2fvt n PRO 39 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 2fvt n ASP 40 N -0.63 0.58 -3.90 2.55 2.03 -1.26 -4.62 116.55 111.29 2fvt n ASP 40 Ca 0.04 0.12 -0.10 0.00 0.52 0.00 0.00 54.79 55.37 2fvt n ASP 40 Cb 0.02 -0.15 -0.09 0.00 -0.72 0.00 0.00 41.12 40.18 2fvt n ASP 40 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2fvt s ALA 41 N -2.00 -0.15 -0.31 -1.67 0.00 -1.22 -1.85 121.76 114.55 2fvt s ALA 41 Ca 0.00 -0.46 -0.13 0.00 0.00 0.00 0.00 51.96 51.36 2fvt s ALA 41 Cb 0.00 0.25 -0.03 0.00 0.00 0.00 0.00 23.12 23.34 2fvt s ALA 41 CO 0.00 -0.33 0.29 0.08 0.00 0.00 0.00 175.76 175.80 2fvt s VAL 42 N -2.54 5.24 0.10 0.00 1.01 0.40 -2.09 120.40 122.50 2fvt s VAL 42 Ca -0.05 0.11 0.05 0.00 0.00 0.00 0.00 61.98 62.09 2fvt s VAL 42 Cb -0.01 -3.69 -0.04 0.00 0.00 0.00 0.00 36.38 32.63 2fvt s VAL 42 CO -0.04 0.07 -0.01 0.26 0.00 0.00 0.00 175.10 175.38 2fvt s TRP 43 N 1.88 2.96 -0.09 5.22 0.52 -0.05 -4.68 118.94 124.71 2fvt s TRP 43 Ca 0.10 -0.04 -0.25 0.00 0.02 0.00 0.00 56.10 55.93 2fvt s TRP 43 Cb -0.16 -1.52 -0.03 0.00 -1.15 0.00 0.00 33.47 30.61 2fvt s TRP 43 CO 0.11 0.48 0.77 0.20 0.02 0.00 0.00 176.95 178.53 2fvt s GLY 44 N -2.33 2.50 0.10 0.98 0.00 -1.26 -0.43 107.32 106.87 2fvt s GLY 44 Ca 0.25 0.15 0.00 0.00 0.00 0.00 0.00 44.72 45.12 2fvt s GLY 44 CO 0.18 1.40 0.26 0.86 0.00 0.00 0.00 173.10 175.79 2fvt s TRP 45 N 1.25 3.50 -1.50 1.90 -0.00 -0.83 -4.91 118.94 118.36 2fvt s TRP 45 Ca 0.39 0.26 0.17 0.00 -0.00 0.00 0.00 56.10 56.92 2fvt s TRP 45 Cb -0.18 -1.77 0.46 0.00 -0.00 0.00 0.00 33.47 31.99 2fvt s TRP 45 CO 0.18 0.54 1.38 -3.47 -0.00 0.00 0.00 176.95 175.58 2fvt n ASP 46 N 0.02 3.41 -4.36 5.86 2.03 -1.26 -4.56 116.55 117.68 2fvt n ASP 46 Ca -0.05 -1.99 -0.45 0.00 0.52 0.00 0.00 54.79 52.82 2fvt n ASP 46 Cb 0.52 -0.35 -0.03 0.00 -0.72 0.00 0.00 41.12 40.54 2fvt n ASP 46 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 2fvt s VAL 47 N -1.02 5.11 -2.07 5.18 1.01 -1.26 -4.86 120.40 122.49 2fvt s VAL 47 Ca 0.36 -1.65 0.16 0.00 0.00 0.00 0.00 61.98 60.85 2fvt s VAL 47 Cb 0.19 -4.51 0.43 0.00 0.00 0.00 0.00 36.38 32.48 2fvt s VAL 47 CO 0.25 -1.13 1.38 0.35 0.00 0.00 0.00 175.10 175.95 2fvt n THR 48 N 4.99 0.58 -4.48 3.92 -2.24 -1.26 -4.69 114.28 111.10 2fvt n THR 48 Ca 0.03 -0.62 -0.23 0.00 -2.27 0.00 0.00 64.05 60.97 2fvt n THR 48 Cb 0.45 0.38 -0.16 0.00 -2.10 0.00 0.00 70.33 68.89 2fvt n THR 48 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2fvt s LYS 49 N -1.42 1.32 0.44 -0.78 1.02 -1.26 -5.00 119.74 114.05 2fvt s LYS 49 Ca 0.33 -0.35 0.12 0.00 0.02 0.00 0.00 55.97 56.09 2fvt s LYS 49 Cb 0.17 -1.16 1.00 0.00 -0.52 0.00 0.00 37.83 37.32 2fvt s LYS 49 CO 0.23 0.06 2.03 -1.35 -0.92 0.00 0.00 175.35 175.40 2fvt h PRO 50 N 6.73 0.40 -0.62 -1.68 0.11 -1.88 -0.96 132.00 134.11 2fvt h PRO 50 Ca -0.33 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.75 2fvt h PRO 50 Cb 1.17 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.19 2fvt h PRO 50 CO 0.48 0.27 0.00 -1.91 -0.21 0.00 0.00 178.00 176.63 2fvt n GLU 51 N -4.48 2.54 -0.21 1.05 2.13 -1.26 -3.69 120.64 116.73 2fvt n GLU 51 Ca 0.06 -2.23 0.10 0.00 0.66 0.00 0.00 57.16 55.75 2fvt n GLU 51 Cb 0.23 -1.52 0.27 0.00 0.27 0.00 0.00 31.44 30.69 2fvt n GLU 51 CO 