#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 0.82 -3.31 1.61 3.86 -2.04 -3.39 115.15 112.71 2g5m h HIS 2 Ca 0.00 -0.24 -0.65 0.00 -1.16 0.00 0.00 60.37 58.32 2g5m h HIS 2 Cb 0.00 -0.17 -0.25 0.00 1.06 0.00 0.00 27.41 28.05 2g5m h HIS 2 CO 0.00 0.98 -0.73 -1.64 0.86 0.00 0.00 177.93 177.40 2g5m s MET 3 N -4.37 3.48 -0.73 2.45 1.00 -1.26 -4.60 119.30 115.27 2g5m s MET 3 Ca -0.12 -0.63 -0.22 0.00 0.00 0.00 0.00 55.69 54.72 2g5m s MET 3 Cb 0.09 -2.73 0.09 0.00 0.00 0.00 0.00 34.83 32.27 2g5m s MET 3 CO 0.83 0.22 1.01 -1.21 0.00 0.00 0.00 175.02 175.87 2g5m s GLU 4 N 0.36 3.24 -0.97 2.03 2.02 -0.39 -4.82 118.70 120.17 2g5m s GLU 4 Ca -0.09 -1.08 -0.20 0.00 0.02 0.00 0.00 54.97 53.62 2g5m s GLU 4 Cb -0.15 -4.43 0.11 0.00 0.10 0.00 0.00 34.13 29.75 2g5m s GLU 4 CO 0.05 -1.81 1.25 -0.51 0.02 0.00 0.00 175.26 174.25 2g5m s LEU 5 N 3.72 4.55 0.00 1.80 2.01 -1.25 -0.40 118.68 129.10 2g5m s LEU 5 Ca 0.25 -1.89 0.02 0.00 0.01 0.00 0.00 54.13 52.52 2g5m s LEU 5 Cb -0.14 -2.46 -0.04 0.00 0.01 0.00 0.00 46.19 43.57 2g5m s LEU 5 CO 0.05 -1.20 -0.02 0.72 1.01 0.00 0.00 176.35 176.91 2g5m s PHE 6 N 3.40 3.01 0.25 0.29 -0.12 0.50 -4.85 117.98 120.46 2g5m s PHE 6 Ca 0.38 0.04 -0.30 0.00 -0.05 0.00 0.00 56.93 57.00 2g5m s PHE 6 Cb -0.03 -1.65 -0.09 0.00 -0.63 0.00 0.00 43.02 40.62 2g5m s PHE 6 CO -0.09 0.44 1.13 -1.25 -0.05 0.00 0.00 175.22 175.39 2g5m s PRO 7 N -1.55 4.60 -0.08 1.99 0.04 -1.26 -0.28 135.00 138.46 2g5m s PRO 7 Ca 0.19 1.83 0.01 0.00 0.04 0.00 0.00 61.00 63.07 2g5m s PRO 7 Cb -0.11 -3.20 0.02 0.00 0.04 0.00 0.00 34.50 31.24 2g5m s PRO 7 CO 0.10 0.12 -0.10 0.08 0.04 0.00 0.00 177.00 177.24 2g5m s VAL 8 N -0.85 1.05 -0.11 -0.36 1.01 0.23 -4.90 120.40 116.47 2g5m s VAL 8 Ca 0.47 -0.38 -0.02 0.00 0.00 0.00 0.00 61.98 62.04 2g5m s VAL 8 Cb -0.32 -1.00 -0.03 0.00 0.00 0.00 0.00 36.38 35.03 2g5m s VAL 8 CO 0.40 0.35 -0.03 -0.70 0.00 0.00 0.00 175.10 175.12 2g5m s GLU 9 N 1.04 3.23 0.09 2.72 2.12 -1.26 0.18 118.70 126.82 2g5m s GLU 9 Ca -0.08 -0.48 -0.01 0.00 0.36 0.00 0.00 54.97 54.77 2g5m s GLU 9 Cb -0.15 -2.81 -0.04 0.00 0.26 0.00 0.00 34.13 31.39 2g5m s GLU 9 CO -0.01 0.50 0.00 -1.17 -0.54 0.00 0.00 175.26 174.05 2g5m s LEU 10 N -0.34 2.20 0.11 2.70 0.20 -0.96 -4.72 118.68 117.87 2g5m s LEU 10 Ca 0.06 -1.09 0.03 0.00 0.69 0.00 0.00 54.13 53.82 2g5m s LEU 10 Cb -0.12 0.22 -0.04 0.00 -0.43 0.00 0.00 46.19 45.82 2g5m s LEU 10 CO 0.02 -0.65 -0.08 -1.83 -0.29 0.00 0.00 176.35 173.53 2g5m s GLU 11 N -3.97 0.91 0.14 1.98 -1.05 -1.26 -2.11 118.70 113.34 2g5m s GLU 11 Ca 0.14 -1.35 -0.30 0.00 -0.15 0.00 0.00 54.97 53.32 2g5m s GLU 11 Cb 0.08 -0.38 -0.07 0.00 -0.44 0.00 0.00 34.13 33.32 2g5m s GLU 11 CO -0.05 0.02 1.05 0.15 0.95 0.00 0.00 175.26 177.39 2g5m s LYS 12 N -3.66 4.62 0.83 -4.83 -0.14 0.12 -4.77 119.74 111.91 2g5m s LYS 12 Ca 0.12 1.61 -0.07 0.00 -1.36 0.00 0.00 55.97 56.28 2g5m s LYS 12 Cb 0.03 -3.32 0.18 0.00 -1.68 0.00 0.00 37.83 33.04 2g5m s LYS 12 CO -0.02 0.10 1.13 -3.47 -0.76 0.00 0.00 175.35 172.33 2g5m n ASP 13 N 2.66 0.87 0.22 2.83 -0.08 0.82 -4.86 116.55 119.00 2g5m n ASP 13 Ca 0.03 -1.89 0.05 0.00 -1.51 0.00 0.00 54.79 51.47 2g5m n ASP 13 Cb 0.47 -0.79 0.47 0.00 2.34 0.00 0.00 41.12 43.62 2g5m n ASP 13 CO 0.00 0.00 0.00 0.28 0.12 0.00 0.00 177.20 177.60 2g5m h SER 14 N -1.04 0.00 0.37 1.67 0.02 -1.96 -0.85 113.55 111.75 2g5m h SER 14 Ca -0.37 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.58 2g5m h SER 14 Cb 1.21 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.75 2g5m h SER 14 CO 0.34 0.23 -0.52 1.21 -1.14 0.00 0.00 176.83 176.94 2g5m n GLU 15 N -4.24 0.18 0.00 3.45 2.13 -1.26 -5.03 