#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3gfb s LYS 4 N 0.00 2.23 0.27 3.49 -0.14 -1.26 -0.35 119.74 123.98 3gfb s LYS 4 Ca 0.00 -1.31 -0.17 0.00 -1.36 0.00 0.00 55.97 53.13 3gfb s LYS 4 Cb 0.00 -2.19 0.01 0.00 -1.68 0.00 0.00 37.83 33.97 3gfb s LYS 4 CO 0.00 0.41 0.62 0.00 -0.76 0.00 0.00 175.35 175.62 3gfb s MET 5 N -3.24 1.71 0.15 1.68 0.23 0.02 -4.72 119.30 115.12 3gfb s MET 5 Ca 0.28 -1.13 -0.12 0.00 -1.03 0.00 0.00 55.69 53.70 3gfb s MET 5 Cb -0.08 0.55 -0.07 0.00 -1.53 0.00 0.00 34.83 33.71 3gfb s MET 5 CO 0.18 -0.76 0.50 -0.65 -2.03 0.00 0.00 175.02 172.26 3gfb s GLN 6 N -3.89 3.86 -0.07 3.16 -0.21 -1.26 0.22 119.66 121.47 3gfb s GLN 6 Ca 0.16 0.33 -0.10 0.00 0.02 0.00 0.00 55.36 55.77 3gfb s GLN 6 Cb -0.04 -2.88 0.02 0.00 1.00 0.00 0.00 33.01 31.11 3gfb s GLN 6 CO 0.08 0.47 0.27 0.00 -2.12 0.00 0.00 175.29 173.98 3gfb s ALA 7 N -1.53 -0.66 -0.43 6.09 0.00 -0.83 -2.54 121.76 121.86 3gfb s ALA 7 Ca 0.39 0.58 -0.24 0.00 0.00 0.00 0.00 51.96 52.69 3gfb s ALA 7 Cb -0.14 -0.29 0.02 0.00 0.00 0.00 0.00 23.12 22.72 3gfb s ALA 7 CO 0.20 -0.16 0.86 0.42 0.00 0.00 0.00 175.76 177.07 3gfb s ILE 8 N -0.31 4.58 -0.02 0.00 1.01 0.12 -1.27 121.20 125.32 3gfb s ILE 8 Ca -0.04 0.73 0.06 0.00 0.00 0.00 0.00 60.65 61.39 3gfb s ILE 8 Cb -0.03 -4.35 -0.01 0.00 0.01 0.00 0.00 42.46 38.08 3gfb s ILE 8 CO 0.01 -0.69 -0.20 -0.32 0.00 0.00 0.00 174.94 173.74 3gfb s MET 9 N 3.47 1.70 -0.63 2.79 1.75 -0.28 -1.36 119.30 126.74 3gfb s MET 9 Ca 0.34 -0.72 -0.22 0.00 -1.25 0.00 0.00 55.69 53.84 3gfb s MET 9 Cb -0.11 -1.61 0.08 0.00 2.84 0.00 0.00 34.83 36.02 3gfb s MET 9 CO 0.23 0.41 0.89 0.21 -0.65 0.00 0.00 175.02 176.11 3gfb s LYS 10 N -0.40 3.10 -0.08 4.11 2.47 0.37 0.09 119.74 129.40 3gfb s LYS 10 Ca 0.06 -0.93 0.02 0.00 -1.56 0.00 0.00 55.97 53.56 3gfb s LYS 10 Cb -0.09 -4.23 -0.25 0.00 -1.46 0.00 0.00 37.83 31.81 3gfb s LYS 10 CO -0.00 -1.72 0.52 1.79 0.16 0.00 0.00 175.35 176.10 3gfb h THR 11 N 5.96 0.74 -4.24 3.43 1.35 -1.88 0.33 112.91 118.60 3gfb h THR 11 Ca -0.29 -2.52 -0.14 0.00 -0.55 0.00 0.00 66.41 62.91 3gfb h THR 11 Cb 1.08 2.48 -0.15 0.00 -1.73 0.00 0.00 68.15 69.83 3gfb h THR 11 CO 1.15 0.72 -0.68 -0.54 -0.25 0.00 0.00 175.52 175.92 3gfb s LYS 12 N -2.58 0.68 -1.07 4.72 1.02 -1.26 -4.28 119.74 116.97 3gfb s LYS 12 Ca -0.14 -1.27 -0.22 0.00 0.02 0.00 0.00 55.97 54.36 3gfb s LYS 12 Cb 0.07 0.19 -0.10 0.00 -0.52 0.00 0.00 37.83 37.47 3gfb s LYS 12 CO 0.80 -0.13 1.92 -2.30 -0.92 0.00 0.00 175.35 174.72 3gfb n PRO 13 N 0.06 1.69 -3.92 -1.68 -0.02 -1.26 -4.88 135.00 124.99 3gfb n PRO 13 Ca -0.12 -2.34 -0.08 0.00 -2.02 0.00 0.00 63.50 58.94 3gfb n PRO 13 Cb 0.61 -3.47 -0.03 0.00 -0.02 0.00 0.00 33.50 30.60 3gfb n PRO 13 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3gfb s ALA 14 N 8.72 -0.78 0.89 3.55 0.00 -1.26 -5.15 121.76 127.73 3gfb s ALA 14 Ca 0.64 -0.57 -0.16 0.00 0.00 0.00 0.00 51.96 51.87 3gfb s ALA 14 Cb 0.04 0.94 -0.09 0.00 0.00 0.00 0.00 23.12 24.01 3gfb s ALA 14 CO 0.13 -0.96 -0.26 0.98 0.00 0.00 0.00 175.76 175.65 3gfb n TYR 15 N -0.43 -3.45 -4.09 0.00 9.36 -1.26 -4.68 117.16 112.61 3gfb n TYR 15 Ca -0.03 0.14 0.00 0.00 3.32 0.00 0.00 57.90 61.33 3gfb n TYR 15 Cb 0.60 -1.61 -0.00 0.00 -0.63 0.00 0.00 39.34 37.70 3gfb n TYR 15 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 3gfb n GLY 16 N 2.65 -1.99 3.46 2.98 0.00 0.72 -4.97 105.19 108.04 3gfb n GLY 16 Ca 0.03 -1.39 -0.14 0.00 0.00 0.00 0.00 46.02 44.52 3gfb n GLY 16 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gfb s ALA 17 N -1.10 -1.64 -0.16 4.61 0.00 -1.26 -4.76 121.76 117.44 3gfb s ALA 17 Ca 0.00 0.81 -0.05 0.00 0.00 0.00 0.00 51.96 52.72 3gfb s ALA 17 Cb 0.00 0.51 -0.03 0.00 0.00 0.00 0.00 23.12 23.60 3gfb s ALA 17 CO 0.00 -0.60 0.00 -1.21 0.00 0.00 0.00 175.76 173.96 3gfb s GLU 18 N -2.68 3.73 -0.42 0.00 2.02 0.11 -4.90 118.70 116.57 3gfb s GLU 18 Ca -0.04 -0.44 -0.27 0.00 0.02 0.00 0.00 54.97 54.24 3gfb s GLU 18 Cb -0.01 -3.02 -0.05 0.00 0.10 0.00 0.00 34.13 31.16 3gfb s GLU 18 CO -0.03 0.30 2.21 -1.17 0.02 0.00 0.00 175.26 176.58 3gfb s LEU 19 N 0.24 3.41 0.25 1.80 2.96 -1.26 -1.12 118.68 124.95 3gfb s LEU 19 Ca 0.00 1.20 0.10 0.00 -0.22 0.00 0.00 54.13 55.22 3gfb s LEU 19 Cb -0.13 -2.89 -0.05 0.00 0.50 0.00 0.00 46.19 43.62 3gfb s LEU 19 CO 0.02 -2.43 -0.18 0.68 -1.32 0.00 0.00 176.35 173.11 3gfb s VAL 20 N 10.12 2.21 -0.20 1.68 -7.23 -0.40 -4.95 120.40 121.62 3gfb s VAL 20 Ca 0.92 -2.33 -0.13 0.00 -1.81 0.00 0.00 61.98 58.63 3gfb s VAL 20 Cb -0.21 -2.20 -0.05 0.00 0.56 0.00 0.00 36.38 34.48 3gfb s VAL 20 CO 0.28 -0.47 0.25 -0.70 -0.31 0.00 0.00 175.10 174.15 3gfb s GLU 21 N -3.54 4.16 0.22 4.82 2.12 -1.26 -1.97 118.70 123.25 3gfb s GLU 21 Ca 0.27 -0.06 0.02 0.00 0.36 0.00 0.00 54.97 55.56 3gfb s GLU 21 Cb -0.04 -3.49 -0.05 0.00 0.26 0.00 0.00 34.13 30.81 3gfb s GLU 21 CO 0.12 0.12 0.05 0.14 -0.54 0.00 0.00 175.26 175.15 3gfb s VAL 22 N 0.86 0.64 0.55 3.70 -7.23 0.13 -4.96 120.40 114.10 3gfb s VAL 22 Ca 0.13 -1.99 -0.19 0.00 -1.81 0.00 0.00 61.98 58.11 3gfb s VAL 22 Cb -0.13 -2.39 -0.06 0.00 0.56 0.00 0.00 36.38 34.36 3gfb s VAL 22 CO 0.04 -0.23 1.11 -1.81 -0.31 0.00 0.00 175.10 173.90 3gfb s ASP 23 N -3.25 5.78 -0.12 4.85 -0.00 -1.26 -0.80 116.67 121.86 3gfb s ASP 23 Ca 0.31 2.10 -0.29 0.00 -0.00 0.00 0.00 52.55 54.67 3gfb s ASP 23 Cb 0.07 -2.57 -0.01 0.00 -0.00 0.00 0.00 42.92 40.41 3gfb s ASP 23 CO 0.09 -1.18 1.02 -0.69 -0.00 0.00 0.00 175.17 174.42 3gfb s VAL 24 N -1.88 4.75 0.72 -1.27 1.01 0.53 -4.76 120.40 119.50 3gfb s VAL 24 Ca 0.71 2.03 -0.13 0.00 0.00 0.00 0.00 61.98 64.58 3gfb s VAL 24 Cb -0.22 -4.30 0.04 0.00 0.00 0.00 0.00 36.38 31.89 3gfb s VAL 24 CO 0.27 -0.02 1.13 -2.16 0.00 0.00 0.00 175.10 174.32 3gfb s PRO 25 N 2.21 2.36 -0.17 2.72 0.04 -1.26 -4.87 135.00 136.02 3gfb s PRO 25 Ca 0.48 1.44 -0.04 0.00 0.04 0.00 0.00 61.00 62.91 3gfb s PRO 25 Cb -0.18 -1.89 -0.03 0.00 0.04 0.00 0.00 34.50 32.44 3gfb s PRO 25 CO 0.16 -1.60 -0.02 0.15 0.04 0.00 0.00 177.00 175.74 3gfb s LYS 26 N -4.29 3.66 -0.18 4.56 1.02 -1.26 -4.95 119.74 118.30 3gfb s LYS 26 Ca 0.67 -0.52 -0.29 0.00 0.02 0.00 0.00 55.97 55.86 3gfb s LYS 26 Cb -0.22 -2.99 -0.03 0.00 -0.52 0.00 0.00 37.83 34.07 3gfb s LYS 26 CO 0.47 0.15 1.62 -1.25 -0.92 0.00 0.00 175.35 175.42 3gfb s PRO 27 N 0.63 3.89 0.00 -1.68 0.04 -1.26 -5.05 135.00 131.56 3gfb s PRO 27 Ca -0.01 1.79 0.00 0.00 0.04 0.00 0.00 61.00 62.81 3gfb s PRO 27 Cb -0.14 -4.02 0.00 0.00 0.04 0.00 0.00 34.50 30.38 3gfb s PRO 27 CO 0.02 -1.19 0.00 0.41 0.04 0.00 0.00 177.00 176.29 3gfb n GLY 28 N 4.52 -0.15 3.77 0.56 0.00 -1.26 -4.22 105.19 108.41 3gfb n GLY 28 Ca 0.18 -1.74 -0.41 0.00 0.00 0.00 0.00 46.02 44.06 3gfb n GLY 28 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3gfb s PRO 29 N 0.24 4.30 0.00 1.61 0.02 -1.26 -1.94 135.00 137.96 3gfb s PRO 29 Ca 0.00 2.30 0.00 0.00 0.02 0.00 0.00 61.00 63.32 3gfb s PRO 29 Cb 0.00 -3.05 0.00 0.00 0.02 0.00 0.00 34.50 31.47 3gfb s PRO 29 CO 0.00 -0.27 0.00 0.41 -0.33 0.00 0.00 177.00 176.81 3gfb n GLY 30 N 0.79 0.62 3.64 0.52 0.00 -1.14 -4.95 105.19 104.68 3gfb n GLY 30 Ca 0.01 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.79 3gfb n GLY 30 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3gfb s GLU 31 N -0.37 2.30 0.03 1.61 2.02 -0.82 -0.81 118.70 122.66 3gfb s GLU 31 Ca 0.00 -1.35 0.03 0.00 0.02 0.00 0.00 54.97 53.67 3gfb s GLU 31 Cb 0.00 -2.20 -0.02 0.00 0.10 0.00 0.00 34.13 32.02 3gfb s GLU 31 CO 0.00 0.38 -0.10 0.08 0.02 0.00 0.00 175.26 175.64 3gfb s VAL 32 N -2.18 0.79 -0.15 2.63 1.01 -0.38 0.76 120.40 122.88 3gfb s VAL 32 Ca 0.30 -0.81 -0.04 0.00 0.00 0.00 0.00 61.98 61.44 3gfb s VAL 32 Cb -0.07 -0.74 -0.03 0.00 0.00 0.00 0.00 36.38 35.54 3gfb s VAL 32 CO 0.19 -0.05 -0.03 -0.22 0.00 0.00 0.00 175.10 174.99 3gfb s LEU 33 N -0.96 3.32 0.06 3.92 0.20 0.20 0.11 118.68 125.53 3gfb s LEU 33 Ca -0.01 -0.08 0.09 0.00 0.69 0.00 0.00 54.13 54.82 3gfb s LEU 33 Cb -0.07 -1.80 -0.03 0.00 -0.43 0.00 0.00 46.19 43.86 3gfb s LEU 33 CO 0.01 0.20 -0.24 0.27 -0.29 0.00 0.00 176.35 176.29 3gfb s ILE 34 N 0.20 2.33 -0.18 6.68 -4.36 -0.30 -0.34 121.20 125.23 3gfb s ILE 34 Ca -0.01 -1.40 -0.29 0.00 -0.26 0.00 0.00 60.65 58.68 3gfb s ILE 34 Cb -0.14 -1.95 -0.00 0.00 1.25 0.00 0.00 42.46 41.62 3gfb s ILE 34 CO 0.03 0.31 1.10 -0.75 0.24 0.00 0.00 174.94 175.87 3gfb s LYS 35 N -1.44 4.28 -0.47 0.37 2.20 0.56 -1.97 119.74 123.28 3gfb s LYS 35 Ca 0.13 1.46 -0.29 0.00 -0.36 0.00 0.00 55.97 56.91 3gfb s LYS 35 Cb -0.10 -3.65 0.03 0.00 -1.51 0.00 0.00 37.83 32.59 3gfb s LYS 35 CO 0.04 -0.59 1.17 0.08 -0.36 0.00 0.00 175.35 175.68 3gfb s VAL 36 N 3.05 4.18 -0.04 4.02 1.01 -0.23 -1.28 120.40 131.12 3gfb s VAL 36 Ca 0.48 1.21 -0.04 0.00 0.00 0.00 0.00 61.98 63.64 3gfb s VAL 36 Cb -0.18 -4.56 -0.28 0.00 0.00 0.00 0.00 36.38 31.37 3gfb s VAL 36 CO 0.11 -0.97 0.71 -0.07 0.00 0.00 0.00 175.10 174.88 3gfb h LEU 37 N 11.29 0.40 -7.25 3.92 3.38 -1.51 -3.37 115.31 122.18 3gfb h LEU 37 Ca -0.23 -0.64 -0.10 0.00 0.09 0.00 0.00 57.88 57.00 3gfb h LEU 37 Cb 1.06 -0.13 -0.22 0.00 0.09 0.00 0.00 40.66 41.47 3gfb h LEU 37 CO 1.12 1.55 -0.11 0.00 0.09 0.00 0.00 178.44 181.09 3gfb s ALA 38 N -2.60 -1.23 -0.14 1.53 0.00 -1.04 -4.24 121.76 114.04 3gfb s ALA 38 Ca -0.12 1.19 -0.06 0.00 0.00 0.00 0.00 51.96 52.96 3gfb s ALA 38 Cb 0.07 -0.52 0.06 0.00 0.00 0.00 0.00 23.12 22.73 3gfb s ALA 38 CO 0.83 -0.26 0.30 -0.08 0.00 0.00 0.00 175.76 176.55 3gfb s THR 39 N -0.27 -0.28 0.37 0.00 -1.32 -0.67 -0.84 115.64 112.63 3gfb s THR 39 Ca -0.04 0.20 -0.03 0.00 -1.21 0.00 0.00 61.69 60.60 3gfb s THR 39 Cb -0.03 -0.48 -0.04 0.00 -1.51 0.00 0.00 72.50 70.43 3gfb s THR 39 CO 0.03 0.08 0.63 -0.94 -2.21 0.00 0.00 174.62 172.21 3gfb s SER 40 N 1.96 6.34 -0.22 8.08 1.04 -1.07 -0.91 113.70 128.92 3gfb s SER 40 Ca -0.04 0.70 -0.20 0.00 0.48 0.00 0.00 55.95 56.89 3gfb s SER 40 Cb -0.11 -2.14 -0.02 0.00 0.10 0.00 0.00 66.02 63.85 3gfb s SER 40 CO -0.10 -0.36 0.61 -0.63 0.98 0.00 0.00 173.24 173.74 3gfb s ILE 41 N -2.38 5.02 0.26 -1.02 1.01 -1.05 -4.25 121.20 118.79 3gfb s ILE 41 Ca 0.44 1.12 -0.17 0.00 0.00 0.00 0.00 60.65 62.04 3gfb s ILE 41 Cb -0.10 -3.92 -0.08 0.00 0.01 0.00 0.00 42.46 38.36 3gfb s ILE 41 CO 0.37 0.08 0.71 0.00 0.00 0.00 0.00 174.94 176.10 3gfb h GLY 43 N 2.89 1.16 0.99 0.00 0.00 -1.99 0.12 103.07 106.23 3gfb h GLY 43 Ca -0.48 -0.19 -0.00 0.00 0.00 0.00 0.00 47.33 46.66 3gfb h GLY 43 CO 0.65 -0.15 0.27 -0.84 0.00 0.00 0.00 176.54 176.47 3gfb h THR 44 N 0.35 1.14 -0.44 4.70 2.02 -1.99 -0.84 112.91 117.83 3gfb h THR 44 Ca 0.61 -0.32 -0.04 0.00 0.77 0.00 0.00 66.41 67.43 3gfb h THR 44 Cb 1.63 0.56 -0.02 0.00 -1.74 0.00 0.00 68.15 68.58 3gfb h THR 44 CO -0.29 0.14 0.10 0.44 0.37 0.00 0.00 175.52 176.28 3gfb h ASP 45 N 0.58 0.68 -0.99 4.18 3.32 -1.58 -1.02 116.42 121.59 3gfb h ASP 45 Ca 0.16 -0.24 0.21 0.00 0.02 0.00 0.00 57.03 57.19 3gfb h ASP 45 Cb -0.00 -0.18 -0.10 0.00 0.22 0.00 0.00 39.33 39.27 3gfb h ASP 45 CO -0.03 0.74 0.62 0.25 -1.72 0.00 0.00 179.24 179.10 3gfb h LEU 46 N 0.59 0.65 -0.20 1.55 5.85 -0.45 0.15 115.31 123.44 3gfb h LEU 46 Ca 0.14 0.09 -0.07 0.00 0.84 0.00 0.00 57.88 58.88 3gfb h LEU 46 Cb 0.33 -0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.32 3gfb h LEU 46 CO 0.00 0.20 -0.33 0.45 -0.34 0.00 0.00 178.44 178.42 3gfb h HIS 47 N 0.61 0.00 -0.20 1.25 3.86 -0.17 -0.34 115.15 120.16 3gfb h HIS 47 Ca 0.57 0.00 -0.21 0.00 -1.16 0.00 0.00 60.37 59.57 3gfb h HIS 47 Cb 1.10 0.00 0.01 0.00 1.06 0.00 0.00 27.41 29.57 3gfb h HIS 47 CO -0.00 0.33 -0.69 0.82 0.86 0.00 0.00 177.93 