0.00 0.00 0.00 0.94 -0.41 0.00 0.00 177.13 177.66 2fvt n GLN 52 N 1.24 2.25 -2.39 5.31 7.27 -0.36 -4.83 117.38 125.86 2fvt n GLN 52 Ca 0.21 -1.91 -0.41 0.00 0.07 0.00 0.00 57.00 54.95 2fvt n GLN 52 Cb 0.55 -1.45 -0.03 0.00 2.41 0.00 0.00 30.24 31.72 2fvt n GLN 52 CO 0.00 0.00 0.00 0.42 0.07 0.00 0.00 177.06 177.55 2fvt s ILE 53 N -1.44 3.75 0.34 1.69 1.01 -1.24 -4.77 121.20 120.53 2fvt s ILE 53 Ca 0.37 0.60 0.04 0.00 0.00 0.00 0.00 60.65 61.66 2fvt s ILE 53 Cb 0.20 -4.47 -0.07 0.00 0.01 0.00 0.00 42.46 38.13 2fvt s ILE 53 CO 0.28 -1.25 0.05 -0.62 0.00 0.00 0.00 174.94 173.40 2fvt s ASP 54 N 4.60 2.59 0.28 3.58 2.15 -1.26 -5.00 116.67 123.61 2fvt s ASP 54 Ca 0.51 -1.37 0.01 0.00 0.43 0.00 0.00 52.55 52.13 2fvt s ASP 54 Cb -0.10 -0.13 0.58 0.00 -0.30 0.00 0.00 42.92 42.96 2fvt s ASP 54 CO 0.23 -0.58 1.79 0.03 -0.17 0.00 0.00 175.17 176.48 2fvt h ARG 55 N 2.07 0.77 -0.53 4.34 3.08 -1.94 0.27 114.38 122.43 2fvt h ARG 55 Ca -0.41 -0.05 -0.09 0.00 0.07 0.00 0.00 59.98 59.50 2fvt h ARG 55 Cb 1.24 -0.17 -0.02 0.00 0.08 0.00 0.00 29.97 31.10 2fvt h ARG 55 CO 0.71 0.51 -0.03 -0.92 -1.07 0.00 0.00 179.97 179.17 2fvt h TYR 56 N 0.79 1.06 0.00 3.04 3.20 -1.96 -1.52 116.97 121.57 2fvt h TYR 56 Ca 0.50 -0.20 -0.03 0.00 3.14 0.00 0.00 58.73 62.14 2fvt h TYR 56 Cb 0.64 -0.27 -0.00 0.00 1.54 0.00 0.00 36.73 38.64 2fvt h TYR 56 CO -0.04 0.98 -0.13 0.77 -1.64 0.00 0.00 178.16 178.09 2fvt h SER 57 N 0.83 0.00 -0.53 -2.11 0.02 -1.50 -2.06 113.55 108.20 2fvt h SER 57 Ca 0.15 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.10 2fvt h SER 57 Cb 0.58 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.12 2fvt h SER 57 CO 0.03 0.13 0.00 0.18 -1.14 0.00 0.00 176.83 176.04 2fvt n LEU 58 N -3.60 4.76 -0.34 5.07 4.77 -0.05 -4.56 117.00 123.05 2fvt n LEU 58 Ca -0.02 -2.67 0.01 0.00 -0.03 0.00 0.00 56.01 53.30 2fvt n LEU 58 Cb 0.26 -0.58 0.17 0.00 -2.33 0.00 0.00 43.42 40.95 2fvt n LEU 58 CO 0.30 0.73 1.27 -0.61 -1.33 0.00 0.00 177.39 177.75 2fvt h GLN 59 N 3.46 1.17 0.00 3.23 4.15 -0.54 0.18 115.11 126.76 2fvt h GLN 59 Ca 0.00 -0.07 -0.08 0.00 0.77 0.00 0.00 58.65 59.27 2fvt h GLN 59 Cb 1.56 -0.26 -0.01 0.00 0.21 0.00 0.00 27.48 28.97 2fvt h GLN 59 CO 0.29 0.77 -0.37 -0.09 -1.93 0.00 0.00 178.83 177.51 2fvt h ARG 60 N 1.21 0.00 -0.25 1.69 2.43 -1.82 -2.29 114.38 115.34 2fvt h ARG 60 Ca 0.37 0.00 -0.16 0.00 -0.81 0.00 0.00 59.98 59.39 2fvt h ARG 60 Cb -0.01 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.53 2fvt h ARG 60 CO -0.11 0.37 -0.47 0.28 -1.51 0.00 0.00 179.97 178.53 2fvt h VAL 61 N 0.00 1.30 -0.62 0.20 2.07 -1.02 0.16 116.25 118.34 2fvt h VAL 61 Ca -0.00 -1.67 -0.08 0.00 0.82 0.00 0.00 66.70 65.77 2fvt h VAL 61 Cb 0.75 1.61 -0.02 0.00 -1.52 0.00 0.00 31.29 32.11 2fvt h VAL 61 CO 0.05 0.53 0.09 -0.26 0.02 0.00 0.00 177.57 178.00 2fvt h PHE 62 N 0.54 1.10 -0.37 1.57 0.04 -0.93 -0.97 116.94 117.91 2fvt h PHE 62 Ca 0.03 -0.16 -0.13 0.00 2.80 0.00 0.00 57.97 60.51 2fvt h PHE 62 Cb 1.02 -0.30 -0.01 0.00 2.20 0.00 0.00 35.95 38.87 2fvt h PHE 62 CO 0.05 0.94 -0.27 0.22 -0.60 0.00 0.00 178.31 178.65 2fvt h ASP 63 N 0.94 0.88 -0.51 2.17 3.58 -1.12 -3.00 116.42 119.36 2fvt h ASP 63 Ca 0.19 -0.44 0.00 0.00 0.42 0.00 0.00 57.03 57.20 2fvt h ASP 63 Cb 0.44 -0.25 