#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fvt n ALA 2 N 0.00 0.00 -2.17 3.17 0.00 -1.26 -3.51 120.51 116.74 2fvt n ALA 2 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 53.01 2fvt n ALA 2 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 2fvt n ALA 2 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 2fvt n GLN 3 N -0.14 3.14 -1.09 0.00 -0.06 -1.26 -4.49 117.38 113.48 2fvt n GLN 3 Ca 0.00 -3.06 -0.03 0.00 -2.00 0.00 0.00 57.00 51.90 2fvt n GLN 3 Cb 0.00 -3.25 -0.01 0.00 -4.06 0.00 0.00 30.24 22.92 2fvt n GLN 3 CO 0.00 0.00 0.00 0.54 -0.20 0.00 0.00 177.06 177.40 2fvt n ARG 4 N 6.18 -1.84 -3.56 3.69 1.74 -1.24 -4.88 116.66 116.75 2fvt n ARG 4 Ca 0.47 0.60 -0.17 0.00 -0.77 0.00 0.00 57.85 57.98 2fvt n ARG 4 Cb 0.41 -5.03 -0.06 0.00 -1.02 0.00 0.00 32.46 26.75 2fvt n ARG 4 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 2fvt s SER 5 N -2.12 -0.60 0.65 0.55 0.01 -1.23 -5.16 113.70 105.80 2fvt s SER 5 Ca 0.00 0.68 -0.16 0.00 1.31 0.00 0.00 55.95 57.78 2fvt s SER 5 Cb 0.00 0.57 -0.00 0.00 0.21 0.00 0.00 66.02 66.79 2fvt s SER 5 CO 0.00 -0.56 1.12 -1.61 0.41 0.00 0.00 173.24 172.60 2fvt s GLU 6 N -1.10 2.79 0.39 12.44 2.02 -1.26 -4.50 118.70 129.47 2fvt s GLU 6 Ca -0.11 1.46 -0.24 0.00 0.02 0.00 0.00 54.97 56.10 2fvt s GLU 6 Cb -0.01 -1.94 -0.09 0.00 0.10 0.00 0.00 34.13 32.19 2fvt s GLU 6 CO 0.09 -1.27 1.04 0.96 0.02 0.00 0.00 175.26 176.09 2fvt s ILE 7 N -2.23 3.78 0.23 -1.63 -5.25 -1.26 -4.97 121.20 109.87 2fvt s ILE 7 Ca 0.69 1.37 -0.32 0.00 -0.99 0.00 0.00 60.65 61.40 2fvt s ILE 7 Cb -0.22 -3.72 -0.12 0.00 2.95 0.00 0.00 42.46 41.35 2fvt s ILE 7 CO 0.40 0.02 1.66 -0.81 -1.79 0.00 0.00 174.94 174.42 2fvt n PRO 8 N 0.01 2.66 -4.14 0.37 -0.04 -1.26 -5.00 135.00 127.59 2fvt n PRO 8 Ca 0.05 0.95 -0.36 0.00 -0.04 0.00 0.00 63.50 64.10 2fvt n PRO 8 Cb 0.50 -2.77 -0.08 0.00 -0.04 0.00 0.00 33.50 31.11 2fvt n PRO 8 CO 0.00 0.00 0.00 -1.01 -0.04 0.00 0.00 175.50 174.45 2fvt s HIS 9 N 0.74 3.37 -0.52 0.54 3.76 -1.26 -5.07 115.29 116.85 2fvt s HIS 9 Ca 0.72 0.35 -0.26 0.00 -0.15 0.00 0.00 55.06 55.72 2fvt s HIS 9 Cb -0.53 -1.85 0.03 0.00 1.11 0.00 0.00 32.58 31.34 2fvt s HIS 9 CO 0.38 0.60 1.00 -0.06 -0.85 0.00 0.00 174.74 175.81 2fvt s PHE 10 N -0.97 2.80 -0.65 1.40 0.08 -1.26 -4.95 117.98 114.44 2fvt s PHE 10 Ca 0.15 0.25 -0.23 0.00 0.12 0.00 0.00 56.93 57.22 2fvt s PHE 10 Cb -0.12 -4.15 0.06 0.00 -0.57 0.00 0.00 43.02 38.25 2fvt s PHE 10 CO 0.04 -1.31 0.99 -1.25 -0.10 0.00 0.00 175.22 173.59 2fvt s PRO 11 N 4.11 3.15 -0.29 0.24 0.05 -1.26 -0.14 135.00 140.86 2fvt s PRO 11 Ca 0.36 -0.68 -0.01 0.00 0.05 0.00 0.00 61.00 60.72 2fvt s PRO 11 Cb -0.10 -4.19 0.00 0.00 0.05 0.00 0.00 34.50 30.25 2fvt s PRO 11 CO 0.24 -1.79 0.03 -2.13 0.05 0.00 0.00 177.00 173.40 2fvt n ARG 12 N 7.82 -3.24 -4.86 4.56 0.00 -1.25 -4.85 116.66 114.85 2fvt n ARG 12 Ca -0.02 2.62 -0.33 0.00 -0.00 0.00 0.00 57.85 60.12 2fvt n ARG 12 Cb 0.46 -5.13 -0.13 0.00 0.00 0.00 0.00 32.46 27.66 2fvt n ARG 12 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.63 178.62 2fvt s THR 13 N -1.58 3.06 -1.56 5.15 2.01 -1.26 -5.00 115.64 116.46 2fvt s THR 13 Ca 0.01 -0.70 0.18 0.00 0.31 0.00 0.00 61.69 61.48 2fvt s THR 13 Cb -0.00 -2.22 -0.02 0.00 0.01 0.00 0.00 72.50 70.27 2fvt s THR 13 CO 0.73 0.57 0.90 0.00 -0.69 0.00 0.00 174.62 176.13 2fvt n ALA 14 N 2.71 3.32 -2.91 7.40 0.00 -1.26 -4.89 120.51 124.88 2fvt n ALA 14 Ca -0.17 -0.56 -0.40 0.00 0.00 0.00 0.00 53.44 52.31 2fvt n ALA 14 Cb 0.52 -0.62 -0.11 0.00 0.00 0.00 0.00 19.45 19.24 2fvt n ALA 14 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2fvt s ALA 15 N -2.07 3.23 -0.10 0.00 0.00 -1.26 -4.67 121.76 116.89 2fvt s ALA 15 Ca 0.14 -1.73 -0.01 0.00 0.00 0.00 0.00 51.96 50.36 2fvt s ALA 15 Cb 0.14 -2.52 -0.03 0.00 0.00 0.00 0.00 23.12 20.71 2fvt s ALA 15 CO 0.46 -1.38 -0.03 0.42 0.00 0.00 0.00 175.76 175.23 2fvt s ILE 16 N 1.52 4.03 0.02 0.00 1.01 -1.26 -5.01 121.20 121.50 2fvt s ILE 16 Ca 0.01 -0.34 -0.03 0.00 0.00 0.00 0.00 60.65 60.28 2fvt s ILE 16 Cb -0.19 -2.70 -0.01 0.00 0.01 0.00 0.00 42.46 39.57 2fvt s ILE 16 CO 0.06 0.58 0.05 -0.62 0.00 0.00 0.00 174.94 175.00 2fvt s ASP 17 N -0.57 0.16 -0.33 3.58 -1.08 -1.26 -5.01 116.67 112.15 2fvt s ASP 17 Ca 0.09 -0.40 -0.13 0.00 -0.52 0.00 0.00 52.55 51.59 2fvt s ASP 17 Cb -0.12 0.15 0.02 0.00 -1.46 0.00 0.00 42.92 41.51 2fvt s ASP 17 CO 0.02 -0.35 0.34 0.00 0.52 0.00 0.00 175.17 175.70 2fvt n ALA 18 N 1.43 -2.85 -2.87 3.66 0.00 -1.25 -3.43 