#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 -0.79 3.17 0.00 -1.26 -5.03 120.51 116.60 2fvt n ALA 2 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 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 -0.49 0.00 -0.09 0.00 7.27 -1.26 -5.00 117.38 117.82 2fvt n GLN 3 Ca 0.00 0.00 -0.14 0.00 0.07 0.00 0.00 57.00 56.93 2fvt n GLN 3 Cb 0.00 0.00 -0.07 0.00 2.41 0.00 0.00 30.24 32.58 2fvt n GLN 3 CO 0.00 0.00 0.00 2.89 0.07 0.00 0.00 177.06 180.02 2fvt n ARG 4 N -1.31 0.52 0.00 3.69 1.85 -1.26 -4.94 116.66 115.20 2fvt n ARG 4 Ca 0.00 0.55 0.00 0.00 -1.00 0.00 0.00 57.85 57.40 2fvt n ARG 4 Cb 0.00 -1.72 0.00 0.00 -1.05 0.00 0.00 32.46 29.69 2fvt n ARG 4 CO 0.00 0.00 0.00 0.43 -0.01 0.00 0.00 177.63 178.05 2fvt n SER 5 N -4.51 0.00 -4.43 2.89 7.64 -1.26 -4.34 113.62 109.60 2fvt n SER 5 Ca -0.22 0.00 -0.44 0.00 1.01 0.00 0.00 58.87 59.22 2fvt n SER 5 Cb 0.50 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.68 2fvt n SER 5 CO 0.00 0.00 0.00 -1.83 -3.01 0.00 0.00 175.04 170.20 2fvt s GLU 6 N 0.00 3.55 0.21 1.43 -1.05 -1.26 -5.02 118.70 116.56 2fvt s GLU 6 Ca 0.00 -1.76 -0.18 0.00 -0.15 0.00 0.00 54.97 52.88 2fvt s GLU 6 Cb 0.00 -4.79 -0.08 0.00 -0.44 0.00 0.00 34.13 28.82 2fvt s GLU 6 CO 0.00 -1.71 0.68 0.96 0.95 0.00 0.00 175.26 176.14 2fvt s ILE 7 N 2.49 4.65 0.04 1.83 -5.25 -1.26 -5.01 121.20 118.70 2fvt s ILE 7 Ca 0.29 1.13 -0.30 0.00 -0.99 0.00 0.00 60.65 60.78 2fvt s ILE 7 Cb -0.07 -3.80 -0.08 0.00 2.95 0.00 0.00 42.46 41.46 2fvt s ILE 7 CO -0.08 0.17 1.79 -2.84 -1.79 0.00 0.00 174.94 172.19 2fvt s PRO 8 N -2.09 4.16 -0.39 0.37 0.02 -1.26 -4.95 135.00 130.88 2fvt s PRO 8 Ca 0.43 2.44 -0.28 0.00 0.02 0.00 0.00 61.00 63.62 2fvt s PRO 8 Cb -0.15 -3.85 0.02 0.00 0.02 0.00 0.00 34.50 30.53 2fvt s PRO 8 CO 0.20 -0.85 1.02 -1.01 -0.33 0.00 0.00 177.00 176.03 2fvt s HIS 9 N 3.52 3.03 0.07 6.54 3.76 -1.26 -4.98 115.29 125.96 2fvt s HIS 9 Ca 0.80 0.86 -0.31 0.00 -0.15 0.00 0.00 55.06 56.26 2fvt s HIS 9 Cb -0.41 -3.87 -0.09 0.00 1.11 0.00 0.00 32.58 29.33 2fvt s HIS 9 CO 0.35 -0.93 1.76 -0.06 -0.85 0.00 0.00 174.74 175.02 2fvt s PHE 10 N 3.78 2.08 -1.52 1.40 0.08 -1.26 -4.89 117.98 117.65 2fvt s PHE 10 Ca 0.43 0.06 -0.10 0.00 0.12 0.00 0.00 56.93 57.43 2fvt s PHE 10 Cb -0.11 -4.08 -0.01 0.00 -0.57 0.00 0.00 43.02 38.26 2fvt s PHE 10 CO 0.21 -4.49 2.61 -0.35 -0.10 0.00 0.00 175.22 173.11 2fvt n PRO 11 N 6.15 3.58 -2.32 0.24 -0.04 -1.26 -3.46 135.00 137.89 2fvt n PRO 11 Ca 0.17 -2.57 -0.01 0.00 -0.04 0.00 0.00 63.50 61.05 2fvt n PRO 11 Cb 0.40 -2.92 -0.01 0.00 -0.04 0.00 0.00 33.50 30.93 2fvt n PRO 11 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2fvt n ARG 12 N 4.05 -2.66 -3.03 0.54 1.74 -1.24 -4.94 116.66 111.12 2fvt n ARG 12 Ca 0.67 2.23 -0.44 0.00 -0.77 0.00 0.00 57.85 59.54 2fvt n ARG 12 Cb 0.29 -3.99 -0.05 0.00 -1.02 0.00 0.00 32.46 27.68 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 -0.95 4.67 -2.06 0.55 2.01 -1.26 -4.84 115.64 113.76 2fvt s THR 13 Ca -0.06 -0.40 0.22 0.00 0.31 0.00 0.00 61.69 61.76 2fvt s THR 13 Cb 0.00 -4.45 0.01 0.00 0.01 0.00 0.00 72.50 68.08 2fvt s THR 13 CO 0.55 -1.04 1.07 0.00 -0.69 0.00 0.00 174.62 174.51 2fvt n ALA 14 N 6.73 3.39 -3.85 7.40 0.00 -1.26 -4.82 120.51 128.10 2fvt n ALA 14 Ca -0.05 -0.64 -0.34 0.00 0.00 0.00 0.00 53.44 52.42 2fvt n ALA 14 Cb 0.45 -0.76 -0.14 0.00 0.00 0.00 0.00 19.45 19.00 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 -2.33 2.78 -0.03 0.00 0.00 -1.26 -4.72 121.76 116.20 2fvt s ALA 15 Ca 0.19 -1.95 0.07 0.00 0.00 0.00 0.00 51.96 50.26 2fvt s ALA 15 Cb 0.17 -1.88 -0.02 0.00 0.00 0.00 0.00 23.12 21.40 2fvt s ALA 15 CO 0.52 -1.36 -0.23 0.42 0.00 0.00 0.00 175.76 175.11 2fvt s ILE 16 N 1.14 2.29 0.00 0.00 1.01 -1.26 -4.68 121.20 119.70 2fvt s ILE 16 Ca -0.03 -1.01 0.00 0.00 0.00 0.00 0.00 60.65 59.61 2fvt s ILE 16 Cb -0.20 -1.82 0.00 0.00 0.01 0.00 0.00 42.46 40.45 2fvt s ILE 16 CO -0.04 0.58 0.00 -0.67 0.00 0.00 0.00 174.94 174.82 2fvt n ASP 17 N 2.45 0.00 -2.61 3.58 -0.08 -1.26 -4.95 116.55 113.69 2fvt n ASP 17 Ca -0.16 -0.93 -0.18 0.00 -1.51 0.00 0.00 54.79 52.01 2fvt n ASP 17 Cb 0.51 0.00 -0.00 0.00 2.34 0.00 0.00 41.12 43.97 2fvt n ASP 17 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2fvt n ALA 18 N -3.00 -0.78 -2.84 -1.67 0.00 -1.26 -4.02 120.51 106.94 2fvt n ALA 18 Ca 0.00 0.15 -0.34 0.00 0.00 0.00 0.00 53.44 53.24 2fvt n ALA 18 Cb 0.00 -2.21 -0.10 0.00 