#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fj1 s ILE 2 N 0.00 4.94 -0.06 -0.39 -4.36 -1.26 -3.39 121.20 116.68 1fj1 s ILE 2 Ca 0.00 1.57 -0.27 0.00 -0.26 0.00 0.00 60.65 61.69 1fj1 s ILE 2 Cb 0.00 -4.11 0.06 0.00 1.25 0.00 0.00 42.46 39.67 1fj1 s ILE 2 CO 0.00 0.10 0.61 0.00 0.24 0.00 0.00 174.94 175.89 1fj1 s GLN 3 N 1.70 0.96 -0.24 0.37 -2.07 -0.46 -5.00 119.66 114.92 1fj1 s GLN 3 Ca 0.38 0.24 0.02 0.00 -1.82 0.00 0.00 55.36 54.18 1fj1 s GLN 3 Cb -0.17 0.45 0.05 0.00 -1.09 0.00 0.00 33.01 32.25 1fj1 s GLN 3 CO 0.15 -0.28 -0.12 -0.51 -1.32 0.00 0.00 175.29 173.21 1fj1 s LEU 4 N -1.07 3.05 -0.06 2.60 1.43 -1.26 -1.80 118.68 121.57 1fj1 s LEU 4 Ca -0.10 -1.21 0.04 0.00 -1.03 0.00 0.00 54.13 51.83 1fj1 s LEU 4 Cb -0.01 -1.48 -0.02 0.00 0.03 0.00 0.00 46.19 44.70 1fj1 s LEU 4 CO 0.08 -0.16 -0.16 0.68 0.23 0.00 0.00 176.35 177.02 1fj1 s VAL 5 N 1.18 2.87 0.29 -1.59 -7.23 -0.74 -3.90 120.40 111.28 1fj1 s VAL 5 Ca -0.06 -0.79 0.08 0.00 -1.81 0.00 0.00 61.98 59.41 1fj1 s VAL 5 Cb -0.18 -2.12 -0.04 0.00 0.56 0.00 0.00 36.38 34.60 1fj1 s VAL 5 CO -0.07 0.58 0.15 -1.10 -0.31 0.00 0.00 175.10 174.35 1fj1 s GLN 6 N -0.56 2.58 0.93 4.82 -0.21 -1.26 -0.76 119.66 125.20 1fj1 s GLN 6 Ca 0.08 -1.32 -0.11 0.00 0.02 0.00 0.00 55.36 54.03 1fj1 s GLN 6 Cb -0.11 -2.34 0.15 0.00 1.00 0.00 0.00 33.01 31.70 1fj1 s GLN 6 CO 0.01 0.27 1.10 -1.54 -2.12 0.00 0.00 175.29 173.01 1fj1 s SER 7 N -3.83 3.02 1.12 5.90 1.04 -0.88 -4.99 113.70 115.09 1fj1 s SER 7 Ca 0.35 1.82 -0.18 0.00 0.48 0.00 0.00 55.95 58.42 1fj1 s SER 7 Cb -0.06 -2.41 0.26 0.00 0.10 0.00 0.00 66.02 63.91 1fj1 s SER 7 CO 0.23 -2.97 1.18 -0.83 0.98 0.00 0.00 173.24 171.83 1fj1 s GLY 8 N -2.98 1.64 0.25 7.32 0.00 -1.26 -4.65 107.32 107.64 1fj1 s GLY 8 Ca 0.65 -1.02 -0.31 0.00 0.00 0.00 0.00 44.72 44.04 1fj1 s GLY 8 CO 0.58 -0.18 1.47 -1.55 0.00 0.00 0.00 173.10 173.43 1fj1 n PRO 9 N -4.43 2.22 -4.72 2.90 -0.04 -1.26 -4.74 135.00 124.93 1fj1 n PRO 9 Ca 0.14 0.79 -0.32 0.00 -0.04 0.00 0.00 63.50 64.07 1fj1 n PRO 9 Cb 0.59 -2.49 -0.12 0.00 -0.04 0.00 0.00 33.50 31.44 1fj1 n PRO 9 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1fj1 s GLU 10 N -0.29 2.31 -0.22 0.54 0.41 -0.06 -5.00 118.70 116.39 1fj1 s GLU 10 Ca 0.68 -0.84 -0.00 0.00 -0.41 0.00 0.00 54.97 54.40 1fj1 s GLU 10 Cb -0.61 -2.31 0.06 0.00 -1.78 0.00 0.00 34.13 29.49 1fj1 s GLU 10 CO 0.48 0.58 -0.04 -1.17 -0.49 0.00 0.00 175.26 174.62 1fj1 s LEU 11 N -1.18 2.21 0.28 1.80 2.96 -1.26 -1.02 118.68 122.46 1fj1 s LEU 11 Ca 0.14 -1.06 0.11 0.00 -0.22 0.00 0.00 54.13 53.10 1fj1 s LEU 11 Cb -0.11 -1.04 -0.05 0.00 0.50 0.00 0.00 46.19 45.49 1fj1 s LEU 11 CO 0.04 -0.24 -0.17 -0.54 -1.32 0.00 0.00 176.35 174.12 1fj1 s LYS 12 N 1.51 1.65 0.18 1.98 -0.14 -0.17 -4.98 119.74 119.75 1fj1 s LYS 12 Ca -0.04 -1.77 -0.07 0.00 -1.36 0.00 0.00 55.97 52.73 1fj1 s LYS 12 Cb -0.18 -1.63 -0.06 0.00 -1.68 0.00 0.00 37.83 34.27 1fj1 s LYS 12 CO -0.07 0.26 0.44 0.15 -0.76 0.00 0.00 175.35 175.38 1fj1 s LYS 13 N -3.56 3.69 0.42 1.68 1.02 -1.26 -0.74 119.74 120.99 1fj1 s LYS 13 Ca 0.29 0.05 -0.23 0.00 0.02 0.00 0.00 55.97 56.10 1fj1 s LYS 13 Cb -0.03 -2.77 -0.11 0.00 -0.52 0.00 0.00 37.83 34.40 1fj1 s LYS 13 CO 0.14 0.41 0.81 -2.30 -0.92 0.00 0.00 175.35 173.49 1fj1 n PRO 14 N -0.00 0.99 0.00 -1.68 -0.02 -1.26 -1.67 135.00 131.35 1fj1 n PRO 14 Ca -0.01 0.36 0.00 0.00 -2.02 0.00 0.00 63.50 61.82 1fj1 n PRO 14 Cb 0.52 -1.81 0.00 0.00 -0.02 0.00 0.00 33.50 32.19 1fj1 n PRO 14 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1fj1 n GLY 15 N 1.45 2.79 0.94 -1.23 0.00 0.87 -4.86 105.19 105.14 1fj1 n GLY 15 Ca 0.11 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.05 1fj1 n GLY 15 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1fj1 n GLU 16 N -2.00 -0.55 -4.28 1.61 1.02 -0.67 -3.65 120.64 112.12 1fj1 n GLU 16 Ca 0.00 -0.50 -0.21 0.00 -0.02 0.00 0.00 57.16 56.43 1fj1 n GLU 16 Cb 0.00 -0.35 -0.13 0.00 -0.02 0.00 0.00 31.44 30.94 1fj1 n GLU 16 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 1fj1 s THR 17 N -1.68 1.35 0.03 2.62 2.01 -1.26 -1.29 115.64 117.42 1fj1 s THR 17 Ca 0.18 -1.31 0.03 0.00 0.31 0.00 0.00 61.69 60.91 1fj1 s THR 17 Cb -0.01 -1.24 -0.02 0.00 0.01 0.00 0.00 72.50 71.24 1fj1 s THR 17 CO 0.13 -0.09 -0.10 0.54 -0.69 0.00 0.00 174.62 174.41 1fj1 s VAL 18 N -1.11 0.78 -0.20 3.82 0.11 -0.77 -5.00 120.40 118.01 1fj1 s VAL 18 Ca 0.02 -0.81 -0.00 0.00 -2.93 0.00 0.00 61.98 58.26 1fj1 s VAL 18 Cb -0.09 -0.73 0.05 0.00 -1.53 0.00 0.00 36.38 34.08 1fj1 s VAL 18 CO 0.03 -0.06 -0.05 -0.75 -3.33 0.00 0.00 175.10 170.94 1fj1 s LYS 19 N -0.97 1.47 -0.12 1.54 2.20 -1.26 -1.55 119.74 121.05 1fj1 s LYS 19 Ca -0.01 -0.75 -0.11 0.00 -0.36 0.00 0.00 55.97 54.74 1fj1 s LYS 19 Cb -0.07 -2.33 -0.05 0.00 -1.51 0.00 0.00 37.83 33.88 1fj1 s LYS 19 CO 0.01 -0.54 0.23 0.42 -0.36 0.00 0.00 175.35 175.11 1fj1 s ILE 20 N 1.53 5.35 0.11 5.43 1.01 0.08 -4.92 121.20 129.79 1fj1 s ILE 20 Ca -0.03 0.41 0.06 0.00 0.00 0.00 0.00 60.65 61.09 1fj1 s ILE 20 Cb -0.17 -3.53 -0.04 0.00 0.01 0.00 0.00 42.46 38.73 1fj1 s ILE 20 CO -0.07 0.52 -0.03 -0.94 0.00 0.00 0.00 174.94 174.41 1fj1 s SER 21 N -0.37 4.77 -0.18 3.58 1.04 -1.26 -1.13 113.70 120.14 1fj1 s SER 21 Ca 0.16 -0.29 -0.04 0.00 0.48 0.00 0.00 55.95 56.25 1fj1 s SER 21 Cb -0.13 -1.04 0.06 0.00 0.10 0.00 0.00 66.02 65.01 1fj1 s SER 21 CO 0.04 0.16 0.08 0.00 0.98 0.00 0.00 173.24 174.50 1fj1 s LYS 23 N 2.08 4.22 -0.16 0.00 2.20 0.06 -1.14 119.74 126.98 1fj1 s LYS 23 Ca 0.02 0.07 -0.08 0.00 -0.36 0.00 0.00 55.97 55.62 1fj1 s LYS 23 Cb -0.16 -3.47 -0.04 0.00 -1.51 0.00 0.00 37.83 32.65 1fj1 s LYS 23 CO -0.10 0.15 0.10 0.00 -0.36 0.00 0.00 175.35 175.14 1fj1 s ALA 24 N 0.75 3.61 0.00 3.13 0.00 0.18 -1.79 121.76 127.64 1fj1 s ALA 24 Ca 0.16 -0.70 -0.05 0.00 0.00 0.00 0.00 51.96 51.36 1fj1 s ALA 24 Cb -0.13 -1.98 -0.00 0.00 0.00 0.00 0.00 23.12 21.01 1fj1 s ALA 24 CO 0.05 0.32 0.10 -1.54 0.00 0.00 0.00 175.76 174.69 1fj1 s SER 25 N -0.10 0.07 0.00 0.00 1.04 -0.74 -4.82 113.70 109.14 1fj1 s SER 25 Ca 0.09 -0.25 0.00 0.00 0.48 0.00 0.00 55.95 56.27 1fj1 s SER 25 Cb -0.12 0.18 0.00 0.00 0.10 0.00 0.00 66.02 66.19 1fj1 s SER 25 CO 0.01 -0.34 0.00 0.61 0.98 0.00 0.00 173.24 174.50 1fj1 n GLY 26 N 1.57 0.53 3.74 7.32 0.00 -1.22 -1.36 105.19 115.77 1fj1 n GLY 26 Ca -0.22 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.71 1fj1 n GLY 26 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1fj1 s TYR 27 N -2.23 0.10 -0.65 1.61 -0.85 -1.26 -4.46 117.35 109.60 1fj1 s TYR 27 Ca 0.00 -0.54 -0.27 0.00 -0.52 0.00 0.00 57.07 55.74 1fj1 s TYR 27 Cb 0.00 0.49 0.04 0.00 0.38 0.00 0.00 41.96 42.87 1fj1 s TYR 27 CO 0.00 -1.18 1.18 0.99 -1.52 0.00 0.00 175.55 175.02 1fj1 s THR 28 N -3.75 3.96 0.32 -3.49 2.01 -1.26 -4.87 115.64 108.55 1fj1 s THR 28 Ca 0.17 0.49 0.13 0.00 0.31 0.00 0.00 61.69 62.79 1fj1 s THR 28 Cb -0.04 -4.79 0.34 0.00 0.01 0.00 0.00 72.50 68.02 1fj1 s THR 28 CO 0.09 -1.55 1.42 0.33 -0.69 0.00 0.00 174.62 174.21 1fj1 n PHE 