#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 0.35 -3.68 1.61 -0.00 -1.98 -3.40 115.15 108.05 2g5m h HIS 2 Ca 0.00 -0.14 -0.67 0.00 -0.00 0.00 0.00 60.37 59.56 2g5m h HIS 2 Cb 0.00 -0.06 -0.21 0.00 -0.00 0.00 0.00 27.41 27.13 2g5m h HIS 2 CO 0.00 0.82 -0.54 0.00 -0.00 0.00 0.00 177.93 178.21 2g5m s MET 3 N -3.84 3.41 -0.64 5.26 0.00 -1.26 -2.91 119.30 119.32 2g5m s MET 3 Ca -0.15 -0.67 -0.23 0.00 0.00 0.00 0.00 55.69 54.64 2g5m s MET 3 Cb 0.03 -3.61 0.06 0.00 0.00 0.00 0.00 34.83 31.32 2g5m s MET 3 CO 0.75 -0.40 0.98 -1.21 0.00 0.00 0.00 175.02 175.14 2g5m s GLU 4 N 1.64 3.16 -0.96 3.16 2.02 0.12 -4.85 118.70 123.00 2g5m s GLU 4 Ca 0.05 -0.66 -0.18 0.00 0.02 0.00 0.00 54.97 54.20 2g5m s GLU 4 Cb -0.17 -4.19 0.14 0.00 0.10 0.00 0.00 34.13 30.02 2g5m s GLU 4 CO 0.07 -1.77 1.15 -0.51 0.02 0.00 0.00 175.26 174.22 2g5m s LEU 5 N 4.17 5.18 0.02 1.80 2.01 -1.25 -1.39 118.68 129.22 2g5m s LEU 5 Ca 0.25 -2.24 0.04 0.00 0.01 0.00 0.00 54.13 52.18 2g5m s LEU 5 Cb -0.15 -2.38 -0.03 0.00 0.01 0.00 0.00 46.19 43.63 2g5m s LEU 5 CO 0.13 -0.98 -0.06 0.72 1.01 0.00 0.00 176.35 177.17 2g5m s PHE 6 N 2.32 2.89 0.09 0.29 -0.12 0.07 -4.86 117.98 118.66 2g5m s PHE 6 Ca 0.33 -0.04 -0.28 0.00 -0.05 0.00 0.00 56.93 56.89 2g5m s PHE 6 Cb -0.05 -1.59 -0.06 0.00 -0.63 0.00 0.00 43.02 40.69 2g5m s PHE 6 CO -0.08 0.39 0.88 -1.25 -0.05 0.00 0.00 175.22 175.11 2g5m s PRO 7 N -1.56 4.62 -0.09 1.99 0.04 -1.26 -0.09 135.00 138.66 2g5m s PRO 7 Ca 0.18 1.30 0.04 0.00 0.04 0.00 0.00 61.00 62.56 2g5m s PRO 7 Cb -0.11 -3.37 0.00 0.00 0.04 0.00 0.00 34.50 31.06 2g5m s PRO 7 CO 0.09 0.24 -0.21 0.08 0.04 0.00 0.00 177.00 177.24 2g5m s VAL 8 N -0.04 1.85 -0.10 -0.36 1.01 0.31 -4.92 120.40 118.16 2g5m s VAL 8 Ca 0.44 -0.91 0.02 0.00 0.00 0.00 0.00 61.98 61.53 2g5m s VAL 8 Cb -0.22 -1.61 -0.02 0.00 0.00 0.00 0.00 36.38 34.54 2g5m s VAL 8 CO 0.27 0.51 -0.16 -0.70 0.00 0.00 0.00 175.10 175.03 2g5m s GLU 9 N 0.34 3.06 0.28 2.72 2.12 -1.26 0.01 118.70 125.97 2g5m s GLU 9 Ca -0.16 -0.73 0.11 0.00 0.36 0.00 0.00 54.97 54.55 2g5m s GLU 9 Cb -0.17 -2.49 -0.05 0.00 0.26 0.00 0.00 34.13 31.68 2g5m s GLU 9 CO 0.07 0.33 -0.17 -0.51 -0.54 0.00 0.00 175.26 174.44 2g5m s LEU 10 N 0.03 2.61 -0.04 2.70 1.43 -0.98 -4.90 118.68 119.53 2g5m s LEU 10 Ca -0.06 -1.07 0.02 0.00 -1.03 0.00 0.00 54.13 51.99 2g5m s LEU 10 Cb -0.15 -1.00 0.01 0.00 0.03 0.00 0.00 46.19 45.08 2g5m s LEU 10 CO 0.05 -0.05 -0.07 -0.70 0.23 0.00 0.00 176.35 175.80 2g5m s GLU 11 N -3.56 0.96 0.29 1.70 2.12 -1.26 -3.84 118.70 115.11 2g5m s GLU 11 Ca 0.29 -0.23 0.03 0.00 0.36 0.00 0.00 54.97 55.43 2g5m s GLU 11 Cb -0.03 -0.90 -0.03 0.00 0.26 0.00 0.00 34.13 33.44 2g5m s GLU 11 CO 0.14 0.03 0.45 0.15 -0.54 0.00 0.00 175.26 175.49 2g5m s LYS 12 N 0.51 3.44 0.00 4.30 1.02 -1.26 -4.69 119.74 123.05 2g5m s LYS 12 Ca -0.08 -0.58 0.00 0.00 0.02 0.00 0.00 55.97 55.33 2g5m s LYS 12 Cb -0.11 -2.78 0.00 0.00 -0.52 0.00 0.00 37.83 34.41 2g5m s LYS 12 CO 0.01 0.28 0.00 -0.25 -0.92 0.00 0.00 175.35 174.47 2g5m n ASP 13 N -1.60 1.33 -0.12 2.83 8.00 -1.18 -4.95 116.55 120.86 2g5m n ASP 13 Ca -0.07 -0.83 0.02 0.00 0.71 0.00 0.00 54.79 54.63 2g5m n ASP 13 Cb 0.57 0.00 0.32 0.00 -0.02 0.00 0.00 41.12 41.99 2g5m n ASP 13 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 2g5m h SER 14 N 0.00 0.69 1.76 -2.24 0.02 -1.99 -0.93 113.55 110.84 2g5m h SER 14 Ca 0.00 -0.03 -0.04 0.00 -0.84 0.00 0.00 61.79 60.88 2g5m h SER 14 Cb 0.00 -0.17 -0.01 0.00 0.14 0.00 0.00 62.40 62.36 2g5m h SER 14 CO 0.00 0.51 -0.20 -0.08 -1.14 0.00 0.00 176.83 175.92 2g5m h GLU 15 N 0.80 0.00 0.00 3.45 4.81 -1.96 -3.49 114.58 118.19 2g5m h GLU 15 Ca 