#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ifg h LEU 7 N 0.00 1.03 -2.04 2.45 5.85 -1.93 -2.21 115.31 118.46 1ifg h LEU 7 Ca 0.00 -0.25 0.00 0.00 0.84 0.00 0.00 57.88 58.47 1ifg h LEU 7 Cb 0.00 -0.27 0.00 0.00 0.37 0.00 0.00 40.66 40.76 1ifg h LEU 7 CO 0.00 1.03 0.07 -0.33 -0.34 0.00 0.00 178.44 178.88 1ifg h GLU 8 N 1.00 0.00 0.00 1.25 3.07 -1.93 0.17 114.58 118.15 1ifg h GLU 8 Ca 0.20 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.06 1ifg h GLU 8 Cb 0.45 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.36 1ifg h GLU 8 CO 0.01 0.00 0.00 -0.22 -1.40 0.00 0.00 179.01 177.40 1ifg h LYS 9 N 0.00 0.00 0.00 2.33 3.64 -1.86 -3.29 116.57 117.39 1ifg h LYS 9 Ca 0.00 0.00 -0.33 0.00 -1.27 0.00 0.00 60.65 59.05 1ifg h LYS 9 Cb 0.15 0.00 -0.05 0.00 -0.41 0.00 0.00 32.23 31.92 1ifg h LYS 9 CO 0.00 0.00 -1.90 -0.89 -2.27 0.00 0.00 179.45 174.39 1ifg n ILE 10 N -3.07 1.52 -3.47 2.00 5.41 0.57 -5.05 119.36 117.28 1ifg n ILE 10 Ca 0.01 -0.20 -0.14 0.00 1.00 0.00 0.00 62.75 63.43 1ifg n ILE 10 Cb 0.35 -2.00 -0.04 0.00 -0.71 0.00 0.00 39.64 37.25 1ifg n ILE 10 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1ifg s ALA 11 N -2.50 -1.70 -1.31 -1.39 0.00 -1.07 -5.05 121.76 108.75 1ifg s ALA 11 Ca -0.34 0.90 -0.13 0.00 0.00 0.00 0.00 51.96 52.39 1ifg s ALA 11 Cb 0.10 0.44 -0.05 0.00 0.00 0.00 0.00 23.12 23.62 1ifg s ALA 11 CO 0.51 -0.59 2.37 -0.35 0.00 0.00 0.00 175.76 177.69 1ifg n PRO 12 N 0.15 2.74 -1.92 0.00 -0.04 -1.26 -3.91 135.00 130.77 1ifg n PRO 12 Ca -0.16 -2.19 -0.39 0.00 -0.04 0.00 0.00 63.50 60.72 1ifg n PRO 12 Cb 0.61 -2.96 0.01 0.00 -0.04 0.00 0.00 33.50 31.13 1ifg n PRO 12 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 1ifg s TYR 13 N 3.26 2.56 0.73 0.54 1.51 -1.26 -4.93 117.35 119.76 1ifg s TYR 13 Ca 0.54 1.36 -0.16 0.00 -1.01 0.00 0.00 57.07 57.81 1ifg s TYR 13 Cb 0.15 -3.76 0.03 0.00 -0.11 0.00 0.00 41.96 38.27 1ifg s TYR 13 CO -0.04 -2.53 1.19 -2.30 -1.11 0.00 0.00 175.55 170.77 1ifg n PRO 14 N -0.36 0.61 -2.60 -1.71 -0.02 -1.26 -4.95 135.00 124.72 1ifg n PRO 14 Ca 0.06 0.27 -0.32 0.00 -2.02 0.00 0.00 63.50 61.50 1ifg n PRO 14 Cb 0.44 -2.43 -0.05 0.00 -0.02 0.00 0.00 33.50 31.44 1ifg n PRO 14 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 1ifg s GLN 15 N -3.67 4.02 0.29 -0.52 -1.52 -1.26 -4.99 119.66 112.02 1ifg s GLN 15 Ca 0.77 0.95 -0.29 0.00 -1.95 0.00 0.00 55.36 54.84 1ifg s GLN 15 Cb -0.34 -2.18 -0.10 0.00 -0.22 0.00 0.00 33.01 30.17 1ifg s GLN 15 CO 0.46 -0.16 1.30 0.00 -0.25 0.00 0.00 175.29 176.65 1ifg s ALA 16 N -2.44 3.51 1.38 6.09 0.00 -1.26 -5.01 121.76 124.03 1ifg s ALA 16 Ca 0.59 1.21 -0.23 0.00 0.00 0.00 0.00 51.96 53.53 1ifg s ALA 16 Cb -0.10 -3.47 0.35 0.00 0.00 0.00 0.00 23.12 19.90 1ifg s ALA 16 CO 0.25 -0.59 0.97 0.39 0.00 0.00 0.00 175.76 176.78 1ifg n GLU 17 N 1.33 -4.10 -2.14 0.00 1.02 -1.26 -4.84 120.64 110.64 1ifg n GLU 17 Ca 0.02 -1.59 -0.41 0.00 -0.02 0.00 0.00 57.16 55.16 1ifg n GLU 17 Cb 0.42 -1.77 -0.02 0.00 -0.02 0.00 0.00 31.44 30.04 1ifg n GLU 17 CO 0.00 0.00 0.00 -1.59 1.18 0.00 0.00 177.13 176.72 1ifg s LYS 18 N -5.26 4.36 0.00 3.49 0.00 -1.26 -2.28 119.74 118.79 1ifg s LYS 18 Ca 0.69 2.17 0.00 0.00 0.00 0.00 0.00 55.97 58.83 1ifg s LYS 18 Cb -0.10 -3.11 0.00 0.00 0.00 0.00 0.00 37.83 34.62 1ifg s LYS 18 CO 0.55 -0.22 0.00 0.41 0.00 0.00 0.00 175.35 176.09 1ifg n GLY 19 N 1.42 0.38 3.44 0.59 0.00 -1.26 -5.01 105.19 104.76 1ifg n GLY 19 Ca 0.03 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.83 1ifg n GLY 19 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1ifg s MET 20 N -0.52 1.59 -0.00 1.61 -1.94 -0.97 -0.20 119.30 118.87 1ifg s MET 20 Ca 0.00 -1.84 -0.05 0.00 -1.71 0.00 0.00 55.69 52.09 1ifg s MET 20 Cb 0.00 -1.05 -0.00 0.00 2.01 0.00 0.00 34.83 35.79 1ifg s MET 20 CO 0.00 -0.05 0.10 -1.59 -0.01 0.00 0.00 175.02 173.47 1ifg s LYS 21 N -3.79 0.39 -0.21 2.03 -2.85 0.28 -4.64 119.74 110.95 1ifg s LYS 21 Ca 0.32 -0.34 -0.16 0.00 -1.00 0.00 0.00 55.97 54.79 1ifg s LYS 21 Cb 0.06 0.16 -0.04 0.00 -2.06 0.00 0.00 37.83 35.95 1ifg s LYS 21 CO 0.13 -0.08 0.41 0.50 0.10 0.00 0.00 175.35 176.41 1ifg s ARG 22 N -1.13 4.15 -0.08 1.78 3.52 -1.26 -2.13 118.95 123.80 1ifg s ARG 22 Ca -0.12 0.21 0.04 0.00 -0.13 0.00 0.00 55.73 55.73 1ifg s ARG 22 Cb -0.07 -3.56 -0.01 0.00 -1.56 0.00 0.00 34.95 29.75 1ifg s ARG 22 CO 0.01 -0.09 -0.21 -0.65 -0.81 0.00 0.00 175.30 173.55 1ifg s GLN 23 N 1.48 2.79 -0.02 5.12 -0.21 0.09 -2.29 119.66 126.62 1ifg s GLN 23 Ca 0.19 -0.83 0.07 0.00 0.02 0.00 0.00 55.36 54.81 1ifg s GLN 23 Cb -0.15 -2.31 -0.02 0.00 1.00 0.00 0.00 33.01 31.54 1ifg s GLN 23 