#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2g5m n HIS 2 N 0.00 -1.06 -2.41 1.61 -0.00 -1.26 -4.36 115.22 107.74 2g5m n HIS 2 Ca 0.00 0.00 -0.39 0.00 -0.00 0.00 0.00 57.72 57.33 2g5m n HIS 2 Cb 0.00 0.16 -0.03 0.00 -0.00 0.00 0.00 29.99 30.12 2g5m n HIS 2 CO 0.00 0.00 0.00 -1.64 -0.00 0.00 0.00 176.34 174.70 2g5m s MET 3 N 0.00 3.15 -0.56 -0.41 1.00 -1.23 -4.44 119.30 116.80 2g5m s MET 3 Ca 0.00 -0.41 -0.25 0.00 0.00 0.00 0.00 55.69 55.03 2g5m s MET 3 Cb 0.00 -4.71 0.04 0.00 0.00 0.00 0.00 34.83 30.15 2g5m s MET 3 CO 0.00 -2.42 1.00 -1.21 0.00 0.00 0.00 175.02 172.39 2g5m s GLU 4 N 5.86 3.36 -0.87 2.03 2.02 -1.20 -4.75 118.70 125.15 2g5m s GLU 4 Ca 0.48 -0.16 -0.22 0.00 0.02 0.00 0.00 54.97 55.09 2g5m s GLU 4 Cb -0.06 -4.05 0.08 0.00 0.10 0.00 0.00 34.13 30.20 2g5m s GLU 4 CO 0.06 -1.55 1.20 -0.51 0.02 0.00 0.00 175.26 174.47 2g5m s LEU 5 N 4.21 4.23 -0.01 1.80 2.01 -1.25 -0.56 118.68 129.11 2g5m s LEU 5 Ca 0.33 -1.43 0.06 0.00 0.01 0.00 0.00 54.13 53.10 2g5m s LEU 5 Cb -0.11 -2.47 -0.03 0.00 0.01 0.00 0.00 46.19 43.59 2g5m s LEU 5 CO 0.20 -1.37 -0.20 0.72 1.01 0.00 0.00 176.35 176.71 2g5m s PHE 6 N 4.03 2.51 0.19 0.29 -0.12 0.44 -4.91 117.98 120.41 2g5m s PHE 6 Ca 0.34 -0.29 -0.30 0.00 -0.05 0.00 0.00 56.93 56.63 2g5m s PHE 6 Cb -0.07 -1.53 -0.08 0.00 -0.63 0.00 0.00 43.02 40.72 2g5m s PHE 6 CO -0.02 0.12 0.97 -1.25 -0.05 0.00 0.00 175.22 174.99 2g5m s PRO 7 N -0.89 4.77 0.01 1.99 0.04 -1.26 -0.04 135.00 139.62 2g5m s PRO 7 Ca 0.12 1.51 0.06 0.00 0.04 0.00 0.00 61.00 62.73 2g5m s PRO 7 Cb -0.10 -3.31 -0.02 0.00 0.04 0.00 0.00 34.50 31.11 2g5m s PRO 7 CO 0.01 0.36 -0.19 0.08 0.04 0.00 0.00 177.00 177.30 2g5m s VAL 8 N -0.69 1.51 -0.11 -0.36 1.01 0.21 -4.92 120.40 117.05 2g5m s VAL 8 Ca 0.44 -0.96 0.01 0.00 0.00 0.00 0.00 61.98 61.47 2g5m s VAL 8 Cb -0.26 -1.29 0.02 0.00 0.00 0.00 0.00 36.38 34.86 2g5m s VAL 8 CO 0.32 0.31 -0.11 -0.70 0.00 0.00 0.00 175.10 174.92 2g5m s GLU 9 N -0.76 1.78 0.32 2.72 2.12 -1.26 0.28 118.70 123.91 2g5m s GLU 9 Ca 0.07 -0.38 0.09 0.00 0.36 0.00 0.00 54.97 55.10 2g5m s GLU 9 Cb -0.08 -1.66 -0.05 0.00 0.26 0.00 0.00 34.13 32.60 2g5m s GLU 9 CO 0.00 -0.16 0.06 -0.51 -0.54 0.00 0.00 175.26 174.11 2g5m s LEU 10 N 1.32 3.13 0.05 2.70 1.43 -0.68 -4.98 118.68 121.66 2g5m s LEU 10 Ca -0.01 -0.84 0.07 0.00 -1.03 0.00 0.00 54.13 52.32 2g5m s LEU 10 Cb -0.14 -1.58 -0.03 0.00 0.03 0.00 0.00 46.19 44.48 2g5m s LEU 10 CO -0.05 -0.21 -0.21 -1.83 0.23 