120.51 115.19 2fvt n ALA 18 Ca -0.23 0.63 -0.34 0.00 0.00 0.00 0.00 53.44 53.50 2fvt n ALA 18 Cb 0.56 -2.14 -0.11 0.00 0.00 0.00 0.00 19.45 17.75 2fvt n ALA 18 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 2fvt s TYR 19 N -1.84 3.09 0.00 0.00 5.04 -1.26 -0.39 117.35 121.99 2fvt s TYR 19 Ca 0.16 -0.13 0.00 0.00 -2.44 0.00 0.00 57.07 54.66 2fvt s TYR 19 Cb -0.03 -1.96 0.00 0.00 0.35 0.00 0.00 41.96 40.32 2fvt s TYR 19 CO 0.67 0.09 0.00 0.41 -1.34 0.00 0.00 175.55 175.38 2fvt n GLY 20 N 3.30 -0.01 3.64 8.97 0.00 -0.03 -5.02 105.19 116.04 2fvt n GLY 20 Ca -0.17 -0.04 -0.43 0.00 0.00 0.00 0.00 46.02 45.38 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 4.01 0.00 1.61 2.20 -1.26 -1.57 119.74 124.73 2fvt s LYS 21 Ca 0.00 1.40 0.00 0.00 -0.36 0.00 0.00 55.97 57.01 2fvt s LYS 21 Cb 0.00 -3.85 0.00 0.00 -1.51 0.00 0.00 37.83 32.47 2fvt s LYS 21 CO 0.00 -1.00 0.00 0.41 -0.36 0.00 0.00 175.35 174.40 2fvt n GLY 22 N 4.12 0.58 3.13 5.54 0.00 -1.26 -4.84 105.19 112.46 2fvt n GLY 22 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.17 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 -2.00 1.34 3.14 -0.02 0.00 -0.61 -3.71 105.19 103.33 2fvt n GLY 23 Ca 0.00 -0.72 -0.37 0.00 0.00 0.00 0.00 46.02 44.93 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 3.53 -0.80 1.61 0.40 0.12 -0.85 117.98 121.99 2fvt s PHE 24 Ca 0.00 -2.36 -0.18 0.00 -0.60 0.00 0.00 56.93 53.79 2fvt s PHE 24 Cb 0.00 -3.29 0.14 0.00 0.51 0.00 0.00 43.02 40.38 2fvt s PHE 24 CO 0.00 -0.96 0.94 -0.47 0.70 0.00 0.00 175.22 175.43 2fvt s TYR 25 N 0.96 3.18 -0.04 0.36 5.04 0.47 -0.22 117.35 127.09 2fvt s TYR 25 Ca 0.09 -1.33 -0.03 0.00 -2.44 0.00 0.00 57.07 53.37 2fvt s TYR 25 Cb -0.23 -4.13 0.02 0.00 0.35 0.00 0.00 41.96 37.98 2fvt s TYR 25 CO -0.03 -1.36 0.11 -0.59 -1.34 0.00 0.00 175.55 172.33 2fvt s PHE 26 N 2.32 -0.11 -0.38 4.97 -0.71 -1.25 -3.96 117.98 118.85 2fvt s PHE 26 Ca 0.24 0.32 -0.10 0.00 -1.04 0.00 0.00 56.93 56.35 2fvt s PHE 26 Cb -0.12 -0.04 0.01 0.00 -1.21 0.00 0.00 43.02 41.67 2fvt s PHE 26 CO -0.04 -0.10 0.39 0.00 -1.34 0.00 0.00 175.22 174.14 2fvt n ALA 27 N 3.57 -3.17 0.00 1.99 0.00 -1.26 -4.31 120.51 117.33 2fvt n ALA 27 Ca -0.19 0.94 0.00 0.00 0.00 0.00 0.00 53.44 54.18 2fvt n ALA 27 Cb 0.56 -2.81 0.00 0.00 0.00 0.00 0.00 19.45 17.19 2fvt n ALA 27 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2fvt n GLY 28 N 0.01 2.01 3.13 0.00 0.00 -1.26 -4.90 105.19 104.18 2fvt n GLY 28 Ca 0.08 -0.36 -0.11 0.00 0.00 0.00 0.00 46.02 45.63 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 0.71 0.33 1.61 -2.45 -1.26 -5.13 119.30 113.12 2fvt s MET 29 Ca 0.00 -1.13 -0.29 0.00 -1.25 0.00 0.00 55.69 53.02 2fvt s MET 29 Cb 0.00 -0.20 -0.11 0.00 1.25 0.00 0.00 34.83 35.77 2fvt s MET 29 CO 0.00 -0.00 1.43 -1.12 1.05 0.00 0.00 175.02 176.38 2fvt s SER 30 N -2.54 6.53 -0.28 1.11 0.01 -1.26 -3.99 113.70 113.27 2fvt s SER 30 Ca 0.04 2.87 0.03 0.00 1.31 0.00 0.00 55.95 60.20 2fvt s SER 30 Cb 0.00 -2.65 0.07 0.00 0.21 0.00 0.00 66.02 63.65 2fvt s SER 30 CO -0.03 -0.74 -0.06 -1.00 0.41 0.00 0.00 173.24 171.81 2fvt s HIS 31 N -0.84 3.40 0.48 2.43 4.02 0.69 -4.96 115.29 120.52 2fvt s HIS 31 Ca 0.54 -2.49 0.04 0.00 1.02 0.00 0.00 55.06 54.17 2fvt s HIS 31 Cb -0.44 -2.20 -0.02 0.00 -1.02 0.00 0.00 32.58 28.91 2fvt s HIS 31 CO 0.55 -0.90 0.14 1.14 1.02 0.00 0.00 174.74 176.69 2fvt s GLN 32 N 1.05 2.18 2.39 1.40 -2.07 -1.24 0.13 119.66 123.51 2fvt s GLN 32 Ca -0.04 -2.15 0.00 0.00 -1.82 0.00 0.00 55.36 51.35 2fvt s GLN 32 Cb -0.20 -1.78 0.00 0.00 -1.09 0.00 0.00 33.01 29.94 2fvt s GLN 32 CO -0.06 -0.32 0.00 0.41 -1.32 0.00 0.00 175.29 174.00 2fvt n GLY 33 N -1.34 1.26 2.88 2.60 0.00 -1.26 -4.82 105.19 104.51 2fvt n GLY 33 Ca -0.09 -0.79 -0.14 0.00 0.00 0.00 0.00 46.02 45.00 2fvt n GLY 33 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2fvt s SER 34 N -4.00 -0.04 -0.07 1.61 1.04 -1.25 -0.20 113.70 110.78 2fvt s SER 34 Ca 0.00 0.17 0.02 0.00 0.48 0.00 0.00 55.95 56.62 2fvt s SER 34 Cb 0.00 0.09 -0.02 0.00 0.10 0.00 0.00 66.02 66.19 2fvt s SER 34 CO 0.00 -0.10 -0.14 -0.76 0.98 0.00 0.00 173.24 173.22 2fvt s LEU 35 N 0.79 2.73 -0.51 2.42 1.43 0.10 -0.64 118.68 125.01 2fvt s LEU 35 Ca -0.06 -0.24 -0.10 0.00 -1.03 0.00 0.00 54.13 52.71 2fvt s LEU 35 Cb -0.09 -1.57 0.13 0.00 0.03 0.00 0.00 46.19 44.69 2fvt s LEU 35 CO -0.03 0.29 0.40 -0.76 0.23 0.00 0.00 176.35 176.47 2fvt s LEU 36 N -0.39 5.78 -0.81 1.79 1.43 0.98 -1.66 118.68 125.80 2fvt s LEU 36 Ca 0.04 -2.03 -0.26 0.00 -1.03 0.00 0.00 54.13 50.85 2fvt s LEU 36 Cb -0.12 -2.03 0.03 0.00 0.03 0.00 0.00 46.19 44.09 2fvt s LEU 36 CO 0.02 -0.67 1.43 -0.36 0.23 0.00 0.00 176.35 176.99 2fvt s PHE 37 N 1.18 2.25 0.20 0.29 0.40 0.66 -1.26 117.98 121.70 2fvt s PHE 37 Ca 0.07 -0.14 0.06 0.00 -0.60 0.00 0.00 56.93 56.33 2fvt s PHE 37 Cb -0.25 -4.56 -0.04 0.00 0.51 0.00 0.00 43.02 38.68 2fvt s PHE 37 CO -0.01 -2.05 0.10 -0.51 0.70 0.00 0.00 175.22 173.45 2fvt s LEU 38 N 6.13 3.63 0.53 -0.37 1.43 -0.70 -1.71 118.68 127.62 2fvt s LEU 38 Ca 0.43 -0.27 0.22 0.00 -1.03 0.00 0.00 54.13 53.48 2fvt s LEU 38 Cb -0.06 -2.22 1.38 0.00 0.03 0.00 0.00 46.19 45.31 2fvt s LEU 38 CO 0.08 0.04 2.07 -0.65 0.23 0.00 0.00 176.35 178.13 2fvt h PRO 39 N 2.22 0.00 0.29 1.29 0.11 -1.88 -2.66 132.00 131.36 2fvt h PRO 39 Ca -0.47 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.62 2fvt h PRO 39 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 2fvt h PRO 39 CO 0.61 0.00 -0.14 0.22 -0.21 0.00 0.00 178.00 178.48 2fvt h ASP 40 N 0.00 -0.33 -5.49 -2.05 3.58 -1.94 -3.34 116.42 106.85 2fvt h ASP 40 Ca 0.13 -0.20 0.22 0.00 0.42 0.00 0.00 57.03 57.60 2fvt h ASP 40 Cb 0.54 0.08 -0.08 0.00 1.72 0.00 0.00 39.33 41.59 2fvt h ASP 40 CO -0.00 0.14 0.62 0.00 -2.88 0.00 0.00 179.24 177.12 2fvt s ALA 41 N -4.08 -1.83 -0.61 -0.78 0.00 -1.00 -3.76 121.76 109.71 2fvt s ALA 41 Ca -0.12 0.13 -0.22 0.00 0.00 0.00 0.00 51.96 51.75 2fvt s ALA 41 Cb 0.01 0.62 0.07 0.00 0.00 0.00 0.00 23.12 23.82 2fvt s ALA 41 CO 0.43 -1.06 0.86 0.08 0.00 0.00 0.00 175.76 176.07 2fvt s VAL 42 N -2.70 4.51 0.34 0.00 1.01 0.80 -1.73 120.40 122.63 2fvt s VAL 42 Ca 0.16 -0.41 0.07 0.00 0.00 0.00 0.00 61.98 61.80 2fvt s VAL 42 Cb -0.00 -4.57 -0.02 0.00 0.00 0.00 0.00 36.38 31.79 2fvt s VAL 42 CO 0.01 -1.24 0.38 0.26 0.00 0.00 0.00 175.10 174.52 2fvt s TRP 43 N 3.56 3.01 0.03 5.22 0.52 -0.39 -4.65 118.94 126.24 2fvt s TRP 43 Ca 0.20 -0.26 -0.14 0.00 0.02 0.00 0.00 56.10 55.92 2fvt s TRP 43 Cb -0.18 -1.90 -0.06 0.00 -1.15 0.00 0.00 33.47 30.18 2fvt s TRP 43 CO 0.11 0.08 0.43 0.20 0.02 0.00 0.00 176.95 177.79 2fvt s GLY 44 N -4.09 2.46 0.13 0.98 0.00 -1.26 -0.01 107.32 105.53 2fvt s GLY 44 Ca 0.43 -0.23 0.02 0.00 0.00 0.00 0.00 44.72 44.94 2fvt s GLY 44 CO 0.29 0.10 0.25 0.86 0.00 0.00 0.00 173.10 174.60 2fvt s TRP 45 N -1.18 3.46 -0.29 1.90 -0.00 0.19 -4.81 118.94 118.20 2fvt s TRP 45 Ca 0.27 0.13 0.11 0.00 -0.00 0.00 0.00 56.10 56.62 2fvt s TRP 45 Cb -0.16 -1.67 0.78 0.00 -0.00 0.00 0.00 33.47 32.42 2fvt s TRP 45 CO 0.15 0.53 1.79 -3.47 -0.00 0.00 0.00 176.95 175.96 2fvt n ASP 46 N -0.35 5.20 -4.65 5.86 2.03 -1.26 -4.37 116.55 119.00 2fvt n ASP 46 Ca -0.07 -3.12 -0.35 0.00 0.52 0.00 0.00 54.79 51.77 2fvt n ASP 46 Cb 0.53 -0.73 -0.09 0.00 -0.72 0.00 0.00 41.12 40.11 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 -2.92 4.93 -0.18 5.18 1.01 -1.26 -5.00 120.40 122.16 2fvt s VAL 47 Ca 0.55 0.02 -0.07 0.00 0.00 0.00 0.00 61.98 62.48 2fvt s VAL 47 Cb 0.43 -3.23 -0.22 0.00 0.00 0.00 0.00 36.38 33.37 2fvt s VAL 47 CO 0.14 0.45 0.14 0.41 0.00 0.00 0.00 175.10 176.25 2fvt n THR 48 N 3.55 1.66 -4.15 3.92 -1.04 -1.26 -3.97 114.28 113.00 2fvt n THR 48 Ca -0.16 -0.53 -0.10 0.00 -2.04 0.00 0.00 64.05 61.22 2fvt n THR 48 Cb 0.52 -1.71 -0.10 0.00 -1.82 0.00 0.00 70.33 67.22 2fvt n THR 48 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 2fvt s LYS 49 N -2.52 0.87 1.07 -2.82 1.02 -1.26 -4.89 119.74 111.21 2fvt s LYS 49 Ca -0.28 -1.39 -0.14 0.00 0.02 0.00 0.00 55.97 54.18 2fvt s LYS 49 Cb 0.08 0.15 0.17 0.00 -0.52 0.00 0.00 37.83 37.71 2fvt s LYS 49 CO 0.68 -0.20 0.66 -2.30 -0.92 0.00 0.00 175.35 173.28 2fvt n PRO 50 N -0.06 -1.49 0.00 -1.68 -0.02 -1.26 -3.00 135.00 127.50 2fvt n PRO 50 Ca -0.08 -0.40 0.00 0.00 -2.02 0.00 0.00 63.50 61.00 2fvt n PRO 50 Cb 0.63 -2.03 0.00 0.00 -0.02 0.00 0.00 33.50 32.08 2fvt n PRO 50 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 2fvt n GLU 51 N -3.49 0.00 0.00 -0.52 1.02 -1.26 -4.66 120.64 111.74 2fvt n GLU 51 Ca 0.05 0.00 0.13 0.00 -0.02 0.00 0.00 57.16 57.31 2fvt n GLU 51 Cb 0.56 -1.90 0.64 0.00 -0.02 0.00 0.00 31.44 30.72 2fvt n GLU 51 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 2fvt n GLN 52 N -1.32 0.34 -2.46 3.49 6.02 -1.16 -4.55 117.38 117.75 2fvt n GLN 52 Ca 0.00 0.05 -0.39 0.00 -0.01 0.00 0.00 57.00 56.65 2fvt n GLN 52 Cb 0.00 -1.50 -0.03 0.00 1.02 0.00 0.00 30.24 29.73 2fvt n GLN 52 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 2fvt s