CO 0.08 0.35 -0.23 0.08 -2.12 0.00 0.00 175.29 173.46 1ifg s VAL 24 N -0.07 1.80 -0.28 1.09 1.01 0.44 -0.45 120.40 123.94 1ifg s VAL 24 Ca -0.05 -0.96 0.03 0.00 0.00 0.00 0.00 61.98 60.99 1ifg s VAL 24 Cb -0.14 -1.50 0.07 0.00 0.00 0.00 0.00 36.38 34.80 1ifg s VAL 24 CO 0.04 0.51 -0.08 -0.63 0.00 0.00 0.00 175.10 174.95 1ifg s ILE 25 N -0.46 2.25 -0.42 2.22 1.01 0.43 -0.57 121.20 125.65 1ifg s ILE 25 Ca 0.07 -1.73 -0.14 0.00 0.00 0.00 0.00 60.65 58.85 1ifg s ILE 25 Cb -0.09 -2.38 0.04 0.00 0.01 0.00 0.00 42.46 40.04 1ifg s ILE 25 CO -0.00 -0.12 0.30 -1.58 0.00 0.00 0.00 174.94 173.53 1ifg s GLN 26 N 1.08 2.91 0.49 2.79 2.00 -1.26 -1.16 119.66 126.51 1ifg s GLN 26 Ca -0.06 -1.14 -0.19 0.00 -2.00 0.00 0.00 55.36 51.98 1ifg s GLN 26 Cb -0.20 -3.94 -0.08 0.00 0.80 0.00 0.00 33.01 29.59 1ifg s GLN 26 CO -0.05 -0.81 1.00 -0.51 -0.50 0.00 0.00 175.29 174.41 1ifg s LEU 27 N 1.62 3.76 0.07 3.68 1.43 -1.26 -5.05 118.68 122.93 1ifg s LEU 27 Ca 0.04 1.73 -0.13 0.00 -1.03 0.00 0.00 54.13 54.74 1ifg s LEU 27 Cb -0.20 -4.54 -0.06 0.00 0.03 0.00 0.00 46.19 41.42 1ifg s LEU 27 CO 0.08 -0.65 0.45 0.42 0.23 0.00 0.00 176.35 176.88 1ifg s THR 28 N -2.30 4.99 0.14 5.49 -4.23 -1.26 -4.70 115.64 113.78 1ifg s THR 28 Ca 0.63 0.71 -0.31 0.00 -1.18 0.00 0.00 61.69 61.53 1ifg s THR 28 Cb -0.12 -3.70 -0.09 0.00 1.34 0.00 0.00 72.50 69.92 1ifg s THR 28 CO 0.23 0.38 1.53 -2.16 -0.54 0.00 0.00 174.62 174.07 1ifg s PRO 29 N -1.62 4.24 0.35 3.99 0.04 -1.26 -4.79 135.00 135.96 1ifg s PRO 29 Ca 0.31 2.28 0.09 0.00 0.04 0.00 0.00 61.00 63.72 1ifg s PRO 29 Cb -0.15 -3.24 -0.07 0.00 0.04 0.00 0.00 34.50 31.08 1ifg s PRO 29 CO 0.17 -0.58 -0.07 -0.65 0.04 0.00 0.00 177.00 175.91 1ifg s GLN 30 N 1.33 1.83 0.09 4.56 -1.52 -1.26 -5.08 119.66 119.61 1ifg s GLN 30 Ca 0.69 -1.96 -0.30 0.00 -1.95 0.00 0.00 55.36 51.84 1ifg s GLN 30 Cb -0.41 -1.67 -0.15 0.00 -0.22 0.00 0.00 33.01 30.56 1ifg s GLN 30 CO 0.31 0.10 1.64 0.93 -0.25 0.00 0.00 175.29 178.02 1ifg h GLU 31 N 1.99 -0.64 -2.96 2.91 4.39 -2.06 -3.36 114.58 114.85 1ifg h GLU 31 Ca -0.42 0.04 -0.62 0.00 0.34 0.00 0.00 59.36 58.70 1ifg h GLU 31 Cb 1.25 0.15 -0.42 0.00 -0.10 0.00 0.00 28.75 29.62 1ifg h GLU 31 CO 0.72 -0.43 -0.58 -3.47 -1.16 0.00 0.00 179.01 174.10 1ifg n ASP 32 N -5.41 3.10 0.27 1.42 2.03 -1.26 -4.90 116.55 111.80 1ifg n ASP 32 Ca -0.10 -3.24 0.18 0.00 0.52 0.00 0.00 54.79 52.14 1ifg n ASP 32 Cb 0.31 -0.75 0.78 0.00 -0.72 0.00 0.00 41.12 40.75 1ifg n ASP 32 CO 0.00 0.00 0.00 -0.33 -1.92 0.00 0.00 177.20 174.95 1ifg h GLU 33 N 5.22 0.00 0.00 -0.67 5.08 -1.89 -2.67 114.58 119.65 1ifg h GLU 33 Ca 0.16 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.52 1ifg h GLU 33 Cb 0.74 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.99 1ifg h GLU 33 CO 0.73 0.00 0.00 1.03 -1.00 0.00 0.00 179.01 179.77 1ifg h SER 34 N 0.00 0.00 -0.15 1.42 0.87 -1.91 -1.98 113.55 111.80 1ifg h SER 34 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 1ifg h SER 34 Cb 0.36 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.32 1ifg h SER 34 CO 0.00 0.00 0.00 0.35 -0.53 0.00 0.00 176.83 176.65 1ifg n THR 35 N -2.72 0.20 -4.10 2.23 -2.24 -1.01 -4.97 114.28 101.67 1ifg n THR 35 Ca 0.00 -0.60 -0.24 0.00 -2.27 0.00 0.00 64.05 60.95 1ifg n THR 35 Cb 0.22 1.25 -0.05 0.00 -2.10 0.00 0.00 70.33 69.66 1ifg n THR 35 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1ifg s LEU 36 N -1.62 3.81 0.04 3.22 1.02 -0.74 -1.94 118.68 122.47 1ifg s LEU 36 Ca 0.29 -0.20 -0.04 0.00 0.02 0.00 0.00 54.13 54.20 1ifg s LEU 36 Cb 0.19 -2.38 -0.02 0.00 0.02 0.00 0.00 46.19 44.00 1ifg s LEU 36 CO 0.27 0.01 0.07 -0.54 0.02 0.00 0.00 176.35 176.18 1ifg s LYS 37 N -3.51 0.59 -0.20 1.70 -0.14 -0.36 -3.12 119.74 114.69 1ifg s LYS 37 Ca 0.32 -0.85 0.01 0.00 -1.36 0.00 0.00 55.97 54.09 1ifg s LYS 37 Cb -0.09 0.22 0.03 0.00 -1.68 0.00 0.00 37.83 36.32 1ifg s LYS 37 CO 0.24 -0.14 -0.16 0.08 -0.76 0.00 0.00 175.35 174.61 1ifg s VAL 38 N -2.87 2.01 -0.21 3.17 1.01 0.29 -0.89 120.40 122.90 1ifg s VAL 38 Ca -0.03 -1.09 -0.16 0.00 0.00 0.00 0.00 61.98 60.70 1ifg s VAL 38 Cb 0.00 -1.92 -0.04 0.00 0.00 0.00 0.00 36.38 34.43 1ifg s VAL 38 CO -0.06 0.36 0.43 -0.70 0.00 0.00 0.00 175.10 175.14 1ifg s GLU 39 N 1.27 4.15 0.03 2.72 2.12 -0.57 -0.83 118.70 127.59 1ifg s GLU 39 Ca 0.01 0.24 -0.26 0.00 0.36 0.00 0.00 54.97 55.33 1ifg s GLU 39 Cb -0.15 -3.56 -0.05 0.00 0.26 0.00 0.00 34.13 30.63 1ifg s GLU 39 CO -0.10 -0.11 0.79 -0.51 -0.54 0.00 0.00 175.26 174.78 1ifg s LEU 40 N 1.54 4.43 -0.41 2.70 1.43 -0.20 -2.53 118.68 125.64 1ifg s LEU 40 Ca 0.20 1.46 -0.00 0.00 -1.03 0.00 0.00 54.13 54.76 