29 N 8.66 0.90 0.61 4.92 7.35 -1.26 -0.10 117.46 138.54 1fj1 n PHE 29 Ca 0.04 1.07 0.09 0.00 -0.76 0.00 0.00 57.45 57.89 1fj1 n PHE 29 Cb 0.48 -1.38 0.39 0.00 0.35 0.00 0.00 39.48 39.33 1fj1 n PHE 29 CO 0.00 0.00 0.00 -2.37 -0.76 0.00 0.00 176.76 173.63 1fj1 n THR 30 N -5.12 0.76 1.43 -2.13 5.66 -1.26 -3.59 114.28 110.02 1fj1 n THR 30 Ca 0.30 0.18 0.14 0.00 -3.05 0.00 0.00 64.05 61.62 1fj1 n THR 30 Cb 1.01 -0.89 0.58 0.00 -1.55 0.00 0.00 70.33 69.48 1fj1 n THR 30 CO 0.00 0.00 0.00 0.47 -3.05 0.00 0.00 175.07 172.49 1fj1 n ASP 31 N -1.55 0.69 -3.86 1.09 8.00 0.86 -4.35 116.55 117.42 1fj1 n ASP 31 Ca 0.04 -0.79 -0.12 0.00 0.71 0.00 0.00 54.79 54.63 1fj1 n ASP 31 Cb 0.22 -0.02 -0.13 0.00 -0.02 0.00 0.00 41.12 41.17 1fj1 n ASP 31 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 1fj1 s TYR 32 N -2.38 -0.03 0.11 1.24 2.02 -1.24 -5.09 117.35 111.98 1fj1 s TYR 32 Ca 0.30 0.08 -0.33 0.00 -0.37 0.00 0.00 57.07 56.75 1fj1 s TYR 32 Cb 0.20 0.00 -0.12 0.00 -0.40 0.00 0.00 41.96 41.64 1fj1 s TYR 32 CO 0.46 -0.05 1.56 0.77 -1.57 0.00 0.00 175.55 176.72 1fj1 h SER 33 N 5.89 -1.54 -1.45 2.29 0.02 -1.88 -3.40 113.55 113.48 1fj1 h SER 33 Ca -0.25 0.17 0.00 0.00 -0.84 0.00 0.00 61.79 60.87 1fj1 h SER 33 Cb 1.21 0.59 0.00 0.00 0.14 0.00 0.00 62.40 64.33 1fj1 h SER 33 CO 0.47 -0.52 0.00 0.80 -1.14 0.00 0.00 176.83 176.44 1fj1 n MET 34 N -5.47 0.00 -3.98 3.45 1.56 -1.26 -3.77 117.12 107.66 1fj1 n MET 34 Ca -0.07 0.24 -0.26 0.00 -0.27 0.00 0.00 57.70 57.34 1fj1 n MET 34 Cb 0.40 -0.37 -0.03 0.00 2.15 0.00 0.00 33.22 35.36 1fj1 n MET 34 CO 0.00 0.00 0.00 0.71 -0.73 0.00 0.00 175.97 175.95 1fj1 s TYR 35 N 0.00 3.41 -0.04 1.12 1.51 0.12 -1.81 117.35 121.66 1fj1 s TYR 35 Ca 0.00 0.07 0.06 0.00 -1.01 0.00 0.00 57.07 56.19 1fj1 s TYR 35 Cb 0.00 -1.62 -0.01 0.00 -0.11 0.00 0.00 41.96 40.22 1fj1 s TYR 35 CO 0.00 0.51 -0.22 -1.58 -1.11 0.00 0.00 175.55 173.15 1fj1 s TRP 36 N -1.77 2.12 -0.04 2.71 0.52 -0.28 -0.26 118.94 121.94 1fj1 s TRP 36 Ca 0.34 -0.56 0.02 0.00 0.02 0.00 0.00 56.10 55.92 1fj1 s TRP 36 Cb -0.11 -1.39 0.01 0.00 -1.15 0.00 0.00 33.47 30.83 1fj1 s TRP 36 CO 0.27 -0.15 -0.08 0.08 0.02 0.00 0.00 176.95 177.10 1fj1 s VAL 37 N -0.23 0.75 -0.15 4.03 1.01 0.45 -0.43 120.40 125.83 1fj1 s VAL 37 Ca 0.00 -0.29 -0.12 0.00 0.00 0.00 0.00 61.98 61.57 1fj1 s VAL 37 Cb -0.12 -0.70 -0.05 0.00 0.00 0.00 0.00 36.38 35.51 1fj1 s VAL 37 CO 0.02 0.26 0.25 -0.75 0.00 0.00 0.00 175.10 174.87 1fj1 s LYS 38 N 0.53 4.11 -0.41 2.72 2.20 0.10 -1.02 119.74 127.98 1fj1 s LYS 38 Ca -0.08 0.03 0.04 0.00 -0.36 0.00 0.00 55.97 55.59 1fj1 s LYS 38 Cb -0.12 -3.38 0.11 0.00 -1.51 0.00 0.00 37.83 32.94 1fj1 s LYS 38 CO 0.01 0.36 0.14 -1.14 -0.36 0.00 0.00 175.35 174.36 1fj1 s GLN 39 N 0.13 1.62 -0.04 4.03 -0.44 0.98 -1.52 119.66 124.43 1fj1 s GLN 39 Ca 0.15 -2.13 -0.04 0.00 -2.50 0.00 0.00 55.36 50.84 1fj1 s GLN 39 Cb -0.13 -3.15 -0.04 0.00 -1.64 0.00 0.00 33.01 28.06 1fj1 s GLN 39 CO 0.03 -1.02 0.17 0.00 0.50 0.00 0.00 175.29 174.97 1fj1 s ALA 40 N 0.45 3.92 0.08 1.58 0.00 -1.26 -0.95 121.76 125.57 1fj1 s ALA 40 Ca 0.14 -0.73 -0.32 0.00 0.00 0.00 0.00 51.96 51.04 1fj1 s ALA 40 Cb -0.22 -1.90 -0.11 0.00 0.00 0.00 0.00 23.12 20.89 1fj1 s ALA 40 CO -0.05 0.71 1.81 -2.30 0.00 0.00 0.00 175.76 175.92 1fj1 n PRO 41 N 1.26 2.55 0.00 0.00 -0.02 -1.26 -0.29 135.00 137.24 1fj1 n PRO 41 Ca -0.14 0.93 0.00 0.00 -2.02 0.00 0.00 63.50 62.27 1fj1 n PRO 41 Cb 0.53 -2.79 0.00 0.00 -0.02 0.00 0.00 33.50 31.22 1fj1 n PRO 41 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1fj1 n GLY 42 N 4.14 3.15 3.96 -1.23 0.00 -1.26 -5.02 105.19 108.93 1fj1 n GLY 42 Ca 0.19 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 46.01 1fj1 n GLY 42 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1fj1 s LYS 43 N -0.35 3.06 0.00 1.61 3.01 0.60 -5.11 119.74 122.55 1fj1 s LYS 43 Ca 0.00 -1.05 0.00 0.00 -1.01 0.00 0.00 55.97 53.91 1fj1 s LYS 43 Cb 0.00 -2.75 0.00 0.00 -1.01 0.00 0.00 37.83 34.07 1fj1 s LYS 43 CO 0.00 0.11 0.00 0.41 0.51 0.00 0.00 175.35 176.38 1fj1 n GLY 44 N -1.55 0.55 3.45 -3.33 0.00 -1.26 -4.44 105.19 98.61 1fj1 n GLY 44 Ca -0.01 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.67 1fj1 n GLY 44 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1fj1 s LEU 45 N 0.00 2.99 -0.05 0.99 1.43 -1.26 -4.06 118.68 118.72 1fj1 s LEU 45 Ca 0.00 -0.21 0.02 0.00 -1.03 0.00 0.00 54.13 52.91 1fj1 s LEU 45 Cb 0.00 -1.69 0.01 0.00 0.03 0.00 0.00 46.19 44.54 1fj1 s LEU 45 CO 0.00 0.19 -0.11 -0.54 0.23 0.00 0.00 176.35 176.12 1fj1 s LYS 46 N 0.24 1.35 0.07 1.70 -0.14 -0.57 -4.97 119.74 117.41 1fj1 s LYS 46 Ca -0.06 -0.36 -0.31 0.00 -1.36 0.00 0.00 55.97 53.89 1fj1 s LYS 46 Cb -0.15 -1.18 -0.06 0.00 -1.68 0.00 0.00 37.83 34.76 1fj1 s LYS 46 CO 0.04 0.06 1.26 0.50 -0.76 0.00 0.00 175.35 176.45 1fj1 s ARG 47 N 0.48 4.39 -0.17 1.68 3.52 -1.26 0.02 118.95 127.60 1fj1 s ARG 47 Ca -0.09 1.86 -0.01 0.00 -0.13 0.00 0.00 55.73 57.36 1fj1 s ARG 47 Cb -0.13 -3.33 -0.22 0.00 -1.56 0.00 0.00 34.95 29.71 1fj1 s ARG 47 CO 0.02 -0.32 0.14 -1.33 -0.81 0.00 0.00 175.30 172.99 1fj1 n MET 48 N 4.02 0.71 -3.64 5.12 2.81 0.43 -4.76 117.12 121.81 1fj1 n MET 48 Ca 0.10 0.21 0.00 0.00 -1.81 0.00 0.00 57.70 56.19 1fj1 n MET 48 Cb 0.45 -1.63 0.00 0.00 -0.71 0.00 0.00 33.22 31.33 1fj1 n MET 48 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1fj1 n GLY 49 N 2.06 -2.01 3.32 3.03 0.00 -1.23 -1.09 105.19 109.27 1fj1 n GLY 49 Ca -0.37 -1.17 -0.09 0.00 0.00 0.00 0.00 46.02 44.39 1fj1 n GLY 49 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 1fj1 s TRP 50 N -2.29 0.26 -0.03 1.61 -2.14 -0.79 -1.13 118.94 114.43 1fj1 s TRP 50 Ca 0.00 -0.63 0.04 0.00 2.66 0.00 0.00 56.10 58.16 1fj1 s TRP 50 Cb 0.00 -0.00 -0.00 0.00 -3.10 0.00 0.00 33.47 30.36 1fj1 s TRP 50 CO 0.00 -0.69 -0.14 -1.50 -2.66 0.00 0.00 176.95 171.97 1fj1 s ILE 51 N -3.92 1.13 -0.25 0.66 2.07 -0.75 -1.36 121.20 118.77 1fj1 s ILE 51 Ca 0.12 -0.57 -0.29 0.00 -1.41 0.00 0.00 60.65 58.50 1fj1 s ILE 51 Cb 0.03 -0.97 -0.01 0.00 0.13 0.00 0.00 42.46 41.65 1fj1 s ILE 51 CO -0.04 0.33 1.43 0.21 -1.91 0.00 0.00 174.94 174.96 1fj1 s ASN 52 N -0.05 6.58 0.51 4.50 3.84 0.42 -4.06 114.94 126.69 1fj1 s ASN 52 Ca -0.00 1.43 0.30 0.00 0.21 0.00 0.00 52.86 54.80 1fj1 s ASN 52 Cb -0.08 -2.54 1.15 0.00 -0.55 0.00 0.00 41.25 39.23 1fj1 s ASN 52 CO 0.01 -1.12 1.91 0.74 -2.79 0.00 0.00 177.10 175.84 1fj1 h THR 53 N 5.99 0.12 0.15 -5.21 2.02 -1.78 0.91 112.91 115.11 1fj1 h THR 53 Ca -0.29 -0.70 -0.32 0.00 0.77 0.00 0.00 66.41 65.86 1fj1 h THR 53 Cb 1.12 1.62 0.00 0.00 -1.74 0.00 0.00 68.15 69.16 1fj1 h THR 53 CO 1.01 0.05 -1.58 -0.08 0.37 0.00 0.00 175.52 175.30 1fj1 h GLU 54 N 0.00 0.32 0.00 6.66 4.81 -1.89 -3.41 114.58 121.07 1fj1 h GLU 54 Ca -0.00 -0.54 0.00 0.00 -0.13 0.00 0.00 59.36 58.68 1fj1 h GLU 54 Cb 0.62 0.20 0.00 0.00 0.63 0.00 0.00 28.75 30.20 1fj1 h GLU 54 CO 0.01 1.21 -1.07 0.25 -0.73 0.00 0.00 179.01 178.67 1fj1 n THR 55 N -3.52 0.00 -0.26 0.32 -2.24 -1.16 -5.02 114.28 102.40 