#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 -0.13 -3.13 1.61 -0.00 -2.03 -3.41 115.15 108.06 2g5m h HIS 2 Ca 0.00 -0.00 -0.60 0.00 -0.00 0.00 0.00 60.37 59.77 2g5m h HIS 2 Cb 0.00 0.04 -0.07 0.00 -0.00 0.00 0.00 27.41 27.38 2g5m h HIS 2 CO 0.00 0.26 -0.25 0.00 -0.00 0.00 0.00 177.93 177.94 2g5m s MET 3 N -4.44 4.06 -0.64 5.26 0.00 -1.26 -4.27 119.30 118.01 2g5m s MET 3 Ca -0.15 0.28 -0.22 0.00 0.00 0.00 0.00 55.69 55.60 2g5m s MET 3 Cb 0.02 -3.32 0.08 0.00 0.00 0.00 0.00 34.83 31.61 2g5m s MET 3 CO 0.61 0.46 0.89 -1.21 0.00 0.00 0.00 175.02 175.78 2g5m s GLU 4 N -0.27 3.09 -0.91 3.16 2.02 0.64 -4.86 118.70 121.56 2g5m s GLU 4 Ca 0.21 -0.96 -0.18 0.00 0.02 0.00 0.00 54.97 54.07 2g5m s GLU 4 Cb -0.15 -4.24 0.15 0.00 0.10 0.00 0.00 34.13 29.99 2g5m s GLU 4 CO 0.09 -1.74 1.06 -0.51 0.02 0.00 0.00 175.26 174.19 2g5m s LEU 5 N 3.69 5.36 0.03 1.80 2.01 -1.25 -1.07 118.68 129.26 2g5m s LEU 5 Ca 0.19 -2.17 0.09 0.00 0.01 0.00 0.00 54.13 52.25 2g5m s LEU 5 Cb -0.19 -2.36 -0.03 0.00 0.01 0.00 0.00 46.19 43.62 2g5m s LEU 5 CO 0.09 -0.97 -0.25 0.72 1.01 0.00 0.00 176.35 176.95 2g5m s PHE 6 N 2.22 2.38 0.26 0.29 -0.12 -0.02 -4.93 117.98 118.06 2g5m s PHE 6 Ca 0.30 -0.38 -0.30 0.00 -0.05 0.00 0.00 56.93 56.50 2g5m s PHE 6 Cb -0.06 -1.42 -0.09 0.00 -0.63 0.00 0.00 43.02 40.82 2g5m s PHE 6 CO -0.09 0.13 1.08 -1.25 -0.05 0.00 0.00 175.22 175.04 2g5m s PRO 7 N -1.19 4.66 -0.10 1.99 0.04 -1.26 -0.23 135.00 138.91 2g5m s PRO 7 Ca 0.12 1.76 0.01 0.00 0.04 0.00 0.00 61.00 62.92 2g5m s PRO 7 Cb -0.10 -3.21 0.02 0.00 0.04 0.00 0.00 34.50 31.25 2g5m s PRO 7 CO 0.02 0.23 -0.10 0.08 0.04 0.00 0.00 177.00 177.27 2g5m s VAL 8 N -1.05 1.16 -0.19 -0.36 1.01 0.54 -4.90 120.40 116.62 2g5m s VAL 8 Ca 0.45 -0.41 -0.08 0.00 0.00 0.00 0.00 61.98 61.93 2g5m s VAL 8 Cb -0.31 -1.12 -0.04 0.00 0.00 0.00 0.00 36.38 34.91 2g5m s VAL 8 CO 0.39 0.38 0.07 -0.70 0.00 0.00 0.00 175.10 175.25 2g5m s GLU 9 N 1.32 4.00 0.14 2.72 2.12 -1.26 -0.13 118.70 127.61 2g5m s GLU 9 Ca -0.02 -0.33 -0.04 0.00 0.36 0.00 0.00 54.97 54.94 2g5m s GLU 9 Cb -0.14 -3.25 -0.03 0.00 0.26 0.00 0.00 34.13 30.98 2g5m s GLU 9 CO -0.05 0.26 0.14 -0.51 -0.54 0.00 0.00 175.26 174.57 2g5m s LEU 10 N 0.41 1.46 0.17 2.70 1.43 -0.89 -4.85 118.68 119.11 2g5m s LEU 10 Ca 0.04 -1.09 0.01 0.00 -1.03 0.00 0.00 54.13 52.07 2g5m s LEU 10 Cb -0.12 0.63 -0.05 0.00 0.03 0.00 0.00 46.19 46.68 2g5m s LEU 10 CO 0.00 -0.79 0.01 -1.83 0.23 0.00 0.00 176.35 173.97 2g5m s GLU 11 N -4.02 1.09 0.63 1.70 -1.05 -1.26 -1.48 118.70 114.31 2g5m s GLU 11 Ca 0.22 -1.53 -0.09 0.00 -0.15 0.00 0.00 54.97 53.42 2g5m s GLU 11 Cb 0.06 -0.19 -0.00 0.00 -0.44 0.00 0.00 34.13 33.55 2g5m s GLU 11 CO 0.01 -0.15 1.00 0.15 0.95 0.00 0.00 175.26 177.22 2g5m s LYS 12 N -3.94 3.10 0.00 -4.83 -0.14 -0.18 -4.42 119.74 109.34 2g5m s LYS 12 Ca 0.24 0.37 0.00 0.00 -1.36 0.00 0.00 55.97 55.23 2g5m s LYS 12 Cb 0.06 -2.14 0.00 0.00 -1.68 0.00 0.00 37.83 34.08 2g5m s LYS 12 CO 0.04 -0.76 0.00 -0.25 -0.76 0.00 0.00 175.35 173.62 2g5m n ASP 13 N -2.76 1.09 0.17 2.83 9.92 -1.26 -4.85 116.55 121.68 2g5m n ASP 13 Ca 0.05 0.00 0.05 0.00 -0.53 0.00 0.00 54.79 54.36 2g5m n ASP 13 Cb 0.56 0.00 0.23 0.00 -0.64 0.00 0.00 41.12 41.27 2g5m n ASP 13 CO 0.00 0.00 0.00 -1.28 0.13 0.00 0.00 177.20 176.05 2g5m h SER 14 N 0.00 0.00 0.00 -2.24 0.87 -1.99 -3.34 113.55 106.85 2g5m h SER 14 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 2g5m h SER 14 Cb 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 61.96 2g5m h SER 14 CO 0.00 0.41 -0.31 -0.08 -0.53 0.00 0.00 176.83 176.32 2g5m h GLU 15 N 0.00 0.00 0.00 2.24 4.81 -1.93 -3.50 