1ifg s LEU 40 Cb -0.15 -3.27 0.11 0.00 0.03 0.00 0.00 46.19 42.91 1ifg s LEU 40 CO 0.09 -0.03 0.18 -0.76 0.23 0.00 0.00 176.35 176.06 1ifg s LEU 41 N 0.12 5.05 -0.27 1.79 1.43 0.08 -4.95 118.68 121.94 1ifg s LEU 41 Ca 0.40 -2.19 -0.08 0.00 -1.03 0.00 0.00 54.13 51.24 1ifg s LEU 41 Cb -0.20 -1.76 -0.02 0.00 0.03 0.00 0.00 46.19 44.24 1ifg s LEU 41 CO 0.23 -0.46 0.09 -0.63 0.23 0.00 0.00 176.35 175.81 1ifg s ILE 42 N 0.90 4.38 0.00 -0.59 1.01 -1.26 -0.50 121.20 125.15 1ifg s ILE 42 Ca 0.10 -0.25 0.00 0.00 0.00 0.00 0.00 60.65 60.50 1ifg s ILE 42 Cb -0.22 -3.11 0.00 0.00 0.01 0.00 0.00 42.46 39.15 1ifg s ILE 42 CO -0.05 0.26 0.00 0.61 0.00 0.00 0.00 174.94 175.76 1ifg n GLY 43 N 4.94 1.23 3.03 6.18 0.00 -0.65 -1.00 105.19 118.92 1ifg n GLY 43 Ca -0.15 -0.57 -0.14 0.00 0.00 0.00 0.00 46.02 45.16 1ifg n GLY 43 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1ifg s GLN 44 N 1.16 0.49 -0.42 1.61 -0.21 0.27 -0.65 119.66 121.91 1ifg s GLN 44 Ca 0.00 -0.59 -0.26 0.00 0.02 0.00 0.00 55.36 54.53 1ifg s GLN 44 Cb 0.00 -0.32 0.02 0.00 1.00 0.00 0.00 33.01 33.72 1ifg s GLN 44 CO 0.00 0.07 0.94 0.99 -2.12 0.00 0.00 175.29 175.16 1ifg s THR 45 N -1.01 4.51 0.06 -0.19 2.01 -1.26 -0.75 115.64 119.01 1ifg s THR 45 Ca -0.07 0.98 0.05 0.00 0.31 0.00 0.00 61.69 62.96 1ifg s THR 45 Cb -0.08 -4.40 -0.03 0.00 0.01 0.00 0.00 72.50 68.01 1ifg s THR 45 CO 0.00 -0.71 -0.15 -0.76 -0.69 0.00 0.00 174.62 172.32 1ifg s LEU 46 N 3.67 2.25 -0.29 4.42 1.43 -0.49 -4.91 118.68 124.76 1ifg s LEU 46 Ca 0.38 -0.57 -0.25 0.00 -1.03 0.00 0.00 54.13 52.66 1ifg s LEU 46 Cb -0.11 -0.57 0.00 0.00 0.03 0.00 0.00 46.19 45.55 1ifg s LEU 46 CO 0.23 -0.03 0.86 -0.70 0.23 0.00 0.00 176.35 176.94 1ifg s GLU 47 N -1.57 4.05 0.15 1.70 2.12 -1.26 -0.69 118.70 123.20 1ifg s GLU 47 Ca -0.00 0.80 0.01 0.00 0.36 0.00 0.00 54.97 56.13 1ifg s GLU 47 Cb -0.09 -3.70 -0.04 0.00 0.26 0.00 0.00 34.13 30.55 1ifg s GLU 47 CO 0.02 -0.67 0.02 0.14 -0.54 0.00 0.00 175.26 174.24 1ifg s VAL 48 N 3.05 0.42 0.00 3.70 -7.23 0.11 -4.84 120.40 115.61 1ifg s VAL 48 Ca 0.36 -1.94 0.00 0.00 -1.81 0.00 0.00 61.98 58.58 1ifg s VAL 48 Cb -0.14 -2.07 0.00 0.00 0.56 0.00 0.00 36.38 34.73 1ifg s VAL 48 CO 0.11 -0.49 0.00 -0.90 -0.31 0.00 0.00 175.10 173.52 1ifg n ASP 49 N -0.17 -0.10 0.25 4.85 3.85 -1.26 -1.15 116.55 122.82 1ifg n ASP 49 Ca -0.06 -0.66 0.17 0.00 -0.71 0.00 0.00 54.79 53.52 1ifg n ASP 49 Cb 0.63 0.00 0.73 0.00 -1.35 0.00 0.00 41.12 41.14 1ifg n ASP 49 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 1ifg s ASN 51 N -5.14 5.68 0.32 0.00 0.01 -1.26 -5.00 114.94 109.55 1ifg s ASN 51 Ca 0.00 2.00 -0.28 0.00 -0.71 0.00 0.00 52.86 53.87 1ifg s ASN 51 Cb 0.10 -2.56 -0.10 0.00 0.41 0.00 0.00 41.25 39.10 1ifg s ASN 51 CO 0.46 -1.24 1.15 -0.76 -1.51 0.00 0.00 177.10 175.20 1ifg s LEU 52 N -4.19 4.45 0.12 0.60 1.43 -1.26 -4.89 118.68 114.94 1ifg s LEU 52 Ca 0.68 2.35 0.07 0.00 -1.03 0.00 0.00 54.13 56.20 1ifg s LEU 52 Cb -0.20 -3.73 -0.04 0.00 0.03 0.00 0.00 46.19 42.26 1ifg s LEU 52 CO 0.32 -0.32 -0.18 -1.00 0.23 0.00 0.00 176.35 175.40 1ifg s HIS 53 N -1.23 1.64 0.00 0.29 3.76 -1.26 -2.53 115.29 115.96 1ifg s HIS 53 Ca 0.48 -0.47 -0.03 0.00 -0.15 0.00 0.00 55.06 54.90 1ifg s HIS 53 Cb -0.33 -0.87 -0.01 0.00 1.11 0.00 0.00 32.58 32.49 1ifg s HIS 53 CO 0.42 0.21 0.04 1.03 -0.85 0.00 0.00 174.74 175.59 1ifg s ARG 54 N -2.29 0.28 -0.02 1.40 1.81 -0.72 -4.55 118.95 114.85 1ifg s ARG 54 Ca 0.08 -0.33 -0.04 0.00 -1.72 0.00 0.00 55.73 53.71 1ifg s ARG 54 Cb -0.08 0.11 -0.04 0.00 -0.45 0.00 0.00 34.95 34.49 1ifg s ARG 54 CO 0.04 -0.05 0.20 -1.17 -0.68 0.00 0.00 175.30 173.64 1ifg s LEU 55 N -0.96 4.37 0.10 2.53 2.96 -0.69 -0.65 118.68 126.35 1ifg s LEU 55 Ca -0.11 0.43 -0.07 0.00 -0.22 0.00 0.00 54.13 54.16 1ifg s LEU 55 Cb -0.06 -2.55 -0.06 0.00 0.50 0.00 0.00 46.19 44.02 1ifg s LEU 55 CO -0.00 0.28 0.38 -0.83 -1.32 0.00 0.00 176.35 174.86 1ifg s GLY 56 N -1.73 2.28 0.00 7.98 0.00 -0.67 -3.95 107.32 111.22 1ifg s GLY 56 Ca 0.26 -0.49 0.00 0.00 0.00 0.00 0.00 44.72 44.49 1ifg s GLY 56 CO 0.16 -0.34 0.00 0.61 0.00 0.00 0.00 173.10 173.53 1ifg n GLY 57 N 0.53 1.58 2.95 0.20 0.00 -1.25 -2.18 105.19 107.02 1ifg n GLY 57 Ca -0.06 -1.00 -0.18 0.00 0.00 0.00 0.00 46.02 44.79 1ifg n GLY 57 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1ifg s LYS 58 N -2.00 0.64 -0.40 1.61 2.20 0.27 -4.88 119.74 117.18 1ifg s LYS 58 Ca 0.00 -0.19 -0.18 0.00 -0.36 0.00 0.00 55.97 55.25 1ifg s LYS 58 Cb 0.00 -0.64 0.01 0.00 -1.51 0.00 0.00 37.83 35.70 1ifg s LYS 58 CO 0.00 0.06 0.47 -1.17 -0.36 0.00 0.00 175.35 174.35 1ifg s LEU 59 N 0.24 4.69 -0.13 