1fj1 n THR 55 Ca -0.18 -0.19 0.00 0.00 -2.27 0.00 0.00 64.05 61.40 1fj1 n THR 55 Cb 1.06 0.50 0.00 0.00 -2.10 0.00 0.00 70.33 69.79 1fj1 n THR 55 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1fj1 n GLY 56 N 1.91 0.99 3.68 3.38 0.00 0.31 -5.02 105.19 110.45 1fj1 n GLY 56 Ca -0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.59 1fj1 n GLY 56 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1fj1 s GLU 57 N -0.55 4.20 -0.01 1.61 2.12 -1.24 -4.66 118.70 120.17 1fj1 s GLU 57 Ca 0.00 2.29 -0.01 0.00 0.36 0.00 0.00 54.97 57.60 1fj1 s GLU 57 Cb 0.00 -3.67 -0.04 0.00 0.26 0.00 0.00 34.13 30.68 1fj1 s GLU 57 CO 0.00 -0.74 0.11 -1.25 -0.54 0.00 0.00 175.26 172.84 1fj1 s PRO 58 N 2.87 3.20 -0.10 4.30 0.04 -1.26 -0.43 135.00 143.62 1fj1 s PRO 58 Ca 0.73 -0.42 0.00 0.00 0.04 0.00 0.00 61.00 61.36 1fj1 s PRO 58 Cb -0.38 -2.95 0.02 0.00 0.04 0.00 0.00 34.50 31.23 1fj1 s PRO 58 CO 0.32 0.66 -0.07 -0.08 0.04 0.00 0.00 177.00 177.87 1fj1 s THR 59 N -1.22 0.94 0.27 1.26 -1.32 -0.46 -5.00 115.64 110.10 1fj1 s THR 59 Ca 0.24 -0.26 0.01 0.00 -1.21 0.00 0.00 61.69 60.47 1fj1 s THR 59 Cb -0.12 -0.95 -0.04 0.00 -1.51 0.00 0.00 72.50 69.88 1fj1 s THR 59 CO 0.15 0.34 0.45 -0.31 -2.21 0.00 0.00 174.62 173.04 1fj1 s TYR 60 N 1.51 3.48 0.23 9.09 2.02 -1.26 -1.89 117.35 130.53 1fj1 s TYR 60 Ca 0.01 0.24 -0.12 0.00 -0.37 0.00 0.00 57.07 56.83 1fj1 s TYR 60 Cb -0.13 -1.79 -0.08 0.00 -0.40 0.00 0.00 41.96 39.56 1fj1 s TYR 60 CO -0.05 0.29 0.60 0.00 -1.57 0.00 0.00 175.55 174.81 1fj1 s ALA 61 N -2.08 3.51 0.30 3.71 0.00 -0.25 -4.94 121.76 122.01 1fj1 s ALA 61 Ca 0.38 -0.15 0.05 0.00 0.00 0.00 0.00 51.96 52.24 1fj1 s ALA 61 Cb -0.10 -2.54 0.81 0.00 0.00 0.00 0.00 23.12 21.29 1fj1 s ALA 61 CO 0.32 0.45 1.64 -0.44 0.00 0.00 0.00 175.76 177.73 1fj1 h ASP 62 N 2.79 0.05 0.09 0.00 3.32 -1.93 0.31 116.42 121.05 1fj1 h ASP 62 Ca -0.48 0.21 0.00 0.00 0.02 0.00 0.00 57.03 56.78 1fj1 h ASP 62 Cb 1.18 0.27 0.00 0.00 0.22 0.00 0.00 39.33 41.00 1fj1 h ASP 62 CO 0.67 -0.19 0.00 0.47 -1.72 0.00 0.00 179.24 178.47 1fj1 n ASP 63 N -5.23 0.00 -2.14 6.45 10.43 -1.26 -3.50 116.55 121.30 1fj1 n ASP 63 Ca 0.24 -0.49 -0.18 0.00 2.57 0.00 0.00 54.79 56.94 1fj1 n ASP 63 Cb 0.77 -0.07 0.03 0.00 1.84 0.00 0.00 41.12 43.70 1fj1 n ASP 63 CO 0.00 0.00 0.00 0.49 -1.07 0.00 0.00 177.20 176.62 1fj1 n PHE 64 N -1.07 2.31 -3.49 1.24 3.72 0.11 -5.04 117.46 115.24 1fj1 n PHE 64 Ca 0.14 -2.16 -0.34 0.00 -0.05 0.00 0.00 57.45 55.04 1fj1 n PHE 64 Cb 0.09 -0.31 -0.05 0.00 -0.94 0.00 0.00 39.48 38.27 1fj1 n PHE 64 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 1fj1 s LYS 65 N -3.60 3.83 0.28 -1.08 -0.14 -1.23 -4.39 119.74 113.41 1fj1 s LYS 65 Ca 0.45 0.27 0.00 0.00 -1.36 0.00 0.00 55.97 55.33 1fj1 s LYS 65 Cb 0.39 -2.90 0.00 0.00 -1.68 0.00 0.00 37.83 33.64 1fj1 s LYS 65 CO 0.02 0.48 0.00 0.41 -0.76 0.00 0.00 175.35 175.50 1fj1 n GLY 66 N 0.61 0.84 0.00 -3.33 0.00 -1.26 -4.59 105.19 97.46 1fj1 n GLY 66 Ca -0.05 -0.68 0.05 0.00 0.00 0.00 0.00 46.02 45.34 1fj1 n GLY 66 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1fj1 n ARG 67 N 0.00 0.09 -4.33 1.61 1.74 -1.26 -4.77 116.66 109.74 1fj1 n ARG 67 Ca 0.00 0.25 -0.33 0.00 -0.77 0.00 0.00 57.85 57.00 1fj1 n ARG 67 Cb 0.00 -1.50 -0.09 0.00 -1.02 0.00 0.00 32.46 29.85 1fj1 n ARG 67 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 1fj1 s PHE 68 N -2.73 3.06 -0.05 -1.55 0.40 -1.26 -1.24 117.98 114.60 1fj1 s PHE 68 Ca 0.08 0.08 -0.04 0.00 -0.60 0.00 0.00 56.93 56.44 1fj1 s PHE 68 Cb 0.07 -1.68 0.01 0.00 0.51 0.00 0.00 43.02 41.93 1fj1 s PHE 68 CO 0.16 0.45 0.13 0.00 0.70 0.00 0.00 175.22 176.66 1fj1 s ALA 69 N -1.04 -0.31 -0.16 5.36 0.00 0.07 -4.95 121.76 120.73 1fj1 s ALA 69 Ca 0.18 0.39 -0.00 0.00 0.00 0.00 0.00 51.96 52.53 1fj1 s ALA 69 Cb -0.11 -0.23 -0.00 0.00 0.00 0.00 0.00 23.12 22.77 1fj1 s ALA 69 CO 0.09 -0.07 -0.14 -0.51 0.00 0.00 0.00 175.76 175.12 1fj1 s LEU 70 N 0.17 2.51 0.26 0.00 1.02 -1.26 0.47 118.68 121.85 1fj1 s LEU 70 Ca -0.01 -0.47 0.02 0.00 0.02 0.00 0.00 54.13 53.69 1fj1 s LEU 70 Cb -0.02 -1.58 -0.04 0.00 0.02 0.00 0.00 46.19 44.57 1fj1 s LEU 70 CO -0.00 0.07 0.15 -0.94 0.02 0.00 0.00 176.35 175.65 1fj1 s SER 71 N 0.91 0.98 0.08 2.29 1.04 -0.71 -4.73 113.70 113.55 1fj1 s SER 71 Ca -0.03 -1.49 -0.09 0.00 0.48 0.00 0.00 55.95 54.82 1fj1 s SER 71 Cb -0.15 0.36 0.00 0.00 0.10 0.00 0.00 66.02 66.34 1fj1 s SER 71 CO -0.01 -0.86 0.20 -1.48 0.98 0.00 0.00 173.24 172.07 1fj1 s LEU 72 N -3.28 1.36 -0.58 2.42 0.05 -1.26 -0.38 118.68 117.01 1fj1 s LEU 72 Ca 0.38 -0.55 0.04 0.00 0.05 0.00 0.00 54.13 54.05 1fj1 s LEU 72 Cb 0.06 1.05 0.15 0.00 -2.05 0.00 0.00 46.19 45.41 1fj1 s LEU 72 CO 0.16 -0.69 0.37 -0.62 -0.55 0.00 0.00 176.35 175.03 1fj1 s ASP 73 N -2.64 4.10 0.41 1.48 -1.08 -0.27 -4.99 116.67 113.70 1fj1 s ASP 73 Ca 0.02 -3.33 0.15 0.00 -0.52 0.00 0.00 52.55 48.86 1fj1 s ASP 73 Cb 0.03 -1.39 1.02 0.00 -1.46 0.00 0.00 42.92 41.11 1fj1 s ASP 73 CO -0.09 -0.16 1.90 0.74 0.52 0.00 0.00 175.17 178.08 1fj1 h THR 74 N 4.85 0.78 0.00 1.71 2.02 -1.95 -0.29 112.91 120.04 1fj1 h THR 74 Ca 0.07 -0.16 -0.00 0.00 0.77 0.00 0.00 66.41 67.09 1fj1 h THR 74 Cb 0.84 0.28 -0.00 0.00 -1.74 0.00 0.00 68.15 67.53 1fj1 h THR 74 CO 0.63 0.08 -0.01 0.77 0.37 0.00 0.00 175.52 177.36 1fj1 h SER 75 N 0.46 0.00 -0.17 4.18 4.64 -1.95 -2.04 113.55 118.68 1fj1 h SER 75 Ca 0.40 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.72 1fj1 h SER 75 Cb 0.88 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.97 1fj1 h SER 75 CO -0.14 0.01 0.00 0.00 -0.87 0.00 0.00 176.83 175.83 1fj1 n ALA 76 N -2.18 2.12 -4.00 5.18 0.00 -0.16 -4.99 120.51 116.48 1fj1 n ALA 76 Ca -0.03 -1.16 -0.26 0.00 0.00 0.00 0.00 53.44 51.99 1fj1 n ALA 76 Cb 0.11 -0.24 -0.03 0.00 0.00 0.00 0.00 19.45 19.29 1fj1 n ALA 76 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1fj1 n SER 77 N -0.05 -0.13 -4.01 0.00 7.64 -0.77 -4.72 113.62 111.59 1fj1 n SER 77 Ca 0.07 -1.04 -0.19 0.00 1.01 0.00 0.00 58.87 58.71 1fj1 n SER 77 Cb 0.37 -2.86 -0.15 0.00 -1.01 0.00 0.00 64.21 60.55 1fj1 n SER 77 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1fj1 s THR 78 N -4.02 0.72 0.25 0.44 2.01 -1.15 -0.65 115.64 113.25 1fj1 s THR 78 Ca 0.00 -0.36 0.09 0.00 0.31 0.00 0.00 61.69 61.73 1fj1 s THR 78 Cb -0.00 -0.63 -0.04 0.00 0.01 0.00 0.00 72.50 71.84 1fj1 s THR 78 CO 0.90 0.22 0.02 0.00 -0.69 0.00 0.00 174.62 175.07 1fj1 s ALA 79 N -0.01 3.21 0.02 7.40 0.00 -0.30 -1.11 121.76 130.97 1fj1 s ALA 79 Ca 0.00 -1.59 0.01 0.00 0.00 0.00 0.00 51.96 50.38 1fj1 s ALA 79 Cb -0.06 -0.85 -0.01 0.00 0.00 0.00 0.00 23.12 22.20 1fj1 s ALA 79 CO -0.00 0.29 -0.05 0.71 0.00 0.00 0.00 175.76 176.71 1fj1 s TYR 80 N -2.23 0.40 -0.21 0.00 2.02 0.49 -1.04 117.35 116.79 1fj1 s TYR 80 Ca 0.31 -0.31 0.01 0.00 -0.37 0.00 0.00 57.07 56.71 1fj1 s TYR 80 Cb -0.07 -0.26 0.03 0.00 -0.40 0.00 0.00 41.96 41.27 1fj1 s TYR 80 CO 0.20 -0.07 -0.16 -1.17 -1.57 0.00 0.00 175.55 172.77 1fj1 s LEU 81 N -0.89 2.59 -0.24 -1.29 2.96 -0.29 -1.75 