114.58 116.19 2g5m h GLU 15 Ca -0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2g5m h GLU 15 Cb 1.08 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.46 2g5m h GLU 15 CO 0.05 0.00 0.00 0.41 -0.73 0.00 0.00 179.01 178.74 2g5m n GLY 16 N 1.69 0.66 0.21 1.92 0.00 -1.26 -5.12 105.19 103.29 2g5m n GLY 16 Ca -0.04 -0.54 0.03 0.00 0.00 0.00 0.00 46.02 45.47 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 -0.12 -3.23 0.99 4.32 -1.26 -4.85 117.00 112.84 2g5m n LEU 17 Ca 0.00 0.28 -0.24 0.00 -0.02 0.00 0.00 56.01 56.04 2g5m n LEU 17 Cb 0.00 -0.68 -0.07 0.00 -1.62 0.00 0.00 43.42 41.05 2g5m n LEU 17 CO 0.00 -0.47 -0.27 0.61 -1.22 0.00 0.00 177.39 176.04 2g5m n GLY 18 N -2.50 2.28 2.81 -0.72 0.00 -1.26 -4.09 105.19 101.71 2g5m n GLY 18 Ca -0.00 -1.29 -0.08 0.00 0.00 0.00 0.00 46.02 44.65 2g5m n GLY 18 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2g5m n ILE 19 N 2.06 0.00 -3.76 -0.61 -5.35 -1.26 -0.93 119.36 109.51 2g5m n ILE 19 Ca 0.24 -0.89 -0.13 0.00 -0.27 0.00 0.00 62.75 61.70 2g5m n ILE 19 Cb 0.52 0.78 -0.10 0.00 -1.74 0.00 0.00 39.64 39.09 2g5m n ILE 19 CO 0.00 0.00 0.00 -0.55 -1.76 0.00 0.00 176.55 174.24 2g5m s SER 20 N -2.60 -0.30 0.14 7.28 0.15 -0.35 -4.71 113.70 113.30 2g5m s SER 20 Ca 0.14 0.52 0.06 0.00 0.70 0.00 0.00 55.95 57.37 2g5m s SER 20 Cb -0.03 0.58 -0.04 0.00 -1.71 0.00 0.00 66.02 64.82 2g5m s SER 20 CO 0.11 -0.19 0.02 0.27 1.20 0.00 0.00 173.24 174.65 2g5m s ILE 21 N -0.18 3.96 -0.03 6.45 -4.36 -1.26 0.58 121.20 126.37 2g5m s ILE 21 Ca -0.03 -1.20 0.03 0.00 -0.26 0.00 0.00 60.65 59.19 2g5m s ILE 21 Cb -0.03 -2.96 -0.00 0.00 1.25 0.00 0.00 42.46 40.72 2g5m s ILE 21 CO 0.01 -0.02 -0.12 -0.51 0.24 0.00 0.00 174.94 174.54 2g5m s ILE 22 N -1.57 1.04 -0.65 8.37 1.10 0.68 -4.67 121.20 125.50 2g5m s ILE 22 Ca 0.27 -0.51 -0.18 0.00 -0.51 0.00 0.00 60.65 59.73 2g5m s ILE 22 Cb -0.10 -0.90 0.12 0.00 0.15 0.00 0.00 42.46 41.73 2g5m s ILE 22 CO 0.19 0.31 0.72 -0.83 -2.11 0.00 0.00 174.94 173.23 2g5m s GLY 23 N 0.08 1.94 -0.14 1.50 0.00 -1.26 -1.89 107.32 107.55 2g5m s GLY 23 Ca -0.02 -2.46 -0.02 0.00 0.00 0.00 0.00 44.72 42.21 2g5m s GLY 23 CO 0.01 1.53 -0.07 -3.16 0.00 0.00 0.00 173.10 171.41 2g5m s MET 24 N 2.22 3.53 0.00 2.90 0.23 -0.10 -4.99 119.30 123.09 2g5m s MET 24 Ca 0.13 -0.57 0.00 0.00 -1.03 0.00 0.00 55.69 54.22 2g5m s MET 24 Cb -0.21 -2.81 0.00 0.00 -1.53 0.00 0.00 34.83 30.28 2g5m s MET 24 CO 0.02 0.26 0.00 0.41 -2.03 0.00 0.00 175.02 173.69 2g5m n GLY 25 N 3.44 2.66 2.41 3.16 0.00 -1.26 -1.26 105.19 114.33 2g5m n GLY 25 Ca -0.18 0.04 -0.18 0.00 0.00 0.00 0.00 46.02 45.70 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 -3.00 -0.46 -0.55 4.61 0.00 -1.26 -4.85 120.51 115.00 2g5m n ALA 26 Ca 0.00 0.20 0.00 0.00 0.00 0.00 0.00 53.44 53.64 2g5m n ALA 26 Cb 0.00 -1.96 0.00 0.00 0.00 0.00 0.00 19.45 17.49 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 -0.92 0.10 3.14 0.00 0.00 -1.26 -4.97 105.19 101.28 2g5m n GLY 27 Ca -0.21 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.43 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 -2.31 3.69 -0.03 4.61 0.00 -1.26 -4.82 121.76 121.64 2g5m s ALA 28 Ca 0.00 -3.29 -0.00 0.00 0.00 0.00 0.00 51.96 48.67 2g5m s ALA 28 Cb 0.00 -2.84 -0.26 0.00 0.00 0.00 0.00 23.12 20.02 2g5m s ALA 28 CO 0.00 -2.15 0.71 0.38 0.00 0.00 0.00 175.76 174.71 2g5m h ASP 29 N 7.16 0.30 0.00 0.00 2.03 -1.93 -3.29 116.42 120.69 2g5m h ASP 29 Ca 0.01 -0.50 0.00 0.00 -0.73 0.00 0.00 57.03 55.81 2g5m h ASP 29 Cb 0.97 -0.10 0.00 0.00 -0.83 0.00 0.00 39.33 39.37 2g5m h ASP 29 CO 0.72 1.43 0.00 1.15 -1.03 0.00 0.00 179.24 181.51 2g5m n MET 