0.00 0.00 1.72 0.00 0.00 39.33 41.25 2fvt h ASP 63 CO 0.01 1.13 0.00 0.59 -2.88 0.00 0.00 179.24 178.10 2fvt n ASN 64 N -4.19 4.55 0.19 2.28 5.03 0.53 -4.41 115.26 119.24 2fvt n ASN 64 Ca -0.02 -2.59 0.14 0.00 0.87 0.00 0.00 54.58 52.98 2fvt n ASN 64 Cb 0.48 -0.60 0.65 0.00 -1.02 0.00 0.00 39.78 39.29 2fvt n ASN 64 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2fvt h ALA 65 N 3.79 1.00 -0.11 5.41 0.00 -1.02 -2.21 119.26 126.12 2fvt h ALA 65 Ca 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.85 2fvt h ALA 65 Cb 1.51 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.29 2fvt h ALA 65 CO 0.31 0.00 -0.20 -0.91 0.00 0.00 0.00 179.25 178.45 2fvt h ASN 66 N 0.00 0.17 0.06 0.00 4.21 -1.83 -2.10 115.58 116.09 2fvt h ASN 66 Ca 0.00 -0.04 0.00 0.00 1.21 0.00 0.00 56.30 57.47 2fvt h ASN 66 Cb 0.19 -0.05 0.00 0.00 -1.12 0.00 0.00 38.32 37.35 2fvt h ASN 66 CO 0.00 0.39 -0.37 0.00 -1.29 0.00 0.00 177.43 176.17 2fvt n ALA 67 N -2.49 3.32 -3.08 -0.83 0.00 -0.83 -4.84 120.51 111.75 2fvt n ALA 67 Ca -0.01 -0.56 -0.39 0.00 0.00 0.00 0.00 53.44 52.48 2fvt n ALA 67 Cb 0.31 -0.91 -0.12 0.00 0.00 0.00 0.00 19.45 18.73 2fvt n ALA 67 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2fvt s ILE 68 N -2.44 4.08 -0.14 0.00 1.01 -0.79 -4.31 121.20 118.62 2fvt s ILE 68 Ca 0.22 -0.95 -0.13 0.00 0.00 0.00 0.00 60.65 59.79 2fvt s ILE 68 Cb 0.19 -3.26 -0.04 0.00 0.01 0.00 0.00 42.46 39.36 2fvt s ILE 68 CO 0.53 -0.14 -0.26 -0.67 0.00 0.00 0.00 174.94 174.41 2fvt n ASP 69 N 4.88 1.48 -4.44 3.58 -0.08 0.29 -4.64 116.55 117.62 2fvt n ASP 69 Ca -0.13 0.28 -0.38 0.00 -1.51 0.00 0.00 54.79 53.05 2fvt n ASP 69 Cb 0.46 -0.69 -0.12 0.00 2.34 0.00 0.00 41.12 43.10 2fvt n ASP 69 CO 0.00 0.00 0.00 -0.89 0.12 0.00 0.00 177.20 176.43 2fvt s THR 70 N -2.42 4.54 -0.41 5.18 2.01 -0.49 0.23 115.64 124.27 2fvt s THR 70 Ca -0.21 -0.40 -0.11 0.00 0.31 0.00 0.00 61.69 61.28 2fvt s THR 70 Cb 0.03 -3.29 0.06 0.00 0.01 0.00 0.00 72.50 69.31 2fvt s THR 70 CO 0.32 0.10 0.26 -0.22 -0.69 0.00 0.00 174.62 174.39 2fvt s LEU 71 N 1.61 5.07 -0.31 4.42 2.96 0.14 -0.52 118.68 132.05 2fvt s LEU 71 Ca 0.05 -1.32 -0.17 0.00 -0.22 0.00 0.00 54.13 52.47 2fvt s LEU 71 Cb -0.17 -2.02 -0.02 0.00 0.50 0.00 0.00 46.19 44.48 2fvt s LEU 71 CO 0.06 -0.50 0.45 -0.63 -1.32 0.00 0.00 176.35 174.40 2fvt s ILE 72 N 1.49 5.10 -0.17 6.68 1.01 0.88 -0.53 121.20 135.66 2fvt s ILE 72 Ca 0.03 0.48 -0.05 0.00 0.00 0.00 0.00 60.65 61.11 2fvt s ILE 72 Cb -0.22 -3.83 -0.03 0.00 0.01 0.00 0.00 42.46 38.39 2fvt s ILE 72 CO 0.04 -0.02 -0.00 -0.69 0.00 0.00 0.00 174.94 174.27 2fvt s VAL 73 N 2.22 4.18 -0.34 2.92 1.01 0.11 -0.40 120.40 130.09 2fvt s VAL 73 Ca 0.17 -0.25 -0.08 0.00 0.00 0.00 0.00 61.98 61.82 2fvt s VAL 73 Cb -0.16 -2.85 0.03 0.00 0.00 0.00 0.00 36.38 33.40 2fvt s VAL 73 CO 0.11 0.48 0.13 -0.83 0.00 0.00 0.00 175.10 174.99 2fvt s GLY 74 N 0.44 1.86 0.18 4.51 0.00 0.47 -0.37 107.32 114.41 2fvt s GLY 74 Ca -0.01 -1.67 -0.03 0.00 0.00 0.00 0.00 44.72 43.01 2fvt s GLY 74 CO 0.02 0.77 1.47 -0.91 0.00 0.00 0.00 173.10 174.45 2fvt h THR 75 N 6.01 1.34 0.00 0.90 1.35 -1.68 -1.15 112.91 119.68 2fvt h THR 75 Ca -0.26 -1.92 0.00 0.00 -0.55 0.00 0.00 66.41 63.68 2fvt h THR 75 Cb 1.10 1.90 0.00 0.00 -1.73 0.00 0.00 