5.43 2.96 -1.26 -1.60 118.68 129.00 1ifg s LEU 59 Ca -0.03 -0.48 -0.20 0.00 -0.22 0.00 0.00 54.13 53.19 1ifg s LEU 59 Cb -0.07 -2.46 -0.04 0.00 0.50 0.00 0.00 46.19 44.12 1ifg s LEU 59 CO -0.00 -0.57 0.58 -1.61 -1.32 0.00 0.00 176.35 173.43 1ifg s GLU 60 N 2.26 4.33 -0.08 1.98 0.41 0.12 -4.92 118.70 122.80 1ifg s GLU 60 Ca 0.15 0.61 -0.17 0.00 -0.41 0.00 0.00 54.97 55.14 1ifg s GLU 60 Cb -0.16 -3.48 -0.05 0.00 -1.78 0.00 0.00 34.13 28.66 1ifg s GLU 60 CO 0.14 0.01 0.46 1.21 -0.49 0.00 0.00 175.26 176.59 1ifg s ASN 61 N 0.85 6.73 0.22 -0.19 3.84 -1.26 -1.41 114.94 123.72 1ifg s ASN 61 Ca 0.30 0.87 0.02 0.00 0.21 0.00 0.00 52.86 54.25 1ifg s ASN 61 Cb -0.16 -2.28 -0.05 0.00 -0.55 0.00 0.00 41.25 38.21 1ifg s ASN 61 CO 0.12 0.11 0.04 -0.54 -2.79 0.00 0.00 177.10 174.05 1ifg s LYS 62 N 0.04 1.27 -0.06 0.43 1.02 -0.30 -5.00 119.74 117.14 1ifg s LYS 62 Ca 0.25 -1.65 0.01 0.00 0.02 0.00 0.00 55.97 54.60 1ifg s LYS 62 Cb -0.16 -0.30 0.02 0.00 -0.52 0.00 0.00 37.83 36.87 1ifg s LYS 62 CO 0.11 -0.20 -0.07 0.99 -0.92 0.00 0.00 175.35 175.26 1ifg s THR 63 N -3.68 0.74 -0.26 2.17 2.01 -1.26 -1.49 115.64 113.87 1ifg s THR 63 Ca 0.31 -0.22 -0.29 0.00 0.31 0.00 0.00 61.69 61.79 1ifg s THR 63 Cb 0.07 -0.74 -0.02 0.00 0.01 0.00 0.00 72.50 71.81 1ifg s THR 63 CO 0.09 0.28 1.65 -0.22 -0.69 0.00 0.00 174.62 175.72 1ifg s LEU 64 N 0.98 3.78 0.25 4.42 2.96 0.63 -4.93 118.68 126.77 1ifg s LEU 64 Ca -0.10 1.50 -0.31 0.00 -0.22 0.00 0.00 54.13 55.00 1ifg s LEU 64 Cb -0.14 -3.53 -0.13 0.00 0.50 0.00 0.00 46.19 42.88 1ifg s LEU 64 CO 0.00 -1.37 1.40 -0.62 -1.32 0.00 0.00 176.35 174.44 1ifg n GLU 65 N 7.87 2.05 0.00 1.98 -0.58 -1.26 -0.54 120.64 130.15 1ifg n GLU 65 Ca 0.20 0.73 0.00 0.00 -0.42 0.00 0.00 57.16 57.66 1ifg n GLU 65 Cb 0.46 -2.38 0.00 0.00 -0.57 0.00 0.00 31.44 28.95 1ifg n GLU 65 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1ifg n GLY 66 N 2.04 2.03 0.19 0.62 0.00 -1.26 -4.62 105.19 104.19 1ifg n GLY 66 Ca 0.11 -0.29 -0.16 0.00 0.00 0.00 0.00 46.02 45.69 1ifg n GLY 66 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 173.32 174.81 1ifg h TRP 67 N 0.00 0.83 0.00 1.61 4.06 -1.91 -3.47 115.95 117.07 1ifg h TRP 67 Ca 0.00 -0.34 0.00 0.00 2.06 0.00 0.00 58.89 60.61 1ifg h TRP 67 Cb 0.00 -0.14 0.00 0.00 -1.00 0.00 0.00 29.16 28.02 1ifg h TRP 67 CO 0.00 1.13 0.00 0.41 -3.56 0.00 0.00 178.44 176.42 1ifg n GLY 68 N 0.59 0.76 3.77 1.49 0.00 0.29 -5.03 105.19 107.07 1ifg n GLY 68 Ca -0.07 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.56 1ifg n GLY 68 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1ifg s TYR 69 N -2.75 3.90 0.56 1.61 2.02 -1.26 -4.78 117.35 116.64 1ifg s TYR 69 Ca 0.00 1.77 -0.05 0.00 -0.37 0.00 0.00 57.07 58.43 1ifg s TYR 69 Cb 0.00 -2.88 0.00 0.00 -0.40 0.00 0.00 41.96 38.68 1ifg s TYR 69 CO 0.00 0.43 0.85 -0.51 -1.57 0.00 0.00 175.55 174.75 1ifg s ASP 70 N -1.27 5.69 0.28 2.29 1.11 -1.26 -0.27 116.67 123.24 1ifg s ASP 70 Ca 0.41 0.66 -0.18 0.00 0.18 0.00 0.00 52.55 53.61 1ifg s ASP 70 Cb -0.23 -1.72 0.02 0.00 1.07 0.00 0.00 42.92 42.05 1ifg s ASP 70 CO 0.28 -0.96 0.66 -0.72 1.18 0.00 0.00 175.17 175.61 1ifg s TYR 71 N -2.89 -0.01 0.03 4.23 -0.85 -0.56 -4.63 117.35 112.67 1ifg s TYR 71 Ca 0.52 -0.43 0.02 0.00 -0.52 0.00 0.00 57.07 56.66 1ifg s TYR 71 Cb -0.10 0.57 -0.02 0.00 0.38 0.00 0.00 41.96 42.79 1ifg s TYR 71 CO 0.44 -1.19 -0.07 0.71 -1.52 0.00 0.00 175.55 173.92 1ifg s TYR 72 N -3.85 0.59 -0.11 -3.49 1.51 0.20 -1.15 117.35 111.06 1ifg s TYR 72 Ca 0.14 -0.40 0.02 0.00 -1.01 0.00 0.00 57.07 55.82 1ifg s TYR 72 Cb -0.04 -0.36 0.02 0.00 -0.11 0.00 0.00 41.96 41.46 1ifg s TYR 72 CO 0.08 -0.07 -0.14 0.08 -1.11 0.00 0.00 175.55 174.38 1ifg s VAL 73 N -1.07 1.44 -0.31 0.71 1.01 -0.50 0.89 120.40 122.56 1ifg s VAL 73 Ca -0.07 -0.61 -0.12 0.00 0.00 0.00 0.00 61.98 61.18 1ifg s VAL 73 Cb -0.08 -1.32 -0.03 0.00 0.00 0.00 0.00 36.38 34.95 1ifg s VAL 73 CO 0.00 0.43 0.22 0.12 0.00 0.00 0.00 175.10 175.87 1ifg s PHE 74 N 1.01 3.22 0.00 5.22 5.36 0.11 0.12 117.98 133.03 1ifg s PHE 74 Ca -0.06 -0.07 0.00 0.00 -0.96 0.00 0.00 56.93 55.83 1ifg s PHE 74 Cb -0.15 -2.43 0.00 0.00 -0.34 0.00 0.00 43.02 40.10 1ifg s PHE 74 CO -0.02 -0.28 0.00 -0.40 -1.46 0.00 0.00 175.22 173.07 1ifg n ASP 75 N 5.09 0.00 -4.06 6.13 5.68 -0.63 -4.38 116.55 124.38 1ifg n ASP 75 Ca -0.13 -0.03 -0.31 0.00 -0.50 0.00 0.00 54.79 53.81 1ifg n ASP 75 Cb 0.51 0.00 -0.01 0.00 -1.14 0.00 0.00 41.12 40.48 1ifg n ASP 75 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 1ifg n LYS 76 N 0.00 -3.83 -2.59 0.11 4.76 -1.26 -0.56 118.16 114.79 1ifg n LYS 76 Ca 0.00 0.44 -0.38 