#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fvt h ALA 2 N 0.00 -0.00 -3.43 3.04 0.00 -2.13 -3.45 119.26 113.29 2fvt h ALA 2 Ca 0.00 -0.00 -0.66 0.00 0.00 0.00 0.00 54.91 54.25 2fvt h ALA 2 Cb 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 17.79 17.43 2fvt h ALA 2 CO 0.00 -0.00 -0.83 -1.14 0.00 0.00 0.00 179.25 177.28 2fvt s GLN 3 N -1.20 2.50 -0.84 0.00 2.00 -1.26 -5.05 119.66 115.81 2fvt s GLN 3 Ca -0.00 -1.01 -0.25 0.00 -2.00 0.00 0.00 55.36 52.10 2fvt s GLN 3 Cb 0.00 -2.64 -0.04 0.00 0.80 0.00 0.00 33.01 31.13 2fvt s GLN 3 CO 0.00 -0.39 1.89 0.50 -0.50 0.00 0.00 175.29 176.80 2fvt s ARG 4 N 1.25 2.63 -0.82 1.67 3.52 -1.26 -4.86 118.95 121.08 2fvt s ARG 4 Ca -0.01 -0.12 -0.01 0.00 -0.13 0.00 0.00 55.73 55.46 2fvt s ARG 4 Cb -0.16 -4.91 0.20 0.00 -1.56 0.00 0.00 34.95 28.52 2fvt s ARG 4 CO -0.09 -3.15 0.68 -1.12 -0.81 0.00 0.00 175.30 170.80 2fvt s SER 5 N 7.84 5.69 0.02 -2.12 0.01 -1.26 -4.86 113.70 119.02 2fvt s SER 5 Ca 0.68 -3.59 0.22 0.00 1.31 0.00 0.00 55.95 54.57 2fvt s SER 5 Cb -0.08 -1.86 -0.17 0.00 0.21 0.00 0.00 66.02 64.12 2fvt s SER 5 CO 0.04 -0.20 0.78 1.21 0.41 0.00 0.00 173.24 175.48 2fvt n GLU 6 N 2.49 0.41 0.29 12.44 2.13 -1.26 -4.46 120.64 132.67 2fvt n GLU 6 Ca 0.19 -0.07 -0.17 0.00 0.66 0.00 0.00 57.16 57.76 2fvt n GLU 6 Cb 0.37 -1.57 -0.09 0.00 0.27 0.00 0.00 31.44 30.42 2fvt n GLU 6 CO 0.00 0.00 0.00 0.82 -0.41 0.00 0.00 177.13 177.54 2fvt h ILE 7 N 0.00 0.00 -3.08 6.31 1.08 -2.02 -3.34 117.51 116.46 2fvt h ILE 7 Ca 0.00 0.00 -0.73 0.00 -0.39 0.00 0.00 64.86 63.74 2fvt h ILE 7 Cb 0.82 0.00 -0.21 0.00 -3.07 0.00 0.00 36.82 34.35 2fvt h ILE 7 CO 0.00 0.00 0.22 -2.16 -0.69 0.00 0.00 178.15 175.52 2fvt s PRO 8 N -5.66 3.30 0.20 2.37 0.04 -1.26 -4.86 135.00 129.13 2fvt s PRO 8 Ca -0.17 -1.76 -0.09 0.00 0.04 0.00 0.00 61.00 59.02 2fvt s PRO 8 Cb 0.04 -4.44 0.11 0.00 0.04 0.00 0.00 34.50 30.25 2fvt s PRO 8 CO 0.56 -1.50 1.72 0.45 0.04 0.00 0.00 177.00 178.27 2fvt h HIS 9 N 8.70 1.15 -3.30 0.56 3.86 -1.86 -3.39 115.15 120.87 2fvt h HIS 9 Ca -0.09 -0.12 -0.56 0.00 -1.16 0.00 0.00 60.37 58.43 2fvt h HIS 9 Cb 1.06 -0.33 -0.34 0.00 1.06 0.00 0.00 27.41 28.86 2fvt h HIS 9 CO 0.95 0.92 -0.83 -0.06 0.86 0.00 0.00 177.93 179.77 2fvt s PHE 10 N -5.38 1.79 -0.62 2.45 0.40 -1.25 -5.05 117.98 110.32 2fvt s PHE 10 Ca -0.12 -0.80 -0.05 0.00 -0.60 0.00 0.00 56.93 55.36 2fvt s PHE 10 Cb 0.14 -1.31 -0.08 0.00 0.51 0.00 0.00 43.02 42.28 2fvt s PHE 10 CO 0.84 -0.42 2.15 -2.30 0.70 0.00 0.00 175.22 176.19 2fvt n PRO 11 N 4.14 1.78 -3.57 0.24 -0.02 -1.26 -3.98 135.00 132.33 2fvt n PRO 11 Ca -0.19 -1.17 -0.22 0.00 -2.02 0.00 0.00 63.50 59.90 2fvt n PRO 11 Cb 0.51 -2.24 0.02 0.00 -0.02 0.00 0.00 33.50 31.77 2fvt n PRO 11 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2fvt n ARG 12 N 3.73 -1.31 -2.97 -0.52 1.74 -1.26 -4.90 116.66 111.17 2fvt n ARG 12 Ca 0.38 0.82 -0.43 0.00 -0.77 0.00 0.00 57.85 57.84 2fvt n ARG 12 Cb 0.25 -3.89 -0.05 0.00 -1.02 0.00 0.00 32.46 27.76 2fvt n ARG 12 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 2fvt s THR 13 N -3.19 4.57 -1.23 0.55 2.01 -1.26 -4.81 115.64 112.27 2fvt s THR 13 Ca 0.20 -0.29 0.15 0.00 0.31 0.00 0.00 61.69 62.06 2fvt s THR 13 Cb -0.07 -4.50 0.45 0.00 0.01 0.00 0.00 72.50 68.38 2fvt s THR 13 CO 0.85 -1.12 1.37 0.00 -0.69 0.00 0.00 174.62 175.03 2fvt n ALA 14 N 7.01 2.32 -4.03 7.40 0.00 -1.26 -4.86 120.51 127.10 2fvt n ALA 14 Ca -0.04 -1.27 -0.31 0.00 0.00 0.00 0.00 53.44 51.82 2fvt n ALA 14 Cb 0.46 -0.63 -0.15 0.00 0.00 0.00 0.00 19.45 19.12 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 -1.12 2.66 -0.17 0.00 0.00 -1.26 -4.76 121.76 117.11 2fvt s ALA 15 Ca 0.34 -2.11 -0.09 0.00 0.00 0.00 0.00 51.96 50.10 2fvt s ALA 15 Cb 0.18 -1.76 -0.05 0.00 0.00 0.00 0.00 23.12 21.50 2fvt s ALA 15 CO 0.21 -1.45 0.14 0.42 0.00 0.00 0.00 175.76 175.08 2fvt s ILE 16 N 1.04 5.45 -0.18 0.00 1.01 -1.26 -4.02 121.20 123.24 2fvt s ILE 16 Ca 0.01 0.20 0.05 0.00 0.00 0.00 0.00 60.65 60.92 2fvt s ILE 16 Cb -0.19 -3.45 -0.22 0.00 0.01 0.00 0.00 42.46 38.61 2fvt s ILE 16 CO -0.07 0.51 0.11 0.47 0.00 0.00 0.00 174.94 175.96 2fvt n ASP 17 N 2.91 1.41 -3.70 3.58 9.92 0.26 -4.94 116.55 126.00 2fvt n ASP 17 Ca -0.18 0.05 -0.17 0.00 -0.53 0.00 0.00 54.79 53.97 2fvt n ASP 17 Cb 0.53 -0.15 -0.16 0.00 -0.64 0.00 0.00 41.12 40.70 2fvt n ASP 17 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2fvt s ALA 18 N -2.53 -0.06 -0.25 2.24 0.00 -0.96 -4.99 