#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2g5m h HIS 2 N 0.00 -0.00 -3.43 1.61 -0.00 -2.00 -3.42 115.15 107.91 2g5m h HIS 2 Ca 0.00 -0.00 -0.72 0.00 -0.00 0.00 0.00 60.37 59.65 2g5m h HIS 2 Cb 0.00 0.00 -0.25 0.00 -0.00 0.00 0.00 27.41 27.16 2g5m h HIS 2 CO 0.00 -0.00 -0.43 -1.64 -0.00 0.00 0.00 177.93 175.85 2g5m s MET 3 N -1.88 2.77 -0.66 5.26 1.00 -1.26 -2.79 119.30 121.74 2g5m s MET 3 Ca -0.00 -1.34 -0.16 0.00 0.00 0.00 0.00 55.69 54.19 2g5m s MET 3 Cb 0.00 -3.88 0.15 0.00 0.00 0.00 0.00 34.83 31.10 2g5m s MET 3 CO 0.00 -0.92 0.65 -1.21 0.00 0.00 0.00 175.02 173.54 2g5m s GLU 4 N 1.52 3.22 -0.77 2.03 2.02 -0.92 -4.87 118.70 120.93 2g5m s GLU 4 Ca 0.03 -1.89 -0.24 0.00 0.02 0.00 0.00 54.97 52.90 2g5m s GLU 4 Cb -0.23 -4.36 0.06 0.00 0.10 0.00 0.00 34.13 29.70 2g5m s GLU 4 CO 0.05 -1.37 1.16 -0.51 0.02 0.00 0.00 175.26 174.60 2g5m s LEU 5 N 1.38 3.92 0.05 1.80 2.01 -1.24 -1.25 118.68 125.35 2g5m s LEU 5 Ca 0.11 -0.99 0.05 0.00 0.01 0.00 0.00 54.13 53.30 2g5m s LEU 5 Cb -0.22 -2.49 -0.02 0.00 0.01 0.00 0.00 46.19 43.47 2g5m s LEU 5 CO -0.01 -1.55 -0.13 0.72 1.01 0.00 0.00 176.35 176.39 2g5m s PHE 6 N 4.61 1.16 0.20 0.29 -0.12 0.10 -4.95 117.98 119.27 2g5m s PHE 6 Ca 0.31 -0.40 -0.30 0.00 -0.05 0.00 0.00 56.93 56.50 2g5m s PHE 6 Cb -0.10 -0.68 -0.08 0.00 -0.63 0.00 0.00 43.02 41.53 2g5m s PHE 6 CO 0.07 0.03 1.08 -1.25 -0.05 0.00 0.00 175.22 175.10 2g5m s PRO 7 N -1.37 4.63 0.10 1.99 0.04 -1.26 -0.32 135.00 138.81 2g5m s PRO 7 Ca -0.01 1.71 0.10 0.00 0.04 0.00 0.00 61.00 62.84 2g5m s PRO 7 Cb -0.09 -3.26 -0.04 0.00 0.04 0.00 0.00 34.50 31.15 2g5m s PRO 7 CO 0.02 0.14 -0.25 0.08 0.04 0.00 0.00 177.00 177.03 2g5m s VAL 8 N -0.48 2.06 0.03 -0.36 1.01 0.30 -4.91 120.40 118.05 2g5m s VAL 8 Ca 0.48 -1.60 0.06 0.00 0.00 0.00 0.00 61.98 60.92 2g5m s VAL 8 Cb -0.29 -1.82 -0.02 0.00 0.00 0.00 0.00 36.38 34.25 2g5m s VAL 8 CO 0.36 0.12 -0.18 -0.70 0.00 0.00 0.00 175.10 174.70 2g5m s GLU 9 N -1.80 1.24 0.04 2.72 2.12 -1.26 0.37 118.70 122.13 2g5m s GLU 9 Ca 0.11 -0.78 -0.02 0.00 0.36 0.00 0.00 54.97 54.64 2g5m s GLU 9 Cb -0.10 -1.28 -0.03 0.00 0.26 0.00 0.00 34.13 32.98 2g5m s GLU 9 CO 0.05 0.33 0.00 -0.51 -0.54 0.00 0.00 175.26 174.59 2g5m s LEU 10 N -0.93 2.26 -0.20 2.70 1.43 -0.38 -4.76 118.68 118.80 2g5m s LEU 10 Ca 0.05 -0.80 0.00 0.00 -1.03 0.00 0.00 54.13 52.35 2g5m s LEU 10 Cb -0.08 0.30 0.05 0.00 0.03 0.00 0.00 46.19 46.49 2g5m s LEU 10 CO 0.01 -0.53 -0.06 -0.70 0.23 0.00 0.00 176.35 175.30 2g5m s GLU 11 N -3.22 1.57 0.48 1.70 2.12 -1.26 -1.60 118.70 118.49 2g5m s GLU 11 Ca 0.00 -0.77 -0.20 0.00 0.36 0.00 0.00 54.97 54.37 2g5m s GLU 11 Cb 0.03 -2.34 -0.09 0.00 0.26 0.00 0.00 34.13 31.99 2g5m s GLU 11 CO -0.07 -0.51 1.00 -1.59 -0.54 0.00 0.00 175.26 173.55 2g5m s LYS 12 N 1.51 3.93 0.21 4.30 -2.85 0.33 -4.88 119.74 122.28 2g5m s LYS 12 Ca -0.02 1.23 0.00 0.00 -1.00 0.00 0.00 55.97 56.18 2g5m s LYS 12 Cb -0.17 -2.12 0.04 0.00 -2.06 0.00 0.00 37.83 33.52 2g5m s LYS 12 CO -0.07 -0.31 0.29 -3.47 0.10 0.00 0.00 175.35 171.89 2g5m n ASP 13 N -0.99 0.45 0.20 0.03 -0.08 -0.55 -4.86 116.55 110.76 2g5m n ASP 13 Ca 0.08 -1.37 0.07 0.00 -1.51 0.00 0.00 54.79 52.07 2g5m n ASP 13 Cb 0.53 -0.18 0.40 0.00 2.34 0.00 0.00 41.12 44.20 2g5m n ASP 13 CO 0.00 0.00 0.00 -1.28 0.12 0.00 0.00 177.20 176.04 2g5m h SER 14 N -0.14 0.00 0.70 1.67 0.87 -1.99 -0.84 113.55 113.81 2g5m h SER 14 Ca -0.10 0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.46 2g5m h SER 14 Cb 0.37 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 62.33 2g5m h SER 14 CO 0.11 0.32 -0.03 -0.08 -0.53 0.00 0.00 176.83 176.62 2g5m h GLU 15 N 0.00 0.00 0.00 2.24 4.57 -1.93 -3.48 114.58 115.98 2g5m h GLU 15 Ca -0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 2g5m h GLU 15 Cb 0.81 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.40 2g5m h GLU 15 CO 0.04 0.03 0.00 0.41 -1.18 0.00 0.00 179.01 178.31 2g5m n GLY 16 N -0.31 1.40 2.04 1.92 0.00 -0.32 -4.89 105.19 105.03 2g5m n GLY 16 Ca -0.01 -0.77 -0.11 0.00 0.00 0.00 0.00 46.02 45.14 2g5m n GLY 16 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2g5m n LEU 17 N 0.00 0.00 -2.96 0.99 7.99 -1.26 -1.47 117.00 120.29 2g5m n LEU 17 Ca 0.00 -1.33 -0.15 0.00 -0.01 0.00 0.00 56.01 54.52 2g5m n LEU 17 Cb 0.00 -0.20 0.00 0.00 -0.11 0.00 0.00 43.42 43.11 2g5m n LEU 17 CO 0.00 -0.59 -0.02 0.61 -1.51 0.00 0.00 177.39 175.88 2g5m n GLY 18 N 1.33 1.51 3.82 -0.72 0.00 -1.26 -2.89 105.19 106.97 2g5m n GLY 18 Ca 0.07 -0.70 -0.06 0.00 0.00 0.00 0.00 46.02 45.34 2g5m n GLY 18 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2g5m s ILE 19 N -0.36 0.00 0.01 -0.61 -4.36 -1.26 -0.87 121.20 113.74 2g5m s ILE 19 Ca 0.33 -0.87 0.04 0.00 -0.26 0.00 0.00 60.65 59.89 2g5m s ILE 19 Cb 0.22 -2.00 -0.01 0.00 1.25 0.00 0.00 42.46 41.93 2g5m s ILE 19 CO -0.16 0.00 -0.11 -0.44 0.24 0.00 0.00 174.94 174.47 2g5m s SER 20 N -2.93 1.31 0.10 4.36 0.01 0.56 -4.62 113.70 112.50 2g5m s SER 20 Ca 0.11 -0.28 0.08 0.00 1.31 0.00 0.00 55.95 57.18 2g5m s SER 20 Cb -0.04 -0.12 -0.04 0.00 0.21 0.00 0.00 66.02 66.03 2g5m s SER 20 CO 0.05 0.09 -0.16 0.27 0.41 0.00 0.00 173.24 173.90 2g5m s ILE 21 N -0.46 3.00 -0.06 1.44 -4.36 -1.26 0.70 121.20 120.19 2g5m s ILE 21 Ca 0.03 -1.39 0.05 0.00 -0.26 0.00 0.00 60.65 59.08 2g5m s ILE 21 Cb -0.05 -2.37 -0.01 0.00 1.25 0.00 0.00 42.46 41.27 2g5m s ILE 21 CO 0.00 0.13 -0.23 -0.51 0.24 0.00 0.00 174.94 174.57 2g5m s ILE 22 N -1.14 2.19 -0.72 8.37 1.10 0.12 -4.70 121.20 126.42 2g5m s ILE 22 Ca 0.19 -1.01 -0.16 0.00 -0.51 0.00 0.00 60.65 59.15 2g5m s ILE 22 Cb -0.11 -1.81 0.16 0.00 0.15 0.00 0.00 42.46 40.86 2g5m s ILE 22 CO 0.11 0.57 0.73 -0.83 -2.11 0.00 0.00 174.94 173.40 2g5m s GLY 23 N -0.13 2.26 -0.39 1.50 0.00 -1.26 -1.75 107.32 107.54 2g5m s GLY 23 Ca -0.04 -2.84 -0.26 0.00 0.00 0.00 0.00 44.72 41.58 2g5m s GLY 23 CO 0.04 1.40 0.94 1.06 0.00 0.00 0.00 173.10 176.53 2g5m s MET 24 N 1.32 3.77 -1.42 2.90 1.00 -0.74 -4.92 119.30 121.22 2g5m s MET 24 Ca 0.15 0.49 -0.12 0.00 0.00 0.00 0.00 55.69 56.21 2g5m s MET 24 Cb -0.17 -3.83 0.06 0.00 0.00 0.00 0.00 34.83 30.89 2g5m s MET 24 CO -0.03 -1.03 2.23 0.41 0.00 0.00 0.00 175.02 176.61 2g5m n GLY 25 N 4.52 4.55 0.97 -0.03 0.00 -1.26 -2.34 105.19 111.59 2g5m n GLY 25 Ca 0.07 -1.75 0.00 0.00 0.00 0.00 0.00 46.02 44.34 2g5m n GLY 25 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2g5m n ALA 26 N 4.90 0.00 -0.48 4.61 0.00 -1.26 -5.05 120.51 123.23 2g5m n ALA 26 Ca 0.53 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.97 2g5m n ALA 26 Cb 0.35 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.80 2g5m n ALA 26 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2g5m n GLY 27 N -1.37 3.14 2.90 0.00 0.00 -0.99 -3.52 105.19 105.35 2g5m n GLY 27 Ca 0.00 0.26 -0.30 0.00 0.00 0.00 0.00 46.02 45.98 2g5m n GLY 27 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2g5m s ALA 28 N -1.00 3.14 0.13 4.61 0.00 -1.16 -4.84 121.76 122.65 2g5m s ALA 28 Ca 0.00 -3.21 -0.12 0.00 0.00 0.00 0.00 51.96 48.63 2g5m s ALA 28 Cb 0.00 -2.11 -0.04 0.00 0.00 0.00 0.00 23.12 20.97 2g5m s ALA 28 CO 0.00 -2.03 1.48 0.22 0.00 0.00 0.00 175.76 175.43 2g5m h ASP 29 N 6.43 0.89 -0.92 0.00 3.58 -1.85 0.25 116.42 124.80 2g5m h ASP 29 Ca -0.05 -0.43 -0.47 0.00 0.42 0.00 0.00 57.03 56.50 2g5m h ASP 29 Cb 0.89 -0.25 -0.18 0.00 1.72 0.00 0.00 39.33 41.51 2g5m h ASP 29 CO 0.65 1.13 0.49 1.15 -2.88 0.00 0.00 