179.24 3gfb h ILE 48 N 0.00 1.28 0.72 2.45 2.04 -0.42 0.14 117.51 123.73 3gfb h ILE 48 Ca -0.00 -1.90 -0.04 0.00 1.00 0.00 0.00 64.86 63.93 3gfb h ILE 48 Cb 1.18 1.86 0.01 0.00 -0.74 0.00 0.00 36.82 39.13 3gfb h ILE 48 CO 0.04 0.61 -0.35 0.22 0.00 0.00 0.00 178.15 178.67 3gfb h TYR 49 N 0.57 -0.90 -1.04 1.37 3.20 -0.24 -2.60 116.97 117.33 3gfb h TYR 49 Ca -0.03 -0.02 0.28 0.00 3.14 0.00 0.00 58.73 62.10 3gfb h TYR 49 Cb 1.31 0.30 -0.12 0.00 1.54 0.00 0.00 36.73 39.76 3gfb h TYR 49 CO 0.08 -0.56 0.63 0.93 -1.64 0.00 0.00 178.16 177.60 3gfb h GLU 50 N -1.12 0.42 -2.96 1.82 5.08 -1.23 0.20 114.58 116.81 3gfb h GLU 50 Ca -0.10 -0.03 -0.18 0.00 -1.00 0.00 0.00 59.36 58.05 3gfb h GLU 50 Cb 0.74 -0.10 0.05 0.00 0.50 0.00 0.00 28.75 29.95 3gfb h GLU 50 CO 0.16 0.28 -0.30 1.87 -1.00 0.00 0.00 179.01 180.02 3gfb n TRP 51 N -4.84 -1.20 -0.02 4.33 -0.00 0.47 -4.02 117.44 112.16 3gfb n TRP 51 Ca 0.28 0.40 -0.03 0.00 -0.00 0.00 0.00 57.50 58.15 3gfb n TRP 51 Cb 0.89 -2.77 0.03 0.00 -0.00 0.00 0.00 31.31 29.46 3gfb n TRP 51 CO 0.00 0.00 0.00 0.27 -0.00 0.00 0.00 177.69 177.96 3gfb n ASN 52 N -0.45 -2.17 -0.03 5.87 0.23 -1.14 -4.62 115.26 112.95 3gfb n ASN 52 Ca -0.01 -0.09 -0.13 0.00 -0.53 0.00 0.00 54.58 53.82 3gfb n ASN 52 Cb 0.53 -0.10 -0.09 0.00 -2.08 0.00 0.00 39.78 38.04 3gfb n ASN 52 CO 0.00 0.00 0.00 -0.33 -0.93 0.00 0.00 177.26 176.00 3gfb h GLU 53 N 0.00 0.14 -0.52 -3.83 3.07 -1.95 -2.00 114.58 109.49 3gfb h GLU 53 Ca -0.04 -0.08 0.10 0.00 -0.50 0.00 0.00 59.36 58.84 3gfb h GLU 53 Cb 0.13 0.01 -0.10 0.00 -0.84 0.00 0.00 28.75 27.95 3gfb h GLU 53 CO 0.02 0.64 -0.10 2.35 -1.40 0.00 0.00 179.01 180.52 3gfb h TRP 54 N -0.35 -0.22 -0.68 4.33 7.01 -1.94 -2.81 115.95 121.28 3gfb h TRP 54 Ca 0.00 0.04 -0.08 0.00 2.11 0.00 0.00 58.89 60.97 3gfb h TRP 54 Cb 0.62 0.18 -0.03 0.00 -2.10 0.00 0.00 29.16 27.84 3gfb h TRP 54 CO 0.11 -0.20 0.12 0.00 -2.79 0.00 0.00 178.44 175.67 3gfb h ALA 55 N 1.51 0.90 -0.92 2.65 0.00 -1.75 -2.01 119.26 119.64 3gfb h ALA 55 Ca 0.25 -0.27 0.19 0.00 0.00 0.00 0.00 54.91 55.08 3gfb h ALA 55 Cb 0.39 -0.26 -0.11 0.00 0.00 0.00 0.00 17.79 17.81 3gfb h ALA 55 CO -0.51 0.67 0.48 1.96 0.00 0.00 0.00 179.25 181.85 3gfb h GLN 56 N 1.05 0.56 -0.25 0.00 4.20 -1.14 -2.05 115.11 117.49 3gfb h GLN 56 Ca 0.21 -0.03 -0.12 0.00 0.06 0.00 0.00 58.65 58.77 3gfb h GLN 56 Cb 0.44 -0.13 -0.00 0.00 0.30 0.00 0.00 27.48 28.09 3gfb h GLN 56 CO 0.01 0.37 -0.30 0.66 -0.67 0.00 0.00 178.83 178.90 3gfb h SER 57 N 0.58 0.70 0.00 1.46 4.64 -1.14 -3.42 113.55 116.37 3gfb h SER 57 Ca 0.54 -0.49 -0.46 0.00 -0.47 0.00 0.00 61.79 60.91 3gfb h SER 57 Cb 0.91 -0.20 -0.07 0.00 -0.31 0.00 0.00 62.40 62.74 3gfb h SER 57 CO -0.43 1.05 -2.49 -1.14 -0.87 0.00 0.00 176.83 172.95 3gfb n ARG 58 N -4.29 0.59 -3.06 4.77 3.00 -0.95 -4.97 116.66 111.75 3gfb n ARG 58 Ca -0.05 0.27 -0.39 0.00 -0.00 0.00 0.00 57.85 57.68 3gfb n ARG 58 Cb 0.48 -1.50 -0.06 0.00 0.00 0.00 0.00 32.46 31.38 3gfb n ARG 58 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.63 176.13 3gfb s ILE 59 N -2.50 4.48 -0.53 5.15 1.10 -0.80 -4.93 121.20 123.17 3gfb s ILE 59 Ca -0.38 1.57 0.00 0.00 -0.51 0.00 0.00 60.65 61.33 3gfb s ILE 59 Cb 0.14 -4.07 0.14 0.00 0.15 0.00 0.00 42.46 38.82 3gfb s ILE 59 CO 0.50 0.53 0.31 -0.54 -2.11 0.00 0.00 174.94 173.63 3gfb s LYS 60 N -1.10 2.18 0.63 3.50 1.02 -1.26 -4.86 119.74 119.85 3gfb s LYS 60 Ca 0.34 -2.43 -0.16 0.00 0.02 0.00 0.00 55.97 53.73 3gfb s LYS 60 Cb -0.22 -3.51 -0.02 0.00 -0.52 0.00 0.00 37.83 33.57 3gfb s LYS 60 CO 0.24 -1.12 1.12 -2.14 -0.92 0.00 0.00 175.35 172.54 3gfb s PRO 61 N 0.06 2.93 0.26 -1.68 0.02 -1.26 -4.53 135.00 130.80 3gfb s PRO 61 Ca 0.15 1.47 -0.23 0.00 0.02 0.00 0.00 61.00 62.41 3gfb s PRO 61 Cb -0.23 -1.96 -0.09 0.00 0.02 0.00 0.00 34.50 32.24 3gfb s PRO 61 CO -0.03 -1.16 0.83 -1.25 -0.33 0.00 0.00 177.00 175.07 3gfb s PRO 62 N -3.86 4.46 -0.03 5.54 0.04 -1.26 -4.96 135.00 134.94 3gfb s PRO 62 Ca 0.69 1.12 -0.19 0.00 0.04 0.00 0.00 61.00 62.66 3gfb s PRO 62 Cb -0.22 -2.91 0.04 0.00 0.04 0.00 0.00 34.50 31.45 3gfb s PRO 62 CO 0.37 0.37 0.40 -1.14 0.04 0.00 0.00 177.00 177.05 3gfb s GLN 63 N -1.87 0.76 0.03 4.56 0.74 0.11 -4.97 119.66 119.01 3gfb s GLN 63 Ca 0.45 -0.06 -0.29 0.00 0.05 0.00 0.00 55.36 55.51 3gfb s GLN 63 Cb -0.19 0.35 -0.04 0.00 1.10 0.00 0.00 33.01 34.23 3gfb s GLN 63 CO 0.23 -0.22 0.94 0.42 -0.55 0.00 0.00 175.29 176.11 3gfb s ILE 64 N -1.25 4.78 0.84 -2.34 1.01 -1.26 -0.48 121.20 122.49 3gfb s ILE 64 Ca -0.13 1.98 -0.13 0.00 0.00 0.00 0.00 60.65 62.38 3gfb s ILE 64 Cb -0.04 -4.28 0.10 0.00 0.01 0.00 0.00 42.46 38.25 3gfb s ILE 64 CO 0.06 0.22 1.21 -0.04 0.00 0.00 0.00 174.94 176.39 3gfb s MET 65 N 0.65 1.69 0.00 2.79 -1.94 -0.46 -1.48 119.30 120.54 3gfb s MET 65 Ca 0.48 -0.00 0.00 0.00 -1.71 0.00 0.00 55.69 54.46 3gfb s MET 65 Cb -0.21 -1.93 0.00 0.00 2.01 0.00 0.00 34.83 34.70 3gfb s MET 65 CO 0.27 -1.77 0.00 0.41 -0.01 0.00 0.00 175.02 173.92 3gfb n GLY 66 N -3.41 2.41 0.00 -0.03 0.00 -1.26 -1.73 105.19 101.17 3gfb n GLY 66 Ca 0.09 -1.65 0.00 0.00 0.00 0.00 0.00 46.02 44.47 3gfb n GLY 66 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 3gfb n HIS 67 N 1.51 0.00 -2.61 1.61 1.44 -1.26 -2.86 115.22 113.05 3gfb n HIS 67 Ca 0.00 0.00 -0.43 0.00 -2.01 0.00 0.00 57.72 55.28 3gfb n HIS 67 Cb 0.00 0.00 -0.02 0.00 0.12 0.00 0.00 29.99 30.09 3gfb n HIS 67 CO 0.00 0.00 0.00 -1.21 -2.81 0.00 0.00 176.34 172.32 3gfb s GLU 68 N -1.00 3.87 0.00 -1.40 2.02 -1.26 -4.81 118.70 116.13 3gfb s GLU 68 Ca 0.00 0.80 0.04 0.00 0.02 0.00 0.00 54.97 55.83 3gfb s GLU 68 Cb 0.00 -3.83 -0.01 0.00 0.10 0.00 0.00 34.13 30.38 3gfb s GLU 68 CO 0.00 -1.17 -0.12 0.54 0.02 0.00 0.00 175.26 174.52 3gfb s VAL 69 N 4.12 0.98 -0.18 2.63 0.11 -1.26 -2.60 120.40 124.21 3gfb s VAL 69 Ca 0.47 -0.64 -0.00 0.00 -2.93 0.00 0.00 61.98 58.88 3gfb s VAL 69 Cb -0.09 -0.84 0.01 0.00 -1.53 0.00 0.00 36.38 33.92 3gfb s VAL 69 CO 0.25 0.20 -0.15 0.00 -3.33 0.00 0.00 175.10 172.06 3gfb s ALA 70 N -0.43 2.49 0.05 1.54 0.00 -0.02 -4.06 121.76 121.32 3gfb s ALA 70 Ca 0.04 -1.14 -0.12 0.00 0.00 0.00 0.00 51.96 50.74 3gfb s ALA 70 Cb -0.05 -1.30 0.01 0.00 0.00 0.00 0.00 23.12 21.78 3gfb s ALA 70 CO -0.00 -0.23 0.26 0.20 0.00 0.00 0.00 175.76 175.99 3gfb s GLY 71 N 1.13 -0.05 -0.15 0.00 0.00 0.37 -1.26 107.32 107.36 3gfb s GLY 71 Ca 0.01 -0.18 0.02 0.00 0.00 0.00 0.00 44.72 44.57 3gfb s GLY 71 CO -0.05 -0.38 -0.21 1.85 0.00 0.00 0.00 173.10 174.31 3gfb s GLU 72 N -2.84 3.04 0.12 2.90 2.12 -0.40 -0.26 118.70 123.37 3gfb s GLU 72 Ca -0.03 -0.84 -0.31 0.00 0.36 0.00 0.00 54.97 54.15 3gfb s GLU 72 Cb 0.00 -2.49 -0.10 0.00 0.26 0.00 0.00 34.13 31.81 3gfb s GLU 72 CO -0.05 -0.06 1.69 0.08 -0.54 0.00 0.00 175.26 176.38 3gfb s VAL 73 N 0.93 2.72 -0.07 3.70 1.01 0.10 -0.32 120.40 128.46 3gfb s VAL 73 Ca -0.04 0.32 0.14 0.00 0.00 0.00 0.00 61.98 62.40 3gfb s VAL 73 Cb -0.15 -3.20 -0.21 0.00 0.00 0.00 0.00 36.38 32.82 3gfb s VAL 73 CO -0.04 0.01 0.21 1.33 0.00 0.00 0.00 175.10 176.60 3gfb n VAL 74 N 4.49 0.43 -3.55 2.92 0.24 0.54 -1.64 118.33 121.77 3gfb n VAL 74 Ca 0.16 -0.46 -0.15 0.00 -2.04 0.00 0.00 64.34 61.85 3gfb n VAL 74 Cb 0.39 -0.19 -0.06 0.00 -1.47 0.00 0.00 33.84 32.51 3gfb n VAL 74 CO 0.00 0.00 0.00 -0.70 -2.14 0.00 0.00 176.83 173.99 3gfb s GLU 75 N -2.74 0.90 -0.10 7.34 2.12 -1.19 -4.82 118.70 120.22 3gfb s GLU 75 Ca -0.06 0.35 0.03 0.00 0.36 0.00 0.00 54.97 55.65 3gfb s GLU 75 Cb 0.07 0.43 -0.00 0.00 0.26 0.00 0.00 34.13 34.89 3gfb s GLU 75 CO 0.61 -0.26 -0.22 0.08 -0.54 0.00 0.00 175.26 174.93 3gfb s VAL 76 N -0.90 2.23 1.12 3.70 1.01 -1.26 0.61 120.40 126.91 3gfb s VAL 76 Ca -0.07 -0.96 -0.14 0.00 0.00 0.00 0.00 61.98 60.81 3gfb s VAL 76 Cb -0.01 -1.86 0.25 0.00 0.00 0.00 0.00 36.38 34.76 3gfb s VAL 76 CO 0.06 0.55 1.06 -0.83 0.00 0.00 0.00 175.10 175.95 3gfb s GLY 77 N 0.31 1.54 0.05 4.51 0.00 0.23 -4.93 107.32 109.03 3gfb s GLY 77 Ca -0.17 -0.40 -0.36 0.00 0.00 0.00 0.00 44.72 43.79 3gfb s GLY 77 CO 0.08 0.32 1.50 -1.05 0.00 0.00 0.00 173.10 173.94 3gfb n PRO 78 N -4.64 1.51 -2.54 2.90 -0.02 -1.26 -2.92 135.00 128.03 3gfb n PRO 78 Ca 0.05 0.54 -0.04 0.00 -2.02 0.00 0.00 63.50 62.04 3gfb n PRO 78 Cb 0.57 -2.24 0.01 0.00 -0.02 0.00 0.00 33.50 31.81 3gfb n PRO 78 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3gfb n GLY 79 N 3.11 0.56 3.33 -1.23 0.00 -1.26 -2.90 105.19 106.81 3gfb n GLY 79 Ca 0.19 -0.56 -0.36 0.00 0.00 0.00 0.00 46.02 45.29 3gfb n GLY 79 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3gfb s VAL 80 N -2.84 3.62 -0.05 1.61 1.01 -1.15 -4.43 120.40 118.17 3gfb s VAL 80 Ca 0.08 -0.50 0.14 0.00 0.00 0.00 0.00 61.98 61.70 3gfb s VAL 80 Cb -0.04 -2.71 -0.21 0.00 0.00 0.00 0.00 36.38 33.43 3gfb s VAL 80 CO 0.10 0.33 0.25 -1.84 0.00 0.00 0.00 175.10 173.94 3gfb n GLU 81 N 4.82 0.79 0.00 2.72 0.00 -1.26 -4.65 120.64 123.06 3gfb n GLU 81 Ca -0.17 -0.10 0.11 0.00 0.00 0.00 0.00 57.16 57.00 3gfb n GLU 81 Cb 0.50 -1.35 0.15 0.00 0.00 0.00 0.00 31.44 30.74 3gfb n GLU 81 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 3gfb n ASP 82 N -2.13 0.74 -4.41 -1.84 8.00 -1.26 -4.79 116.55 110.85 3gfb n ASP 82 Ca -0.08 -0.56 -0.31 0.00 0.71 0.00 0.00 54.79 54.55 3gfb n ASP 82 Cb 0.53 0.46 -0.14 0.00 -0.02 0.00 0.00 41.12 41.95 3gfb n ASP 82 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3gfb s LEU 83 N -2.94 2.45 0.10 0.64 1.43 -1.26 -5.13 118.68 113.98 3gfb s LEU 83 Ca 0.12 -0.44 -0.03 0.00 -1.03 0.00 0.00 54.13 52.75 3gfb s LEU 83 Cb 0.17 -1.44 -0.03 0.00 0.03 0.00 0.00 46.19 44.92 3gfb s LEU 83 CO 0.73 0.28 0.07 0.00 0.23 0.00 0.00 176.35 177.66 3gfb s GLN 84 N -1.18 0.85 0.12 1.70 -2.07 -1.26 -4.94 119.66 112.87 3gfb s GLN 84 Ca 0.13 -1.28 -0.35 0.00 -1.82 0.00 0.00 55.36 52.03 3gfb s GLN 84 Cb -0.10 0.26 -0.16 0.00 -1.09 0.00 0.00 33.01 31.91 3gfb s GLN 84 CO 0.03 -0.23 1.31 0.28 -1.32 0.00 0.00 175.29 175.35 3gfb n VAL 85 N -0.04 0.25 0.00 3.63 0.31 -1.26 -2.03 118.33 119.19 3gfb n VAL 85 Ca -0.09 -0.06 0.00 0.00 -0.01 0.00 0.00 64.34 64.17 3gfb n VAL 85 Cb 0.63 -0.88 0.00 0.00 -0.91 0.00 0.00 33.84 32.68 3gfb n VAL 85 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3gfb n GLY 86 N 2.43 1.43 3.71 2.92 0.00 -0.65 -4.97 105.19 110.05 3gfb n GLY 86 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 3gfb n GLY 86 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3gfb s ASP 87 N -1.74 6.63 -0.43 1.61 1.01 -0.86 -4.73 116.67 118.16 3gfb s ASP 87 Ca 0.00 2.54 -0.21 0.00 0.71 0.00 0.00 52.55 55.59 3gfb s ASP 87 Cb 0.00 -2.58 0.02 0.00 1.01 0.00 0.00 42.92 41.37 3gfb s ASP 87 CO 0.00 -0.82 0.65 -0.47 0.21 0.00 0.00 175.17 174.74 3gfb s TYR 88 N 1.52 3.07 0.14 4.23 5.04 -1.26 0.01 117.35 130.10 3gfb s TYR 88 Ca 0.70 0.01 0.05 0.00 -2.44 0.00 0.00 57.07 55.40 3gfb s TYR 88 Cb -0.42 -3.33 -0.04 0.00 0.35 0.00 0.00 41.96 38.52 3gfb s TYR 88 CO 0.31 -0.84 -0.12 0.96 -1.34 0.00 0.00 175.55 174.52 3gfb s ILE 89 N 2.82 1.30 0.26 3.14 -4.36 0.64 -0.06 121.20 124.94 3gfb s ILE 89 Ca 0.23 -1.89 0.10 0.00 -0.26 0.00 0.00 60.65 58.83 3gfb s ILE 89 Cb -0.14 -1.69 -0.04 0.00 1.25 0.00 0.00 42.46 41.84 3gfb s ILE 89 CO 0.19 -0.56 -0.05 -0.44 0.24 0.00 0.00 174.94 174.32 3gfb s SER 90 N -2.80 4.36 0.01 4.36 0.01 0.76 -0.47 113.70 119.92 3gfb s SER 90 Ca 0.13 -0.70 0.05 0.00 1.31 0.00 0.00 55.95 56.74 3gfb s SER 90 Cb -0.02 -0.74 -0.03 0.00 0.21 0.00 0.00 66.02 65.44 3gfb s SER 90 CO 0.02 0.02 -0.14 -0.69 0.41 0.00 0.00 173.24 172.87 3gfb s VAL 91 N -2.29 3.12 -0.35 3.43 1.01 -1.26 0.42 120.40 124.48 3gfb s VAL 91 Ca 0.30 -0.95 -0.19 