121.76 115.21 2fvt s ALA 18 Ca -0.22 0.46 -0.07 0.00 0.00 0.00 0.00 51.96 52.13 2fvt s ALA 18 Cb 0.08 -0.61 -0.03 0.00 0.00 0.00 0.00 23.12 22.55 2fvt s ALA 18 CO 0.72 -0.39 0.07 1.52 0.00 0.00 0.00 175.76 177.69 2fvt s TYR 19 N 1.85 3.09 0.00 0.00 1.13 -1.26 -0.71 117.35 121.45 2fvt s TYR 19 Ca -0.01 -0.39 0.00 0.00 -1.41 0.00 0.00 57.07 55.26 2fvt s TYR 19 Cb -0.12 -2.24 0.00 0.00 -1.10 0.00 0.00 41.96 38.50 2fvt s TYR 19 CO -0.05 -0.34 0.00 0.41 -2.51 0.00 0.00 175.55 173.06 2fvt n GLY 20 N 4.90 -0.24 5.00 5.49 0.00 0.79 -4.92 105.19 116.21 2fvt n GLY 20 Ca -0.16 -1.67 0.00 0.00 0.00 0.00 0.00 46.02 44.19 2fvt n GLY 20 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2fvt n LYS 21 N 0.00 0.00 0.00 1.61 4.81 -1.26 -1.03 118.16 122.29 2fvt n LYS 21 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.44 2fvt n LYS 21 Cb 0.00 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.05 2fvt n LYS 21 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2fvt n GLY 22 N 0.00 -2.10 0.00 3.14 0.00 -1.26 -5.03 105.19 99.94 2fvt n GLY 22 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 0.00 1.07 3.00 -0.02 0.00 -0.20 -3.58 105.19 105.47 2fvt n GLY 23 Ca 0.00 -0.68 -0.26 0.00 0.00 0.00 0.00 46.02 45.08 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 1.57 -0.39 1.61 0.08 -0.75 -0.15 117.98 119.96 2fvt s PHE 24 Ca 0.00 -0.66 -0.04 0.00 0.12 0.00 0.00 56.93 56.34 2fvt s PHE 24 Cb 0.00 -1.18 0.09 0.00 -0.57 0.00 0.00 43.02 41.36 2fvt s PHE 24 CO 0.00 -0.37 0.18 -0.47 -0.10 0.00 0.00 175.22 174.46 2fvt s TYR 25 N 0.96 3.45 0.49 0.36 6.14 0.11 -0.43 117.35 128.43 2fvt s TYR 25 Ca -0.09 -2.06 0.02 0.00 0.64 0.00 0.00 57.07 55.58 2fvt s TYR 25 Cb -0.15 -2.92 -0.02 0.00 0.42 0.00 0.00 41.96 39.29 2fvt s TYR 25 CO 0.00 -0.90 0.01 -0.59 0.64 0.00 0.00 175.55 174.70 2fvt s PHE 26 N 1.24 1.96 -0.64 4.97 -0.71 -1.26 -0.57 117.98 122.97 2fvt s PHE 26 Ca 0.04 -0.92 -0.30 0.00 -1.04 0.00 0.00 56.93 54.71 2fvt s PHE 26 Cb -0.22 -1.63 -0.13 0.00 -1.21 0.00 0.00 43.02 39.83 2fvt s PHE 26 CO -0.02 0.25 2.47 0.00 -1.34 0.00 0.00 175.22 176.58 2fvt n ALA 27 N -1.21 0.67 0.00 1.99 0.00 -1.26 -3.62 120.51 117.08 2fvt n ALA 27 Ca -0.17 -0.50 0.00 0.00 0.00 0.00 0.00 53.44 52.77 2fvt n ALA 27 Cb 0.67 -2.72 0.00 0.00 0.00 0.00 0.00 19.45 17.40 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 6.32 0.52 3.21 0.00 0.00 -1.26 -5.01 105.19 108.97 2fvt n GLY 28 Ca 0.48 -0.23 -0.10 0.00 0.00 0.00 0.00 46.02 46.17 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 0.81 0.08 1.61 -2.45 -1.24 -5.13 119.30 112.98 2fvt s MET 29 Ca 0.00 -0.78 -0.31 0.00 -1.25 0.00 0.00 55.69 53.35 2fvt s MET 29 Cb 0.00 0.34 -0.08 0.00 1.25 0.00 0.00 34.83 36.34 2fvt s MET 29 CO 0.00 -0.26 1.55 -1.54 1.05 0.00 0.00 175.02 175.83 2fvt s SER 30 N -2.51 6.68 -0.15 1.11 1.04 -1.26 -4.34 113.70 114.27 2fvt s SER 30 Ca 0.00 2.41 -0.04 0.00 0.48 0.00 0.00 55.95 58.80 2fvt s SER 30 Cb 0.02 -2.57 0.06 0.00 0.10 0.00 0.00 66.02 63.63 2fvt s SER 30 CO -0.08 -0.81 0.11 -2.28 0.98 0.00 0.00 173.24 171.16 2fvt s HIS 31 N 2.13 0.08 0.92 5.02 5.04 0.42 -4.91 115.29 123.99 2fvt s HIS 31 Ca 0.70 -0.08 -0.12 0.00 -1.54 0.00 0.00 55.06 54.02 2fvt s HIS 31 Cb -0.38 -0.58 0.14 0.00 0.04 0.00 0.00 32.58 31.80 2fvt s HIS 31 CO 0.31 -0.45 1.10 1.14 -2.34 0.00 0.00 174.74 174.49 2fvt s GLN 32 N 2.18 1.09 0.00 2.88 -2.07 -1.24 -1.80 119.66 120.70 2fvt s GLN 32 Ca 0.03 0.67 0.00 0.00 -1.82 0.00 0.00 55.36 54.25 2fvt s GLN 32 Cb -0.15 -1.80 0.00 0.00 -1.09 0.00 0.00 33.01 29.97 2fvt s GLN 32 CO -0.08 -2.32 0.00 0.41 -1.32 0.00 0.00 175.29 171.98 2fvt n GLY 33 N -1.30 0.26 3.21 2.60 0.00 -1.26 -4.86 105.19 103.84 2fvt n GLY 33 Ca 0.06 -1.44 -0.11 0.00 0.00 0.00 0.00 46.02 44.53 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 -0.02 0.06 1.61 1.04 -1.25 -0.47 113.70 110.68 2fvt s SER 34 Ca 0.00 -0.34 0.03 0.00 0.48 0.00 0.00 55.95 56.12 2fvt s SER 34 Cb 0.00 0.32 -0.03 0.00 0.10 0.00 0.00 66.02 66.41 2fvt s SER 34 CO 0.00 -0.60 -0.09 -0.76 0.98 0.00 0.00 173.24 172.77 2fvt s LEU 35 N -2.18 2.30 -0.40 2.42 1.43 -0.52 -1.52 118.68 120.21 2fvt s LEU 35 Ca -0.04 -0.64 -0.05 0.00 -1.03 0.00 0.00 54.13 52.38 2fvt s LEU 35 Cb -0.00 -0.21 0.10 0.00 0.03 0.00 0.00 46.19 46.11 2fvt s LEU 35 CO -0.05 -0.22 0.21 -0.76 0.23 0.00 0.00 176.35 175.75 2fvt s LEU 36 N -1.85 5.12 -0.72 1.79 1.43 0.12 -1.95 118.68 122.62 2fvt s LEU 36 Ca -0.05 -1.83 -0.19 0.00 -1.03 0.00 0.00 54.13 