0.00 0.00 176.35 174.28 2g5m s GLU 11 N -3.76 1.32 0.49 1.70 -1.05 -1.26 -2.39 118.70 113.76 2g5m s GLU 11 Ca 0.35 -0.98 -0.02 0.00 -0.15 0.00 0.00 54.97 54.18 2g5m s GLU 11 Cb -0.02 -1.46 -0.00 0.00 -0.44 0.00 0.00 34.13 32.20 2g5m s GLU 11 CO 0.21 0.37 0.74 -1.59 0.95 0.00 0.00 175.26 175.93 2g5m s LYS 12 N -1.32 3.07 0.53 -4.83 -2.85 0.10 -4.67 119.74 109.77 2g5m s LYS 12 Ca 0.07 -0.31 0.04 0.00 -1.00 0.00 0.00 55.97 54.77 2g5m s LYS 12 Cb -0.09 -2.47 0.04 0.00 -2.06 0.00 0.00 37.83 33.25 2g5m s LYS 12 CO 0.02 -0.37 0.33 -3.47 0.10 0.00 0.00 175.35 171.97 2g5m n ASP 13 N -2.22 2.81 0.21 0.03 2.03 0.01 -4.93 116.55 114.50 2g5m n ASP 13 Ca 0.02 -2.89 0.08 0.00 0.52 0.00 0.00 54.79 52.52 2g5m n ASP 13 Cb 0.57 0.02 0.46 0.00 -0.72 0.00 0.00 41.12 41.46 2g5m n ASP 13 CO 0.00 0.00 0.00 0.28 -1.92 0.00 0.00 177.20 175.56 2g5m h SER 14 N 0.72 0.00 -0.05 1.67 0.02 -1.99 -0.76 113.55 113.17 2g5m h SER 14 Ca -0.35 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.60 2g5m h SER 14 Cb 1.24 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.78 2g5m h SER 14 CO 0.55 0.28 0.00 1.21 -1.14 0.00 0.00 176.83 177.74 2g5m n GLU 15 N -3.61 1.41 0.00 3.45 4.07 -1.26 -5.01 120.64 119.68 2g5m n GLU 15 Ca -0.01 -0.61 0.00 0.00 -0.06 0.00 0.00 57.16 56.49 2g5m n GLU 15 Cb 0.41 -1.43 0.00 0.00 -0.06 0.00 0.00 31.44 30.36 2g5m n GLU 15 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2g5m n GLY 16 N 1.06 0.73 3.19 8.31 0.00 -0.29 -4.90 105.19 113.29 2g5m n GLY 16 Ca 0.19 -1.27 -0.18 0.00 0.00 0.00 0.00 46.02 44.76 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 -3.07 0.99 4.77 -1.26 -0.81 117.00 117.62 2g5m n LEU 17 Ca 0.00 -1.86 -0.17 0.00 -0.03 0.00 0.00 56.01 53.95 2g5m n LEU 17 Cb 0.00 -0.46 -0.02 0.00 -2.33 0.00 0.00 43.42 40.61 2g5m n LEU 17 CO 0.00 -0.81 -0.18 0.61 -1.33 0.00 0.00 177.39 175.68 2g5m n GLY 18 N -1.09 3.40 3.55 -0.72 0.00 -1.26 -3.75 105.19 105.33 2g5m n GLY 18 Ca 0.14 -1.70 -0.14 0.00 0.00 0.00 0.00 46.02 44.31 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 -2.73 0.00 0.12 -0.61 -4.36 -1.26 -1.17 121.20 111.19 2g5m s ILE 19 Ca 0.38 -1.48 -0.13 0.00 -0.26 0.00 0.00 60.65 59.16 2g5m s ILE 19 Cb 0.37 -2.71 0.02 0.00 1.25 0.00 0.00 42.46 41.38 2g5m s ILE 19 CO -0.06 0.00 0.33 -0.44 0.24 0.00 0.00 174.94 175.00 2g5m s SER 20 N -3.22 -0.09 0.16 4.36 0.01 0.36 -4.80 113.70 110.48 2g5m s SER 20 Ca 0.28 -0.50 0.05 0.00 1.31 0.00 0.00 55.95 57.09 2g5m s SER 20 