0.21 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.44 2g5m h GLU 15 Cb -0.07 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.31 2g5m h GLU 15 CO -0.04 0.20 0.00 0.41 -0.73 0.00 0.00 179.01 178.85 2g5m n GLY 16 N 1.11 0.54 3.91 1.92 0.00 -0.36 -5.00 105.19 107.31 2g5m n GLY 16 Ca 0.03 -1.52 -0.27 0.00 0.00 0.00 0.00 46.02 44.26 2g5m n GLY 16 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2g5m s LEU 17 N 0.00 2.68 -0.43 0.99 2.96 -1.26 -2.67 118.68 120.96 2g5m s LEU 17 Ca 0.00 0.63 0.08 0.00 -0.22 0.00 0.00 54.13 54.62 2g5m s LEU 17 Cb 0.00 -3.21 0.28 0.00 0.50 0.00 0.00 46.19 43.75 2g5m s LEU 17 CO 0.00 -1.72 0.78 0.61 -1.32 0.00 0.00 176.35 174.70 2g5m n GLY 18 N -3.10 1.76 3.85 7.98 0.00 -1.26 -4.12 105.19 110.29 2g5m n GLY 18 Ca 0.08 -0.80 -0.07 0.00 0.00 0.00 0.00 46.02 45.23 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 -0.61 0.00 0.07 -0.61 -4.36 -1.26 -1.15 121.20 113.28 2g5m s ILE 19 Ca 0.33 -0.99 0.04 0.00 -0.26 0.00 0.00 60.65 59.76 2g5m s ILE 19 Cb 0.24 -2.22 -0.03 0.00 1.25 0.00 0.00 42.46 41.71 2g5m s ILE 19 CO -0.14 0.00 -0.11 -0.44 0.24 0.00 0.00 174.94 174.50 2g5m s SER 20 N -2.96 1.30 0.10 4.36 0.01 0.24 -4.69 113.70 112.05 2g5m s SER 20 Ca 0.12 -0.65 0.10 0.00 1.31 0.00 0.00 55.95 56.83 2g5m s SER 20 Cb -0.06 0.00 -0.03 0.00 0.21 0.00 0.00 66.02 66.14 2g5m s SER 20 CO 0.08 -0.18 -0.25 0.27 0.41 0.00 0.00 173.24 173.57 2g5m s ILE 21 N -1.66 2.05 -0.09 1.44 -4.36 -1.26 0.48 121.20 117.80 2g5m s ILE 21 Ca -0.03 -1.57 0.04 0.00 -0.26 0.00 0.00 60.65 58.83 2g5m s ILE 21 Cb -0.08 -1.81 -0.01 0.00 1.25 0.00 0.00 42.46 41.82 2g5m s ILE 21 CO 0.01 0.13 -0.23 -0.51 0.24 0.00 0.00 174.94 174.58 2g5m s ILE 22 N -1.00 2.22 -0.63 8.37 1.10 0.13 -4.68 121.20 126.72 2g5m s ILE 22 Ca 0.11 -0.98 -0.17 0.00 -0.51 0.00 0.00 60.65 59.10 2g5m s ILE 22 Cb -0.10 -1.84 0.13 0.00 0.15 0.00 0.00 42.46 40.80 2g5m s ILE 22 CO 0.04 0.56 0.69 -0.83 -2.11 0.00 0.00 174.94 173.29 2g5m s GLY 23 N 0.10 1.99 -0.38 1.50 0.00 -1.26 -1.45 107.32 107.82 2g5m s GLY 23 Ca -0.11 -2.50 -0.17 0.00 0.00 0.00 0.00 44.72 41.94 2g5m s GLY 23 CO 0.06 1.46 0.44 1.06 0.00 0.00 0.00 173.10 176.12 2g5m s MET 24 N 2.04 3.39 0.00 2.90 -1.94 -0.07 -4.95 119.30 120.67 2g5m s MET 24 Ca 0.11 -0.48 0.00 0.00 -1.71 0.00 0.00 55.69 53.61 2g5m s MET 24 Cb -0.23 -3.87 0.00 0.00 2.01 0.00 0.00 34.83 32.74 2g5m s MET 24 CO 0.02 -0.70 0.00 0.41 -0.01 0.00 0.00 175.02 174.74 2g5m n GLY 25 N 4.98 1.80 0.00 -0.03 0.00 -1.26 -0.28 105.19 110.40 2g5m n GLY 25 Ca -0.07 -1.49 0.00 0.00 0.00 0.00 0.00 46.02 44.46 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 -1.34 0.00 -2.04 4.61 0.00 -1.26 -5.04 120.51 115.44 2g5m n ALA 26 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 53.01 2g5m n ALA 26 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.42 2g5m n ALA 26 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2g5m s GLY 27 N -0.88 1.08 -0.32 0.00 0.00 -1.26 -4.80 107.32 101.14 2g5m s GLY 27 Ca 0.00 0.47 0.15 0.00 0.00 0.00 0.00 44.72 45.34 2g5m s GLY 27 CO 0.00 3.13 1.07 0.00 0.00 0.00 0.00 173.10 177.31 2g5m n ALA 28 N 9.04 3.73 1.96 3.20 0.00 -1.26 -4.88 120.51 132.31 2g5m n ALA 28 Ca 0.20 -3.34 0.12 0.00 0.00 0.00 0.00 53.44 50.42 2g5m n ALA 28 Cb 0.45 -0.74 0.70 0.00 0.00 0.00 0.00 19.45 19.87 2g5m n ALA 28 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2g5m n ASP 29 N -0.42 0.00 -0.09 0.00 2.03 -1.26 -0.42 116.55 116.39 2g5m n ASP 29 Ca 0.20 -1.23 0.00 0.00 0.52 0.00 0.00 54.79 54.28 2g5m n ASP 29 Cb 0.81 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 41.21 2g5m n ASP 29 CO 0.00 0.00 0.00 1.15 -1.92 0.00 0.00 