0.00 0.00 0.00 0.00 61.98 61.14 3gfb s VAL 91 Cb -0.06 -2.31 -0.00 0.00 0.00 0.00 0.00 36.38 34.01 3gfb s VAL 91 CO 0.19 0.42 0.59 -0.70 0.00 0.00 0.00 175.10 175.59 3gfb s GLU 92 N -1.26 3.66 0.03 2.72 2.56 0.21 -4.84 118.70 121.77 3gfb s GLU 92 Ca 0.15 -0.03 0.28 0.00 0.00 0.00 0.00 54.97 55.36 3gfb s GLU 92 Cb -0.11 -3.81 0.98 0.00 2.00 0.00 0.00 34.13 33.20 3gfb s GLU 92 CO 0.05 -0.69 1.76 0.25 -0.56 0.00 0.00 175.26 176.07 3gfb n THR 93 N 5.51 0.07 -2.33 -1.70 -2.24 -1.26 -4.34 114.28 108.00 3gfb n THR 93 Ca -0.03 -0.04 -0.35 0.00 -2.27 0.00 0.00 64.05 61.37 3gfb n THR 93 Cb 0.49 -0.31 -0.04 0.00 -2.10 0.00 0.00 70.33 68.37 3gfb n THR 93 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 3gfb s HIS 94 N -3.02 2.21 -0.91 4.78 3.76 -1.26 -2.32 115.29 118.54 3gfb s HIS 94 Ca 0.13 -0.20 -0.24 0.00 -0.15 0.00 0.00 55.06 54.60 3gfb s HIS 94 Cb 0.18 -4.40 0.00 0.00 1.11 0.00 0.00 32.58 29.47 3gfb s HIS 94 CO 0.59 -1.83 1.66 0.42 -0.85 0.00 0.00 174.74 174.73 3gfb s ILE 95 N 7.32 3.66 0.75 0.60 1.01 -1.22 -4.91 121.20 128.42 3gfb s ILE 95 Ca 0.57 -0.40 -0.13 0.00 0.00 0.00 0.00 60.65 60.70 3gfb s ILE 95 Cb -0.03 -4.53 0.05 0.00 0.01 0.00 0.00 42.46 37.96 3gfb s ILE 95 CO -0.05 -1.45 1.12 0.68 0.00 0.00 0.00 174.94 175.24 3gfb s VAL 96 N 7.40 2.95 1.00 2.92 -7.23 -1.26 0.11 120.40 126.30 3gfb s VAL 96 Ca 0.56 0.37 -0.27 0.00 -1.81 0.00 0.00 61.98 60.84 3gfb s VAL 96 Cb -0.05 -2.81 -0.19 0.00 0.56 0.00 0.00 36.38 33.90 3gfb s VAL 96 CO -0.01 -0.34 -1.44 0.00 -0.31 0.00 0.00 175.10 173.00 3gfb n GLY 98 N 3.46 0.44 1.56 0.00 0.00 -1.26 -4.88 105.19 104.51 3gfb n GLY 98 Ca -0.02 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.06 3gfb n GLY 98 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3gfb n LYS 99 N 0.00 3.96 -1.44 1.61 5.02 -1.26 -4.56 118.16 121.49 3gfb n LYS 99 Ca 0.00 -2.42 -0.33 0.00 -2.02 0.00 0.00 58.31 53.54 3gfb n LYS 99 Cb 0.00 -2.07 0.08 0.00 -0.02 0.00 0.00 35.03 33.02 3gfb n LYS 99 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3gfb h TYR 101 N -0.52 -0.75 -0.35 0.00 3.20 -1.97 0.68 116.97 117.26 3gfb h TYR 101 Ca -0.46 0.07 -0.03 0.00 3.14 0.00 0.00 58.73 61.44 3gfb h TYR 101 Cb 1.26 0.41 -0.01 0.00 1.54 0.00 0.00 36.73 39.93 3gfb h TYR 101 CO 0.53 -0.35 0.10 0.00 -1.64 0.00 0.00 178.16 176.79 3gfb h ALA 102 N 1.15 0.46 -0.02 1.82 0.00 -1.87 -1.57 119.26 119.23 3gfb h ALA 102 Ca 0.25 -0.17 -0.16 0.00 0.00 0.00 0.00 54.91 54.82 3gfb h ALA 102 Cb 0.53 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.17 3gfb h ALA 102 CO -0.65 0.11 -0.72 0.00 0.00 0.00 0.00 179.25 177.99 3gfb h LYS 104 N 0.08 0.22 0.00 0.00 1.57 0.42 -2.16 116.57 116.71 3gfb h LYS 104 Ca -0.02 -0.11 0.00 0.00 -1.87 0.00 0.00 60.65 58.65 3gfb h LYS 104 Cb 1.27 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.59 3gfb h LYS 104 CO 0.10 0.63 0.00 0.72 -0.57 0.00 0.00 179.45 180.34 3gfb n HIS 105 N -3.99 0.01 -1.28 -1.35 8.25 -0.60 -4.94 115.22 111.32 3gfb n HIS 105 Ca -0.02 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.45 3gfb n HIS 105 Cb 0.50 -0.51 0.00 0.00 1.12 0.00 0.00 29.99 31.11 3gfb n HIS 105 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 3gfb n ASN 106 N -1.51 -1.00 -4.14 0.41 3.02 -0.81 -5.02 115.26 106.21 3gfb n ASN 106 Ca 0.05 0.00 -0.42 0.00 -0.03 0.00 0.00 54.58 54.19 3gfb n ASN 106 Cb 0.25 -0.36 -0.01 0.00 -0.61 0.00 0.00 39.78 39.05 3gfb n ASN 106 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 3gfb n ARG 107 N -1.34 3.59 0.06 3.52 1.74 0.59 -4.83 116.66 119.99 3gfb n ARG 107 Ca 0.00 -4.51 -0.13 0.00 -0.77 0.00 0.00 57.85 52.45 3gfb n ARG 107 Cb 0.28 -2.49 -0.13 0.00 -1.02 0.00 0.00 32.46 29.09 3gfb n ARG 107 CO 0.00 0.00 0.00 1.88 -1.52 0.00 0.00 177.63 177.99 3gfb h TYR 108 N 6.01 0.26 -0.68 -1.55 0.05 -1.85 -3.16 116.97 116.06 3gfb h TYR 108 Ca 0.18 -0.19 0.11 0.00 0.05 0.00 0.00 58.73 58.88 3gfb h TYR 108 Cb 0.77 -0.01 -0.08 0.00 1.01 0.00 0.00 36.73 38.42 3gfb h TYR 108 CO 0.82 1.20 0.26 1.12 -1.05 0.00 0.00 178.16 180.51 3gfb h HIS 109 N 0.04 0.45 -2.27 4.88 2.07 -1.76 -2.57 115.15 115.99 3gfb h HIS 109 Ca -0.16 0.03 -0.75 0.00 -2.85 0.00 0.00 60.37 56.64 3gfb h HIS 109 Cb 1.94 -0.10 -0.31 0.00 2.57 0.00 0.00 27.41 31.51 3gfb h HIS 109 CO 0.04 0.09 0.59 1.55 -3.07 0.00 0.00 177.93 177.12 3gfb n VAL 110 N -5.00 5.30 -4.43 6.12 3.14 -1.24 -3.48 118.33 118.75 3gfb n VAL 110 Ca 0.11 -5.88 -0.35 0.00 -2.96 0.00 0.00 64.34 55.26 3gfb n VAL 110 Cb 0.33 -1.52 -0.10 0.00 -1.06 0.00 0.00 33.84 31.49 3gfb n VAL 110 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 3gfb n GLN 112 N 2.31 2.68 -0.95 0.00 1.13 -1.26 -4.67 117.38 116.61 3gfb n GLN 112 Ca -0.18 -3.32 0.00 0.00 -1.94 0.00 0.00 57.00 51.56 3gfb n GLN 112 Cb 0.53 -2.25 0.00 0.00 0.11 0.00 0.00 30.24 28.63 3gfb n GLN 112 CO 0.00 0.00 0.00 0.09 -1.44 0.00 0.00 177.06 175.71 3gfb n ASN 113 N -0.53 0.00 -0.11 1.08 4.13 -1.26 -4.92 115.26 113.64 3gfb n ASN 113 Ca 0.56 -0.67 -0.22 0.00 1.68 0.00 0.00 54.58 55.93 3gfb n ASN 113 Cb 0.39 0.00 -0.07 0.00 -1.54 0.00 0.00 39.78 38.56 3gfb n ASN 113 CO 0.00 0.00 0.00 1.07 0.28 0.00 0.00 177.26 178.61 3gfb n THR 114 N 0.00 1.43 -4.54 3.41 5.66 0.30 -3.95 114.28 116.60 3gfb n THR 114 Ca 0.00 -0.20 -0.26 0.00 -3.05 0.00 0.00 64.05 60.54 3gfb n THR 114 Cb 0.00 -1.98 -0.07 0.00 -1.55 0.00 0.00 70.33 66.73 3gfb n THR 114 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 175.07 172.31 3gfb n LYS 115 N -4.22 0.68 -4.26 1.09 4.76 -1.20 -5.04 118.16 109.97 3gfb n LYS 115 Ca -0.39 -3.30 -0.18 0.00 -2.87 0.00 0.00 58.31 51.57 3gfb n LYS 115 Cb 0.74 1.51 -0.13 0.00 -1.84 0.00 0.00 35.03 35.31 3gfb n LYS 115 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 3gfb s ILE 116 N -2.90 0.85 -0.15 -0.18 -1.09 -1.26 -3.37 121.20 113.10 3gfb s ILE 116 Ca 0.14 -0.86 -0.29 0.00 -2.23 0.00 0.00 60.65 57.40 3gfb s ILE 116 Cb 0.01 -0.79 -0.03 0.00 -1.58 0.00 0.00 42.46 40.07 3gfb s ILE 116 CO 0.10 -0.05 1.40 0.12 -1.23 0.00 0.00 174.94 175.27 3gfb s PHE 117 N -0.82 2.54 -1.46 3.97 5.36 -0.98 -1.41 117.98 125.17 3gfb s PHE 117 Ca -0.01 0.73 0.00 0.00 -0.96 0.00 0.00 56.93 56.70 3gfb s PHE 117 Cb -0.07 -3.68 0.00 0.00 -0.34 0.00 0.00 43.02 38.93 3gfb s PHE 117 CO 0.01 -2.40 0.00 0.41 -1.46 0.00 0.00 175.22 171.78 3gfb n GLY 118 N 3.88 1.37 0.92 13.12 0.00 0.64 -4.63 105.19 120.48 3gfb n GLY 118 Ca 0.15 -0.37 -0.01 0.00 0.00 0.00 0.00 46.02 45.79 3gfb n GLY 118 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3gfb n VAL 119 N -2.67 1.25 -0.25 1.61 0.31 -1.20 -4.17 118.33 113.22 3gfb n VAL 119 Ca -0.14 0.36 0.09 0.00 -0.01 0.00 0.00 64.34 64.64 3gfb n VAL 119 Cb 0.47 -1.69 0.24 0.00 -0.91 0.00 0.00 33.84 31.95 3gfb n VAL 119 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 3gfb n ASP 120 N -3.62 3.47 -3.61 4.52 8.00 -0.50 -4.64 116.55 120.16 3gfb n ASP 120 Ca -0.02 -1.99 -0.03 0.00 0.71 0.00 0.00 54.79 53.45 3gfb n ASP 120 Cb 0.08 -0.36 -0.02 0.00 -0.02 0.00 0.00 41.12 40.80 3gfb n ASP 120 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3gfb s MET 121 N -1.02 0.21 0.13 -1.24 0.23 -1.23 -4.86 119.30 111.52 3gfb s MET 121 Ca 0.37 -0.08 -0.35 0.00 -1.03 0.00 0.00 55.69 54.60 3gfb s MET 121 Cb 0.19 0.10 -0.15 0.00 -1.53 0.00 0.00 34.83 33.44 3gfb s MET 121 CO 0.25 -0.09 1.53 -0.25 -2.03 0.00 0.00 175.02 174.43 3gfb n ASP 122 N -0.08 2.73 -0.10 -1.18 8.00 -1.26 -0.26 116.55 124.40 3gfb n ASP 122 Ca 0.02 1.09 0.00 0.00 0.71 0.00 0.00 54.79 56.61 3gfb n ASP 122 Cb 0.58 -1.36 0.00 0.00 -0.02 0.00 0.00 41.12 40.31 3gfb n ASP 122 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3gfb n GLY 123 N 3.22 1.40 0.00 0.44 0.00 -0.55 -3.95 105.19 105.76 3gfb n GLY 123 Ca 0.17 -1.56 0.00 0.00 0.00 0.00 0.00 46.02 44.64 3gfb n GLY 123 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3gfb n VAL 124 N 0.00 0.06 -1.45 1.61 0.24 -0.90 -4.79 118.33 113.10 3gfb n VAL 124 Ca 0.00 -0.12 -0.41 0.00 -2.04 0.00 0.00 64.34 61.77 3gfb n VAL 124 Cb 0.00 1.49 -0.02 0.00 -1.47 0.00 0.00 33.84 33.84 3gfb n VAL 124 CO 0.00 0.00 0.00 0.49 -2.14 0.00 0.00 176.83 175.18 3gfb n PHE 125 N -0.03 2.79 -3.70 6.34 3.72 -0.70 -4.73 117.46 121.13 3gfb n PHE 125 Ca 0.00 -2.55 -0.09 0.00 -0.05 0.00 0.00 57.45 54.76 3gfb n PHE 125 Cb 0.30 -2.23 -0.02 0.00 -0.94 0.00 0.00 39.48 36.59 3gfb n PHE 125 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3gfb s ALA 126 N 3.72 -1.35 0.26 4.37 0.00 -1.26 0.16 121.76 127.66 3gfb s ALA 126 Ca 0.52 -0.03 0.06 0.00 0.00 0.00 0.00 51.96 52.51 3gfb s ALA 126 Cb 0.14 0.86 0.32 0.00 0.00 0.00 0.00 23.12 24.45 3gfb s ALA 126 CO -0.02 -0.94 1.61 0.45 0.00 0.00 0.00 175.76 176.86 3gfb h HIS 127 N 2.00 0.24 -3.62 0.00 3.86 -1.78 -3.41 115.15 112.44 3gfb h HIS 127 Ca -0.24 -0.09 -0.34 0.00 -1.16 0.00 0.00 60.37 58.54 3gfb h HIS 127 Cb 1.27 -0.05 -0.17 0.00 1.06 0.00 0.00 27.41 29.52 3gfb h HIS 127 CO 0.36 0.71 -0.73 0.71 0.86 0.00 0.00 177.93 179.83 3gfb s TYR 128 N -3.83 1.18 -0.12 2.45 2.02 -1.26 -1.06 117.35 116.72 3gfb s TYR 128 Ca -0.04 -0.66 -0.16 0.00 -0.37 0.00 0.00 57.07 55.85 3gfb s TYR 128 Cb 0.12 -0.63 0.04 0.00 -0.40 0.00 0.00 41.96 41.10 3gfb s TYR 128 CO 0.78 0.05 0.42 0.00 -1.57 0.00 0.00 175.55 175.23 3gfb s ALA 129 N -2.57 -1.04 0.15 3.71 0.00 -0.83 -4.90 121.76 116.29 3gfb s ALA 129 Ca 0.09 1.01 -0.28 0.00 0.00 0.00 0.00 51.96 52.78 3gfb s ALA 129 Cb -0.02 -0.48 -0.07 0.00 0.00 0.00 0.00 23.12 22.55 3gfb s ALA 129 CO 0.01 -0.23 0.87 0.42 0.00 0.00 0.00 175.76 176.83 3gfb s ILE 130 N -0.22 4.37 -0.06 0.00 -1.09 -1.26 -1.15 121.20 121.79 3gfb s ILE 130 Ca -0.04 1.90 -0.00 0.00 -2.23 0.00 0.00 60.65 60.28 3gfb s ILE 130 Cb -0.03 -4.24 0.03 0.00 -1.58 0.00 0.00 42.46 36.63 3gfb s ILE 130 CO 0.02 0.44 -0.01 -0.69 -1.23 0.00 0.00 174.94 173.46 3gfb s VAL 131 N -0.68 0.43 -0.04 2.92 1.01 0.12 -4.95 120.40 119.21 3gfb s VAL 131 Ca 0.41 0.03 -0.37 0.00 0.00 0.00 0.00 61.98 62.05 3gfb s VAL 131 Cb -0.24 -0.54 -0.16 0.00 0.00 0.00 0.00 36.38 35.45 3gfb s VAL 131 CO 0.28 0.25 1.54 -0.81 0.00 0.00 0.00 175.10 176.36 3gfb n PRO 132 N 4.75 1.34 -0.21 2.72 -0.04 -1.26 -1.25 135.00 141.05 3gfb n PRO 132 Ca -0.14 0.49 -0.01 0.00 -0.04 0.00 0.00 63.50 63.80 3gfb n PRO 132 Cb 0.50 -2.17 0.10 0.00 -0.04 0.00 0.00 33.50 31.89 3gfb n PRO 132 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3gfb h ALA 133 N 5.93 0.80 0.00 0.55 0.00 -1.29 -1.69 119.26 123.56 3gfb h ALA 133 Ca -0.47 0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.50 3gfb h ALA 133 Cb 1.32 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.11 3gfb h ALA 133 CO 0.86 -0.13 0.00 1.57 0.00 0.00 0.00 179.25 181.55 3gfb h LYS 134 N 0.48 0.00 -0.02 0.00 5.09 -1.91 -0.59 116.57 119.62 3gfb h LYS 134 Ca 0.30 0.00 0.00 0.00 0.09 0.00 0.00 60.65 61.04 3gfb h LYS 134 Cb 0.32 0.00 0.00 0.00 0.10 0.00 0.00 32.23 32.65 3gfb h LYS 134 CO -0.26 0.00 -0.10 0.09 -2.09 0.00 0.00 179.45 177.09 3gfb n ASN 135 N -2.58 2.03 -4.71 7.07 4.13 -0.64 -4.95 115.26 115.62 3gfb n ASN 135 Ca -0.02 -1.59 -0.40 0.00 1.68 0.00 0.00 54.58 54.25 3gfb n ASN 135 Cb 0.05 0.08 -0.05 0.00 -1.54 0.00 0.00 39.78 38.33 3gfb n ASN 135 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3gfb s ALA 136 N -2.13 3.37 -0.19 5.41 0.00 -0.23 -0.62 121.76 127.38 3gfb s ALA 136 Ca 0.30 0.07 -0.04 0.00 0.00 0.00 0.00 51.96 52.29 3gfb s ALA 136 Cb 0.20 -2.93 -0.02 0.00 0.00 0.00 0.00 23.12 20.37 3gfb s ALA 136 CO 0.38 -0.15 -0.03 -0.46 0.00 0.00 0.00 175.76 175.50 3gfb s TRP 137 N 0.92 2.99 -0.01 0.00 -0.11 0.17 -4.95 118.94 117.95 3gfb s TRP 137 Ca 0.36 -0.56 -0.30 0.00 1.22 0.00 0.00 