ILE 53 N -2.59 3.88 0.42 5.09 1.01 -1.26 -4.73 121.20 123.00 2fvt s ILE 53 Ca 0.24 -1.01 0.08 0.00 0.00 0.00 0.00 60.65 59.95 2fvt s ILE 53 Cb 0.17 -4.91 -0.03 0.00 0.01 0.00 0.00 42.46 37.70 2fvt s ILE 53 CO 0.39 -1.75 0.32 -0.62 0.00 0.00 0.00 174.94 173.28 2fvt s ASP 54 N 5.34 4.87 0.45 3.58 2.15 -1.26 -4.98 116.67 126.82 2fvt s ASP 54 Ca 0.53 -0.84 0.11 0.00 0.43 0.00 0.00 52.55 52.78 2fvt s ASP 54 Cb -0.00 -0.55 1.01 0.00 -0.30 0.00 0.00 42.92 43.08 2fvt s ASP 54 CO -0.02 -0.62 2.08 0.03 -0.17 0.00 0.00 175.17 176.46 2fvt h ARG 55 N 1.14 0.36 0.00 4.34 3.08 -1.97 -0.17 114.38 121.15 2fvt h ARG 55 Ca -0.42 -0.02 -0.16 0.00 0.07 0.00 0.00 59.98 59.45 2fvt h ARG 55 Cb 1.26 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 31.21 2fvt h ARG 55 CO 0.61 0.24 -0.74 1.88 -1.07 0.00 0.00 179.97 180.88 2fvt h TYR 56 N 0.37 0.00 0.00 3.04 0.05 -1.96 -2.99 116.97 115.48 2fvt h TYR 56 Ca 0.12 0.00 -0.01 0.00 0.05 0.00 0.00 58.73 58.89 2fvt h TYR 56 Cb 0.03 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 37.77 2fvt h TYR 56 CO -0.00 0.74 -0.03 0.77 -1.05 0.00 0.00 178.16 178.60 2fvt h SER 57 N 0.00 0.00 -0.25 3.88 0.02 -1.36 -2.70 113.55 113.13 2fvt h SER 57 Ca -0.01 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.94 2fvt h SER 57 Cb 1.41 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.95 2fvt h SER 57 CO 0.10 0.03 0.00 0.18 -1.14 0.00 0.00 176.83 176.00 2fvt n LEU 58 N -3.12 3.03 0.05 5.07 4.77 -0.62 -4.50 117.00 121.67 2fvt n LEU 58 Ca 0.02 -1.53 -0.15 0.00 -0.03 0.00 0.00 56.01 54.31 2fvt n LEU 58 Cb 0.39 -0.57 -0.09 0.00 -2.33 0.00 0.00 43.42 40.82 2fvt n LEU 58 CO 0.30 0.41 0.51 -0.61 -1.33 0.00 0.00 177.39 176.67 2fvt h GLN 59 N 1.74 -0.61 0.00 3.23 4.15 -1.59 0.99 115.11 123.01 2fvt h GLN 59 Ca 0.00 0.04 0.00 0.00 0.77 0.00 0.00 58.65 59.46 2fvt h GLN 59 Cb 1.13 0.14 0.00 0.00 0.21 0.00 0.00 27.48 28.96 2fvt h GLN 59 CO 0.21 -0.41 0.00 -0.09 -1.93 0.00 0.00 178.83 176.61 2fvt h ARG 60 N -0.63 0.00 0.07 1.69 2.43 -1.87 -0.29 114.38 115.77 2fvt h ARG 60 Ca 0.01 0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.18 2fvt h ARG 60 Cb 0.68 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.23 2fvt h ARG 60 CO -0.35 0.00 -0.03 0.28 -1.51 0.00 0.00 179.97 178.36 2fvt h VAL 61 N 0.00 1.18 -0.35 0.20 2.07 -1.47 -2.90 116.25 114.99 2fvt h VAL 61 Ca 0.00 -1.49 -0.04 0.00 0.82 0.00 0.00 66.70 65.99 2fvt h VAL 61 Cb 0.32 2.06 -0.02 0.00 -1.52 0.00 0.00 31.29 32.14 2fvt h VAL 61 CO 0.00 0.34 0.03 -0.26 0.02 0.00 0.00 177.57 177.69 2fvt h PHE 62 N -0.83 0.54 -0.63 1.57 0.04 -0.58 -0.53 116.94 116.52 2fvt h PHE 62 Ca -0.01 -0.05 0.01 0.00 2.80 0.00 0.00 57.97 60.73 2fvt h PHE 62 Cb 0.62 -0.16 -0.03 0.00 2.20 0.00 0.00 35.95 38.58 2fvt h PHE 62 CO 0.14 0.51 0.42 0.22 -0.60 0.00 0.00 178.31 179.00 2fvt h ASP 63 N 0.51 0.70 -0.28 2.17 3.58 -1.10 -2.39 116.42 119.61 2fvt h ASP 63 Ca 0.11 -0.02 0.00 0.00 0.42 0.00 0.00 57.03 57.55 2fvt h ASP 63 Cb 0.29 -0.17 0.00 0.00 1.72 0.00 0.00 39.33 41.17 2fvt h ASP 63 CO 0.01 0.50 0.00 0.59 -2.88 0.00 0.00 179.24 177.45 2fvt n ASN 64 N -4.45 3.30 0.00 2.28 3.02 -1.00 -4.63 115.26 113.78 2fvt n ASN 64 Ca 0.07 -2.51 0.05 0.00 -0.03 0.00 0.00 54.58 52.16 2fvt n ASN 64 Cb 0.07 -0.37 0.24 0.00 -0.61 0.00 0.00 39.78 39.10 2fvt n ASN 64 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2fvt n ALA 65 N -0.08 1.53 0.18 5.41 0.00 -0.24 -1.74 120.51 125.57 2fvt n ALA 65 Ca 0.16 -0.04 0.05 0.00 0.00 0.00 0.00 53.44 53.61 2fvt n ALA 65 Cb 0.64 -1.17 0.33 0.00 0.00 0.00 0.00 19.45 19.25 2fvt n ALA 65 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 177.50 176.53 2fvt h ASN 66 N 0.00 0.00 -0.17 0.00 -0.73 -1.82 -2.75 115.58 110.11 2fvt h ASN 66 Ca 0.00 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.17 2fvt h ASN 66 Cb 0.16 0.00 0.00 0.00 0.27 0.00 0.00 38.32 38.75 2fvt h ASN 66 CO 0.00 0.39 0.00 0.00 -0.37 0.00 0.00 177.43 177.45 2fvt n ALA 67 N -2.32 2.44 -2.96 1.57 0.00 -0.71 -4.88 120.51 113.66 2fvt n ALA 67 Ca -0.00 -0.81 -0.38 0.00 0.00 0.00 0.00 53.44 52.25 2fvt n ALA 67 Cb 0.51 -0.81 -0.12 0.00 0.00 0.00 0.00 19.45 19.03 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 -1.75 4.41 -0.24 0.00 1.01 -1.04 -4.64 121.20 118.95 2fvt s ILE 68 Ca 0.31 -0.51 -0.13 0.00 0.00 0.00 0.00 60.65 60.32 2fvt s ILE 68 Cb 0.21 -3.26 -0.16 0.00 0.01 0.00 0.00 42.46 39.25 2fvt s ILE 68 CO 0.30 0.06 -0.12 -0.67 0.00 0.00 0.00 174.94 174.51 2fvt n ASP 69 N 4.95 1.95 -4.33 3.58 2.03 0.12 -4.68 116.55 120.17 2fvt n ASP 69 Ca -0.14 0.28 -0.32 0.00 0.52 0.00 0.00 54.79 55.13 2fvt n ASP 69 Cb 0.49 -0.81 -0.15 0.00 -0.72 0.00 0.00 41.12 39.93 2fvt n ASP 69 CO 0.00 0.00 0.00 -0.89 -1.92 0.00 0.00 177.20 174.39 2fvt s THR 70 N -2.47 2.52 -0.25 5.18 2.01 -1.02 -0.08 115.64 121.52 2fvt s THR 70 Ca -0.34 -0.89 0.02 0.00 0.31 0.00 0.00 61.69 60.80 2fvt s THR 70 Cb 0.11 -1.98 0.05 0.00 0.01 0.00 0.00 72.50 70.69 2fvt s THR 70 CO 0.56 0.56 -0.12 -0.22 -0.69 0.00 0.00 174.62 174.71 2fvt s LEU 71 N -0.06 3.30 -0.31 4.42 2.96 0.12 -0.43 118.68 128.68 2fvt s LEU 71 Ca -0.05 -1.29 -0.17 0.00 -0.22 0.00 0.00 54.13 52.40 2fvt s LEU 71 Cb -0.14 -1.55 -0.02 0.00 0.50 0.00 0.00 46.19 44.98 2fvt s LEU 71 CO 0.04 -0.17 0.48 -0.63 -1.32 0.00 0.00 176.35 174.76 2fvt s ILE 72 N 1.14 5.07 -0.38 6.68 1.01 0.03 -1.71 121.20 133.03 2fvt s ILE 72 Ca -0.07 0.55 -0.13 0.00 0.00 0.00 0.00 60.65 61.00 2fvt s ILE 72 Cb -0.19 -3.86 0.02 0.00 0.01 0.00 0.00 42.46 38.43 2fvt s ILE 72 CO -0.06 -0.04 0.25 -0.69 0.00 0.00 0.00 174.94 174.40 2fvt s VAL 73 N 2.29 4.98 -0.45 2.92 1.01 -0.02 0.05 120.40 131.18 2fvt s VAL 73 Ca 0.19 -0.66 -0.18 0.00 0.00 0.00 0.00 61.98 61.33 2fvt s VAL 73 Cb -0.16 -3.74 0.04 0.00 0.00 0.00 0.00 36.38 32.52 2fvt s VAL 73 CO 0.11 -0.23 0.49 -0.83 0.00 0.00 0.00 175.10 174.65 2fvt s GLY 74 N 1.64 1.88 0.00 4.51 0.00 0.24 -1.03 107.32 114.55 2fvt s GLY 74 Ca 0.04 -1.64 0.12 0.00 0.00 0.00 0.00 44.72 43.24 2fvt s GLY 74 CO 0.09 1.24 1.37 -1.30 0.00 0.00 0.00 173.10 174.50 2fvt n THR 75 N 5.47 0.16 0.00 0.90 -2.24 -1.02 -1.28 114.28 116.27 2fvt n THR 75 Ca -0.08 -0.19 0.00 0.00 -2.27 0.00 0.00 64.05 61.52 2fvt n THR 75 Cb 0.46 0.06 0.00 0.00 -2.10 0.00 0.00 70.33 68.76 2fvt n THR 75 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2fvt n GLY 76 N 0.85 1.58 0.08 3.38 0.00 -1.25 -3.95 105.19 105.89 2fvt n GLY 76 Ca 0.10 -0.64 0.07 0.00 0.00 0.00 0.00 46.02 45.55 2fvt n GLY 76 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fvt n ALA 77 N 5.83 2.38 -2.45 4.61 0.00 -1.26 -3.78 120.51 125.84 2fvt n ALA 77 Ca 0.00 -0.50 -0.19 0.00 0.00 0.00 0.00 53.44 52.75 2fvt n ALA 77 Cb 0.00 -0.87 -0.11 0.00 0.00 0.00 0.00 19.45 18.47 2fvt n ALA 77 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2fvt s ASP 78 N -5.20 2.32 -0.55 0.00 2.15 -1.25 -5.10 116.67 109.04 2fvt s ASP 78 Ca -0.04 -0.86 -0.21 0.00 0.43 0.00 0.00 52.55 51.86 2fvt s ASP 78 Cb 0.10 -0.11 0.06 0.00 -0.30 0.00 0.00 42.92 42.68 2fvt s ASP 78 CO 0.84 -0.11 0.78 -0.69 -0.17 0.00 0.00 175.17 175.81 2fvt s VAL 79 N -2.26 4.64 -0.36 1.11 1.01 -1.26 -4.58 120.40 118.69 2fvt s VAL 79 Ca 0.13 -0.26 -0.15 0.00 0.00 0.00 0.00 61.98 61.70 2fvt s VAL 79 Cb -0.04 -4.44 -0.00 0.00 0.00 0.00 0.00 36.38 31.89 2fvt s VAL 79 CO 0.05 -1.02 0.35 0.86 0.00 0.00 0.00 175.10 175.33 2fvt s TRP 80 N 3.26 3.21 -0.15 5.22 -0.00 -1.26 -5.06 118.94 124.16 2fvt s TRP 80 Ca 0.21 -0.18 -0.23 0.00 -0.00 0.00 0.00 56.10 55.90 2fvt s TRP 80 Cb -0.17 -2.67 -0.03 0.00 -0.00 0.00 0.00 33.47 30.61 2fvt s TRP 80 CO 0.14 -0.48 0.71 -1.50 -0.00 0.00 0.00 176.95 175.81 2fvt s ILE 81 N 1.95 4.99 0.23 5.86 1.10 -1.26 -4.94 121.20 129.12 2fvt s ILE 81 Ca 0.10 1.40 -0.31 0.00 -0.51 0.00 0.00 60.65 61.33 2fvt s ILE 81 Cb -0.17 -4.03 -0.11 0.00 0.15 0.00 0.00 42.46 38.30 2fvt s ILE 81 CO 0.12 0.13 1.60 0.00 -2.11 0.00 0.00 174.94 174.68 2fvt s ALA 82 N 1.65 3.79 0.61 1.50 0.00 -1.26 -4.95 121.76 123.11 2fvt s ALA 82 Ca 0.34 1.49 -0.18 0.00 0.00 0.00 0.00 51.96 53.61 2fvt s ALA 82 Cb -0.17 -3.64 -0.05 0.00 0.00 0.00 0.00 23.12 19.27 2fvt s ALA 82 CO 0.13 -0.88 0.94 -2.30 0.00 0.00 0.00 175.76 173.66 2fvt n PRO 83 N 3.19 0.85 -0.15 0.00 -0.02 -1.26 -4.64 135.00 132.97 2fvt n PRO 83 Ca 0.12 0.33 -0.03 0.00 -2.02 0.00 0.00 63.50 61.90 2fvt n PRO 83 Cb 0.37 -2.15 0.04 0.00 -0.02 0.00 0.00 33.50 31.75 2fvt n PRO 83 CO 0.00 0.00 0.00 -0.09 1.98 0.00 0.00 175.50 177.39 2fvt h ARG 84 N 0.42 0.05 -0.34 -0.52 9.65 -1.98 0.10 114.38 121.76 2fvt h ARG 84 Ca -0.48 -0.00 -0.01 0.00 -1.10 0.00 0.00 59.98 58.38 2fvt h ARG 84 Cb 1.37 -0.01 -0.02 0.00 -1.39 0.00 0.00 29.97 29.92 2fvt h ARG 84 CO 0.50 0.03 0.18 1.96 2.80 0.00 0.00 179.97 185.44 2fvt h GLN 85 N 0.05 0.48 -0.56 0.20 7.50 -1.98 0.25 115.11 121.05 2fvt h GLN 85 Ca 0.24 -0.06 -0.01 0.00 0.50 0.00 0.00 58.65 59.32 2fvt h GLN 85 Cb 0.37 -0.09 -0.03 0.00 0.05 0.00 0.00 27.48 27.78 2fvt h GLN 85 CO -0.46 0.41 0.31 1.25 -1.50 0.00 0.00 178.83 178.84 2fvt h LEU 86 N 0.42 0.70 -0.69 1.46 5.85 -1.74 0.27 115.31 121.58 2fvt h LEU 86 Ca 0.12 -0.09 -0.07 0.00 0.84 0.00 0.00 57.88 58.68 2fvt h LEU 86 Cb 0.08 -0.18 -0.03 0.00 0.37 0.00 0.00 40.66 40.90 2fvt h LEU 86 CO -0.02 0.59 0.17 -0.09 -0.34 0.00 0.00 178.44 178.75 2fvt h ARG 87 N 0.75 1.10 -0.08 1.25 2.43 -0.49 -1.98 114.38 117.36 2fvt h ARG 87 Ca 0.20 -0.26 -0.18 0.00 -0.81 0.00 0.00 59.98 58.92 2fvt h ARG 87 Cb 0.05 -0.14 -0.00 0.00 -0.42 0.00 0.00 29.97 29.45 2fvt h ARG 87 CO -0.03 0.97 -0.72 1.49 -1.51 0.00 0.00 179.97 180.18 2fvt h GLU 88 N 1.03 0.41 -0.43 0.20 4.22 -0.15 -2.16 114.58 117.70 2fvt h GLU 88 Ca 0.22 -0.33 -0.04 0.00 0.08 0.00 0.00 59.36 59.29 2fvt h GLU 88 Cb 0.37 0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.67 2fvt h GLU 88 CO 0.00 0.97 0.11 0.00 -2.18 0.00 0.00 179.01 177.91 2fvt h ALA 89 N 0.94 0.57 -0.47 2.92 0.00 -0.31 -1.86 119.26 121.05 2fvt h ALA 89 Ca -0.03 -0.19 -0.05 0.00 0.00 0.00 0.00 54.91 54.64 2fvt h ALA 89 Cb 1.29 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.89 2fvt h ALA 89 CO 0.12 0.24 0.10 -0.07 0.00 0.00 0.00 179.25 179.64 2fvt h LEU 90 N 0.56 0.66 -1.59 0.00 3.38 -1.29 -0.96 115.31 116.08 2fvt h LEU 90 Ca 0.14 -0.11 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 2fvt h LEU 90 Cb 0.30 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.86 2fvt h LEU 90 CO -0.00 0.67 0.16 -0.09 0.09 0.00 0.00 178.44 179.27 2fvt h ARG 91 N 0.69 0.44 0.00 1.13 2.43 -1.04 -1.14 114.38 116.88 2fvt h ARG 91 Ca 0.15 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.28 2fvt h ARG 91 Cb 0.28 -0.09 0.00 0.00 -0.42 0.00 0.00 29.97 29.74 2fvt h ARG 91 CO 0.00 0.33 0.00 0.78 -1.51 0.00 0.00 179.97 179.58 2fvt h GLY 92 N 0.53 0.00 -1.43 2.80 0.00 -0.35 -0.89 103.07 103.73 2fvt h GLY 92 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.45 2fvt h GLY 92 CO -0.02 0.00 0.00 -0.62 0.00 0.00 0.00 176.54 175.90 2fvt n VAL 93 N -2.45 0.25 -1.21 4.60 0.31 -0.49 -4.92 118.33 114.42 2fvt n VAL 93 Ca 0.02 -0.49 -0.07 0.00 -0.01 0.00 0.00 64.34 63.79 2fvt n VAL 93 Cb 0.27 0.76 -0.03 0.00 -0.91 0.00 0.00 33.84 33.93 2fvt n VAL 93 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 2fvt n ASN 94 N 0.85 -4.14 -4.60 4.52 3.02 -0.34 -4.99 115.26 109.58 2fvt n ASN 94 Ca 0.17 0.18 -0.41 0.00 -0.03 0.00 0.00 54.58 54.50 2fvt n ASN 94 Cb 0.47 -2.28 -0.08 0.00 -0.61 0.00 0.00 39.78 37.28 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 -2.18 5.03 -0.63 2.41 1.01 -0.87 -4.84 120.40 120.33 2fvt s VAL 95 Ca 0.00 0.70 -0.27 0.00 0.00 0.00 0.00 61.98 62.41 2fvt s VAL 95 Cb 0.00 -3.89 -0.00 0.00 0.00 0.00 0.00 36.38 32.48 2fvt s VAL 95 CO 0.00 -0.05 1.63 -0.69 0.00 0.00 0.00 175.10 175.99 2fvt s VAL 96 N 2.38 3.52 -0.09 2.92 1.01 0.89 -4.02 120.40 127.01 2fvt s VAL 96 Ca 0.21 0.33 -0.20 0.00 0.00 0.00 0.00 61.98 62.32 2fvt s VAL 96 Cb -0.15 -4.29 -0.04 0.00 0.00 0.00 0.00 36.38 31.90 2fvt s VAL 96 CO 0.11 -1.21 0.55 -0.22 0.00 0.00 0.00 175.10 174.33 2fvt s LEU 97 N 7.63 4.30 -0.02 3.92 2.96 -1.26 0.10 118.68 136.32 2fvt s LEU 97 Ca 0.56 0.95 0.01 0.00 -0.22 0.00 0.00 54.13 55.42 2fvt s LEU 97 Cb -0.11 -2.82 0.02 0.00 0.50 0.00 0.00 46.19 43.77 2fvt s LEU 97 CO 0.20 -0.02 -0.01 -0.62 -1.32 0.00 0.00 176.35 174.58 2fvt s ASP 98 N 0.58 0.37 -0.22 3.68 2.15 -0.69 -4.97 116.67 117.57 2fvt s ASP 98 Ca 0.30 -0.03 -0.07 0.00 0.43 0.00 0.00 52.55 53.17 2fvt s ASP 98 Cb -0.16 -0.15 -0.03 0.00 -0.30 0.00 0.00 42.92 42.28 2fvt s ASP 98 CO 0.13 -0.05 0.05 -0.89 -0.17 0.00 0.00 175.17 174.24 2fvt s THR 99 N 0.60 4.34 0.17 1.71 2.01 -1.26 -0.84 115.64 122.36 2fvt s THR 99 Ca -0.06 -0.17 -0.08 0.00 0.31 0.00 0.00 61.69 61.69 2fvt s THR 99 Cb -0.09 -2.99 -0.01 0.00 0.01 0.00 0.00 72.50 69.42 2fvt s THR 99 CO -0.01 0.39 0.26 -0.32 -0.69 0.00 0.00 174.62 174.26 2fvt s MET 100 N 1.11 1.15 0.44 4.92 1.75 -0.20 -4.97 119.30 123.50 2fvt s MET 100 Ca 0.04 -1.23 -0.21 0.00 -1.25 0.00 0.00 55.69 53.04 2fvt s MET 100 Cb -0.14 0.36 -0.10 0.00 2.84 0.00 0.00 34.83 37.79 2fvt s MET 100 CO 0.03 -0.42 1.00 -0.65 -0.65 0.00 0.00 175.02 174.33 2fvt s GLN 101 N -3.99 4.06 0.25 4.11 -0.21 -1.26 -2.42 119.66 120.20 2fvt s GLN 101 Ca 0.19 1.28 -0.03 0.00 0.02 0.00 0.00 55.36 56.82 2fvt s GLN 101 Cb 0.04 -2.22 0.46 0.00 1.00 0.00 0.00 33.01 32.29 2fvt s GLN 101 CO 0.01 -0.20 1.79 1.15 -2.12 0.00 0.00 175.29 175.93 2fvt h THR 102 N 1.83 0.84 0.15 -0.19 2.02 -1.88 -1.35 112.91 114.34 2fvt h THR 102 Ca -0.49 -0.25 -0.00 0.00 0.77 0.00 0.00 66.41 66.43 2fvt h