177.20 176.43 2g5m n MET 30 N -0.88 0.77 0.00 -0.67 0.00 -1.26 -4.66 117.12 110.43 2g5m n MET 30 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.88 2g5m n MET 30 Cb 0.08 -1.07 0.00 0.00 0.00 0.00 0.00 33.22 32.24 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 0.25 1.87 1.24 3.17 0.00 -1.22 -5.04 105.19 105.46 2g5m n GLY 31 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 0.00 0.00 -3.90 0.99 4.77 -0.76 -5.06 117.00 113.05 2g5m n LEU 32 Ca 0.00 0.00 -0.37 0.00 -0.03 0.00 0.00 56.01 55.61 2g5m n LEU 32 Cb 0.00 -0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.11 2g5m n LEU 32 CO 0.00 -0.50 -0.15 -1.84 -1.33 0.00 0.00 177.39 173.57 2g5m n GLU 33 N -2.50 -0.77 -3.55 3.23 0.28 0.44 -4.91 120.64 112.86 2g5m n GLU 33 Ca 0.00 0.36 -0.41 0.00 -0.16 0.00 0.00 57.16 56.95 2g5m n GLU 33 Cb 0.00 -2.89 -0.06 0.00 1.43 0.00 0.00 31.44 29.92 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 -6.41 3.08 0.19 3.44 1.02 -1.26 -2.16 119.74 117.65 2g5m s LYS 34 Ca 0.36 -2.59 0.09 0.00 0.02 0.00 0.00 55.97 53.84 2g5m s LYS 34 Cb -0.18 -4.05 -0.04 0.00 -0.52 0.00 0.00 37.83 33.04 2g5m s LYS 34 CO 0.93 -1.23 -0.07 -0.51 -0.92 0.00 0.00 175.35 173.55 2g5m s LEU 35 N -0.13 3.05 -0.42 3.17 1.02 -1.03 -4.93 118.68 119.40 2g5m s LEU 35 Ca 0.19 -0.56 0.00 0.00 0.02 0.00 0.00 54.13 53.77 2g5m s LEU 35 Cb -0.15 -1.70 0.11 0.00 0.02 0.00 0.00 46.19 44.47 2g5m s LEU 35 CO -0.06 0.09 0.19 -0.83 0.02 0.00 0.00 176.35 175.75 2g5m s GLY 36 N -2.96 2.09 -0.96 -3.19 0.00 0.61 -4.29 107.32 98.61 2g5m s GLY 36 Ca 0.26 -2.71 -0.16 0.00 0.00 0.00 0.00 44.72 42.11 2g5m s GLY 36 CO 0.16 1.00 1.08 -0.42 0.00 0.00 0.00 173.10 174.93 2g5m s ILE 37 N 0.76 5.10 0.61 0.90 -1.09 -1.26 -0.89 121.20 125.32 2g5m s ILE 37 Ca 0.11 -2.12 -0.07 0.00 -2.23 0.00 0.00 60.65 56.35 2g5m s ILE 37 Cb -0.22 -4.71 0.01 0.00 -1.58 0.00 0.00 42.46 35.96 2g5m s ILE 37 CO -0.05 -1.38 0.93 -0.36 -1.23 0.00 0.00 174.94 172.85 2g5m s PHE 38 N 1.57 3.29 -0.01 3.97 0.40 -0.53 -2.68 117.98 123.98 2g5m s PHE 38 Ca 0.30 0.73 -0.30 0.00 -0.60 0.00 0.00 56.93 57.06 2g5m s PHE 38 Cb -0.06 -2.77 -0.03 0.00 0.51 0.00 0.00 43.02 40.66 2g5m s PHE 38 CO -0.08 -0.86 1.08 0.08 0.70 0.00 0.00 175.22 176.15 2g5m s VAL 39 N -3.04 4.52 -0.15 -0.44 1.01 0.28 0.20 120.40 122.78 2g5m s VAL 39 Ca 0.54 1.81 0.01 0.00 0.00 0.00 0.00 61.98 64.34 2g5m s VAL 39 Cb -0.11 -4.16 -0.23 0.00 0.00 0.00 0.00 36.38 31.88 2g5m s VAL 39 CO 0.46 0.09 0.25 1.17 0.00 0.00 0.00 175.10 177.07 2g5m n LYS 40 N 4.34 0.71 -3.62 2.72 4.81 0.18 -4.52 118.16 122.79 2g5m n LYS 40 Ca 0.08 0.22 -0.10 0.00 -0.87 0.00 0.00 58.31 57.64 2g5m n LYS 40 Cb 0.48 -1.66 -0.03 0.00 0.02 0.00 0.00 35.03 33.85 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 -2.55 0.01 -0.41 3.15 -1.32 -1.14 -4.96 115.64 108.42 2g5m s THR 41 Ca -0.21 -0.47 0.04 0.00 -1.21 0.00 0.00 61.69 59.84 2g5m s THR 41 Cb 0.07 -1.39 0.11 0.00 -1.51 0.00 0.00 72.50 69.79 2g5m s THR 41 CO 0.74 -0.05 0.13 -0.69 -2.21 0.00 0.00 174.62 172.54 2g5m s VAL 42 N -3.82 2.33 0.11 5.08 1.01 -1.26 -0.59 120.40 123.25 2g5m s VAL 42 Ca 0.06 -2.68 -0.31 0.00 0.00 0.00 0.00 61.98 59.05 2g5m s VAL 42 Cb -0.02 -2.69 -0.10 0.00 0.00 0.00 0.00 36.38 33.57 2g5m s VAL 42 CO -0.06 -0.68 1.87 0.41 0.00 0.00 0.00 175.10 176.64 2g5m n THR 43 N 3.84 0.44 -0.13 3.92 -1.04 -0.30 -4.80 114.28 116.22 2g5m n THR 43 Ca 0.04 -0.08 0.14 0.00 -2.04 0.00 0.00 64.05 62.12 2g5m n THR 43 Cb 0.38 -2.19 0.51 0.00 -1.82 0.00 0.00 70.33 67.22 2g5m n THR 43 CO 0.00 0.00 0.00 -0.33 -0.64 0.00 0.00 175.07 174.10 2g5m h GLU 44 N 8.98 0.39 0.00 -2.82 5.08 -1.97 -1.42 114.58 122.81 2g5m h GLU 44 Ca -0.47 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 57.87 2g5m h GLU 44 Cb 1.22 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 30.39 2g5m h GLU 44 CO 0.95 0.25 0.00 0.78 -1.00 0.00 0.00 179.01 179.99 2g5m h GLY 45 N 0.40 0.00 -2.17 -3.84 0.00 -1.92 -3.42 103.07 92.11 2g5m h GLY 45 Ca 0.33 0.00 -0.49 0.00 0.00 0.00 0.00 47.33 47.17 2g5m h GLY 45 CO -0.10 0.00 -0.36 -0.32 0.00 0.00 0.00 176.54 175.77 2g5m s GLY 46 N -4.04 2.12 0.42 4.60 0.00 -0.54 -4.78 107.32 105.10 2g5m s GLY 46 Ca 0.03 -1.85 0.09 0.00 0.00 0.00 0.00 44.72 42.99 2g5m s GLY 46 CO 0.55 -1.68 2.06 0.00 0.00 0.00 0.00 173.10 174.02 2g5m h ALA 47 N 0.96 1.77 -0.19 3.20 0.00 -1.66 -2.22 119.26 121.11 2g5m h ALA 47 Ca -0.41 -0.02 -0.07 0.00 0.00 0.00 0.00 54.91 54.41 2g5m h ALA 47 Cb 1.27 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.91 2g5m h ALA 47 CO 0.56 0.19 -0.18 0.00 0.00 0.00 0.00 179.25 179.82 2g5m h ALA 48 N 1.76 1.33 0.08 0.00 0.00 -1.83 0.25 119.26 120.85 2g5m h ALA 48 Ca 0.15 -0.27 -0.28 0.00 0.00 0.00 0.00 54.91 54.52 2g5m h ALA 48 Cb 0.02 -0.10 0.03 0.00 0.00 0.00 0.00 17.79 17.73 2g5m h ALA 48 CO -0.04 0.45 -1.13 1.25 0.00 0.00 0.00 179.25 179.79 2g5m h HIS 49 N 0.31 0.97 -0.55 0.00 6.17 -1.51 0.56 115.15 121.11 2g5m h HIS 49 Ca 0.06 -0.59 -0.11 0.00 0.71 0.00 0.00 60.37 60.43 2g5m h HIS 49 Cb 0.50 -0.09 -0.02 0.00 2.52 0.00 0.00 27.41 30.33 2g5m h HIS 49 CO 0.01 1.43 -0.09 0.00 0.71 0.00 0.00 177.93 179.99 2g5m h ARG 50 N 0.24 1.02 0.08 5.26 3.08 -1.03 -3.28 114.38 119.75 2g5m h ARG 50 Ca -0.16 -0.36 -0.00 0.00 0.07 0.00 0.00 59.98 59.52 2g5m h ARG 50 Cb 1.81 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 31.79 2g5m h ARG 50 CO 0.22 1.05 -0.04 0.22 -1.07 0.00 0.00 179.97 180.35 2g5m h ASP 51 N 0.91 -0.10 0.00 7.04 1.82 -0.59 -3.49 116.42 122.02 2g5m h ASP 51 Ca 0.14 -0.16 0.00 0.00 -0.39 0.00 0.00 57.03 56.63 2g5m h ASP 51 Cb 0.65 0.02 0.00 0.00 0.68 0.00 0.00 39.33 40.69 2g5m h ASP 51 CO 0.05 0.46 0.00 0.61 -1.61 0.00 0.00 179.24 178.75 2g5m n GLY 52 N 1.42 0.59 0.40 -0.78 0.00 0.19 -5.02 105.19 101.98 2g5m n GLY 52 Ca -0.03 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.85 2g5m n GLY 52 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2g5m h ARG 53 N 3.00 -0.74 -6.22 1.61 2.47 -1.91 -3.40 114.38 109.19 2g5m h ARG 53 Ca 0.00 0.05 -0.56 0.00 -1.26 0.00 0.00 59.98 58.21 2g5m h ARG 53 Cb 0.00 0.17 -0.04 0.00 -1.65 0.00 0.00 29.97 28.45 2g5m h ARG 53 CO 0.00 -0.49 0.45 0.42 0.56 0.00 0.00 179.97 180.91 2g5m s ILE 54 N -5.24 4.84 0.39 2.04 1.01 -1.26 -5.02 121.20 117.96 2g5m s ILE 54 Ca -0.14 1.93 0.08 0.00 0.00 0.00 0.00 60.65 62.51 2g5m s ILE 54 Cb 0.04 -4.26 -0.01 0.00 0.01 0.00 0.00 42.46 38.24 2g5m s ILE 54 CO 0.48 0.06 0.45 -1.10 0.00 0.00 0.00 174.94 174.83 2g5m s GLN 55 N 1.72 2.76 0.00 2.79 -0.21 -1.26 -4.82 119.66 120.64 2g5m s GLN 55 Ca 0.46 -1.32 0.12 0.00 0.02 0.00 0.00 55.36 54.65 2g5m s GLN 55 Cb -0.18 -2.60 0.72 0.00 1.00 0.00 0.00 33.01 31.95 2g5m s GLN 55 CO 0.19 -0.14 1.23 1.55 -2.12 0.00 0.00 175.29 176.00 2g5m n VAL 56 N -1.64 0.00 0.02 1.09 3.14 -1.26 -1.89 118.33 117.80 2g5m n VAL 56 Ca 0.04 0.00 0.01 0.00 -2.96 0.00 0.00 64.34 61.43 2g5m n VAL 56 Cb 0.60 -0.44 0.02 0.00 -1.06 0.00 0.00 33.84 32.96 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 -0.78 1.77 -4.91 6.55 2.85 -1.26 -4.60 115.26 114.88 2g5m n ASN 57 Ca 0.09 -1.61 -0.27 0.00 -0.11 0.00 0.00 54.58 52.69 2g5m n ASN 57 Cb 0.04 -0.03 0.01 0.00 1.24 0.00 0.00 39.78 41.04 2g5m n ASN 57 CO 0.00 0.00 0.00 -1.81 -2.11 0.00 0.00 177.26 173.34 2g5m s ASP 58 N -0.65 6.04 -0.03 1.20 1.01 -0.79 -4.89 116.67 118.55 2g5m s ASP 