56.10 56.82 3gfb s TRP 137 Cb -0.17 -2.04 -0.05 0.00 -1.50 0.00 0.00 33.47 29.71 3gfb s TRP 137 CO 0.16 -0.27 1.28 0.15 -4.62 0.00 0.00 176.95 173.65 3gfb s LYS 138 N 0.93 4.34 0.29 5.86 1.02 -1.26 -0.17 119.74 130.74 3gfb s LYS 138 Ca 0.00 1.80 -0.06 0.00 0.02 0.00 0.00 55.97 57.74 3gfb s LYS 138 Cb -0.15 -3.53 -0.05 0.00 -0.52 0.00 0.00 37.83 33.59 3gfb s LYS 138 CO 0.01 -0.47 0.56 -0.80 -0.92 0.00 0.00 175.35 173.73 3gfb s ASN 139 N 1.56 6.46 0.32 2.83 0.02 0.91 -4.94 114.94 122.11 3gfb s ASN 139 Ca 0.59 0.74 -0.29 0.00 -1.02 0.00 0.00 52.86 52.89 3gfb s ASN 139 Cb -0.28 -2.16 -0.10 0.00 0.02 0.00 0.00 41.25 38.73 3gfb s ASN 139 CO 0.25 -0.19 1.31 -2.84 0.02 0.00 0.00 177.10 175.65 3gfb s PRO 140 N -3.48 4.36 0.52 -0.60 0.02 -1.26 -4.75 135.00 129.81 3gfb s PRO 140 Ca 0.44 2.21 0.23 0.00 0.02 0.00 0.00 61.00 63.91 3gfb s PRO 140 Cb -0.11 -3.08 1.41 0.00 0.02 0.00 0.00 34.50 32.74 3gfb s PRO 140 CO 0.29 -0.19 2.11 0.87 -0.33 0.00 0.00 177.00 179.75 3gfb h LYS 141 N 3.50 0.00 -0.12 5.54 1.79 -1.98 -0.45 116.57 124.86 3gfb h LYS 141 Ca -0.49 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 57.98 3gfb h LYS 141 Cb 1.23 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.88 3gfb h LYS 141 CO 0.66 0.09 0.00 -0.40 -1.08 0.00 0.00 179.45 178.72 3gfb n ASP 142 N -4.00 1.35 -4.66 0.86 5.75 -1.26 -4.80 116.55 109.79 3gfb n ASP 142 Ca -0.02 -1.62 -0.43 0.00 -0.01 0.00 0.00 54.79 52.71 3gfb n ASP 142 Cb 0.18 -0.07 -0.02 0.00 -1.03 0.00 0.00 41.12 40.18 3gfb n ASP 142 CO 0.00 0.00 0.00 -0.32 -0.11 0.00 0.00 177.20 176.77 3gfb s MET 143 N -1.86 4.22 0.25 0.11 1.75 -0.18 -4.98 119.30 118.60 3gfb s MET 143 Ca 0.33 1.47 -0.31 0.00 -1.25 0.00 0.00 55.69 55.93 3gfb s MET 143 Cb 0.17 -3.71 -0.14 0.00 2.84 0.00 0.00 34.83 33.99 3gfb s MET 143 CO 0.27 -0.71 1.34 -2.30 -0.65 0.00 0.00 175.02 172.97 3gfb n PRO 144 N 6.53 1.90 0.16 4.11 -0.02 -1.26 -4.78 135.00 141.64 3gfb n PRO 144 Ca 0.13 0.67 0.19 0.00 -2.02 0.00 0.00 63.50 62.47 3gfb n PRO 144 Cb 0.46 -2.28 0.79 0.00 -0.02 0.00 0.00 33.50 32.44 3gfb n PRO 144 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 3gfb h PRO 145 N 3.78 0.00 0.00 0.52 0.11 -1.95 -1.47 132.00 133.00 3gfb h PRO 145 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 3gfb h PRO 145 Cb 1.29 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.40 3gfb h PRO 145 CO 0.73 0.00 0.00 1.05 -0.21 0.00 0.00 178.00 179.57 3gfb h GLU 146 N 0.00 0.00 0.03 1.05 9.09 -1.93 -2.55 114.58 120.26 3gfb h GLU 146 Ca 0.13 0.00 -0.35 0.00 0.05 0.00 0.00 59.36 59.19 3gfb h GLU 146 Cb 0.75 0.00 -0.05 0.00 -1.65 0.00 0.00 28.75 27.81 3gfb h GLU 146 CO -0.00 0.00 -1.96 0.66 0.05 0.00 0.00 179.01 177.76 3gfb n TYR 147 N -2.89 0.64 0.23 2.06 4.01 -0.59 -3.54 117.16 117.07 3gfb n TYR 147 Ca 0.02 0.22 0.18 0.00 -0.16 0.00 0.00 57.90 58.15 3gfb n TYR 147 Cb 0.36 -1.07 0.80 0.00 -0.31 0.00 0.00 39.34 39.12 3gfb n TYR 147 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3gfb h ALA 148 N -0.44 1.68 0.00 -0.72 0.00 -1.50 0.41 119.26 118.70 3gfb h ALA 148 Ca -0.50 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.40 3gfb h ALA 148 Cb 1.64 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.44 3gfb h ALA 148 CO -0.19 -0.45 -0.58 0.00 0.00 0.00 0.00 179.25 178.03 3gfb n ALA 149 N -2.12 3.11 -0.63 0.00 0.00 -0.96 -3.49 120.51 116.41 3gfb n ALA 149 Ca 0.02 -0.28 0.08 0.00 0.00 0.00 0.00 53.44 53.26 3gfb n ALA 149 Cb 0.46 -1.16 0.36 0.00 0.00 0.00 0.00 19.45 19.12 3gfb n ALA 149 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3gfb n LEU 150 N -1.89 4.97 0.06 0.00 4.77 0.14 -4.23 117.00 120.82 3gfb n LEU 150 Ca 0.04 -2.51 -0.18 0.00 -0.03 0.00 0.00 56.01 53.33 3gfb n LEU 150 Cb 0.40 -0.61 -0.14 0.00 -2.33 0.00 0.00 43.42 40.74 3gfb n LEU 150 CO 0.36 0.73 -0.41 1.56 -1.33 0.00 0.00 177.39 178.30 3gfb h GLN 151 N 3.95 0.26 0.68 3.23 4.20 -1.59 -0.16 115.11 125.69 3gfb h GLN 151 Ca 0.00 -0.45 -0.03 0.00 0.06 0.00 0.00 58.65 58.23 3gfb h GLN 151 Cb 1.60 0.17 0.01 0.00 0.30 0.00 0.00 27.48 29.55 3gfb h GLN 151 CO 0.32 1.12 -0.32 1.49 -0.67 0.00 0.00 178.83 180.76 3gfb h GLU 152 N 0.07 -0.88 0.00 1.46 4.81 -1.84 0.48 114.58 118.68 3gfb h GLU 152 Ca -0.27 0.06 -0.02 0.00 -0.13 0.00 0.00 59.36 59.00 3gfb h GLU 152 Cb 2.03 0.20 -0.00 0.00 0.63 0.00 0.00 28.75 31.61 3gfb h GLU 152 CO 0.16 -0.56 -0.09 -1.00 -0.73 0.00 0.00 179.01 176.78 3gfb h PRO 153 N -0.98 0.00 -0.59 0.92 0.13 -1.86 0.10 132.00 129.72 3gfb h PRO 153 Ca -0.09 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.02 3gfb h PRO 153 Cb 0.72 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.82 3gfb h PRO 153 CO 0.15 0.09 0.31 -0.07 -0.23 0.00 0.00 178.00 178.25 3gfb h LEU 154 N 0.00 0.72 -0.21 1.56 3.38 -0.94 -2.43 115.31 117.39 3gfb h LEU 154 Ca -0.00 -0.06 0.05 0.00 0.09 0.00 0.00 57.88 57.96 3gfb h LEU 154 Cb 0.61 -0.18 -0.05 0.00 0.09 0.00 0.00 40.66 41.12 3gfb h LEU 154 CO 0.01 0.59 -0.13 1.23 0.09 0.00 0.00 178.44 180.24 3gfb h GLY 155 N 0.89 0.04 -0.70 0.83 0.00 0.26 -1.16 103.07 103.22 3gfb h GLY 155 Ca 0.21 0.16 0.14 0.00 0.00 0.00 0.00 47.33 47.84 3gfb h GLY 155 CO -0.03 -0.14 -0.33 3.43 0.00 0.00 0.00 176.54 179.47 3gfb h ASN 156 N -0.12 -1.19 0.14 0.19 -0.26 -1.35 -1.67 115.58 111.32 3gfb h ASN 156 Ca 0.12 0.27 -0.06 0.00 -0.56 0.00 0.00 56.30 56.07 3gfb h ASN 156 Cb 0.30 0.64 -0.01 0.00 -1.06 0.00 0.00 38.32 38.18 3gfb h ASN 156 CO -0.29 -0.29 -0.20 0.00 -1.06 0.00 0.00 177.43 175.59 3gfb h ALA 157 N 1.33 1.51 0.01 -0.83 0.00 -1.21 -2.78 119.26 117.29 3gfb h ALA 157 Ca 0.31 -0.23 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 3gfb h ALA 157 Cb 0.58 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.31 3gfb h ALA 157 CO -0.84 0.36 -0.01 0.28 0.00 0.00 0.00 179.25 179.04 3gfb h VAL 158 N 0.13 1.56 -0.05 0.00 2.07 -0.73 0.78 116.25 120.00 3gfb h VAL 158 Ca 0.02 -1.89 0.02 0.00 0.82 0.00 0.00 66.70 65.67 3gfb h VAL 158 Cb 0.44 2.81 -0.00 0.00 -1.52 0.00 0.00 31.29 33.01 3gfb h VAL 158 CO 0.03 0.48 0.11 0.44 0.02 0.00 0.00 177.57 178.65 3gfb h ASP 159 N -0.85 0.00 0.00 0.57 5.19 -1.37 0.17 116.42 120.13 3gfb h ASP 159 Ca -0.00 0.00 -0.01 0.00 -0.62 0.00 0.00 57.03 56.40 3gfb h ASP 159 Cb 0.79 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 40.30 3gfb h ASP 159 CO 0.00 0.00 -0.59 0.41 -3.12 0.00 0.00 179.24 175.94 3gfb n THR 160 N -3.39 1.43 -0.24 0.35 -1.04 -1.05 -3.31 114.28 107.03 3gfb n THR 160 Ca -0.02 0.20 0.05 0.00 -2.04 0.00 0.00 64.05 62.24 3gfb n THR 160 Cb 0.20 -2.38 0.17 0.00 -1.82 0.00 0.00 70.33 66.49 3gfb n THR 160 CO 0.00 0.00 0.00 0.58 -0.64 0.00 0.00 175.07 175.01 3gfb h VAL 161 N -1.00 0.57 -0.71 12.58 2.07 -0.76 -3.16 116.25 125.83 3gfb h VAL 161 Ca -0.01 -0.10 -0.46 0.00 0.82 0.00 0.00 66.70 66.95 3gfb h VAL 161 Cb 0.59 0.24 -0.27 0.00 -1.52 0.00 0.00 31.29 30.33 3gfb h VAL 161 CO -0.01 0.05 0.06 0.18 0.02 0.00 0.00 177.57 177.88 3gfb n LEU 162 N -5.12 5.63 0.00 2.57 4.77 0.59 -4.42 117.00 121.03 3gfb n LEU 162 Ca 0.13 -4.18 0.13 0.00 -0.03 0.00 0.00 56.01 52.07 3gfb n LEU 162 Cb 0.42 -0.67 0.61 0.00 -2.33 0.00 0.00 43.42 41.45 3gfb n LEU 162 CO 0.15 1.54 0.95 0.00 -1.33 0.00 0.00 177.39 178.69 3gfb n ALA 163 N -0.96 2.29 -3.14 -1.18 0.00 -1.20 -4.82 120.51 111.51 3gfb n ALA 163 Ca 0.47 -0.10 -0.02 0.00 0.00 0.00 0.00 53.44 53.80 3gfb n ALA 163 Cb 0.98 -1.45 -0.00 0.00 0.00 0.00 0.00 19.45 18.98 3gfb n ALA 163 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3gfb n GLY 164 N 1.33 2.75 3.71 0.00 0.00 -1.26 -5.10 105.19 106.62 3gfb n GLY 164 Ca 0.08 -1.33 -0.38 0.00 0.00 0.00 0.00 46.02 44.38 3gfb n GLY 164 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3gfb n PRO 165 N -0.08 1.34 0.00 1.61 -0.04 -1.26 -4.96 135.00 131.61 3gfb n PRO 165 Ca -0.00 0.51 0.00 0.00 -0.04 0.00 0.00 63.50 63.96 3gfb n PRO 165 Cb 0.08 -2.46 0.00 0.00 -0.04 0.00 0.00 33.50 31.08 3gfb n PRO 165 CO 0.00 0.00 0.00 1.51 -0.04 0.00 0.00 175.50 176.97 3gfb n ILE 166 N -1.42 0.00 -1.86 0.52 3.06 -1.26 -4.99 119.36 113.41 3gfb n ILE 166 Ca 0.13 -0.02 -0.42 0.00 -2.50 0.00 0.00 62.75 59.95 3gfb n ILE 166 Cb 0.46 0.69 -0.02 0.00 0.54 0.00 0.00 39.64 41.31 3gfb n ILE 166 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 3gfb s ALA 167 N -0.06 3.74 -0.94 1.51 0.00 -1.23 -1.62 121.76 123.16 3gfb s ALA 167 Ca 0.00 1.48 0.00 0.00 0.00 0.00 0.00 51.96 53.44 3gfb s ALA 167 Cb 0.00 -3.63 0.00 0.00 0.00 0.00 0.00 23.12 19.49 3gfb s ALA 167 CO 0.00 -0.88 0.00 0.41 0.00 0.00 0.00 175.76 175.29 3gfb n GLY 168 N 2.62 1.02 3.49 0.00 0.00 0.27 -4.89 105.19 107.70 3gfb n GLY 168 Ca 0.09 -0.38 -0.35 0.00 0.00 0.00 0.00 46.02 45.38 3gfb n GLY 168 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3gfb s ARG 169 N -2.53 3.70 0.01 1.61 0.52 -0.64 -4.60 118.95 117.02 3gfb s ARG 169 Ca 0.00 -0.47 -0.30 0.00 -0.52 0.00 0.00 55.73 54.43 3gfb s ARG 169 Cb 0.00 -3.16 -0.06 0.00 0.52 0.00 0.00 34.95 32.24 3gfb s ARG 169 CO 0.00 0.02 1.52 -1.54 0.02 0.00 0.00 175.30 175.33 3gfb s SER 170 N 1.00 6.74 -0.08 0.23 1.04 -1.25 -2.17 113.70 119.21 3gfb s SER 170 Ca 0.03 2.25 0.05 0.00 0.48 0.00 0.00 55.95 58.75 3gfb s SER 170 Cb -0.14 -2.56 -0.01 0.00 0.10 0.00 0.00 66.02 63.42 3gfb s SER 170 CO 0.02 -0.81 -0.24 -0.89 0.98 0.00 0.00 173.24 172.31 3gfb s THR 171 N 2.77 2.14 -0.20 2.02 2.01 -0.27 -1.33 115.64 122.78 3gfb s THR 171 Ca 0.68 -1.01 -0.04 0.00 0.31 0.00 0.00 61.69 61.63 3gfb s THR 171 Cb -0.34 -1.80 -0.02 0.00 0.01 0.00 0.00 72.50 70.35 3gfb s THR 171 CO 0.29 0.56 -0.03 -0.22 -0.69 0.00 0.00 174.62 174.53 3gfb s LEU 172 N 0.10 3.08 -0.22 4.42 2.96 -0.62 -0.87 118.68 127.53 3gfb s LEU 172 Ca -0.11 -0.27 -0.05 0.00 -0.22 0.00 0.00 54.13 53.47 3gfb s LEU 172 Cb -0.16 -1.77 -0.02 0.00 0.50 0.00 0.00 46.19 44.74 3gfb s LEU 172 CO 0.06 0.05 0.00 -0.63 -1.32 0.00 0.00 176.35 174.52 3gfb s ILE 173 N 1.06 3.82 -0.28 6.68 1.01 -0.60 -1.04 121.20 131.86 3gfb s ILE 173 Ca 0.01 -0.34 -0.11 0.00 0.00 0.00 0.00 60.65 60.21 3gfb s ILE 173 Cb -0.15 -2.75 -0.05 0.00 0.01 0.00 0.00 42.46 39.52 3gfb s ILE 173 CO 0.01 0.40 0.19 0.42 0.00 0.00 0.00 174.94 175.95 3gfb s THR 174 N 1.40 5.31 0.00 2.92 -4.23 -0.89 -1.04 115.64 119.11 3gfb s THR 174 Ca 0.05 0.18 0.00 0.00 -1.18 0.00 0.00 61.69 60.73 3gfb s THR 174 Cb -0.15 -3.53 0.00 0.00 1.34 0.00 0.00 72.50 70.17 3gfb s THR 174 CO 0.00 0.26 0.00 0.61 -0.54 0.00 0.00 174.62 174.95 3gfb n GLY 175 N 4.96 1.27 2.69 3.99 0.00 -0.26 -1.05 105.19 116.79 3gfb n GLY 175 Ca -0.14 -0.98 -0.35 0.00 0.00 0.00 0.00 46.02 44.55 3gfb n GLY 175 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gfb n ALA 176 N 2.15 5.99 -1.95 4.61 0.00 -1.26 -4.26 120.51 125.79 3gfb n ALA 176 Ca 0.00 -4.11 -0.28 0.00 0.00 0.00 0.00 53.44 49.05 3gfb n ALA 176 Cb 0.00 -1.45 0.17 0.00 0.00 0.00 0.00 19.45 18.17 3gfb n ALA 176 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 3gfb s GLY 177 N -2.02 1.78 0.19 0.00 0.00 -1.26 -4.59 107.32 101.41 3gfb s GLY 177 Ca 0.52 -1.39 -0.11 0.00 0.00 0.00 0.00 44.72 43.74 3gfb s GLY 177 CO -0.29 -0.66 1.20 -1.05 0.00 0.00 0.00 173.10 172.29 3gfb n PRO 178 N -3.51 -0.15 -0.24 2.90 -0.01 -1.26 -1.03 135.00 131.69 3gfb n PRO 178 Ca 0.16 1.19 -0.08 0.00 -0.01 0.00 0.00 63.50 64.76 3gfb n PRO 178 Cb 0.60 -1.77 0.04 0.00 -0.01 0.00 0.00 33.50 32.36 3gfb n PRO 178 CO 0.00 0.00 0.00 -0.07 -0.01 0.00 0.00 175.50 175.42 3gfb h LEU 179 N 0.00 1.08 -1.43 2.45 3.38 -1.95 -2.82 115.31 116.02 3gfb h LEU 179 Ca 0.30 -0.26 -0.05 0.00 0.09 0.00 0.00 57.88 57.96 3gfb h LEU 179 Cb 0.49 -0.29 -0.01 0.00 0.09 0.00 0.00 40.66 40.94 3gfb h LEU 179 CO -0.77 1.06 -0.16 1.23 0.09 0.00 0.00 178.44 179.89 3gfb h GLY 180 N 1.06 0.19 0.71 0.83 0.00 -1.26 -0.57 103.07 104.02 3gfb h GLY 180 Ca 0.21 -0.12 -0.07 0.00 0.00 0.00 0.00 47.33 47.35 3gfb h GLY 180 CO 0.01 0.11 -0.22 1.41 0.00 0.00 0.00 176.54 177.85 3gfb h LEU 181 N 0.17 0.39 -1.32 3.11 3.38 -0.95 0.21 115.31 120.28 3gfb h LEU 181 Ca 0.03 -0.56 0.04 0.00 0.09 0.00 0.00 57.88 57.48 3gfb h LEU 181 Cb 0.39 -0.11 -0.04 0.00 0.09 0.00 0.00 40.66 40.99 3gfb h LEU 181 CO 0.02 0.87 0.48 -0.07 0.09 0.00 0.00 178.44 179.84 3gfb h LEU 182 N -0.09 0.75 -0.13 1.67 3.38 -1.36 -1.21 115.31 118.32 3gfb h LEU 182 Ca 0.00 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 3gfb h LEU 182 Cb 0.81 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.38 3gfb h LEU 182 CO 0.05 0.51 0.06 1.23 0.09 0.00 0.00 178.44 180.38 3gfb h GLY 183 N 0.87 0.20 1.03 0.83 0.00 -0.59 0.13 103.07 105.54 3gfb h GLY 183 Ca 0.30 -0.10 -0.08 0.00 0.00 0.00 0.00 47.33 47.44 3gfb h GLY 183 CO -0.09 0.10 0.03 -2.22 0.00 0.00 0.00 176.54 174.36 3gfb h ILE 184 N 0.07 1.26 -0.33 2.60 2.04 -0.14 -2.46 117.51 120.55 3gfb h ILE 184 Ca 0.04 -1.07 -0.02 0.00 1.00 0.00 0.00 64.86 64.82 3gfb h ILE 184 Cb 0.14 0.86 -0.01 0.00 -0.74 0.00 0.00 36.82 37.07 3gfb h ILE 184 CO -0.00 0.38 0.13 0.00 0.00 0.00 0.00 178.15 178.65 3gfb h ALA 185 N 0.97 0.43 -0.41 1.87 0.00 -0.74 -1.66 119.26 119.72 3gfb h ALA 185 Ca 0.16 -0.13 0.04 0.00 0.00 0.00 0.00 54.91 54.97 3gfb h ALA 185 Cb 0.50 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 3gfb h ALA 185 CO 0.02 0.03 0.27 0.28 0.00 0.00 0.00 179.25 179.86 3gfb h VAL 186 N 0.38 1.01 0.15 0.00 2.07 -0.76 -2.41 116.25 116.70 3gfb h VAL 186 Ca 0.11 -0.14 -0.24 0.00 0.82 0.00 0.00 66.70 67.25 3gfb h VAL 186 Cb 0.20 0.57 0.02 0.00 -1.52 0.00 0.00 31.29 30.55 3gfb h VAL 186 CO -0.01 0.07 -1.11 0.00 0.02 0.00 0.00 177.57 176.55 3gfb h ALA 187 N 1.77 -0.02 -0.87 1.67 0.00 -0.93 0.12 119.26 121.00 3gfb h ALA 187 Ca 0.17 -0.84 0.08 0.00 0.00 0.00 0.00 54.91 54.31 3gfb h ALA 187 Cb 0.17 0.23 -0.07 0.00 0.00 0.00 0.00 17.79 18.12 3gfb h ALA 187 CO -0.04 0.57 0.53 0.87 0.00 0.00 0.00 179.25 181.18 3gfb h LYS 188 N -0.26 0.91 -0.59 0.00 1.79 -1.34 -1.00 116.57 116.08 3gfb h LYS 188 Ca -0.21 -0.05 -0.08 0.00 -2.18 0.00 0.00 60.65 58.13 3gfb h LYS 188 Cb 1.77 -0.21 -0.02 0.00 -1.58 0.00 0.00 32.23 32.19 3gfb h LYS 188 CO 0.15 0.60 0.06 0.00 -1.08 0.00 0.00 179.45 179.18 3gfb h ALA 189 N 1.43 0.98 0.00 3.86 0.00 -1.25 -1.69 119.26 122.60 3gfb h ALA 189 Ca 0.39 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 55.03 3gfb h ALA 189 Cb 0.25 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.81 3gfb h ALA 189 CO -0.20 0.63 0.00 0.43 0.00 0.00 0.00 179.25 180.11 3gfb n SER 190 N -4.21 0.00 0.00 0.00 7.64 0.42 -4.91 113.62 112.56 3gfb n SER 190 Ca 0.04 -0.29 0.00 0.00 1.01 0.00 0.00 58.87 59.63 3gfb n SER 190 Cb 0.30 -0.07 0.00 0.00 -1.01 0.00 0.00 64.21 63.43 3gfb n SER 190 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3gfb n GLY 191 N -0.20 0.55 3.73 0.23 0.00 -0.64 -3.49 105.19 105.37 3gfb n GLY 191 Ca 0.09 -0.67 -0.42 0.00 0.00 0.00 0.00 46.02 45.02 3gfb n GLY 191 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gfb s ALA 192 N -2.00 3.56 -0.29 4.61 0.00 -0.42 0.96 121.76 128.17 3gfb s ALA 192 Ca 0.00 1.11 -0.13 0.00 0.00 0.00 0.00 51.96 52.95 3gfb s ALA 192 Cb 0.00 -3.51 0.12 0.00 0.00 0.00 0.00 23.12 19.72 3gfb s ALA 192 CO 0.00 -0.58 0.71 -0.47 0.00 0.00 0.00 175.76 175.42 3gfb s TYR 193 N 0.67 -1.15 0.41 0.00 5.04 -0.92 -4.37 117.35 117.03 3gfb s TYR 193 Ca 0.61 2.11 -0.23 0.00 -2.44 0.00 0.00 57.07 57.13 3gfb s TYR 193 Cb -0.37 0.69 -0.10 0.00 0.35 0.00 0.00 41.96 42.53 3gfb s TYR 193 CO 0.34 -0.57 0.98 -1.25 -1.34 0.00 0.00 175.55 173.70 3gfb s PRO 194 N 2.32 4.24 -0.57 4.97 0.04 -1.26 -3.75 135.00 140.99 3gfb s PRO 194 Ca -0.07 1.26 -0.25 0.00 0.04 0.00 0.00 61.00 61.98 3gfb s PRO 194 Cb -0.09 -2.37 0.04 0.00 0.04 0.00 0.00 34.50 32.13 3gfb s PRO 194 CO -0.19 -0.04 1.01 0.08 0.04 0.00 0.00 177.00 177.90 3gfb s VAL 195 N -1.94 4.28 -0.28 -0.36 1.01 -1.26 -1.11 120.40 120.74 3gfb s VAL 195 Ca 0.59 0.40 -0.11 0.00 0.00 0.00 0.00 61.98 62.86 3gfb s VAL 195 Cb -0.14 -4.60 -0.05 0.00 0.00 0.00 0.00 36.38 31.59 3gfb s VAL 195 CO 0.19 -1.21 0.21 -0.63 0.00 0.00 0.00 175.10 173.66 3gfb s ILE 196 N 4.24 5.29 -0.21 2.22 1.01 -0.05 0.23 121.20 133.94 3gfb s ILE 196 Ca 0.33 0.22 -0.05 0.00 0.00 0.00 0.00 60.65 61.15 3gfb s ILE 196 Cb -0.11 -3.55 -0.02 0.00 0.01 0.00 0.00 42.46 38.78 3gfb s ILE 196 CO 0.20 0.24 -0.00 -0.69 0.00 0.00 0.00 174.94 174.69 3gfb s VAL 197 N 1.80 3.90 -0.51 2.92 1.01 0.29 -1.55 120.40 128.26 3gfb s VAL 197 Ca 0.08 -0.33 -0.19 0.00 0.00 0.00 0.00 61.98 61.54 3gfb s VAL 197 Cb -0.16 -2.77 0.06 0.00 0.00 0.00 0.00 36.38 33.51 3gfb s VAL 197 CO 0.11 0.42 0.64 -0.55 0.00 0.00 0.00 175.10 175.72 3gfb s SER 198 N 1.12 6.23 -0.09 3.32 0.15 -0.21 0.19 113.70 124.41 3gfb s SER 198 Ca 0.02 -0.92 -0.04 0.00 0.70 0.00 0.00 55.95 55.71 3gfb s SER 198 Cb -0.14 -2.30 0.04 0.00 -1.71 0.00 0.00 66.02 61.91 3gfb s SER 198 CO 0.01 -0.92 0.19 -0.70 1.20 0.00 0.00 173.24 173.03 3gfb s GLU 199 N 2.68 0.14 0.04 5.44 2.56 -0.66 -1.11 118.70 127.80 3gfb s GLU 199 Ca 0.15 0.45 -0.19 0.00 0.00 0.00 0.00 54.97 55.38 3gfb s GLU 199 Cb -0.19 -0.15 -0.16 0.00 2.00 0.00 0.00 34.13 35.62 3gfb s GLU 199 CO 0.12 -0.17 1.27 -1.35 -0.56 0.00 0.00 175.26 174.57 3gfb h PRO 200 N 7.25 0.43 -6.63 4.30 0.11 -1.95 -3.36 132.00 132.15 3gfb h PRO 200 Ca -0.41 -0.29 -0.54 0.00 0.11 0.00 0.00 66.00 64.86 3gfb h PRO 200 Cb 1.15 0.04 0.06 0.00 0.11 0.00 0.00 31.00 32.36 3gfb h PRO 200 CO 0.39 0.91 0.95 0.45 -0.21 0.00 0.00 178.00 180.49 3gfb n SER 201 N -4.40 3.76 0.07 -2.05 2.88 -1.26 -4.92 113.62 107.70 3gfb n SER 201 Ca -0.07 1.07 -0.06 0.00 -1.33 0.00 0.00 58.87 58.48 3gfb n SER 201 Cb 0.48 -1.54 -0.10 0.00 -0.75 0.00 0.00 64.21 62.30 3gfb n SER 201 CO 0.00 0.00 0.00 -0.08 -1.23 0.00 0.00 175.04 173.73 3gfb h GLU 202 N 6.38 0.00 0.04 -1.46 4.81 -1.99 -2.13 114.58 120.24 3gfb h GLU 202 Ca -0.44 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 58.79 3gfb h GLU 202 Cb 1.22 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.60 3gfb h GLU 202 CO 0.93 0.92 -0.02 0.35 -0.73 0.00 0.00 179.01 180.46 3gfb h PHE 203 N 0.00 -0.05 -0.03 0.92 3.57 -1.93 -2.47 116.94 116.95 3gfb h PHE 203 Ca -0.02 -0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.45 3gfb h PHE 203 Cb 1.73 0.02 -0.01 0.00 2.79 0.00 0.00 35.95 40.49 3gfb h PHE 203 CO 0.00 0.15 -0.11 0.00 -2.23 0.00 0.00 178.31 176.12 3gfb h ARG 204 N -0.25 0.04 0.00 1.11 3.08 -1.87 -1.50 114.38 114.99 3gfb h ARG 204 Ca -0.01 -0.01 -0.07 0.00 0.07 0.00 0.00 59.98 59.97 3gfb h ARG 204 Cb 0.22 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.26 3gfb h ARG 204 CO 0.01 0.16 -0.33 0.00 -1.07 0.00 0.00 179.97 178.73 3gfb h ARG 205 N 0.04 0.00 0.00 0.04 3.08 -1.22 -0.52 114.38 115.80 3gfb h ARG 205 Ca 0.01 0.00 -0.13 0.00 0.07 0.00 0.00 59.98 59.93 3gfb h ARG 205 Cb 0.22 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.25 3gfb h ARG 205 CO 0.01 0.33 -0.75 -0.22 -1.07 0.00 0.00 179.97 178.28 3gfb h LYS 206 N 0.00 0.00 0.07 0.04 3.64 -0.83 -2.58 116.57 116.91 3gfb h LYS 206 Ca -0.00 0.00 -0.28 0.00 -1.27 0.00 0.00 60.65 59.10 3gfb h LYS 206 Cb 1.02 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.82 3gfb h LYS 206 CO 0.04 0.48 -1.43 -0.07 -2.27 0.00 0.00 179.45 176.21 3gfb h LEU 207 N 0.00 0.22 -0.33 5.20 3.38 -1.16 -2.42 115.31 120.20 3gfb h LEU 207 Ca -0.04 -0.31 0.07 0.00 0.09 0.00 0.00 57.88 57.69 3gfb h LEU 207 Cb 1.45 -0.07 -0.07 0.00 0.09 0.00 0.00 40.66 42.06 3gfb h LEU 207 CO 0.06 1.26 -0.15 0.00 0.09 0.00 0.00 178.44 179.70 3gfb h ALA 208 N 0.71 0.11 -0.07 1.53 0.00 -1.12 -1.52 119.26 118.90 3gfb h ALA 208 Ca -0.19 0.12 -0.14 0.00 0.00 0.00 0.00 54.91 54.70 3gfb h ALA 208 Cb 1.95 0.38 -0.01 0.00 0.00 0.00 0.00 17.79 20.11 3gfb h ALA 208 CO 0.14 -0.54 -0.59 -0.22 0.00 0.00 0.00 179.25 178.04 3gfb h LYS 209 N -0.10 0.23 -0.10 0.00 1.63 -1.44 -1.47 116.57 115.32 3gfb h LYS 209 Ca 0.17 -0.15 -0.03 0.00 -0.85 0.00 0.00 60.65 59.78 3gfb h LYS 209 Cb 0.36 0.02 -0.00 0.00 -0.60 0.00 0.00 32.23 32.01 3gfb h LYS 209 CO -0.40 0.75 -0.06 -0.22 -3.45 0.00 0.00 179.45 176.07 3gfb h LYS 210 N 0.17 0.23 -0.86 1.90 3.64 -1.38 -3.12 116.57 117.15 3gfb h LYS 210 Ca -0.00 -0.11 0.14 0.00 -1.27 0.00 0.00 60.65 59.41 3gfb h LYS 210 Cb 1.09 -0.00 -0.09 0.00 -0.41 0.00 0.00 32.23 32.81 3gfb h LYS 210 CO 0.09 0.60 0.46 0.28 -2.27 0.00 0.00 179.45 178.61 3gfb h VAL 211 N -0.15 0.75 0.00 2.00 2.07 -1.19 -3.47 116.25 116.26 3gfb h VAL 211 Ca 0.02 -0.23 0.00 0.00 0.82 0.00 0.00 66.70 67.31 3gfb h VAL 211 Cb 0.54 0.03 0.00 0.00 -1.52 0.00 0.00 31.29 30.34 3gfb h VAL 211 CO 0.02 0.12 0.00 0.61 0.02 0.00 0.00 177.57 178.34 3gfb n GLY 212 N -1.33 -0.96 3.46 2.17 0.00 -0.77 -4.74 105.19 103.03 3gfb n GLY 212 Ca 0.17 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.72 3gfb n GLY 212 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gfb n ALA 213 N 0.00 -2.03 0.07 4.61 0.00 -0.62 -4.92 120.51 117.62 3gfb n ALA 213 Ca 0.00 0.43 0.03 0.00 0.00 0.00 0.00 53.44 53.90 3gfb n ALA 213 Cb 0.00 -1.75 -0.04 0.00 0.00 0.00 0.00 19.45 17.66 3gfb n ALA 213 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 3gfb h ASP 214 N 1.39 0.00 -3.61 0.00 3.32 -0.58 -3.44 116.42 113.50 3gfb h ASP 214 Ca -0.32 0.00 -0.09 0.00 0.02 0.00 0.00 57.03 56.64 3gfb h ASP 214 Cb 1.41 0.00 -0.24 0.00 0.22 0.00 0.00 39.33 40.72 3gfb h ASP 214 CO 0.58 0.45 -0.17 -0.31 -1.72 0.00 0.00 179.24 178.08 3gfb s TYR 215 N -3.01 -0.62 0.03 4.55 2.02 -1.08 -5.01 117.35 114.23 3gfb s TYR 215 Ca -0.01 1.41 0.06 0.00 -0.37 0.00 0.00 57.07 58.16 3gfb s TYR 215 Cb 0.08 0.26 -0.03 0.00 -0.40 0.00 0.00 41.96 41.87 3gfb s TYR 215 CO 0.79 -0.32 -0.16 0.14 -1.57 0.00 0.00 175.55 174.43 3gfb s VAL 216 N 0.76 2.93 0.01 0.71 -7.23 -1.26 0.11 120.40 116.43 3gfb s VAL 216 Ca -0.04 -1.10 0.03 0.00 -1.81 0.00 0.00 61.98 59.06 3gfb s VAL 216 Cb -0.05 -2.24 -0.01 0.00 0.56 0.00 0.00 36.38 34.64 3gfb s VAL 216 CO -0.06 0.36 -0.10 0.54 -0.31 0.00 0.00 175.10 175.53 3gfb s VAL 217 N -0.93 0.78 -0.41 1.32 0.11 0.13 -4.89 120.40 116.52 3gfb s VAL 217 Ca 0.15 -0.58 -0.20 0.00 -2.93 0.00 0.00 61.98 58.42 3gfb s VAL 217 Cb -0.11 -0.69 0.01 0.00 -1.53 0.00 0.00 36.38 34.07 3gfb s VAL 217 CO 0.05 0.11 0.59 0.21 -3.33 0.00 0.00 175.10 172.73 3gfb s ASN 218 N -0.53 6.32 0.04 3.54 2.47 -1.26 -1.66 114.94 123.86 3gfb s ASN 218 Ca 0.02 -0.24 0.11 0.00 0.42 0.00 0.00 52.86 53.17 3gfb s ASN 218 Cb -0.05 -2.30 0.50 0.00 -1.45 0.00 0.00 41.25 37.95 3gfb s ASN 218 CO 0.00 -0.67 1.36 -0.81 -3.72 0.00 0.00 177.10 173.26 3gfb n PRO 219 N 6.05 0.02 -0.01 0.43 -0.04 -1.26 -1.31 135.00 138.89 3gfb n PRO 219 Ca -0.03 0.36 -0.21 0.00 -0.04 0.00 0.00 63.50 63.58 3gfb n PRO 219 Cb 0.48 -1.56 -0.14 0.00 -0.04 0.00 0.00 33.50 32.25 3gfb n PRO 219 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 3gfb n PHE 220 N -1.60 1.14 0.02 0.54 3.01 -1.26 -4.62 117.46 114.68 3gfb n PHE 220 Ca 0.02 0.24 -0.12 0.00 1.01 0.00 0.00 57.45 58.60 3gfb n PHE 220 Cb 0.12 -1.15 -0.09 0.00 -0.01 0.00 0.00 39.48 38.35 3gfb n PHE 220 CO 0.00 0.00 0.00 0.93 1.01 0.00 0.00 176.76 178.70 3gfb h GLU 221 N 0.04 -0.10 -4.73 -1.08 5.08 -1.76 -3.48 114.58 108.55 3gfb h GLU 221 Ca -0.44 0.01 -0.26 0.00 -1.00 0.00 0.00 59.36 57.66 3gfb h GLU 221 Cb 2.01 0.02 -0.15 0.00 0.50 0.00 0.00 28.75 31.13 3gfb h GLU 221 CO 0.06 0.40 -0.67 -1.83 -1.00 0.00 0.00 