118.68 119.78 1fj1 s LEU 81 Ca -0.06 -0.88 -0.07 0.00 -0.22 0.00 0.00 54.13 52.90 1fj1 s LEU 81 Cb -0.06 -1.51 -0.03 0.00 0.50 0.00 0.00 46.19 45.09 1fj1 s LEU 81 CO -0.00 -0.06 0.05 -2.28 -1.32 0.00 0.00 176.35 172.74 1fj1 s HIS 82 N 1.24 3.08 -0.26 5.38 5.65 0.18 -0.74 115.29 129.82 1fj1 s HIS 82 Ca 0.01 -0.42 0.01 0.00 0.25 0.00 0.00 55.06 54.91 1fj1 s HIS 82 Cb -0.15 -2.20 0.05 0.00 -1.18 0.00 0.00 32.58 29.10 1fj1 s HIS 82 CO -0.10 -0.32 -0.09 0.42 -0.65 0.00 0.00 174.74 174.00 1fj1 s ILE 83 N 1.43 2.42 0.23 0.89 1.01 -0.59 -0.75 121.20 125.84 1fj1 s ILE 83 Ca 0.05 -1.43 0.06 0.00 0.00 0.00 0.00 60.65 59.33 1fj1 s ILE 83 Cb -0.15 -2.35 -0.03 0.00 0.01 0.00 0.00 42.46 39.94 1fj1 s ILE 83 CO 0.03 0.05 0.26 -0.94 0.00 0.00 0.00 174.94 174.34 1fj1 s SER 84 N 1.18 5.89 -1.15 3.58 1.04 -0.37 -1.85 113.70 122.02 1fj1 s SER 84 Ca -0.05 -0.08 -0.08 0.00 0.48 0.00 0.00 55.95 56.21 1fj1 s SER 84 Cb -0.19 -1.62 -0.03 0.00 0.10 0.00 0.00 66.02 64.28 1fj1 s SER 84 CO -0.05 -0.03 0.84 -3.20 0.98 0.00 0.00 173.24 171.78 1fj1 n ASN 85 N -1.12 -4.55 -4.69 7.02 4.05 -0.46 -4.80 115.26 110.71 1fj1 n ASN 85 Ca -0.08 -0.81 -0.43 0.00 0.45 0.00 0.00 54.58 53.71 1fj1 n ASN 85 Cb 0.57 -4.44 -0.01 0.00 1.23 0.00 0.00 39.78 37.13 1fj1 n ASN 85 CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 177.26 174.39 1fj1 n LEU 86 N -3.82 3.48 -4.28 1.20 4.77 -0.41 -4.53 117.00 113.41 1fj1 n LEU 86 Ca -0.15 1.20 -0.16 0.00 -0.03 0.00 0.00 56.01 56.87 1fj1 n LEU 86 Cb 0.63 -1.47 -0.10 0.00 -2.33 0.00 0.00 43.42 40.15 1fj1 n LEU 86 CO 0.64 -0.54 -0.42 -0.54 -1.33 0.00 0.00 177.39 175.19 1fj1 s LYS 87 N -1.88 1.15 0.47 3.23 1.02 -1.26 -0.09 119.74 122.38 1fj1 s LYS 87 Ca 0.56 -1.48 0.20 0.00 0.02 0.00 0.00 55.97 55.26 1fj1 s LYS 87 Cb -0.57 -0.82 1.20 0.00 -0.52 0.00 0.00 37.83 37.12 1fj1 s LYS 87 CO 0.62 0.12 1.95 -0.91 -0.92 0.00 0.00 175.35 176.21 1fj1 h ASN 88 N 2.76 0.23 0.02 2.83 2.35 -1.96 0.36 115.58 122.18 1fj1 h ASN 88 Ca -0.37 0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.39 1fj1 h ASN 88 Cb 1.20 -0.03 0.00 0.00 0.05 0.00 0.00 38.32 39.54 1fj1 h ASN 88 CO 0.62 0.12 0.00 -0.62 -1.65 0.00 0.00 177.43 175.90 1fj1 n GLU 89 N -4.43 0.14 0.03 0.81 4.71 -1.26 -0.77 120.64 119.87 1fj1 n GLU 89 Ca 0.13 0.63 0.12 0.00 -0.01 0.00 0.00 57.16 58.03 1fj1 n GLU 89 Cb 0.58 -1.96 0.20 0.00 -1.01 0.00 0.00 31.44 29.26 1fj1 n GLU 89 CO 0.00 0.00 0.00 -0.25 0.09 0.00 0.00 177.13 176.97 1fj1 n ASP 90 N -2.25 0.59 -4.67 1.62 10.43 0.13 -4.79 116.55 117.59 1fj1 n ASP 90 Ca -0.01 -0.04 -0.42 0.00 2.57 0.00 0.00 54.79 56.88 1fj1 n ASP 90 Cb 0.04 0.23 -0.03 0.00 1.84 0.00 0.00 41.12 43.21 1fj1 n ASP 90 CO 0.00 0.00 0.00 0.28 -1.07 0.00 0.00 177.20 176.41 1fj1 s THR 91 N -3.10 3.83 -0.03 -3.53 -1.32 0.05 -4.82 115.64 106.72 1fj1 s THR 91 Ca 0.08 1.12 0.00 0.00 -1.21 0.00 0.00 61.69 61.68 1fj1 s THR 91 Cb 0.15 -3.72 0.00 0.00 -1.51 0.00 0.00 72.50 67.42 1fj1 s THR 91 CO 0.71 -0.05 0.00 0.00 -2.21 0.00 0.00 174.62 173.08 1fj1 n ALA 92 N 6.08 0.00 -2.96 11.08 0.00 -0.66 -4.80 120.51 129.26 1fj1 n ALA 92 Ca 0.14 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 53.25 1fj1 n ALA 92 Cb 0.44 0.00 -0.14 0.00 0.00 0.00 0.00 19.45 19.75 1fj1 n ALA 92 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1fj1 s THR 93 N -3.00 3.19 -0.06 0.00 2.01 -0.13 -0.73 115.64 116.92 1fj1 s THR 93 Ca 0.00 -0.62 0.01 0.00 0.31 0.00 0.00 61.69 61.39 1fj1 s THR 93 Cb 0.00 -2.33 -0.03 0.00 0.01 0.00 0.00 72.50 70.15 1fj1 s THR 93 CO 0.00 0.53 -0.06 -0.31 -0.69 0.00 0.00 174.62 174.09 1fj1 s TYR 94 N 0.15 2.95 0.13 4.92 2.02 -0.57 -0.01 117.35 126.94 1fj1 s TYR 94 Ca -0.06 0.03 0.07 0.00 -0.37 0.00 0.00 57.07 56.74 1fj1 s TYR 94 Cb -0.15 -1.70 -0.04 0.00 -0.40 0.00 0.00 41.96 39.67 1fj1 s TYR 94 CO 0.04 0.35 -0.17 -0.06 -1.57 0.00 0.00 175.55 174.14 1fj1 s PHE 95 N -0.84 1.63 0.16 2.71 0.08 -0.18 -0.83 117.98 120.70 1fj1 s PHE 95 Ca 0.13 -0.49 0.09 0.00 0.12 0.00 0.00 56.93 56.78 1fj1 s PHE 95 Cb -0.11 -0.85 -0.04 0.00 -0.57 0.00 0.00 43.02 41.45 1fj1 s PHE 95 CO 0.02 0.22 -0.10 0.00 -0.10 0.00 0.00 175.22 175.26 1fj1 s ALA 97 N -1.56 -0.69 -0.01 0.00 0.00 0.64 -1.71 121.76 118.44 1fj1 s ALA 97 Ca 0.23 0.06 0.00 0.00 0.00 0.00 0.00 51.96 52.25 1fj1 s ALA 97 Cb -0.09 0.27 0.01 0.00 0.00 0.00 0.00 23.12 23.30 1fj1 s ALA 97 CO 0.14 -0.38 -0.00 0.50 0.00 0.00 0.00 175.76 176.02 1fj1 s ARG 98 N -2.31 0.07 5.67 0.00 3.52 -0.89 0.15 118.95 125.17 1fj1 s ARG 98 Ca -0.07 0.01 0.00 0.00 -0.13 0.00 0.00 55.73 55.54 1fj1 s ARG 98 Cb -0.02 -0.13 0.00 0.00 -1.56 0.00 0.00 34.95 33.25 1fj1 s ARG 98 CO -0.02 -0.02 0.00 0.41 -0.81 0.00 0.00 175.30 174.86 1fj1 n GLY 99 N 3.29 2.92 0.00 8.12 0.00 -1.26 -2.98 105.19 115.28 1fj1 n GLY 99 Ca -0.15 -0.35 0.02 0.00 0.00 0.00 0.00 46.02 45.53 1fj1 n GLY 99 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1fj1 n LEU 100 N 0.00 0.04 -0.72 0.99 4.32 -1.26 -4.78 117.00 115.58 1fj1 n LEU 100 Ca 0.00 -0.12 0.07 0.00 -0.02 0.00 0.00 56.01 55.94 1fj1 n LEU 100 Cb 0.00 0.00 0.20 0.00 -1.62 0.00 0.00 43.42 42.00 1fj1 n LEU 100 CO 0.00 0.01 0.66 -0.90 -1.22 0.00 0.00 177.39 175.94 1fj1 n ASP 101 N -1.49 3.36 -3.84 -1.43 5.75 -1.25 -4.99 116.55 112.67 1fj1 n ASP 101 Ca -0.00 -2.57 -0.17 0.00 -0.01 0.00 0.00 54.79 52.04 1fj1 n ASP 101 Cb 0.08 -0.39 -0.16 0.00 -1.03 0.00 0.00 41.12 39.62 1fj1 n ASP 101 CO 0.00 0.00 0.00 -0.44 -0.11 0.00 0.00 177.20 176.65 1fj1 s SER 102 N -1.55 0.47 0.00 -1.12 0.01 -1.16 -5.05 113.70 105.31 1fj1 s SER 102 Ca 0.32 -0.04 -0.00 0.00 1.31 0.00 0.00 55.95 57.54 1fj1 s SER 102 Cb 0.24 -0.22 -0.00 0.00 0.21 0.00 0.00 66.02 66.24 1fj1 s SER 102 CO 0.11 -0.07 -0.00 0.26 0.41 0.00 0.00 173.24 173.94 1fj1 s TRP 103 N 0.83 0.04 1.15 2.43 0.52 -1.26 -2.10 118.94 120.55 1fj1 s TRP 103 Ca -0.09 -0.08 -0.19 0.00 0.02 0.00 0.00 56.10 55.77 1fj1 s TRP 103 Cb -0.12 -0.03 0.27 0.00 -1.15 0.00 0.00 33.47 32.44 1fj1 s TRP 103 CO -0.01 -0.03 1.16 0.20 0.02 0.00 0.00 176.95 178.29 1fj1 s GLY 104 N -0.22 1.63 0.00 0.98 0.00 -0.69 -4.54 107.32 104.47 1fj1 s GLY 104 Ca -0.02 -1.02 0.29 0.00 0.00 0.00 0.00 44.72 43.96 1fj1 s GLY 104 CO -0.00 -0.16 1.90 0.61 0.00 0.00 0.00 173.10 175.45 1fj1 n GLN 105 N -4.53 0.26 0.00 2.90 0.00 -1.25 -4.83 117.38 109.93 1fj1 n GLN 105 Ca 0.14 -0.04 0.00 0.00 0.00 0.00 0.00 57.00 57.09 1fj1 n GLN 105 Cb 0.59 -1.50 0.00 0.00 0.00 0.00 0.00 30.24 29.34 1fj1 n GLN 105 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1fj1 n GLY 106 N 1.39 -1.51 2.90 2.61 0.00 -1.26 -5.02 105.19 104.30 1fj1 n GLY 106 Ca 0.10 -1.46 -0.23 0.00 0.00 0.00 0.00 46.02 44.43 1fj1 n GLY 106 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1fj1 s THR 107 N -3.32 0.74 -0.05 2.61 -4.23 -0.01 -4.89 115.64 106.49 1fj1 s THR 107 Ca 0.00 -0.19 -0.29 0.00 -1.18 0.00 0.00 61.69 60.02 1fj1 s THR 107 Cb 0.00 -0.76 -0.02 0.00 1.34 0.00 0.00 72.50 73.06 1fj1 s THR 107 CO 0.00 0.29 0.96 -0.55 -0.54 0.00 0.00 174.62 174.78 1fj1 s SER 108 N 1.19 7.29 -0.13 3.99 0.15 -1.26 -1.52 113.70 123.41 1fj1 s SER 108 Ca -0.06 1.56 0.02 0.00 0.70 0.00 0.00 55.95 58.17 1fj1 s SER 108 Cb -0.14 -2.55 -0.00 0.00 -1.71 0.00 0.00 66.02 61.62 1fj1 s SER 108 CO -0.02 -0.32 -0.19 -0.69 1.20 0.00 0.00 173.24 173.23 1fj1 s VAL 109 N 1.38 2.47 -0.18 4.45 1.01 0.09 -0.88 120.40 128.74 1fj1 s VAL 109 Ca 0.49 -0.86 -0.00 0.00 0.00 0.00 0.00 61.98 61.61 1fj1 s VAL 109 Cb -0.20 -2.00 0.01 0.00 0.00 0.00 0.00 36.38 34.19 1fj1 s VAL 109 CO 0.23 0.54 -0.16 -0.89 0.00 0.00 0.00 175.10 174.82 1fj1 s THR 110 N 0.54 2.45 -0.26 3.92 2.01 -0.19 -1.65 115.64 122.46 1fj1 s THR 110 Ca -0.12 -0.82 -0.09 0.00 0.31 0.00 0.00 61.69 60.97 1fj1 s THR 110 Cb -0.16 -2.05 -0.04 0.00 0.01 0.00 0.00 72.50 70.26 1fj1 s THR 110 CO 0.04 0.51 0.14 -0.69 -0.69 0.00 0.00 174.62 173.93 1fj1 s VAL 111 N 1.19 4.94 -0.10 3.82 1.01 -1.26 -1.00 120.40 129.00 1fj1 s VAL 111 Ca 0.02 0.04 -0.31 0.00 0.00 0.00 0.00 61.98 61.73 1fj1 s VAL 111 Cb -0.14 -3.32 0.12 0.00 0.00 0.00 0.00 36.38 33.04 1fj1 s VAL 111 CO -0.07 0.31 1.03 -0.55 0.00 0.00 0.00 175.10 175.81 1fj1 s SER 112 N 1.53 -0.27 0.09 3.32 0.15 0.08 -4.76 113.70 113.84 1fj1 s SER 112 Ca 0.07 0.05 0.19 0.00 0.70 0.00 0.00 55.95 56.96 1fj1 s SER 112 Cb -0.15 0.28 -0.12 0.00 -1.71 0.00 0.00 66.02 64.32 1fj1 s SER 112 CO 0.07 -0.43 0.83 -1.20 1.20 0.00 0.00 173.24 173.71 1fj1 n SER 113 N -0.05 0.75 -4.47 5.45 7.64 -1.26 -4.12 113.62 117.56 1fj1 n SER 113 Ca -0.05 0.31 -0.35 0.00 1.01 0.00 0.00 58.87 59.79 1fj1 n SER 113 Cb 0.60 0.44 0.09 0.00 -1.01 0.00 0.00 64.21 64.32 1fj1 n SER 113 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1fj1 n ALA 114 N -2.33 -1.65 -2.40 -0.43 0.00 -1.26 -4.97 120.51 107.47 1fj1 n ALA 114 Ca -0.07 -0.34 -0.32 0.00 0.00 0.00 0.00 53.44 52.71 1fj1 n ALA 114 Cb 0.74 -1.87 -0.14 0.00 0.00 0.00 0.00 19.45 18.18 1fj1 n ALA 114 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.50 175.91 1fj1 s LYS 115 N -3.08 2.27 0.10 0.00 0.00 -1.26 -5.04 119.74 112.74 1fj1 s LYS 115 Ca 0.64 -0.84 -0.28 0.00 0.00 0.00 0.00 55.97 55.49 1fj1 s LYS 115 Cb -0.31 -2.20 -0.16 0.00 0.00 0.00 0.00 37.83 35.16 1fj1 s LYS 115 CO 0.60 0.59 0.63 2.41 0.00 0.00 0.00 175.35 179.57 1fj1 n THR 116 N 2.28 1.04 -3.66 3.79 -1.04 -1.26 -4.79 114.28 110.64 1fj1 n THR 116 Ca -0.17 -0.26 -0.10 0.00 -2.04 0.00 0.00 64.05 61.48 1fj1 n THR 116 Cb 0.52 0.00 -0.11 0.00 -1.82 0.00 0.00 70.33 68.92 1fj1 n THR 116 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 1fj1 s THR 117 N -0.52 -0.53 0.86 12.58 2.01 -0.52 -4.94 115.64 124.58 1fj1 s THR 117 Ca 0.64 0.20 -0.11 0.00 0.31 0.00 0.00 61.69 62.73 1fj1 s THR 117 Cb -0.91 -0.59 0.11 0.00 0.01 0.00 0.00 72.50 71.12 1fj1 s THR 117 CO 0.48 0.08 1.09 -2.16 -0.69 0.00 0.00 174.62 173.43 1fj1 s PRO 118 N 2.46 1.55 0.79 4.92 0.04 -1.26 -1.71 135.00 141.79 1fj1 s PRO 118 Ca -0.01 1.02 -0.13 0.00 0.04 0.00 0.00 61.00 61.91 1fj1 s PRO 118 Cb -0.12 -1.83 0.19 0.00 0.04 0.00 0.00 34.50 32.78 1fj1 s PRO 118 CO -0.11 -2.09 0.90 -0.35 0.04 0.00 0.00 177.00 175.39 1fj1 n PRO 119 N -3.81 -1.58 -3.20 0.56 -0.04 -1.26 -4.40 135.00 121.26 1fj1 n PRO 119 Ca 0.08 -1.41 -0.23 0.00 -0.04 0.00 0.00 63.50 61.89 1fj1 n PRO 119 Cb 0.54 -1.08 -0.07 0.00 -0.04 0.00 0.00 33.50 32.86 1fj1 n PRO 119 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 1fj1 n SER 120 N -3.92 -0.28 -4.49 3.54 7.64 -1.07 -4.99 113.62 110.05 1fj1 n SER 120 Ca 0.12 -2.65 -0.49 0.00 1.01 0.00 0.00 58.87 56.85 1fj1 n SER 120 Cb 0.42 -0.40 -0.06 0.00 -1.01 0.00 0.00 64.21 63.16 1fj1 n SER 120 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 1fj1 n VAL 121 N 1.83 0.24 -4.08 0.44 0.31 -1.25 -4.18 118.33 111.64 1fj1 n VAL 121 Ca 0.23 -0.29 -0.35 0.00 -0.01 0.00 0.00 64.34 63.92 1fj1 n VAL 121 Cb 0.52 -1.83 -0.14 0.00 -0.91 0.00 0.00 33.84 31.48 1fj1 n VAL 121 CO 0.00 0.00 0.00 -0.31 -1.32 0.00 0.00 176.83 175.20 1fj1 s TYR 122 N 7.24 2.95 0.56 3.52 1.51 -0.06 -4.93 117.35 128.14 1fj1 s TYR 122 Ca 1.07 -0.83 -0.21 0.00 -1.01 0.00 0.00 57.07 56.09 1fj1 s TYR 122 Cb -0.75 -2.06 -0.04 0.00 -0.11 0.00 0.00 41.96 39.00 1fj1 s TYR 122 CO 0.47 -0.45 1.34 -0.35 -1.11 0.00 0.00 175.55 175.45 1fj1 n PRO 123 N 4.49 1.58 -4.05 -1.71 -0.04 -1.26 -1.16 135.00 132.86 1fj1 n PRO 123 Ca -0.18 0.59 -0.32 0.00 -0.04 0.00 0.00 63.50 63.55 1fj1 n PRO 123 Cb 0.51 -2.56 -0.15 0.00 -0.04 0.00 0.00 33.50 31.26 1fj1 n PRO 123 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1fj1 s LEU 124 N -3.57 3.11 0.01 1.53 1.43 0.07 -4.82 118.68 116.44 1fj1 s LEU 124 Ca 0.74 -1.26 -0.00 0.00 -1.03 0.00 0.00 54.13 52.57 1fj1 s LEU 124 Cb -0.41 -1.46 -0.01 0.00 0.03 0.00 0.00 46.19 44.33 1fj1 s LEU 124 CO 0.48 -0.18 -0.01 0.00 0.23 0.00 0.00 176.35 176.87 1fj1 s ALA 125 N 1.18 0.06 0.03 4.21 0.00 -1.26 -2.12 121.76 123.86 1fj1 s ALA 125 Ca -0.07 -0.41 -0.06 0.00 0.00 0.00 0.00 51.96 51.42 1fj1 s ALA 125 Cb -0.19 0.11 -0.01 0.00 0.00 0.00 0.00 23.12 23.02 1fj1 s ALA 125 CO -0.06 -0.12 0.44 -2.30 0.00 0.00 0.00 175.76 173.71 1fj1 n PRO 126 N 1.97 -0.08 -0.04 0.00 -0.02 -1.26 -4.94 135.00 130.62 1fj1 n PRO 126 Ca -0.21 0.43 0.00 0.00 -2.02 0.00 0.00 63.50 61.70 1fj1 n PRO 126 Cb 0.56 -0.64 0.00 0.00 -0.02 0.00 0.00 33.50 33.41 1fj1 n PRO 126 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1fj1 n GLY 127 N -1.05 -0.31 2.72 -1.23 0.00 -1.26 -4.91 105.19 99.15 1fj1 n GLY 127 Ca 0.00 -1.19 -0.38 0.00 0.00 0.00 0.00 46.02 44.45 1fj1 n GLY 127 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fj1 n GLY 129 N 1.60 0.59 0.00 0.00 0.00 -1.26 -5.03 105.19 101.09 1fj1 n GLY 129 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.16 1fj1 n GLY 129 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1fj1 n ASP 130 N 0.00 0.00 0.00 1.61 2.03 -1.21 -5.13 116.55 113.85 1fj1 n ASP 130 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 1fj1 n ASP 130 Cb 0.00 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.40 1fj1 n ASP 130 CO 0.00 0.00 0.00 1.07 -1.92 0.00 0.00 177.20 176.35 1fj1 n THR 131 N 0.00 0.00 -2.89 5.18 5.66 -1.26 -5.13 114.28 115.84 1fj1 n THR 131 Ca 0.00 0.00 -0.41 0.00 -3.05 0.00 0.00 64.05 60.59 1fj1 n THR 131 Cb 0.00 0.00 -0.04 0.00 -1.55 0.00 0.00 70.33 68.74 1fj1 n THR 131 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 1fj1 s THR 132 N -0.67 4.95 -0.73 1.09 -4.23 -1.26 -4.97 115.64 109.82 1fj1 s THR 132 Ca 0.00 1.71 0.02 0.00 -1.18 0.00 0.00 61.69 62.24 1fj1 s THR 132 Cb 0.00 -4.16 0.35 0.00 1.34 0.00 0.00 72.50 70.02 1fj1 s THR 132 CO 0.00 0.18 1.36 0.61 -0.54 0.00 0.00 174.62 176.23 1fj1 n GLY 133 N 3.08 5.83 4.25 3.99 0.00 -1.26 -4.87 105.19 116.22 1fj1 n GLY 133 Ca 0.02 -2.69 0.00 0.00 0.00 0.00 0.00 46.02 43.36 1fj1 n GLY 133 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1fj1 n SER 134 N -0.25 0.00 -4.26 1.61 2.88 -1.26 -4.81 113.62 107.52 1fj1 n SER 134 Ca 0.40 0.00 -0.15 0.00 -1.33 0.00 0.00 58.87 57.78 1fj1 n SER 134 Cb 0.37 0.00 -0.10 0.00 -0.75 0.00 0.00 64.21 63.73 1fj1 n SER 134 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 