0.00 0.00 0.00 19.45 17.14 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 -2.87 3.21 0.00 0.00 5.04 -1.26 -3.76 117.35 117.71 2fvt s TYR 19 Ca 0.09 0.02 0.00 0.00 -2.44 0.00 0.00 57.07 54.73 2fvt s TYR 19 Cb -0.04 -2.05 0.00 0.00 0.35 0.00 0.00 41.96 40.22 2fvt s TYR 19 CO 0.11 0.14 0.00 0.41 -1.34 0.00 0.00 175.55 174.87 2fvt n GLY 20 N 3.47 1.49 2.95 8.97 0.00 -1.26 -5.10 105.19 115.71 2fvt n GLY 20 Ca -0.17 -0.12 -0.13 0.00 0.00 0.00 0.00 46.02 45.60 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 0.29 0.00 1.61 2.20 -1.26 -4.90 119.74 117.68 2fvt s LYS 21 Ca 0.00 -0.30 0.00 0.00 -0.36 0.00 0.00 55.97 55.31 2fvt s LYS 21 Cb 0.00 -0.17 0.00 0.00 -1.51 0.00 0.00 37.83 36.15 2fvt s LYS 21 CO 0.00 0.04 0.00 0.41 -0.36 0.00 0.00 175.35 175.44 2fvt n GLY 22 N 2.50 1.95 0.00 5.54 0.00 -1.26 -4.75 105.19 109.16 2fvt n GLY 22 Ca -0.16 -0.24 0.00 0.00 0.00 0.00 0.00 46.02 45.62 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 -0.51 2.94 -0.02 0.00 -1.26 -4.57 105.19 101.77 2fvt n GLY 23 Ca 0.00 0.20 -0.29 0.00 0.00 0.00 0.00 46.02 45.93 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 1.92 -0.45 1.61 0.08 -0.19 -4.02 117.98 116.92 2fvt s PHE 24 Ca 0.00 -1.17 -0.04 0.00 0.12 0.00 0.00 56.93 55.84 2fvt s PHE 24 Cb 0.00 -1.43 0.12 0.00 -0.57 0.00 0.00 43.02 41.14 2fvt s PHE 24 CO 0.00 -0.64 0.27 -0.47 -0.10 0.00 0.00 175.22 174.28 2fvt s TYR 25 N 1.56 3.53 0.42 0.36 6.14 -1.25 -1.58 117.35 126.54 2fvt s TYR 25 Ca 0.02 -2.32 0.07 0.00 0.64 0.00 0.00 57.07 55.47 2fvt s TYR 25 Cb -0.15 -3.29 -0.06 0.00 0.42 0.00 0.00 41.96 38.88 2fvt s TYR 25 CO -0.08 -0.96 0.12 -0.59 0.64 0.00 0.00 175.55 174.67 2fvt s PHE 26 N 1.05 2.53 -0.32 4.97 -0.71 -1.26 -4.14 117.98 120.10 2fvt s PHE 26 Ca 0.09 -0.63 -0.34 0.00 -1.04 0.00 0.00 56.93 55.00 2fvt s PHE 26 Cb -0.23 -1.89 -0.11 0.00 -1.21 0.00 0.00 43.02 39.59 2fvt s PHE 26 CO -0.03 0.26 2.17 0.00 -1.34 0.00 0.00 175.22 176.28 2fvt n ALA 27 N -1.16 1.15 0.00 1.99 0.00 -1.26 -3.91 120.51 117.32 2fvt n ALA 27 Ca -0.03 -0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.35 2fvt n ALA 27 Cb 0.65 -2.59 0.00 0.00 0.00 0.00 0.00 19.45 17.51 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 6.30 1.14 3.36 0.00 0.00 -1.26 -5.06 105.19 109.67 2fvt n GLY 28 Ca 0.39 -0.77 -0.31 0.00 0.00 0.00 0.00 46.02 45.33 2fvt n GLY 28 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2fvt s MET 29 N 0.00 1.99 0.43 1.61 -1.94 -1.25 -5.13 119.30 115.01 2fvt s MET 29 Ca 0.00 -1.00 -0.15 0.00 -1.71 0.00 0.00 55.69 52.83 2fvt s MET 29 Cb 0.00 -2.06 -0.08 0.00 2.01 0.00 0.00 34.83 34.69 2fvt s MET 29 CO 0.00 0.54 0.86 -1.54 -0.01 0.00 0.00 175.02 174.87 2fvt s SER 30 N -1.05 6.68 0.14 3.03 1.04 -1.26 -4.42 113.70 117.86 2fvt s SER 30 Ca 0.12 1.40 -0.07 0.00 0.48 0.00 0.00 55.95 57.88 2fvt s SER 30 Cb -0.10 -2.43 -0.02 0.00 0.10 0.00 0.00 66.02 63.57 2fvt s SER 30 CO 0.02 -0.41 0.20 -1.00 0.98 0.00 0.00 173.24 173.02 2fvt s HIS 31 N -2.34 0.48 0.00 5.02 3.76 -0.61 -5.04 115.29 116.56 2fvt s HIS 31 Ca 0.56 -0.87 0.00 0.00 -0.15 0.00 0.00 55.06 54.60 2fvt s HIS 31 Cb -0.10 -0.18 0.00 0.00 1.11 0.00 0.00 32.58 33.41 2fvt s HIS 31 CO 0.25 -0.63 0.00 0.94 -0.85 0.00 0.00 174.74 174.45 2fvt n GLN 32 N -0.15 0.00 0.00 1.40 7.27 -1.26 -1.02 117.38 123.62 2fvt n GLN 32 Ca -0.08 0.00 0.00 0.00 0.07 0.00 0.00 57.00 56.99 2fvt n GLN 32 Cb 0.63 -0.22 0.00 0.00 2.41 0.00 0.00 30.24 33.06 2fvt n GLN 32 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 2fvt n GLY 33 N 2.60 -0.86 3.13 1.69 0.00 -1.26 -4.25 105.19 106.23 2fvt n GLY 33 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.91 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 -1.56 -0.01 0.14 1.61 1.04 -1.24 -0.16 113.70 113.53 2fvt s SER 34 Ca 0.00 -0.16 0.10 0.00 0.48 0.00 0.00 55.95 56.37 2fvt s SER 34 Cb 0.00 0.22 -0.04 0.00 0.10 0.00 0.00 66.02 66.30 2fvt s SER 34 CO 0.00 -0.39 -0.24 -0.76 0.98 0.00 0.00 173.24 172.83 2fvt s LEU 35 N -1.40 2.36 -0.50 2.42 2.01 -0.30 -0.60 118.68 122.67 2fvt s LEU 35 Ca -0.14 -0.78 -0.03 0.00 0.01 0.00 0.00 54.13 53.18 2fvt s LEU 35 Cb -0.07 -1.09 0.13 0.00 0.01 0.00 0.00 46.19 45.17 2fvt s LEU 35 CO 0.02 0.12 0.31 -0.76 1.01 0.00 0.00 176.35 177.04 2fvt s LEU 36 N -2.25 5.30 -0.83 1.79 1.43 0.11 -1.29 118.68 122.93 2fvt s LEU 36 Ca 0.14 -2.33 -0.23 0.00 -1.03 0.00 0.00 54.13 50.68 2fvt s LEU 36 Cb -0.09 -1.86 0.07 0.00 0.03 0.00 