179.01 175.98 3gfb s GLU 222 N -3.85 1.04 -0.06 2.33 -1.05 -0.43 -5.08 118.70 111.60 3gfb s GLU 222 Ca -0.15 -1.49 -0.30 0.00 -0.15 0.00 0.00 54.97 52.88 3gfb s GLU 222 Cb 0.01 -0.19 -0.06 0.00 -0.44 0.00 0.00 34.13 33.45 3gfb s GLU 222 CO 0.60 -0.13 1.68 0.34 0.95 0.00 0.00 175.26 178.70 3gfb s ASP 223 N -3.14 6.62 0.11 0.83 -1.08 -1.26 -4.08 116.67 114.67 3gfb s ASP 223 Ca 0.22 2.22 -0.14 0.00 -0.52 0.00 0.00 52.55 54.33 3gfb s ASP 223 Cb 0.06 -2.53 -0.09 0.00 -1.46 0.00 0.00 42.92 38.90 3gfb s ASP 223 CO 0.02 -0.97 1.41 1.55 0.52 0.00 0.00 175.17 177.70 3gfb h PRO 224 N 9.76 0.77 -0.88 4.34 0.13 -1.87 -2.43 132.00 141.83 3gfb h PRO 224 Ca -0.40 -0.45 0.16 0.00 -0.87 0.00 0.00 66.00 64.45 3gfb h PRO 224 Cb 1.18 0.04 -0.16 0.00 0.13 0.00 0.00 31.00 32.19 3gfb h PRO 224 CO 0.96 1.08 -0.28 0.28 -0.23 0.00 0.00 178.00 179.81 3gfb h VAL 225 N 0.53 0.09 -0.41 1.56 2.07 -1.92 0.37 116.25 118.54 3gfb h VAL 225 Ca 0.03 0.00 -0.12 0.00 0.82 0.00 0.00 66.70 67.44 3gfb h VAL 225 Cb 0.99 0.09 -0.01 0.00 -1.52 0.00 0.00 31.29 30.83 3gfb h VAL 225 CO 0.09 0.00 -0.21 0.50 0.02 0.00 0.00 177.57 177.97 3gfb h LYS 226 N -0.02 0.82 -0.22 1.57 3.11 -1.96 0.20 116.57 120.08 3gfb h LYS 226 Ca 0.38 -0.33 -0.03 0.00 -2.81 0.00 0.00 60.65 57.86 3gfb h LYS 226 Cb 0.63 -0.04 -0.01 0.00 -1.00 0.00 0.00 32.23 31.81 3gfb h LYS 226 CO -0.90 0.96 0.02 0.35 -2.81 0.00 0.00 179.45 177.06 3gfb h PHE 227 N 0.72 0.40 -0.61 1.91 3.57 -0.90 -1.74 116.94 120.28 3gfb h PHE 227 Ca 0.10 -0.06 0.03 0.00 3.53 0.00 0.00 57.97 61.57 3gfb h PHE 227 Cb 0.73 -0.11 -0.04 0.00 2.79 0.00 0.00 35.95 39.32 3gfb h PHE 227 CO 0.04 0.53 0.36 0.28 -2.23 0.00 0.00 178.31 177.29 3gfb h VAL 228 N 0.15 1.04 -0.05 1.41 2.07 0.16 -2.45 116.25 118.59 3gfb h VAL 228 Ca 0.06 -0.24 0.02 0.00 0.82 0.00 0.00 66.70 67.36 3gfb h VAL 228 Cb 0.36 0.27 -0.00 0.00 -1.52 0.00 0.00 31.29 30.40 3gfb h VAL 228 CO 0.01 0.13 0.05 0.24 0.02 0.00 0.00 177.57 178.01 3gfb h MET 229 N 0.71 0.00 0.08 1.57 2.86 -0.16 -0.73 114.93 119.25 3gfb h MET 229 Ca 0.25 0.00 -0.15 0.00 -2.06 0.00 0.00 59.70 57.74 3gfb h MET 229 Cb 0.06 0.00 0.01 0.00 0.06 0.00 0.00 31.60 31.73 3gfb h MET 229 CO -0.12 0.00 -0.72 -0.44 1.06 0.00 0.00 176.91 176.69 3gfb h ASP 230 N 0.00 0.27 -0.83 1.22 3.32 -0.87 0.42 116.42 119.95 3gfb h ASP 230 Ca 0.03 -0.91 0.09 0.00 0.02 0.00 0.00 57.03 56.25 3gfb h ASP 230 Cb 0.12 -0.09 -0.07 0.00 0.22 0.00 0.00 39.33 39.51 3gfb h ASP 230 CO -0.00 1.32 0.48 0.40 -1.72 0.00 0.00 179.24 179.72 3gfb h ILE 231 N -0.61 0.93 -0.56 0.35 2.04 -1.44 -3.09 117.51 115.13 3gfb h ILE 231 Ca -0.15 -0.28 0.00 0.00 1.00 0.00 0.00 64.86 65.43 3gfb h ILE 231 Cb 1.44 0.04 0.00 0.00 -0.74 0.00 0.00 36.82 37.56 3gfb h ILE 231 CO 0.05 0.15 0.00 0.35 0.00 0.00 0.00 178.15 178.70 3gfb n THR 232 N -4.72 2.43 -2.90 -0.27 -2.24 -0.29 -4.87 114.28 101.42 3gfb n THR 232 Ca 0.13 -1.28 -0.22 0.00 -2.27 0.00 0.00 64.05 60.41 3gfb n THR 232 Cb 0.26 -0.21 0.02 0.00 -2.10 0.00 0.00 70.33 68.30 3gfb n THR 232 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 3gfb n ASP 233 N 0.70 -5.89 0.00 3.42 -0.08 -1.06 -0.80 116.55 112.84 3gfb n ASP 233 Ca 0.26 -0.22 0.00 0.00 -1.51 0.00 0.00 54.79 53.32 3gfb n ASP 233 Cb 1.09 -4.80 0.00 0.00 2.34 0.00 0.00 41.12 39.75 3gfb n ASP 233 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 3gfb n GLY 234 N -1.38 1.51 0.15 0.27 0.00 0.15 -4.92 105.19 100.96 3gfb n GLY 234 Ca -0.14 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.82 3gfb n GLY 234 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gfb h ALA 235 N 0.00 0.72 0.00 4.61 0.00 -1.21 -3.49 119.26 119.89 3gfb h ALA 235 Ca 0.00 -0.61 0.00 0.00 0.00 0.00 0.00 54.91 54.30 3gfb h ALA 235 Cb 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.71 3gfb h ALA 235 CO 0.00 0.80 0.00 0.41 0.00 0.00 0.00 179.25 180.46 3gfb n GLY 236 N 0.49 -0.17 3.86 0.00 0.00 -1.26 -4.14 105.19 103.97 3gfb n GLY 236 Ca -0.03 -1.82 -0.32 0.00 0.00 0.00 0.00 46.02 43.85 3gfb n GLY 236 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3gfb s VAL 237 N -1.57 4.72 -0.04 1.61 -7.23 0.31 -4.47 120.40 113.73 3gfb s VAL 237 Ca 0.00 0.85 0.09 0.00 -1.81 0.00 0.00 61.98 61.11 3gfb s VAL 237 Cb 0.00 -3.63 -0.23 0.00 0.56 0.00 0.00 36.38 33.08 3gfb s VAL 237 CO 0.00 -0.22 0.67 -0.08 -0.31 0.00 0.00 175.10 175.16 3gfb h GLU 238 N 2.15 0.04 -5.11 4.82 4.57 -1.54 0.46 114.58 119.97 3gfb h GLU 238 Ca -0.48 -0.07 -0.64 0.00 -1.18 0.00 0.00 59.36 56.99 3gfb h GLU 238 Cb 1.18 0.03 -0.34 0.00 -0.16 0.00 0.00 28.75 29.46 3gfb h GLU 238 CO 0.66 0.63 -0.86 0.08 -1.18 0.00 0.00 179.01 178.34 3gfb s VAL 239 N -2.60 1.85 -0.28 0.32 1.01 -0.70 -2.05 120.40 117.94 3gfb s VAL 239 Ca -0.07 -0.88 -0.03 0.00 0.00 0.00 0.00 61.98 61.00 3gfb s VAL 239 Cb 0.08 -1.62 0.03 0.00 0.00 0.00 0.00 36.38 34.86 3gfb s VAL 239 CO 0.82 0.51 0.00 0.12 0.00 0.00 0.00 175.10 176.55 3gfb s PHE 240 N 0.59 3.15 -0.41 5.22 5.36 0.16 -1.59 117.98 130.46 3gfb s PHE 240 Ca -0.14 -1.48 -0.14 0.00 -0.96 0.00 0.00 56.93 54.21 3gfb s PHE 240 Cb -0.17 -2.14 0.03 0.00 -0.34 0.00 0.00 43.02 40.41 3gfb s PHE 240 CO 0.04 -0.71 0.29 -0.51 -1.46 0.00 0.00 175.22 172.88 3gfb s LEU 241 N 1.36 5.11 -0.50 6.12 1.43 -0.20 -0.64 118.68 131.35 3gfb s LEU 241 Ca -0.01 -1.01 -0.23 0.00 -1.03 0.00 0.00 54.13 51.85 3gfb s LEU 241 Cb -0.18 -2.13 0.04 0.00 0.03 0.00 0.00 46.19 43.95 3gfb s LEU 241 CO -0.01 -0.47 0.85 -0.70 0.23 0.00 0.00 176.35 176.24 3gfb s GLU 242 N 1.64 3.36 -0.23 1.70 -6.30 -0.24 -2.10 118.70 116.53 3gfb s GLU 242 Ca 0.04 -0.22 0.07 0.00 -2.50 0.00 0.00 54.97 52.36 3gfb s GLU 242 Cb -0.20 -4.00 -0.19 0.00 0.00 0.00 0.00 34.13 29.74 3gfb s GLU 242 CO 0.09 -1.29 -0.13 1.19 0.02 0.00 0.00 175.26 175.14 3gfb n PHE 243 N 7.02 0.00 -0.05 5.30 3.72 -0.22 -0.45 117.46 132.78 3gfb n PHE 243 Ca 0.02 0.00 0.03 0.00 -0.05 0.00 0.00 57.45 57.44 3gfb n PHE 243 Cb 0.48 -0.96 0.37 0.00 -0.94 0.00 0.00 39.48 38.43 3gfb n PHE 243 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 3gfb h SER 244 N 0.00 0.57 -1.06 4.37 4.64 -1.61 -3.25 113.55 117.21 3gfb h SER 244 Ca -0.55 -0.02 -0.31 0.00 -0.47 0.00 0.00 61.79 60.44 3gfb h SER 244 Cb 1.97 -0.14 -0.10 0.00 -0.31 0.00 0.00 62.40 63.82 3gfb h SER 244 CO -0.05 0.43 -0.31 0.61 -0.87 0.00 0.00 176.83 176.64 3gfb n GLY 245 N -1.42 1.15 3.58 -0.77 0.00 -1.26 -4.74 105.19 101.72 3gfb n GLY 245 Ca 0.04 -0.29 -0.42 0.00 0.00 0.00 0.00 46.02 45.35 3gfb n GLY 245 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gfb s ALA 246 N -2.61 3.41 0.30 4.61 0.00 -1.26 -4.11 121.76 122.09 3gfb s ALA 246 Ca 0.00 -0.71 0.01 0.00 0.00 0.00 0.00 51.96 51.27 3gfb s ALA 246 Cb 0.00 -3.37 0.72 0.00 0.00 0.00 0.00 23.12 20.47 3gfb s ALA 246 CO 0.00 -1.54 1.60 -1.35 0.00 0.00 0.00 175.76 174.47 3gfb h PRO 247 N 8.55 0.07 -0.50 0.00 0.11 -1.94 1.75 132.00 140.04 3gfb h PRO 247 Ca -0.25 -0.00 0.02 0.00 0.11 0.00 0.00 66.00 65.87 3gfb h PRO 247 Cb 1.09 -0.02 -0.03 0.00 0.11 0.00 0.00 31.00 32.16 3gfb h PRO 247 CO 0.91 0.05 0.33 -0.22 -0.21 0.00 0.00 178.00 178.87 3gfb h LYS 248 N 0.08 0.62 -0.20 1.05 1.63 -2.00 -3.06 116.57 114.68 3gfb h LYS 248 Ca 0.57 -0.04 -0.14 0.00 -0.85 0.00 0.00 60.65 60.19 3gfb h LYS 248 Cb 1.17 -0.14 0.00 0.00 -0.60 0.00 0.00 32.23 32.66 3gfb h LYS 248 CO -0.80 0.41 -0.42 0.00 -3.45 0.00 0.00 179.45 175.19 3gfb h ALA 249 N 1.69 0.32 -0.65 5.00 0.00 0.22 -2.59 119.26 123.24 3gfb h ALA 249 Ca 0.19 -0.46 0.14 0.00 0.00 0.00 0.00 54.91 54.78 3gfb h ALA 249 Cb -0.01 -0.05 -0.11 0.00 0.00 0.00 0.00 17.79 17.62 3gfb h ALA 249 CO -0.05 0.43 -0.02 1.25 0.00 0.00 0.00 179.25 180.86 3gfb h LEU 250 N 0.32 -0.35 -0.37 0.00 5.85 -0.94 -0.17 115.31 119.66 3gfb h LEU 250 Ca 0.00 0.17 -0.04 0.00 0.84 0.00 0.00 57.88 58.86 3gfb h LEU 250 Cb 1.02 0.31 -0.01 0.00 0.37 0.00 0.00 40.66 42.35 3gfb h LEU 250 CO 0.09 -0.15 0.08 -0.08 -0.34 0.00 0.00 178.44 178.05 3gfb h GLU 251 N 0.09 0.60 -0.12 1.25 4.81 -1.54 -2.49 114.58 117.18 3gfb h GLU 251 Ca 0.34 -0.15 -0.16 0.00 -0.13 0.00 0.00 59.36 59.26 3gfb h GLU 251 Cb 0.56 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.86 3gfb h GLU 251 CO -0.58 0.64 -0.61 1.96 -0.73 0.00 0.00 179.01 179.69 3gfb h GLN 252 N 0.45 0.42 0.20 1.92 4.20 -1.19 -2.49 115.11 118.62 3gfb h GLN 252 Ca 0.11 -0.29 0.01 0.00 0.06 0.00 0.00 58.65 58.55 3gfb h GLN 252 Cb 0.32 0.04 -0.03 0.00 0.30 0.00 0.00 27.48 28.12 3gfb h GLN 252 CO 0.00 0.90 -0.27 0.78 -0.67 0.00 0.00 178.83 179.57 3gfb h GLY 253 N 1.24 -0.56 0.99 3.46 0.00 -1.07 -2.06 103.07 105.07 3gfb h GLY 253 Ca -0.01 0.31 0.10 0.00 0.00 0.00 0.00 47.33 47.74 3gfb h GLY 253 CO 0.11 -0.23 0.42 1.41 0.00 0.00 0.00 176.54 178.24 3gfb h LEU 254 N -0.53 0.39 -0.48 3.11 3.38 -1.43 0.13 115.31 119.89 3gfb h LEU 254 Ca 0.01 0.01 -0.17 0.00 0.09 0.00 0.00 57.88 57.82 3gfb h LEU 254 Cb 0.52 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 41.18 3gfb h LEU 254 CO -0.10 0.23 -0.75 0.11 0.09 0.00 0.00 178.44 178.02 3gfb h LYS 255 N 0.44 0.10 -0.40 1.13 1.57 -1.50 -3.29 116.57 114.62 3gfb h LYS 255 Ca 0.29 -0.10 -0.10 0.00 -1.87 0.00 0.00 60.65 58.87 3gfb h LYS 255 Cb 0.57 0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.88 3gfb h LYS 255 CO -0.09 0.81 -0.17 0.00 -0.57 0.00 0.00 179.45 179.43 3gfb h ALA 256 N 1.16 0.94 -2.82 3.86 0.00 -0.42 -3.46 119.26 118.52 3gfb h ALA 256 Ca -0.02 -0.35 -0.53 0.00 0.00 0.00 0.00 54.91 54.02 3gfb h ALA 256 Cb 1.33 -0.16 0.07 0.00 0.00 0.00 0.00 17.79 19.03 3gfb h ALA 256 CO 0.11 0.62 0.75 0.08 0.00 0.00 0.00 179.25 180.80 3gfb s VAL 257 N -4.68 2.50 0.59 0.00 1.01 0.32 -0.53 120.40 119.61 3gfb s VAL 257 Ca -0.09 0.45 -0.20 0.00 0.00 0.00 0.00 61.98 62.14 3gfb s VAL 257 Cb 0.13 -3.29 -0.03 0.00 0.00 0.00 0.00 36.38 33.19 3gfb s VAL 257 CO 0.83 0.09 1.31 0.28 0.00 0.00 0.00 175.10 177.61 3gfb s THR 258 N -0.45 2.15 0.40 3.92 -1.32 0.16 -4.70 115.64 115.80 3gfb s THR 258 Ca 0.56 0.10 -0.26 0.00 -1.21 0.00 0.00 61.69 60.88 3gfb s THR 258 Cb -0.43 -3.05 -0.10 0.00 -1.51 0.00 0.00 72.50 67.41 3gfb s THR 258 CO 0.49 -0.01 1.37 -2.65 -2.21 0.00 0.00 174.62 171.61 3gfb n PRO 259 N -1.42 2.22 -0.94 7.08 -0.02 -1.26 -1.20 135.00 139.46 3gfb n PRO 259 Ca 0.13 0.79 0.00 0.00 -2.02 0.00 0.00 63.50 62.39 3gfb n PRO 259 Cb 0.47 -2.50 0.00 0.00 -0.02 0.00 0.00 33.50 31.45 3gfb n PRO 259 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3gfb n GLY 260 N 0.66 0.73 3.68 -1.23 0.00 0.72 -5.00 105.19 104.76 3gfb n GLY 260 Ca 0.05 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.77 3gfb n GLY 260 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3gfb s GLY 261 N -2.00 1.60 -0.07 -0.02 0.00 -0.34 -4.78 107.32 101.70 3gfb s GLY 261 Ca 0.00 -0.76 0.04 0.00 0.00 0.00 0.00 44.72 44.00 3gfb s GLY 261 CO 0.00 -0.01 -0.19 -1.60 0.00 0.00 0.00 173.10 171.30 3gfb s ARG 262 N -5.32 2.26 -0.05 2.90 3.00 -0.87 -2.01 118.95 118.86 3gfb s ARG 262 Ca 0.69 -0.68 0.06 0.00 -1.00 0.00 0.00 55.73 54.80 3gfb s ARG 262 Cb -0.12 -1.83 -0.01 0.00 0.00 0.00 0.00 34.95 32.99 3gfb s ARG 262 CO 0.56 0.18 -0.25 0.08 0.00 0.00 0.00 175.30 175.87 3gfb s VAL 263 N 0.28 2.13 -0.19 7.11 1.01 0.48 0.40 120.40 131.61 3gfb s VAL 263 Ca -0.12 -1.05 -0.02 0.00 0.00 0.00 0.00 61.98 60.79 3gfb s VAL 263 Cb -0.15 -1.76 -0.00 0.00 0.00 0.00 0.00 36.38 34.47 3gfb s VAL 263 CO 0.05 0.57 -0.11 -0.44 0.00 0.00 0.00 175.10 175.18 3gfb s SER 264 N -0.33 3.88 -0.31 3.32 0.01 0.18 -1.01 113.70 119.45 3gfb s SER 264 Ca 0.01 -0.46 -0.11 0.00 1.31 0.00 0.00 55.95 56.70 3gfb s SER 264 Cb -0.12 -1.64 -0.02 0.00 0.21 0.00 0.00 66.02 64.45 3gfb s SER 264 