179.24 179.79 2g5m n MET 30 N -4.18 2.25 0.14 0.28 0.00 -1.26 -3.32 117.12 111.03 2g5m n MET 30 Ca -0.02 -2.25 0.00 0.00 0.00 0.00 0.00 57.70 55.43 2g5m n MET 30 Cb 0.47 -1.99 0.00 0.00 0.00 0.00 0.00 33.22 31.70 2g5m n MET 30 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 2g5m n GLY 31 N 0.44 -1.82 0.00 3.17 0.00 -1.14 -5.01 105.19 100.84 2g5m n GLY 31 Ca 0.44 0.41 0.00 0.00 0.00 0.00 0.00 46.02 46.87 2g5m n GLY 31 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2g5m n LEU 32 N -3.07 0.33 -1.52 0.99 7.99 0.66 -5.02 117.00 117.36 2g5m n LEU 32 Ca 0.00 -0.44 -0.09 0.00 -0.01 0.00 0.00 56.01 55.47 2g5m n LEU 32 Cb 0.00 0.00 -0.03 0.00 -0.11 0.00 0.00 43.42 43.28 2g5m n LEU 32 CO 0.00 0.08 -0.10 -1.84 -1.51 0.00 0.00 177.39 174.03 2g5m n GLU 33 N -0.22 -1.45 -4.46 3.23 0.28 0.05 -4.91 120.64 113.16 2g5m n GLU 33 Ca 0.00 0.54 -0.23 0.00 -0.16 0.00 0.00 57.16 57.31 2g5m n GLU 33 Cb 0.07 -4.80 -0.09 0.00 1.43 0.00 0.00 31.44 28.05 2g5m n GLU 33 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 177.13 177.12 2g5m s LYS 34 N -3.25 1.80 0.33 3.44 1.02 -1.26 -4.91 119.74 116.91 2g5m s LYS 34 Ca 0.00 -2.06 -0.27 0.00 0.02 0.00 0.00 55.97 53.66 2g5m s LYS 34 Cb 0.00 -0.55 -0.13 0.00 -0.52 0.00 0.00 37.83 36.63 2g5m s LYS 34 CO 0.00 -0.41 1.11 1.28 -0.92 0.00 0.00 175.35 176.41 2g5m n LEU 35 N -0.79 2.59 -4.18 3.17 4.77 -1.24 -2.98 117.00 118.34 2g5m n LEU 35 Ca -0.04 1.16 -0.37 0.00 -0.03 0.00 0.00 56.01 56.73 2g5m n LEU 35 Cb 0.65 -1.37 -0.11 0.00 -2.33 0.00 0.00 43.42 40.26 2g5m n LEU 35 CO 0.37 -1.08 -0.18 -0.83 -1.33 0.00 0.00 177.39 174.33 2g5m s GLY 36 N -0.50 1.94 -0.87 -0.72 0.00 -1.00 -4.18 107.32 101.97 2g5m s GLY 36 Ca 0.58 -2.25 -0.17 0.00 0.00 0.00 0.00 44.72 42.88 2g5m s GLY 36 CO 0.60 0.94 0.96 -0.42 0.00 0.00 0.00 173.10 175.18 2g5m s ILE 37 N 1.26 5.11 0.58 0.90 -1.09 -1.26 -1.78 121.20 124.93 2g5m s ILE 37 Ca 0.04 -1.94 -0.03 0.00 -2.23 0.00 0.00 60.65 56.49 2g5m s ILE 37 Cb -0.22 -4.64 0.02 0.00 -1.58 0.00 0.00 42.46 36.04 2g5m s ILE 37 CO -0.01 -1.29 0.86 -0.36 -1.23 0.00 0.00 174.94 172.91 2g5m s PHE 38 N 1.61 3.08 -0.00 3.97 0.40 -0.72 -2.68 117.98 123.64 2g5m s PHE 38 Ca 0.26 0.38 -0.29 0.00 -0.60 0.00 0.00 56.93 56.68 2g5m s PHE 38 Cb -0.08 -2.78 -0.03 0.00 0.51 0.00 0.00 43.02 40.64 2g5m s PHE 38 CO -0.09 -0.89 0.95 0.08 0.70 0.00 0.00 175.22 175.97 2g5m s VAL 39 N -2.93 4.87 -0.19 -0.44 1.01 0.18 0.15 120.40 123.05 2g5m s VAL 39 Ca 0.55 1.99 -0.05 0.00 0.00 0.00 0.00 61.98 64.47 2g5m s VAL 39 Cb -0.10 -4.29 -0.22 0.00 0.00 0.00 0.00 36.38 31.77 2g5m s VAL 39 CO 0.42 0.18 0.10 1.17 0.00 0.00 0.00 175.10 176.97 2g5m n LYS 40 N 3.81 0.70 -3.69 2.72 0.00 0.22 -4.48 118.16 117.44 2g5m n LYS 40 Ca 0.05 0.24 -0.10 0.00 0.00 0.00 0.00 58.31 58.50 2g5m n LYS 40 Cb 0.51 -1.63 -0.03 0.00 0.00 0.00 0.00 35.03 33.88 2g5m n LYS 40 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.40 177.32 2g5m s THR 41 N -2.53 0.02 -0.39 3.15 -1.32 -1.05 -4.96 115.64 108.56 2g5m s THR 41 Ca -0.28 -0.66 -0.04 0.00 -1.21 0.00 0.00 61.69 59.50 2g5m s THR 41 Cb 0.08 -1.49 0.09 0.00 -1.51 0.00 0.00 72.50 69.68 2g5m s THR 41 CO 0.68 -0.10 0.18 -0.69 -2.21 0.00 0.00 174.62 172.48 2g5m s VAL 42 N -3.85 3.43 -0.05 5.08 1.01 -1.26 -0.32 120.40 124.44 2g5m s VAL 42 Ca 0.08 -1.82 -0.30 0.00 0.00 0.00 0.00 61.98 59.94 2g5m s VAL 42 Cb -0.01 -3.24 -0.05 0.00 0.00 0.00 0.00 36.38 33.08 2g5m s VAL 42 CO -0.04 -0.56 1.49 -0.89 0.00 0.00 0.00 175.10 175.09 2g5m s THR 43 N 1.22 3.73 0.24 3.92 2.01 -0.05 -4.81 115.64 121.90 2g5m s THR 43 Ca 0.05 0.99 -0.06 0.00 0.31 0.00 0.00 61.69 62.98 2g5m s THR 43 Cb -0.22 -3.64 0.22 0.00 0.01 0.00 0.00 72.50 68.86 2g5m s THR 43 CO -0.02 -0.05 