51.02 2fvt s LEU 36 Cb -0.08 -1.86 0.11 0.00 0.03 0.00 0.00 46.19 44.39 2fvt s LEU 36 CO -0.00 -0.53 0.90 -0.36 0.23 0.00 0.00 176.35 176.59 2fvt s PHE 37 N 1.23 3.00 0.58 0.29 0.40 0.08 -0.12 117.98 123.44 2fvt s PHE 37 Ca 0.05 -1.05 -0.07 0.00 -0.60 0.00 0.00 56.93 55.27 2fvt s PHE 37 Cb -0.23 -4.15 -0.01 0.00 0.51 0.00 0.00 43.02 39.14 2fvt s PHE 37 CO -0.02 -1.43 0.91 -0.51 0.70 0.00 0.00 175.22 174.87 2fvt s LEU 38 N 2.87 3.31 0.07 -0.37 1.43 -0.64 -0.09 118.68 125.27 2fvt s LEU 38 Ca 0.21 0.95 0.11 0.00 -1.03 0.00 0.00 54.13 54.37 2fvt s LEU 38 Cb -0.16 -3.85 0.50 0.00 0.03 0.00 0.00 46.19 42.71 2fvt s LEU 38 CO 0.02 -0.92 1.34 -0.81 0.23 0.00 0.00 176.35 176.21 2fvt n PRO 39 N -2.57 0.04 -0.02 1.29 -0.04 -1.10 -3.60 135.00 129.00 2fvt n PRO 39 Ca 0.04 0.42 -0.07 0.00 -0.04 0.00 0.00 63.50 63.85 2fvt n PRO 39 Cb 0.56 -1.61 -0.02 0.00 -0.04 0.00 0.00 33.50 32.39 2fvt n PRO 39 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 2fvt n ASP 40 N -1.69 0.99 -4.20 3.54 2.03 -1.26 -4.77 116.55 111.18 2fvt n ASP 40 Ca 0.01 0.15 -0.12 0.00 0.52 0.00 0.00 54.79 55.36 2fvt n ASP 40 Cb 0.10 -0.36 -0.10 0.00 -0.72 0.00 0.00 41.12 40.03 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 -2.23 1.17 -0.07 -1.67 0.00 -1.24 -4.74 121.76 112.98 2fvt s ALA 41 Ca -0.11 -1.62 -0.04 0.00 0.00 0.00 0.00 51.96 50.19 2fvt s ALA 41 Cb 0.03 1.00 -0.04 0.00 0.00 0.00 0.00 23.12 24.11 2fvt s ALA 41 CO 0.15 -0.49 0.11 0.08 0.00 0.00 0.00 175.76 175.62 2fvt s VAL 42 N -3.97 5.14 0.21 0.00 1.01 -1.26 -1.62 120.40 119.92 2fvt s VAL 42 Ca 0.31 -0.05 0.03 0.00 0.00 0.00 0.00 61.98 62.27 2fvt s VAL 42 Cb 0.07 -3.28 -0.05 0.00 0.00 0.00 0.00 36.38 33.12 2fvt s VAL 42 CO 0.07 0.51 -0.01 0.26 0.00 0.00 0.00 175.10 175.93 2fvt s TRP 43 N -1.09 1.47 0.12 5.22 0.52 0.84 -3.79 118.94 122.23 2fvt s TRP 43 Ca 0.18 -0.92 -0.09 0.00 0.02 0.00 0.00 56.10 55.29 2fvt s TRP 43 Cb -0.12 -0.84 -0.06 0.00 -1.15 0.00 0.00 33.47 31.30 2fvt s TRP 43 CO 0.08 -0.05 0.44 0.20 0.02 0.00 0.00 176.95 177.63 2fvt s GLY 44 N -3.27 2.32 0.16 0.98 0.00 -1.26 0.14 107.32 106.39 2fvt s GLY 44 Ca 0.26 -0.37 0.07 0.00 0.00 0.00 0.00 44.72 44.68 2fvt s GLY 44 CO 0.07 -0.19 -0.04 0.86 0.00 0.00 0.00 173.10 173.80 2fvt s TRP 45 N -1.53 2.79 -0.22 1.90 -0.00 -0.58 -4.65 118.94 116.67 2fvt s TRP 45 Ca 0.37 -0.15 0.16 0.00 -0.00 0.00 0.00 56.10 56.48 2fvt s TRP 45 Cb -0.13 -1.38 0.65 0.00 -0.00 0.00 0.00 33.47 32.61 2fvt s TRP 45 CO 0.20 0.50 1.56 -3.47 -0.00 0.00 0.00 176.95 175.74 2fvt n ASP 46 N 0.11 4.66 -4.81 5.86 2.03 -1.26 -4.23 116.55 118.90 2fvt n ASP 46 Ca -0.11 -2.98 -0.36 0.00 0.52 0.00 0.00 54.79 51.87 2fvt n ASP 46 Cb 0.54 -0.60 -0.07 0.00 -0.72 0.00 0.00 41.12 40.27 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 -2.79 5.45 -0.09 5.18 1.01 -1.26 -4.97 120.40 122.93 2fvt s VAL 47 Ca 0.47 0.23 -0.01 0.00 0.00 0.00 0.00 61.98 62.68 2fvt s VAL 47 Cb 0.37 -3.45 -0.05 0.00 0.00 0.00 0.00 36.38 33.26 2fvt s VAL 47 CO 0.12 0.54 -0.09 0.41 0.00 0.00 0.00 175.10 176.08 2fvt n THR 48 N 2.66 0.49 -3.89 3.92 -1.04 -1.26 -3.78 114.28 111.38 2fvt n THR 48 Ca -0.18 -0.16 -0.35 0.00 -2.04 0.00 0.00 64.05 61.31 2fvt n THR 48 Cb 0.54 -1.11 -0.05 0.00 -1.82 0.00 0.00 70.33 67.88 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 -2.17 3.44 0.53 -2.82 1.02 -1.26 -4.92 119.74 113.56 2fvt s LYS 49 Ca -0.12 -0.20 0.22 0.00 0.02 0.00 0.00 55.97 55.88 2fvt s LYS 49 Cb 0.04 -3.15 1.36 0.00 -0.52 0.00 0.00 37.83 35.56 2fvt s LYS 49 CO 0.18 0.74 2.07 -1.35 -0.92 0.00 0.00 175.35 176.07 2fvt h PRO 50 N 4.50 0.00 0.00 -1.68 0.11 -1.96 0.50 132.00 133.47 2fvt h PRO 50 Ca -0.52 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.56 2fvt h PRO 50 Cb 1.21 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.32 2fvt h PRO 50 CO 0.63 0.00 -0.10 0.93 -0.21 0.00 0.00 178.00 179.24 2fvt h GLU 51 N 0.00 0.00 -0.03 1.05 5.08 -2.00 -2.68 114.58 116.01 2fvt h GLU 51 Ca 0.14 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.50 2fvt h GLU 51 Cb 0.55 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.80 2fvt h GLU 51 CO -0.00 0.10 0.00 1.04 -1.00 0.00 0.00 179.01 179.15 2fvt n GLN 52 N -3.64 1.14 -2.22 2.33 6.02 0.17 -4.63 117.38 116.54 2fvt n GLN 52 Ca -0.02 -0.21 -0.36 0.00 -0.01 0.00 0.00 57.00 56.41 2fvt n GLN 52 Cb 0.22 -1.31 -0.04 0.00 1.02 0.00 0.00 30.24 30.14 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 -1.96 3.54 0.30 5.09 1.01 -1.01 -4.74 121.20 