0.00 46.19 44.34 2fvt s LEU 36 CO 0.07 -0.49 1.20 -0.36 0.23 0.00 0.00 176.35 177.00 2fvt s PHE 37 N 0.70 2.63 0.59 0.29 0.40 0.40 -0.53 117.98 122.46 2fvt s PHE 37 Ca 0.11 -0.66 -0.06 0.00 -0.60 0.00 0.00 56.93 55.71 2fvt s PHE 37 Cb -0.22 -4.48 0.00 0.00 0.51 0.00 0.00 43.02 38.83 2fvt s PHE 37 CO -0.04 -1.80 0.91 -0.51 0.70 0.00 0.00 175.22 174.48 2fvt s LEU 38 N 4.45 3.25 0.00 -0.37 1.43 -0.39 -0.49 118.68 126.56 2fvt s LEU 38 Ca 0.34 0.80 0.00 0.00 -1.03 0.00 0.00 54.13 54.24 2fvt s LEU 38 Cb -0.08 -3.65 0.00 0.00 0.03 0.00 0.00 46.19 42.49 2fvt s LEU 38 CO 0.02 -1.03 0.38 -2.65 0.23 0.00 0.00 176.35 173.30 2fvt n PRO 39 N -2.59 0.58 0.00 1.29 -0.02 -1.21 -3.40 135.00 129.65 2fvt n PRO 39 Ca 0.04 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.52 2fvt n PRO 39 Cb 0.57 -1.21 0.00 0.00 -0.02 0.00 0.00 33.50 32.85 2fvt n PRO 39 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 2fvt n ASP 40 N 0.00 0.00 -3.92 2.55 5.75 -1.26 -5.00 116.55 114.67 2fvt n ASP 40 Ca 0.00 0.00 -0.09 0.00 -0.01 0.00 0.00 54.79 54.69 2fvt n ASP 40 Cb 0.10 0.00 -0.09 0.00 -1.03 0.00 0.00 41.12 40.10 2fvt n ASP 40 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2fvt s ALA 41 N -1.00 -0.07 -0.29 2.12 0.00 -1.22 -3.66 121.76 117.65 2fvt s ALA 41 Ca 0.00 -0.61 -0.08 0.00 0.00 0.00 0.00 51.96 51.27 2fvt s ALA 41 Cb 0.00 0.30 -0.01 0.00 0.00 0.00 0.00 23.12 23.41 2fvt s ALA 41 CO 0.00 -0.37 0.12 0.08 0.00 0.00 0.00 175.76 175.59 2fvt s VAL 42 N -3.02 4.43 0.48 0.00 1.01 -1.23 -1.26 120.40 120.81 2fvt s VAL 42 Ca -0.01 -0.37 0.07 0.00 0.00 0.00 0.00 61.98 61.66 2fvt s VAL 42 Cb 0.01 -3.20 0.01 0.00 0.00 0.00 0.00 36.38 33.20 2fvt s VAL 42 CO -0.06 0.16 0.39 0.26 0.00 0.00 0.00 175.10 175.84 2fvt s TRP 43 N 1.60 2.14 0.08 5.22 0.52 0.31 -4.62 118.94 124.19 2fvt s TRP 43 Ca 0.05 -0.67 0.03 0.00 0.02 0.00 0.00 56.10 55.52 2fvt s TRP 43 Cb -0.16 -2.03 -0.04 0.00 -1.15 0.00 0.00 33.47 30.08 2fvt s TRP 43 CO 0.05 -0.30 0.09 0.20 0.02 0.00 0.00 176.95 177.01 2fvt s GLY 44 N -4.20 2.02 0.30 0.98 0.00 -1.26 0.06 107.32 105.22 2fvt s GLY 44 Ca 0.42 -1.01 0.07 0.00 0.00 0.00 0.00 44.72 44.20 2fvt s GLY 44 CO 0.25 -0.99 0.24 0.86 0.00 0.00 0.00 173.10 173.45 2fvt s TRP 45 N -1.41 2.96 -0.26 1.90 -0.00 0.23 -4.64 118.94 117.72 2fvt s TRP 45 Ca 0.30 -0.23 0.12 0.00 -0.00 0.00 0.00 56.10 56.28 2fvt s TRP 45 Cb -0.12 -1.62 0.55 0.00 -0.00 0.00 0.00 33.47 32.28 2fvt s TRP 45 CO 0.22 0.34 1.51 -3.47 -0.00 0.00 0.00 176.95 175.55 2fvt n ASP 46 N -1.27 3.30 -4.44 5.86 2.03 -1.26 -4.46 116.55 116.31 2fvt n ASP 46 Ca -0.04 -3.43 -0.33 0.00 0.52 0.00 0.00 54.79 51.51 2fvt n ASP 46 Cb 0.59 -0.63 -0.13 0.00 -0.72 0.00 0.00 41.12 40.23 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 -3.07 3.13 -0.09 5.18 1.01 -1.26 -5.02 120.40 120.27 2fvt s VAL 47 Ca 0.46 -0.67 -0.04 0.00 0.00 0.00 0.00 61.98 61.73 2fvt s VAL 47 Cb 0.39 -2.27 -0.26 0.00 0.00 0.00 0.00 36.38 34.24 2fvt s VAL 47 CO 0.05 0.56 0.47 0.74 0.00 0.00 0.00 175.10 176.92 2fvt h THR 48 N 4.81 0.72 -3.51 3.92 2.02 -1.92 -3.28 112.91 115.67 2fvt h THR 48 Ca -0.37 -2.44 -0.05 0.00 0.77 0.00 0.00 66.41 64.32 2fvt h THR 48 Cb 1.18 2.53 -0.11 0.00 -1.74 0.00 0.00 68.15 70.01 2fvt h THR 48 CO 0.53 0.83 -0.09 -1.59 0.37 0.00 0.00 175.52 175.57 2fvt s LYS 49 N -2.57 1.31 1.08 6.66 -2.85 -1.26 -4.75 119.74 117.36 2fvt s LYS 49 Ca -0.18 -0.98 -0.15 0.00 -1.00 0.00 0.00 55.97 53.66 2fvt s LYS 49 Cb 0.07 0.47 0.15 0.00 -2.06 0.00 0.00 37.83 36.45 2fvt s LYS 49 CO 0.79 -0.53 0.48 -0.35 0.10 0.00 0.00 175.35 175.84 2fvt n PRO 50 N -0.30 -1.44 0.00 1.78 -0.04 -1.26 -3.02 135.00 130.72 2fvt n PRO 50 Ca -0.09 -0.39 0.00 0.00 -0.04 0.00 0.00 63.50 62.98 2fvt n PRO 50 Cb 0.63 -1.93 0.00 0.00 -0.04 0.00 0.00 33.50 32.16 2fvt n PRO 50 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 2fvt n GLU 51 N -3.00 0.00 0.00 0.54 2.13 -1.26 -4.63 120.64 114.42 2fvt n GLU 51 Ca 0.04 0.00 0.14 0.00 0.66 0.00 0.00 57.16 58.00 2fvt n GLU 51 Cb 0.57 -0.77 0.79 0.00 0.27 0.00 0.00 31.44 32.30 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 -0.46 0.70 -2.41 5.31 7.27 -1.17 -4.73 117.38 121.91 2fvt n GLN 52 Ca 0.00 0.01 -0.43 0.00 0.07 0.00 0.00 57.00 56.65 2fvt n GLN 52 Cb 0.00 -1.50 -0.02 0.00 2.41 0.00 0.00 30.24 31.13 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 -2.21 3.99 0.12 1.69 1.01 -1.26 -4.75 121.20 119.79 2fvt s ILE 53 Ca 0.36 1.02 0.01 