Cb -0.01 0.43 -0.04 0.00 0.21 0.00 0.00 66.02 66.60 2g5m s SER 20 CO 0.19 -0.83 -0.11 0.27 0.41 0.00 0.00 173.24 173.17 2g5m s ILE 21 N -3.85 1.27 -0.02 1.44 -4.36 -1.26 0.34 121.20 114.76 2g5m s ILE 21 Ca 0.06 -2.08 0.01 0.00 -0.26 0.00 0.00 60.65 58.37 2g5m s ILE 21 Cb 0.03 -1.88 0.01 0.00 1.25 0.00 0.00 42.46 41.87 2g5m s ILE 21 CO -0.10 -0.72 -0.03 -0.51 0.24 0.00 0.00 174.94 173.82 2g5m s ILE 22 N -3.26 0.34 -0.73 8.37 1.10 0.72 -4.53 121.20 123.22 2g5m s ILE 22 Ca 0.18 -0.11 -0.25 0.00 -0.51 0.00 0.00 60.65 59.96 2g5m s ILE 22 Cb 0.02 -0.34 0.05 0.00 0.15 0.00 0.00 42.46 42.34 2g5m s ILE 22 CO 0.02 0.13 1.15 -0.83 -2.11 0.00 0.00 174.94 173.30 2g5m s GLY 23 N 0.33 1.13 0.49 1.50 0.00 -1.26 -2.11 107.32 107.41 2g5m s GLY 23 Ca -0.03 -1.66 0.05 0.00 0.00 0.00 0.00 44.72 43.08 2g5m s GLY 23 CO -0.00 2.39 0.22 1.06 0.00 0.00 0.00 173.10 176.77 2g5m s MET 24 N 4.91 2.23 0.74 2.90 -1.94 -0.56 -4.98 119.30 122.61 2g5m s MET 24 Ca 0.30 -2.06 -0.08 0.00 -1.71 0.00 0.00 55.69 52.14 2g5m s MET 24 Cb -0.11 -1.91 0.07 0.00 2.01 0.00 0.00 34.83 34.89 2g5m s MET 24 CO 0.11 -0.38 1.07 0.20 -0.01 0.00 0.00 175.02 176.01 2g5m s GLY 25 N -4.05 1.67 0.30 -0.03 0.00 -1.26 0.01 107.32 103.96 2g5m s GLY 25 Ca 0.29 -0.89 0.07 0.00 0.00 0.00 0.00 44.72 44.19 2g5m s GLY 25 CO 0.17 -0.45 -0.07 0.00 0.00 0.00 0.00 173.10 172.76 2g5m s ALA 26 N -3.35 2.54 0.03 3.20 0.00 -1.08 -3.47 121.76 119.62 2g5m s ALA 26 Ca 0.61 -1.97 0.10 0.00 0.00 0.00 0.00 51.96 50.71 2g5m s ALA 26 Cb -0.10 0.13 -0.15 0.00 0.00 0.00 0.00 23.12 22.99 2g5m s ALA 26 CO 0.46 -0.03 1.21 0.78 0.00 0.00 0.00 175.76 178.19 2g5m h GLY 27 N 2.19 0.00 -4.93 0.00 0.00 -1.85 -3.40 103.07 95.08 2g5m h GLY 27 Ca -0.41 0.00 -0.24 0.00 0.00 0.00 0.00 47.33 46.69 2g5m h GLY 27 CO 0.68 0.00 1.27 0.00 0.00 0.00 0.00 176.54 178.49 2g5m n ALA 28 N -2.35 4.33 0.08 3.60 0.00 -1.26 -3.10 120.51 121.80 2g5m n ALA 28 Ca -0.02 -1.48 -0.08 0.00 0.00 0.00 0.00 53.44 51.86 2g5m n ALA 28 Cb 0.91 -2.63 0.05 0.00 0.00 0.00 0.00 19.45 17.77 2g5m n ALA 28 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.50 177.72 2g5m h ASP 29 N 5.30 0.31 -0.41 0.00 3.58 -1.86 -0.93 116.42 122.41 2g5m h ASP 29 Ca 0.29 -0.21 -0.00 0.00 0.42 0.00 0.00 57.03 57.53 2g5m h ASP 29 Cb 0.51 -0.09 -0.02 0.00 1.72 0.00 0.00 39.33 41.45 2g5m h ASP 29 CO 0.88 0.95 0.25 0.00 -2.88 0.00 0.00 179.24 178.44 2g5m h MET 30 N 0.17 0.58 0.00 0.28 -0.00 -1.92 -2.90 114.93 111.14 2g5m h