123.43 2fvt s ILE 53 Ca 0.28 -0.07 0.08 0.00 0.00 0.00 0.00 60.65 60.95 2fvt s ILE 53 Cb 0.14 -4.33 -0.06 0.00 0.01 0.00 0.00 42.46 38.22 2fvt s ILE 53 CO 0.22 -1.27 -0.09 -0.62 0.00 0.00 0.00 174.94 173.18 2fvt s ASP 54 N 6.74 3.19 0.40 3.58 -1.08 -1.26 -5.00 116.67 123.24 2fvt s ASP 54 Ca 0.58 -1.16 0.09 0.00 -0.52 0.00 0.00 52.55 51.54 2fvt s ASP 54 Cb -0.08 -0.25 0.87 0.00 -1.46 0.00 0.00 42.92 42.01 2fvt s ASP 54 CO 0.09 -0.24 2.01 -0.09 0.52 0.00 0.00 175.17 177.46 2fvt h ARG 55 N 2.20 0.56 0.00 4.34 2.43 -1.95 0.68 114.38 122.65 2fvt h ARG 55 Ca -0.41 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 58.73 2fvt h ARG 55 Cb 1.24 -0.13 0.00 0.00 -0.42 0.00 0.00 29.97 30.67 2fvt h ARG 55 CO 0.67 0.37 -0.48 0.66 -1.51 0.00 0.00 179.97 179.67 2fvt n TYR 56 N -4.47 0.61 0.09 2.20 4.01 -1.26 -2.84 117.16 115.49 2fvt n TYR 56 Ca 0.07 0.18 -0.04 0.00 -0.16 0.00 0.00 57.90 57.95 2fvt n TYR 56 Cb 0.19 -0.70 -0.05 0.00 -0.31 0.00 0.00 39.34 38.47 2fvt n TYR 56 CO 0.00 0.00 0.00 0.77 -0.46 0.00 0.00 176.86 177.17 2fvt h SER 57 N 0.00 0.00 -0.47 7.72 0.02 -1.45 -3.08 113.55 116.29 2fvt h SER 57 Ca 0.00 0.00 -0.14 0.00 -0.84 0.00 0.00 61.79 60.81 2fvt h SER 57 Cb 0.73 0.00 -0.08 0.00 0.14 0.00 0.00 62.40 63.19 2fvt h SER 57 CO 0.00 0.83 0.18 0.18 -1.14 0.00 0.00 176.83 176.87 2fvt n LEU 58 N -3.35 4.53 -0.13 5.07 4.77 0.09 -4.58 117.00 123.39 2fvt n LEU 58 Ca 0.00 -2.34 -0.04 0.00 -0.03 0.00 0.00 56.01 53.60 2fvt n LEU 58 Cb 0.85 -0.66 0.04 0.00 -2.33 0.00 0.00 43.42 41.33 2fvt n LEU 58 CO 0.45 0.64 0.91 -0.61 -1.33 0.00 0.00 177.39 177.44 2fvt h GLN 59 N 1.65 0.22 0.00 3.23 4.15 -1.44 0.10 115.11 123.03 2fvt h GLN 59 Ca 0.17 -0.01 -0.01 0.00 0.77 0.00 0.00 58.65 59.57 2fvt h GLN 59 Cb 1.74 -0.05 -0.00 0.00 0.21 0.00 0.00 27.48 29.38 2fvt h GLN 59 CO 0.47 0.15 -0.06 -0.09 -1.93 0.00 0.00 178.83 177.37 2fvt h ARG 60 N 0.23 0.00 -0.15 1.69 2.43 -1.87 -1.30 114.38 115.41 2fvt h ARG 60 Ca 0.21 0.00 -0.21 0.00 -0.81 0.00 0.00 59.98 59.17 2fvt h ARG 60 Cb 0.25 0.00 0.01 0.00 -0.42 0.00 0.00 29.97 29.80 2fvt h ARG 60 CO -0.26 0.06 -0.74 0.28 -1.51 0.00 0.00 179.97 177.79 2fvt h VAL 61 N 0.00 1.30 0.00 0.20 2.07 -1.20 -2.64 116.25 115.98 2fvt h VAL 61 Ca -0.00 -1.97 -0.03 0.00 0.82 0.00 0.00 66.70 65.51 2fvt h VAL 61 Cb 0.61 1.96 -0.00 0.00 -1.52 0.00 0.00 31.29 32.34 2fvt h VAL 61 CO 0.01 0.62 -0.17 -0.26 0.02 0.00 0.00 177.57 177.79 2fvt h PHE 62 N 0.50 0.00 -0.06 1.57 0.04 -0.63 -1.38 116.94 116.97 2fvt h PHE 62 Ca -0.04 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.72 2fvt h PHE 62 Cb 1.35 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 39.50 2fvt h PHE 62 CO 0.08 0.17 0.02 0.22 -0.60 0.00 0.00 178.31 178.19 2fvt h ASP 63 N 0.00 0.09 -1.05 2.17 1.82 -1.08 -2.89 116.42 115.49 2fvt h ASP 63 Ca -0.00 -0.22 -0.68 0.00 -0.39 0.00 0.00 57.03 55.74 2fvt h ASP 63 Cb 0.89 -0.02 -0.30 0.00 0.68 0.00 0.00 39.33 40.58 2fvt h ASP 63 CO 0.02 0.29 0.81 0.59 -1.61 0.00 0.00 179.24 179.34 2fvt n ASN 64 N -4.92 7.58 -0.08 2.28 4.13 -1.01 -4.85 115.26 118.40 2fvt n ASN 64 Ca -0.07 -3.79 -0.13 0.00 1.68 0.00 0.00 54.58 52.27 2fvt n ASN 64 Cb 0.14 -0.96 -0.09 0.00 -1.54 0.00 0.00 39.78 37.33 2fvt n ASN 64 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2fvt h ALA 65 N 2.07 -0.80 -0.06 5.41 0.00 -1.02 -0.45 119.26 124.40 2fvt h ALA 65 Ca 0.60 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.48 2fvt h ALA 65 Cb 0.80 1.05 0.00 0.00 0.00 0.00 0.00 17.79 19.64 2fvt h ALA 65 CO 1.55 -1.02 0.00 -1.71 0.00 0.00 0.00 179.25 178.07 2fvt n ASN 66 N -5.20 1.07 0.10 0.00 4.05 -1.26 -2.20 115.26 111.81 2fvt n ASN 66 Ca -0.04 -1.46 0.04 0.00 0.45 0.00 0.00 54.58 53.56 2fvt n ASN 66 Cb 0.33 -0.03 -0.01 0.00 1.23 0.00 0.00 39.78 41.30 2fvt n ASN 66 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 2fvt h ALA 67 N 4.08 0.67 -2.78 5.20 0.00 -1.49 -3.39 119.26 121.55 2fvt h ALA 67 Ca 0.00 -0.48 -0.78 0.00 0.00 0.00 0.00 54.91 53.66 2fvt h ALA 67 Cb 0.33 0.08 -0.28 0.00 0.00 0.00 0.00 17.79 17.92 2fvt h ALA 67 CO 0.00 0.56 0.15 0.42 0.00 0.00 0.00 179.25 180.38 2fvt s ILE 68 N -3.04 5.44 0.05 0.00 1.01 -0.57 -4.57 121.20 119.52 2fvt s ILE 68 Ca 0.01 -2.96 -0.17 0.00 0.00 0.00 0.00 60.65 57.53 2fvt s ILE 68 Cb 0.08 -4.34 -0.20 0.00 0.01 0.00 0.00 42.46 38.01 2fvt s ILE 68 CO 0.77 -1.07 1.19 -0.78 0.00 0.00 0.00 174.94 175.05 2fvt h ASP 69 N 7.17 0.71 -3.31 3.58 1.82 -1.68 -3.43 116.42 121.29 2fvt h ASP 69 Ca 