0.00 0.00 0.00 0.00 60.65 62.04 2fvt s ILE 53 Cb 0.19 -4.28 -0.00 0.00 0.01 0.00 0.00 42.46 38.38 2fvt s ILE 53 CO 0.36 -0.78 0.14 -0.90 0.00 0.00 0.00 174.94 173.76 2fvt n ASP 54 N 8.51 -0.38 -0.11 3.58 5.68 -1.26 -4.94 116.55 127.63 2fvt n ASP 54 Ca 0.15 -1.69 -0.01 0.00 -0.50 0.00 0.00 54.79 52.74 2fvt n ASP 54 Cb 0.48 0.76 0.23 0.00 -1.14 0.00 0.00 41.12 41.45 2fvt n ASP 54 CO 0.00 0.00 0.00 -0.09 -1.33 0.00 0.00 177.20 175.78 2fvt h ARG 55 N 0.00 0.77 0.14 0.11 2.43 -1.96 0.14 114.38 116.01 2fvt h ARG 55 Ca -0.09 -0.13 -0.30 0.00 -0.81 0.00 0.00 59.98 58.65 2fvt h ARG 55 Cb 0.41 -0.13 0.03 0.00 -0.42 0.00 0.00 29.97 29.86 2fvt h ARG 55 CO 0.12 0.67 -1.27 -0.92 -1.51 0.00 0.00 179.97 177.06 2fvt h TYR 56 N 0.76 0.92 0.00 2.20 3.20 -1.97 -3.14 116.97 118.95 2fvt h TYR 56 Ca 0.18 -0.60 -0.01 0.00 3.14 0.00 0.00 58.73 61.44 2fvt h TYR 56 Cb 0.22 -0.07 -0.00 0.00 1.54 0.00 0.00 36.73 38.42 2fvt h TYR 56 CO 0.01 1.45 -0.03 0.77 -1.64 0.00 0.00 178.16 178.72 2fvt h SER 57 N 0.23 0.00 -0.54 -2.11 0.02 -1.75 -1.98 113.55 107.42 2fvt h SER 57 Ca -0.19 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.76 2fvt h SER 57 Cb 1.95 0.00 0.00 0.00 0.14 0.00 0.00 62.40 64.49 2fvt h SER 57 CO 0.24 0.03 0.00 0.18 -1.14 0.00 0.00 176.83 176.14 2fvt n LEU 58 N -3.17 4.66 -0.06 5.07 4.77 -0.00 -4.54 117.00 123.73 2fvt n LEU 58 Ca -0.01 -2.36 -0.08 0.00 -0.03 0.00 0.00 56.01 53.54 2fvt n LEU 58 Cb 0.25 -0.60 -0.02 0.00 -2.33 0.00 0.00 43.42 40.72 2fvt n LEU 58 CO 0.26 0.65 0.83 -0.61 -1.33 0.00 0.00 177.39 177.20 2fvt h GLN 59 N 3.54 0.03 0.00 3.23 4.15 -1.36 0.12 115.11 124.81 2fvt h GLN 59 Ca 0.00 -0.00 -0.01 0.00 0.77 0.00 0.00 58.65 59.41 2fvt h GLN 59 Cb 1.54 -0.01 -0.00 0.00 0.21 0.00 0.00 27.48 29.22 2fvt h GLN 59 CO 0.31 0.02 -0.05 -0.09 -1.93 0.00 0.00 178.83 177.09 2fvt h ARG 60 N 0.03 0.00 0.02 1.69 2.43 -1.84 0.17 114.38 116.87 2fvt h ARG 60 Ca 0.12 0.00 -0.06 0.00 -0.81 0.00 0.00 59.98 59.23 2fvt h ARG 60 Cb 0.17 0.00 0.01 0.00 -0.42 0.00 0.00 29.97 29.73 2fvt h ARG 60 CO -0.23 0.05 -0.25 0.28 -1.51 0.00 0.00 179.97 178.31 2fvt h VAL 61 N 0.00 1.60 0.00 0.20 2.07 -1.30 -3.09 116.25 115.73 2fvt h VAL 61 Ca -0.00 -2.09 -0.05 0.00 0.82 0.00 0.00 66.70 65.37 2fvt h VAL 61 Cb 0.17 2.96 -0.01 0.00 -1.52 0.00 0.00 31.29 32.90 2fvt h VAL 61 CO 0.01 0.57 -0.24 -0.26 0.02 0.00 0.00 177.57 177.66 2fvt h PHE 62 N -0.61 0.00 -0.07 1.57 0.04 -0.33 0.52 116.94 118.06 2fvt h PHE 62 Ca -0.04 0.00 -0.02 0.00 2.80 0.00 0.00 57.97 60.71 2fvt h PHE 62 Cb 1.06 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 39.21 2fvt h PHE 62 CO 0.20 0.24 -0.07 0.22 -0.60 0.00 0.00 178.31 178.31 2fvt h ASP 63 N 0.00 0.09 0.00 2.17 3.58 -0.71 -2.93 116.42 118.62 2fvt h ASP 63 Ca -0.00 -0.01 -0.01 0.00 0.42 0.00 0.00 57.03 57.43 2fvt h ASP 63 Cb 0.43 -0.02 -0.02 0.00 1.72 0.00 0.00 39.33 41.44 2fvt h ASP 63 CO 0.03 0.17 -0.27 0.59 -2.88 0.00 0.00 179.24 176.88 2fvt n ASN 64 N -4.40 1.82 0.29 2.28 3.02 -0.80 -4.78 115.26 112.69 2fvt n ASN 64 Ca -0.02 -3.17 0.15 0.00 -0.03 0.00 0.00 54.58 51.52 2fvt n ASN 64 Cb 0.18 -0.43 0.87 0.00 -0.61 0.00 0.00 39.78 39.79 2fvt n ASN 64 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2fvt h ALA 65 N 0.38 1.31 0.00 5.41 0.00 -0.72 -0.94 119.26 124.69 2fvt h ALA 65 Ca -0.01 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.85 2fvt h ALA 65 Cb 1.10 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.88 2fvt h ALA 65 CO 0.01 0.07 0.00 -0.91 0.00 0.00 0.00 179.25 178.41 2fvt h ASN 66 N 0.00 0.00 -0.37 0.00 4.21 -1.86 -1.67 115.58 115.89 2fvt h ASN 66 Ca -0.00 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.51 2fvt h ASN 66 Cb 0.18 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.38 2fvt h ASN 66 CO 0.01 0.00 0.00 0.00 -1.29 0.00 0.00 177.43 176.15 2fvt n ALA 67 N -2.03 2.34 -3.03 -0.83 0.00 -0.36 -4.94 120.51 111.66 2fvt n ALA 67 Ca -0.00 -1.03 -0.33 0.00 0.00 0.00 0.00 53.44 52.08 2fvt n ALA 67 Cb 0.22 -0.64 -0.14 0.00 0.00 0.00 0.00 19.45 18.89 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 -1.14 3.29 -0.07 0.00 1.01 -0.63 -4.71 121.20 118.95 2fvt s ILE 68 Ca 0.31 -0.58 -0.03 0.00 0.00 0.00 0.00 60.65 60.35 2fvt s ILE 68 Cb 0.17 -2.40 -0.03 0.00 0.01 0.00 0.00 42.46 40.21 2fvt s ILE 68 CO 0.23 0.52 -0.09 -0.67 0.00 0.00 0.00 174.94 174.93 2fvt n ASP 69 N 3.50 1.19 -4.08 3.58 -0.08 0.11 -4.29 116.55 116.48 2fvt n ASP 69 Ca -0.18 