0.00 -2.87 0.00 0.00 58.31 55.51 1ifg n LYS 76 Cb 0.00 -5.04 -0.05 0.00 -1.84 0.00 0.00 35.03 28.11 1ifg n LYS 76 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 1ifg s VAL 77 N -3.49 3.78 -0.00 -0.18 1.01 -1.26 -3.76 120.40 116.50 1ifg s VAL 77 Ca 0.49 1.49 0.01 0.00 0.00 0.00 0.00 61.98 63.97 1ifg s VAL 77 Cb -0.26 -3.84 -0.00 0.00 0.00 0.00 0.00 36.38 32.28 1ifg s VAL 77 CO 0.89 0.13 -0.02 -0.94 0.00 0.00 0.00 175.10 175.16 1ifg s SER 78 N -1.41 0.23 0.64 3.32 1.04 -0.93 -4.90 113.70 111.69 1ifg s SER 78 Ca 0.53 -0.03 -0.17 0.00 0.48 0.00 0.00 55.95 56.75 1ifg s SER 78 Cb -0.24 -0.03 -0.12 0.00 0.10 0.00 0.00 66.02 65.73 1ifg s SER 78 CO 0.30 0.02 -0.05 -0.24 0.98 0.00 0.00 173.24 174.25 1ifg n SER 79 N 3.05 -3.33 -4.63 7.02 2.88 -1.26 -1.67 113.62 115.68 1ifg n SER 79 Ca -0.13 0.57 -0.42 0.00 -1.33 0.00 0.00 58.87 57.56 1ifg n SER 79 Cb 0.59 -0.94 0.00 0.00 -0.75 0.00 0.00 64.21 63.12 1ifg n SER 79 CO 0.00 0.00 0.00 -2.65 -1.23 0.00 0.00 175.04 171.16 1ifg n PRO 80 N 1.08 1.55 -4.47 -1.46 -0.02 -1.26 -4.35 135.00 126.06 1ifg n PRO 80 Ca 0.07 0.55 -0.27 0.00 -2.02 0.00 0.00 63.50 61.83 1ifg n PRO 80 Cb 0.49 -2.09 -0.10 0.00 -0.02 0.00 0.00 33.50 31.79 1ifg n PRO 80 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 1ifg s VAL 81 N -1.19 2.19 0.14 -1.45 -7.23 0.18 -4.96 120.40 108.07 1ifg s VAL 81 Ca 0.61 -1.98 -0.24 0.00 -1.81 0.00 0.00 61.98 58.56 1ifg s VAL 81 Cb -0.58 -2.91 0.07 0.00 0.56 0.00 0.00 36.38 33.52 1ifg s VAL 81 CO 0.59 -0.07 0.67 -0.94 -0.31 0.00 0.00 175.10 175.04 1ifg s SER 82 N -3.73 -0.50 0.39 4.85 1.04 -1.26 -1.76 113.70 112.72 1ifg s SER 82 Ca 0.36 -0.05 -0.24 0.00 0.48 0.00 0.00 55.95 56.49 1ifg s SER 82 Cb 0.06 0.57 -0.09 0.00 0.10 0.00 0.00 66.02 66.66 1ifg s SER 82 CO 0.19 -0.93 1.05 0.42 0.98 0.00 0.00 173.24 174.94 1ifg s THR 83 N -3.64 3.74 -1.07 2.02 -4.23 -1.05 -4.99 115.64 106.42 1ifg s THR 83 Ca 0.03 1.36 -0.06 0.00 -1.18 0.00 0.00 61.69 61.83 1ifg s THR 83 Cb -0.01 -3.72 0.28 0.00 1.34 0.00 0.00 72.50 70.40 1ifg s THR 83 CO -0.11 0.04 1.21 0.23 -0.54 0.00 0.00 174.62 175.45 1ifg n MET 84 N 0.04 3.77 -4.21 3.99 0.00 -1.26 -4.77 117.12 114.69 1ifg n MET 84 Ca 0.04 -4.50 -0.19 0.00 0.00 0.00 0.00 57.70 53.05 1ifg n MET 84 Cb 0.49 -2.51 -0.12 0.00 0.00 0.00 0.00 33.22 31.08 1ifg n MET 84 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1ifg s MET 85 N -1.89 0.84 0.57 0.03 0.23 -1.26 -5.13 119.30 112.69 1ifg s MET 85 Ca 0.31 -0.92 -0.20 0.00 -1.03 0.00 0.00 55.69 53.86 1ifg s MET 85 Cb -0.04 -0.85 -0.04 0.00 -1.53 0.00 0.00 34.83 32.37 1ifg s MET 85 CO -0.01 0.19 1.22 0.00 -2.03 0.00 0.00 175.02 174.39 1ifg s ALA 86 N -1.19 2.63 0.11 3.16 0.00 -1.26 -4.85 121.76 120.36 1ifg s ALA 86 Ca -0.01 1.05 0.06 0.00 0.00 0.00 0.00 51.96 53.05 1ifg s ALA 86 Cb -0.10 -3.46 -0.04 0.00 0.00 0.00 0.00 23.12 19.52 1ifg s ALA 86 CO 0.02 -1.14 -0.02 0.00 0.00 0.00 0.00 175.76 174.63 1ifg n PRO 88 N 0.42 -0.13 -0.56 0.00 -0.02 -1.26 -4.75 135.00 128.69 1ifg n PRO 88 Ca -0.11 1.49 0.00 0.00 -2.02 0.00 0.00 63.50 62.86 1ifg n PRO 88 Cb 0.53 -2.21 0.00 0.00 -0.02 0.00 0.00 33.50 31.79 1ifg n PRO 88 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 1ifg n ASP 89 N -5.51 0.00 -1.81 2.55 5.68 -1.26 -5.06 116.55 111.14 1ifg n ASP 89 Ca 0.13 -0.37 -0.12 0.00 -0.50 0.00 0.00 54.79 53.93 1ifg n ASP 89 Cb 0.45 0.00 0.23 0.00 -1.14 0.00 0.00 41.12 40.65 1ifg n ASP 89 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1ifg n GLY 90 N 0.00 4.34 3.72 6.12 0.00 -1.26 -4.92 105.19 113.19 1ifg n GLY 90 Ca 0.00 -1.10 -0.42 0.00 0.00 0.00 0.00 46.02 44.51 1ifg n GLY 90 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ifg s LYS 91 N -3.17 4.59 0.19 1.61 0.00 -1.26 -5.03 119.74 116.66 1ifg s LYS 91 Ca 0.52 1.51 0.09 0.00 0.00 0.00 0.00 55.97 58.10 1ifg s LYS 91 Cb 0.44 -3.40 -0.04 0.00 0.00 0.00 0.00 37.83 34.83 1ifg s LYS 91 CO 0.09 0.02 -0.10 0.15 0.00 0.00 0.00 175.35 175.51 1ifg s LYS 92 N 0.52 2.05 0.05 1.78 1.02 -1.26 -4.44 119.74 119.45 1ifg s LYS 92 Ca 0.51 -1.30 -0.03 0.00 0.02 0.00 0.00 55.97 55.17 1ifg s LYS 92 Cb -0.24 -2.14 -0.03 0.00 -0.52 0.00 0.00 37.83 34.91 1ifg s LYS 92 CO 0.30 0.43 0.03 -1.83 -0.92 0.00 0.00 175.35 173.35 1ifg s GLU 93 N -2.90 0.60 -0.30 1.68 -1.05 -0.30 -4.85 118.70 111.59 1ifg s GLU 93 Ca 0.25 -1.01 -0.29 0.00 -0.15 0.00 0.00 54.97 53.77 1ifg s GLU 93 Cb -0.08 0.22 0.01 0.00 -0.44 0.00 0.00 34.13 33.83 1ifg s GLU 93 CO 0.15 -0.13 1.21 0.15 0.95 0.00 0.00 175.26 177.59 1ifg s LYS 94 N -3.34 3.99 0.13 -4.83 1.02 -1.26 -0.71 119.74 114.73 1ifg s LYS 94 Ca 0.01 1.19 0.07 0.00 0.02 0.00 0.00 55.97 