30 N -3.36 0.80 -1.23 4.15 0.00 -1.26 -1.25 117.12 114.96 2g5m n MET 30 Ca -0.20 0.00 -0.30 0.00 0.00 0.00 0.00 57.70 57.20 2g5m n MET 30 Cb 1.04 -1.39 0.08 0.00 0.00 0.00 0.00 33.22 32.96 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 0.54 5.39 2.16 3.17 0.00 -1.24 -4.79 105.19 110.41 2g5m n GLY 31 Ca 0.15 -1.94 -0.07 0.00 0.00 0.00 0.00 46.02 44.15 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 -0.73 -1.14 -2.72 0.99 4.32 -1.15 -2.66 117.00 113.91 2g5m n LEU 32 Ca 0.57 0.04 -0.19 0.00 -0.02 0.00 0.00 56.01 56.40 2g5m n LEU 32 Cb 0.77 -1.35 0.00 0.00 -1.62 0.00 0.00 43.42 41.22 2g5m n LEU 32 CO 0.70 -0.15 -0.13 -0.62 -1.22 0.00 0.00 177.39 175.97 2g5m n GLU 33 N -1.97 -2.99 -1.96 3.23 1.02 -0.38 -4.67 120.64 112.93 2g5m n GLU 33 Ca -0.08 0.80 -0.24 0.00 -0.02 0.00 0.00 57.16 57.61 2g5m n GLU 33 Cb 0.49 -5.51 -0.06 0.00 -0.02 0.00 0.00 31.44 26.34 2g5m n GLU 33 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 2g5m s LYS 34 N -5.37 2.34 0.46 3.49 -0.14 -1.09 -3.52 119.74 115.92 2g5m s LYS 34 Ca 0.14 -0.27 -0.06 0.00 -1.36 0.00 0.00 55.97 54.43 2g5m s LYS 34 Cb -0.07 -5.04 -0.04 0.00 -1.68 0.00 0.00 37.83 31.01 2g5m s LYS 34 CO 0.18 -3.70 0.77 -1.17 -0.76 0.00 0.00 175.35 170.67 2g5m s LEU 35 N 11.22 3.68 -0.68 3.17 2.96 -1.26 -4.85 118.68 132.92 2g5m s LEU 35 Ca 0.74 0.94 -0.04 0.00 -0.22 0.00 0.00 54.13 55.54 2g5m s LEU 35 Cb -0.07 -3.88 0.18 0.00 0.50 0.00 0.00 46.19 42.92 2g5m s LEU 35 CO 0.03 -0.53 0.52 -0.83 -1.32 0.00 0.00 176.35 174.21 2g5m s GLY 36 N -3.94 2.58 -1.22 7.98 0.00 -0.39 -4.80 107.32 107.53 2g5m s GLY 36 Ca 0.48 -3.33 -0.13 0.00 0.00 0.00 0.00 44.72 41.74 2g5m s GLY 36 CO 0.42 1.13 1.49 1.39 0.00 0.00 0.00 173.10 177.54 2g5m n ILE 37 N 3.45 4.30 -2.30 0.90 2.08 -1.25 -0.92 119.36 125.61 2g5m n ILE 37 Ca 0.10 -4.72 -0.26 0.00 0.56 0.00 0.00 62.75 58.43 2g5m n ILE 37 Cb 0.39 -2.45 0.05 0.00 -0.75 0.00 0.00 39.64 36.88 2g5m n ILE 37 CO 0.00 0.00 0.00 -0.36 0.56 0.00 0.00 176.55 176.75 2g5m s PHE 38 N 1.20 3.07 0.02 1.39 0.40 -0.79 -2.87 117.98 120.39 2g5m s PHE 38 Ca 0.42 0.52 -0.29 0.00 -0.60 0.00 0.00 56.93 56.98 2g5m s PHE 38 Cb -0.01 -2.97 -0.04 0.00 0.51 0.00 0.00 43.02 40.51 2g5m s PHE 38 CO 0.00 -1.13 0.93 0.08 0.70 0.00 0.00 175.22 175.80 2g5m s VAL 39 N -3.12 4.80 -0.15 -0.44 1.01 -0.08 -0.23 120.40 122.19 2g5m s VAL 39 Ca 0.57 1.96 -0.07 0.00 0.00 0.00 0.00 61.98 64.45 2g5m s VAL 39 Cb -0.11 -4.28 -0.24 0.00 0.00 0.00 0.00 36.38 31.76 2g5m s VAL 39 CO 0.45 0.22 0.25 1.17 0.00 0.00 0.00 175.10 177.19 2g5m n LYS 40 N 3.56 0.73 -3.64 2.72 4.81 0.20 -4.50 118.16 122.04 2g5m n LYS 40 Ca 0.04 0.27 -0.10 0.00 -0.87 0.00 0.00 58.31 57.64 2g5m n LYS 40 Cb 0.51 -1.68 -0.03 0.00 0.02 0.00 0.00 35.03 33.84 2g5m n LYS 40 CO 0.00 0.00 0.00 -0.08 1.17 0.00 0.00 177.40 178.49 2g5m s THR 41 N -2.54 0.03 -0.43 3.15 -1.32 -1.15 -4.97 115.64 108.41 2g5m s THR 41 Ca -0.25 -0.54 0.02 0.00 -1.21 0.00 0.00 61.69 59.71 2g5m s THR 41 Cb 0.07 -1.36 0.13 0.00 -1.51 0.00 0.00 72.50 69.83 2g5m s THR 41 CO 0.73 -0.12 0.21 -0.69 -2.21 0.00 0.00 174.62 172.53 2g5m s VAL 42 N -3.83 1.61 0.13 5.08 1.01 -1.26 -1.21 120.40 121.93 2g5m s VAL 42 Ca 0.06 -2.51 -0.30 0.00 0.00 0.00 0.00 61.98 59.22 2g5m s VAL 42 Cb -0.01 -2.14 -0.07 0.00 0.00 0.00 0.00 36.38 34.16 2g5m s VAL 42 CO -0.07 -0.82 1.24 -0.89 0.00 0.00 0.00 175.10 174.56 2g5m s THR 43 N 0.46 3.64 -1.65 3.92 2.01 -0.11 -4.81 115.64 119.10 2g5m s THR 43 Ca 0.16 1.27 0.12 0.00 0.31 0.00 0.00 61.69 63.55 2g5m s THR 43 Cb -0.23 -3.81 0.26 0.00 0.01 0.00 0.00 72.50 68.73 2g5m s THR 43 CO -0.04 0.15 1.24 -1.84 -0.69 0.00 0.00 174.62 