MET 30 Ca -0.03 -0.05 -0.33 0.00 -0.00 0.00 0.00 59.70 59.30 2g5m h MET 30 Cb 1.31 -0.12 -0.05 0.00 -0.00 0.00 0.00 31.60 32.74 2g5m h MET 30 CO 0.12 0.41 -2.10 0.41 -0.00 0.00 0.00 176.91 175.75 2g5m n GLY 31 N -1.38 -0.32 0.00 -3.00 0.00 -1.18 -4.85 105.19 94.47 2g5m n GLY 31 Ca 0.03 -0.10 0.00 0.00 0.00 0.00 0.00 46.02 45.96 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 -3.87 0.05 -3.94 0.99 4.77 -0.42 -4.99 117.00 109.58 2g5m n LEU 32 Ca -0.39 -0.47 -0.30 0.00 -0.03 0.00 0.00 56.01 54.82 2g5m n LEU 32 Cb 0.78 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.88 2g5m n LEU 32 CO 0.02 0.01 0.05 -0.62 -1.33 0.00 0.00 177.39 175.53 2g5m n GLU 33 N -1.05 -5.01 -2.48 3.23 1.02 -0.79 -4.92 120.64 110.64 2g5m n GLU 33 Ca 0.00 0.56 -0.23 0.00 -0.02 0.00 0.00 57.16 57.47 2g5m n GLU 33 Cb 0.02 -5.35 0.07 0.00 -0.02 0.00 0.00 31.44 26.16 2g5m n GLU 33 CO 0.00 0.00 0.00 -1.59 1.18 0.00 0.00 177.13 176.72 2g5m s LYS 34 N -6.60 2.13 0.28 3.49 -2.85 -1.25 -4.96 119.74 109.99 2g5m s LYS 34 Ca 0.57 -0.72 0.07 0.00 -1.00 0.00 0.00 55.97 54.90 2g5m s LYS 34 Cb -0.29 -2.33 -0.03 0.00 -2.06 0.00 0.00 37.83 33.11 2g5m s LYS 34 CO 0.85 -1.13 0.20 -0.51 0.10 0.00 0.00 175.35 174.86 2g5m s LEU 35 N -5.04 3.66 -0.30 2.77 1.43 -1.26 -2.65 118.68 117.29 2g5m s LEU 35 Ca 0.61 -0.39 0.02 0.00 -1.03 0.00 0.00 54.13 53.34 2g5m s LEU 35 Cb -0.09 -2.21 0.09 0.00 0.03 0.00 0.00 46.19 44.01 2g5m s LEU 35 CO 0.42 -0.14 0.03 -0.83 0.23 0.00 0.00 176.35 176.06 2g5m s GLY 36 N -3.87 1.53 -0.98 -3.19 0.00 0.10 -4.54 107.32 96.37 2g5m s GLY 36 Ca 0.35 -1.98 -0.19 0.00 0.00 0.00 0.00 44.72 42.90 2g5m s GLY 36 CO 0.25 1.11 1.21 -0.42 0.00 0.00 0.00 173.10 175.25 2g5m s ILE 37 N 1.23 4.65 0.61 0.90 -1.09 -1.26 -1.50 121.20 124.74 2g5m s ILE 37 Ca 0.06 -1.59 -0.08 0.00 -2.23 0.00 0.00 60.65 56.81 2g5m s ILE 37 Cb -0.19 -4.83 -0.00 0.00 -1.58 0.00 0.00 42.46 35.86 2g5m s ILE 37 CO -0.12 -1.58 0.96 -0.36 -1.23 0.00 0.00 174.94 172.60 2g5m s PHE 38 N 2.88 3.36 0.11 3.97 0.40 -0.90 -2.41 117.98 125.40 2g5m s PHE 38 Ca 0.36 0.86 -0.31 0.00 -0.60 0.00 0.00 56.93 57.24 2g5m s PHE 38 Cb -0.04 -2.77 -0.07 0.00 0.51 0.00 0.00 43.02 40.65 2g5m s PHE 38 CO -0.08 -0.83 1.29 0.08 0.70 0.00 0.00 175.22 176.37 2g5m s VAL 39 N -3.08 3.60 -0.20 -0.44 1.01 0.43 -0.20 120.40 121.52 2g5m s VAL 39 Ca 0.54 1.19 -0.19 0.00 0.00 0.00 0.00 61.98 63.51 2g5m s VAL 39 Cb -0.11 -3.76 -0.20 0.00 0.00 0.00 0.00 36.38 32.32 2g5m s VAL 