0.12 -0.69 -0.66 0.00 -0.39 0.00 0.00 57.03 55.41 2fvt h ASP 69 Cb 0.96 -0.21 -0.28 0.00 0.68 0.00 0.00 39.33 40.47 2fvt h ASP 69 CO 0.84 1.30 -0.78 -0.89 -1.61 0.00 0.00 179.24 178.10 2fvt s THR 70 N -3.48 2.89 -0.27 2.25 2.01 -1.07 0.01 115.64 117.99 2fvt s THR 70 Ca -0.12 -0.70 0.00 0.00 0.31 0.00 0.00 61.69 61.18 2fvt s THR 70 Cb 0.06 -2.22 0.05 0.00 0.01 0.00 0.00 72.50 70.39 2fvt s THR 70 CO 0.86 0.51 -0.06 -0.22 -0.69 0.00 0.00 174.62 175.02 2fvt s LEU 71 N 0.64 3.54 -0.23 4.42 2.96 0.83 -0.80 118.68 130.04 2fvt s LEU 71 Ca -0.07 -1.24 -0.12 0.00 -0.22 0.00 0.00 54.13 52.47 2fvt s LEU 71 Cb -0.16 -1.63 -0.05 0.00 0.50 0.00 0.00 46.19 44.86 2fvt s LEU 71 CO 0.03 -0.20 0.24 -0.63 -1.32 0.00 0.00 176.35 174.47 2fvt s ILE 72 N 1.20 5.30 -0.17 6.68 1.01 0.31 -1.14 121.20 134.38 2fvt s ILE 72 Ca -0.06 0.36 -0.03 0.00 0.00 0.00 0.00 60.65 60.93 2fvt s ILE 72 Cb -0.19 -3.58 -0.02 0.00 0.01 0.00 0.00 42.46 38.68 2fvt s ILE 72 CO -0.04 0.30 -0.07 -0.69 0.00 0.00 0.00 174.94 174.45 2fvt s VAL 73 N 1.22 3.44 -0.47 2.92 1.01 0.09 -0.11 120.40 128.51 2fvt s VAL 73 Ca 0.11 -0.50 -0.12 0.00 0.00 0.00 0.00 61.98 61.47 2fvt s VAL 73 Cb -0.14 -2.51 0.09 0.00 0.00 0.00 0.00 36.38 33.82 2fvt s VAL 73 CO 0.06 0.48 0.36 -0.83 0.00 0.00 0.00 175.10 175.17 2fvt s GLY 74 N 0.75 2.03 0.12 4.51 0.00 0.52 -0.52 107.32 114.72 2fvt s GLY 74 Ca -0.03 -2.28 -0.13 0.00 0.00 0.00 0.00 44.72 42.28 2fvt s GLY 74 CO 0.02 1.06 1.48 -0.91 0.00 0.00 0.00 173.10 174.75 2fvt h THR 75 N 5.95 1.28 -0.60 0.90 1.35 -1.55 -0.35 112.91 119.90 2fvt h THR 75 Ca -0.26 -1.39 0.00 0.00 -0.55 0.00 0.00 66.41 64.22 2fvt h THR 75 Cb 1.09 1.37 0.00 0.00 -1.73 0.00 0.00 68.15 68.88 2fvt h THR 75 CO 0.86 0.46 0.00 0.61 -0.25 0.00 0.00 175.52 177.20 2fvt n GLY 76 N 0.02 -0.68 4.73 5.82 0.00 -1.26 -4.62 105.19 109.20 2fvt n GLY 76 Ca -0.02 -0.93 0.00 0.00 0.00 0.00 0.00 46.02 45.06 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 1.79 0.00 -2.37 4.61 0.00 -1.26 -4.77 120.51 118.51 2fvt n ALA 77 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.35 2fvt n ALA 77 Cb 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.35 2fvt n ALA 77 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.50 177.66 2fvt s ASP 78 N 0.00 0.61 -0.66 0.00 -4.77 -1.26 -5.10 116.67 105.48 2fvt s ASP 78 Ca 0.00 -0.85 -0.21 0.00 -3.30 0.00 0.00 52.55 48.19 2fvt s ASP 78 Cb 0.00 0.14 0.09 0.00 -1.09 0.00 0.00 42.92 42.06 2fvt s ASP 78 CO 0.00 -0.47 0.90 -0.69 0.70 0.00 0.00 175.17 175.61 2fvt s VAL 79 N -3.10 4.52 0.06 2.11 1.01 -1.26 -4.67 120.40 119.07 2fvt s VAL 79 Ca 0.02 -0.68 -0.30 0.00 0.00 0.00 0.00 61.98 61.02 2fvt s VAL 79 Cb 0.02 -4.63 -0.05 0.00 0.00 0.00 0.00 36.38 31.71 2fvt s VAL 79 CO -0.06 -1.36 1.12 0.86 0.00 0.00 0.00 175.10 175.66 2fvt s TRP 80 N 3.50 3.53 -0.16 5.22 -0.00 -1.26 -5.01 118.94 124.76 2fvt s TRP 80 Ca 0.20 1.46 -0.21 0.00 -0.00 0.00 0.00 56.10 57.54 2fvt s TRP 80 Cb -0.18 -3.31 -0.03 0.00 -0.00 0.00 0.00 33.47 29.95 2fvt s TRP 80 CO 0.07 -0.82 0.65 -1.50 -0.00 0.00 0.00 176.95 175.35 2fvt s ILE 81 N 0.84 5.03 -0.01 5.86 1.10 -1.26 -5.00 121.20 127.76 2fvt s ILE 81 Ca 0.55 1.26 -0.30 0.00 -0.51 0.00 0.00 60.65 61.65 2fvt s ILE 81 Cb -0.27 -3.97 -0.03 0.00 0.15 0.00 0.00 42.46 38.34 2fvt s ILE 81 CO 0.30 0.15 0.99 0.00 -2.11 0.00 0.00 174.94 174.27 2fvt s ALA 82 N 1.57 3.20 0.56 1.50 0.00 -1.26 -5.02 121.76 122.32 2fvt s ALA 82 Ca 0.31 0.53 -0.20 0.00 0.00 0.00 0.00 51.96 52.60 2fvt s ALA 82 Cb -0.16 -3.36 -0.06 0.00 0.00 0.00 0.00 23.12 19.54 2fvt s ALA 82 CO 0.12 -0.29 1.06 -2.30 0.00 0.00 0.00 175.76 174.35 2fvt n PRO 83 N 4.06 1.13 -0.21 0.00 -0.02 -1.26 -4.78 135.00 133.91 2fvt n PRO 83 Ca 0.07 0.43 -0.00 0.00 -2.02 0.00 0.00 63.50 61.97 2fvt n PRO 83 Cb 0.50 -2.24 0.22 0.00 -0.02 0.00 0.00 33.50 31.96 2fvt n PRO 83 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2fvt h ARG 84 N 0.84 0.99 -0.15 -0.52 3.08 -1.98 -1.22 114.38 115.42 2fvt h ARG 84 Ca -0.48 -0.09 -0.08 0.00 0.07 0.00 0.00 59.98 59.40 2fvt h ARG 84 Cb 1.35 -0.21 -0.01 0.00 0.08 0.00 0.00 29.97 31.18 2fvt h ARG 84 CO 0.53 0.70 -0.25 1.96 -1.07 0.00 0.00 179.97 181.84 2fvt h GLN 85 N 1.01 0.27 -0.26 0.04 1.08 -1.98 0.73 115.11 116.00 2fvt h GLN 85 Ca 0.26 -0.09 -0.09 0.00 -1.45 0.00 0.00 58.65 57.29 2fvt h GLN 85 Cb -0.04 -0.02 -0.01 0.00 -0.05 0.00 0.00 27.48 27.37 2fvt h GLN 85 CO -0.05 0.50 -0.19 1.25 -0.95 0.00 0.00 178.83 179.39 2fvt h LEU 86 N 0.24 0.62 -0.47 1.46 5.85 -1.65 -1.76 115.31 119.60 2fvt h LEU 86 Ca 0.04 -0.44 -0.08 0.00 0.84 0.00 0.00 57.88 58.24 2fvt h LEU 86 Cb 0.57 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.41 2fvt h LEU 86 CO 0.04 0.93 -0.01 -0.09 -0.34 0.00 0.00 178.44 178.97 2fvt h ARG 87 N 0.31 0.84 -0.58 1.25 2.43 -0.86 -1.88 114.38 115.89 2fvt h ARG 87 Ca 0.05 -0.27 0.06 0.00 -0.81 0.00 0.00 59.98 59.01 2fvt h ARG 87 Cb 0.73 -0.07 -0.06 0.00 -0.42 0.00 0.00 29.97 30.15 2fvt h ARG 87 CO 0.05 0.89 0.28 1.49 -1.51 0.00 0.00 179.97 181.18 2fvt h GLU 88 N 0.69 0.51 -0.17 0.20 4.57 0.54 0.17 114.58 121.09 2fvt h GLU 88 Ca 0.13 -0.03 -0.04 0.00 -1.18 0.00 0.00 59.36 58.24 2fvt h GLU 88 Cb 0.52 -0.12 -0.01 0.00 -0.16 0.00 0.00 28.75 28.99 2fvt h GLU 88 CO 0.03 0.34 -0.05 0.00 -1.18 0.00 0.00 179.01 178.14 2fvt h ALA 89 N 1.34 0.24 -0.83 2.92 0.00 -1.21 -1.21 119.26 120.51 2fvt h ALA 89 Ca 0.27 -0.25 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 2fvt h ALA 89 Cb 0.22 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 17.91 2fvt h ALA 89 CO -0.21 0.02 0.39 -0.07 0.00 0.00 0.00 179.25 179.38 2fvt h LEU 90 N 0.04 1.09 -1.18 0.00 3.38 -0.94 -0.99 115.31 116.71 2fvt h LEU 90 Ca 0.04 -0.14 -0.07 0.00 0.09 0.00 0.00 57.88 57.80 2fvt h LEU 90 Cb 0.50 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.96 2fvt h LEU 90 CO 0.02 0.93 -0.35 -0.09 0.09 0.00 0.00 178.44 179.04 2fvt h ARG 91 N 1.18 0.00 -0.02 1.13 2.43 -0.65 0.16 114.38 118.61 2fvt h ARG 91 Ca 0.28 0.00 -0.10 0.00 -0.81 0.00 0.00 59.98 59.35 2fvt h ARG 91 Cb 0.14 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.67 2fvt h ARG 91 CO -0.03 0.35 -0.47 0.78 -1.51 0.00 0.00 179.97 179.08 2fvt h GLY 92 N 1.58 0.05 1.37 2.80 0.00 0.01 -1.25 103.07 107.63 2fvt h GLY 92 Ca -0.00 -0.05 0.00 0.00 0.00 0.00 0.00 47.33 47.27 2fvt h GLY 92 CO 0.05 0.05 -0.08 -0.62 0.00 0.00 0.00 176.54 175.94 2fvt n VAL 93 N -3.98 0.00 -2.54 4.60 0.31 -0.50 -4.91 118.33 111.32 2fvt n VAL 93 Ca -0.02 -0.02 -0.11 0.00 -0.01 0.00 0.00 64.34 64.18 2fvt n VAL 93 Cb 0.50 -0.30 0.01 0.00 -0.91 0.00 0.00 33.84 33.14 2fvt n VAL 93 CO 0.00 0.00 0.00 -3.20 -1.32 0.00 0.00 176.83 172.31 2fvt n ASN 94 N -1.23 -3.80 -4.61 4.52 5.15 -0.47 -4.87 115.26 109.96 2fvt n ASN 94 Ca 0.12 -0.11 -0.38 0.00 -0.60 0.00 0.00 54.58 53.61 2fvt n ASN 94 Cb 0.28 -2.78 -0.10 0.00 -0.53 0.00 0.00 39.78 36.65 2fvt n ASN 94 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 2fvt s VAL 95 N -2.78 5.27 -0.68 3.44 1.01 -0.04 -4.90 120.40 121.72 2fvt s VAL 95 Ca 0.12 0.31 -0.27 0.00 0.00 0.00 0.00 61.98 62.14 2fvt s VAL 95 Cb -0.05 -3.58 0.02 0.00 0.00 0.00 0.00 36.38 32.76 2fvt s VAL 95 CO 0.14 0.24 1.43 -0.69 0.00 0.00 0.00 175.10 176.22 2fvt s VAL 96 N 1.73 3.65 0.02 2.92 1.01 0.10 -4.17 120.40 125.67 2fvt s VAL 96 Ca 0.10 0.41 -0.23 0.00 0.00 0.00 0.00 61.98 62.26 2fvt s VAL 96 Cb -0.16 -4.62 -0.05 0.00 0.00 0.00 0.00 36.38 31.55 2fvt s VAL 96 CO 0.10 -1.53 0.69 -0.22 0.00 0.00 0.00 175.10 174.14 2fvt s LEU 97 N 6.53 4.43 -0.09 3.92 2.96 -1.26 -0.12 118.68 135.06 2fvt s LEU 97 Ca 0.45 1.32 -0.03 0.00 -0.22 0.00 0.00 54.13 55.65 2fvt s LEU 97 Cb -0.09 -3.10 0.04 0.00 0.50 0.00 0.00 46.19 43.54 2fvt s LEU 97 CO 0.18 0.05 0.06 -0.62 -1.32 0.00 0.00 176.35 174.70 2fvt s ASP 98 N -0.11 1.64 -0.27 3.68 -1.08 -0.30 -4.95 116.67 115.27 2fvt s ASP 98 Ca 0.35 -0.19 -0.11 0.00 -0.52 0.00 0.00 52.55 52.09 2fvt s ASP 98 Cb -0.19 -0.23 -0.05 0.00 -1.46 0.00 0.00 42.92 40.98 2fvt s ASP 98 CO 0.20 -0.27 0.18 0.42 0.52 0.00 0.00 175.17 176.22 2fvt s THR 99 N 2.12 5.22 0.11 1.71 -4.23 -1.26 -0.73 115.64 118.57 2fvt s THR 99 Ca 0.04 0.14 0.02 0.00 -1.18 0.00 0.00 61.69 60.71 2fvt s THR 99 Cb -0.13 -3.48 -0.01 0.00 1.34 0.00 0.00 72.50 70.22 2fvt s THR 99 CO -0.05 0.26 0.09 0.23 -0.54 0.00 0.00 174.62 174.62 2fvt n MET 100 N 5.00 0.14 -1.86 3.99 2.81 0.32 -4.97 117.12 122.55 2fvt n MET 100 Ca -0.14 -1.08 -0.31 0.00 -1.81 0.00 0.00 57.70 54.36 2fvt n MET 100 Cb 0.52 0.89 0.02 0.00 -0.71 0.00 0.00 33.22 33.94 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 -2.43 3.47 0.20 0.03 1.11 -1.26 -1.55 119.66 119.22 2fvt s GLN 101 Ca 0.13 0.72 -0.11 0.00 0.01 0.00 0.00 55.36 56.11 2fvt s GLN 101 Cb 0.01 -2.07 0.14 0.00 -1.01 0.00 0.00 33.01 30.08 2fvt s GLN 101 CO 0.09 -0.66 1.87 1.15 0.01 0.00 0.00 175.29 177.75 2fvt h THR 102 N -0.39 1.16 0.40 -0.19 2.02 -1.88 -2.50 112.91 111.53 2fvt h THR 102 Ca -0.44 -0.32 -0.02 0.00 0.77 0.00 