120.64 115.87 2g5m n GLU 15 Ca -0.02 -0.12 0.00 0.00 0.66 0.00 0.00 57.16 57.68 2g5m n GLU 15 Cb 0.29 -1.50 0.00 0.00 0.27 0.00 0.00 31.44 30.50 2g5m n GLU 15 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2g5m n GLY 16 N 1.47 1.13 1.32 8.31 0.00 -0.33 -4.97 105.19 112.12 2g5m n GLY 16 Ca 0.07 -0.79 -0.07 0.00 0.00 0.00 0.00 46.02 45.23 2g5m n GLY 16 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2g5m n LEU 17 N 0.00 0.00 -2.71 0.99 7.94 -1.26 -0.13 117.00 121.84 2g5m n LEU 17 Ca 0.00 -0.83 -0.07 0.00 -1.11 0.00 0.00 56.01 54.00 2g5m n LEU 17 Cb 0.00 -0.16 0.09 0.00 0.53 0.00 0.00 43.42 43.89 2g5m n LEU 17 CO 0.00 -0.59 0.47 0.61 -1.11 0.00 0.00 177.39 176.78 2g5m n GLY 18 N 2.57 0.13 3.83 -3.96 0.00 -1.26 -2.03 105.19 104.47 2g5m n GLY 18 Ca 0.06 0.20 -0.07 0.00 0.00 0.00 0.00 46.02 46.21 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 0.19 0.00 0.02 -0.61 -4.36 -1.26 -1.00 121.20 114.18 2g5m s ILE 19 Ca 0.21 -0.85 0.01 0.00 -0.26 0.00 0.00 60.65 59.75 2g5m s ILE 19 Cb 0.29 -2.75 -0.02 0.00 1.25 0.00 0.00 42.46 41.24 2g5m s ILE 19 CO -0.09 0.00 -0.04 -0.44 0.24 0.00 0.00 174.94 174.61 2g5m s SER 20 N -3.15 0.35 0.37 4.36 0.01 0.32 -4.67 113.70 111.30 2g5m s SER 20 Ca 0.17 -0.38 0.08 0.00 1.31 0.00 0.00 55.95 57.13 2g5m s SER 20 Cb -0.04 0.05 -0.05 0.00 0.21 0.00 0.00 66.02 66.19 2g5m s SER 20 CO 0.09 -0.19 0.09 0.27 0.41 0.00 0.00 173.24 173.91 2g5m s ILE 21 N -1.05 2.52 -0.05 1.44 -4.36 -1.26 0.65 121.20 119.10 2g5m s ILE 21 Ca -0.10 -1.83 -0.03 0.00 -0.26 0.00 0.00 60.65 58.43 2g5m s ILE 21 Cb -0.07 -2.92 0.02 0.00 1.25 0.00 0.00 42.46 40.74 2g5m s ILE 21 CO -0.00 -0.11 0.11 -0.51 0.24 0.00 0.00 174.94 174.67 2g5m s ILE 22 N -2.55 -0.02 -0.44 8.37 1.10 0.66 -4.49 121.20 123.83 2g5m s ILE 22 Ca 0.38 0.08 -0.22 0.00 -0.51 0.00 0.00 60.65 60.38 2g5m s ILE 22 Cb 0.02 -0.17 0.02 0.00 0.15 0.00 0.00 42.46 42.48 2g5m s ILE 22 CO 0.21 0.03 0.71 -0.83 -2.11 0.00 0.00 174.94 172.95 2g5m s GLY 23 N 0.52 1.66 0.38 1.50 0.00 -1.26 -1.46 107.32 108.66 2g5m s GLY 23 Ca -0.04 -1.09 0.04 0.00 0.00 0.00 0.00 44.72 43.63 2g5m s GLY 23 CO -0.02 1.65 0.13 1.03 0.00 0.00 0.00 173.10 175.89 2g5m n MET 24 N 6.47 0.62 0.00 2.90 2.81 0.02 -5.01 117.12 124.93 2g5m n MET 24 Ca 0.00 -3.22 0.00 0.00 -1.81 0.00 0.00 57.70 52.67 2g5m n MET 24 Cb 0.48 1.70 0.00 0.00 -0.71 0.00 0.00 33.22 34.69 2g5m n MET 24 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2g5m n GLY 25 N -0.58 3.38 3.66 3.03 0.00 -1.26 0.17 105.19 113.58 2g5m n GLY 25 Ca -0.06 -1.66 -0.05 0.00 0.00 0.00 0.00 46.02 44.25 2g5m n GLY 25 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2g5m s ALA 26 N -1.57 -1.73 0.00 4.61 0.00 -1.26 -4.84 121.76 116.96 2g5m s ALA 26 Ca 0.00 0.47 0.00 0.00 0.00 0.00 0.00 51.96 52.43 2g5m s ALA 26 Cb 0.00 0.55 0.00 0.00 0.00 0.00 0.00 23.12 23.67 2g5m s ALA 26 CO 0.00 -0.91 0.00 0.41 0.00 0.00 0.00 175.76 175.26 2g5m n GLY 27 N -0.39 0.33 3.56 0.00 0.00 -1.26 -4.92 105.19 102.52 2g5m n GLY 27 Ca -0.07 -1.11 -0.33 0.00 0.00 0.00 0.00 46.02 44.51 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 2.16 0.14 4.61 0.00 -1.26 -4.78 121.76 121.62 2g5m s ALA 28 Ca 0.00 -1.89 -0.10 0.00 0.00 0.00 0.00 51.96 49.97 2g5m s ALA 28 Cb 0.00 -4.55 -0.06 0.00 0.00 0.00 0.00 23.12 18.51 2g5m s ALA 28 CO 0.00 -4.29 1.41 0.22 0.00 0.00 0.00 175.76 173.10 2g5m h ASP 29 N 10.48 0.91 0.60 0.00 3.58 -1.94 0.34 116.42 130.40 2g5m h ASP 29 Ca 0.16 -0.50 0.00 0.00 0.42 0.00 0.00 57.03 57.10 2g5m h ASP 29 Cb 1.00 -0.26 0.00 0.00 1.72 0.00 0.00 39.33 41.79 2g5m h ASP 29 CO 1.31 1.29 -0.23 1.15 -2.88 0.00 0.00 179.24 179.87 2g5m n MET 30 N -3.99 0.22 -0.10 0.28 0.00 -1.26 -3.21 117.12 109.06 2g5m n MET 30 Ca -0.04 -0.09 -0.20 0.00 0.00 0.00 0.00 57.70 57.36 2g5m n MET 30 Cb 0.64 -1.50 -0.07 0.00 0.00 0.00 0.00 33.22 32.29 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 1.44 -0.35 0.00 3.17 0.00 -1.12 -4.90 105.19 103.44 2g5m n GLY 31 Ca 0.09 -0.13 -0.01 0.00 0.00 0.00 0.00 46.02 45.97 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 -3.99 1.65 -2.46 0.99 4.77 0.83 -5.01 117.00 113.77 2g5m n LEU 32 Ca -0.37 -0.00 -0.12 0.00 -0.03 0.00 0.00 56.01 55.49 2g5m n LEU 32 Cb 0.74 -0.01 -0.01 0.00 -2.33 0.00 0.00 43.42 41.81 2g5m n LEU 32 CO 0.04 0.29 -0.15 -1.84 -1.33 0.00 0.00 177.39 174.41 2g5m n GLU 33 N -2.30 -2.31 -2.11 3.23 0.28 0.84 -4.79 120.64 113.49 2g5m n GLU 33 Ca -0.02 0.56 -0.40 0.00 -0.16 0.00 0.00 57.16 57.14 2g5m n GLU 33 Cb 0.52 -5.16 -0.03 0.00 1.43 0.00 0.00 31.44 28.21 2g5m n GLU 33 CO 0.00 0.00 0.00 -1.59 -0.16 0.00 0.00 177.13 175.38 2g5m s LYS 34 N -5.05 2.91 0.14 3.44 0.00 -1.21 -3.93 119.74 116.04 2g5m s LYS 34 Ca 0.01 0.74 -0.02 0.00 0.00 0.00 0.00 55.97 56.70 2g5m s LYS 34 Cb -0.00 -4.29 -0.05 0.00 0.00 0.00 0.00 37.83 33.49 2g5m s LYS 34 CO 0.01 -2.39 0.33 -0.51 0.00 0.00 0.00 175.35 172.79 2g5m s LEU 35 N 8.00 4.28 -0.53 2.77 1.43 -1.25 -4.14 118.68 129.24 2g5m s LEU 35 Ca 0.66 0.41 -0.04 0.00 -1.03 0.00 0.00 54.13 54.14 2g5m s LEU 35 Cb -0.14 -3.14 0.14 0.00 0.03 0.00 0.00 46.19 43.07 2g5m s LEU 35 CO 0.24 0.05 0.34 -0.83 0.23 0.00 0.00 176.35 176.39 2g5m s GLY 36 N -2.75 2.26 -1.07 -3.19 0.00 0.13 -4.63 107.32 98.07 2g5m s GLY 36 Ca 0.38 -2.91 -0.18 0.00 0.00 0.00 0.00 44.72 42.02 2g5m s GLY 36 CO 0.27 1.07 1.34 -0.42 0.00 0.00 0.00 173.10 175.36 2g5m s ILE 37 N 0.55 4.62 0.67 0.90 -1.09 -1.26 -0.80 121.20 124.79 2g5m s ILE 37 Ca 0.12 -1.80 -0.08 0.00 -2.23 0.00 0.00 60.65 56.67 2g5m s ILE 37 Cb -0.22 -4.91 0.03 0.00 -1.58 0.00 0.00 42.46 35.79 2g5m s ILE 37 CO -0.04 -1.67 1.00 -0.36 -1.23 0.00 0.00 174.94 172.65 2g5m s PHE 38 N 2.89 3.13 0.08 3.97 0.08 -0.53 -2.65 117.98 124.95 2g5m s PHE 38 Ca 0.40 0.67 -0.30 0.00 0.12 0.00 0.00 56.93 57.82 2g5m s PHE 38 Cb -0.02 -3.02 -0.05 0.00 -0.57 0.00 0.00 43.02 39.35 2g5m s PHE 38 CO -0.05 -1.17 0.98 0.08 -0.10 0.00 0.00 175.22 174.96 2g5m s VAL 39 N -3.20 4.58 -0.20 -0.44 1.01 0.04 -0.24 120.40 121.94 2g5m s VAL 39 Ca 0.57 2.03 -0.05 0.00 0.00 0.00 0.00 61.98 64.54 2g5m s VAL 39 Cb -0.11 -4.30 -0.20 0.00 0.00 0.00 0.00 36.38 31.77 2g5m s VAL 39 CO 0.47 0.26 0.03 1.17 0.00 0.00 0.00 175.10 177.02 2g5m n LYS 40 N 3.16 0.68 -3.64 2.72 4.81 0.21 -4.53 118.16 121.57 2g5m n LYS 40 Ca 0.04 0.24 -0.10 0.00 -0.87 0.00 0.00 58.31 57.61 2g5m n LYS 40 Cb 0.50 -1.61 -0.03 0.00 0.02 0.00 0.00 35.03 33.90 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 -2.52 0.02 -0.28 3.15 -1.32 -1.08 -4.96 115.64 108.65 2g5m s THR 41 Ca -0.30 -0.55 0.02 0.00 -1.21 0.00 0.00 61.69 59.65 2g5m s THR 41 Cb 0.08 -1.38 0.06 0.00 -1.51 0.00 0.00 72.50 69.75 2g5m s THR 41 CO 0.65 -0.11 -0.06 -0.69 -2.21 0.00 0.00 174.62 172.21 2g5m s VAL 42 N -3.83 2.40 0.04 5.08 1.01 -1.26 -0.52 120.40 123.32 2g5m s VAL 42 Ca 0.06 -1.67 -0.30 0.00 0.00 0.00 0.00 61.98 60.07 2g5m s VAL 42 Cb -0.01 -2.45 -0.08 0.00 0.00 0.00 0.00 36.38 33.85 2g5m s VAL 42 CO -0.06 -0.12 1.67 -0.89 0.00 0.00 0.00 175.10 175.70 2g5m s THR 43 N 1.11 3.15 0.29 3.92 2.01 -0.17 -4.83 115.64 121.12 2g5m s THR 43 Ca -0.06 0.50 0.04 0.00 0.31 0.00 0.00 61.69 62.49 2g5m s THR 43 Cb -0.20 -3.32 0.06 0.00 0.01 0.00 0.00 72.50 69.05 2g5m s THR 43 CO -0.04 -0.01 1.72 -0.33 -0.69 0.00 0.00 174.62 175.27 2g5m h GLU 44 N 8.73 0.38 -0.66 4.92 5.08 -1.97 -1.37 114.58 129.68 2g5m h GLU 44 Ca -0.42 -0.15 0.00 0.00 -1.00 0.00 0.00 59.36 57.78 2g5m h GLU 44 Cb 1.20 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.43 2g5m h GLU 44 CO 0.93 0.65 0.00 0.41 -1.00 0.00 0.00 179.01 180.01 2g5m n GLY 45 N -0.33 1.50 3.54 -3.84 0.00 -1.26 -4.67 105.19 100.12 2g5m n GLY 45 Ca -0.01 -0.33 -0.26 0.00 0.00 0.00 0.00 46.02 45.42 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 -0.52 2.48 0.10 -0.02 0.00 -0.52 -4.86 107.32 103.99 2g5m s GLY 46 Ca 0.20 -1.45 -0.29 0.00 0.00 0.00 0.00 44.72 43.18 2g5m s GLY 46 CO 0.08 -1.90 1.64 0.00 0.00 0.00 0.00 173.10 172.92 2g5m h ALA 47 N 1.83 -0.55 0.00 3.20 0.00 -1.61 -3.08 119.26 119.05 2g5m h ALA 47 Ca -0.39 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.43 2g5m h ALA 47 Cb 1.27 0.38 -0.00 0.00 0.00 0.00 0.00 17.79 19.44 2g5m h ALA 47 CO 0.66 -0.84 -0.04 0.00 0.00 0.00 0.00 179.25 179.03 2g5m h ALA 48 N 0.08 1.65 0.17 0.00 0.00 -1.82 0.32 119.26 119.65 2g5m h ALA 48 Ca -0.01 -0.04 -0.31 0.00 0.00 0.00 0.00 54.91 54.56 2g5m h ALA 48 Cb 0.52 -0.01 0.03 0.00 0.00 0.00 0.00 17.79 18.33 2g5m h ALA 48 CO -0.06 0.05 -1.32 1.25 0.00 0.00 0.00 179.25 179.17 2g5m h HIS 49 N 0.00 0.88 -0.13 0.00 6.17 -1.65 0.19 115.15 120.61 2g5m h HIS 49 Ca -0.00 -0.60 -0.22 0.00 0.71 0.00 0.00 60.37 60.26 2g5m h HIS 49 Cb 0.09 -0.05 0.01 0.00 2.52 0.00 0.00 27.41 29.97 2g5m h HIS 49 CO 0.00 1.45 -0.77 0.00 0.71 0.00 0.00 177.93 179.32 2g5m h ARG 50 N 0.18 0.71 0.19 5.26 3.08 -1.18 -3.29 114.38 119.34 2g5m h ARG 50 Ca -0.20 -0.58 -0.01 0.00 0.07 0.00 0.00 59.98 59.26 2g5m h ARG 50 Cb 2.01 0.12 0.00 0.00 0.08 0.00 0.00 29.97 32.19 2g5m h ARG 50 CO 0.24 1.20 -0.09 0.22 -1.07 0.00 0.00 179.97 180.47 2g5m h ASP 51 N 0.48 -0.22 0.00 7.04 3.58 -0.48 -3.49 116.42 123.33 2g5m h ASP 51 Ca -0.05 0.01 0.00 0.00 0.42 0.00 0.00 57.03 57.41 2g5m h ASP 51 Cb 1.39 0.06 0.00 0.00 1.72 0.00 0.00 39.33 42.50 2g5m h ASP 51 CO 0.15 -0.11 0.00 0.61 -2.88 0.00 0.00 179.24 177.02 2g5m n GLY 52 N -0.12 0.72 0.10 -0.78 0.00 0.68 -5.00 105.19 100.80 2g5m n GLY 52 Ca -0.03 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.80 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 4.22 0.21 -6.36 1.61 2.47 -1.85 -3.43 114.38 111.25 2g5m h ARG 53 Ca 0.00 -0.36 -0.55 0.00 -1.26 0.00 0.00 59.98 57.81 2g5m h ARG 53 Cb 0.00 0.13 -0.02 0.00 -1.65 0.00 0.00 29.97 28.43 2g5m h ARG 53 CO 0.00 1.17 0.50 0.42 0.56 0.00 0.00 179.97 182.63 2g5m s ILE 54 N -2.38 4.64 0.37 2.04 1.01 -1.26 -4.97 121.20 120.65 2g5m s ILE 54 Ca -0.16 1.91 0.08 0.00 0.00 0.00 0.00 60.65 62.47 2g5m s ILE 54 Cb 0.01 -4.22 -0.04 0.00 0.01 0.00 0.00 42.46 38.21 2g5m s ILE 54 CO 0.78 0.08 0.20 -1.10 0.00 0.00 0.00 174.94 174.90 2g5m s GLN 55 N 1.50 2.39 0.00 2.79 -0.21 -1.26 -4.82 119.66 120.05 2g5m s GLN 55 Ca 0.52 -1.60 0.17 0.00 0.02 0.00 0.00 55.36 54.47 2g5m s GLN 55 Cb -0.22 -2.19 0.95 0.00 1.00 0.00 0.00 33.01 32.55 2g5m s GLN 55 CO 0.24 0.00 1.44 1.55 -2.12 0.00 0.00 175.29 176.41 2g5m n VAL 56 N -1.26 0.20 -0.54 1.09 3.14 -1.26 -2.08 118.33 117.62 2g5m n VAL 56 Ca -0.01 0.05 0.05 0.00 -2.96 0.00 0.00 64.34 61.47 2g5m n VAL 56 Cb 0.62 -0.78 0.07 0.00 -1.06 0.00 0.00 33.84 32.69 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 -1.11 2.20 -4.95 6.55 0.23 -1.26 -4.50 115.26 112.42 2g5m n ASN 57 Ca 0.11 -2.54 -0.23 0.00 -0.53 0.00 0.00 54.58 51.38 2g5m n ASN 57 Cb 0.08 -0.22 0.04 0.00 -2.08 0.00 0.00 39.78 37.61 2g5m n ASN 57 CO 0.00 0.00 0.00 -1.81 -0.93 0.00 0.00 177.26 174.52 2g5m s ASP 58 N -1.93 5.25 -0.04 0.53 1.01 -0.88 -4.87 116.67 115.74 2g5m s ASP 58 Ca 0.16 0.22 0.02 0.00 0.71 0.00 0.00 