68.15 69.42 2fvt h THR 75 CO 0.62 0.59 0.00 0.61 -0.25 0.00 0.00 175.52 177.09 2fvt n GLY 76 N 0.38 0.08 0.11 5.82 0.00 -1.25 -4.59 105.19 105.73 2fvt n GLY 76 Ca -0.04 -0.52 -0.21 0.00 0.00 0.00 0.00 46.02 45.26 2fvt n GLY 76 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fvt h ALA 77 N 0.00 0.24 -2.35 4.61 0.00 -1.90 -2.47 119.26 117.39 2fvt h ALA 77 Ca 0.00 -1.13 -0.50 0.00 0.00 0.00 0.00 54.91 53.28 2fvt h ALA 77 Cb 0.00 0.60 0.05 0.00 0.00 0.00 0.00 17.79 18.45 2fvt h ALA 77 CO 0.00 0.72 0.33 0.16 0.00 0.00 0.00 179.25 180.46 2fvt s ASP 78 N -6.84 6.17 -0.34 0.00 -4.77 -1.26 -4.91 116.67 104.72 2fvt s ASP 78 Ca -0.25 1.25 -0.10 0.00 -3.30 0.00 0.00 52.55 50.14 2fvt s ASP 78 Cb 0.05 -2.35 0.01 0.00 -1.09 0.00 0.00 42.92 39.53 2fvt s ASP 78 CO 0.66 -0.83 0.17 0.54 0.70 0.00 0.00 175.17 176.41 2fvt s VAL 79 N -3.07 4.53 -0.24 2.11 0.11 -1.26 -4.71 120.40 117.88 2fvt s VAL 79 Ca 0.53 -0.64 -0.11 0.00 -2.93 0.00 0.00 61.98 58.83 2fvt s VAL 79 Cb -0.11 -3.41 -0.05 0.00 -1.53 0.00 0.00 36.38 31.28 2fvt s VAL 79 CO 0.51 -0.06 0.20 0.86 -3.33 0.00 0.00 175.10 173.28 2fvt s TRP 80 N 1.58 3.32 -0.26 1.54 -0.00 -1.26 -5.06 118.94 118.79 2fvt s TRP 80 Ca 0.03 0.28 -0.23 0.00 -0.00 0.00 0.00 56.10 56.19 2fvt s TRP 80 Cb -0.18 -2.32 -0.01 0.00 -0.00 0.00 0.00 33.47 30.96 2fvt s TRP 80 CO 0.06 0.03 0.74 0.42 -0.00 0.00 0.00 176.95 178.20 2fvt s ILE 81 N 1.16 4.89 0.14 5.86 1.09 -1.26 -4.91 121.20 128.18 2fvt s ILE 81 Ca 0.09 1.31 -0.16 0.00 -1.10 0.00 0.00 60.65 60.79 2fvt s ILE 81 Cb -0.14 -4.05 -0.07 0.00 -1.06 0.00 0.00 42.46 37.14 2fvt s ILE 81 CO 0.06 -0.07 0.58 0.00 -0.10 0.00 0.00 174.94 175.41 2fvt s ALA 82 N 2.73 3.55 0.22 9.38 0.00 -1.26 -5.03 121.76 131.34 2fvt s ALA 82 Ca 0.31 -0.04 -0.31 0.00 0.00 0.00 0.00 51.96 51.91 2fvt s ALA 82 Cb -0.15 -2.60 -0.11 0.00 0.00 0.00 0.00 23.12 20.26 2fvt s ALA 82 CO 0.09 0.42 1.62 -2.14 0.00 0.00 0.00 175.76 175.75 2fvt s PRO 83 N -1.75 4.16 0.60 0.00 0.02 -1.26 -4.88 135.00 131.89 2fvt s PRO 83 Ca 0.36 2.50 0.31 0.00 0.02 0.00 0.00 61.00 64.19 2fvt s PRO 83 Cb -0.16 -3.09 1.81 0.00 0.02 0.00 0.00 34.50 33.08 2fvt s PRO 83 CO 0.19 -0.65 2.19 -0.09 -0.33 0.00 0.00 177.00 178.31 2fvt h ARG 84 N 6.24 0.00 -0.39 5.54 2.43 -1.98 0.43 114.38 126.64 2fvt h ARG 84 Ca -0.44 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 58.71 2fvt h ARG 84 Cb 1.21 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 30.74 2fvt h ARG 84 CO 0.89 0.00 0.17 1.96 -1.51 0.00 0.00 179.97 181.48 2fvt h GLN 85 N 0.00 0.54 -0.11 0.20 4.20 -1.98 0.85 115.11 118.81 2fvt h GLN 85 Ca 0.04 -0.06 -0.17 0.00 0.06 0.00 0.00 58.65 58.51 2fvt h GLN 85 Cb 0.23 -0.11 0.01 0.00 0.30 0.00 0.00 27.48 27.91 2fvt h GLN 85 CO -0.00 0.44 -0.59 1.25 -0.67 0.00 0.00 178.83 179.26 2fvt h LEU 86 N 0.55 0.71 -0.98 1.46 5.85 -1.29 -2.28 115.31 119.33 2fvt h LEU 86 Ca 0.14 -0.64 -0.03 0.00 0.84 0.00 0.00 57.88 58.18 2fvt h LEU 86 Cb 0.09 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 40.88 2fvt h LEU 86 CO -0.02 1.24 0.32 -0.09 -0.34 0.00 0.00 178.44 179.55 2fvt h ARG 87 N 0.23 1.05 0.00 1.25 1.12 -1.12 -2.45 114.38 114.46 2fvt h ARG 87 Ca -0.04 -0.16 -0.08 0.00 -1.11 0.00 0.00 59.98 58.58 2fvt h ARG 87 Cb 1.23 -0.19 -0.01 0.00 -0.01 0.00 