173.45 2g5m n GLU 44 N 3.21 0.25 -0.05 4.92 0.28 -1.26 -2.75 120.64 125.25 2g5m n GLU 44 Ca 0.07 0.11 0.11 0.00 -0.16 0.00 0.00 57.16 57.29 2g5m n GLU 44 Cb 0.45 -1.50 0.45 0.00 1.43 0.00 0.00 31.44 32.27 2g5m n GLU 44 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2g5m n GLY 45 N -0.25 0.01 3.22 -1.84 0.00 -1.26 -4.69 105.19 100.37 2g5m n GLY 45 Ca 0.07 -0.38 -0.13 0.00 0.00 0.00 0.00 46.02 45.58 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 -1.68 1.56 0.42 -0.02 0.00 -1.11 -4.84 107.32 101.65 2g5m s GLY 46 Ca 0.34 -1.75 0.17 0.00 0.00 0.00 0.00 44.72 43.48 2g5m s GLY 46 CO 0.28 -1.43 1.85 0.00 0.00 0.00 0.00 173.10 173.80 2g5m h ALA 47 N 2.54 2.20 -0.34 3.20 0.00 -1.85 -2.19 119.26 122.82 2g5m h ALA 47 Ca -0.35 0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.54 2g5m h ALA 47 Cb 1.25 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 19.00 2g5m h ALA 47 CO 0.52 -0.49 0.08 0.00 0.00 0.00 0.00 179.25 179.37 2g5m h ALA 48 N 1.61 0.45 -0.14 0.00 0.00 -1.85 0.54 119.26 119.86 2g5m h ALA 48 Ca 0.47 -0.18 -0.20 0.00 0.00 0.00 0.00 54.91 55.00 2g5m h ALA 48 Cb 1.17 -0.13 0.01 0.00 0.00 0.00 0.00 17.79 18.84 2g5m h ALA 48 CO -0.18 0.12 -0.70 1.25 0.00 0.00 0.00 179.25 179.74 2g5m h HIS 49 N 0.39 0.97 -0.73 0.00 6.17 -1.58 0.94 115.15 121.31 2g5m h HIS 49 Ca 0.11 -0.43 0.01 0.00 0.71 0.00 0.00 60.37 60.77 2g5m h HIS 49 Cb 0.30 -0.15 -0.04 0.00 2.52 0.00 0.00 27.41 30.05 2g5m h HIS 49 CO 0.02 1.25 0.48 0.00 0.71 0.00 0.00 177.93 180.39 2g5m h ARG 50 N 0.42 0.95 0.02 5.26 3.08 -1.13 -3.02 114.38 119.96 2g5m h ARG 50 Ca -0.05 -0.06 -0.00 0.00 0.07 0.00 0.00 59.98 59.94 2g5m h ARG 50 Cb 1.33 -0.22 0.00 0.00 0.08 0.00 0.00 29.97 31.17 2g5m h ARG 50 CO 0.14 0.63 -0.01 0.22 -1.07 0.00 0.00 179.97 179.89 2g5m h ASP 51 N 0.98 -0.02 -0.19 7.04 1.82 0.03 -3.49 116.42 122.58 2g5m h ASP 51 Ca 0.27 -0.74 0.00 0.00 -0.39 0.00 0.00 57.03 56.17 2g5m h ASP 51 Cb -0.10 0.01 0.00 0.00 0.68 0.00 0.00 39.33 39.92 2g5m h ASP 51 CO -0.07 0.81 0.00 0.61 -1.61 0.00 0.00 179.24 178.99 2g5m n GLY 52 N 1.38 0.86 0.00 -0.78 0.00 0.30 -5.08 105.19 101.87 2g5m n GLY 52 Ca -0.08 -0.10 0.00 0.00 0.00 0.00 0.00 46.02 45.84 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 -0.10 0.00 -1.74 1.61 5.12 -1.04 -4.95 116.66 115.56 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 0.08 0.00 -0.03 0.00 -1.16 0.00 0.00 32.46 31.35 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 0.00 2.84 0.48 0.55 1.01 -1.26 -4.99 121.20 119.82 2g5m s ILE 54 Ca 0.00 0.13 0.09 0.00 0.00 0.00 0.00 60.65 60.87 2g5m s ILE 54 Cb 0.00 -3.08 0.04 0.00 0.01 0.00 0.00 42.46 39.42 2g5m s ILE 54 CO 0.00 -0.01 0.63 -1.10 0.00 0.00 0.00 174.94 174.47 2g5m s GLN 55 N 3.45 2.60 0.00 2.79 -0.21 -1.26 -4.74 119.66 122.29 2g5m s GLN 55 Ca 0.82 -1.44 0.28 0.00 0.02 0.00 0.00 55.36 55.05 2g5m s GLN 55 Cb -0.43 -2.67 1.59 0.00 1.00 0.00 0.00 33.01 32.49 2g5m s GLN 55 CO 0.37 -0.49 2.00 1.55 -2.12 0.00 0.00 175.29 176.60 2g5m n VAL 56 N -1.97 0.04 -1.50 1.09 3.14 -1.26 -2.72 118.33 115.15 2g5m n VAL 56 Ca 0.10 0.01 0.07 0.00 -2.96 0.00 0.00 64.34 61.56 2g5m n VAL 56 Cb 0.60 -0.56 0.14 0.00 -1.06 0.00 0.00 33.84 32.96 2g5m n VAL 56 CO 0.00 0.00 0.00 -0.46 -6.46 0.00 0.00 176.83 169.91 2g5m n ASN 57 N -1.10 1.73 -4.99 6.55 2.04 -1.26 -4.56 115.26 113.68 2g5m n ASN 57 Ca 0.18 -3.17 -0.19 0.00 -0.44 0.00 0.00 54.58 50.96 2g5m n ASN 57 Cb 0.14 -0.43 0.00 0.00 -2.53 0.00 0.00 39.78 36.96 2g5m n ASN 57 CO 0.00 0.00 0.00 -1.81 -0.44 0.00 0.00 177.26 175.01 2g5m s ASP 58 N -2.72 5.83 -0.02 0.53 1.11 -1.10 -4.81 116.67 115.49 2g5m s ASP 58 Ca 0.31 -0.13 -0.00 