57.26 1ifg s LYS 94 Cb 0.03 -3.82 -0.04 0.00 -0.52 0.00 0.00 37.83 33.49 1ifg s LYS 94 CO -0.08 -1.02 -0.16 0.15 -0.92 0.00 0.00 175.35 173.33 1ifg s LYS 95 N 3.94 1.08 -0.61 1.68 1.02 0.13 -4.91 119.74 122.07 1ifg s LYS 95 Ca 0.52 -1.26 -0.22 0.00 0.02 0.00 0.00 55.97 55.03 1ifg s LYS 95 Cb -0.15 -1.05 0.07 0.00 -0.52 0.00 0.00 37.83 36.18 1ifg s LYS 95 CO 0.20 0.21 0.89 0.12 -0.92 0.00 0.00 175.35 175.85 1ifg s PHE 96 N -1.97 2.77 -0.21 3.18 5.36 -1.26 -1.39 117.98 124.46 1ifg s PHE 96 Ca 0.10 -0.50 -0.24 0.00 -0.96 0.00 0.00 56.93 55.34 1ifg s PHE 96 Cb -0.06 -4.14 -0.01 0.00 -0.34 0.00 0.00 43.02 38.47 1ifg s PHE 96 CO 0.04 -1.49 0.77 0.08 -1.46 0.00 0.00 175.22 173.16 1ifg s VAL 97 N 3.73 4.91 0.39 3.12 1.01 0.07 -4.89 120.40 128.75 1ifg s VAL 97 Ca 0.22 1.46 0.08 0.00 0.00 0.00 0.00 61.98 63.73 1ifg s VAL 97 Cb -0.17 -4.07 -0.06 0.00 0.00 0.00 0.00 36.38 32.08 1ifg s VAL 97 CO 0.12 0.01 0.06 0.42 0.00 0.00 0.00 175.10 175.71 1ifg s THR 98 N 2.39 2.25 0.12 3.92 -4.23 -1.26 -0.57 115.64 118.26 1ifg s THR 98 Ca 0.34 -1.90 -0.12 0.00 -1.18 0.00 0.00 61.69 58.83 1ifg s THR 98 Cb -0.16 -2.94 -0.06 0.00 1.34 0.00 0.00 72.50 70.68 1ifg s THR 98 CO 0.10 -0.05 0.48 0.00 -0.54 0.00 0.00 174.62 174.60 1ifg s ALA 99 N -2.63 3.65 -0.37 3.99 0.00 -0.17 -1.70 121.76 124.54 1ifg s ALA 99 Ca 0.37 -0.26 -0.27 0.00 0.00 0.00 0.00 51.96 51.80 1ifg s ALA 99 Cb 0.05 -2.39 0.02 0.00 0.00 0.00 0.00 23.12 20.80 1ifg s ALA 99 CO 0.20 0.51 0.99 -0.47 0.00 0.00 0.00 175.76 176.99 1ifg s TYR 100 N -1.46 3.06 -0.25 0.00 5.04 -1.26 -4.73 117.35 117.76 1ifg s TYR 100 Ca 0.36 0.87 0.22 0.00 -2.44 0.00 0.00 57.07 56.07 1ifg s TYR 100 Cb -0.14 -3.76 -0.31 0.00 0.35 0.00 0.00 41.96 38.10 1ifg s TYR 100 CO 0.19 -0.87 0.57 1.28 -1.34 0.00 0.00 175.55 175.38 1ifg n LEU 101 N 6.93 0.22 0.00 6.97 4.77 -1.26 -4.94 117.00 129.69 1ifg n LEU 101 Ca 0.09 -0.11 0.00 0.00 -0.03 0.00 0.00 56.01 55.96 1ifg n LEU 101 Cb 0.48 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.57 1ifg n LEU 101 CO 0.60 0.06 0.00 0.61 -1.33 0.00 0.00 177.39 177.33 1ifg n GLY 102 N 1.32 -0.14 0.25 -0.72 0.00 -1.26 -3.39 105.19 101.24 1ifg n GLY 102 Ca -0.02 -1.00 0.13 0.00 0.00 0.00 0.00 46.02 45.13 1ifg n GLY 102 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1ifg h ASP 103 N 5.43 0.00 0.13 1.61 3.32 -1.98 -2.17 116.42 122.77 1ifg h ASP 103 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1ifg h ASP 103 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 1ifg h ASP 103 CO 0.00 0.12 0.00 0.00 -1.72 0.00 0.00 179.24 177.64 1ifg h ALA 104 N 1.88 1.00 -0.00 3.45 0.00 -1.98 0.48 119.26 124.09 1ifg h ALA 104 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1ifg h ALA 104 Cb 0.57 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.36 1ifg h ALA 104 CO 0.02 0.00 -0.38 0.41 0.00 0.00 0.00 179.25 179.30 1ifg n GLY 105 N -1.04 -1.12 3.36 0.00 0.00 -0.81 -4.71 105.19 100.87 1ifg n GLY 105 Ca -0.01 -0.33 -0.43 0.00 0.00 0.00 0.00 46.02 45.24 1ifg n GLY 105 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1ifg s MET 106 N -2.86 2.89 0.19 1.61 1.00 0.16 -1.03 119.30 121.26 1ifg s MET 106 Ca 0.15 -1.35 0.04 0.00 0.00 0.00 0.00 55.69 54.52 1ifg s MET 106 Cb 0.18 -4.04 -0.03 0.00 0.00 0.00 0.00 34.83 30.94 1ifg s MET 106 CO 0.63 -0.99 0.31 -0.51 0.00 0.00 0.00 175.02 174.47 1ifg s LEU 107 N 1.59 4.33 0.37 -0.03 1.43 -0.01 -4.90 118.68 121.47 1ifg s LEU 107 Ca 0.04 0.13 -0.25 0.00 -1.03 0.00 0.00 54.13 53.01 1ifg s LEU 107 Cb -0.24 -2.89 -0.09 0.00 0.03 0.00 0.00 46.19 43.01 1ifg s LEU 107 CO 0.06 0.00 1.08 -0.13 0.23 0.00 0.00 176.35 177.59 1ifg s ARG 108 N -3.54 4.24 -0.34 1.70 0.52 -1.26 -0.55 118.95 119.72 1ifg s ARG 108 Ca 0.34 1.63 -0.28 0.00 -0.52 0.00 0.00 55.73 56.90 1ifg s ARG 108 Cb -0.10 -2.70 0.02 0.00 0.52 0.00 0.00 34.95 32.68 1ifg s ARG 108 CO 0.29 -0.10 1.01 -0.47 0.02 0.00 0.00 175.30 176.05 1ifg s TYR 109 N -1.51 3.11 -0.31 -0.53 6.14 -1.18 -4.68 117.35 118.38 1ifg s TYR 109 Ca 0.55 1.00 -0.02 0.00 0.64 0.00 0.00 57.07 59.24 1ifg s TYR 109 Cb -0.26 -3.69 0.12 0.00 0.42 0.00 0.00 41.96 38.56 1ifg s TYR 109 CO 0.32 -0.80 0.18 1.21 0.64 0.00 0.00 175.55 177.10 1ifg s ASN 110 N 1.77 3.07 0.01 4.32 3.04 -1.26 -4.64 114.94 121.25 1ifg s ASN 110 Ca 0.42 -1.56 0.10 0.00 0.04 0.00 0.00 52.86 51.86 1ifg s ASN 110 Cb -0.12 -0.25 0.43 0.00 -1.54 0.00 0.00 41.25 39.77 1ifg s ASN 110 CO 0.17 -0.38 1.31 -1.54 -3.04 0.00 0.00 177.10 173.62 1ifg n SER 111 N 4.80 0.03 0.19 -4.21 3.41 -1.26 -2.91 113.62 113.66 1ifg n SER 111 Ca 0.01 0.51 0.05 0.00 -0.26 0.00 0.00 58.87 59.19 1ifg n SER 111 Cb 0.41 -0.51 0.32 