0.00 29.97 30.99 2fvt h ARG 87 CO 0.12 0.83 -0.40 1.49 -3.11 0.00 0.00 179.97 178.90 2fvt h GLU 88 N 1.04 0.00 -0.58 0.20 4.81 0.74 0.48 114.58 121.27 2fvt h GLU 88 Ca 0.25 0.00 -0.04 0.00 -0.13 0.00 0.00 59.36 59.43 2fvt h GLU 88 Cb 0.15 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.51 2fvt h GLU 88 CO -0.03 0.40 0.19 0.00 -0.73 0.00 0.00 179.01 178.84 2fvt h ALA 89 N 1.60 0.75 0.00 2.92 0.00 -0.95 -1.96 119.26 121.62 2fvt h ALA 89 Ca -0.00 -0.19 -0.06 0.00 0.00 0.00 0.00 54.91 54.66 2fvt h ALA 89 Cb 0.75 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 2fvt h ALA 89 CO 0.05 0.41 -0.26 -0.07 0.00 0.00 0.00 179.25 179.38 2fvt h LEU 90 N 0.81 0.00 -1.45 0.00 3.38 -0.91 -2.64 115.31 114.51 2fvt h LEU 90 Ca 0.19 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 58.10 2fvt h LEU 90 Cb 0.27 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.01 2fvt h LEU 90 CO -0.01 0.26 -0.22 -0.09 0.09 0.00 0.00 178.44 178.48 2fvt h ARG 91 N 0.00 0.09 -0.91 1.13 1.12 0.61 0.17 114.38 116.60 2fvt h ARG 91 Ca -0.00 -0.02 0.08 0.00 -1.11 0.00 0.00 59.98 58.93 2fvt h ARG 91 Cb 0.82 -0.01 -0.06 0.00 -0.01 0.00 0.00 29.97 30.70 2fvt h ARG 91 CO 0.03 0.30 0.59 0.78 -3.11 0.00 0.00 179.97 178.56 2fvt h GLY 92 N 0.76 1.32 -3.22 2.80 0.00 -0.99 0.26 103.07 104.00 2fvt h GLY 92 Ca 0.01 -0.40 0.00 0.00 0.00 0.00 0.00 47.33 46.95 2fvt h GLY 92 CO 0.03 0.25 0.00 3.33 0.00 0.00 0.00 176.54 180.15 2fvt n VAL 93 N -4.51 2.06 -2.29 4.60 0.24 -0.81 -4.94 118.33 112.68 2fvt n VAL 93 Ca 0.15 -1.25 -0.17 0.00 -2.04 0.00 0.00 64.34 61.03 2fvt n VAL 93 Cb 0.25 0.04 -0.01 0.00 -1.47 0.00 0.00 33.84 32.65 2fvt n VAL 93 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 2fvt n ASN 94 N 1.05 -4.97 -4.63 -1.34 3.02 0.08 -4.94 115.26 103.54 2fvt n ASN 94 Ca 0.27 -0.00 -0.42 0.00 -0.03 0.00 0.00 54.58 54.40 2fvt n ASN 94 Cb 0.97 -4.06 -0.05 0.00 -0.61 0.00 0.00 39.78 36.03 2fvt n ASN 94 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2fvt s VAL 95 N -2.83 4.83 -0.71 2.41 1.01 0.53 -4.83 120.40 120.81 2fvt s VAL 95 Ca 0.00 1.34 -0.27 0.00 0.00 0.00 0.00 61.98 63.05 2fvt s VAL 95 Cb 0.00 -4.11 0.03 0.00 0.00 0.00 0.00 36.38 32.29 2fvt s VAL 95 CO 0.00 -0.15 1.31 -0.69 0.00 0.00 0.00 175.10 175.57 2fvt s VAL 96 N 2.87 3.73 -0.22 2.92 1.01 0.14 -4.12 120.40 126.72 2fvt s VAL 96 Ca 0.33 0.46 -0.20 0.00 0.00 0.00 0.00 61.98 62.57 2fvt s VAL 96 Cb -0.15 -4.82 -0.02 0.00 0.00 0.00 0.00 36.38 31.39 2fvt s VAL 96 CO 0.10 -1.72 0.62 -0.22 0.00 0.00 0.00 175.10 173.88 2fvt s LEU 97 N 5.88 4.11 -0.17 3.92 2.96 -1.26 0.23 118.68 134.35 2fvt s LEU 97 Ca 0.39 0.76 0.00 0.00 -0.22 0.00 0.00 54.13 55.06 2fvt s LEU 97 Cb -0.08 -2.86 0.04 0.00 0.50 0.00 0.00 46.19 43.79 2fvt s LEU 97 CO 0.17 -0.31 -0.08 -0.62 -1.32 0.00 0.00 176.35 174.19 2fvt s ASP 98 N 1.32 2.99 -0.24 3.68 2.15 0.31 -4.96 116.67 121.91 2fvt s ASP 98 Ca 0.27 -0.70 -0.13 0.00 0.43 0.00 0.00 52.55 52.42 2fvt s ASP 98 Cb -0.16 -1.06 -0.04 0.00 -0.30 0.00 0.00 42.92 41.36 2fvt s ASP 98 CO 0.09 -0.15 0.27 -0.89 -0.17 0.00 0.00 175.17 174.32 2fvt s THR 99 N 1.53 5.27 0.20 1.71 2.01 -1.26 -0.72 115.64 124.38 2fvt s THR 99 Ca 0.01 0.38 0.04 0.00 0.31 0.00 0.00 61.69 62.43 2fvt s THR 99 Cb -0.15 -3.60 -0.02 0.00 0.01 0.00 