0.06 -0.29 0.00 -1.51 0.00 0.00 54.79 52.88 2fvt n ASP 69 Cb 0.53 -0.19 -0.17 0.00 2.34 0.00 0.00 41.12 43.63 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 -2.14 1.56 -0.30 5.18 2.01 0.12 -0.68 115.64 121.40 2fvt s THR 70 Ca -0.10 -0.69 -0.06 0.00 0.31 0.00 0.00 61.69 61.15 2fvt s THR 70 Cb 0.04 -1.41 0.02 0.00 0.01 0.00 0.00 72.50 71.16 2fvt s THR 70 CO 0.14 0.45 0.06 -0.22 -0.69 0.00 0.00 174.62 174.36 2fvt s LEU 71 N 0.85 3.91 -0.37 4.42 2.96 0.96 -0.22 118.68 131.18 2fvt s LEU 71 Ca -0.09 -0.91 -0.12 0.00 -0.22 0.00 0.00 54.13 52.79 2fvt s LEU 71 Cb -0.15 -1.84 0.02 0.00 0.50 0.00 0.00 46.19 44.72 2fvt s LEU 71 CO 0.00 -0.23 0.22 -0.63 -1.32 0.00 0.00 176.35 174.39 2fvt s ILE 72 N 1.43 4.76 -0.35 6.68 1.01 0.12 -1.06 121.20 133.79 2fvt s ILE 72 Ca 0.00 -0.73 -0.17 0.00 0.00 0.00 0.00 60.65 59.75 2fvt s ILE 72 Cb -0.18 -3.61 -0.01 0.00 0.01 0.00 0.00 42.46 38.67 2fvt s ILE 72 CO 0.01 -0.20 0.47 -0.69 0.00 0.00 0.00 174.94 174.54 2fvt s VAL 73 N 1.60 5.06 -0.56 2.92 1.01 0.11 -0.59 120.40 129.94 2fvt s VAL 73 Ca 0.03 0.24 -0.26 0.00 0.00 0.00 0.00 61.98 61.99 2fvt s VAL 73 Cb -0.19 -3.93 0.03 0.00 0.00 0.00 0.00 36.38 32.30 2fvt s VAL 73 CO 0.07 -0.19 1.08 -0.83 0.00 0.00 0.00 175.10 175.23 2fvt s GLY 74 N 1.75 1.26 0.00 4.51 0.00 0.13 -1.25 107.32 113.72 2fvt s GLY 74 Ca 0.17 -1.00 0.29 0.00 0.00 0.00 0.00 44.72 44.17 2fvt s GLY 74 CO 0.13 2.30 1.82 2.41 0.00 0.00 0.00 173.10 179.75 2fvt n THR 75 N 6.46 0.00 0.00 0.90 -1.04 0.14 -1.52 114.28 119.23 2fvt n THR 75 Ca 0.06 -0.17 0.00 0.00 -2.04 0.00 0.00 64.05 61.89 2fvt n THR 75 Cb 0.48 0.26 0.00 0.00 -1.82 0.00 0.00 70.33 69.25 2fvt n THR 75 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2fvt n GLY 76 N 1.17 0.92 0.61 3.41 0.00 -1.26 -4.30 105.19 105.74 2fvt n GLY 76 Ca 0.19 -1.02 0.06 0.00 0.00 0.00 0.00 46.02 45.25 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 2.30 -3.09 4.61 0.00 -1.26 -1.03 120.51 123.83 2fvt n ALA 77 Ca 0.00 -0.95 -0.12 0.00 0.00 0.00 0.00 53.44 52.38 2fvt n ALA 77 Cb 0.00 -0.45 -0.09 0.00 0.00 0.00 0.00 19.45 18.91 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 -1.00 -0.05 -0.48 0.00 2.15 -1.26 -5.00 116.67 111.03 2fvt s ASP 78 Ca 0.21 -0.15 -0.21 0.00 0.43 0.00 0.00 52.55 52.83 2fvt s ASP 78 Cb 0.12 0.27 0.04 0.00 -0.30 0.00 0.00 42.92 43.04 2fvt s ASP 78 CO 0.16 -0.45 0.71 -0.69 -0.17 0.00 0.00 175.17 174.73 2fvt s VAL 79 N -1.70 4.73 0.10 1.11 1.01 -1.26 -4.54 120.40 119.85 2fvt s VAL 79 Ca -0.12 0.04 -0.21 0.00 0.00 0.00 0.00 61.98 61.70 2fvt s VAL 79 Cb -0.05 -4.31 -0.07 0.00 0.00 0.00 0.00 36.38 31.95 2fvt s VAL 79 CO 0.01 -0.76 0.62 0.86 0.00 0.00 0.00 175.10 175.83 2fvt s TRP 80 N 3.05 3.83 -0.66 5.22 -0.00 -1.26 -5.02 118.94 124.10 2fvt s TRP 80 Ca 0.23 1.36 -0.23 0.00 -0.00 0.00 0.00 56.10 57.46 2fvt s TRP 80 Cb -0.15 -2.56 0.06 0.00 -0.00 0.00 0.00 33.47 30.83 2fvt s TRP 80 CO 0.18 0.57 0.99 0.42 -0.00 0.00 0.00 176.95 179.11 2fvt s ILE 81 N -1.12 4.28 0.37 5.86 1.01 -1.26 -4.86 121.20 125.47 2fvt s ILE 81 Ca 0.31 -0.23 -0.28 0.00 0.00 0.00 0.00 60.65 60.45 2fvt s ILE 81 Cb -0.20 -4.69 -0.11 0.00 0.01 0.00 0.00 42.46 37.46 2fvt s ILE 81 CO 0.21 -1.46 1.44 0.00 0.00 0.00 0.00 174.94 175.12 2fvt n ALA 82 N 7.83 2.10 -1.66 9.38 0.00 -1.26 -4.88 120.51 132.02 2fvt n ALA 82 Ca -0.03 0.35 -0.45 0.00 0.00 0.00 0.00 53.44 53.30 2fvt n ALA 82 Cb 0.46 -2.38 -0.03 0.00 0.00 0.00 0.00 19.45 17.50 2fvt n ALA 82 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 2fvt n PRO 83 N 0.47 1.90 -0.15 0.00 -0.02 -1.26 -4.81 135.00 131.12 2fvt n PRO 83 Ca 0.02 0.68 -0.03 0.00 -2.02 0.00 0.00 63.50 62.14 2fvt n PRO 83 Cb 0.38 -2.31 0.06 0.00 -0.02 0.00 0.00 33.50 31.60 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 4.16 0.31 -0.35 -0.52 9.65 -1.99 0.12 114.38 125.76 2fvt h ARG 84 Ca -0.45 -0.02 -0.01 0.00 -1.10 0.00 0.00 59.98 58.41 2fvt h ARG 84 Cb 1.29 -0.07 -0.02 0.00 -1.39 0.00 0.00 29.97 29.78 2fvt h ARG 84 CO 0.75 0.20 0.19 0.37 2.80 0.00 0.00 179.97 184.29 2fvt h GLN 85 N 0.32 0.49 -0.90 0.20 -0.00 -1.98 0.87 115.11 114.10 2fvt h GLN 85 Ca 0.23 -0.06 -0.02 0.00 -0.00 0.00 0.00 58.65 58.80 2fvt h GLN 85 Cb 0.25 -0.10 -0.04 0.00 0.00 0.00 0.00 27.48 27.60 2fvt h GLN 85 CO -0.25 0.41 0.49 1.25 0.00 0.00 0.00 178.83 180.73 2fvt h LEU 86 N 0.44 1.13 -0.39 -2.39 5.85 -1.81 0.19 115.31 118.34 2fvt h LEU 86 Ca 0.12 -0.10 -0.01 0.00 0.84 0.00 0.00 57.88 