0.00 0.18 0.00 0.00 52.55 52.90 2g5m s ASP 58 Cb 0.29 -1.15 0.02 0.00 1.07 0.00 0.00 42.92 43.15 2g5m s ASP 58 CO -0.03 -0.60 0.03 -0.22 1.18 0.00 0.00 175.17 175.53 2g5m s LEU 59 N -4.32 1.34 -0.72 1.23 2.96 -1.26 -0.91 118.68 116.99 2g5m s LEU 59 Ca 0.48 0.06 -0.25 0.00 -0.22 0.00 0.00 54.13 54.20 2g5m s LEU 59 Cb -0.10 0.00 0.04 0.00 0.50 0.00 0.00 46.19 46.64 2g5m s LEU 59 CO 0.33 -0.09 1.18 -0.76 -1.32 0.00 0.00 176.35 175.69 2g5m s LEU 60 N 0.73 3.58 -0.05 -0.68 1.43 -1.14 -2.22 118.68 120.33 2g5m s LEU 60 Ca -0.06 -0.66 -0.13 0.00 -1.03 0.00 0.00 54.13 52.26 2g5m s LEU 60 Cb -0.09 -2.51 -0.31 0.00 0.03 0.00 0.00 46.19 43.32 2g5m s LEU 60 CO -0.02 -1.70 0.67 0.58 0.23 0.00 0.00 176.35 176.11 2g5m h VAL 61 N 6.02 0.99 -2.80 -1.59 2.07 -1.40 -3.45 116.25 116.09 2g5m h VAL 61 Ca -0.27 -2.50 -0.07 0.00 0.82 0.00 0.00 66.70 64.68 2g5m h VAL 61 Cb 1.06 2.79 -0.17 0.00 -1.52 0.00 0.00 31.29 33.45 2g5m h VAL 61 CO 1.25 0.83 -0.00 -1.83 0.02 0.00 0.00 177.57 177.83 2g5m s GLU 62 N -2.56 0.99 0.11 1.57 -1.05 -1.12 -0.59 118.70 116.06 2g5m s GLU 62 Ca -0.16 -0.23 0.02 0.00 -0.15 0.00 0.00 54.97 54.44 2g5m s GLU 62 Cb 0.05 0.45 0.02 0.00 -0.44 0.00 0.00 34.13 34.21 2g5m s GLU 62 CO 0.84 -0.35 0.15 1.55 0.95 0.00 0.00 175.26 178.41 2g5m n VAL 63 N 0.50 0.00 -0.25 1.83 3.14 -0.17 -0.27 118.33 123.12 2g5m n VAL 63 Ca -0.19 -0.37 -0.06 0.00 -2.96 0.00 0.00 64.34 60.76 2g5m n VAL 63 Cb 0.60 -0.89 -0.01 0.00 -1.06 0.00 0.00 33.84 32.48 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 0.02 -1.37 -0.70 6.55 3.58 -1.83 -3.29 116.42 119.38 2g5m h ASP 64 Ca -0.05 0.25 -0.33 0.00 0.42 0.00 0.00 57.03 57.32 2g5m h ASP 64 Cb 0.24 0.66 -0.41 0.00 1.72 0.00 0.00 39.33 41.55 2g5m h ASP 64 CO 0.08 -0.31 -1.08 0.61 -2.88 0.00 0.00 179.24 175.66 2g5m n GLY 65 N -1.42 2.56 3.42 -0.78 0.00 -1.26 -4.95 105.19 102.75 2g5m n GLY 65 Ca 0.04 -1.43 -0.07 0.00 0.00 0.00 0.00 46.02 44.56 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 -3.83 -0.51 -0.16 2.61 2.01 -1.24 -5.14 115.64 109.37 2g5m s THR 66 Ca 0.31 0.09 -0.22 0.00 0.31 0.00 0.00 61.69 62.18 2g5m s THR 66 Cb 0.37 -0.79 -0.03 0.00 0.01 0.00 0.00 72.50 72.07 2g5m s THR 66 CO -0.02 0.04 0.69 -0.44 -0.69 0.00 0.00 174.62 174.20 2g5m s SER 67 N 2.29 6.81 -0.65 3.53 0.01 -1.26 -1.00 113.70 123.44 2g5m s SER 67 Ca -0.06 0.99 -0.21 0.00 1.31 0.00 0.00 55.95 57.98 2g5m s SER 67 Cb -0.10 -2.38 0.08 0.00 0.21 0.00 0.00 66.02 63.83 2g5m s SER 67 CO -0.15 -0.26 0.89 -0.76 0.41 0.00 0.00 173.24 173.36 2g5m s LEU 68 N 1.70 4.75 0.28 2.44 1.43 0.24 -4.81 118.68 124.72 2g5m s LEU 68 Ca 0.33 -1.19 0.05 0.00 -1.03 0.00 0.00 54.13 52.29 2g5m s LEU 68 Cb -0.16 -2.38 0.40 0.00 0.03 0.00 0.00 46.19 44.08 2g5m s LEU 68 CO 0.12 -1.32 1.67 0.58 0.23 0.00 0.00 176.35 177.64 2g5m h VAL 69 N 5.95 1.31 0.00 -1.59 2.07 -1.91 -3.45 116.25 118.63 2g5m h VAL 69 Ca -0.27 -1.56 0.00 0.00 0.82 0.00 0.00 66.70 65.69 2g5m h VAL 69 Cb 1.07 1.68 0.00 0.00 -1.52 0.00 0.00 31.29 32.52 2g5m h VAL 69 CO 1.15 0.47 0.00 0.61 0.02 0.00 0.00 177.57 179.82 2g5m n GLY 70 N -0.13 -0.91 3.92 2.17 0.00 -1.23 -3.20 105.19 105.81 2g5m n GLY 70 Ca -0.02 0.23 -0.27 0.00 0.00 0.00 0.00 46.02 45.96 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 2.12 0.73 1.61 -7.23 -1.26 -4.58 120.40 111.79 2g5m s VAL 71 Ca 0.00 -0.15 -0.11 0.00 -1.81 0.00 0.00 61.98 59.90 2g5m s VAL 71 Cb 0.00 -2.97 0.03 0.00 0.56 0.00 0.00 36.38 34.00 2g5m s VAL 71 CO 0.00 0.00 1.09 0.42 -0.31 0.00 0.00 175.10 176.30 2g5m s THR 72 N -3.47 3.51 0.32 5.32 -4.23 -1.26 -4.83 115.64 110.99 2g5m s THR 72 Ca 0.64 0.49 -0.00 0.00 -1.18 0.00 0.00 61.69 