0.00 72.50 68.74 2fvt s THR 99 CO -0.08 0.27 0.17 0.23 -0.69 0.00 0.00 174.62 174.51 2fvt n MET 100 N 4.70 0.25 -2.45 4.92 2.81 0.50 -4.95 117.12 122.89 2fvt n MET 100 Ca -0.12 -1.96 -0.27 0.00 -1.81 0.00 0.00 57.70 53.54 2fvt n MET 100 Cb 0.52 1.62 0.02 0.00 -0.71 0.00 0.00 33.22 34.66 2fvt n MET 100 CO 0.00 0.00 0.00 -0.65 1.51 0.00 0.00 175.97 176.83 2fvt s GLN 101 N -2.79 3.22 0.19 0.03 -0.21 -1.26 -2.09 119.66 116.75 2fvt s GLN 101 Ca 0.23 0.14 -0.12 0.00 0.02 0.00 0.00 55.36 55.63 2fvt s GLN 101 Cb 0.01 -2.30 0.19 0.00 1.00 0.00 0.00 33.01 31.92 2fvt s GLN 101 CO 0.17 -0.49 1.74 1.79 -2.12 0.00 0.00 175.29 176.37 2fvt h THR 102 N -0.03 0.79 0.11 -0.19 1.35 -1.73 -1.25 112.91 111.96 2fvt h THR 102 Ca -0.46 -0.11 -0.00 0.00 -0.55 0.00 0.00 66.41 65.29 2fvt h THR 102 Cb 1.23 0.43 -0.01 0.00 -1.73 0.00 0.00 68.15 68.08 2fvt h THR 102 CO 0.61 0.06 -0.15 1.23 -0.25 0.00 0.00 175.52 177.02 2fvt h GLY 103 N 0.33 -0.98 0.80 5.82 0.00 -1.94 -1.74 103.07 105.35 2fvt h GLY 103 Ca 0.25 0.44 0.15 0.00 0.00 0.00 0.00 47.33 48.18 2fvt h GLY 103 CO -0.28 -0.33 0.45 -2.55 0.00 0.00 0.00 176.54 173.83 2fvt h PRO 104 N -0.27 0.24 0.10 4.80 0.11 -1.94 -2.28 132.00 132.76 2fvt h PRO 104 Ca -0.01 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 66.08 2fvt h PRO 104 Cb 0.25 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 31.30 2fvt h PRO 104 CO -0.04 0.16 -0.05 0.00 -0.21 0.00 0.00 178.00 177.86 2fvt h ALA 105 N 1.68 -0.14 -0.52 -0.75 0.00 -0.96 -1.44 119.26 117.13 2fvt h ALA 105 Ca 0.32 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 55.13 2fvt h ALA 105 Cb 0.91 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.73 2fvt h ALA 105 CO -0.07 -0.52 0.25 0.82 0.00 0.00 0.00 179.25 179.72 2fvt h ILE 106 N -0.25 1.20 0.09 0.00 2.04 -0.78 -1.17 117.51 118.63 2fvt h ILE 106 Ca -0.01 -0.55 0.01 0.00 1.00 0.00 0.00 64.86 65.30 2fvt h ILE 106 Cb 0.20 0.61 -0.02 0.00 -0.74 0.00 0.00 36.82 36.88 2fvt h ILE 106 CO 0.02 0.22 -0.14 0.03 0.00 0.00 0.00 178.15 178.28 2fvt h ARG 107 N 0.69 -0.27 -0.54 2.37 3.08 -1.34 0.48 114.38 118.84 2fvt h ARG 107 Ca 0.18 0.02 -0.08 0.00 0.07 0.00 0.00 59.98 60.16 2fvt h ARG 107 Cb 0.12 0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.21 2fvt h ARG 107 CO -0.02 -0.18 0.01 1.15 -1.07 0.00 0.00 179.97 179.86 2fvt h THR 108 N -0.28 1.25 -0.34 2.04 2.02 -1.16 -2.45 112.91 113.99 2fvt h THR 108 Ca 0.02 -1.06 -0.02 0.00 0.77 0.00 0.00 66.41 66.12 2fvt h THR 108 Cb 0.30 0.82 -0.01 0.00 -1.74 0.00 0.00 68.15 67.51 2fvt h THR 108 CO -0.08 0.38 0.12 0.22 0.37 0.00 0.00 175.52 176.53 2fvt h TYR 109 N 0.85 0.54 -0.58 3.16 3.20 -0.94 -1.27 116.97 121.92 2fvt h TYR 109 Ca 0.16 -0.05 0.05 0.00 3.14 0.00 0.00 58.73 62.03 2fvt h TYR 109 Cb 0.48 -0.16 -0.05 0.00 1.54 0.00 0.00 36.73 38.55 2fvt h TYR 109 CO 0.03 0.51 0.31 -0.97 -1.64 0.00 0.00 178.16 176.41 2fvt h ASN 110 N 0.40 0.46 -0.13 -2.11 -0.73 -0.65 0.55 115.58 113.36 2fvt h ASN 110 Ca 0.11 0.03 -0.02 0.00 1.87 0.00 0.00 56.30 58.29 2fvt h ASN 110 Cb 0.22 -0.06 -0.00 0.00 0.27 0.00 0.00 38.32 38.74 2fvt h ASN 110 CO -0.01 0.31 -0.00 0.40 -0.37 0.00 0.00 177.43 177.76 2fvt h ILE 111 N 0.59 1.26 -0.48 2.57 2.04 -1.31 -2.93 117.51 119.24 2fvt h ILE 111 Ca 0.26 -0.84 -0.10 