58 Ca 0.04 0.83 -0.00 0.00 0.71 0.00 0.00 52.55 54.13 2g5m s ASP 58 Cb 0.03 -2.04 0.03 0.00 1.01 0.00 0.00 42.92 41.94 2g5m s ASP 58 CO 0.03 -0.73 0.02 -0.22 0.21 0.00 0.00 175.17 174.48 2g5m s LEU 59 N -4.81 0.92 -0.73 1.23 2.96 -1.26 -0.55 118.68 116.44 2g5m s LEU 59 Ca 0.49 -0.00 -0.22 0.00 -0.22 0.00 0.00 54.13 54.18 2g5m s LEU 59 Cb -0.10 -0.20 0.08 0.00 0.50 0.00 0.00 46.19 46.47 2g5m s LEU 59 CO 0.45 -0.14 1.02 -0.76 -1.32 0.00 0.00 176.35 175.60 2g5m s LEU 60 N 1.32 4.48 0.11 -0.68 1.43 -1.09 -2.95 118.68 121.29 2g5m s LEU 60 Ca -0.06 -1.23 0.21 0.00 -1.03 0.00 0.00 54.13 52.03 2g5m s LEU 60 Cb -0.13 -2.42 -0.12 0.00 0.03 0.00 0.00 46.19 43.55 2g5m s LEU 60 CO -0.03 -1.37 0.83 0.55 0.23 0.00 0.00 176.35 176.56 2g5m n VAL 61 N 5.87 0.60 -3.54 -1.59 3.14 -0.32 -4.61 118.33 117.88 2g5m n VAL 61 Ca 0.04 -0.58 -0.14 0.00 -2.96 0.00 0.00 64.34 60.70 2g5m n VAL 61 Cb 0.46 -0.33 -0.05 0.00 -1.06 0.00 0.00 33.84 32.86 2g5m n VAL 61 CO 0.00 0.00 0.00 -0.70 -6.46 0.00 0.00 176.83 169.67 2g5m s GLU 62 N -3.29 0.83 0.00 1.45 2.12 -1.22 -3.09 118.70 115.50 2g5m s GLU 62 Ca -0.03 0.14 0.00 0.00 0.36 0.00 0.00 54.97 55.44 2g5m s GLU 62 Cb 0.10 0.39 0.00 0.00 0.26 0.00 0.00 34.13 34.88 2g5m s GLU 62 CO 0.83 -0.27 0.00 1.55 -0.54 0.00 0.00 175.26 176.82 2g5m n VAL 63 N 0.71 0.00 0.15 3.70 3.14 -1.05 0.04 118.33 125.01 2g5m n VAL 63 Ca -0.14 0.00 -0.13 0.00 -2.96 0.00 0.00 64.34 61.11 2g5m n VAL 63 Cb 0.58 -1.34 -0.06 0.00 -1.06 0.00 0.00 33.84 31.96 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 0.00 -0.66 0.00 6.55 1.82 -0.73 -3.39 116.42 120.01 2g5m h ASP 64 Ca 0.00 0.07 -0.09 0.00 -0.39 0.00 0.00 57.03 56.62 2g5m h ASP 64 Cb 0.00 0.24 -0.01 0.00 0.68 0.00 0.00 39.33 40.24 2g5m h ASP 64 CO 0.00 -0.35 -1.00 0.61 -1.61 0.00 0.00 179.24 176.89 2g5m n GLY 65 N -1.37 -0.17 3.63 -0.78 0.00 -1.26 -4.92 105.19 100.33 2g5m n GLY 65 Ca -0.08 -0.07 -0.43 0.00 0.00 0.00 0.00 46.02 45.45 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 -2.22 3.21 -0.45 2.61 2.01 -1.26 -4.92 115.64 114.62 2g5m s THR 66 Ca -0.11 0.24 -0.29 0.00 0.31 0.00 0.00 61.69 61.84 2g5m s THR 66 Cb 0.03 -3.21 0.02 0.00 0.01 0.00 0.00 72.50 69.36 2g5m s THR 66 CO 0.15 -0.08 1.27 -0.44 -0.69 0.00 0.00 174.62 174.82 2g5m s SER 67 N 5.69 6.49 0.22 3.53 0.01 -1.26 -2.54 113.70 125.83 2g5m s SER 67 Ca 0.88 0.61 0.00 0.00 1.31 0.00 0.00 55.95 58.75 2g5m s SER 67 Cb -0.34 -2.55 0.00 0.00 0.21 0.00 0.00 66.02 63.34 2g5m s SER 67 CO 0.36 -1.35 0.00 0.18 0.41 0.00 0.00 173.24 172.84 2g5m n LEU 68 N 8.33 0.00 0.00 2.44 4.77 -1.23 -4.98 117.00 126.33 2g5m n LEU 68 Ca 0.14 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.12 2g5m n LEU 68 Cb 0.49 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.58 2g5m n LEU 68 CO 0.71 -0.24 0.00 0.55 -1.33 0.00 0.00 177.39 177.09 2g5m n VAL 69 N -0.69 0.00 0.00 4.08 3.14 -1.18 -4.79 118.33 118.89 2g5m n VAL 69 Ca 0.00 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.38 2g5m n VAL 69 Cb 0.00 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 32.78 2g5m n VAL 69 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 2g5m n GLY 70 N 0.00 -1.89 4.03 7.55 0.00 -0.92 -2.48 105.19 111.48 2g5m n GLY 70 Ca 0.00 0.87 -0.20 0.00 0.00 0.00 0.00 46.02 46.70 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 2.19 0.70 1.61 -7.23 -1.26 -4.46 120.40 111.95 2g5m s VAL 71 Ca 0.00 -0.99 -0.11 0.00 -1.81 0.00 0.00 61.98 59.07 2g5m s VAL 71 Cb 0.00 -2.20 0.01 0.00 0.56 0.00 0.00 36.38 34.75 2g5m s VAL 71 CO 0.00 0.00 1.07 0.42 -0.31 0.00 0.00 175.10 176.28 2g5m s THR 72 N -2.67 3.88 0.25 5.32 -4.23 -1.26 -4.82 115.64 112.12 2g5m s THR 