THR 102 Cb 1.20 0.04 -0.00 0.00 -1.74 0.00 0.00 68.15 67.64 2fvt h THR 102 CO 0.60 0.14 -0.13 1.23 0.37 0.00 0.00 175.52 177.73 2fvt h GLY 103 N 0.74 -0.79 1.82 2.16 0.00 -1.93 0.15 103.07 105.23 2fvt h GLY 103 Ca 0.43 0.35 0.02 0.00 0.00 0.00 0.00 47.33 48.13 2fvt h GLY 103 CO -0.29 -0.28 0.07 -2.55 0.00 0.00 0.00 176.54 173.49 2fvt h PRO 104 N -0.28 0.00 -0.64 4.80 0.11 -1.96 -1.24 132.00 132.79 2fvt h PRO 104 Ca -0.02 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 66.02 2fvt h PRO 104 Cb 0.24 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 31.32 2fvt h PRO 104 CO -0.01 0.00 0.11 0.00 -0.21 0.00 0.00 178.00 177.89 2fvt h ALA 105 N 1.94 0.85 -0.43 -0.75 0.00 -0.82 0.52 119.26 120.57 2fvt h ALA 105 Ca 0.04 -0.26 0.02 0.00 0.00 0.00 0.00 54.91 54.70 2fvt h ALA 105 Cb 0.17 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 2fvt h ALA 105 CO -0.00 0.60 0.26 0.82 0.00 0.00 0.00 179.25 180.93 2fvt h ILE 106 N 0.97 1.05 0.06 0.00 2.04 0.53 0.29 117.51 122.45 2fvt h ILE 106 Ca 0.20 -0.18 -0.00 0.00 1.00 0.00 0.00 64.86 65.87 2fvt h ILE 106 Cb 0.42 0.48 0.00 0.00 -0.74 0.00 0.00 36.82 36.99 2fvt h ILE 106 CO 0.01 0.10 -0.03 0.03 0.00 0.00 0.00 178.15 178.26 2fvt h ARG 107 N 0.52 -0.08 -0.67 2.37 3.08 -1.25 -1.20 114.38 117.15 2fvt h ARG 107 Ca 0.17 0.01 -0.02 0.00 0.07 0.00 0.00 59.98 60.20 2fvt h ARG 107 Cb 0.00 0.02 -0.03 0.00 0.08 0.00 0.00 29.97 30.04 2fvt h ARG 107 CO -0.07 0.11 0.32 1.15 -1.07 0.00 0.00 179.97 180.41 2fvt h THR 108 N -0.27 1.22 -0.24 2.04 2.02 -0.72 -1.80 112.91 115.16 2fvt h THR 108 Ca -0.01 -0.61 -0.01 0.00 0.77 0.00 0.00 66.41 66.56 2fvt h THR 108 Cb 0.23 0.36 -0.01 0.00 -1.74 0.00 0.00 68.15 66.99 2fvt h THR 108 CO 0.01 0.26 0.13 0.22 0.37 0.00 0.00 175.52 176.51 2fvt h TYR 109 N 0.95 0.34 -0.04 3.16 3.20 -0.34 -0.97 116.97 123.28 2fvt h TYR 109 Ca 0.23 -0.01 0.01 0.00 3.14 0.00 0.00 58.73 62.10 2fvt h TYR 109 Cb 0.10 -0.11 -0.00 0.00 1.54 0.00 0.00 36.73 38.26 2fvt h TYR 109 CO 0.01 0.30 0.03 -0.97 -1.64 0.00 0.00 178.16 175.89 2fvt h ASN 110 N 0.28 0.00 0.02 -2.11 -0.73 -0.53 0.21 115.58 112.72 2fvt h ASN 110 Ca 0.09 0.00 -0.00 0.00 1.87 0.00 0.00 56.30 58.25 2fvt h ASN 110 Cb 0.08 0.00 0.00 0.00 0.27 0.00 0.00 38.32 38.67 2fvt h ASN 110 CO -0.01 0.00 -0.01 0.40 -0.37 0.00 0.00 177.43 177.44 2fvt h ILE 111 N 0.00 1.38 0.00 2.57 2.04 -0.92 -3.37 117.51 119.21 2fvt h ILE 111 Ca 0.02 -1.84 -0.01 0.00 1.00 0.00 0.00 64.86 64.03 2fvt h ILE 111 Cb 0.08 2.52 -0.00 0.00 -0.74 0.00 0.00 36.82 38.68 2fvt h ILE 111 CO -0.00 0.44 -0.03 0.24 0.00 0.00 0.00 178.15 178.79 2fvt h MET 112 N -0.91 0.00 -0.40 2.37 2.86 -0.80 -2.81 114.93 115.24 2fvt h MET 112 Ca -0.00 0.00 -0.05 0.00 -2.06 0.00 0.00 59.70 57.59 2fvt h MET 112 Cb 0.74 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.38 2fvt h MET 112 CO 0.01 0.03 0.04 0.97 1.06 0.00 0.00 176.91 179.02 2fvt h ILE 113 N 0.00 1.21 0.00 -1.22 6.09 -0.74 -1.24 117.51 121.61 2fvt h ILE 113 Ca -0.00 -0.80 -0.08 0.00 -1.37 0.00 0.00 64.86 62.61 2fvt h ILE 113 Cb 0.90 0.86 -0.01 0.00 0.47 0.00 0.00 36.82 39.05 2fvt h ILE 113 CO 0.00 0.28 -0.96 1.23 -3.07 0.00 0.00 178.15 175.64 2fvt h GLY 114 N 0.87 0.00 0.00 8.18 0.00 -1.69 -2.99 103.07 107.44 2fvt h GLY 114 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.46 2fvt h GLY 114 CO 0.01 0.00 0.00 -2.21 0.00 0.00 0.00 176.54 174.34 2fvt n GLU 115 N -2.90 0.00 -0.08 4.80 0.00 -0.89 -4.59 120.64 116.99 2fvt n GLU 115 Ca -0.03 0.47 -0.06 0.00 0.00 0.00 0.00 57.16 57.54 2fvt n GLU 115 Cb 0.69 -1.17 -0.16 0.00 0.00 0.00 0.00 31.44 30.80 2fvt n GLU 115 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.13 180.02 2fvt n ARG 116 N -1.91 0.68 -0.82 5.31 1.85 -0.52 -4.97 116.66 116.28 2fvt n ARG 116 Ca 0.00 -0.02 0.00 0.00 -1.00 0.00 0.00 57.85 56.83 2fvt n ARG 116 Cb 0.00 -1.54 0.00 0.00 -1.05 0.00 0.00 32.46 29.87 2fvt n ARG 116 CO 0.00 0.00 0.00 0.54 -0.01 0.00 0.00 177.63 178.16 2fvt n ARG 117 N -2.68 -0.61 -0.81 2.89 3.00 -1.12 -4.81 116.66 112.53 2fvt n ARG 117 Ca -0.26 0.15 -0.04 0.00 -0.01 0.00 0.00 57.85 57.69 2fvt n ARG 117 Cb 1.04 -4.07 0.23 0.00 0.00 0.00 0.00 32.46 29.66 2fvt n ARG 117 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.63 178.17 2fvt n ARG 118 N -1.24 2.46 -4.18 5.56 1.74 -1.26 -4.84 116.66 114.90 2fvt n ARG 118 Ca 0.00 -3.06 -0.34 0.00 -0.77 0.00 0.00 57.85 53.67 2fvt n ARG 118 Cb 0.15 -1.94 -0.10 0.00 -1.02 0.00 0.00 32.46 29.55 2fvt n ARG 118 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 