0.00 66.41 66.41 2fvt h THR 102 Cb 1.20 0.16 -0.01 0.00 -1.74 0.00 0.00 68.15 67.76 2fvt h THR 102 CO 0.62 0.17 -0.29 1.23 0.37 0.00 0.00 175.52 177.61 2fvt h GLY 103 N 0.92 -0.96 1.16 2.16 0.00 -1.97 -0.98 103.07 103.40 2fvt h GLY 103 Ca 0.26 0.42 0.10 0.00 0.00 0.00 0.00 47.33 48.11 2fvt h GLY 103 CO -0.07 -0.32 0.33 -2.55 0.00 0.00 0.00 176.54 173.93 2fvt h PRO 104 N -0.66 0.20 -0.20 4.80 0.11 -1.97 -2.33 132.00 131.95 2fvt h PRO 104 Ca -0.05 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 66.02 2fvt h PRO 104 Cb 0.55 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 31.61 2fvt h PRO 104 CO 0.02 0.13 0.02 0.00 -0.21 0.00 0.00 178.00 177.97 2fvt h ALA 105 N 1.76 0.26 -0.36 -0.75 0.00 -1.15 -1.61 119.26 117.41 2fvt h ALA 105 Ca 0.22 -0.18 0.03 0.00 0.00 0.00 0.00 54.91 54.98 2fvt h ALA 105 Cb 0.61 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.30 2fvt h ALA 105 CO -0.04 -0.06 0.18 0.82 0.00 0.00 0.00 179.25 180.15 2fvt h ILE 106 N 0.11 0.98 -0.22 0.00 2.04 -0.64 -0.61 117.51 119.16 2fvt h ILE 106 Ca 0.06 -0.13 -0.01 0.00 1.00 0.00 0.00 64.86 65.78 2fvt h ILE 106 Cb 0.33 0.58 -0.01 0.00 -0.74 0.00 0.00 36.82 36.98 2fvt h ILE 106 CO 0.01 0.07 0.09 -0.09 0.00 0.00 0.00 178.15 178.22 2fvt h ARG 107 N 0.37 0.33 -0.63 2.37 2.43 -1.42 -2.06 114.38 115.77 2fvt h ARG 107 Ca 0.15 -0.06 -0.05 0.00 -0.81 0.00 0.00 59.98 59.21 2fvt h ARG 107 Cb 0.07 -0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 29.54 2fvt h ARG 107 CO -0.11 0.39 0.19 1.15 -1.51 0.00 0.00 179.97 180.08 2fvt h THR 108 N 0.21 1.24 0.08 0.20 2.02 -1.11 -1.78 112.91 113.76 2fvt h THR 108 Ca 0.07 -0.82 0.01 0.00 0.77 0.00 0.00 66.41 66.43 2fvt h THR 108 Cb 0.18 0.54 -0.01 0.00 -1.74 0.00 0.00 68.15 67.12 2fvt h THR 108 CO -0.01 0.32 -0.10 0.22 0.37 0.00 0.00 175.52 176.33 2fvt h TYR 109 N 0.93 -0.25 -0.78 3.16 3.20 -0.85 -1.58 116.97 120.80 2fvt h TYR 109 Ca 0.21 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.08 2fvt h TYR 109 Cb 0.27 0.10 -0.04 0.00 1.54 0.00 0.00 36.73 38.60 2fvt h TYR 109 CO 0.02 -0.15 0.49 -0.97 -1.64 0.00 0.00 178.16 175.91 2fvt h ASN 110 N -0.21 0.92 -0.49 -2.11 -0.73 -1.09 0.38 115.58 112.25 2fvt h ASN 110 Ca 0.01 -0.05 -0.00 0.00 1.87 0.00 0.00 56.30 58.13 2fvt h ASN 110 Cb 0.21 -0.23 -0.02 0.00 0.27 0.00 0.00 38.32 38.54 2fvt h ASN 110 CO -0.04 0.70 0.29 0.40 -0.37 0.00 0.00 177.43 178.41 2fvt h ILE 111 N 1.07 1.15 -0.26 2.57 2.04 -1.12 -0.90 117.51 122.07 2fvt h ILE 111 Ca 0.28 -0.35 -0.19 0.00 1.00 0.00 0.00 64.86 65.60 2fvt h ILE 111 Cb -0.07 0.50 0.00 0.00 -0.74 0.00 0.00 36.82 36.51 2fvt h ILE 111 CO -0.06 0.16 -0.56 0.24 0.00 0.00 0.00 178.15 177.93 2fvt h MET 112 N 0.65 0.84 -0.12 2.37 2.86 -0.94 -3.01 114.93 117.58 2fvt h MET 112 Ca 0.18 -0.56 -0.03 0.00 -2.06 0.00 0.00 59.70 57.23 2fvt h MET 112 Cb -0.00 0.07 -0.01 0.00 0.06 0.00 0.00 31.60 31.73 2fvt h MET 112 CO -0.03 1.18 -0.06 0.82 1.06 0.00 0.00 176.91 179.88 2fvt h ILE 113 N 0.61 1.12 -0.05 -1.22 1.08 -0.75 0.35 117.51 118.65 2fvt h ILE 113 Ca 0.00 -0.50 0.00 0.00 -0.39 0.00 0.00 64.86 63.97 2fvt h ILE 113 Cb 1.17 1.10 0.00 0.00 -3.07 0.00 0.00 36.82 36.02 2fvt h ILE 113 CO 0.12 0.16 0.00 0.61 -0.69 0.00 0.00 178.15 178.35 2fvt n GLY 114 N -1.13 -0.73 0.00 5.37 0.00 -0.36 -4.23 105.19 104.12 2fvt n GLY 114 Ca -0.01 -0.12 0.00 0.00 0.00 0.00 0.00 46.02 45.89 2fvt n GLY 114 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2fvt n GLU 115 N -0.45 0.00 -0.01 1.61 0.00 -0.23 -4.99 120.64 116.57 2fvt n GLU 115 Ca 0.08 0.00 0.07 0.00 0.00 0.00 0.00 57.16 57.31 2fvt n GLU 115 Cb 0.08 0.00 -0.10 0.00 0.00 0.00 0.00 31.44 31.42 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 -0.89 0.86 0.00 5.31 1.85 -0.22 -5.08 116.66 118.49 2fvt n ARG 116 Ca 0.00 -0.10 0.00 0.00 -1.00 0.00 0.00 57.85 56.75 2fvt n ARG 116 Cb 0.00 -1.29 0.00 0.00 -1.05 0.00 0.00 32.46 30.12 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 -1.85 0.00 -1.66 2.89 1.74 0.11 -4.87 116.66 113.02 2fvt n ARG 117 Ca -0.01 0.00 -0.16 0.00 -0.77 0.00 0.00 57.85 56.90 2fvt n ARG 117 Cb 0.33 0.00 -0.06 0.00 -1.02 0.00 0.00 32.46 31.72 2fvt n ARG 117 CO 0.00 0.00 0.00 -2.13 -1.52 0.00 0.00 177.63 173.98 2fvt n ARG 118 N 13.99 -1.18 -4.05 5.56 0.63 -1.26 -4.74 116.66 125.60 2fvt n ARG 118 Ca 0.00 1.02 -0.13 0.00 -0.92 0.00 0.00 57.85 57.82 2fvt n ARG 118 Cb 0.00 -5.27 -0.13 0.00 0.45 0.00 0.00 32.46 27.52 2fvt n ARG 118 CO 0.00 0.00 0.00 0.54 -2.51 0.00 0.00 