0.00 -0.26 0.00 0.00 64.21 64.17 1ifg n SER 111 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 1ifg h LYS 112 N 0.00 0.00 -4.84 4.33 1.57 -1.94 -3.44 116.57 112.25 1ifg h LYS 112 Ca 0.00 0.00 -0.37 0.00 -1.87 0.00 0.00 60.65 58.41 1ifg h LYS 112 Cb 0.16 0.00 -0.26 0.00 0.08 0.00 0.00 32.23 32.22 1ifg h LYS 112 CO 0.00 0.38 -0.77 -0.51 -0.57 0.00 0.00 179.45 177.98 1ifg s LEU 113 N -7.07 2.12 0.58 2.94 1.43 -1.15 -5.15 118.68 112.39 1ifg s LEU 113 Ca 0.00 -0.34 -0.16 0.00 -1.03 0.00 0.00 54.13 52.60 1ifg s LEU 113 Cb 0.11 -0.42 -0.04 0.00 0.03 0.00 0.00 46.19 45.87 1ifg s LEU 113 CO 0.69 0.00 1.05 -2.16 0.23 0.00 0.00 176.35 176.17 1ifg s PRO 114 N -0.84 3.39 -0.23 1.29 0.04 -1.26 -4.78 135.00 132.60 1ifg s PRO 114 Ca -0.00 1.19 -0.13 0.00 0.04 0.00 0.00 61.00 62.09 1ifg s PRO 114 Cb -0.06 -2.04 -0.04 0.00 0.04 0.00 0.00 34.50 32.39 1ifg s PRO 114 CO 0.00 -0.75 0.28 0.42 0.04 0.00 0.00 177.00 177.00 1ifg s ILE 115 N -2.46 5.27 -0.15 0.56 1.01 -0.31 -4.94 121.20 120.18 1ifg s ILE 115 Ca 0.63 0.43 0.01 0.00 0.00 0.00 0.00 60.65 61.73 1ifg s ILE 115 Cb -0.15 -3.62 0.00 0.00 0.01 0.00 0.00 42.46 38.70 1ifg s ILE 115 CO 0.36 0.27 -0.18 -0.69 0.00 0.00 0.00 174.94 174.70 1ifg s VAL 116 N 1.38 2.43 -0.07 2.92 1.01 -1.26 -0.43 120.40 126.37 1ifg s VAL 116 Ca 0.13 -0.85 0.02 0.00 0.00 0.00 0.00 61.98 61.28 1ifg s VAL 116 Cb -0.15 -2.01 0.01 0.00 0.00 0.00 0.00 36.38 34.24 1ifg s VAL 116 CO 0.07 0.53 -0.13 -0.69 0.00 0.00 0.00 175.10 174.88 1ifg s VAL 117 N 0.83 1.20 -0.17 2.92 1.01 0.41 -0.63 120.40 125.98 1ifg s VAL 117 Ca -0.06 -0.51 -0.06 0.00 0.00 0.00 0.00 61.98 61.35 1ifg s VAL 117 Cb -0.15 -1.09 -0.04 0.00 0.00 0.00 0.00 36.38 35.09 1ifg s VAL 117 CO -0.01 0.37 0.05 -0.31 0.00 0.00 0.00 175.10 175.20 1ifg s TYR 118 N 0.67 3.23 0.24 5.22 1.51 0.26 -0.73 117.35 127.75 1ifg s TYR 118 Ca -0.14 0.06 -0.04 0.00 -1.01 0.00 0.00 57.07 55.94 1ifg s TYR 118 Cb -0.16 -2.03 -0.03 0.00 -0.11 0.00 0.00 41.96 39.64 1ifg s TYR 118 CO 0.04 0.19 0.27 0.95 -1.11 0.00 0.00 175.55 175.89 1ifg s THR 119 N 0.17 0.00 0.63 -0.71 -4.23 -0.91 0.09 115.64 110.67 1ifg s THR 119 Ca 0.04 -1.80 -0.17 0.00 -1.18 0.00 0.00 61.69 58.57 1ifg s THR 119 Cb -0.12 -2.43 -0.02 0.00 1.34 0.00 0.00 72.50 71.27 1ifg s THR 119 CO 0.01 0.00 1.18 -2.84 -0.54 0.00 0.00 174.62 172.43 1ifg s PRO 120 N -3.97 2.80 0.59 3.99 0.02 -1.26 -0.55 135.00 136.60 1ifg s PRO 120 Ca 0.34 1.72 0.28 0.00 0.02 0.00 0.00 61.00 63.36 1ifg s PRO 120 Cb 0.04 -1.92 1.56 0.00 0.02 0.00 0.00 34.50 34.20 1ifg s PRO 120 CO 0.13 -1.32 2.00 0.38 -0.33 0.00 0.00 177.00 177.87 1ifg h ASP 121 N 0.52 0.00 -0.56 2.53 3.04 -0.85 -2.01 116.42 119.09 1ifg h ASP 121 Ca -0.49 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.30 1ifg h ASP 121 Cb 1.29 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.58 1ifg h ASP 121 CO 0.54 0.00 0.00 -0.46 -2.04 0.00 0.00 179.24 177.28 1ifg n ASN 122 N -3.78 5.28 -4.31 4.15 6.94 -1.26 -4.90 115.26 117.37 1ifg n ASN 122 Ca 0.05 -2.78 -0.31 0.00 -0.02 0.00 0.00 54.58 51.51 1ifg n ASN 122 Cb 0.49 -0.65 -0.16 0.00 -2.36 0.00 0.00 39.78 37.09 1ifg n ASN 122 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 1ifg s VAL 123 N -2.48 2.15 0.07 3.53 1.01 -0.75 -4.85 120.40 119.08 1ifg s VAL 123 Ca 0.51 -1.06 0.04 0.00 0.00 0.00 0.00 61.98 61.47 1ifg s VAL 123 Cb 0.38 -1.76 -0.04 0.00 0.00 0.00 0.00 36.38 34.95 1ifg s VAL 123 CO 0.17 0.58 0.00 -1.81 0.00 0.00 0.00 175.10 174.04 1ifg s ASP 124 N -0.46 5.06 -0.19 3.32 1.01 0.18 -4.77 116.67 120.82 1ifg s ASP 124 Ca 0.05 -0.14 -0.02 0.00 0.71 0.00 0.00 52.55 53.16 1ifg s ASP 124 Cb -0.11 -1.23 -0.00 0.00 1.01 0.00 0.00 42.92 42.58 1ifg s ASP 124 CO 0.01 0.19 -0.10 -0.69 0.21 0.00 0.00 175.17 174.79 1ifg s VAL 125 N -1.27 2.98 0.42 -1.27 1.01 -1.26 -1.64 120.40 119.36 1ifg s VAL 125 Ca 0.25 -0.64 0.04 0.00 0.00 0.00 0.00 61.98 61.62 1ifg s VAL 125 Cb -0.12 -2.31 -0.04 0.00 0.00 0.00 0.00 36.38 33.91 1ifg s VAL 125 CO 0.17 0.48 0.05 -0.54 0.00 0.00 0.00 175.10 175.26 1ifg s LYS 126 N 1.16 1.94 0.16 2.72 1.02 0.35 -1.22 119.74 125.86 1ifg s LYS 126 Ca 0.01 -2.16 -0.24 0.00 0.02 0.00 0.00 55.97 53.61 1ifg s LYS 126 Cb -0.14 -1.15 0.06 0.00 -0.52 0.00 0.00 37.83 36.08 1ifg s LYS 126 CO -0.03 -0.28 0.69 1.52 -0.92 0.00 0.00 175.35 176.33 1ifg s TYR 127 N -3.04 -0.41 -0.09 3.18 1.13 0.10 -0.74 117.35 117.49 1ifg s TYR 127 Ca 0.24 0.15 -0.14 0.00 -1.41 0.00 0.00 57.07 55.91 1ifg s TYR 127 Cb 0.05 0.60 0.03 0.00 -1.10 0.00 0.00 41.96 41.54 1ifg s TYR 127 CO 0.12 -0.89 0.36 -0.98 -2.51 0.00 0.00 175.55 171.65 1ifg s ARG 128 N -3.66 0.53 0.22 -3.49 1.70 -1.05 -0.00 118.95 113.20 1ifg s ARG 128 Ca 0.05 0.26 -0.17 0.00 -0.47 0.00 0.00 55.73 55.40 1ifg s ARG 128 Cb -0.02 0.25 -0.08 0.00 -0.57 0.00 0.00 34.95 34.53 1ifg s ARG 128 CO -0.07 -0.11 0.67 0.08 -1.08 0.00 0.00 175.30 174.80 1ifg s VAL 129 N -0.37 4.68 -0.20 4.99 1.01 -1.26 -1.52 120.40 127.73 1ifg s VAL 129 Ca -0.05 1.06 0.01 0.00 0.00 0.00 0.00 61.98 63.00 1ifg s VAL 129 Cb -0.03 -3.77 0.04 0.00 0.00 0.00 0.00 36.38 32.62 1ifg s VAL 129 CO 0.02 0.13 -0.10 0.26 0.00 0.00 0.00 175.10 175.41 1ifg s TRP 130 N -1.61 2.47 -0.25 5.22 0.52 -0.07 0.28 118.94 125.50 1ifg s TRP 130 Ca 0.44 -1.64 -0.09 0.00 0.02 0.00 0.00 56.10 54.83 1ifg s TRP 130 Cb -0.15 -1.66 -0.04 0.00 -1.15 0.00 0.00 33.47 30.47 1ifg s TRP 130 CO 0.20 -0.75 0.13 0.00 0.02 0.00 0.00 176.95 176.55 1ifg s ALA 130 N 1.38 3.40 -1.46 0.98 0.00 -0.63 -1.23 121.76 124.19 1ifg s ALA 130 Ca -0.02 -1.04 -0.04 0.00 0.00 0.00 0.00 51.96 50.86 1ifg s ALA 130 Cb -0.16 -2.26 0.02 0.00 0.00 0.00 0.00 23.12 20.71 1ifg s ALA 130 CO -0.08 -0.41 0.37 -0.25 0.00 0.00 0.00 175.76 175.39 1ifg n ASP 130 N 4.76 -5.23 0.00 0.00 8.00 -0.82 -1.88 116.55 121.39 1ifg n ASP 130 Ca -0.15 -0.18 0.00 0.00 0.71 0.00 0.00 54.79 55.17 1ifg n ASP 130 Cb 0.52 -4.29 0.00 0.00 -0.02 0.00 0.00 41.12 37.33 1ifg n ASP 130 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1ifg n GLY 130 N -1.24 0.78 3.10 0.44 0.00 -1.26 -5.04 105.19 101.97 1ifg n GLY 130 Ca -0.12 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.59 1ifg n GLY 130 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ifg s LYS 131 N -0.54 2.63 0.22 1.61 -2.85 -0.79 -5.11 119.74 114.91 1ifg s LYS 131 Ca 0.00 -0.70 -0.30 0.00 -1.00 0.00 0.00 55.97 53.96 1ifg s LYS 131 Cb 0.00 -2.22 -0.10 0.00 -2.06 0.00 0.00 37.83 33.45 1ifg s LYS 131 CO 0.00 -0.10 1.42 0.00 0.10 0.00 0.00 175.35 176.77 1ifg s ALA 132 N 1.07 3.62 0.80 0.59 0.00 -1.26 -1.60 121.76 124.97 1ifg s ALA 132 Ca -0.03 1.26 -0.12 0.00 0.00 0.00 0.00 51.96 53.08 1ifg s ALA 132 Cb -0.14 -3.54 0.07 0.00 0.00 0.00 0.00 23.12 19.50 1ifg s ALA 132 CO -0.05 -0.68 1.12 -1.21 0.00 0.00 0.00 175.76 174.93 1ifg s GLU 133 N -0.03 2.08 -0.00 0.00 2.02 0.14 -4.93 118.70 117.98 1ifg s GLU 133 Ca 0.60 0.43 -0.23 0.00 0.02 0.00 0.00 54.97 55.79 1ifg s GLU 133 Cb -0.40 -1.94 -0.13 0.00 0.10 0.00 0.00 34.13 31.76 1ifg s GLU 133 CO 0.40 -1.58 0.96 1.49 0.02 0.00 0.00 175.26 176.55 1ifg h GLU 134 N -1.05 -0.77 -6.34 1.61 4.81 -1.96 -3.44 114.58 107.44 1ifg h GLU 134 Ca -0.47 0.05 -0.64 0.00 -0.13 0.00 0.00 59.36 58.17 1ifg h GLU 134 Cb 1.29 0.18 0.04 0.00 0.63 0.00 0.00 28.75 30.89 1ifg h GLU 134 CO 0.62 -0.50 0.79 1.17 -0.73 0.00 0.00 179.01 180.36 1ifg n LYS 135 N -5.31 1.75 -3.62 1.92 3.00 -1.26 -4.97 118.16 109.67 1ifg n LYS 135 Ca -0.10 0.63 -0.40 0.00 -0.00 0.00 0.00 58.31 58.44 1ifg n LYS 135 Cb 0.32 -2.37 -0.11 0.00 0.00 0.00 0.00 35.03 32.87 1ifg n LYS 135 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.40 177.82 1ifg s ILE 136 N 1.87 4.42 0.37 3.15 1.01 -1.26 -4.48 121.20 126.28 1ifg s ILE 136 Ca 0.86 -0.99 0.04 0.00 0.00 0.00 0.00 60.65 60.57 1ifg s ILE 136 Cb -0.81 -3.51 -0.01 0.00 0.01 0.00 0.00 42.46 38.13 1ifg s ILE 136 CO 0.47 -0.28 0.53 -1.81 0.00 0.00 0.00 174.94 173.86 1ifg s ASP 137 N 1.63 5.96 -0.09 3.58 1.01 1.00 -4.88 116.67 124.89 1ifg s ASP 137 Ca 0.02 0.01 -0.01 0.00 0.71 0.00 0.00 52.55 53.27 1ifg s ASP 137 Cb -0.20 -1.41 -0.03 0.00 1.01 0.00 0.00 42.92 42.29 1ifg s ASP 137 CO 0.05 -0.49 -0.01 0.20 0.21 0.00 0.00 175.17 175.13 1ifg s ASN 138 N -4.17 5.10 0.72 0.27 0.01 -1.26 0.03 114.94 115.63 1ifg s ASN 138 Ca 0.45 0.10 -0.11 0.00 -0.71 0.00 0.00 52.86 52.59 1ifg s ASN 138 Cb -0.10 -1.43 0.02 0.00 0.41 0.00 0.00 41.25 40.15 1ifg s ASN 138 CO 0.33 0.36 1.07 0.00 -1.51 0.00 0.00 177.10 177.35 1ifg s ALA 139 N -0.79 2.55 -0.18 0.60 0.00 -0.36 -4.94 121.76 118.65 1ifg s ALA 139 Ca 0.12 0.16 -0.07 0.00 0.00 0.00 0.00 51.96 52.17 1ifg s ALA 139 Cb -0.11 -3.21 -0.04 0.00 0.00 0.00 0.00 23.12 19.76 1ifg s ALA 139 CO 0.02 -1.38 0.04 0.08 0.00 0.00 0.00 175.76 174.52 1ifg s VAL 140 N -2.98 4.54 -0.45 0.00 1.01 0.26 -4.82 120.40 117.96 1ifg s VAL 140 Ca 0.59 -0.12 -0.29 0.00 0.00 0.00 0.00 61.98 62.16 1ifg s VAL 140 Cb -0.15 -3.04 0.02 0.00 0.00 0.00 0.00 36.38 33.20 1ifg s VAL 140 CO 0.55 0.45 1.34 -0.69 0.00 0.00 0.00 175.10 176.75 1ifg s VAL 141 N 0.50 3.97 0.00 2.92 1.01 -1.26 -0.42 120.40 127.11 1ifg s VAL 141 Ca 0.02 0.97 0.00 0.00 0.00 0.00 0.00 61.98 62.97 1ifg s VAL 141 Cb -0.13 -4.34 0.00 0.00 0.00 0.00 0.00 36.38 31.90 1ifg s VAL 141 CO 0.01 -0.88 0.00 -2.11 0.00 0.00 0.00 175.10 172.12