1fj1 s SER 135 N 0.00 1.94 -0.00 -3.46 0.01 -1.26 -0.95 113.70 109.96 1fj1 s SER 135 Ca 0.00 -1.00 0.01 0.00 1.31 0.00 0.00 55.95 56.27 1fj1 s SER 135 Cb 0.00 -0.04 0.00 0.00 0.21 0.00 0.00 66.02 66.20 1fj1 s SER 135 CO 0.00 -0.29 -0.02 0.54 0.41 0.00 0.00 173.24 173.88 1fj1 s VAL 136 N -3.17 0.15 -0.13 3.43 0.11 0.17 -4.52 120.40 116.42 1fj1 s VAL 136 Ca 0.17 -0.06 -0.02 0.00 -2.93 0.00 0.00 61.98 59.15 1fj1 s VAL 136 Cb 0.01 -0.15 -0.02 0.00 -1.53 0.00 0.00 36.38 34.69 1fj1 s VAL 136 CO 0.02 0.06 -0.07 -0.89 -3.33 0.00 0.00 175.10 170.88 1fj1 s THR 137 N 0.10 3.59 0.23 5.04 2.01 -1.26 0.40 115.64 125.75 1fj1 s THR 137 Ca -0.01 -0.48 0.03 0.00 0.31 0.00 0.00 61.69 61.55 1fj1 s THR 137 Cb -0.02 -2.54 -0.05 0.00 0.01 0.00 0.00 72.50 69.90 1fj1 s THR 137 CO -0.00 0.52 0.00 -0.76 -0.69 0.00 0.00 174.62 173.69 1fj1 s LEU 138 N 0.17 2.16 0.00 4.42 1.43 0.25 -4.63 118.68 122.48 1fj1 s LEU 138 Ca -0.04 -1.23 -0.04 0.00 -1.03 0.00 0.00 54.13 51.79 1fj1 s LEU 138 Cb -0.14 -0.25 0.01 0.00 0.03 0.00 0.00 46.19 45.84 1fj1 s LEU 138 CO 0.04 -0.53 0.20 0.61 0.23 0.00 0.00 176.35 176.90 1fj1 n GLY 139 N -0.42 1.38 2.97 -3.19 0.00 -0.90 0.11 105.19 105.14 1fj1 n GLY 139 Ca -0.05 -1.00 -0.13 0.00 0.00 0.00 0.00 46.02 44.84 1fj1 n GLY 139 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fj1 s LEU 141 N -0.82 3.37 -0.65 0.00 2.96 -0.31 -2.08 118.68 121.16 1fj1 s LEU 141 Ca -0.06 -0.13 0.01 0.00 -0.22 0.00 0.00 54.13 53.74 1fj1 s LEU 141 Cb -0.06 -1.85 0.16 0.00 0.50 0.00 0.00 46.19 44.95 1fj1 s LEU 141 CO -0.00 0.11 0.44 -0.69 -1.32 0.00 0.00 176.35 174.89 1fj1 s VAL 142 N 0.73 3.26 0.24 1.68 1.01 -0.41 -0.88 120.40 126.03 1fj1 s VAL 142 Ca 0.00 -3.49 0.04 0.00 0.00 0.00 0.00 61.98 58.53 1fj1 s VAL 142 Cb -0.14 -3.15 -0.03 0.00 0.00 0.00 0.00 36.38 33.06 1fj1 s VAL 142 CO 0.02 -0.91 0.37 -0.75 0.00 0.00 0.00 175.10 173.83 1fj1 s LYS 143 N -0.62 3.45 -1.38 2.72 2.20 -1.26 -1.40 119.74 123.44 1fj1 s LYS 143 Ca 0.20 -0.66 -0.05 0.00 -0.36 0.00 0.00 55.97 55.10 1fj1 s LYS 143 Cb -0.17 -2.87 0.03 0.00 -1.51 0.00 0.00 37.83 33.30 1fj1 s LYS 143 CO -0.06 0.41 0.80 0.41 -0.36 0.00 0.00 175.35 176.55 1fj1 n GLY 144 N -1.27 -0.36 3.77 5.54 0.00 -0.70 -2.59 105.19 109.58 1fj1 n GLY 144 Ca -0.08 0.15 -0.33 0.00 0.00 0.00 0.00 46.02 45.76 1fj1 n GLY 144 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1fj1 s TYR 145 N -3.55 1.86 -0.29 1.61 1.13 -0.92 -4.59 117.35 112.60 1fj1 s TYR 145 Ca 0.23 -0.95 -0.27 0.00 -1.41 0.00 0.00 57.07 54.68 1fj1 s TYR 145 Cb -0.12 -1.62 0.19 0.00 -1.10 0.00 0.00 41.96 39.31 1fj1 s TYR 145 CO 0.82 0.21 1.38 0.12 -2.51 0.00 0.00 175.55 175.56 1fj1 s PHE 146 N -2.87 -0.08 0.00 -3.49 5.36 -0.69 -0.44 117.98 115.76 1fj1 s PHE 146 Ca 0.07 0.18 0.00 0.00 -0.96 0.00 0.00 56.93 56.21 1fj1 s PHE 146 Cb 0.01 0.48 0.00 0.00 -0.34 0.00 0.00 43.02 43.18 1fj1 s PHE 146 CO 0.04 -0.05 0.00 -0.35 -1.46 0.00 0.00 175.22 173.39 1fj1 n PRO 147 N 1.20 0.96 -1.44 10.12 -0.04 -1.26 -1.44 135.00 143.10 1fj1 n PRO 147 Ca -0.07 0.00 -0.31 0.00 -0.04 0.00 0.00 63.50 63.08 1fj1 n PRO 147 Cb 0.58 0.00 0.07 0.00 -0.04 0.00 0.00 33.50 34.10 1fj1 n PRO 147 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 1fj1 s GLU 148 N -0.75 2.62 0.00 0.54 -6.30 -1.26 -4.89 118.70 108.66 1fj1 s GLU 148 Ca 0.00 1.08 0.00 0.00 -2.50 0.00 0.00 54.97 53.55 1fj1 s GLU 148 Cb 0.00 -1.95 0.00 0.00 0.00 0.00 0.00 34.13 32.18 1fj1 s GLU 148 CO 0.00 -1.36 0.00 0.45 0.02 0.00 0.00 175.26 174.37 1fj1 n SER 149 N -3.26 0.00 -3.62 -1.70 2.88 -1.26 -4.98 113.62 101.68 1fj1 n SER 149 Ca 0.08 0.00 -0.15 0.00 -1.33 0.00 0.00 58.87 57.47 1fj1 n SER 149 Cb 0.53 0.00 -0.07 0.00 -0.75 0.00 0.00 64.21 63.92 1fj1 n SER 149 CO 0.00 0.00 0.00 0.68 -1.23 0.00 0.00 175.04 174.49 1fj1 s VAL 150 N 0.00 0.01 -0.22 2.46 -7.23 -1.26 -4.61 120.40 109.55 1fj1 s VAL 150 Ca 0.00 -0.08 0.02 0.00 -1.81 0.00 0.00 61.98 60.10 1fj1 s VAL 150 Cb 0.00 -0.87 0.04 0.00 0.56 0.00 0.00 36.38 36.12 1fj1 s VAL 150 CO 0.00 -0.05 -0.12 -0.89 -0.31 0.00 0.00 175.10 173.73 1fj1 s THR 151 N -0.58 1.90 -0.27 5.32 2.01 -0.70 -4.90 115.64 118.43 1fj1 s THR 151 Ca -0.07 -1.22 -0.10 0.00 0.31 0.00 0.00 61.69 60.61 1fj1 s THR 151 Cb -0.03 -1.94 -0.05 0.00 0.01 0.00 0.00 72.50 70.49 1fj1 s THR 151 CO 0.05 0.17 0.17 -0.69 -0.69 0.00 0.00 174.62 173.63 1fj1 s VAL 152 N 1.27 5.17 0.13 3.82 1.01 -1.26 -1.45 120.40 129.09 1fj1 s VAL 152 Ca -0.03 0.12 0.06 0.00 0.00 0.00 0.00 61.98 62.14 1fj1 s VAL 152 Cb -0.17 -3.45 -0.04 0.00 0.00 0.00 0.00 36.38 32.72 1fj1 s VAL 152 CO -0.08 0.28 -0.15 0.42 0.00 0.00 0.00 175.10 175.57 1fj1 s THR 153 N 1.64 1.40 0.21 3.92 -4.23 -1.11 -4.95 115.64 112.52 1fj1 s THR 153 Ca 0.07 -1.76 0.09 0.00 -1.18 0.00 0.00 61.69 58.91 1fj1 s THR 153 Cb -0.16 -1.59 -0.05 0.00 1.34 0.00 0.00 72.50 72.05 1fj1 s THR 153 CO 0.09 -0.41 -0.16 0.26 -0.54 0.00 0.00 174.62 173.86 1fj1 s TRP 154 N -2.16 1.86 -0.20 3.99 0.52 -1.26 -1.57 118.94 120.10 1fj1 s TRP 154 Ca 0.10 -0.50 -0.04 0.00 0.02 0.00 0.00 56.10 55.68 1fj1 s TRP 154 Cb -0.05 -0.86 0.08 0.00 -1.15 0.00 0.00 33.47 31.49 1fj1 s TRP 154 CO 0.03 0.43 0.14 -0.80 0.02 0.00 0.00 176.95 176.77 1fj1 s ASN 155 N -3.21 2.24 0.41 2.95 -0.87 -1.25 -5.05 114.94 110.17 1fj1 s ASN 155 Ca 0.22 -0.62 0.03 0.00 -1.57 0.00 0.00 52.86 50.92 1fj1 s ASN 155 Cb -0.03 -0.06 -0.03 0.00 -0.02 0.00 0.00 41.25 41.12 1fj1 s ASN 155 CO 0.08 -0.36 0.10 -0.94 -2.57 0.00 0.00 177.10 173.42 1fj1 s SER 156 N 2.19 2.93 -0.19 -1.22 1.04 -1.26 -3.87 113.70 113.32 1fj1 s SER 156 Ca 0.05 -1.64 -0.26 0.00 0.48 0.00 0.00 55.95 54.58 1fj1 s SER 156 Cb -0.16 0.44 -0.01 0.00 0.10 0.00 0.00 66.02 66.39 1fj1 s SER 156 CO -0.16 -0.88 0.87 -0.83 0.98 0.00 0.00 173.24 173.22 1fj1 s GLY 157 N -3.63 1.99 0.28 7.32 0.00 -1.26 -4.80 107.32 107.22 1fj1 s GLY 157 Ca 0.23 0.04 0.00 0.00 0.00 0.00 0.00 44.72 44.99 1fj1 s GLY 157 CO 0.13 1.79 0.00 -1.26 0.00 0.00 0.00 173.10 173.76 1fj1 n SER 158 N 5.54 -4.80 -0.42 1.64 2.88 -1.26 -4.86 113.62 112.34 1fj1 n SER 158 Ca 0.06 0.71 -0.06 0.00 -1.33 0.00 0.00 58.87 58.25 1fj1 n SER 158 Cb 0.48 -2.03 -0.01 0.00 -0.75 0.00 0.00 64.21 61.90 1fj1 n SER 158 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 1fj1 n LEU 159 N -1.19 0.10 0.00 2.46 4.77 -1.26 -4.94 117.00 116.93 1fj1 n LEU 159 Ca 0.00 0.11 0.00 0.00 -0.03 0.00 0.00 56.01 56.09 1fj1 n LEU 159 Cb 0.05 -0.08 0.00 0.00 -2.33 0.00 0.00 43.42 41.06 1fj1 n LEU 159 CO 0.00 -0.09 0.00 -1.54 -1.33 0.00 0.00 177.39 174.43 1fj1 n SER 160 N 0.34 0.00 0.00 -1.43 3.41 -1.26 -4.83 113.62 109.85 1fj1 n SER 160 Ca 0.03 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.64 1fj1 n SER 160 Cb -0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 1fj1 n SER 160 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1fj1 n SER 161 N -0.29 0.00 -1.18 4.04 3.41 -1.26 -4.54 113.62 113.80 1fj1 n SER 161 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 1fj1 n SER 161 Cb 0.00 -0.47 0.00 0.00 -0.26 0.00 0.00 64.21 63.48 