58.73 2fvt h LEU 86 Cb 0.06 -0.29 -0.02 0.00 0.37 0.00 0.00 40.66 40.79 2fvt h LEU 86 CO -0.02 0.91 0.20 -0.09 -0.34 0.00 0.00 178.44 179.10 2fvt h ARG 87 N 1.26 0.56 0.00 1.25 2.43 -0.33 -1.97 114.38 117.58 2fvt h ARG 87 Ca 0.32 -0.08 -0.07 0.00 -0.81 0.00 0.00 59.98 59.34 2fvt h ARG 87 Cb 0.03 -0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 29.47 2fvt h ARG 87 CO -0.05 0.48 -0.32 1.49 -1.51 0.00 0.00 179.97 180.05 2fvt h GLU 88 N 0.50 0.00 -0.04 0.20 4.81 -0.15 0.16 114.58 120.06 2fvt h GLU 88 Ca 0.14 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.36 2fvt h GLU 88 Cb 0.09 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.47 2fvt h GLU 88 CO -0.02 0.32 -0.00 0.00 -0.73 0.00 0.00 179.01 178.58 2fvt h ALA 89 N 1.68 0.06 -0.56 2.92 0.00 -0.28 0.26 119.26 123.34 2fvt h ALA 89 Ca -0.00 -0.18 -0.05 0.00 0.00 0.00 0.00 54.91 54.67 2fvt h ALA 89 Cb 0.68 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.43 2fvt h ALA 89 CO 0.04 -0.26 0.14 -0.07 0.00 0.00 0.00 179.25 179.10 2fvt h LEU 90 N -0.24 0.85 -1.70 0.00 3.38 -1.11 -2.33 115.31 114.16 2fvt h LEU 90 Ca 0.01 -0.23 -0.03 0.00 0.09 0.00 0.00 57.88 57.72 2fvt h LEU 90 Cb 0.36 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 2fvt h LEU 90 CO 0.00 0.86 -0.11 -0.09 0.09 0.00 0.00 178.44 179.19 2fvt h ARG 91 N 0.79 0.04 0.00 1.13 1.12 -0.11 0.51 114.38 117.87 2fvt h ARG 91 Ca 0.18 -0.01 -0.08 0.00 -1.11 0.00 0.00 59.98 58.96 2fvt h ARG 91 Cb 0.34 -0.01 -0.01 0.00 -0.01 0.00 0.00 29.97 30.28 2fvt h ARG 91 CO 0.00 0.16 -0.37 0.78 -3.11 0.00 0.00 179.97 177.44 2fvt h GLY 92 N 0.43 0.00 0.00 2.80 0.00 0.09 -3.37 103.07 103.02 2fvt h GLY 92 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.34 2fvt h GLY 92 CO 0.02 0.00 0.00 -0.62 0.00 0.00 0.00 176.54 175.94 2fvt n VAL 93 N -4.03 0.00 -1.40 4.60 0.31 -0.58 -4.98 118.33 112.24 2fvt n VAL 93 Ca -0.02 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.31 2fvt n VAL 93 Cb 0.41 -0.15 0.00 0.00 -0.91 0.00 0.00 33.84 33.19 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 -0.57 0.00 -4.24 4.52 5.15 -0.81 -5.12 115.26 114.20 2fvt n ASN 94 Ca 0.00 -0.59 -0.34 0.00 -0.60 0.00 0.00 54.58 53.04 2fvt n ASN 94 Cb 0.00 0.00 -0.15 0.00 -0.53 0.00 0.00 39.78 39.10 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 0.00 2.91 -0.17 3.44 1.01 0.07 -4.05 120.40 123.61 2fvt s VAL 95 Ca 0.00 -0.69 -0.25 0.00 0.00 0.00 0.00 61.98 61.04 2fvt s VAL 95 Cb 0.00 -2.31 -0.02 0.00 0.00 0.00 0.00 36.38 34.05 2fvt s VAL 95 CO 0.00 0.44 0.82 -0.69 0.00 0.00 0.00 175.10 175.67 2fvt s VAL 96 N 1.40 4.89 -0.44 2.92 1.01 0.15 -2.07 120.40 128.26 2fvt s VAL 96 Ca 0.05 1.61 -0.15 0.00 0.00 0.00 0.00 61.98 63.49 2fvt s VAL 96 Cb -0.14 -4.13 0.04 0.00 0.00 0.00 0.00 36.38 32.15 2fvt s VAL 96 CO -0.06 0.04 0.35 -0.22 0.00 0.00 0.00 175.10 175.20 2fvt s LEU 97 N 2.09 5.32 -0.00 3.92 2.96 -1.26 -0.02 118.68 131.69 2fvt s LEU 97 Ca 0.38 -1.08 0.05 0.00 -0.22 0.00 0.00 54.13 53.26 2fvt s LEU 97 Cb -0.17 -2.18 -0.03 0.00 0.50 0.00 0.00 46.19 44.32 2fvt s LEU 97 CO 0.13 -0.54 -0.16 -0.62 -1.32 0.00 0.00 176.35 173.84 2fvt s ASP 98 N 2.08 3.95 -0.07 3.68 -1.08 -0.22 -5.01 116.67 119.99 2fvt s ASP 98 Ca 0.05 -0.31 0.02 0.00 -0.52 0.00 0.00 52.55 51.79 2fvt s ASP 98 Cb -0.21 -0.75 0.02 0.00 -1.46 0.00 0.00 42.92 40.52 2fvt s ASP 98 CO 0.09 0.30 -0.11 -0.89 0.52 0.00 0.00 175.17 175.08 2fvt s THR 99 N -0.85 1.07 0.37 1.71 2.01 -1.26 -0.71 115.64 117.98 2fvt s THR 99 Ca 0.14 -0.41 -0.14 0.00 0.31 0.00 0.00 61.69 61.59 2fvt s THR 99 Cb -0.11 -1.01 0.04 0.00 0.01 0.00 0.00 72.50 71.44 2fvt s THR 99 CO 0.03 0.35 0.73 0.00 -0.69 0.00 0.00 174.62 175.04 2fvt s MET 100 N 0.92 2.16 0.86 4.92 0.23 -0.38 -4.86 119.30 123.15 2fvt s MET 100 Ca -0.10 -1.48 -0.10 0.00 -1.03 0.00 0.00 55.69 52.98 2fvt s MET 100 Cb -0.15 0.59 0.11 0.00 -1.53 0.00 0.00 34.83 33.85 2fvt s MET 100 CO 0.01 -0.99 1.11 -0.65 -2.03 0.00 0.00 175.02 172.47 2fvt s GLN 101 N -2.53 1.55 0.21 3.16 1.11 -1.26 0.28 119.66 122.17 2fvt s GLN 101 Ca 0.18 1.30 -0.09 0.00 0.01 0.00 0.00 55.36 56.76 2fvt s GLN 101 Cb -0.04 -1.81 0.14 0.00 -1.01 0.00 0.00 33.01 30.29 2fvt s GLN 101 CO 0.13 -2.18 1.77 1.79 0.01 0.00 0.00 175.29 176.81 2fvt h THR 102 N -1.53 1.26 0.27 -0.19 1.35 -1.37 -1.79 112.91 110.90 2fvt h THR 102 Ca -0.44 -0.80 -0.01 0.00 -0.55 0.00 0.00 66.41 64.61 2fvt h THR 102 Cb 1.25 0.36 -0.02 0.00 -1.73 0.00 0.00 68.15 