2fvt s VAL 119 N -3.11 4.49 -0.07 1.55 0.11 -1.26 0.14 120.40 122.25 2fvt s VAL 119 Ca 0.47 -0.15 0.03 0.00 -2.93 0.00 0.00 61.98 59.41 2fvt s VAL 119 Cb 0.41 -2.98 -0.02 0.00 -1.53 0.00 0.00 36.38 32.26 2fvt s VAL 119 CO 0.06 0.51 -0.17 0.00 -3.33 0.00 0.00 175.10 172.16 2fvt s ALA 120 N 0.05 2.51 -0.23 1.54 0.00 0.43 -4.62 121.76 121.44 2fvt s ALA 120 Ca 0.04 -0.98 -0.02 0.00 0.00 0.00 0.00 51.96 50.99 2fvt s ALA 120 Cb -0.13 -0.94 0.01 0.00 0.00 0.00 0.00 23.12 22.07 2fvt s ALA 120 CO 0.01 0.44 -0.08 0.00 0.00 0.00 0.00 175.76 176.14 2fvt s ALA 121 N -0.30 2.69 -0.60 0.00 0.00 -0.69 -0.79 121.76 122.06 2fvt s ALA 121 Ca 0.02 -1.29 -0.11 0.00 0.00 0.00 0.00 51.96 50.57 2fvt s ALA 121 Cb -0.13 -1.61 0.15 0.00 0.00 0.00 0.00 23.12 21.53 2fvt s ALA 121 CO 0.03 -0.57 0.51 0.00 0.00 0.00 0.00 175.76 175.72 2fvt s ALA 122 N 1.39 3.66 -0.18 0.00 0.00 0.11 -0.25 121.76 126.49 2fvt s ALA 122 Ca 0.04 -2.84 -0.04 0.00 0.00 0.00 0.00 51.96 49.11 2fvt s ALA 122 Cb -0.15 -3.09 -0.02 0.00 0.00 0.00 0.00 23.12 19.85 2fvt s ALA 122 CO -0.05 -2.06 -0.02 -0.51 0.00 0.00 0.00 175.76 173.12 2fvt s LEU 123 N 0.91 3.21 -0.11 0.00 1.43 -0.66 -0.59 118.68 122.88 2fvt s LEU 123 Ca 0.10 -0.19 -0.06 0.00 -1.03 0.00 0.00 54.13 52.95 2fvt s LEU 123 Cb -0.22 -1.80 -0.04 0.00 0.03 0.00 0.00 46.19 44.16 2fvt s LEU 123 CO -0.02 0.10 0.11 -0.63 0.23 0.00 0.00 176.35 176.13 2fvt s ILE 124 N 0.80 5.25 0.51 -0.59 1.01 -0.41 -0.72 121.20 127.05 2fvt s ILE 124 Ca -0.00 0.09 -0.19 0.00 0.00 0.00 0.00 60.65 60.55 2fvt s ILE 124 Cb -0.14 -3.28 -0.08 0.00 0.01 0.00 0.00 42.46 38.97 2fvt s ILE 124 CO 0.02 0.60 1.02 0.00 0.00 0.00 0.00 174.94 176.58 2fvt s ALA 125 N -1.01 2.89 0.25 9.38 0.00 0.71 -3.74 121.76 130.24 2fvt s ALA 125 Ca 0.15 0.47 -0.30 0.00 0.00 0.00 0.00 51.96 52.28 2fvt s ALA 125 Cb -0.12 -3.21 -0.10 0.00 0.00 0.00 0.00 23.12 19.69 2fvt s ALA 125 CO 0.04 -0.35 1.40 0.14 0.00 0.00 0.00 175.76 176.99 2fvt s VAL 126 N -2.21 2.76 -1.22 0.00 -7.23 -1.26 -4.85 120.40 106.40 2fvt s VAL 126 Ca 0.64 0.65 -0.21 0.00 -1.81 0.00 0.00 61.98 61.26 2fvt s VAL 126 Cb -0.14 -3.42 -0.03 0.00 0.56 0.00 0.00 36.38 33.35 2fvt s VAL 126 CO 0.24 0.11 1.86 -2.84 -0.31 0.00 0.00 175.10 174.16 2fvt s PRO 127 N -0.51 3.04 0.42 4.82 0.02 -1.26 -4.74 135.00 136.79 2fvt s PRO 127 Ca 0.58 -1.44 0.29 0.00 0.02 0.00 0.00 61.00 60.45 2fvt s PRO 127 Cb -0.41 -5.35 1.31 0.00 0.02 0.00 0.00 34.50 30.07 2fvt s PRO 127 CO 0.44 -3.33 1.88 1.25 -0.33 0.00 0.00 177.00 176.90 2fvt h LEU 128 N 15.84 0.00 -1.42 -5.54 5.85 -1.97 -1.09 115.31 126.98 2fvt h LEU 128 Ca 0.30 0.00 0.00 0.00 0.84 0.00 0.00 57.88 59.02 2fvt h LEU 128 Cb 0.92 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.95 2fvt h LEU 128 CO 1.31 0.00 0.00 -1.84 -0.34 0.00 0.00 178.44 177.57 2fvt n GLU 129 N -2.63 1.93 -1.75 1.25 -0.00 -1.26 -4.92 120.64 113.25 2fvt n GLU 129 Ca 0.01 -1.40 -0.07 0.00 -0.00 0.00 0.00 57.16 55.69 2fvt n GLU 129 Cb 0.21 -1.41 -0.02 0.00 -0.00 0.00 0.00 31.44 30.23 2fvt n GLU 129 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.13 174.74 2fvt n HIS 130 N 0.63 -1.09 -3.13 -1.84 1.44 -0.41 -4.87 115.22 105.95 2fvt n HIS 130 Ca 0.16 0.00 -0.43 0.00 -2.01 0.00 0.00 57.72 55.44 2fvt n HIS 130 Cb 0.39 -1.93 -0.06 0.00 0.12 0.00 0.00 29.99 28.51 2fvt n HIS 130 CO 0.00 0.00 0.00 -1.58 -2.81 0.00 0.00 176.34 171.95 2fvt s HIS 131 N -1.93 3.04 0.00 -1.40 5.04 -1.26 -4.75 115.29 114.03 2fvt s HIS 131 Ca 0.00 -0.32 0.00 0.00 -1.54 0.00 0.00 55.06 53.20 2fvt s HIS 131 Cb 0.00 -3.47 0.00 0.00 0.04 0.00 0.00 32.58 29.15 2fvt s HIS 131 CO 0.00 -0.98 0.16 -2.39 -2.34 0.00 0.00 174.74 169.19 2fvt n HIS 132 N 6.26 0.00 -0.72 3.88 1.44 -1.26 -5.08 115.22 119.74 2fvt n HIS 132 Ca -0.04 0.00 0.10 0.00 -2.01 0.00 0.00 57.72 55.76 2fvt n HIS 132 Cb 0.46 0.00 -0.03 0.00 0.12 0.00 0.00 29.99 30.55 2fvt n HIS 132 CO 0.00 0.00 0.00 0.72 -2.81 0.00 0.00 176.34 174.25 2fvt n HIS 133 N -0.23 -1.84 -3.63 -1.40 8.25 -1.26 -5.04 115.22 110.07 2fvt n HIS 133 Ca 0.00 0.93 -0.09 0.00 -0.26 0.00 0.00 57.72 58.30 2fvt n HIS 133 Cb 0.07 -1.67 -0.07 0.00 1.12 0.00 0.00 29.99 29.44 2fvt n HIS 133 CO 0.00 0.00 0.00 -1.58 0.64 0.00 0.00 176.34 175.40 2fvt s HIS 134 N -1.96 -0.46 -0.13 4.41 2.46 -1.26 -5.28 115.29 113.08 2fvt s HIS 134 Ca 0.00 1.09 0.01 0.00 0.47 0.00 0.00 55.06 56.63 2fvt s HIS 134 Cb 0.00 0.37 0.01 0.00 -0.13 0.00 0.00 32.58 32.83 2fvt s HIS 134 CO 0.00 -0.24 0.53 -2.39 -2.47 0.00 0.00 174.74 170.18