61.63 2g5m s THR 72 Cb -0.09 -3.38 0.26 0.00 1.34 0.00 0.00 72.50 70.63 2g5m s THR 72 CO 0.48 -0.64 1.98 -0.61 -0.54 0.00 0.00 174.62 175.29 2g5m h GLN 73 N -0.77 0.99 -0.59 3.99 4.15 -1.95 -0.02 115.11 120.91 2g5m h GLN 73 Ca -0.45 -0.06 -0.07 0.00 0.77 0.00 0.00 58.65 58.84 2g5m h GLN 73 Cb 1.25 -0.22 -0.02 0.00 0.21 0.00 0.00 27.48 28.69 2g5m h GLN 73 CO 0.62 0.65 0.09 1.03 -1.93 0.00 0.00 178.83 179.29 2g5m h SER 74 N 1.02 0.93 -0.14 -0.69 0.87 -1.99 -1.02 113.55 112.53 2g5m h SER 74 Ca 0.29 -0.26 -0.01 0.00 -1.23 0.00 0.00 61.79 60.57 2g5m h SER 74 Cb -0.09 -0.25 -0.01 0.00 -0.44 0.00 0.00 62.40 61.62 2g5m h SER 74 CO -0.07 0.96 0.03 0.15 -0.53 0.00 0.00 176.83 177.38 2g5m h PHE 75 N 0.87 0.23 -0.75 2.24 3.04 -1.64 -0.20 116.94 120.73 2g5m h PHE 75 Ca 0.18 -0.03 0.08 0.00 3.98 0.00 0.00 57.97 62.18 2g5m h PHE 75 Cb 0.43 -0.06 -0.07 0.00 2.56 0.00 0.00 35.95 38.81 2g5m h PHE 75 CO 0.03 0.37 0.41 0.00 -2.02 0.00 0.00 178.31 177.11 2g5m h ALA 76 N 0.83 1.03 -0.59 2.41 0.00 -0.84 0.12 119.26 122.22 2g5m h ALA 76 Ca 0.04 0.03 -0.09 0.00 0.00 0.00 0.00 54.91 54.90 2g5m h ALA 76 Cb 0.26 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 2g5m h ALA 76 CO 0.00 0.06 0.03 0.00 0.00 0.00 0.00 179.25 179.35 2g5m h ALA 77 N 1.41 0.93 0.00 0.00 0.00 -0.93 -2.96 119.26 117.71 2g5m h ALA 77 Ca 0.35 -0.29 -0.12 0.00 0.00 0.00 0.00 54.91 54.85 2g5m h ALA 77 Cb 0.28 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 2g5m h ALA 77 CO -0.22 0.65 -0.57 1.03 0.00 0.00 0.00 179.25 180.13 2g5m h SER 78 N 0.93 0.00 0.48 0.00 0.87 0.08 -3.06 113.55 112.85 2g5m h SER 78 Ca 0.18 0.00 -0.20 0.00 -1.23 0.00 0.00 61.79 60.53 2g5m h SER 78 Cb 0.50 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.45 2g5m h SER 78 CO 0.02 0.57 -0.88 1.62 -0.53 0.00 0.00 176.83 177.64 2g5m h VAL 79 N 0.00 1.45 0.00 2.23 3.04 -0.67 -2.11 116.25 120.19 2g5m h VAL 79 Ca -0.01 -2.51 0.00 0.00 -1.01 0.00 0.00 66.70 63.18 2g5m h VAL 79 Cb 1.05 2.41 0.00 0.00 -2.01 0.00 0.00 31.29 32.74 2g5m h VAL 79 CO 0.07 0.74 0.00 0.18 -1.01 0.00 0.00 177.57 177.55 2g5m n LEU 80 N -3.71 0.28 -0.28 3.16 4.77 -1.13 -1.32 117.00 118.77 2g5m n LEU 80 Ca -0.05 0.58 0.08 0.00 -0.03 0.00 0.00 56.01 56.59 2g5m n LEU 80 Cb 0.80 -0.55 -0.02 0.00 -2.33 0.00 0.00 43.42 41.32 2g5m n LEU 80 CO 0.49 -0.44 0.20 0.54 -1.33 0.00 0.00 177.39 176.84 2g5m n ARG 81 N -1.82 1.80 -0.02 3.23 1.74 -0.84 -4.29 116.66 116.45 2g5m n ARG 81 Ca 0.02 -0.63 0.03 0.00 -0.77 0.00 0.00 57.85 56.50 2g5m n ARG 81 Cb 0.16 -1.25 -0.13 0.00 -1.02 0.00 0.00 32.46 30.23 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 -0.38 0.26 -3.55 0.55 3.02 -0.44 -4.99 115.26 109.74 2g5m n ASN 82 Ca 0.06 0.11 -0.31 0.00 -0.03 0.00 0.00 54.58 54.41 2g5m n ASN 82 Cb 0.31 1.18 0.26 0.00 -0.61 0.00 0.00 39.78 40.92 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 -3.09 1.44 0.04 3.41 -4.23 -0.84 -5.07 115.64 107.30 2g5m s THR 83 Ca -0.07 0.00 -0.01 0.00 -1.18 0.00 0.00 61.69 60.44 2g5m s THR 83 Cb 0.10 -2.42 0.01 0.00 1.34 0.00 0.00 72.50 71.53 2g5m s THR 83 CO 0.86 0.00 0.04 0.29 -0.54 0.00 0.00 174.62 175.26 2g5m n LYS 84 N -5.03 -0.86 0.05 3.99 4.76 -1.26 -4.98 118.16 114.84 2g5m n LYS 84 Ca 0.15 -0.06 -0.13 0.00 -2.87 0.00 0.00 58.31 55.40 2g5m n LYS 84 Cb 0.60 -0.05 -0.03 0.00 -1.84 0.00 0.00 35.03 33.71 2g5m n LYS 84 CO 0.00 0.00 0.00 0.78 -1.37 0.00 0.00 177.40 176.81 2g5m h GLY 85 N -0.47 0.51 -6.34 0.72 0.00 -1.97 -3.42 103.07 92.09 2g5m h GLY 85 Ca -0.01 -0.81 -0.55 0.00 0.00 0.00 0.00 47.33 45.95 2g5m h GLY 85 CO 0.01 0.72 -0.82 -1.60 0.00 0.00 0.00 176.54 174.85 2g5m s ARG 86 N -3.42 1.85 