68.01 2fvt h THR 102 CO 0.47 0.33 -0.30 1.23 -0.25 0.00 0.00 175.52 177.00 2fvt h GLY 103 N 1.10 -1.06 1.16 5.82 0.00 -1.93 -0.25 103.07 107.92 2fvt h GLY 103 Ca 0.25 0.49 0.08 0.00 0.00 0.00 0.00 47.33 48.15 2fvt h GLY 103 CO -0.02 -0.33 0.37 -2.55 0.00 0.00 0.00 176.54 174.00 2fvt h PRO 104 N -0.58 0.40 -0.38 4.80 0.11 -1.95 -2.08 132.00 132.32 2fvt h PRO 104 Ca -0.03 -0.02 -0.04 0.00 0.11 0.00 0.00 66.00 66.01 2fvt h PRO 104 Cb 0.51 -0.09 -0.02 0.00 0.11 0.00 0.00 31.00 31.51 2fvt h PRO 104 CO -0.06 0.26 0.09 0.00 -0.21 0.00 0.00 178.00 178.09 2fvt h ALA 105 N 1.72 0.51 -0.74 -0.75 0.00 -0.97 0.22 119.26 119.25 2fvt h ALA 105 Ca 0.25 -0.19 -0.06 0.00 0.00 0.00 0.00 54.91 54.91 2fvt h ALA 105 Cb 0.44 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.05 2fvt h ALA 105 CO -0.06 0.19 0.23 0.82 0.00 0.00 0.00 179.25 180.42 2fvt h ILE 106 N 0.48 1.26 -0.24 0.00 2.04 -0.62 -1.81 117.51 118.62 2fvt h ILE 106 Ca 0.12 -0.90 -0.03 0.00 1.00 0.00 0.00 64.86 65.04 2fvt h ILE 106 Cb 0.31 0.45 -0.01 0.00 -0.74 0.00 0.00 36.82 36.84 2fvt h ILE 106 CO 0.00 0.36 0.01 -0.09 0.00 0.00 0.00 178.15 178.43 2fvt h ARG 107 N 1.09 0.41 -0.58 2.37 2.43 -1.02 -1.16 114.38 117.93 2fvt h ARG 107 Ca 0.24 -0.12 -0.10 0.00 -0.81 0.00 0.00 59.98 59.19 2fvt h ARG 107 Cb 0.30 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 29.79 2fvt h ARG 107 CO -0.01 0.58 -0.02 1.79 -1.51 0.00 0.00 179.97 180.80 2fvt h THR 108 N 0.20 1.27 -0.41 0.20 1.35 -0.49 -1.74 112.91 113.28 2fvt h THR 108 Ca 0.07 -1.17 -0.00 0.00 -0.55 0.00 0.00 66.41 64.76 2fvt h THR 108 Cb 0.38 0.86 -0.02 0.00 -1.73 0.00 0.00 68.15 67.64 2fvt h THR 108 CO 0.01 0.42 0.25 0.22 -0.25 0.00 0.00 175.52 176.16 2fvt h TYR 109 N 0.92 0.54 -0.64 4.73 3.20 -1.28 0.12 116.97 124.56 2fvt h TYR 109 Ca 0.16 -0.00 0.12 0.00 3.14 0.00 0.00 58.73 62.15 2fvt h TYR 109 Cb 0.58 -0.18 -0.04 0.00 1.54 0.00 0.00 36.73 38.63 2fvt h TYR 109 CO 0.04 0.39 0.43 -0.97 -1.64 0.00 0.00 178.16 176.41 2fvt h ASN 110 N 0.54 0.34 0.01 -2.11 -0.73 -0.84 0.49 115.58 113.28 2fvt h ASN 110 Ca 0.15 0.01 -0.00 0.00 1.87 0.00 0.00 56.30 58.33 2fvt h ASN 110 Cb 0.01 -0.06 0.00 0.00 0.27 0.00 0.00 38.32 38.54 2fvt h ASN 110 CO -0.03 0.19 -0.00 0.40 -0.37 0.00 0.00 177.43 177.62 2fvt h ILE 111 N 0.37 1.20 -0.19 2.57 2.04 -0.69 -3.34 117.51 119.46 2fvt h ILE 111 Ca 0.30 -1.86 -0.06 0.00 1.00 0.00 0.00 64.86 64.24 2fvt h ILE 111 Cb 0.69 2.25 -0.01 0.00 -0.74 0.00 0.00 36.82 39.01 2fvt h ILE 111 CO -0.08 0.40 -0.14 0.24 0.00 0.00 0.00 178.15 178.57 2fvt h MET 112 N -0.99 0.32 0.00 2.37 2.86 -0.45 -1.85 114.93 117.19 2fvt h MET 112 Ca -0.00 -0.08 -0.03 0.00 -2.06 0.00 0.00 59.70 57.53 2fvt h MET 112 Cb 0.67 -0.04 -0.00 0.00 0.06 0.00 0.00 31.60 32.28 2fvt h MET 112 CO 0.00 0.46 -0.14 0.97 1.06 0.00 0.00 176.91 179.27 2fvt h ILE 113 N 0.30 0.54 -0.01 -1.22 6.09 -1.07 -1.95 117.51 120.19 2fvt h ILE 113 Ca 0.06 -0.64 -0.11 0.00 -1.37 0.00 0.00 64.86 62.79 2fvt h ILE 113 Cb 0.44 1.43 -0.02 0.00 0.47 0.00 0.00 36.82 39.14 2fvt h ILE 113 CO 0.03 0.13 -0.52 1.23 -3.07 0.00 0.00 178.15 175.95 2fvt h GLY 114 N 1.10 0.02 -0.67 8.18 0.00 -1.45 -2.52 103.07 107.73 2fvt h GLY 114 Ca -0.00 -0.02 0.00 0.00 0.00 0.00 0.00 47.33 47.31 2fvt h GLY 114 CO 0.02 0.02 0.00 1.18 0.00 0.00 0.00 176.54 177.75 2fvt n GLU 115 N -3.93 1.69 -2.75 4.80 -0.58 -0.75 -4.91 120.64 114.21 2fvt n GLU 115 Ca -0.01 -1.03 -0.22 0.00 -0.42 0.00 0.00 57.16 55.48 2fvt n GLU 115 Cb 0.53 -1.42 0.02 0.00 -0.57 0.00 0.00 31.44 29.99 2fvt n GLU 115 CO 0.00 0.00 0.00 -2.13 -0.48 0.00 0.00 177.13 174.52 2fvt n ARG 116 N 0.25 -3.49 -2.90 3.49 0.63 -0.95 -4.98 116.66 108.72 2fvt n ARG 116 Ca 0.17 0.95 -0.36 0.00 -0.92 0.00 0.00 57.85 57.69 2fvt n ARG 116 Cb 0.33 -5.73 -0.06 0.00 0.45 0.00 0.00 32.46 27.45 2fvt n ARG 116 CO 0.00 0.00 0.00 0.50 -2.51 0.00 0.00 177.63 175.62 2fvt s ARG 117 N -5.42 4.41 -1.03 -0.14 3.52 -1.09 -4.93 118.95 114.27 2fvt s ARG 117 Ca 0.17 1.13 -0.22 0.00 -0.13 0.00 0.00 55.73 56.69 2fvt s ARG 117 Cb -0.08 -2.72 -0.11 0.00 -1.56 0.00 0.00 34.95 30.49 2fvt s ARG 117 CO 0.21 0.26 1.92 0.54 -0.81 0.00 0.00 175.30 177.43 2fvt n ARG 118 N 0.39 1.68 -4.18 5.12 1.74 -1.26 -4.66 116.66 115.49 2fvt n ARG 118 Ca 0.02 -2.26 -0.34 0.00 -0.77 0.00 0.00 57.85 54.49 2fvt n ARG 118 Cb 0.51 -3.37 -0.11 0.00 -1.02 0.00 0.00 32.46 28.47 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 8.01 4.32 -0.18 