72 Ca 0.62 0.61 -0.05 0.00 -1.18 0.00 0.00 61.69 61.69 2g5m s THR 72 Cb -0.06 -3.45 0.24 0.00 1.34 0.00 0.00 72.50 70.57 2g5m s THR 72 CO 0.39 -0.80 1.88 -0.61 -0.54 0.00 0.00 174.62 174.94 2g5m h GLN 73 N -0.70 1.10 -0.41 3.99 4.15 -1.93 -0.14 115.11 121.17 2g5m h GLN 73 Ca -0.45 -0.07 -0.13 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 28.65 2g5m h GLN 73 CO 0.60 0.73 -0.27 0.77 -1.93 0.00 0.00 178.83 178.73 2g5m h SER 74 N 1.14 0.89 -0.17 -0.69 0.02 -1.98 -1.14 113.55 111.61 2g5m h SER 74 Ca 0.39 -0.35 -0.01 0.00 -0.84 0.00 0.00 61.79 60.98 2g5m h SER 74 Cb 0.08 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 62.37 2g5m h SER 74 CO -0.15 1.10 0.07 0.15 -1.14 0.00 0.00 176.83 176.87 2g5m h PHE 75 N 0.73 0.26 -0.50 3.45 3.04 -1.71 -1.79 116.94 120.41 2g5m h PHE 75 Ca 0.09 -0.02 0.02 0.00 3.98 0.00 0.00 57.97 62.04 2g5m h PHE 75 Cb 0.82 -0.08 -0.03 0.00 2.56 0.00 0.00 35.95 39.22 2g5m h PHE 75 CO 0.05 0.31 0.30 0.00 -2.02 0.00 0.00 178.31 176.94 2g5m h ALA 76 N 0.92 0.64 -0.69 2.41 0.00 -0.90 -1.87 119.26 119.77 2g5m h ALA 76 Ca 0.06 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.97 2g5m h ALA 76 Cb 0.15 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.77 2g5m h ALA 76 CO -0.01 -0.00 0.46 0.00 0.00 0.00 0.00 179.25 179.70 2g5m h ALA 77 N 1.22 1.51 0.00 0.00 0.00 -0.97 -1.36 119.26 119.67 2g5m h ALA 77 Ca 0.20 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.06 2g5m h ALA 77 Cb 0.02 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.53 2g5m h ALA 77 CO -0.09 0.45 0.00 -1.13 0.00 0.00 0.00 179.25 178.48 2g5m n SER 78 N -4.43 0.80 0.01 0.00 3.41 -0.69 -3.23 113.62 109.49 2g5m n SER 78 Ca 0.07 0.60 -0.13 0.00 -0.26 0.00 0.00 58.87 59.15 2g5m n SER 78 Cb 0.04 -0.80 -0.01 0.00 -0.26 0.00 0.00 64.21 63.17 2g5m n SER 78 CO 0.00 0.00 0.00 1.62 -0.16 0.00 0.00 175.04 176.50 2g5m h VAL 79 N 0.00 1.33 0.00 -3.33 3.04 -0.47 -2.69 116.25 114.13 2g5m h VAL 79 Ca 0.00 -2.04 0.00 0.00 -1.01 0.00 0.00 66.70 63.65 2g5m h VAL 79 Cb 0.66 2.03 0.00 0.00 -2.01 0.00 0.00 31.29 31.97 2g5m h VAL 79 CO 0.00 0.63 0.02 -0.07 -1.01 0.00 0.00 177.57 177.14 2g5m h LEU 80 N 0.41 0.00 -0.64 3.16 -0.00 -1.56 0.61 115.31 117.29 2g5m h LEU 80 Ca -0.04 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.84 2g5m h LEU 80 Cb 1.34 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 42.00 2g5m h LEU 80 CO 0.14 0.00 -0.66 0.54 -0.00 0.00 0.00 178.44 178.46 2g5m n ARG 81 N -2.88 0.82 -0.11 1.13 1.74 -1.04 -4.15 116.66 112.17 2g5m n ARG 81 Ca -0.03 -0.64 0.03 0.00 -0.77 0.00 0.00 57.85 56.45 2g5m n ARG 81 Cb 0.08 -1.48 0.09 0.00 -1.02 0.00 0.00 32.46 30.13 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 -0.55 2.55 -2.90 0.55 3.02 0.14 -5.01 115.26 113.06 2g5m n ASN 82 Ca 0.07 -2.07 -0.08 0.00 -0.03 0.00 0.00 54.58 52.47 2g5m n ASN 82 Cb 0.42 -0.15 0.04 0.00 -0.61 0.00 0.00 39.78 39.48 2g5m n ASN 82 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 2g5m n THR 83 N -0.01 0.00 -0.75 3.41 -2.24 -0.77 -5.05 114.28 108.86 2g5m n THR 83 Ca 0.07 -0.55 0.00 0.00 -2.27 0.00 0.00 64.05 61.30 2g5m n THR 83 Cb 0.38 -1.21 0.00 0.00 -2.10 0.00 0.00 70.33 67.40 2g5m n THR 83 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2g5m n LYS 84 N -1.65 -0.20 -0.03 -0.78 5.02 -1.26 -5.01 118.16 114.25 2g5m n LYS 84 Ca 0.06 0.00 -0.13 0.00 -2.02 0.00 0.00 58.31 56.21 2g5m n LYS 84 Cb 0.21 0.00 -0.11 0.00 -0.02 0.00 0.00 35.03 35.11 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 -0.15 0.03 -6.09 0.72 0.00 -1.99 -3.42 103.07 92.16 2g5m h GLY 85 Ca 0.00 -0.04 -0.67 0.00 0.00 0.00 0.00 47.33 46.62 2g5m h GLY 85 CO 0.00 0.03 -0.83 -1.60 0.00 0.00 0.00 176.54 174.14 2g5m s ARG 86 N -3.54 3.08 0.09 4.80 3.52 -1.26 -4.63 118.95 121.00 2g5m s ARG 86 Ca -0.17 -0.79 0.05 0.00 -0.13 0.00 0.00 55.73 54.69 2g5m s ARG 86 Cb 0.00 -2.62 -0.03 0.00 -1.56 0.00 0.00 34.95 30.74 2g5m s ARG 86 CO 0.69 -0.15 -0.14 0.14 -0.81 0.00 0.00 175.30 175.03 2g5m s VAL 87 N 1.19 1.20 0.51 7.11 -7.23 -1.25 -5.03 120.40 116.90 2g5m s VAL 87 Ca 0.02 -1.48 0.03 0.00 -1.81 0.00 0.00 61.98 58.74 2g5m s VAL 87 Cb -0.14 -1.27 0.03 0.00 0.56 0.00 0.00 36.38 35.55 2g5m s VAL 87 CO -0.08 -0.31 0.72 -0.13 -0.31 0.00 0.00 175.10 174.99 2g5m s ARG 88 N -2.14 2.64 0.01 4.82 0.52 -1.26 -2.32 118.95 121.22 2g5m s ARG 88 Ca 0.03 -0.88 -0.06 0.00 -0.52 0.00 0.00 55.73 54.29 2g5m s ARG 88 Cb -0.08 -2.56 -0.00 0.00 0.52 0.00 0.00 34.95 32.83 2g5m s ARG 88 CO 0.02 -0.58 0.12 -0.06 0.02 0.00 0.00 175.30 174.82 2g5m s PHE 89 N -2.65 0.09 -0.34 -0.53 0.08 0.10 0.06 117.98 114.80 2g5m s PHE 89 Ca 0.56 -0.25 -0.13 0.00 0.12 0.00 0.00 56.93 57.23 2g5m s PHE 89 Cb -0.10 -0.08 -0.01 0.00 -0.57 0.00 0.00 43.02 42.25 2g5m s PHE 89 CO 0.37 -0.30 0.24 -1.64 -0.10 0.00 0.00 175.22 173.79 2g5m s MET 90 N -1.68 3.45 -0.19 0.44 -1.94 0.11 -0.53 119.30 118.96 2g5m s MET 90 Ca -0.13 -0.67 -0.13 0.00 -1.71 0.00 0.00 55.69 53.05 2g5m s MET 90 Cb -0.06 -3.79 -0.05 0.00 2.01 0.00 0.00 34.83 32.94 2g5m s MET 90 CO -0.00 -0.46 0.27 0.42 -0.01 0.00 0.00 175.02 175.25 2g5m s ILE 91 N 1.71 5.30 -0.23 2.53 1.09 0.87 -1.18 121.20 131.29 2g5m s ILE 91 Ca 0.06 0.47 -0.06 0.00 -1.10 0.00 0.00 60.65 60.02 2g5m s ILE 91 Cb -0.17 -3.61 -0.02 0.00 -1.06 0.00 0.00 42.46 37.59 2g5m s ILE 91 CO 0.10 0.35 0.02 -0.83 -0.10 0.00 0.00 174.94 174.48 2g5m s GLY 92 N 0.72 1.71 -0.15 6.18 0.00 -1.15 -0.75 107.32 113.88 2g5m s GLY 92 Ca 0.14 -1.12 0.02 0.00 0.00 0.00 0.00 44.72 43.77 2g5m s GLY 92 CO 0.04 0.45 -0.20 -1.60 0.00 0.00 0.00 173.10 171.79 2g5m s ARG 93 N 1.46 2.88 -1.18 2.90 3.52 -0.49 -4.42 118.95 123.62 2g5m s ARG 93 Ca 0.05 -0.80 -0.15 0.00 -0.13 0.00 0.00 55.73 54.70 2g5m s ARG 93 Cb -0.15 -2.39 0.15 0.00 -1.56 0.00 0.00 34.95 31.00 2g5m s ARG 93 CO 0.01 -0.09 1.44 -2.00 -0.81 0.00 0.00 175.30 173.85 2g5m s GLU 94 N 1.02 4.00 0.02 5.12 2.12 -1.26 0.14 118.70 129.85 2g5m s GLU 94 Ca -0.03 -2.34 -0.18 0.00 0.36 0.00 0.00 54.97 52.78 2g5m s GLU 94 Cb -0.15 -5.13 -0.10 0.00 0.26 0.00 0.00 34.13 29.02 2g5m s GLU 94 CO -0.06 -1.86 1.12 -0.09 -0.54 0.00 0.00 175.26 173.84 2g5m h ARG 95 N 7.51 -0.63 -7.30 4.30 2.43 -1.87 -3.46 114.38 115.36 2g5m h ARG 95 Ca 0.31 0.04 -0.52 0.00 -0.81 0.00 0.00 59.98 59.01 2g5m h ARG 95 Cb 0.90 0.14 0.15 0.00 -0.42 0.00 0.00 29.97 30.74 2g5m h ARG 95 CO 1.27 -0.42 0.29 -1.25 -1.51 0.00 0.00 179.97 178.35 2g5m s PRO 96 N -4.17 1.91 0.00 0.20 0.04 -1.26 -4.68 135.00 127.05 2g5m s PRO 96 Ca -0.10 1.28 0.00 0.00 0.04 0.00 0.00 61.00 62.23 2g5m s PRO 96 Cb 0.01 -1.85 0.00 0.00 0.04 0.00 0.00 34.50 32.70 2g5m s PRO 96 CO 0.29 -1.92 0.00 0.41 0.04 0.00 0.00 177.00 175.82 2g5m n GLY 97 N -0.80 2.05 0.20 0.56 0.00 -1.26 -4.94 105.19 101.00 2g5m n GLY 97 Ca 0.10 -0.19 -0.02 0.00 0.00 0.00 0.00 46.02 45.91 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 0.25 -5.85 1.61 4.11 -1.98 -3.48 114.58 109.23 2g5m h GLU 98 Ca 0.00 -0.11 -0.17 0.00 0.07 0.00 0.00 59.36 59.14 2g5m h GLU 98 Cb 0.00 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.25 2g5m h GLU 98 CO 0.00 0.60 -0.59 0.94 0.07 0.00 0.00 179.01 180.03 2g5m n GLN 99 N -4.05 -1.78 -3.33 1.06 -0.06 -1.26 -5.00 117.38 102.97 2g5m n GLN 99 Ca -0.01 1.50 -0.25 0.00 -2.00 0.00 0.00 57.00 56.24 2g5m n GLN 99 Cb 0.46 -4.34 -0.02 0.00 -4.06 0.00 0.00 