39 CO 0.48 0.11 0.21 1.17 0.00 0.00 0.00 175.10 177.07 2g5m n LYS 40 N 3.65 0.59 -3.86 2.72 4.81 0.15 -4.46 118.16 121.76 2g5m n LYS 40 Ca 0.09 0.53 -0.10 0.00 -0.87 0.00 0.00 58.31 57.96 2g5m n LYS 40 Cb 0.44 -1.73 -0.06 0.00 0.02 0.00 0.00 35.03 33.70 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 -2.39 0.07 -0.33 3.15 -1.32 -1.17 -4.95 115.64 108.69 2g5m s THR 41 Ca -0.28 -1.13 -0.01 0.00 -1.21 0.00 0.00 61.69 59.05 2g5m s THR 41 Cb 0.06 -1.64 0.12 0.00 -1.51 0.00 0.00 72.50 69.54 2g5m s THR 41 CO 0.61 -0.31 0.18 0.54 -2.21 0.00 0.00 174.62 173.44 2g5m s VAL 42 N -3.91 0.18 0.07 5.08 0.11 -1.26 -0.49 120.40 120.17 2g5m s VAL 42 Ca 0.12 -1.43 -0.30 0.00 -2.93 0.00 0.00 61.98 57.43 2g5m s VAL 42 Cb 0.02 -1.15 -0.05 0.00 -1.53 0.00 0.00 36.38 33.67 2g5m s VAL 42 CO -0.03 -0.89 1.14 -0.89 -3.33 0.00 0.00 175.10 171.10 2g5m s THR 43 N 1.39 4.18 0.61 5.04 2.01 -0.32 -4.78 115.64 123.77 2g5m s THR 43 Ca 0.15 1.61 0.32 0.00 0.31 0.00 0.00 61.69 64.07 2g5m s THR 43 Cb -0.21 -4.03 0.37 0.00 0.01 0.00 0.00 72.50 68.64 2g5m s THR 43 CO -0.13 0.15 2.18 -0.33 -0.69 0.00 0.00 174.62 175.80 2g5m h GLU 44 N 6.53 0.00 0.00 4.92 5.08 -1.95 -1.30 114.58 127.86 2g5m h GLU 44 Ca -0.42 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.94 2g5m h GLU 44 Cb 1.21 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.46 2g5m h GLU 44 CO 0.78 0.00 0.00 0.41 -1.00 0.00 0.00 179.01 179.20 2g5m n GLY 45 N -1.31 -0.99 3.58 -3.84 0.00 -1.26 -4.57 105.19 96.80 2g5m n GLY 45 Ca -0.01 -0.17 -0.26 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 -2.13 2.40 0.27 -0.02 0.00 -0.49 -4.85 107.32 102.51 2g5m s GLY 46 Ca 0.40 -2.19 -0.05 0.00 0.00 0.00 0.00 44.72 42.88 2g5m s GLY 46 CO 0.36 -2.02 1.94 0.00 0.00 0.00 0.00 173.10 173.38 2g5m h ALA 47 N 1.86 1.33 -0.72 3.20 0.00 -1.64 -2.84 119.26 120.44 2g5m h ALA 47 Ca -0.43 -0.06 -0.07 0.00 0.00 0.00 0.00 54.91 54.35 2g5m h ALA 47 Cb 1.24 -0.38 -0.03 0.00 0.00 0.00 0.00 17.79 18.62 2g5m h ALA 47 CO 0.78 0.63 0.19 0.00 0.00 0.00 0.00 179.25 180.85 2g5m h ALA 48 N 1.41 0.98 -0.12 0.00 0.00 -1.83 0.27 119.26 119.97 2g5m h ALA 48 Ca 0.35 -0.24 -0.11 0.00 0.00 0.00 0.00 54.91 54.91 2g5m h ALA 48 Cb -0.14 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.37 2g5m h ALA 48 CO -0.08 0.67 -0.36 1.25 0.00 0.00 0.00 179.25 180.73 2g5m h HIS 49 N 1.09 0.60 -0.39 0.00 6.17 -1.64 0.42 115.15 121.39 2g5m h HIS 49 Ca 0.23 -0.24 -0.01 0.00 0.71 0.00 0.00 60.37 