1.55 0.11 -1.26 0.07 120.40 133.02 2fvt s VAL 119 Ca 0.63 -0.20 -0.01 0.00 -2.93 0.00 0.00 61.98 59.47 2fvt s VAL 119 Cb 0.06 -2.93 0.01 0.00 -1.53 0.00 0.00 36.38 31.99 2fvt s VAL 119 CO 0.12 0.47 -0.14 0.00 -3.33 0.00 0.00 175.10 172.22 2fvt s ALA 120 N 0.45 2.50 -0.40 1.54 0.00 0.69 -3.34 121.76 123.20 2fvt s ALA 120 Ca -0.00 -1.16 -0.13 0.00 0.00 0.00 0.00 51.96 50.66 2fvt s ALA 120 Cb -0.13 -1.33 0.03 0.00 0.00 0.00 0.00 23.12 21.68 2fvt s ALA 120 CO 0.02 -0.29 0.27 0.00 0.00 0.00 0.00 175.76 175.76 2fvt s ALA 121 N 1.22 3.41 -0.73 0.00 0.00 0.36 -0.70 121.76 125.32 2fvt s ALA 121 Ca 0.03 -1.76 -0.18 0.00 0.00 0.00 0.00 51.96 50.05 2fvt s ALA 121 Cb -0.14 -2.79 0.13 0.00 0.00 0.00 0.00 23.12 20.32 2fvt s ALA 121 CO -0.07 -1.46 0.84 0.00 0.00 0.00 0.00 175.76 175.07 2fvt s ALA 122 N 1.62 3.51 -0.34 0.00 0.00 0.24 -0.46 121.76 126.33 2fvt s ALA 122 Ca 0.04 -2.55 -0.13 0.00 0.00 0.00 0.00 51.96 49.32 2fvt s ALA 122 Cb -0.19 -3.68 -0.01 0.00 0.00 0.00 0.00 23.12 19.23 2fvt s ALA 122 CO 0.08 -2.53 0.23 -0.51 0.00 0.00 0.00 175.76 173.04 2fvt s LEU 123 N 2.30 4.51 -0.19 0.00 1.43 -0.42 0.17 118.68 126.48 2fvt s LEU 123 Ca 0.19 -0.48 -0.12 0.00 -1.03 0.00 0.00 54.13 52.69 2fvt s LEU 123 Cb -0.16 -2.12 -0.05 0.00 0.03 0.00 0.00 46.19 43.89 2fvt s LEU 123 CO -0.00 -0.25 0.23 -0.63 0.23 0.00 0.00 176.35 175.93 2fvt s ILE 124 N 1.70 5.34 0.46 -0.59 1.01 -0.57 -1.15 121.20 127.39 2fvt s ILE 124 Ca 0.06 0.38 -0.22 0.00 0.00 0.00 0.00 60.65 60.87 2fvt s ILE 124 Cb -0.17 -3.57 -0.08 0.00 0.01 0.00 0.00 42.46 38.65 2fvt s ILE 124 CO 0.10 0.38 1.08 0.00 0.00 0.00 0.00 174.94 176.49 2fvt s ALA 125 N 0.67 2.94 0.26 9.38 0.00 0.78 -4.09 121.76 131.69 2fvt s ALA 125 Ca 0.12 0.73 -0.30 0.00 0.00 0.00 0.00 51.96 52.51 2fvt s ALA 125 Cb -0.13 -3.30 -0.10 0.00 0.00 0.00 0.00 23.12 19.59 2fvt s ALA 125 CO 0.03 -0.40 1.48 0.14 0.00 0.00 0.00 175.76 177.00 2fvt s VAL 126 N -1.77 2.53 -2.00 0.00 -7.23 -1.26 -4.87 120.40 105.80 2fvt s VAL 126 Ca 0.64 0.44 0.16 0.00 -1.81 0.00 0.00 61.98 61.42 2fvt s VAL 126 Cb -0.21 -3.28 0.45 0.00 0.56 0.00 0.00 36.38 33.89 2fvt s VAL 126 CO 0.26 0.07 1.41 -0.81 -0.31 0.00 0.00 175.10 175.72 2fvt n PRO 127 N 2.33 0.70 -1.91 4.82 -0.04 -1.26 -4.88 135.00 134.76 2fvt n PRO 127 Ca 0.07 0.00 -0.01 0.00 -0.04 0.00 0.00 63.50 63.53 2fvt n PRO 127 Cb 0.40 -1.35 -0.00 0.00 -0.04 0.00 0.00 33.50 32.50 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 -0.85 -4.93 0.00 1.53 4.77 -1.26 -5.07 117.00 111.19 2fvt n LEU 128 Ca 0.12 1.78 0.00 0.00 -0.03 0.00 0.00 56.01 57.87 2fvt n LEU 128 Cb 0.05 -2.45 0.00 0.00 -2.33 0.00 0.00 43.42 38.70 2fvt n LEU 128 CO 0.09 -1.99 0.00 -1.84 -1.33 0.00 0.00 177.39 172.32 2fvt n GLU 129 N 1.16 3.09 -1.55 3.23 0.28 -1.26 -4.83 120.64 120.75 2fvt n GLU 129 Ca -0.04 0.00 -0.60 0.00 -0.16 0.00 0.00 57.16 56.36 2fvt n GLU 129 Cb 0.07 0.00 -0.09 0.00 1.43 0.00 0.00 31.44 32.84 2fvt n GLU 129 CO 0.00 0.00 0.00 1.58 -0.16 0.00 0.00 177.13 178.55 2fvt n HIS 130 N 0.00 1.65 -2.71 -1.84 -0.00 -1.26 -4.91 115.22 106.16 2fvt n HIS 130 Ca 0.00 0.74 -0.37 0.00 -0.00 0.00 0.00 57.72 58.08 2fvt n HIS 130 Cb 0.00 -2.36 -0.06 0.00 -0.00 0.00 0.00 29.99 27.57 2fvt n HIS 130 CO 0.00 0.00 0.00 -1.01 -0.00 0.00 0.00 176.34 175.33 2fvt s HIS 131 N 4.66 3.64 -0.74 1.57 3.76 -1.26 -3.97 115.29 122.95 2fvt s HIS 131 Ca 1.08 1.77 -0.00 0.00 -0.15 0.00 0.00 55.06 57.75 2fvt s HIS 131 Cb -1.28 -2.99 0.00 0.00 1.11 0.00 0.00 32.58 29.41 2fvt s HIS 131 CO 0.68 0.02 0.70 0.72 -0.85 0.00 0.00 174.74 176.01 2fvt n HIS 132 N 0.59 -2.97 -2.72 1.40 8.25 -1.26 -4.88 115.22 113.64 2fvt n HIS 132 Ca 0.02 1.13 -0.43 0.00 -0.26 0.00 0.00 57.72 58.18 2fvt n HIS 132 Cb 0.49 -4.07 -0.01 0.00 1.12 0.00 0.00 29.99 27.52 2fvt n HIS 132 CO 0.00 0.00 0.00 -3.38 0.64 0.00 0.00 176.34 173.60 2fvt s HIS 133 N -2.99 2.98 0.00 4.41 -0.00 -1.26 -4.79 115.29 113.64 2fvt s HIS 133 Ca 0.00 -1.62 0.00 0.00 -0.00 0.00 0.00 55.06 53.45 2fvt s HIS 133 Cb -0.00 -4.57 0.00 0.00 -0.00 0.00 0.00 32.58 28.01 2fvt s HIS 133 CO 0.76 -1.68 0.00 1.58 -0.00 0.00 0.00 174.74 175.39 2fvt n HIS 134 N 7.50 0.00 -0.74 0.38 -0.00 -1.26 -5.21 115.22 115.90 2fvt n HIS 134 Ca 0.40 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 58.12 2fvt n HIS 134 Cb 0.46 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.45 2fvt n HIS 134 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.34 177.06