1.87 -0.33 -0.69 0.00 0.00 174.62 175.40 2g5m h GLU 44 N 8.62 1.04 0.00 4.92 5.08 -1.96 -1.39 114.58 130.89 2g5m h GLU 44 Ca -0.36 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 57.93 2g5m h GLU 44 Cb 1.16 -0.23 0.00 0.00 0.50 0.00 0.00 28.75 30.18 2g5m h GLU 44 CO 0.94 0.69 0.00 0.41 -1.00 0.00 0.00 179.01 180.04 2g5m n GLY 45 N -1.34 -1.01 3.77 -3.84 0.00 -1.26 -4.38 105.19 97.14 2g5m n GLY 45 Ca 0.12 0.04 -0.24 0.00 0.00 0.00 0.00 46.02 45.93 2g5m n GLY 45 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2g5m s GLY 46 N -3.26 2.29 0.39 -0.02 0.00 -0.52 -4.96 107.32 101.24 2g5m s GLY 46 Ca 0.04 -2.06 0.08 0.00 0.00 0.00 0.00 44.72 42.78 2g5m s GLY 46 CO 0.26 -1.86 1.98 0.00 0.00 0.00 0.00 173.10 173.48 2g5m h ALA 47 N 1.33 1.80 -0.29 3.20 0.00 -1.67 -2.64 119.26 120.99 2g5m h ALA 47 Ca -0.42 -0.02 -0.10 0.00 0.00 0.00 0.00 54.91 54.36 2g5m h ALA 47 Cb 1.26 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.88 2g5m h ALA 47 CO 0.67 0.10 -0.25 0.00 0.00 0.00 0.00 179.25 179.77 2g5m h ALA 48 N 1.66 1.03 0.16 0.00 0.00 -1.80 0.28 119.26 120.58 2g5m h ALA 48 Ca 0.27 -0.36 -0.31 0.00 0.00 0.00 0.00 54.91 54.52 2g5m h ALA 48 Cb 0.29 -0.13 0.03 0.00 0.00 0.00 0.00 17.79 17.98 2g5m h ALA 48 CO -0.08 0.58 -1.32 1.25 0.00 0.00 0.00 179.25 179.68 2g5m h HIS 49 N 0.50 0.98 -0.53 0.00 6.17 -1.51 0.11 115.15 120.87 2g5m h HIS 49 Ca 0.07 -0.65 -0.11 0.00 0.71 0.00 0.00 60.37 60.39 2g5m h HIS 49 Cb 0.70 -0.07 -0.02 0.00 2.52 0.00 0.00 27.41 30.54 2g5m h HIS 49 CO 0.03 1.49 -0.11 0.00 0.71 0.00 0.00 177.93 180.04 2g5m h ARG 50 N 0.23 1.00 0.03 5.26 3.08 -1.20 -3.15 114.38 119.63 2g5m h ARG 50 Ca -0.21 -0.37 -0.05 0.00 0.07 0.00 0.00 59.98 59.43 2g5m h ARG 50 Cb 1.99 -0.06 0.01 0.00 0.08 0.00 0.00 29.97 31.99 2g5m h ARG 50 CO 0.25 1.05 -0.20 0.22 -1.07 0.00 0.00 179.97 180.22 2g5m h ASP 51 N 0.89 0.12 -0.62 7.04 1.82 -0.53 -3.49 116.42 121.64 2g5m h ASP 51 Ca 0.14 -0.97 0.00 0.00 -0.39 0.00 0.00 57.03 55.81 2g5m h ASP 51 Cb 0.67 -0.04 0.00 0.00 0.68 0.00 0.00 39.33 40.64 2g5m h ASP 51 CO 0.05 1.08 0.00 0.61 -1.61 0.00 0.00 179.24 179.37 2g5m n GLY 52 N 1.56 0.53 0.03 -0.78 0.00 0.33 -5.08 105.19 101.79 2g5m n GLY 52 Ca -0.11 -0.20 0.00 0.00 0.00 0.00 0.00 46.02 45.71 2g5m n GLY 52 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2g5m n ARG 53 N -0.31 0.00 -2.29 1.61 5.12 -0.92 -5.00 116.66 114.87 2g5m n ARG 53 Ca 0.00 0.00 -0.42 0.00 -1.93 0.00 0.00 57.85 55.50 2g5m n ARG 53 Cb 0.15 -0.01 -0.03 0.00 -1.16 0.00 0.00 32.46 31.40 2g5m n ARG 53 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 2g5m s ILE 54 N -0.06 3.48 0.48 0.55 1.01 -1.26 -5.01 121.20 120.39 2g5m s ILE 54 Ca 0.00 1.15 0.08 0.00 0.00 0.00 0.00 60.65 61.88 2g5m s ILE 54 Cb 0.00 -3.74 0.02 0.00 0.01 0.00 0.00 42.46 38.76 2g5m s ILE 54 CO 0.00 0.14 0.54 -1.10 0.00 0.00 0.00 174.94 174.52 2g5m s GLN 55 N 0.36 2.52 0.00 2.79 -0.21 -1.26 -4.80 119.66 119.06 2g5m s GLN 55 Ca 0.58 -1.55 0.23 0.00 0.02 0.00 0.00 55.36 54.64 2g5m s GLN 55 Cb -0.34 -2.51 1.39 0.00 1.00 0.00 0.00 33.01 32.55 2g5m s GLN 55 CO 0.34 -0.45 1.88 1.55 -2.12 0.00 0.00 175.29 176.48 2g5m n VAL 56 N -1.85 0.00 -0.22 1.09 3.14 -1.26 -2.65 118.33 116.59 2g5m n VAL 56 Ca 0.07 0.00 0.01 0.00 -2.96 0.00 0.00 64.34 61.46 2g5m n VAL 56 Cb 0.61 -0.40 0.02 0.00 -1.06 0.00 0.00 33.84 33.01 2g5m n VAL 56 CO 0.00 0.00 0.00 -3.20 -6.46 0.00 0.00 176.83 167.17 2g5m n ASN 57 N -0.88 1.90 -4.94 6.55 4.05 -1.26 -4.58 115.26 116.09 2g5m n ASN 57 Ca 0.18 -2.07 -0.24 0.00 0.45 0.00 0.00 54.58 52.89 2g5m n ASN 57 Cb 0.08 -0.06 0.05 0.00 1.23 0.00 0.00 39.78 41.08 2g5m n ASN 57 CO 0.00 0.00 0.00 -1.81 -3.05 0.00 0.00 177.26 172.40 2g5m s ASP 58 N -1.17 5.21 -0.08 1.20 1.11 -1.08 -3.31 116.67 118.55 2g5m s ASP 58 Ca 0.04 0.32 -0.04 0.00 0.18 0.00 0.00 52.55 53.05 2g5m s ASP 58 Cb 0.04 -1.17 0.04 0.00 1.07 0.00 0.00 42.92 42.89 2g5m s ASP 58 CO 0.00 -1.26 0.18 -0.22 1.18 0.00 0.00 175.17 175.06 2g5m s LEU 59 N -4.96 0.71 -0.85 1.23 2.96 -1.26 -0.65 118.68 115.85 2g5m s LEU 59 Ca 0.57 0.38 -0.22 0.00 -0.22 0.00 0.00 54.13 54.64 2g5m s LEU 59 Cb -0.10 0.52 0.08 0.00 0.50 0.00 0.00 46.19 47.18 2g5m s LEU 59 CO 0.42 -0.14 1.19 -0.76 -1.32 0.00 0.00 176.35 175.74 2g5m s LEU 60 N 1.05 4.16 0.03 -0.68 1.43 -1.09 -3.04 118.68 120.53 2g5m s LEU 60 Ca -0.08 -1.35 -0.16 0.00 -1.03 0.00 0.00 54.13 51.51 2g5m s LEU 60 Cb -0.10 -2.48 -0.36 0.00 0.03 0.00 0.00 46.19 43.29 2g5m s LEU 60 CO -0.06 -1.41 1.00 0.58 0.23 0.00 0.00 176.35 176.69 2g5m h VAL 61 N 6.16 1.28 -2.67 -1.59 2.07 -1.57 -3.44 116.25 116.49 2g5m h VAL 61 Ca -0.02 -2.70 -0.03 0.00 0.82 0.00 0.00 66.70 64.77 2g5m h VAL 61 Cb 1.04 3.04 -0.14 0.00 -1.52 0.00 0.00 31.29 33.71 2g5m h VAL 61 CO 1.24 0.81 0.20 -1.83 0.02 0.00 0.00 177.57 178.02 2g5m s GLU 62 N -2.60 1.21 0.22 1.57 -1.05 -1.20 -1.18 118.70 115.68 2g5m s GLU 62 Ca -0.09 -0.23 0.03 0.00 -0.15 0.00 0.00 54.97 54.53 2g5m s GLU 62 Cb 0.04 0.56 0.03 0.00 -0.44 0.00 0.00 34.13 34.32 2g5m s GLU 62 CO 0.95 -0.48 0.28 1.55 0.95 0.00 0.00 175.26 178.50 2g5m n VAL 63 N 0.04 0.00 -0.12 1.83 3.14 -0.10 -0.90 118.33 122.23 2g5m n VAL 63 Ca -0.18 -0.77 -0.05 0.00 -2.96 0.00 0.00 64.34 60.39 2g5m n VAL 63 Cb 0.62 -0.71 0.03 0.00 -1.06 0.00 0.00 33.84 32.72 2g5m n VAL 63 CO 0.00 0.00 0.00 -0.78 -6.46 0.00 0.00 176.83 169.59 2g5m h ASP 64 N 0.08 -0.14 0.00 6.55 3.58 -0.94 -3.38 116.42 122.17 2g5m h ASP 64 Ca -0.11 0.09 0.00 0.00 0.42 0.00 0.00 57.03 57.43 2g5m h ASP 64 Cb 0.48 0.15 0.00 0.00 1.72 0.00 0.00 39.33 41.69 2g5m h ASP 64 CO 0.16 -0.03 -0.89 0.61 -2.88 0.00 0.00 179.24 176.21 2g5m n GLY 65 N -1.27 -0.49 3.71 -0.78 0.00 -1.26 -4.98 105.19 100.12 2g5m n GLY 65 Ca 0.03 -0.29 -0.42 0.00 0.00 0.00 0.00 46.02 45.33 2g5m n GLY 65 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2g5m s THR 66 N -2.79 4.52 -0.24 2.61 2.01 -1.26 -5.02 115.64 115.46 2g5m s THR 66 Ca -0.26 1.81 -0.16 0.00 0.31 0.00 0.00 61.69 63.39 2g5m s THR 66 Cb 0.04 -4.16 -0.04 0.00 0.01 0.00 0.00 72.50 68.35 2g5m s THR 66 CO 0.38 0.13 0.42 -0.44 -0.69 0.00 0.00 174.62 174.42 2g5m s SER 67 N 1.05 6.36 -0.41 3.53 0.01 -1.26 -0.92 113.70 122.06 2g5m s SER 67 Ca 0.55 0.42 -0.22 0.00 1.31 0.00 0.00 55.95 58.00 2g5m s SER 67 Cb -0.24 -2.23 0.02 0.00 0.21 0.00 0.00 66.02 63.77 2g5m s SER 67 CO 0.28 -0.17 0.75 -0.76 0.41 0.00 0.00 173.24 173.74 2g5m s LEU 68 N 1.86 4.25 0.21 2.44 1.43 -0.32 -4.86 118.68 123.68 2g5m s LEU 68 Ca 0.18 0.03 0.18 0.00 -1.03 0.00 0.00 54.13 53.49 2g5m s LEU 68 Cb -0.15 -2.93 0.01 0.00 0.03 0.00 0.00 46.19 43.15 2g5m s LEU 68 CO 0.09 -0.80 1.17 0.58 0.23 0.00 0.00 176.35 177.61 2g5m h VAL 69 N 5.86 0.46 0.00 -1.59 2.07 -1.94 -3.42 116.25 117.69 2g5m h VAL 69 Ca -0.25 -1.75 0.00 0.00 0.82 0.00 0.00 66.70 65.52 2g5m h VAL 69 Cb 1.09 2.05 0.00 0.00 -1.52 0.00 0.00 31.29 32.91 2g5m h VAL 69 CO 0.92 0.26 0.00 0.61 0.02 0.00 0.00 177.57 179.38 2g5m n GLY 70 N 1.26 -0.74 3.94 2.17 0.00 -1.26 -4.49 105.19 106.06 2g5m n GLY 70 Ca -0.02 0.18 -0.26 0.00 0.00 0.00 0.00 46.02 45.92 2g5m n GLY 70 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2g5m s VAL 71 N 0.00 2.21 0.68 1.61 -7.23 -1.26 -3.70 120.40 112.71 2g5m s VAL 71 Ca 0.00 -0.26 -0.13 0.00 -1.81 0.00 0.00 61.98 59.78 2g5m s VAL 71 Cb 0.00 -2.95 0.01 0.00 0.56 0.00 0.00 36.38 34.00 2g5m s VAL 71 CO 0.00 0.00 1.08 0.42 -0.31 0.00 0.00 175.10 176.29 2g5m s THR 72 N -3.34 3.53 0.28 5.32 -4.23 -1.26 -4.69 115.64 111.26 2g5m s THR 72 Ca 0.63 0.61 -0.01 0.00 -1.18 0.00 0.00 61.69 61.74 2g5m s THR 72 Cb -0.09 -3.17 0.28 0.00 1.34 0.00 0.00 72.50 70.86 2g5m s THR 72 CO 0.46 -0.54 1.90 -0.61 -0.54 0.00 0.00 174.62 175.29 2g5m h GLN 73 N -0.33 1.09 -0.38 3.99 4.15 -1.96 0.28 115.11 121.95 2g5m h GLN 73 Ca -0.45 -0.07 -0.12 0.00 0.77 0.00 0.00 58.65 58.78 2g5m h GLN 73 Cb 1.23 -0.25 -0.01 0.00 0.21 0.00 0.00 27.48 28.66 2g5m h GLN 73 CO 0.55 0.72 -0.26 1.03 -1.93 0.00 0.00 178.83 178.94 2g5m h SER 74 N 1.12 0.81 -0.27 -0.69 0.87 -1.98 -0.68 113.55 112.72 2g5m h SER 74 Ca 0.41 -0.31 -0.05 0.00 -1.23 0.00 0.00 61.79 60.62 2g5m h SER 74 Cb 0.17 -0.22 -0.01 0.00 -0.44 0.00 0.00 62.40 61.90 2g5m h SER 74 CO -0.16 1.03 -0.01 0.15 -0.53 0.00 0.00 176.83 177.30 2g5m h PHE 75 N 0.68 0.54 -0.56 2.24 3.04 -1.62 -0.11 116.94 121.15 2g5m h PHE 75 Ca 0.09 -0.10 -0.01 0.00 3.98 0.00 0.00 57.97 61.93 2g5m h PHE 75 Cb 0.78 -0.14 -0.03 0.00 2.56 0.00 0.00 35.95 39.12 2g5m h PHE 75 CO 0.04 0.65 0.32 0.00 -2.02 0.00 0.00 178.31 177.31 2g5m h ALA 76 N 0.81 0.71 -0.36 2.41 0.00 -0.83 0.18 119.26 122.19 2g5m h ALA 76 Ca 0.08 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 2g5m h ALA 76 Cb 0.45 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 2g5m h ALA 76 CO 0.02 0.21 0.13 0.00 0.00 0.00 0.00 179.25 179.61 2g5m h ALA 77 N 1.15 1.55 0.00 0.00 0.00 -0.89 -2.21 119.26 118.86 2g5m h ALA 77 Ca 0.20 -0.11 -0.16 0.00 0.00 0.00 0.00 54.91 54.84 2g5m h ALA 77 Cb 0.01 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 2g5m h ALA 77 CO -0.03 0.35 -0.74 0.77 0.00 0.00 0.00 179.25 179.59 2g5m h SER 78 N 0.51 0.00 0.41 0.00 0.02 -0.24 -3.25 113.55 111.01 2g5m h SER 78 Ca 0.13 0.00 -0.14 0.00 -0.84 0.00 0.00 61.79 60.94 2g5m h SER 78 Cb 0.13 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.66 2g5m h SER 78 CO -0.01 0.74 -0.58 1.62 -1.14 0.00 0.00 176.83 177.46 2g5m h VAL 79 N 0.00 1.39 0.00 2.27 3.04 -0.03 0.77 116.25 123.68 2g5m h VAL 79 Ca -0.01 -1.93 -0.06 0.00 -1.01 0.00 0.00 66.70 63.69 2g5m h VAL 79 Cb 1.54 1.99 -0.01 0.00 -2.01 0.00 0.00 31.29 32.79 2g5m h VAL 79 CO 0.10 0.57 -0.28 -0.07 -1.01 0.00 0.00 177.57 176.87 2g5m h LEU 80 N 0.13 0.00 0.00 3.16 3.38 -1.56 -1.62 115.31 118.80 2g5m h LEU 80 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2g5m h LEU 80 Cb 1.05 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.80 2g5m h LEU 80 CO 0.09 0.28 -0.90 0.54 0.09 0.00 0.00 178.44 178.53 2g5m n ARG 81 N -4.12 0.42 0.05 1.13 1.74 -0.50 -3.89 116.66 111.48 2g5m n ARG 81 Ca -0.02 0.07 0.12 0.00 -0.77 0.00 0.00 57.85 57.25 2g5m n ARG 81 Cb 0.34 -1.71 0.12 0.00 -1.02 0.00 0.00 32.46 30.19 2g5m n ARG 81 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 2g5m n ASN 82 N -2.29 0.66 -4.88 0.55 3.02 0.15 -4.92 115.26 107.55 2g5m n ASN 82 Ca 0.01 -0.00 -0.23 0.00 -0.03 0.00 0.00 54.58 54.33 2g5m n ASN 82 Cb 0.48 0.38 0.06 0.00 -0.61 0.00 0.00 39.78 40.10 2g5m n ASN 82 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 2g5m s THR 83 N -3.17 2.44 1.30 3.41 -4.23 -0.66 -5.07 115.64 109.65 2g5m s THR 83 Ca 0.05 -0.53 -0.22 0.00 -1.18 0.00 0.00 61.69 59.82 2g5m s THR 83 Cb 0.14 -2.91 0.34 0.00 1.34 0.00 0.00 72.50 71.41 2g5m s THR 83 CO 0.75 0.00 0.77 0.29 -0.54 0.00 0.00 174.62 175.89 2g5m n LYS 84 N -2.63 -4.53 0.10 3.99 5.02 -1.26 -4.96 118.16 113.88 2g5m n LYS 84 Ca 0.10 -1.30 -0.13 0.00 -2.02 0.00 0.00 58.31 54.96 2g5m n LYS 84 Cb 0.60 -1.67 -0.08 0.00 -0.02 0.00 0.00 35.03 33.86 2g5m n LYS 84 CO 0.00 0.00 0.00 0.78 -0.52 0.00 0.00 177.40 177.66 2g5m h GLY 85 N -3.31 -0.23 -6.83 0.72 0.00 -1.94 -3.41 103.07 88.08 2g5m h GLY 85 Ca -0.35 0.09 -0.67 0.00 0.00 0.00 0.00 47.33 