0.06 4.80 3.52 -1.26 -1.01 118.95 123.48 2g5m s ARG 86 Ca -0.06 -0.40 0.03 0.00 -0.13 0.00 0.00 55.73 55.17 2g5m s ARG 86 Cb 0.09 -1.73 -0.03 0.00 -1.56 0.00 0.00 34.95 31.73 2g5m s ARG 86 CO 0.86 -0.18 -0.10 0.14 -0.81 0.00 0.00 175.30 175.21 2g5m s VAL 87 N 1.37 0.78 -0.25 7.11 -7.23 -0.55 -4.98 120.40 116.65 2g5m s VAL 87 Ca -0.00 -1.19 -0.06 0.00 -1.81 0.00 0.00 61.98 58.92 2g5m s VAL 87 Cb -0.13 -0.82 -0.01 0.00 0.56 0.00 0.00 36.38 35.97 2g5m s VAL 87 CO -0.06 -0.32 0.04 -0.13 -0.31 0.00 0.00 175.10 174.32 2g5m s ARG 88 N -1.68 3.43 0.46 4.82 0.52 -1.26 -2.10 118.95 123.13 2g5m s ARG 88 Ca -0.06 -0.62 0.07 0.00 -0.52 0.00 0.00 55.73 54.60 2g5m s ARG 88 Cb -0.10 -3.25 0.02 0.00 0.52 0.00 0.00 34.95 32.15 2g5m s ARG 88 CO 0.01 -0.26 0.63 -0.06 0.02 0.00 0.00 175.30 175.64 2g5m s PHE 89 N 1.55 2.70 -0.24 -0.53 0.08 0.82 -2.47 117.98 119.88 2g5m s PHE 89 Ca 0.05 -0.36 -0.03 0.00 0.12 0.00 0.00 56.93 56.72 2g5m s PHE 89 Cb -0.15 -2.44 0.01 0.00 -0.57 0.00 0.00 43.02 39.87 2g5m s PHE 89 CO 0.01 -0.57 -0.04 -1.64 -0.10 0.00 0.00 175.22 172.88 2g5m s MET 90 N -4.46 3.04 -0.25 0.44 -1.94 0.63 -0.34 119.30 116.44 2g5m s MET 90 Ca 0.56 -0.85 -0.16 0.00 -1.71 0.00 0.00 55.69 53.54 2g5m s MET 90 Cb -0.10 -3.02 -0.04 0.00 2.01 0.00 0.00 34.83 33.69 2g5m s MET 90 CO 0.35 -0.33 0.41 0.42 -0.01 0.00 0.00 175.02 175.86 2g5m s ILE 91 N 1.39 5.16 -0.49 2.53 1.09 0.69 -0.99 121.20 130.57 2g5m s ILE 91 Ca 0.02 0.69 -0.03 0.00 -1.10 0.00 0.00 60.65 60.23 2g5m s ILE 91 Cb -0.16 -3.74 0.13 0.00 -1.06 0.00 0.00 42.46 37.63 2g5m s ILE 91 CO -0.04 0.17 0.30 -0.83 -0.10 0.00 0.00 174.94 174.44 2g5m s GLY 92 N 1.42 2.18 -0.27 6.18 0.00 -0.94 -0.84 107.32 115.06 2g5m s GLY 92 Ca 0.18 -2.81 -0.14 0.00 0.00 0.00 0.00 44.72 41.95 2g5m s GLY 92 CO 0.09 1.06 0.34 -1.60 0.00 0.00 0.00 173.10 172.99 2g5m s ARG 93 N 0.70 4.01 -1.26 2.90 3.52 -0.23 -4.39 118.95 124.20 2g5m s ARG 93 Ca 0.11 -0.02 -0.15 0.00 -0.13 0.00 0.00 55.73 55.54 2g5m s ARG 93 Cb -0.22 -3.65 0.13 0.00 -1.56 0.00 0.00 34.95 29.65 2g5m s ARG 93 CO -0.04 -0.24 1.61 -1.91 -0.81 0.00 0.00 175.30 173.91 2g5m n GLU 94 N 5.22 3.30 0.34 5.12 2.13 -1.26 -0.26 120.64 135.22 2g5m n GLU 94 Ca -0.10 -3.57 -0.15 0.00 0.66 0.00 0.00 57.16 54.01 2g5m n GLU 94 Cb 0.51 -3.22 -0.08 0.00 0.27 0.00 0.00 31.44 28.92 2g5m n GLU 94 CO 0.00 0.00 0.00 -0.09 -0.41 0.00 0.00 177.13 176.63 2g5m h ARG 95 N 7.17 -0.91 -7.02 5.31 2.43 -1.93 -3.44 114.38 115.99 2g5m h ARG 95 Ca 0.38 0.06 -0.55 0.00 -0.81 0.00 0.00 59.98 59.07 2g5m h ARG 95 Cb 0.85 0.21 0.13 0.00 -0.42 0.00 0.00 29.97 30.73 2g5m h ARG 95 CO 1.38 -0.60 0.64 -1.25 -1.51 0.00 0.00 179.97 178.62 2g5m s PRO 96 N -5.26 3.39 0.00 0.20 0.04 -1.26 -3.61 135.00 128.51 2g5m s PRO 96 Ca -0.15 2.29 0.00 0.00 0.04 0.00 0.00 61.00 63.18 2g5m s PRO 96 Cb 0.02 -2.43 0.00 0.00 0.04 0.00 0.00 34.50 32.13 2g5m s PRO 96 CO 0.46 -1.00 0.00 0.41 0.04 0.00 0.00 177.00 176.91 2g5m n GLY 97 N 0.66 3.66 0.16 0.56 0.00 -1.26 -4.88 105.19 104.08 2g5m n GLY 97 Ca 0.08 -0.82 -0.13 0.00 0.00 0.00 0.00 46.02 45.15 2g5m n GLY 97 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 2g5m h GLU 98 N 0.00 0.40 -6.55 1.61 4.11 -1.88 -3.42 114.58 108.84 2g5m h GLU 98 Ca 0.00 -0.42 -0.55 0.00 0.07 0.00 0.00 59.36 58.46 2g5m h GLU 98 Cb 0.00 0.12 -0.07 0.00 0.50 0.00 0.00 28.75 29.30 2g5m h GLU 98 CO 0.00 1.08 1.01 -1.14 0.07 0.00 0.00 179.01 180.03 2g5m s GLN 99 N -3.30 3.50 0.84 1.06 0.74 -1.26 -5.00 119.66 116.24 2g5m s GLN 99 Ca -0.06 0.40 -0.14 0.00 0.05 0.00 0.00 55.36 55.62 2g5m s GLN 99 Cb 0.09 -4.03 0.20 0.00 1.10 0.00 0.00 33.01 30.37 2g5m s GLN 99 CO 0.86 -1.70 1.07 0.43 -0.55 0.00 0.00 175.29 175.40 2g5m n SER 100 N 8.68 -0.24 -2.69 6.67 7.64 -1.26 -4.89 113.62 127.53 2g5m n SER 100 Ca 0.11 -1.34 -0.26 0.00 1.01 0.00 0.00 58.87 58.38 2g5m n SER 100 Cb 0.49 -0.84 -0.09 0.00 -1.01 0.00 0.00 64.21 62.76 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 -3.47 2.92 -3.28 1.43 -0.58 -1.26 -4.81 120.64 111.58 2g5m n GLU 101 Ca 0.14 -1.73 -0.42 0.00 -0.42 0.00 0.00 57.16 54.72 2g5m n GLU 101 Cb 0.48 -2.40 -0.08 0.00 -0.57 0.00 0.00 31.44 28.87 2g5m n GLU 101 CO 0.00 0.00 0.00 0.14 -0.48 0.00 0.00 177.13 176.79 2g5m s VAL 102 N 1.24 5.04 -0.23 2.62 -7.23 -1.26 -4.90 120.40 115.69 2g5m s VAL 102 Ca 0.67 -0.02 0.11 0.00 -1.81 0.00 0.00 61.98 60.93 2g5m s VAL 102 Cb 0.25 -4.00 0.44 0.00 0.56 0.00 0.00 36.38 33.63 2g5m s VAL 102 CO -0.04 -0.33 1.20 0.00 -0.31 0.00 0.00 175.10 175.62 2g5m n ALA 103 N 5.70 4.03 -0.67 1.32 0.00 -1.26 -5.01 120.51 124.62 2g5m n ALA 103 Ca -0.06 -3.41 0.00 0.00 0.00 0.00 0.00 53.44 49.97 2g5m n ALA 103 Cb 0.48 -0.38 0.00 0.00 0.00 0.00 0.00 19.45 19.55 2g5m n ALA 103 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 2g5m n GLN 104 N -0.86 -0.15 -2.27 0.00 -0.06 -1.26 -5.09 117.38 107.69 2g5m n GLN 104 Ca 0.27 0.59 -0.26 0.00 -2.00 0.00 0.00 57.00 55.60 2g5m n GLN 104 Cb 0.82 -0.25 0.15 0.00 -4.06 0.00 0.00 30.24 26.91 2g5m n GLN 104 CO 0.00 0.00 0.00 1.28 -0.20 0.00 0.00 177.06 178.14 2g5m n LEU 105 N 0.05 0.00 0.06 1.69 4.32 -1.26 -5.03 117.00 116.83 2g5m n LEU 105 Ca 0.00 -1.82 -0.09 0.00 -0.02 0.00 0.00 56.01 54.08 2g5m n LEU 105 Cb 0.00 -0.80 -0.06 0.00 -1.62 0.00 0.00 43.42 40.94 2g5m n LEU 105 CO 0.00 -1.18 0.29 0.40 -1.22 0.00 0.00 177.39 175.68 2g5m h ILE 106 N -1.10 0.59 -3.40 -0.08 5.03 -2.06 -3.44 117.51 113.05 2g5m h ILE 106 Ca -0.37 -1.09 -0.36 0.00 -0.12 0.00 0.00 64.86 62.92 2g5m h ILE 106 Cb 1.20 1.02 -0.36 0.00 -3.03 0.00 0.00 36.82 35.65 2g5m h ILE 106 CO 0.33 0.16 -0.75 -1.58 -0.68 0.00 0.00 178.15 175.64 2g5m s GLN 107 N -2.98 0.20 -0.87 2.37 2.00 -1.26 -5.07 119.66 114.05 2g5m s GLN 107 Ca -0.10 0.19 -0.21 0.00 -2.00 0.00 0.00 55.36 53.24 2g5m s GLN 107 Cb 0.00 -0.55 0.10 0.00 0.80 0.00 0.00 33.01 33.35 2g5m s GLN 107 CO 0.36 -0.23 1.15 -1.14 -0.50 0.00 0.00 175.29 174.93 2g5m s GLN 108 N 1.55 3.46 0.47 1.67 2.00 -1.26 -4.86 119.66 122.69 2g5m s GLN 108 Ca -0.02 -1.35 0.32 0.00 -2.00 0.00 0.00 55.36 52.31 2g5m s GLN 108 Cb -0.13 -4.80 1.58 0.00 0.80 0.00 0.00 33.01 30.46 2g5m s GLN 108 CO -0.03 -1.88 1.97 0.00 -0.50 0.00 0.00 175.29 174.85 2g5m h THR 109 N 6.06 0.00 -0.39 -0.34 1.03 -2.02 -1.31 112.91 115.94 2g5m h THR 109 Ca 0.04 -0.17 0.00 0.00 -0.01 0.00 0.00 66.41 66.26 2g5m h THR 109 Cb 1.03 0.99 0.00 0.00 -1.07 0.00 0.00 68.15 69.11 2g5m h THR 109 CO 1.19 0.00 0.00 0.18 -0.01 0.00 0.00 175.52 176.88 2g5m n LEU 110 N -2.71 3.62 0.00 0.00 4.77 -1.26 -5.02 117.00 116.39 2g5m n LEU 110 Ca -0.01 -2.41 0.00 0.00 -0.03 0.00 0.00 56.01 53.57 2g5m n LEU 110 Cb 0.15 -0.40 0.00 0.00 -2.33 0.00 0.00 43.42 40.84 2g5m n LEU 110 CO 0.19 0.74 0.00 1.21 -1.33 0.00 0.00 177.39 178.20 2g5m n GLU 111 N 0.34 0.00 -3.49 3.23 2.13 -0.50 -4.55 120.64 117.80 2g5m n GLU 111 Ca 0.18 0.00 -0.13 0.00 0.66 0.00 0.00 57.16 57.87 2g5m n GLU 111 Cb 0.67 0.00 -0.04 0.00 0.27 0.00 0.00 31.44 32.34 2g5m n GLU 111 CO 0.00 0.00 0.00 -0.65 -0.41 0.00 0.00 177.13 176.07 2g5m s GLN 112 N 0.00 1.03 0.00 5.31 -0.21 -1.26 -4.89 119.66 119.64 2g5m s GLN 112 Ca 0.00 -0.11 0.00 0.00 0.02 0.00 0.00 55.36 55.27 2g5m s GLN 112 Cb 0.00 0.48 0.00 0.00 1.00 0.00 0.00 33.01 34.49 2g5m s GLN 112 CO 0.00 -0.39 0.50 0.39 -2.12 0.00 0.00 175.29 173.67