52.55 53.66 2g5m s ASP 58 Cb 0.14 -1.10 0.01 0.00 1.01 0.00 0.00 42.92 42.99 2g5m s ASP 58 CO 0.02 -1.20 -0.07 -0.22 0.21 0.00 0.00 175.17 173.91 2g5m s LEU 59 N -4.89 1.57 -0.69 1.23 2.96 -1.26 -0.78 118.68 116.82 2g5m s LEU 59 Ca 0.57 -0.16 -0.24 0.00 -0.22 0.00 0.00 54.13 54.08 2g5m s LEU 59 Cb -0.10 -0.51 0.06 0.00 0.50 0.00 0.00 46.19 46.14 2g5m s LEU 59 CO 0.41 0.00 1.05 -0.76 -1.32 0.00 0.00 176.35 175.73 2g5m s LEU 60 N 0.56 4.10 -0.06 -0.68 1.43 -1.08 -3.02 118.68 119.93 2g5m s LEU 60 Ca -0.08 -0.90 -0.16 0.00 -1.03 0.00 0.00 54.13 51.96 2g5m s LEU 60 Cb -0.12 -2.45 -0.30 0.00 0.03 0.00 0.00 46.19 43.34 2g5m s LEU 60 CO 0.01 -1.53 0.73 0.58 0.23 0.00 0.00 176.35 176.37 2g5m h VAL 61 N 6.00 1.16 -2.88 -1.59 2.07 -1.46 -3.43 116.25 116.12 2g5m h VAL 61 Ca -0.27 -2.51 -0.03 0.00 0.82 0.00 0.00 66.70 64.72 2g5m h VAL 61 Cb 1.06 2.89 -0.13 0.00 -1.52 0.00 0.00 31.29 33.59 2g5m h VAL 61 CO 1.21 0.76 0.19 -1.83 0.02 0.00 0.00 177.57 177.92 2g5m s GLU 62 N -2.51 1.24 0.21 1.57 -1.05 -1.08 -1.01 118.70 116.07 2g5m s GLU 62 Ca -0.16 -0.38 0.03 0.00 -0.15 0.00 0.00 54.97 54.32 2g5m s GLU 62 Cb 0.04 0.57 0.03 0.00 -0.44 0.00 0.00 34.13 34.33 2g5m s GLU 62 CO 0.83 -0.52 0.29 1.55 0.95 0.00 0.00 175.26 178.36 2g5m n VAL 63 N -0.18 0.00 -0.18 1.83 3.14 0.17 -0.15 118.33 122.95 2g5m n VAL 63 Ca -0.17 -0.72 -0.01 0.00 -2.96 0.00 0.00 64.34 60.48 2g5m n VAL 63 Cb 0.64 -0.78 0.09 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 0.05 -0.12 -0.74 6.55 3.58 -0.96 -3.28 116.42 121.49 2g5m h ASP 64 Ca -0.10 0.12 -0.33 0.00 0.42 0.00 0.00 57.03 57.14 2g5m h ASP 64 Cb 0.46 0.19 -0.40 0.00 1.72 0.00 0.00 39.33 41.30 2g5m h ASP 64 CO 0.15 -0.04 -1.11 0.61 -2.88 0.00 0.00 179.24 175.97 2g5m n GLY 65 N -1.32 2.25 3.59 -0.78 0.00 -1.26 -4.98 105.19 102.69 2g5m n GLY 65 Ca 0.07 -1.37 -0.00 0.00 0.00 0.00 0.00 46.02 44.72 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 -3.69 -0.93 -0.16 2.61 2.01 -1.24 -5.16 115.64 109.08 2g5m s THR 66 Ca 0.30 0.00 -0.11 0.00 0.31 0.00 0.00 61.69 62.19 2g5m s THR 66 Cb 0.39 -1.00 -0.05 0.00 0.01 0.00 0.00 72.50 71.85 2g5m s THR 66 CO -0.01 0.00 0.22 -0.44 -0.69 0.00 0.00 174.62 173.70 2g5m s SER 67 N 2.84 6.38 -0.34 3.53 0.01 -1.26 -0.66 113.70 124.20 2g5m s SER 67 Ca -0.04 0.44 -0.16 0.00 1.31 0.00 0.00 55.95 57.50 2g5m s SER 67 Cb -0.11 -2.14 -0.01 0.00 0.21 0.00 0.00 66.02 63.97 2g5m s SER 67 CO -0.19 0.20 0.41 -0.76 0.41 0.00 0.00 173.24 173.30 2g5m s LEU 68 N 0.06 4.39 0.29 2.44 1.43 -0.18 -4.89 118.68 122.23 2g5m s LEU 68 Ca 0.14 -0.15 0.18 0.00 -1.03 0.00 0.00 54.13 53.27 2g5m s LEU 68 Cb -0.12 -2.42 0.10 0.00 0.03 0.00 0.00 46.19 43.79 2g5m s LEU 68 CO 0.03 -0.37 1.39 0.58 0.23 0.00 0.00 176.35 178.20 2g5m h VAL 69 N 5.55 0.55 0.00 -1.59 2.07 -1.92 -3.44 116.25 117.47 2g5m h VAL 69 Ca -0.29 -1.81 0.00 0.00 0.82 0.00 0.00 66.70 65.42 2g5m h VAL 69 Cb 1.14 2.21 0.00 0.00 -1.52 0.00 0.00 31.29 33.12 2g5m h VAL 69 CO 0.71 0.31 0.00 0.61 0.02 0.00 0.00 177.57 179.23 2g5m n GLY 70 N 1.21 -0.46 3.34 2.17 0.00 -1.25 -3.32 105.19 106.87 2g5m n GLY 70 Ca 0.01 0.19 -0.19 0.00 0.00 0.00 0.00 46.02 46.02 2g5m n GLY 70 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2g5m n VAL 71 N 0.00 0.00 -2.09 1.61 0.24 -1.26 -4.52 118.33 112.31 2g5m n VAL 71 Ca 0.00 -1.39 -0.28 0.00 -2.04 0.00 0.00 64.34 60.62 2g5m n VAL 71 Cb 0.00 -0.91 0.05 0.00 -1.47 0.00 0.00 33.84 31.51 2g5m n VAL 71 CO 0.00 0.00 0.00 0.42 -2.14 0.00 0.00 176.83 175.11 2g5m s THR 72 N -2.54 3.37 0.36 3.34 -4.23 -1.26 -4.83 115.64 109.85 2g5m s THR 72 Ca 0.56 0.23 0.06 0.00 -1.18 0.00 0.00 61.69 61.36 2g5m s THR 72 Cb -0.03 -3.41 