46.40 2g5m h GLY 85 CO 0.21 -0.08 -0.76 -1.60 0.00 0.00 0.00 176.54 174.31 2g5m s ARG 86 N -5.26 3.05 0.12 4.80 3.52 -1.26 -0.51 118.95 123.41 2g5m s ARG 86 Ca -0.15 -0.83 0.04 0.00 -0.13 0.00 0.00 55.73 54.66 2g5m s ARG 86 Cb 0.04 -2.93 -0.04 0.00 -1.56 0.00 0.00 34.95 30.46 2g5m s ARG 86 CO 0.63 -0.30 -0.10 0.14 -0.81 0.00 0.00 175.30 174.85 2g5m s VAL 87 N 1.37 1.07 0.13 7.11 -7.23 -0.63 -4.98 120.40 117.25 2g5m s VAL 87 Ca 0.03 -1.85 0.06 0.00 -1.81 0.00 0.00 61.98 58.40 2g5m s VAL 87 Cb -0.15 -1.61 -0.04 0.00 0.56 0.00 0.00 36.38 35.14 2g5m s VAL 87 CO -0.05 -0.64 0.04 -0.13 -0.31 0.00 0.00 175.10 174.00 2g5m s ARG 88 N -3.26 2.60 0.20 4.82 0.52 -1.26 -1.25 118.95 121.32 2g5m s ARG 88 Ca 0.11 -0.92 0.02 0.00 -0.52 0.00 0.00 55.73 54.42 2g5m s ARG 88 Cb -0.00 -2.52 -0.05 0.00 0.52 0.00 0.00 34.95 32.90 2g5m s ARG 88 CO 0.00 0.50 0.00 -0.06 0.02 0.00 0.00 175.30 175.77 2g5m s PHE 89 N -1.55 1.35 -0.24 -0.53 0.08 0.16 -0.19 117.98 117.05 2g5m s PHE 89 Ca 0.28 -0.99 -0.03 0.00 0.12 0.00 0.00 56.93 56.30 2g5m s PHE 89 Cb -0.11 -0.77 0.01 0.00 -0.57 0.00 0.00 43.02 41.58 2g5m s PHE 89 CO 0.20 -0.15 -0.04 -1.64 -0.10 0.00 0.00 175.22 173.49 2g5m s MET 90 N -3.90 3.12 -0.16 0.44 -1.94 -0.08 -0.54 119.30 116.24 2g5m s MET 90 Ca 0.26 -0.80 -0.07 0.00 -1.71 0.00 0.00 55.69 53.37 2g5m s MET 90 Cb 0.06 -3.04 -0.04 0.00 2.01 0.00 0.00 34.83 33.81 2g5m s MET 90 CO 0.06 -0.31 0.08 0.42 -0.01 0.00 0.00 175.02 175.26 2g5m s ILE 91 N 1.42 4.95 -0.54 2.53 1.09 0.57 -1.45 121.20 129.78 2g5m s ILE 91 Ca 0.03 0.02 -0.02 0.00 -1.10 0.00 0.00 60.65 59.58 2g5m s ILE 91 Cb -0.16 -3.20 0.14 0.00 -1.06 0.00 0.00 42.46 38.18 2g5m s ILE 91 CO -0.03 0.51 0.33 -0.83 -0.10 0.00 0.00 174.94 174.82 2g5m s GLY 92 N -0.06 2.31 0.02 6.18 0.00 -1.17 -0.72 107.32 113.88 2g5m s GLY 92 Ca 0.07 -3.00 -0.30 0.00 0.00 0.00 0.00 44.72 41.49 2g5m s GLY 92 CO 0.01 1.06 1.35 -1.60 0.00 0.00 0.00 173.10 173.92 2g5m s ARG 93 N 0.34 4.32 -1.28 2.90 3.52 -0.38 -4.16 118.95 124.21 2g5m s ARG 93 Ca 0.14 1.93 -0.12 0.00 -0.13 0.00 0.00 55.73 57.55 2g5m s ARG 93 Cb -0.22 -3.48 0.15 0.00 -1.56 0.00 0.00 34.95 29.84 2g5m s ARG 93 CO -0.03 -0.49 1.76 -1.91 -0.81 0.00 0.00 175.30 173.81 2g5m n GLU 94 N 4.90 3.42 0.33 5.12 4.07 -1.21 -2.17 120.64 135.10 2g5m n GLU 94 Ca 0.12 -3.52 -0.18 0.00 -0.06 0.00 0.00 57.16 53.52 2g5m n GLU 94 Cb 0.44 -3.05 -0.10 0.00 -0.06 0.00 0.00 31.44 28.67 2g5m n GLU 94 CO 0.00 0.00 0.00 -0.09 -0.06 0.00 0.00 177.13 176.98 2g5m h ARG 95 N 6.39 -0.99 -6.06 5.31 2.43 -1.77 -3.41 114.38 116.27 2g5m h ARG 95 Ca 0.39 0.07 -0.58 0.00 -0.81 0.00 0.00 59.98 59.05 2g5m h ARG 95 Cb 0.73 0.23 0.00 0.00 -0.42 0.00 0.00 29.97 30.51 2g5m h ARG 95 CO 1.51 -0.66 1.44 -1.25 -1.51 0.00 0.00 179.97 179.50 2g5m s PRO 96 N -5.91 3.32 0.05 0.20 0.04 -1.26 -3.31 135.00 128.11 2g5m s PRO 96 Ca -0.18 2.13 0.00 0.00 0.04 0.00 0.00 61.00 62.99 2g5m s PRO 96 Cb 0.04 -4.33 0.00 0.00 0.04 0.00 0.00 34.50 30.25 2g5m s PRO 96 CO 0.61 -1.90 0.00 0.41 0.04 0.00 0.00 177.00 176.16 2g5m n GLY 97 N 5.53 -1.39 3.40 0.56 0.00 -1.26 -4.94 105.19 107.10 2g5m n GLY 97 Ca 0.28 0.56 -0.45 0.00 0.00 0.00 0.00 46.02 46.41 2g5m n GLY 97 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2g5m s GLU 98 N -2.00 3.83 0.05 1.61 2.02 -1.21 -3.92 118.70 119.09 2g5m s GLU 98 Ca 0.00 -2.40 0.00 0.00 0.02 0.00 0.00 54.97 52.59 2g5m s GLU 98 Cb 0.00 -4.76 0.00 0.00 0.10 0.00 0.00 34.13 29.47 2g5m s GLU 98 CO 0.00 -1.55 0.00 0.94 0.02 0.00 0.00 175.26 174.67 2g5m n GLN 99 N 4.97 0.00 -2.10 1.61 -0.06 -1.26 -5.06 117.38 115.48 2g5m n GLN 99 Ca 0.24 0.00 -0.24 0.00 -2.00 0.00 0.00 57.00 55.00 2g5m n GLN 99 Cb 0.45 0.00 0.15 0.00 -4.06 0.00 0.00 30.24 