CO 0.02 0.02 0.18 -0.76 0.41 0.00 0.00 173.24 173.11 3gfb s LEU 265 N 1.23 4.15 -0.01 2.44 1.43 0.17 -1.08 118.68 127.01 3gfb s LEU 265 Ca 0.03 -0.36 -0.00 0.00 -1.03 0.00 0.00 54.13 52.77 3gfb s LEU 265 Cb -0.14 -2.06 -0.01 0.00 0.03 0.00 0.00 46.19 44.01 3gfb s LEU 265 CO -0.05 -0.16 -0.01 -0.11 0.23 0.00 0.00 176.35 176.25 3gfb n LEU 266 N 5.03 2.27 -4.58 1.79 7.94 -0.03 -1.32 117.00 128.10 3gfb n LEU 266 Ca -0.14 -0.00 -0.57 0.00 -1.11 0.00 0.00 56.01 54.19 3gfb n LEU 266 Cb 0.50 -0.04 -0.07 0.00 0.53 0.00 0.00 43.42 44.34 3gfb n LEU 266 CO 0.34 0.40 0.82 0.61 -1.11 0.00 0.00 177.39 178.45 3gfb n GLY 267 N 3.31 0.16 3.72 -3.96 0.00 0.40 -4.94 105.19 103.89 3gfb n GLY 267 Ca -0.02 0.78 -0.41 0.00 0.00 0.00 0.00 46.02 46.36 3gfb n GLY 267 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3gfb s LEU 268 N 0.80 4.42 0.35 0.99 1.43 -1.26 -4.37 118.68 121.04 3gfb s LEU 268 Ca 0.90 1.62 -0.23 0.00 -1.03 0.00 0.00 54.13 55.39 3gfb s LEU 268 Cb -1.15 -3.47 -0.10 0.00 0.03 0.00 0.00 46.19 41.50 3gfb s LEU 268 CO 0.56 -0.13 0.91 -0.36 0.23 0.00 0.00 176.35 177.56 3gfb s PHE 269 N 0.48 3.54 -2.00 0.29 0.40 -1.26 -4.29 117.98 115.14 3gfb s PHE 269 Ca 0.47 1.64 0.00 0.00 -0.60 0.00 0.00 56.93 58.44 3gfb s PHE 269 Cb -0.21 -2.84 0.01 0.00 0.51 0.00 0.00 43.02 40.49 3gfb s PHE 269 CO 0.27 0.11 0.67 -0.35 0.70 0.00 0.00 175.22 176.62 3gfb n PRO 270 N 0.10 0.66 0.00 0.24 -0.04 -1.26 -4.87 135.00 129.84 3gfb n PRO 270 Ca 0.03 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.49 3gfb n PRO 270 Cb 0.52 -1.00 0.00 0.00 -0.04 0.00 0.00 33.50 32.97 3gfb n PRO 270 CO 0.00 0.00 0.00 2.89 -0.04 0.00 0.00 175.50 178.35 3gfb n ARG 271 N -0.50 0.00 -0.43 0.54 1.85 -1.26 -5.16 116.66 111.69 3gfb n ARG 271 Ca 0.00 0.00 -0.15 0.00 -1.00 0.00 0.00 57.85 56.70 3gfb n ARG 271 Cb 0.00 0.00 -0.01 0.00 -1.05 0.00 0.00 32.46 31.40 3gfb n ARG 271 CO 0.00 0.00 0.00 0.39 -0.01 0.00 0.00 177.63 178.01 3gfb n GLU 272 N -1.08 0.00 -4.95 2.89 1.02 -1.26 -4.99 120.64 112.27 3gfb n GLU 272 Ca 0.00 0.00 -0.27 0.00 -0.02 0.00 0.00 57.16 56.87 3gfb n GLU 272 Cb 0.00 -0.32 -0.15 0.00 -0.02 0.00 0.00 31.44 30.95 3gfb n GLU 272 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 3gfb s VAL 273 N -0.29 1.69 -0.31 2.62 1.01 -1.26 -5.09 120.40 118.76 3gfb s VAL 273 Ca 0.20 -0.98 -0.10 0.00 0.00 0.00 0.00 61.98 61.10 3gfb s VAL 273 Cb -0.29 -1.42 -0.01 0.00 0.00 0.00 0.00 36.38 34.66 3gfb s VAL 273 CO 0.17 0.41 0.16 -0.89 0.00 0.00 0.00 175.10 174.95 3gfb s THR 274 N -0.57 4.65 -0.07 3.92 2.01 -1.26 -5.08 115.64 119.24 3gfb s THR 274 Ca 0.08 -0.41 0.03 0.00 0.31 0.00 0.00 61.69 61.71 3gfb s THR 274 Cb -0.08 -3.37 0.01 0.00 0.01 0.00 0.00 72.50 69.06 3gfb s THR 274 CO -0.00 0.06 -0.16 -0.63 -0.69 0.00 0.00 174.62 173.20 3gfb s ILE 275 N 1.62 1.40 -1.03 1.82 -1.09 -1.26 -5.03 121.20 117.63 3gfb s ILE 275 Ca 0.05 -0.65 -0.26 0.00 -2.23 0.00 0.00 60.65 57.56 3gfb s ILE 275 Cb -0.17 -1.24 -0.20 0.00 -1.58 0.00 0.00 42.46 39.26 3gfb s ILE 275 CO 0.07 0.41 2.02 -0.67 -1.23 0.00 0.00 174.94 175.54 3gfb n ASP 276 N 3.62 1.84 -0.23 3.58 -0.08 -1.26 -4.84 116.55 119.17 3gfb n ASP 276 Ca -0.21 -2.56 0.02 0.00 -1.51 0.00 0.00 54.79 50.53 3gfb n ASP 276 Cb 0.52 -1.64 0.14 0.00 2.34 0.00 0.00 41.12 42.49 3gfb n ASP 276 CO 0.00 0.00 0.00 -0.26 0.12 0.00 0.00 177.20 177.06 3gfb h PHE 277 N 10.90 0.51 0.62 -0.67 0.04 -1.97 -1.92 116.94 124.45 3gfb h PHE 277 Ca 0.09 0.03 -0.02 0.00 2.80 0.00 0.00 57.97 60.87 3gfb h PHE 277 Cb 0.95 -0.12 -0.01 0.00 2.20 0.00 0.00 35.95 38.97 3gfb h PHE 277 CO 1.07 0.13 -0.44 -0.91 -0.60 0.00 0.00 178.31 177.56 3gfb h ASN 278 N 0.48 -1.14 1.04 2.17 2.35 -1.97 -1.40 115.58 117.11 3gfb h ASN 278 Ca 0.35 0.08 -0.13 0.00 -0.55 0.00 0.00 56.30 56.05 3gfb h ASN 278 Cb 0.45 0.35 -0.02 0.00 0.05 0.00 0.00 38.32 39.15 3gfb h ASN 278 CO -0.32 -0.65 -0.62 0.78 -1.65 0.00 0.00 177.43 174.96 3gfb h ASN 279 N -1.02 0.00 0.11 5.81 2.35 -1.96 0.68 115.58 121.55 3gfb h ASN 279 Ca -0.08 0.00 -0.36 0.00 -0.55 0.00 0.00 56.30 55.32 3gfb h ASN 279 Cb 0.85 0.00 -0.06 0.00 0.05 0.00 0.00 38.32 39.15 3gfb h ASN 279 CO 0.04 0.62 -2.23 0.18 -1.65 0.00 0.00 177.43 174.39 3gfb n LEU 280 N -3.43 0.96 -0.03 1.61 4.77 -0.73 -4.38 117.00 115.76 3gfb n LEU 280 Ca 0.00 0.08 -0.05 0.00 -0.03 0.00 0.00 56.01 56.01 3gfb n LEU 280 Cb 0.71 0.04 -0.03 0.00 -2.33 0.00 0.00 43.42 41.80 3gfb n LEU 280 CO 0.42 0.59 -0.73 -0.38 -1.33 0.00 0.00 177.39 175.96 3gfb n ILE 281 N -2.97 0.40 -0.03 -0.08 5.41 -0.59 -4.58 119.36 116.93 3gfb n ILE 281 Ca -0.32 -0.16 -0.01 0.00 1.00 0.00 0.00 62.75 63.26 3gfb n ILE 281 Cb 1.10 -0.76 -0.00 0.00 -0.71 0.00 0.00 39.64 39.27 3gfb n ILE 281 CO 0.00 0.00 0.00 0.40 0.00 0.00 0.00 176.55 176.95 3gfb h ILE 282 N 0.00 0.00 0.00 1.39 2.04 -1.42 -2.58 117.51 116.94 3gfb h ILE 282 Ca -0.16 -0.53 0.00 0.00 1.00 0.00 0.00 64.86 65.17 3gfb h ILE 282 Cb 1.25 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 37.33 3gfb h ILE 282 CO -0.02 0.00 0.00 0.49 0.00 0.00 0.00 178.15 178.62 3gfb n PHE 283 N -3.49 0.40 1.05 1.37 3.72 0.23 -1.43 117.46 119.32 3gfb n PHE 283 Ca -0.01 0.17 0.12 0.00 -0.05 0.00 0.00 57.45 57.68 3gfb n PHE 283 Cb 0.05 -0.78 0.11 0.00 -0.94 0.00 0.00 39.48 37.91 3gfb n PHE 283 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 3gfb n LYS 284 N -1.88 1.72 -4.05 -1.08 5.02 -1.25 -4.98 118.16 111.67 3gfb n LYS 284 Ca 0.02 -1.38 -0.28 0.00 -2.02 0.00 0.00 58.31 54.64 3gfb n LYS 284 Cb 0.14 -1.47 -0.03 0.00 -0.02 0.00 0.00 35.03 33.64 3gfb n LYS 284 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3gfb n ALA 285 N 0.57 -1.87 -1.76 7.82 0.00 -0.51 -0.20 120.51 124.55 3gfb n ALA 285 Ca 0.12 -0.24 -0.35 0.00 0.00 0.00 0.00 53.44 52.98 3gfb n ALA 285 Cb 0.51 -1.78 0.00 0.00 0.00 0.00 0.00 19.45 18.19 3gfb n ALA 285 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3gfb s LEU 286 N -7.07 3.74 -0.22 0.00 1.43 -1.00 -3.47 118.68 112.08 3gfb s LEU 286 Ca 0.14 2.14 -0.05 0.00 -1.03 0.00 0.00 54.13 55.33 3gfb s LEU 286 Cb -0.08 -4.58 -0.02 0.00 0.03 0.00 0.00 46.19 41.55 3gfb s LEU 286 CO 0.91 -1.19 0.01 -0.70 0.23 0.00 0.00 176.35 175.60 3gfb s GLU 287 N -3.32 3.55 -0.15 1.70 2.12 -0.85 -4.97 118.70 116.78 3gfb s GLU 287 Ca 0.72 -0.54 0.01 0.00 0.36 0.00 0.00 54.97 55.52 3gfb s GLU 287 Cb -0.23 -3.14 0.01 0.00 0.26 0.00 0.00 34.13 31.03 3gfb s GLU 287 CO 0.27 -0.13 -0.19 0.08 -0.54 0.00 0.00 175.26 174.75 3gfb s VAL 288 N 1.38 2.32 -0.20 3.70 1.01 -1.26 -0.39 120.40 126.97 3gfb s VAL 288 Ca 0.05 -0.89 -0.01 0.00 0.00 0.00 0.00 61.98 61.13 3gfb s VAL 288 Cb -0.15 -1.95 0.01 0.00 0.00 0.00 0.00 36.38 34.29 3gfb s VAL 288 CO 0.01 0.53 -0.13 -1.00 0.00 0.00 0.00 175.10 174.51 3gfb s HIS 289 N 0.85 2.86 0.02 5.22 3.76 -0.18 -4.97 115.29 122.85 3gfb s HIS 289 Ca -0.05 -1.29 -0.30 0.00 -0.15 0.00 0.00 55.06 53.26 3gfb s HIS 289 Cb -0.15 -2.00 -0.05 0.00 1.11 0.00 0.00 32.58 31.49 3gfb s HIS 289 CO -0.02 -0.67 1.26 0.20 -0.85 0.00 0.00 174.74 174.67 3gfb s GLY 290 N 1.33 2.16 -0.25 -2.22 0.00 -1.26 0.43 107.32 107.51 3gfb s GLY 290 Ca 0.05 0.82 -0.06 0.00 0.00 0.00 0.00 44.72 45.53 3gfb s GLY 290 CO -0.08 2.22 0.03 -0.42 0.00 0.00 0.00 173.10 174.85 3gfb s ILE 291 N 1.67 3.88 0.02 0.90 -1.09 -0.44 -4.90 121.20 121.24 3gfb s ILE 291 Ca 0.60 -0.40 -0.04 0.00 -2.23 0.00 0.00 60.65 58.58 3gfb s ILE 291 Cb -0.29 -2.84 -0.01 0.00 -1.58 0.00 0.00 42.46 37.74 3gfb s ILE 291 CO 0.27 0.32 0.05 0.28 -1.23 0.00 0.00 174.94 174.63 3gfb s THR 292 N 1.54 0.11 0.00 2.92 -1.32 -1.26 -4.59 115.64 113.03 3gfb s THR 292 Ca 0.05 -0.87 0.00 0.00 -1.21 0.00 0.00 61.69 59.67 3gfb s THR 292 Cb -0.15 -0.43 0.00 0.00 -1.51 0.00 0.00 72.50 70.41 3gfb s THR 292 CO 0.01 -0.48 0.00 0.61 -2.21 0.00 0.00 174.62 172.55 3gfb n GLY 293 N 1.41 0.94 3.23 6.08 0.00 -1.23 -4.21 105.19 111.41 3gfb n GLY 293 Ca -0.23 -0.68 -0.13 0.00 0.00 0.00 0.00 46.02 44.98 3gfb n GLY 293 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3gfb s ARG 294 N 0.00 0.46 -0.15 1.61 0.52 -1.26 -4.49 118.95 115.64 3gfb s ARG 294 Ca 0.00 0.31 -0.29 0.00 -0.52 0.00 0.00 55.73 55.23 3gfb s ARG 294 Cb 0.00 0.22 -0.02 0.00 0.52 0.00 0.00 34.95 35.66 3gfb s ARG 294 CO 0.00 -0.08 1.36 -1.01 0.02 0.00 0.00 175.30 175.59 3gfb s HIS 295 N -0.17 2.63 -0.63 -0.53 3.76 -1.26 -2.41 115.29 116.67 3gfb s HIS 295 Ca -0.03 0.81 -0.18 0.00 -0.15 0.00 0.00 55.06 55.51 3gfb s HIS 295 Cb -0.03 -3.62 0.12 0.00 1.11 0.00 0.00 32.58 30.16 3gfb s HIS 295 CO 0.01 -2.21 0.72 -0.51 -0.85 0.00 0.00 174.74 171.90 3gfb s LEU 296 N 3.69 5.59 -0.02 0.89 1.43 -1.26 -2.60 118.68 126.40 3gfb s LEU 296 Ca 0.59 -1.64 0.03 0.00 -1.03 0.00 0.00 54.13 52.08 3gfb s LEU 296 Cb -0.24 -2.29 0.04 0.00 0.03 0.00 0.00 46.19 43.73 3gfb s LEU 296 CO 0.18 -1.03 0.93 0.79 0.23 0.00 0.00 176.35 177.45 3gfb n TRP 297 N 6.01 0.00 -0.17 0.29 7.02 -1.26 -5.00 117.44 124.32 3gfb n TRP 297 Ca -0.06 -0.16 -0.01 0.00 -1.02 0.00 0.00 57.50 56.26 3gfb n TRP 297 Cb 0.43 -0.05 0.07 0.00 -2.42 0.00 0.00 31.31 29.34 3gfb n TRP 297 CO 0.00 0.00 0.00 0.93 -2.02 0.00 0.00 177.69 176.60 3gfb h GLU 298 N 0.00 0.13 -0.81 -0.99 3.07 -1.98 -1.60 114.58 112.40 3gfb h GLU 298 Ca 0.00 -0.01 -0.02 0.00 -0.50 0.00 0.00 59.36 58.83 3gfb h GLU 298 Cb 1.23 -0.03 -0.04 0.00 -0.84 0.00 0.00 28.75 29.08 3gfb h GLU 298 CO 0.00 0.09 0.43 1.15 -1.40 0.00 0.00 179.01 179.27 3gfb h THR 299 N 0.14 1.24 -0.83 1.13 2.02 -1.89 -1.94 112.91 112.78 3gfb h THR 299 Ca 0.28 -0.63 -0.01 0.00 0.77 0.00 0.00 66.41 66.81 3gfb h THR 299 Cb 0.42 0.18 -0.04 0.00 -1.74 0.00 0.00 68.15 66.97 3gfb h THR 299 CO -0.44 0.28 0.47 -0.50 0.37 0.00 0.00 175.52 175.70 3gfb h TRP 300 N 1.13 1.12 -0.75 3.16 4.06 -1.49 -1.81 115.95 121.37 3gfb h TRP 300 Ca 0.28 -0.02 0.08 0.00 2.06 0.00 0.00 58.89 61.30 3gfb h TRP 300 Cb 0.06 -0.36 -0.07 0.00 -1.00 0.00 0.00 29.16 27.79 3gfb h TRP 300 CO 0.01 0.77 0.42 1.88 -3.56 0.00 0.00 178.44 177.95 3gfb h TYR 301 N 1.15 0.76 -0.44 0.49 0.05 -0.72 -1.33 116.97 116.93 3gfb h TYR 301 Ca 0.29 0.03 -0.13 0.00 0.05 0.00 0.00 58.73 58.98 3gfb h TYR 301 Cb 0.00 -0.23 -0.01 0.00 1.01 0.00 0.00 36.73 37.50 3gfb h TYR 301 CO 0.00 0.32 -0.22 1.15 -1.05 0.00 0.00 178.16 178.37 3gfb h THR 302 N 0.73 1.27 -0.06 -2.88 2.02 -0.82 -2.94 112.91 110.24 3gfb h THR 302 Ca 0.35 -1.38 -0.03 0.00 0.77 0.00 0.00 66.41 66.12 3gfb h THR 302 Cb 0.29 1.21 -0.00 0.00 -1.74 0.00 0.00 68.15 67.91 3gfb h THR 302 CO -0.23 0.47 -0.10 0.58 0.37 0.00 0.00 175.52 176.61 3gfb h VAL 303 N 0.77 1.41 -0.92 3.16 2.07 -1.09 -2.60 116.25 119.05 3gfb h VAL 303 Ca 0.10 -1.38 0.26 0.00 0.82 0.00 0.00 66.70 66.50 3gfb h VAL 303 Cb 0.79 2.19 -0.16 0.00 -1.52 0.00 0.00 31.29 32.60 3gfb h VAL 303 CO 0.07 0.38 0.22 -1.28 0.02 0.00 0.00 177.57 176.97 3gfb h SER 304 N -0.32 -0.08 0.60 0.57 0.87 -1.28 -0.90 113.55 112.99 3gfb h SER 304 Ca 0.00 0.22 -0.24 0.00 -1.23 0.00 0.00 61.79 60.55 3gfb h SER 304 Cb 0.66 0.32 -0.04 0.00 -0.44 0.00 0.00 62.40 62.90 3gfb h SER 304 CO 0.02 -0.23 -1.56 -1.28 -0.53 0.00 0.00 176.83 173.25 3gfb h SER 305 N 0.14 0.00 -0.31 6.23 0.87 -1.45 -1.61 113.55 117.41 3gfb h SER 305 Ca 0.60 0.00 -0.11 0.00 -1.23 0.00 0.00 61.79 61.04 3gfb h SER 305 Cb 1.26 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 63.22 3gfb h SER 305 CO -0.73 0.82 -0.24 -0.07 -0.53 0.00 0.00 176.83 176.08 3gfb h LEU 306 N 0.00 0.75 0.05 2.23 4.07 -1.23 -1.71 115.31 119.47 3gfb h LEU 306 Ca -0.23 -0.44 0.00 0.00 0.08 0.00 0.00 57.88 57.29 3gfb h LEU 306 Cb 1.82 -0.21 -0.01 0.00 1.08 0.00 0.00 40.66 43.35 3gfb h LEU 306 CO 0.07 1.03 -0.10 0.40 -1.08 0.00 