0.00 1.00 0.00 0.00 64.86 65.17 2fvt h ILE 111 Cb 0.15 1.55 -0.02 0.00 -0.74 0.00 0.00 36.82 37.76 2fvt h ILE 111 CO -0.17 0.25 -0.11 0.24 0.00 0.00 0.00 178.15 178.36 2fvt h MET 112 N -0.03 0.88 0.00 2.37 2.86 -0.80 -1.15 114.93 119.06 2fvt h MET 112 Ca 0.04 -0.31 -0.06 0.00 -2.06 0.00 0.00 59.70 57.31 2fvt h MET 112 Cb 0.38 -0.07 -0.01 0.00 0.06 0.00 0.00 31.60 31.96 2fvt h MET 112 CO 0.01 0.95 -0.31 0.97 1.06 0.00 0.00 176.91 179.59 2fvt h ILE 113 N 0.79 0.87 0.06 -1.22 6.09 -0.94 -1.51 117.51 121.65 2fvt h ILE 113 Ca 0.13 -1.22 -0.10 0.00 -1.37 0.00 0.00 64.86 62.30 2fvt h ILE 113 Cb 0.63 1.74 0.01 0.00 0.47 0.00 0.00 36.82 39.66 2fvt h ILE 113 CO 0.04 0.30 -0.41 1.23 -3.07 0.00 0.00 178.15 176.24 2fvt h GLY 114 N 1.60 0.20 0.93 8.18 0.00 -1.26 -3.38 103.07 109.34 2fvt h GLY 114 Ca -0.00 -0.46 -0.03 0.00 0.00 0.00 0.00 47.33 46.83 2fvt h GLY 114 CO 0.04 0.41 -0.34 0.83 0.00 0.00 0.00 176.54 177.48 2fvt h GLU 115 N -0.59 -0.92 0.00 4.80 4.39 -1.12 -3.47 114.58 117.68 2fvt h GLU 115 Ca -0.07 0.06 0.00 0.00 0.34 0.00 0.00 59.36 59.70 2fvt h GLU 115 Cb 1.27 0.21 0.00 0.00 -0.10 0.00 0.00 28.75 30.13 2fvt h GLU 115 CO 0.08 -0.59 0.00 0.54 -1.16 0.00 0.00 179.01 177.88 2fvt n ARG 116 N -5.47 0.00 -1.75 2.33 1.74 -0.58 -5.11 116.66 107.82 2fvt n ARG 116 Ca -0.14 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 56.94 2fvt n ARG 116 Cb 0.39 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.83 2fvt n ARG 116 CO 0.00 0.00 0.00 -2.13 -1.52 0.00 0.00 177.63 173.98 2fvt n ARG 117 N 0.00 0.00 -1.70 5.56 0.63 -1.20 -4.69 116.66 115.26 2fvt n ARG 117 Ca 0.00 0.00 -0.18 0.00 -0.92 0.00 0.00 57.85 56.75 2fvt n ARG 117 Cb 0.00 0.00 -0.06 0.00 0.45 0.00 0.00 32.46 32.85 2fvt n ARG 117 CO 0.00 0.00 0.00 0.54 -2.51 0.00 0.00 177.63 175.66 2fvt n ARG 118 N 0.00 -1.31 -4.96 -0.14 5.12 -1.26 -4.87 116.66 109.24 2fvt n ARG 118 Ca 0.00 1.09 -0.32 0.00 -1.93 0.00 0.00 57.85 56.69 2fvt n ARG 118 Cb 0.00 -5.42 -0.15 0.00 -1.16 0.00 0.00 32.46 25.73 2fvt n ARG 118 CO 0.00 0.00 0.00 0.54 -1.93 0.00 0.00 177.63 176.24 2fvt s VAL 119 N -2.73 2.67 0.05 1.55 0.11 -1.26 -0.55 120.40 120.24 2fvt s VAL 119 Ca 0.00 -0.81 0.08 0.00 -2.93 0.00 0.00 61.98 58.32 2fvt s VAL 119 Cb 0.00 -2.08 -0.03 0.00 -1.53 0.00 0.00 36.38 32.74 2fvt s VAL 119 CO 0.00 0.54 -0.23 0.00 -3.33 0.00 0.00 175.10 172.09 2fvt s ALA 120 N 0.24 1.95 -0.25 1.54 0.00 0.32 -3.96 121.76 121.60 2fvt s ALA 120 Ca -0.12 -1.15 0.02 0.00 0.00 0.00 0.00 51.96 50.71 2fvt s ALA 120 Cb -0.16 -0.38 0.05 0.00 0.00 0.00 0.00 23.12 22.63 2fvt s ALA 120 CO 0.06 0.44 -0.11 0.00 0.00 0.00 0.00 175.76 176.16 2fvt s ALA 121 N -0.83 2.56 -0.63 0.00 0.00 0.49 -0.08 121.76 123.28 2fvt s ALA 121 Ca 0.09 -1.66 -0.19 0.00 0.00 0.00 0.00 51.96 50.20 2fvt s ALA 121 Cb -0.09 -1.57 0.11 0.00 0.00 0.00 0.00 23.12 21.57 2fvt s ALA 121 CO 0.02 -1.05 0.75 0.00 0.00 0.00 0.00 175.76 175.49 2fvt s ALA 122 N 1.16 3.42 -0.28 0.00 0.00 0.46 -0.72 121.76 125.80 2fvt s ALA 122 Ca -0.06 -2.28 -0.06 0.00 0.00 0.00 0.00 51.96 49.56 2fvt s ALA 122 Cb -0.19 -3.58 0.00 0.00 0.00 0.00 0.00 23.12 19.35 2fvt s ALA 122 CO -0.06 -2.42 0.06 -0.51 0.00 0.00 0.00 175.76 172.83 2fvt s LEU 123 N 2.68 3.66 -0.22 0.00 1.43 -0.50 -0.39 118.68 125.34 2fvt