26.78 2g5m n GLN 99 CO 0.00 0.00 0.00 0.43 -0.20 0.00 0.00 177.06 177.29 2g5m n SER 100 N -2.61 0.67 -3.19 1.69 7.64 -1.25 -4.68 113.62 111.88 2g5m n SER 100 Ca 0.00 -1.75 -0.10 0.00 1.01 0.00 0.00 58.87 58.02 2g5m n SER 100 Cb 0.00 -0.78 0.01 0.00 -1.01 0.00 0.00 64.21 62.43 2g5m n SER 100 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2g5m n GLU 101 N -3.18 -1.69 -4.26 1.43 -0.58 -1.26 -4.86 120.64 106.25 2g5m n GLU 101 Ca 0.15 1.51 -0.15 0.00 -0.42 0.00 0.00 57.16 58.26 2g5m n GLU 101 Cb 0.54 -4.73 -0.10 0.00 -0.57 0.00 0.00 31.44 26.58 2g5m n GLU 101 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 2g5m s VAL 102 N -2.75 0.19 -0.14 2.62 0.11 -1.26 -4.92 120.40 114.24 2g5m s VAL 102 Ca 0.10 -2.00 -0.02 0.00 -2.93 0.00 0.00 61.98 57.13 2g5m s VAL 102 Cb -0.02 -2.54 0.00 0.00 -1.53 0.00 0.00 36.38 32.29 2g5m s VAL 102 CO 0.80 0.00 0.08 0.00 -3.33 0.00 0.00 175.10 172.64 2g5m n ALA 103 N -0.39 -3.14 -2.85 1.54 0.00 -1.26 -4.79 120.51 109.62 2g5m n ALA 103 Ca 0.02 0.29 -0.02 0.00 0.00 0.00 0.00 53.44 53.73 2g5m n ALA 103 Cb 0.66 -0.77 0.00 0.00 0.00 0.00 0.00 19.45 19.34 2g5m n ALA 103 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2g5m n GLN 104 N 0.07 -2.75 -1.97 0.00 6.02 -1.26 -4.69 117.38 112.79 2g5m n GLN 104 Ca 0.02 2.32 -0.39 0.00 -0.01 0.00 0.00 57.00 58.93 2g5m n GLN 104 Cb 0.06 -4.53 -0.03 0.00 1.02 0.00 0.00 30.24 26.76 2g5m n GLN 104 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 2g5m n LEU 105 N 0.67 4.80 0.16 1.08 4.77 -1.26 -1.76 117.00 125.46 2g5m n LEU 105 Ca 0.01 -3.60 0.00 0.00 -0.03 0.00 0.00 56.01 52.39 2g5m n LEU 105 Cb 0.17 -1.60 0.00 0.00 -2.33 0.00 0.00 43.42 39.66 2g5m n LEU 105 CO 0.37 -0.18 0.00 -0.38 -1.33 0.00 0.00 177.39 175.87 2g5m n ILE 106 N 6.33 0.00 -3.54 -0.08 2.08 -1.26 -5.09 119.36 117.80 2g5m n ILE 106 Ca 0.49 0.00 -0.20 0.00 0.56 0.00 0.00 62.75 63.60 2g5m n ILE 106 Cb 0.43 -0.23 0.02 0.00 -0.75 0.00 0.00 39.64 39.11 2g5m n ILE 106 CO 0.00 0.00 0.00 1.67 0.56 0.00 0.00 176.55 178.78 2g5m n GLN 107 N -3.27 -1.34 0.06 0.38 7.27 -0.72 -4.90 117.38 114.85 2g5m n GLN 107 Ca 0.00 0.85 0.08 0.00 0.07 0.00 0.00 57.00 58.00 2g5m n GLN 107 Cb 0.00 -4.03 -0.06 0.00 2.41 0.00 0.00 30.24 28.56 2g5m n GLN 107 CO 0.00 0.00 0.00 0.94 0.07 0.00 0.00 177.06 178.07 2g5m n GLN 108 N -3.02 0.62 -2.80 3.69 7.27 -1.26 -4.47 117.38 117.42 2g5m n GLN 108 Ca -0.14 0.07 -0.25 0.00 0.07 0.00 0.00 57.00 56.76 2g5m n GLN 108 Cb 0.60 -1.75 0.01 0.00 2.41 0.00 0.00 30.24 31.51 2g5m n GLN 108 CO 0.00 0.00 0.00 -0.08 0.07 0.00 0.00 177.06 177.05 2g5m s THR 109 N -3.28 4.21 0.00 1.69 -1.32 -1.26 -4.63 115.64 111.06 2g5m s THR 109 Ca -0.03 -0.21 0.00 0.00 -1.21 0.00 0.00 61.69 60.24 2g5m s THR 109 Cb 0.10 -3.59 0.00 0.00 -1.51 0.00 0.00 72.50 67.50 2g5m s THR 109 CO 0.82 -0.50 0.00 0.18 -2.21 0.00 0.00 174.62 172.91 2g5m n LEU 110 N -2.22 0.00 0.00 9.08 4.77 -1.26 -4.81 117.00 122.55 2g5m n LEU 110 Ca 0.01 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.99 2g5m n LEU 110 Cb 0.57 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.66 2g5m n LEU 110 CO 0.50 0.00 0.00 1.21 -1.33 0.00 0.00 177.39 177.77 2g5m n GLU 111 N 0.00 0.00 -3.94 3.23 2.13 -1.26 -4.58 120.64 116.22 2g5m n GLU 111 Ca 0.00 0.00 -0.31 0.00 0.66 0.00 0.00 57.16 57.51 2g5m n GLU 111 Cb 0.00 -0.02 -0.15 0.00 0.27 0.00 0.00 31.44 31.54 2g5m n GLU 111 CO 0.00 0.00 0.00 -1.14 -0.41 0.00 0.00 177.13 175.58 2g5m s GLN 112 N 0.00 1.31 0.00 5.31 2.00 -1.26 -5.15 119.66 121.87 2g5m s GLN 112 Ca 0.00 -1.58 0.28 0.00 -2.00 0.00 0.00 55.36 52.05 2g5m s GLN 112 Cb 0.00 -2.83 1.00 0.00 0.80 0.00 0.00 33.01 31.98 2g5m s GLN 112 CO 0.00 -0.92 1.71 -1.91 -0.50 0.00 0.00 175.29 173.68