0.18 0.00 1.34 0.00 0.00 72.50 70.58 2g5m s THR 72 CO 0.37 -0.49 1.92 -0.61 -0.54 0.00 0.00 174.62 175.28 2g5m h GLN 73 N -0.51 0.47 -0.31 3.99 4.15 -1.96 -1.34 115.11 119.60 2g5m h GLN 73 Ca -0.45 -0.08 -0.05 0.00 0.77 0.00 0.00 58.65 58.83 2g5m h GLN 73 Cb 1.26 -0.08 -0.01 0.00 0.21 0.00 0.00 27.48 28.87 2g5m h GLN 73 CO 0.63 0.48 -0.00 0.77 -1.93 0.00 0.00 178.83 178.77 2g5m h SER 74 N 0.46 0.54 -0.18 -0.69 0.02 -1.99 -0.37 113.55 111.35 2g5m h SER 74 Ca 0.10 -0.31 0.00 0.00 -0.84 0.00 0.00 61.79 60.74 2g5m h SER 74 Cb 0.25 -0.15 -0.01 0.00 0.14 0.00 0.00 62.40 62.64 2g5m h SER 74 CO 0.00 0.72 0.12 0.15 -1.14 0.00 0.00 176.83 176.68 2g5m h PHE 75 N 0.35 0.23 -0.60 3.45 3.04 -1.80 -0.09 116.94 121.51 2g5m h PHE 75 Ca 0.09 0.00 0.02 0.00 3.98 0.00 0.00 57.97 62.06 2g5m h PHE 75 Cb 0.45 -0.08 -0.04 0.00 2.56 0.00 0.00 35.95 38.84 2g5m h PHE 75 CO 0.04 0.15 0.38 0.00 -2.02 0.00 0.00 178.31 176.86 2g5m h ALA 76 N 1.06 0.78 -0.72 2.41 0.00 -1.12 -1.26 119.26 120.41 2g5m h ALA 76 Ca 0.07 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.95 2g5m h ALA 76 Cb -0.02 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 17.53 2g5m h ALA 76 CO -0.01 0.14 0.45 0.00 0.00 0.00 0.00 179.25 179.82 2g5m h ALA 77 N 1.25 1.45 -0.34 0.00 0.00 -0.58 -1.98 119.26 119.05 2g5m h ALA 77 Ca 0.24 -0.07 -0.09 0.00 0.00 0.00 0.00 54.91 54.98 2g5m h ALA 77 Cb -0.01 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.47 2g5m h ALA 77 CO -0.08 0.49 -0.18 0.77 0.00 0.00 0.00 179.25 180.25 2g5m h SER 78 N 0.98 0.63 0.45 0.00 0.02 -0.13 -1.94 113.55 113.56 2g5m h SER 78 Ca 0.26 -0.20 -0.21 0.00 -0.84 0.00 0.00 61.79 60.80 2g5m h SER 78 Cb -0.07 -0.17 -0.01 0.00 0.14 0.00 0.00 62.40 62.29 2g5m h SER 78 CO -0.05 0.82 -0.88 1.62 -1.14 0.00 0.00 176.83 177.19 2g5m h VAL 79 N 0.57 1.44 -0.54 2.27 3.04 -0.54 0.13 116.25 122.62 2g5m h VAL 79 Ca 0.09 -2.49 -0.06 0.00 -1.01 0.00 0.00 66.70 63.23 2g5m h VAL 79 Cb 0.63 2.40 -0.02 0.00 -2.01 0.00 0.00 31.29 32.29 2g5m h VAL 79 CO 0.04 0.73 0.12 -0.07 -1.01 0.00 0.00 177.57 177.38 2g5m h LEU 80 N 0.17 0.84 -0.23 3.16 3.38 -1.30 -1.57 115.31 119.77 2g5m h LEU 80 Ca -0.06 -0.24 -0.19 0.00 0.09 0.00 0.00 57.88 57.48 2g5m h LEU 80 Cb 1.51 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 42.01 2g5m h LEU 80 CO 0.14 0.87 -0.89 0.03 0.09 0.00 0.00 178.44 178.68 2g5m h ARG 81 N 0.77 0.01 0.00 1.13 3.08 -1.18 -3.25 114.38 114.94 2g5m h ARG 81 Ca 0.17 -0.01 -0.11 0.00 0.07 0.00 0.00 59.98 60.09 2g5m h ARG 81 Cb 0.37 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.41 2g5m h ARG 81 CO 0.01 0.89 -0.52 -0.97 -1.07 0.00 0.00 179.97 178.30 2g5m h ASN 82 N 0.00 0.00 -4.29 7.04 -1.24 -0.61 -3.46 115.58 113.02 2g5m h ASN 82 Ca -0.01 0.00 -0.51 0.00 0.71 0.00 0.00 56.30 56.49 2g5m h ASN 82 Cb 1.57 0.00 0.11 0.00 0.73 0.00 0.00 38.32 40.73 2g5m h ASN 82 CO 0.12 0.52 0.35 0.42 -1.29 0.00 0.00 177.43 177.55 2g5m s THR 83 N -3.36 3.59 0.00 -3.57 -4.23 -0.60 -5.05 115.64 102.41 2g5m s THR 83 Ca 0.01 0.57 0.00 0.00 -1.18 0.00 0.00 61.69 61.09 2g5m s THR 83 Cb 0.10 -3.14 0.00 0.00 1.34 0.00 0.00 72.50 70.80 2g5m s THR 83 CO 0.73 -0.62 0.00 0.29 -0.54 0.00 0.00 174.62 174.48 2g5m n LYS 84 N -3.08 -0.87 -0.04 3.99 4.76 -1.26 -4.94 118.16 116.73 2g5m n LYS 84 Ca 0.09 0.00 -0.08 0.00 -2.87 0.00 0.00 58.31 55.44 2g5m n LYS 84 Cb 0.53 0.00 -0.03 0.00 -1.84 0.00 0.00 35.03 33.69 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 -0.53 0.15 -6.87 0.72 0.00 -1.96 -3.42 103.07 91.15 2g5m h GLY 85 Ca 0.00 0.06 -0.44 0.00 0.00 0.00 0.00 47.33 46.95 2g5m h GLY 85 CO 0.00 -0.07 -0.77 -1.60 0.00 0.00 0.00 176.54 174.10 