s LEU 123 Ca 0.14 -0.63 -0.11 0.00 -1.03 0.00 0.00 54.13 52.49 2fvt s LEU 123 Cb -0.22 -1.86 -0.05 0.00 0.03 0.00 0.00 46.19 44.10 2fvt s LEU 123 CO 0.05 -0.15 0.20 -0.63 0.23 0.00 0.00 176.35 176.05 2fvt s ILE 124 N 1.50 5.34 0.55 -0.59 1.01 -0.43 -1.47 121.20 127.11 2fvt s ILE 124 Ca 0.03 0.29 -0.20 0.00 0.00 0.00 0.00 60.65 60.77 2fvt s ILE 124 Cb -0.17 -3.54 -0.05 0.00 0.01 0.00 0.00 42.46 38.71 2fvt s ILE 124 CO 0.02 0.35 1.22 0.00 0.00 0.00 0.00 174.94 176.52 2fvt s ALA 125 N 0.95 2.71 -0.20 9.38 0.00 0.10 -3.96 121.76 130.74 2fvt s ALA 125 Ca 0.10 1.04 -0.29 0.00 0.00 0.00 0.00 51.96 52.81 2fvt s ALA 125 Cb -0.13 -3.45 -0.04 0.00 0.00 0.00 0.00 23.12 19.50 2fvt s ALA 125 CO 0.04 -1.05 1.90 0.08 0.00 0.00 0.00 175.76 176.73 2fvt s VAL 126 N -1.54 3.33 -0.40 0.00 1.01 -1.26 -4.80 120.40 116.73 2fvt s VAL 126 Ca 0.73 0.36 0.02 0.00 0.00 0.00 0.00 61.98 63.08 2fvt s VAL 126 Cb -0.31 -3.37 0.19 0.00 0.00 0.00 0.00 36.38 32.90 2fvt s VAL 126 CO 0.36 -0.18 1.07 -0.81 0.00 0.00 0.00 175.10 175.54 2fvt n PRO 127 N 8.15 1.63 -0.26 2.72 -0.04 -1.26 -4.61 135.00 141.33 2fvt n PRO 127 Ca 0.23 -0.81 0.03 0.00 -0.04 0.00 0.00 63.50 62.91 2fvt n PRO 127 Cb 0.45 -1.47 -0.01 0.00 -0.04 0.00 0.00 33.50 32.42 2fvt n PRO 127 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 2fvt n LEU 128 N 0.11 0.00 -0.82 1.53 4.77 -1.26 -4.25 117.00 117.07 2fvt n LEU 128 Ca 0.12 0.28 0.12 0.00 -0.03 0.00 0.00 56.01 56.50 2fvt n LEU 128 Cb 0.68 -0.77 0.10 0.00 -2.33 0.00 0.00 43.42 41.10 2fvt n LEU 128 CO 0.13 -1.41 0.56 -1.84 -1.33 0.00 0.00 177.39 173.50 2fvt n GLU 129 N -2.01 2.01 -4.02 3.23 0.00 -1.26 -4.86 120.64 113.74 2fvt n GLU 129 Ca 0.00 -1.65 -0.09 0.00 0.00 0.00 0.00 57.16 55.42 2fvt n GLU 129 Cb 0.12 -1.47 -0.08 0.00 0.00 0.00 0.00 31.44 30.01 2fvt n GLU 129 CO 0.00 0.00 0.00 -3.38 0.00 0.00 0.00 177.13 173.75 2fvt s HIS 130 N -2.12 0.52 0.44 -1.84 -3.43 -1.26 -5.17 115.29 102.43 2fvt s HIS 130 Ca 0.26 -0.92 -0.07 0.00 -0.80 0.00 0.00 55.06 53.53 2fvt s HIS 130 Cb 0.20 -0.23 0.11 0.00 -1.43 0.00 0.00 32.58 31.22 2fvt s HIS 130 CO 0.37 -0.58 0.36 0.72 -2.00 0.00 0.00 174.74 173.61 2fvt n HIS 131 N -0.11 -3.17 0.73 0.38 8.25 -1.26 -4.82 115.22 115.21 2fvt n HIS 131 Ca -0.09 -0.33 0.00 0.00 -0.26 0.00 0.00 57.72 57.04 2fvt n HIS 131 Cb 0.63 -0.40 0.00 0.00 1.12 0.00 0.00 29.99 31.34 2fvt n HIS 131 CO 0.00 0.00 0.00 -2.39 0.64 0.00 0.00 176.34 174.59 2fvt n HIS 132 N -3.44 0.00 -3.52 4.41 1.44 -1.26 -4.69 115.22 108.15 2fvt n HIS 132 Ca 0.05 -0.27 -0.41 0.00 -2.01 0.00 0.00 57.72 55.08 2fvt n HIS 132 Cb 0.20 -0.17 -0.11 0.00 0.12 0.00 0.00 29.99 30.03 2fvt n HIS 132 CO 0.00 0.00 0.00 -1.58 -2.81 0.00 0.00 176.34 171.95 2fvt s HIS 133 N -0.06 3.23 0.86 -1.40 5.65 -1.26 -5.07 115.29 117.23 2fvt s HIS 133 Ca 0.00 -0.36 -0.12 0.00 0.25 0.00 0.00 55.06 54.84 2fvt s HIS 133 Cb 0.00 -2.50 0.10 0.00 -1.18 0.00 0.00 32.58 29.01 2fvt s HIS 133 CO 0.00 -0.43 1.10 -3.38 -0.65 0.00 0.00 174.74 171.38 2fvt s HIS 134 N 1.70 2.61 0.00 3.88 0.00 -1.26 -5.07 115.29 117.14 2fvt s HIS 134 Ca 0.06 1.10 0.00 0.00 -3.00 0.00 0.00 55.06 53.21 2fvt s HIS 134 Cb -0.18 -3.20 0.00 0.00 -4.00 0.00 0.00 32.58 25.20 2fvt s HIS 134 CO 0.10 -2.11 0.00 1.58 -1.00 0.00 0.00 174.74 173.31