0.00 178.44 178.76 3gfb h ILE 307 N 0.47 0.00 0.00 1.22 2.04 -1.18 -2.98 117.51 117.08 3gfb h ILE 307 Ca 0.06 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.92 3gfb h ILE 307 Cb 0.79 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 36.87 3gfb h ILE 307 CO 0.06 0.00 0.33 0.00 0.00 0.00 0.00 178.15 178.55 3gfb n GLN 308 N -2.99 0.08 0.02 2.37 1.13 -0.61 -1.09 117.38 116.30 3gfb n GLN 308 Ca -0.02 0.54 0.12 0.00 -1.94 0.00 0.00 57.00 55.70 3gfb n GLN 308 Cb 0.09 -2.08 0.22 0.00 0.11 0.00 0.00 30.24 28.58 3gfb n GLN 308 CO 0.00 0.00 0.00 -1.13 -1.44 0.00 0.00 177.06 174.49 3gfb n SER 309 N -1.96 0.55 0.00 1.08 3.41 -0.64 -4.96 113.62 111.11 3gfb n SER 309 Ca -0.01 -0.09 0.00 0.00 -0.26 0.00 0.00 58.87 58.51 3gfb n SER 309 Cb 0.35 0.23 0.00 0.00 -0.26 0.00 0.00 64.21 64.53 3gfb n SER 309 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3gfb n GLY 310 N 1.44 1.04 0.16 5.00 0.00 -0.25 -4.90 105.19 107.69 3gfb n GLY 310 Ca 0.05 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.18 3gfb n GLY 310 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3gfb h LYS 311 N 2.10 0.00 -6.24 1.61 1.57 -1.78 -3.45 116.57 110.38 3gfb h LYS 311 Ca 0.00 0.00 -0.57 0.00 -1.87 0.00 0.00 60.65 58.21 3gfb h LYS 311 Cb 0.00 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.26 3gfb h LYS 311 CO 0.00 0.00 0.90 -0.51 -0.57 0.00 0.00 179.45 179.27 3gfb s LEU 312 N -5.61 4.02 -1.23 2.94 1.43 -1.25 -4.45 118.68 114.52 3gfb s LEU 312 Ca 0.05 1.36 -0.11 0.00 -1.03 0.00 0.00 54.13 54.39 3gfb s LEU 312 Cb 0.08 -3.54 0.18 0.00 0.03 0.00 0.00 46.19 42.94 3gfb s LEU 312 CO 0.70 -0.89 1.62 -3.20 0.23 0.00 0.00 176.35 174.81 3gfb n ASN 313 N 6.99 5.21 0.09 2.29 5.15 -1.26 -4.73 115.26 129.00 3gfb n ASN 313 Ca 0.14 -3.05 -0.02 0.00 -0.60 0.00 0.00 54.58 51.05 3gfb n ASN 313 Cb 0.46 -1.52 -0.05 0.00 -0.53 0.00 0.00 39.78 38.15 3gfb n ASN 313 CO 0.00 0.00 0.00 -0.07 1.40 0.00 0.00 177.26 178.59 3gfb h LEU 314 N 8.72 0.00 -0.27 1.20 3.38 -1.94 -3.39 115.31 123.02 3gfb h LEU 314 Ca 0.34 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.31 3gfb h LEU 314 Cb 0.76 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.50 3gfb h LEU 314 CO 1.40 0.71 0.16 0.44 0.09 0.00 0.00 178.44 181.24 3gfb h ASP 315 N 0.00 0.33 0.32 -0.43 3.32 -1.93 -1.84 116.42 116.20 3gfb h ASP 315 Ca -0.03 -0.06 -0.00 0.00 0.02 0.00 0.00 57.03 56.95 3gfb h ASP 315 Cb 1.57 -0.08 -0.00 0.00 0.22 0.00 0.00 39.33 41.04 3gfb h ASP 315 CO 0.09 0.30 -0.01 1.55 -1.72 0.00 0.00 179.24 179.45 3gfb h PRO 316 N 0.34 0.00 -0.07 3.56 0.14 -1.94 -3.04 132.00 130.99 3gfb h PRO 316 Ca 0.10 0.00 -0.24 0.00 0.14 0.00 0.00 66.00 66.00 3gfb h PRO 316 Cb 0.03 0.00 0.01 0.00 0.14 0.00 0.00 31.00 31.19 3gfb h PRO 316 CO -0.02 0.01 -0.90 0.82 0.14 0.00 0.00 178.00 178.05 3gfb h ILE 317 N 0.00 1.30 -2.24 -3.56 2.04 -1.55 -3.40 117.51 110.10 3gfb h ILE 317 Ca -0.00 -2.15 -0.52 0.00 1.00 0.00 0.00 64.86 63.19 3gfb h ILE 317 Cb 0.17 2.20 -0.06 0.00 -0.74 0.00 0.00 36.82 38.40 3gfb h ILE 317 CO 0.00 0.67 1.19 -0.63 0.00 0.00 0.00 178.15 179.38 3gfb s ILE 318 N -3.51 3.57 -0.14 -0.67 1.01 -1.06 0.88 121.20 121.28 3gfb s ILE 318 Ca -0.09 0.34 0.16 0.00 0.00 0.00 0.00 60.65 61.07 3gfb s ILE 318 Cb 0.08 -4.45 -0.24 0.00 0.01 0.00 0.00 42.46 37.86 3gfb s ILE 318 CO 0.90 -1.39 0.33 0.35 0.00 0.00 0.00 174.94 175.13 3gfb n THR 319 N 6.78 1.39 -4.39 2.92 -2.24 0.68 -4.86 114.28 114.55 3gfb n THR 319 Ca 0.11 -0.81 -0.23 0.00 -2.27 0.00 0.00 64.05 60.85 3gfb n THR 319 Cb 0.50 -0.64 -0.16 0.00 -2.10 0.00 0.00 70.33 67.93 3gfb n THR 319 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 3gfb s HIS 320 N -2.60 1.16 -0.06 4.78 3.76 -1.22 -4.98 115.29 116.15 3gfb s HIS 320 Ca -0.08 -0.41 0.00 0.00 -0.15 0.00 0.00 55.06 54.43 3gfb s HIS 320 Cb 0.07 -0.91 0.02 0.00 1.11 0.00 0.00 32.58 32.88 3gfb s HIS 320 CO 0.83 -0.25 -0.03 0.15 -0.85 0.00 0.00 174.74 174.59 3gfb s LYS 321 N 0.80 0.80 0.01 1.40 1.02 -1.26 -1.43 119.74 121.07 3gfb s LYS 321 Ca -0.13 -0.05 0.05 0.00 0.02 0.00 0.00 55.97 55.86 3gfb s LYS 321 Cb -0.15 -0.91 -0.02 0.00 -0.52 0.00 0.00 37.83 36.23 3gfb s LYS 321 CO 0.02 -0.15 -0.16 0.71 -0.92 0.00 0.00 175.35 174.84 3gfb s TYR 322 N 1.25 1.44 -0.20 3.18 2.02 0.61 -4.98 117.35 120.68 3gfb s TYR 322 Ca -0.06 -0.30 -0.08 0.00 -0.37 0.00 0.00 57.07 56.26 3gfb s TYR 322 Cb -0.14 -0.90 -0.04 0.00 -0.40 0.00 0.00 41.96 40.48 3gfb s TYR 322 CO -0.02 0.01 0.08 0.15 -1.57 0.00 0.00 175.55 174.20 3gfb s LYS 323 N -0.65 3.98 0.70 -0.62 1.02 -1.26 -0.00 119.74 122.90 3gfb s LYS 323 Ca 0.05 -0.33 0.00 0.00 0.02 0.00 0.00 55.97 55.71 3gfb s LYS 323 Cb -0.07 -3.28 0.00 0.00 -0.52 0.00 0.00 37.83 33.96 3gfb s LYS 323 CO 0.00 0.21 0.00 0.41 -0.92 0.00 0.00 175.35 175.05 3gfb n GLY 324 N 3.74 -1.14 0.85 -3.33 0.00 -0.18 -4.52 105.19 100.61 3gfb n GLY 324 Ca -0.16 -0.81 0.12 0.00 0.00 0.00 0.00 46.02 45.17 3gfb n GLY 324 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3gfb n PHE 325 N -2.65 0.05 -0.35 1.61 3.72 -1.26 -4.65 117.46 113.94 3gfb n PHE 325 Ca 0.00 -0.03 0.13 0.00 -0.05 0.00 0.00 57.45 57.51 3gfb n PHE 325 Cb 0.32 0.00 0.33 0.00 -0.94 0.00 0.00 39.48 39.18 3gfb n PHE 325 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 176.76 176.27 3gfb h ASP 326 N 4.05 0.78 -0.73 4.37 5.19 -2.00 0.74 116.42 128.82 3gfb h ASP 326 Ca 0.00 0.09 -0.33 0.00 -0.62 0.00 0.00 57.03 56.17 3gfb h ASP 326 Cb 0.86 -0.06 -0.19 0.00 0.18 0.00 0.00 39.33 40.12 3gfb h ASP 326 CO 0.00 0.30 0.41 0.29 -3.12 0.00 0.00 179.24 177.12 3gfb n LYS 327 N -4.73 2.46 0.24 3.56 5.02 -1.26 -4.61 118.16 118.84 3gfb n LYS 327 Ca 0.23 -2.44 0.16 0.00 -2.02 0.00 0.00 58.31 54.24 3gfb n LYS 327 Cb 0.56 -1.98 0.82 0.00 -0.02 0.00 0.00 35.03 34.40 3gfb n LYS 327 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 3gfb h PHE 328 N 1.32 0.00 0.17 2.13 -0.00 -1.18 -1.79 116.94 117.59 3gfb h PHE 328 Ca 0.40 0.00 -0.32 0.00 -0.00 0.00 0.00 57.97 58.06 3gfb h PHE 328 Cb 2.33 0.00 0.01 0.00 -0.00 0.00 0.00 35.95 38.29 3gfb h PHE 328 CO 1.20 0.00 -1.55 0.93 -0.00 0.00 0.00 178.31 178.88 3gfb h GLU 329 N 0.00 0.37 -0.58 6.09 5.08 -1.84 -3.30 114.58 120.39 3gfb h GLU 329 Ca 0.00 -0.63 0.10 0.00 -1.00 0.00 0.00 59.36 57.84 3gfb h GLU 329 Cb 0.14 0.23 -0.08 0.00 0.50 0.00 0.00 28.75 29.54 3gfb h GLU 329 CO 0.00 1.30 0.14 1.49 -1.00 0.00 0.00 179.01 180.94 3gfb h GLU 330 N -0.04 0.27 -0.35 2.33 4.81 -1.80 -2.36 114.58 117.45 3gfb h GLU 330 Ca -0.31 -0.02 0.07 0.00 -0.13 0.00 0.00 59.36 58.97 3gfb h GLU 330 Cb 1.98 -0.06 -0.09 0.00 0.63 0.00 0.00 28.75 31.21 3gfb h GLU 330 CO 0.16 0.18 -0.41 0.00 -0.73 0.00 0.00 179.01 178.21 3gfb h ALA 331 N 1.45 -0.42 -0.18 2.92 0.00 -1.48 -1.03 119.26 120.52 3gfb h ALA 331 Ca 0.30 0.06 -0.05 0.00 0.00 0.00 0.00 54.91 55.21 3gfb h ALA 331 Cb 0.43 0.84 -0.00 0.00 0.00 0.00 0.00 17.79 19.05 3gfb h ALA 331 CO -0.37 -0.85 -0.10 0.74 0.00 0.00 0.00 179.25 178.66 3gfb h PHE 332 N -0.35 0.45 -0.72 0.00 0.04 -1.63 -2.65 116.94 112.09 3gfb h PHE 332 Ca 0.13 -0.12 0.05 0.00 2.80 0.00 0.00 57.97 60.83 3gfb h PHE 332 Cb 0.58 -0.10 -0.05 0.00 2.20 0.00 0.00 35.95 38.58 3gfb h PHE 332 CO -0.58 0.70 0.43 1.49 -0.60 0.00 0.00 178.31 179.76 3gfb h GLU 333 N 0.07 0.79 0.00 1.51 4.57 -1.45 -0.51 114.58 119.56 3gfb h GLU 333 Ca 0.04 -0.05 -0.01 0.00 -1.18 0.00 0.00 59.36 58.16 3gfb h GLU 333 Cb 0.59 -0.18 -0.00 0.00 -0.16 0.00 0.00 28.75 29.00 3gfb h GLU 333 CO 0.03 0.53 -0.04 -0.07 -1.18 0.00 0.00 179.01 178.27 3gfb h LEU 334 N 0.82 0.00 0.06 1.64 3.38 -1.11 -2.39 115.31 117.72 3gfb h LEU 334 Ca 0.31 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.27 3gfb h LEU 334 Cb 0.11 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.86 3gfb h LEU 334 CO -0.15 0.04 -0.03 -0.03 0.09 0.00 0.00 178.44 178.36 3gfb h MET 335 N 0.00 -0.08 -0.66 1.13 4.05 -1.01 0.91 114.93 119.27 3gfb h MET 335 Ca -0.00 0.01 0.06 0.00 -0.28 0.00 0.00 59.70 59.48 3gfb h MET 335 Cb 0.08 0.02 -0.08 0.00 -0.80 0.00 0.00 31.60 30.82 3gfb h MET 335 CO 0.01 0.29 -0.40 0.00 0.23 0.00 0.00 176.91 177.04 3gfb h ARG 336 N -0.98 -0.01 0.00 0.39 3.08 -1.18 -0.52 114.38 115.16 3gfb h ARG 336 Ca -0.01 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.04 3gfb h ARG 336 Cb 0.41 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.46 3gfb h ARG 336 CO 0.01 -0.01 0.26 0.00 -1.07 0.00 0.00 179.97 179.17 3gfb n ALA 337 N -3.16 0.46 -2.70 0.04 0.00 -0.90 -4.76 120.51 109.50 3gfb n ALA 337 Ca 0.01 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.35 3gfb n ALA 337 Cb 0.18 -0.45 0.02 0.00 0.00 0.00 0.00 19.45 19.20 3gfb n ALA 337 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3gfb n GLY 338 N -1.21 0.18 0.41 0.00 0.00 -0.20 -4.95 105.19 99.43 3gfb n GLY 338 Ca 0.00 -0.34 0.04 0.00 0.00 0.00 0.00 46.02 45.72 3gfb n GLY 338 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3gfb n LYS 339 N -2.29 1.68 -4.38 1.61 5.02 0.31 -4.85 118.16 115.26 3gfb n LYS 339 Ca -0.04 -1.50 -0.29 0.00 -2.02 0.00 0.00 58.31 54.46 3gfb n LYS 339 Cb 0.55 -1.18 -0.13 0.00 -0.02 0.00 0.00 35.03 34.25 3gfb n LYS 339 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 3gfb s THR 340 N -0.86 2.35 0.00 -0.18 -4.23 -1.22 -4.94 115.64 106.56 3gfb s THR 340 Ca 0.14 -1.76 0.00 0.00 -1.18 0.00 0.00 61.69 58.89 3gfb s THR 340 Cb 0.08 -2.05 0.00 0.00 1.34 0.00 0.00 72.50 71.87 3gfb s THR 340 CO 0.11 0.07 0.00 0.61 -0.54 0.00 0.00 174.62 174.87 3gfb n GLY 341 N 0.82 0.03 3.87 3.99 0.00 -1.26 -4.70 105.19 107.94 3gfb n GLY 341 Ca -0.17 -0.10 -0.33 0.00 0.00 0.00 0.00 46.02 45.42 3gfb n GLY 341 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3gfb s LYS 342 N 0.00 3.84 -0.18 1.61 -0.14 0.25 -4.69 119.74 120.43 3gfb s LYS 342 Ca 0.00 0.30 -0.02 0.00 -1.36 0.00 0.00 55.97 54.89 3gfb s LYS 342 Cb 0.00 -2.81 -0.01 0.00 -1.68 0.00 0.00 37.83 33.34 3gfb s LYS 342 CO 0.00 0.42 -0.09 0.08 -0.76 0.00 0.00 175.35 174.99 3gfb s VAL 343 N -1.63 3.08 -0.10 3.17 1.01 -1.26 -0.23 120.40 124.45 3gfb s VAL 343 Ca 0.42 -0.61 0.01 0.00 0.00 0.00 0.00 61.98 61.79 3gfb s VAL 343 Cb -0.13 -2.36 -0.02 0.00 0.00 0.00 0.00 36.38 33.87 3gfb s VAL 343 CO 0.20 0.47 -0.10 -0.69 0.00 0.00 0.00 175.10 174.98 3gfb s VAL 344 N 1.08 3.37 -0.12 2.92 1.01 -0.52 -2.53 120.40 125.61 3gfb s VAL 344 Ca 0.00 -0.58 -0.10 0.00 0.00 0.00 0.00 61.98 61.31 3gfb s VAL 344 Cb -0.15 -2.39 -0.05 0.00 0.00 0.00 0.00 36.38 33.80 3gfb s VAL 344 CO -0.02 0.56 0.20 -0.36 0.00 0.00 0.00 175.10 175.48 3gfb s PHE 345 N -0.25 3.57 -0.54 5.22 0.08 -0.08 -0.28 117.98 125.69 3gfb s PHE 345 Ca 0.02 0.57 -0.00 0.00 0.12 0.00 0.00 56.93 57.65 3gfb s PHE 345 Cb -0.13 -2.08 0.14 0.00 -0.57 0.00 0.00 43.02 40.38 3gfb s PHE 345 CO 0.03 0.58 0.32 -0.06 -0.10 0.00 0.00 175.22 176.00 3gfb s PHE 346 N -0.61 3.39 0.42 0.36 0.40 1.00 -1.66 117.98 121.28 3gfb s PHE 346 Ca 0.15 -2.84 0.10 0.00 -0.60 0.00 0.00 56.93 53.74 3gfb s PHE 346 Cb -0.13 -3.07 0.91 0.00 0.51 0.00 0.00 43.02 41.25 3gfb s PHE 346 CO 0.04 -0.84 2.01 -1.35 0.70 0.00 0.00 175.22 175.78 3gfb h PRO 347 N 7.04 0.27 -1.60 0.24 0.11 -1.74 -0.36 132.00 135.96 3gfb h PRO 347 Ca -0.05 -0.04 -0.68 0.00 0.11 0.00 0.00 66.00 65.34 3gfb h PRO 347 Cb 0.95 -0.05 -0.26 0.00 0.11 0.00 0.00 31.00 31.75 3gfb h PRO 347 CO 0.69 0.29 0.90 0.72 -0.21 0.00 0.00 178.00 180.38 3gfb n HIS 348 N -4.39 2.86 0.00 0.65 8.25 -1.26 -4.25 115.22 117.08 3gfb n HIS 348 Ca -0.00 -2.53 0.00 0.00 -0.26 0.00 0.00 57.72 54.93 3gfb n HIS 348 Cb 0.17 -1.29 0.00 0.00 1.12 0.00 0.00 29.99 29.99 3gfb n HIS 348 CO 0.00 0.00 0.00 0.36 0.64 0.00 0.00 176.34 177.34