2g5m s ARG 86 N -6.20 0.69 0.03 4.80 3.52 -1.26 0.12 118.95 120.65 2g5m s ARG 86 Ca -0.13 0.05 0.01 0.00 -0.13 0.00 0.00 55.73 55.53 2g5m s ARG 86 Cb 0.10 -0.98 -0.02 0.00 -1.56 0.00 0.00 34.95 32.49 2g5m s ARG 86 CO 0.68 -0.26 -0.05 0.14 -0.81 0.00 0.00 175.30 175.00 2g5m s VAL 87 N 1.78 0.29 0.27 7.11 -7.23 -0.90 -5.01 120.40 116.71 2g5m s VAL 87 Ca 0.02 -0.95 -0.02 0.00 -1.81 0.00 0.00 61.98 59.23 2g5m s VAL 87 Cb -0.13 -0.40 -0.04 0.00 0.56 0.00 0.00 36.38 36.37 2g5m s VAL 87 CO -0.05 -0.43 0.49 -0.13 -0.31 0.00 0.00 175.10 174.68 2g5m s ARG 88 N -1.45 3.55 0.23 4.82 0.52 -1.26 -2.27 118.95 123.10 2g5m s ARG 88 Ca -0.13 -0.22 0.07 0.00 -0.52 0.00 0.00 55.73 54.93 2g5m s ARG 88 Cb -0.10 -2.73 -0.05 0.00 0.52 0.00 0.00 34.95 32.60 2g5m s ARG 88 CO -0.00 0.27 -0.10 -0.06 0.02 0.00 0.00 175.30 175.43 2g5m s PHE 89 N -2.06 1.76 -0.29 -0.53 0.08 0.13 -0.24 117.98 116.83 2g5m s PHE 89 Ca 0.41 -0.67 -0.04 0.00 0.12 0.00 0.00 56.93 56.75 2g5m s PHE 89 Cb -0.11 -0.91 0.03 0.00 -0.57 0.00 0.00 43.02 41.46 2g5m s PHE 89 CO 0.31 0.27 0.03 -1.64 -0.10 0.00 0.00 175.22 174.10 2g5m s MET 90 N -3.70 2.81 -0.18 0.44 -1.94 0.79 -0.60 119.30 116.92 2g5m s MET 90 Ca 0.25 -1.03 -0.13 0.00 -1.71 0.00 0.00 55.69 53.08 2g5m s MET 90 Cb 0.02 -3.25 -0.05 0.00 2.01 0.00 0.00 34.83 33.56 2g5m s MET 90 CO 0.09 -0.51 0.25 0.42 -0.01 0.00 0.00 175.02 175.26 2g5m s ILE 91 N 1.39 5.33 -0.27 2.53 1.09 0.61 -1.14 121.20 130.74 2g5m s ILE 91 Ca -0.00 0.45 -0.06 0.00 -1.10 0.00 0.00 60.65 59.94 2g5m s ILE 91 Cb -0.18 -3.59 0.00 0.00 -1.06 0.00 0.00 42.46 37.63 2g5m s ILE 91 CO 0.00 0.38 0.04 -0.83 -0.10 0.00 0.00 174.94 174.44 2g5m s GLY 92 N 0.55 1.74 -0.28 6.18 0.00 -1.17 -0.37 107.32 113.97 2g5m s GLY 92 Ca 0.14 -1.37 -0.26 0.00 0.00 0.00 0.00 44.72 43.23 2g5m s GLY 92 CO 0.03 0.59 0.89 -1.60 0.00 0.00 0.00 173.10 173.01 2g5m s ARG 93 N 1.49 4.09 -1.01 2.90 6.06 0.46 -4.52 118.95 128.42 2g5m s ARG 93 Ca 0.03 0.90 -0.05 0.00 -2.50 0.00 0.00 55.73 54.11 2g5m s ARG 93 Cb -0.16 -3.69 0.25 0.00 0.06 0.00 0.00 34.95 31.41 2g5m s ARG 93 CO 0.01 -0.67 0.97 -1.91 -2.50 0.00 0.00 175.30 171.20 2g5m n GLU 94 N 6.30 3.15 0.38 5.12 2.13 -1.26 -1.26 120.64 135.19 2g5m n GLU 94 Ca 0.07 -4.47 -0.17 0.00 0.66 0.00 0.00 57.16 53.25 2g5m n GLU 94 Cb 0.47 -2.48 -0.08 0.00 0.27 0.00 0.00 31.44 29.62 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 6.27 -0.92 -6.94 5.31 2.43 -1.93 -3.44 114.38 115.15 2g5m h ARG 95 Ca 0.17 0.06 -0.48 0.00 -0.81 0.00 0.00 59.98 58.93 2g5m h ARG 95 Cb 0.83 0.21 0.00 0.00 -0.42 0.00 0.00 29.97 30.59 2g5m h ARG 95 CO 0.95 -0.59 0.39 -1.25 -1.51 0.00 0.00 179.97 177.96 2g5m s PRO 96 N -5.42 4.32 0.00 0.20 0.04 -1.26 -4.55 135.00 128.32 2g5m s PRO 96 Ca -0.17 1.43 0.00 0.00 0.04 0.00 0.00 61.00 62.31 2g5m s PRO 96 Cb 0.02 -2.62 0.00 0.00 0.04 0.00 0.00 34.50 31.95 2g5m s PRO 96 CO 0.54 0.01 0.00 0.41 0.04 0.00 0.00 177.00 178.01 2g5m n GLY 97 N 0.36 0.00 2.26 0.56 0.00 -1.26 -4.87 105.19 102.24 2g5m n GLY 97 Ca 0.04 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.91 2g5m n GLY 97 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2g5m n GLU 98 N 0.00 -1.58 -0.01 1.61 -0.58 -1.26 -4.82 120.64 114.00 2g5m n GLU 98 Ca 0.00 0.85 -0.17 0.00 -0.42 0.00 0.00 57.16 57.42 2g5m n GLU 98 Cb 0.00 -5.25 -0.09 0.00 -0.57 0.00 0.00 31.44 25.53 2g5m n GLU 98 CO 0.00 0.00 0.00 0.37 -0.48 0.00 0.00 177.13 177.02 2g5m h GLN 99 N 0.00 0.48 -3.28 3.49 4.15 -1.89 -3.50 115.11 114.57 2g5m h GLN 99 Ca -0.33 -0.44 0.21 0.00 0.77 0.00 0.00 58.65 58.86 2g5m h GLN 99 Cb 1.09 0.10 -0.11 0.00 0.21 0.00 0.00 27.48 28.77 2g5m h GLN 99 CO 0.45 1.08 -1.01 -1.13 -1.93 0.00 0.00 178.83 176.28 2g5m n SER 100 N -4.22 -6.82 -1.33 -0.69 3.41 -1.26 -4.66 113.62 98.05 2g5m n SER 100 Ca -0.09 1.36 0.01 0.00 -0.26 0.00 0.00 58.87 59.89 2g5m n SER 100 Cb 0.63 -4.53 0.20 0.00 -0.26 0.00 0.00 64.21 60.25 2g5m n SER 100 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2g5m n GLU 101 N -3.67 2.83 -2.92 4.33 4.71 -1.26 -4.89 120.64 119.77 2g5m n GLU 101 Ca -0.06 -1.67 -0.40 0.00 -0.01 0.00 0.00 57.16 55.02 2g5m n GLU 101 Cb 0.53 -1.86 -0.05 0.00 -1.01 0.00 0.00 31.44 29.05 2g5m n GLU 101 CO 0.00 0.00 0.00 0.08 0.09 0.00 0.00 177.13 177.30 2g5m s VAL 102 N -1.91 4.50 0.00 2.62 1.01 -1.26 -4.99 120.40 120.37 2g5m s VAL 102 Ca 0.29 1.77 0.00 0.00 0.00 0.00 0.00 61.98 64.05 2g5m s VAL 102 Cb 0.23 -4.18 0.00 0.00 0.00 0.00 0.00 36.38 32.43 2g5m s VAL 102 CO 0.08 0.43 0.00 0.00 0.00 0.00 0.00 175.10 175.61 2g5m n ALA 103 N 2.24 0.87 -3.58 5.51 0.00 -1.26 -4.93 120.51 119.35 2g5m n ALA 103 Ca -0.03 -0.11 -0.27 0.00 0.00 0.00 0.00 53.44 53.03 2g5m n ALA 103 Cb 0.49 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.84 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 -2.10 1.88 -4.19 0.00 6.02 -1.26 -5.03 117.38 112.70 2g5m n GLN 104 Ca 0.00 -4.34 -0.12 0.00 -0.01 0.00 0.00 57.00 52.54 2g5m n GLN 104 Cb 0.00 -2.12 -0.10 0.00 1.02 0.00 0.00 30.24 29.04 2g5m n GLN 104 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 2g5m s LEU 105 N -1.74 1.11 -0.09 1.08 2.01 -1.26 -5.07 118.68 114.71 2g5m s LEU 105 Ca 0.33 -1.37 -0.09 0.00 0.01 0.00 0.00 54.13 53.01 2g5m s LEU 105 Cb 0.07 0.46 -0.07 0.00 0.01 0.00 0.00 46.19 46.66 2g5m s LEU 105 CO -0.10 -0.86 0.32 0.40 1.01 0.00 0.00 176.35 177.12 2g5m h ILE 106 N 2.60 0.37 -1.68 -0.59 5.03 -2.03 -3.48 117.51 117.72 2g5m h ILE 106 Ca -0.35 -1.15 0.04 0.00 -0.12 0.00 0.00 64.86 63.28 2g5m h ILE 106 Cb 1.25 0.67 -0.24 0.00 -3.03 0.00 0.00 36.82 35.47 2g5m h ILE 106 CO 0.52 0.12 0.41 -1.58 -0.68 0.00 0.00 178.15 176.94 2g5m s GLN 107 N -2.15 0.63 -0.88 2.37 2.00 -1.26 -5.07 119.66 115.30 2g5m s GLN 107 Ca -0.06 0.50 0.00 0.00 -2.00 0.00 0.00 55.36 53.80 2g5m s GLN 107 Cb -0.00 0.30 0.29 0.00 0.80 0.00 0.00 33.01 34.40 2g5m s GLN 107 CO 0.20 -0.13 1.22 0.00 -0.50 0.00 0.00 175.29 176.08 2g5m n GLN 108 N 1.75 3.81 0.08 1.67 10.64 -1.26 -4.75 117.38 129.32 2g5m n GLN 108 Ca -0.13 -4.64 -0.01 0.00 -1.83 0.00 0.00 57.00 50.39 2g5m n GLN 108 Cb 0.56 -2.40 -0.05 0.00 -0.86 0.00 0.00 30.24 27.49 2g5m n GLN 108 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 2g5m h THR 109 N 3.18 0.95 -0.34 -0.39 1.03 -2.04 -3.27 112.91 112.02 2g5m h THR 109 Ca 0.23 -2.47 -0.18 0.00 -0.01 0.00 0.00 66.41 63.97 2g5m h THR 109 Cb 0.59 2.41 -0.11 0.00 -1.07 0.00 0.00 68.15 69.98 2g5m h THR 109 CO 1.11 0.54 0.23 0.18 -0.01 0.00 0.00 175.52 177.58 2g5m n LEU 110 N -3.15 4.43 -0.27 0.00 4.77 -1.26 -4.29 117.00 117.23 2g5m n LEU 110 Ca -0.03 -2.29 -0.03 0.00 -0.03 0.00 0.00 56.01 53.63 2g5m n LEU 110 Cb 0.84 -0.65 0.08 0.00 -2.33 0.00 0.00 43.42 41.36 2g5m n LEU 110 CO 0.43 0.73 1.18 1.05 -1.33 0.00 0.00 177.39 179.44 2g5m h GLU 111 N 0.42 0.94 -4.09 3.23 4.11 -1.96 -3.46 114.58 113.77 2g5m h GLU 111 Ca 0.22 -0.06 -0.40 0.00 0.07 0.00 0.00 59.36 59.20 2g5m h GLU 111 Cb 1.59 -0.21 0.02 0.00 0.50 0.00 0.00 28.75 30.65 2g5m h GLU 111 CO 0.40 0.62 -0.56 1.04 0.07 0.00 0.00 179.01 180.58 2g5m n GLN 112 N -4.60 -3.62 0.00 1.06 6.02 -1.26 -5.23 117.38 109.75 2g5m n GLN 112 Ca 0.08 0.88 0.15 0.00 -0.01 0.00 0.00 57.00 58.10 2g5m n GLN 112 Cb 0.07 -5.65 0.70 0.00 1.02 0.00 0.00 30.24 26.37 2g5m n GLN 112 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 177.06 176.44