177.63 175.66 2fvt s VAL 119 N -2.66 0.33 0.11 5.15 0.11 -1.26 -2.46 120.40 119.72 2fvt s VAL 119 Ca 0.00 -0.57 0.06 0.00 -2.93 0.00 0.00 61.98 58.55 2fvt s VAL 119 Cb 0.00 -0.36 -0.03 0.00 -1.53 0.00 0.00 36.38 34.45 2fvt s VAL 119 CO 0.00 -0.16 -0.16 0.00 -3.33 0.00 0.00 175.10 171.45 2fvt s ALA 120 N -0.72 1.51 -0.14 1.54 0.00 0.02 -2.71 121.76 121.27 2fvt s ALA 120 Ca -0.05 -1.22 0.01 0.00 0.00 0.00 0.00 51.96 50.70 2fvt s ALA 120 Cb -0.05 -0.13 0.02 0.00 0.00 0.00 0.00 23.12 22.96 2fvt s ALA 120 CO -0.00 0.18 -0.15 0.00 0.00 0.00 0.00 175.76 175.79 2fvt s ALA 121 N -1.68 1.85 -0.51 0.00 0.00 0.88 -0.53 121.76 121.76 2fvt s ALA 121 Ca 0.06 -0.88 -0.16 0.00 0.00 0.00 0.00 51.96 50.98 2fvt s ALA 121 Cb -0.07 -1.01 0.10 0.00 0.00 0.00 0.00 23.12 22.14 2fvt s ALA 121 CO 0.03 -0.30 0.46 0.00 0.00 0.00 0.00 175.76 175.96 2fvt s ALA 122 N 1.34 3.60 -0.19 0.00 0.00 0.85 -0.74 121.76 126.62 2fvt s ALA 122 Ca 0.02 -2.32 -0.04 0.00 0.00 0.00 0.00 51.96 49.62 2fvt s ALA 122 Cb -0.13 -3.19 -0.02 0.00 0.00 0.00 0.00 23.12 19.78 2fvt s ALA 122 CO -0.08 -1.90 -0.03 -0.51 0.00 0.00 0.00 175.76 173.24 2fvt s LEU 123 N 1.67 3.08 -0.08 0.00 1.43 -0.82 -0.36 118.68 123.60 2fvt s LEU 123 Ca 0.04 -0.27 -0.05 0.00 -1.03 0.00 0.00 54.13 52.82 2fvt s LEU 123 Cb -0.27 -1.77 -0.04 0.00 0.03 0.00 0.00 46.19 44.14 2fvt s LEU 123 CO 0.05 0.06 0.14 -0.63 0.23 0.00 0.00 176.35 176.20 2fvt s ILE 124 N 1.01 5.39 0.12 -0.59 1.01 -0.14 -1.44 121.20 126.55 2fvt s ILE 124 Ca 0.01 0.06 -0.31 0.00 0.00 0.00 0.00 60.65 60.41 2fvt s ILE 124 Cb -0.15 -3.39 -0.08 0.00 0.01 0.00 0.00 42.46 38.85 2fvt s ILE 124 CO 0.01 0.53 1.37 0.00 0.00 0.00 0.00 174.94 176.84 2fvt s ALA 125 N -1.11 3.57 -0.04 9.38 0.00 0.38 -4.40 121.76 129.55 2fvt s ALA 125 Ca 0.18 1.09 -0.30 0.00 0.00 0.00 0.00 51.96 52.94 2fvt s ALA 125 Cb -0.12 -3.52 -0.05 0.00 0.00 0.00 0.00 23.12 19.42 2fvt s ALA 125 CO 0.08 -0.59 1.55 0.08 0.00 0.00 0.00 175.76 176.88 2fvt s VAL 126 N 1.03 3.61 0.27 0.00 1.01 -1.26 -4.87 120.40 120.19 2fvt s VAL 126 Ca 0.63 0.86 -0.30 0.00 0.00 0.00 0.00 61.98 63.17 2fvt s VAL 126 Cb -0.36 -3.55 -0.13 0.00 0.00 0.00 0.00 36.38 32.33 2fvt s VAL 126 CO 0.31 -0.05 1.34 -0.81 0.00 0.00 0.00 175.10 175.88 2fvt n PRO 127 N 6.45 2.00 -1.89 2.72 -0.04 -1.26 -4.64 135.00 138.34 2fvt n PRO 127 Ca 0.16 0.71 -0.40 0.00 -0.04 0.00 0.00 63.50 63.92 2fvt n PRO 127 Cb 0.43 -2.32 -0.03 0.00 -0.04 0.00 0.00 33.50 31.54 2fvt n PRO 127 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2fvt s LEU 128 N -0.23 3.41 0.00 1.53 1.02 -1.26 -4.42 118.68 118.72 2fvt s LEU 128 Ca 0.63 0.99 0.00 0.00 0.02 0.00 0.00 54.13 55.78 2fvt s LEU 128 Cb -0.63 -2.99 0.00 0.00 0.02 0.00 0.00 46.19 42.59 2fvt s LEU 128 CO 0.54 -2.19 0.00 -0.62 0.02 0.00 0.00 176.35 174.11 2fvt n GLU 129 N 8.83 0.00 -3.05 1.70 -0.58 -1.26 -4.71 120.64 121.58 2fvt n GLU 129 Ca 0.25 0.00 -0.09 0.00 -0.42 0.00 0.00 57.16 56.90 2fvt n GLU 129 Cb 0.50 0.00 -0.02 0.00 -0.57 0.00 0.00 31.44 31.35 2fvt n GLU 129 CO 0.00 0.00 0.00 0.72 -0.48 0.00 0.00 177.13 177.37 2fvt n HIS 130 N 0.00 -0.91 -0.98 -0.32 8.25 -1.26 -5.13 115.22 114.86 2fvt n HIS 130 Ca 0.00 -1.43 -0.29 0.00 -0.26 0.00 0.00 57.72 55.74 2fvt n HIS 130 Cb 0.00 0.29 0.18 0.00 1.12 0.00 0.00 29.99 31.58 2fvt n HIS 130 CO 0.00 0.00 0.00 -1.01 0.64 0.00 0.00 176.34 175.97 2fvt s HIS 131 N -3.57 1.96 -0.62 4.41 3.76 -1.26 -4.99 115.29 114.98 2fvt s HIS 131 Ca 0.18 1.25 -0.05 0.00 -0.15 0.00 0.00 55.06 56.30 2fvt s HIS 131 Cb -0.00 -3.18 0.16 0.00 1.11 0.00 0.00 32.58 30.66 2fvt s HIS 131 CO 0.13 -2.89 0.45 -1.01 -0.85 0.00 0.00 174.74 170.57 2fvt s HIS 132 N -2.79 3.48 -1.70 1.40 3.76 -1.26 -4.69 115.29 113.48 2fvt s HIS 132 Ca 0.65 -2.50 0.15 0.00 -0.15 0.00 0.00 55.06 53.21 2fvt s HIS 132 Cb -0.20 -3.32 0.19 0.00 1.11 0.00 0.00 32.58 30.36 2fvt s HIS 132 CO 0.59 -0.89 1.06 1.58 -0.85 0.00 0.00 174.74 176.23 2fvt n HIS 133 N 3.80 0.15 -4.51 1.40 -0.00 -1.26 -4.95 115.22 109.84 2fvt n HIS 133 Ca 0.06 -0.12 -0.33 0.00 -0.00 0.00 0.00 57.72 57.32 2fvt n HIS 133 Cb 0.40 -0.00 -0.14 0.00 -0.00 0.00 0.00 29.99 30.25 2fvt n HIS 133 CO 0.00 0.00 0.00 -1.58 -0.00 0.00 0.00 176.34 174.76 2fvt s HIS 134 N -1.18 2.90 -2.12 1.57 5.04 -1.26 -5.33 115.29 114.92 2fvt s HIS 134 Ca 0.21 -0.59 0.31 0.00 -1.54 0.00 0.00 55.06 53.44 2fvt s HIS 134 Cb 0.13 -1.92 1.71 0.00 0.04 0.00 0.00 32.58 32.54 2fvt s HIS 134 CO 0.19 -0.22 2.12 0.72 -2.34 0.00 0.00 174.74 175.21