30.24 22.28 2g5m n GLN 99 CO 0.00 0.00 0.00 -1.12 -0.20 0.00 0.00 177.06 175.74 2g5m s SER 100 N -2.62 6.33 0.22 1.69 0.01 -1.26 -4.99 113.70 113.08 2g5m s SER 100 Ca 0.14 0.55 0.21 0.00 1.31 0.00 0.00 55.95 58.15 2g5m s SER 100 Cb -0.03 -2.07 0.03 0.00 0.21 0.00 0.00 66.02 64.16 2g5m s SER 100 CO 0.81 -0.28 1.12 -0.08 0.41 0.00 0.00 173.24 175.22 2g5m h GLU 101 N 1.00 0.00 -2.46 12.44 4.81 -1.98 -3.37 114.58 125.01 2g5m h GLU 101 Ca -0.49 0.00 -0.66 0.00 -0.13 0.00 0.00 59.36 58.08 2g5m h GLU 101 Cb 1.21 0.00 -0.38 0.00 0.63 0.00 0.00 28.75 30.21 2g5m h GLU 101 CO 0.63 0.09 -0.23 1.33 -0.73 0.00 0.00 179.01 180.10 2g5m n VAL 102 N -2.83 3.10 -1.33 0.32 0.24 -1.26 -4.43 118.33 112.14 2g5m n VAL 102 Ca -0.01 -5.38 0.00 0.00 -2.04 0.00 0.00 64.34 56.91 2g5m n VAL 102 Cb 0.62 -2.11 0.00 0.00 -1.47 0.00 0.00 33.84 30.87 2g5m n VAL 102 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2g5m n ALA 103 N 1.08 1.33 -3.16 2.33 0.00 -1.26 -4.95 120.51 115.88 2g5m n ALA 103 Ca 0.28 -0.67 0.02 0.00 0.00 0.00 0.00 53.44 53.08 2g5m n ALA 103 Cb 0.39 -0.16 -0.01 0.00 0.00 0.00 0.00 19.45 19.67 2g5m n ALA 103 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 2g5m s GLN 104 N -0.00 0.67 -0.44 0.00 2.00 -1.26 -5.11 119.66 115.52 2g5m s GLN 104 Ca 0.00 0.03 0.04 0.00 -2.00 0.00 0.00 55.36 53.43 2g5m s GLN 104 Cb 0.00 0.14 0.12 0.00 0.80 0.00 0.00 33.01 34.07 2g5m s GLN 104 CO 0.00 -1.05 0.18 -0.51 -0.50 0.00 0.00 175.29 173.41 2g5m s LEU 105 N 2.22 4.19 -0.14 3.68 1.02 -1.26 -4.91 118.68 123.48 2g5m s LEU 105 Ca 0.14 -2.62 -0.12 0.00 0.02 0.00 0.00 54.13 51.55 2g5m s LEU 105 Cb -0.05 -1.53 -0.04 0.00 0.02 0.00 0.00 46.19 44.58 2g5m s LEU 105 CO -0.14 -0.29 -0.24 -0.38 0.02 0.00 0.00 176.35 175.31 2g5m n ILE 106 N 3.62 1.20 0.00 -0.59 2.08 -1.26 -4.96 119.36 119.45 2g5m n ILE 106 Ca 0.05 0.23 0.00 0.00 0.56 0.00 0.00 62.75 63.58 2g5m n ILE 106 Cb 0.36 -2.20 0.00 0.00 -0.75 0.00 0.00 39.64 37.05 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 -4.12 0.00 -2.59 0.38 7.27 -1.26 -4.41 117.38 112.65 2g5m n GLN 107 Ca -0.10 0.00 -0.05 0.00 0.07 0.00 0.00 57.00 56.92 2g5m n GLN 107 Cb 0.36 -0.85 0.01 0.00 2.41 0.00 0.00 30.24 32.16 2g5m n GLN 107 CO 0.00 0.00 0.00 1.04 0.07 0.00 0.00 177.06 178.17 2g5m n GLN 108 N 0.00 -1.71 -0.05 3.69 1.13 -1.26 -4.99 117.38 114.18 2g5m n GLN 108 Ca 0.00 1.68 -0.16 0.00 -1.94 0.00 0.00 57.00 56.58 2g5m n GLN 108 Cb 0.00 -4.79 -0.13 0.00 0.11 0.00 0.00 30.24 25.43 2g5m n GLN 108 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2g5m h THR 109 N 1.33 1.64 0.00 5.09 1.03 -2.02 -3.36 112.91 116.62 2g5m h THR 109 Ca 0.00 -2.37 0.00 0.00 -0.01 0.00 0.00 66.41 64.03 2g5m h THR 109 Cb 0.82 3.23 0.00 0.00 -1.07 0.00 0.00 68.15 71.13 2g5m h THR 109 CO 0.17 0.60 -0.80 0.18 -0.01 0.00 0.00 175.52 175.66 2g5m n LEU 110 N -4.49 0.64 -4.38 0.00 4.77 -1.26 -4.66 117.00 107.63 2g5m n LEU 110 Ca -0.13 0.09 -0.45 0.00 -0.03 0.00 0.00 56.01 55.49 2g5m n LEU 110 Cb 0.57 -0.15 -0.06 0.00 -2.33 0.00 0.00 43.42 41.46 2g5m n LEU 110 CO 0.35 0.01 0.25 -0.70 -1.33 0.00 0.00 177.39 175.97 2g5m s GLU 111 N -3.17 3.04 -0.30 3.23 2.56 -1.26 -4.98 118.70 117.82 2g5m s GLU 111 Ca 0.05 -1.29 0.03 0.00 0.00 0.00 0.00 54.97 53.76 2g5m s GLU 111 Cb 0.14 -4.20 0.09 0.00 2.00 0.00 0.00 34.13 32.16 2g5m s GLU 111 CO 0.76 -1.30 0.01 1.14 -0.56 0.00 0.00 175.26 175.30 2g5m s GLN 112 N 2.23 1.57 0.00 4.30 0.00 -1.26 -4.78 119.66 121.73 2g5m s GLN 112 Ca 0.09 -1.54 0.00 0.00 -0.00 0.00 0.00 55.36 53.91 2g5m s GLN 112 Cb -0.24 -2.91 0.00 0.00 0.00 0.00 0.00 33.01 29.86 2g5m s GLN 112 CO 0.07 -0.82 0.04 -1.91 0.00 0.00 0.00 175.29 172.68