1fj1 n SER 161 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1fj1 n SER 162 N 0.00 2.96 -4.67 4.04 3.41 -1.26 -4.80 113.62 113.30 1fj1 n SER 162 Ca 0.00 -1.76 -0.40 0.00 -0.26 0.00 0.00 58.87 56.46 1fj1 n SER 162 Cb 0.00 -0.55 -0.06 0.00 -0.26 0.00 0.00 64.21 63.34 1fj1 n SER 162 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1fj1 s VAL 163 N 0.26 5.03 -0.20 -3.33 1.01 -1.26 -3.22 120.40 118.71 1fj1 s VAL 163 Ca 0.00 1.21 -0.02 0.00 0.00 0.00 0.00 61.98 63.17 1fj1 s VAL 163 Cb 0.00 -3.95 0.00 0.00 0.00 0.00 0.00 36.38 32.43 1fj1 s VAL 163 CO 0.00 0.15 -0.11 -1.00 0.00 0.00 0.00 175.10 174.14 1fj1 s HIS 164 N 1.66 2.87 -0.30 5.22 3.76 -0.47 -4.98 115.29 123.05 1fj1 s HIS 164 Ca 0.30 -1.18 -0.08 0.00 -0.15 0.00 0.00 55.06 53.96 1fj1 s HIS 164 Cb -0.16 -2.01 0.00 0.00 1.11 0.00 0.00 32.58 31.52 1fj1 s HIS 164 CO 0.11 -0.62 0.10 0.99 -0.85 0.00 0.00 174.74 174.48 1fj1 s THR 165 N 1.30 4.15 -0.13 1.30 2.01 -1.26 -0.11 115.64 122.91 1fj1 s THR 165 Ca 0.04 -0.61 -0.21 0.00 0.31 0.00 0.00 61.69 61.23 1fj1 s THR 165 Cb -0.14 -3.13 -0.04 0.00 0.01 0.00 0.00 72.50 69.20 1fj1 s THR 165 CO -0.06 0.08 0.59 -0.36 -0.69 0.00 0.00 174.62 174.18 1fj1 s PHE 166 N 1.53 3.49 0.62 4.92 0.08 -0.66 -5.04 117.98 122.93 1fj1 s PHE 166 Ca 0.03 1.01 -0.19 0.00 0.12 0.00 0.00 56.93 57.90 1fj1 s PHE 166 Cb -0.17 -2.71 -0.02 0.00 -0.57 0.00 0.00 43.02 39.55 1fj1 s PHE 166 CO 0.03 0.04 1.32 -2.30 -0.10 0.00 0.00 175.22 174.21 1fj1 n PRO 167 N 4.13 1.29 -2.44 0.24 -0.02 -1.26 -3.68 135.00 133.25 1fj1 n PRO 167 Ca -0.04 0.49 -0.35 0.00 -2.02 0.00 0.00 63.50 61.59 1fj1 n PRO 167 Cb 0.51 -2.55 -0.02 0.00 -0.02 0.00 0.00 33.50 31.42 1fj1 n PRO 167 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1fj1 s ALA 168 N -1.35 2.90 0.07 3.55 0.00 -1.26 -4.76 121.76 120.91 1fj1 s ALA 168 Ca 0.80 0.73 0.08 0.00 0.00 0.00 0.00 51.96 53.56 1fj1 s ALA 168 Cb -0.39 -3.30 -0.03 0.00 0.00 0.00 0.00 23.12 19.40 1fj1 s ALA 168 CO 0.43 -0.44 -0.22 -0.51 0.00 0.00 0.00 175.76 175.02 1fj1 s LEU 169 N -3.28 2.23 -0.47 0.00 1.02 -0.33 -4.94 118.68 112.90 1fj1 s LEU 169 Ca 0.66 -0.61 -0.20 0.00 0.02 0.00 0.00 54.13 54.00 1fj1 s LEU 169 Cb -0.21 -1.01 0.04 0.00 0.02 0.00 0.00 46.19 45.03 1fj1 s LEU 169 CO 0.25 0.14 0.61 -0.22 0.02 0.00 0.00 176.35 177.16 1fj1 s LEU 170 N -1.52 4.77 -0.27 1.79 2.96 -1.26 -1.53 118.68 123.62 1fj1 s LEU 170 Ca 0.08 -0.67 -0.03 0.00 -0.22 0.00 0.00 54.13 53.30 1fj1 s LEU 170 Cb -0.09 -2.54 0.03 0.00 0.50 0.00 0.00 46.19 44.08 1fj1 s LEU 170 CO 0.03 -0.82 -0.02 -1.58 -1.32 0.00 0.00 176.35 172.64 1fj1 s GLN 171 N 2.66 2.78 -0.98 1.98 2.00 0.18 -4.77 119.66 123.50 1fj1 s GLN 171 Ca 0.18 -1.03 -0.12 0.00 -2.00 0.00 0.00 55.36 52.38 1fj1 s GLN 171 Cb -0.17 -3.10 -0.00 0.00 0.80 0.00 0.00 33.01 30.54 1fj1 s GLN 171 CO 0.15 -0.46 0.72 -1.13 -0.50 0.00 0.00 175.29 174.06 1fj1 n SER 172 N 4.69 -5.60 0.00 6.67 3.41 -1.26 -2.06 113.62 119.47 1fj1 n SER 172 Ca -0.15 -0.84 0.00 0.00 -0.26 0.00 0.00 58.87 57.61 1fj1 n SER 172 Cb 0.46 -3.17 0.00 0.00 -0.26 0.00 0.00 64.21 61.25 1fj1 n SER 172 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1fj1 n GLY 173 N -1.72 1.77 3.22 5.00 0.00 -1.26 -4.95 105.19 107.26 1fj1 n GLY 173 Ca -0.14 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.69 1fj1 n GLY 173 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1fj1 s LEU 174 N 0.00 2.32 0.77 0.99 1.43 -0.88 -5.00 118.68 118.31 1fj1 s LEU 174 Ca 0.00 -0.69 -0.11 0.00 -1.03 0.00 0.00 54.13 52.30 1fj1 s LEU 174 Cb 0.00 -0.63 0.05 0.00 0.03 0.00 0.00 46.19 45.64 1fj1 s LEU 174 CO 0.00 -0.06 1.08 -0.31 0.23 0.00 0.00 176.35 177.30 1fj1 s TYR 175 N -1.49 2.91 -0.24 0.29 1.51 0.42 -0.65 117.35 120.09 1fj1 s TYR 175 Ca 0.03 1.25 -0.16 0.00 -1.01 0.00 0.00 57.07 57.18 1fj1 s TYR 175 Cb -0.09 -3.04 0.07 0.00 -0.11 0.00 0.00 41.96 38.79 1fj1 s TYR 175 CO 0.03 -1.61 0.60 0.99 -1.11 0.00 0.00 175.55 174.46 1fj1 s THR 176 N -3.11 -0.01 0.29 -0.71 2.01 -0.58 -1.72 115.64 111.81 1fj1 s THR 176 Ca 0.60 0.02 0.00 0.00 0.31 0.00 0.00 61.69 62.63 1fj1 s THR 176 Cb -0.14 -0.87 -0.02 0.00 0.01 0.00 0.00 72.50 71.48 1fj1 s THR 176 CO 0.55 0.01 0.31 0.00 -0.69 0.00 0.00 174.62 174.79 1fj1 s MET 177 N 1.27 1.62 0.22 4.92 0.23 -0.50 -1.19 119.30 125.87 1fj1 s MET 177 Ca -0.08 -1.76 -0.12 0.00 -1.03 0.00 0.00 55.69 52.71 1fj1 s MET 177 Cb -0.06 0.36 -0.00 0.00 -1.53 0.00 0.00 34.83 33.60 1fj1 s MET 177 CO -0.13 -0.61 0.42 -1.54 -2.03 0.00 0.00 175.02 171.13 1fj1 s SER 178 N -3.24 -0.07 -0.06 -1.18 1.04 -1.24 -1.29 113.70 107.66 1fj1 s SER 178 Ca 0.36 -0.88 -0.06 0.00 0.48 0.00 0.00 55.95 55.85 1fj1 s SER 178 Cb 0.03 0.54 0.01 0.00 0.10 0.00 0.00 66.02 66.70 1fj1 s SER 178 CO 0.19 -1.06 0.17 -0.55 0.98 0.00 0.00 173.24 172.97 1fj1 s SER 179 N -3.00 -0.16 0.26 7.02 0.15 -0.89 -1.65 113.70 115.44 1fj1 s SER 179 Ca 0.20 0.28 0.12 0.00 0.70 0.00 0.00 55.95 57.25 1fj1 s SER 179 Cb 0.01 0.33 -0.05 0.00 -1.71 0.00 0.00 66.02 64.60 1fj1 s SER 179 CO 0.06 -0.09 -0.18 -0.55 1.20 0.00 0.00 173.24 173.67 1fj1 s SER 180 N -0.06 3.69 -0.26 5.45 0.15 0.84 -1.73 113.70 121.79 1fj1 s SER 180 Ca -0.02 -0.94 -0.13 0.00 0.70 0.00 0.00 55.95 55.56 1fj1 s SER 180 Cb -0.02 -0.37 0.08 0.00 -1.71 0.00 0.00 66.02 64.01 1fj1 s SER 180 CO 0.00 0.05 0.61 0.54 1.20 0.00 0.00 173.24 175.65 1fj1 s VAL 181 N -2.31 -0.21 -0.08 4.45 0.11 0.12 -1.37 120.40 121.11 1fj1 s VAL 181 Ca 0.28 0.03 0.05 0.00 -2.93 0.00 0.00 61.98 59.41 1fj1 s VAL 181 Cb -0.06 -0.90 -0.01 0.00 -1.53 0.00 0.00 36.38 33.88 1fj1 s VAL 181 CO 0.15 0.01 -0.23 0.42 -3.33 0.00 0.00 175.10 172.12 1fj1 s THR 182 N 1.86 2.22 0.20 5.04 -4.23 -1.20 0.87 115.64 120.40 1fj1 s THR 182 Ca -0.09 -0.99 -0.00 0.00 -1.18 0.00 0.00 61.69 59.43 1fj1 s THR 182 Cb -0.07 -1.84 -0.04 0.00 1.34 0.00 0.00 72.50 71.89 1fj1 s THR 182 CO -0.18 0.56 0.10 0.54 -0.54 0.00 0.00 174.62 175.11 1fj1 s VAL 183 N 0.04 0.16 0.13 2.29 0.11 0.16 -4.68 120.40 118.61 1fj1 s VAL 183 Ca -0.09 -1.98 -0.33 0.00 -2.93 0.00 0.00 61.98 56.64 1fj1 s VAL 183 Cb -0.15 -2.42 -0.13 0.00 -1.53 0.00 0.00 36.38 32.15 1fj1 s VAL 183 CO 0.06 -0.11 1.67 -2.65 -3.33 0.00 0.00 175.10 170.74 1fj1 n PRO 184 N -0.27 2.32 0.00 1.54 -0.02 -1.26 0.42 135.00 137.73 1fj1 n PRO 184 Ca -0.00 0.84 0.00 0.00 -2.02 0.00 0.00 63.50 62.32 1fj1 n PRO 184 Cb 0.65 -2.65 0.00 0.00 -0.02 0.00 0.00 33.50 31.49 1fj1 n PRO 184 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1fj1 n SER 185 N 4.21 0.00 -0.08 2.55 3.41 -0.13 -0.96 113.62 122.62 1fj1 n SER 185 Ca 0.18 -0.01 -0.16 0.00 -0.26 0.00 0.00 58.87 58.62 1fj1 n SER 185 Cb 0.31 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.19 1fj1 n SER 185 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1fj1 n SER 186 N -0.60 1.79 0.00 4.04 3.41 -1.26 -4.51 113.62 116.49 1fj1 n SER 186 Ca 0.00 0.10 0.00 0.00 -0.26 0.00 0.00 58.87 58.71 1fj1 n SER 186 Cb 0.00 -0.41 0.02 0.00 -0.26 0.00 0.00 64.21 63.56 1fj1 n SER 186 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 1fj1 n THR 187 N -3.47 0.00 -3.62 6.66 -1.04 -0.13 -3.85 114.28 108.83 1fj1 n THR 187 Ca -0.32 0.00 -0.14 0.00 -2.04 0.00 0.00 64.05 61.55 1fj1 n THR 187 Cb 0.76 -0.87 -0.07 0.00 -1.82 0.00 0.00 70.33 68.34 1fj1 n THR 187 CO 0.00 0.00 0.00 0.86 -0.64 0.00 0.00 175.07 175.29 1fj1 s TRP 188 N -2.00 -0.76 -1.84 -1.42 -0.00 -1.23 -3.03 118.94 108.66 1fj1 s TRP 188 Ca 0.01 1.80 0.00 0.00 -0.00 0.00 0.00 56.10 57.90 1fj1 s TRP 188 Cb 0.00 0.29 0.00 0.00 -0.00 0.00 0.00 33.47 33.77 1fj1 s TRP 188 CO 0.01 -0.40 0.88 -0.35 -0.00 0.00 0.00 176.95 177.08 1fj1 n PRO 189 N 2.45 0.95 0.00 5.86 -0.04 -1.26 -4.80 135.00 138.16 1fj1 n PRO 189 Ca -0.15 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.31 1fj1 n PRO 189 Cb 0.55 -1.08 0.00 0.00 -0.04 0.00 0.00 33.50 32.94 1fj1 n PRO 189 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1fj1 n SER 190 N -0.42 0.00 0.00 3.54 2.88 -1.25 -4.41 113.62 113.96 1fj1 n SER 190 Ca 0.00 0.02 0.00 0.00 -1.33 0.00 0.00 58.87 57.56 1fj1 n SER 190 Cb 0.04 -0.02 0.00 0.00 -0.75 0.00 0.00 64.21 63.48 1fj1 n SER 190 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1fj1 n GLN 191 N -0.94 0.30 -3.64 -1.46 1.13 -1.17 -4.99 117.38 106.61 1fj1 n GLN 191 Ca 0.00 0.00 -0.04 0.00 -1.94 0.00 0.00 57.00 55.02 1fj1 n GLN 191 Cb 0.00 0.00 -0.06 0.00 0.11 0.00 0.00 30.24 30.29 1fj1 n GLN 191 CO 0.00 0.00 0.00 0.95 -1.44 0.00 0.00 177.06 176.57 1fj1 s THR 192 N 1.72 -0.88 -0.04 5.09 -4.23 -1.26 -4.91 115.64 111.12 1fj1 s THR 192 Ca 0.00 0.06 0.03 0.00 -1.18 0.00 0.00 61.69 60.60 1fj1 s THR 192 Cb 0.00 -0.88 -0.03 0.00 1.34 0.00 0.00 72.50 72.93 1fj1 s THR 192 CO 0.00 0.02 -0.12 0.68 -0.54 0.00 0.00 174.62 174.66 1fj1 s VAL 193 N 2.80 3.23 -0.10 2.29 -7.23 -1.26 -4.60 120.40 115.52 1fj1 s VAL 193 Ca -0.04 -0.70 -0.08 0.00 -1.81 0.00 0.00 61.98 59.35 1fj1 s VAL 193 Cb -0.12 -2.29 0.03 0.00 0.56 0.00 0.00 36.38 34.56 1fj1 s VAL 193 CO -0.17 0.56 0.27 0.42 -0.31 0.00 0.00 175.10 175.87 1fj1 s THR 194 N -0.78 -0.01 0.12 5.32 -4.23 -1.25 -1.69 115.64 113.12 1fj1 s THR 194 Ca 0.12 0.04 -0.13 0.00 -1.18 0.00 0.00 61.69 60.54 1fj1 s THR 194 Cb -0.11 -0.38 -0.07 0.00 1.34 0.00 0.00 72.50 73.28 1fj1 s THR 194 CO 0.01 0.02 0.50 0.00 -0.54 0.00 0.00 174.62 174.61 1fj1 s SER 196 N -1.70 4.14 0.26 0.00 0.15 -0.61 -2.14 113.70 113.79 1fj1 s SER 196 Ca 0.36 -2.46 -0.28 0.00 0.70 0.00 0.00 55.95 54.26 1fj1 s SER 196 Cb -0.15 -1.30 -0.09 0.00 -1.71 0.00 0.00 66.02 62.77 1fj1 s SER 196 CO 0.19 -0.31 0.92 -0.69 1.20 0.00 0.00 173.24 174.55 1fj1 s VAL 197 N 0.51 4.15 -0.07 4.45 1.01 -0.95 -2.76 120.40 126.74 1fj1 s VAL 197 Ca 0.15 1.96 0.00 0.00 0.00 0.00 0.00 61.98 64.09 1fj1 s VAL 197 Cb -0.23 -4.21 0.02 0.00 0.00 0.00 0.00 36.38 31.97 1fj1 s VAL 197 CO -0.06 0.39 -0.05 0.00 0.00 0.00 0.00 175.10 175.38 1fj1 s ALA 198 N -1.31 0.95 -0.83 5.51 0.00 -0.53 -1.75 121.76 123.79 1fj1 s ALA 198 Ca 0.43 -0.26 0.02 0.00 0.00 0.00 0.00 51.96 52.15 1fj1 s ALA 198 Cb -0.23 -0.65 0.28 0.00 0.00 0.00 0.00 23.12 22.52 1fj1 s ALA 198 CO 0.29 -0.20 1.09 1.58 0.00 0.00 0.00 175.76 178.52 1fj1 n HIS 199 N 4.49 3.04 -0.57 0.00 -0.00 -0.83 -1.72 115.22 119.64 1fj1 n HIS 199 Ca -0.17 -3.44 0.43 0.00 0.46 0.00 0.00 57.72 55.00 1fj1 n HIS 199 Cb 0.51 -0.86 0.66 0.00 -0.12 0.00 0.00 29.99 30.17 1fj1 n HIS 199 CO 0.00 0.00 0.00 -2.30 0.46 0.00 0.00 176.34 174.50 1fj1 n PRO 200 N 0.98 0.00 -0.01 1.57 -0.02 -1.26 0.11 135.00 136.38 1fj1 n PRO 200 Ca 0.29 0.89 -0.12 0.00 -2.02 0.00 0.00 63.50 62.53 1fj1 n PRO 200 Cb 0.37 -2.06 -0.08 0.00 -0.02 0.00 0.00 33.50 31.71 1fj1 n PRO 200 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1fj1 h ALA 201 N 0.80 0.07 -0.01 3.55 0.00 -1.90 -2.73 119.26 119.04 1fj1 h ALA 201 Ca 0.76 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.52 1fj1 h ALA 201 Cb 3.09 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 20.86 1fj1 h ALA 201 CO -0.01 -0.28 -0.03 -1.13 0.00 0.00 0.00 179.25 177.80 1fj1 n SER 202 N -4.90 0.83 0.00 0.00 3.41 0.30 -4.87 113.62 108.39 1fj1 n SER 202 Ca -0.07 -1.17 0.00 0.00 -0.26 0.00 0.00 58.87 57.37 1fj1 n SER 202 Cb 0.16 -0.01 0.00 0.00 -0.26 0.00 0.00 64.21 64.11 1fj1 n SER 202 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 1fj1 n SER 203 N -0.42 0.00 -4.48 4.04 2.88 -0.30 -4.93 113.62 110.41 1fj1 n SER 203 Ca 0.20 0.00 -0.25 0.00 -1.33 0.00 0.00 58.87 57.49 1fj1 n SER 203 Cb 0.26 -1.34 0.14 0.00 -0.75 0.00 0.00 64.21 62.52 1fj1 n SER 203 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 1fj1 s THR 204 N -1.82 2.03 0.19 2.46 -4.23 -1.24 -4.89 115.64 108.14 1fj1 s THR 204 Ca 0.00 -0.47 -0.23 0.00 -1.18 0.00 0.00 61.69 59.81 1fj1 s THR 204 Cb 0.00 -2.56 0.05 0.00 1.34 0.00 0.00 72.50 71.33 1fj1 s THR 204 CO 0.00 0.00 0.74 0.28 -0.54 0.00 0.00 174.62 175.10 1fj1 s THR 205 N -3.36 0.00 -0.17 3.99 -1.32 -1.26 -1.97 115.64 111.55 1fj1 s THR 205 Ca 0.70 -0.52 -0.18 0.00 -1.21 0.00 0.00 61.69 60.48 1fj1 s THR 205 Cb -0.04 -1.58 0.05 0.00 -1.51 0.00 0.00 72.50 69.42 1fj1 s THR 205 CO 0.47 0.00 0.49 -0.69 -2.21 0.00 0.00 174.62 172.68 1fj1 s VAL 206 N -3.67 0.00 -0.02 5.08 1.01 -0.72 -4.99 120.40 117.10 1fj1 s VAL 206 Ca 0.07 -0.03 0.04 0.00 0.00 0.00 0.00 61.98 62.07 1fj1 s VAL 206 Cb -0.03 -0.70 -0.03 0.00 0.00 0.00 0.00 36.38 35.62 1fj1 s VAL 206 CO -0.02 -0.02 -0.13 -1.81 0.00 0.00 0.00 175.10 173.13 1fj1 s ASP 207 N 0.10 4.16 -0.04 3.32 1.01 -1.26 -2.23 116.67 121.73 1fj1 s ASP 207 Ca -0.01 -0.22 -0.01 0.00 0.71 0.00 0.00 52.55 53.02 1fj1 s ASP 207 Cb -0.03 -0.87 0.03 0.00 1.01 0.00 0.00 42.92 43.05 1fj1 s ASP 207 CO 0.01 0.31 0.03 -0.75 0.21 0.00 0.00 175.17 174.99 1fj1 s LYS 208 N -1.04 0.10 -0.24 8.23 2.47 -0.91 -5.02 119.74 123.33 1fj1 s LYS 208 Ca 0.13 0.24 -0.21 0.00 -1.56 0.00 0.00 55.97 54.57 1fj1 s LYS 208 Cb -0.11 -0.51 -0.02 0.00 -1.46 0.00 0.00 37.83 35.73 1fj1 s LYS 208 CO 0.03 -0.25 0.66 0.21 0.16 0.00 0.00 175.35 176.16 1fj1 s LYS 209 N 1.68 4.15 -0.65 4.03 2.20 -1.26 -2.27 119.74 127.62 1fj1 s LYS 209 Ca -0.01 0.63 -0.27 0.00 -0.36 0.00 0.00 55.97 55.96 1fj1 s LYS 209 Cb -0.13 -3.63 0.01 0.00 -1.51 0.00 0.00 37.83 32.58 1fj1 s LYS 209 CO -0.03 -0.38 1.48 -0.51 -0.36 0.00 0.00 175.35 175.55 1fj1 s LEU 210 N 2.40 3.27 -0.23 5.43 2.01 -0.68 -4.96 118.68 125.91 1fj1 s LEU 210 Ca 0.28 0.01 -0.13 0.00 0.01 0.00 0.00 54.13 54.31 1fj1 s LEU 210 Cb -0.16 -2.72 -0.05 0.00 0.01 0.00 0.00 46.19 43.28 1fj1 s LEU 210 CO 0.09 -1.94 0.26 -0.70 1.01 0.00 0.00 176.35 175.06 1fj1 s GLU 211 N 6.01 4.09 0.16 1.70 2.56 -1.26 -4.66 118.70 127.31 1fj1 s GLU 211 Ca 0.49 -0.09 -0.02 0.00 0.00 0.00 0.00 54.97 55.35 1fj1 s GLU 211 Cb -0.10 -3.55 0.04 0.00 2.00 0.00 0.00 34.13 32.51 1fj1 s GLU 211 CO 0.20 -0.01 0.09 -0.35 -0.56 0.00 0.00 175.26 174.63 1fj1 n PRO 212 N 4.46 -1.24 0.00 4.30 -0.04 -1.26 -4.94 135.00 136.28 1fj1 n PRO 212 Ca -0.12 -0.14 0.00 0.00 -0.04 0.00 0.00 63.50 63.19 1fj1 n PRO 212 Cb 0.52 -0.22 0.00 0.00 -0.04 0.00 0.00 33.50 33.75 1fj1 n PRO 212 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89