61.06 2g5m h HIS 49 Cb 0.35 -0.10 -0.02 0.00 2.52 0.00 0.00 27.41 30.16 2g5m h HIS 49 CO 0.03 0.98 0.19 0.00 0.71 0.00 0.00 177.93 179.84 2g5m h ARG 50 N 0.06 0.56 0.10 5.26 3.08 -1.23 -2.64 114.38 119.57 2g5m h ARG 50 Ca -0.01 -0.08 -0.01 0.00 0.07 0.00 0.00 59.98 59.95 2g5m h ARG 50 Cb 0.98 -0.10 0.00 0.00 0.08 0.00 0.00 29.97 30.93 2g5m h ARG 50 CO 0.08 0.49 -0.05 0.22 -1.07 0.00 0.00 179.97 179.64 2g5m h ASP 51 N 0.50 -0.12 -0.24 7.04 3.58 -0.53 -3.47 116.42 123.18 2g5m h ASP 51 Ca 0.14 -0.23 0.00 0.00 0.42 0.00 0.00 57.03 57.35 2g5m h ASP 51 Cb 0.11 0.03 0.00 0.00 1.72 0.00 0.00 39.33 41.19 2g5m h ASP 51 CO -0.02 0.17 0.00 0.61 -2.88 0.00 0.00 179.24 177.13 2g5m n GLY 52 N -0.40 1.02 0.00 -0.78 0.00 0.09 -5.05 105.19 100.08 2g5m n GLY 52 Ca -0.08 -0.17 0.00 0.00 0.00 0.00 0.00 46.02 45.76 2g5m n GLY 52 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2g5m n ARG 53 N -0.17 0.00 -2.82 1.61 3.00 -0.90 -4.88 116.66 112.50 2g5m n ARG 53 Ca 0.00 0.01 -0.42 0.00 -0.00 0.00 0.00 57.85 57.44 2g5m n ARG 53 Cb 0.12 -0.35 -0.03 0.00 0.00 0.00 0.00 32.46 32.20 2g5m n ARG 53 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.63 178.05 2g5m s ILE 54 N -0.68 4.86 0.41 5.15 1.01 -1.26 -5.04 121.20 125.65 2g5m s ILE 54 Ca 0.00 1.79 0.08 0.00 0.00 0.00 0.00 60.65 62.51 2g5m s ILE 54 Cb 0.00 -4.20 0.01 0.00 0.01 0.00 0.00 42.46 38.27 2g5m s ILE 54 CO 0.00 0.04 0.55 0.00 0.00 0.00 0.00 174.94 175.53 2g5m s GLN 55 N 1.94 2.84 0.00 2.79 -2.07 -1.26 -4.65 119.66 119.25 2g5m s GLN 55 Ca 0.42 -1.24 0.11 0.00 -1.82 0.00 0.00 55.36 52.84 2g5m s GLN 55 Cb -0.17 -2.74 0.60 0.00 -1.09 0.00 0.00 33.01 29.60 2g5m s GLN 55 CO 0.15 -0.23 1.14 1.55 -1.32 0.00 0.00 175.29 176.58 2g5m n VAL 56 N -1.81 0.30 -1.34 3.63 3.14 -1.26 -1.98 118.33 119.01 2g5m n VAL 56 Ca 0.07 0.08 0.06 0.00 -2.96 0.00 0.00 64.34 61.58 2g5m n VAL 56 Cb 0.59 -0.90 0.08 0.00 -1.06 0.00 0.00 33.84 32.55 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 -1.11 1.48 -4.92 6.55 2.85 -1.26 -4.47 115.26 114.37 2g5m n ASN 57 Ca 0.07 -2.63 -0.27 0.00 -0.11 0.00 0.00 54.58 51.64 2g5m n ASN 57 Cb 0.06 -0.33 0.06 0.00 1.24 0.00 0.00 39.78 40.81 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 -2.10 5.03 -0.04 1.20 1.01 -0.84 -4.83 116.67 116.10 2g5m s ASP 58 Ca 0.19 0.61 0.00 0.00 0.71 0.00 0.00 52.55 54.06 2g5m s ASP 58 Cb 0.17 -1.34 0.03 0.00 1.01 0.00 0.00 42.92 42.78 2g5m s ASP 58 CO 0.02 -1.47 -0.02 -0.22 0.21 0.00 0.00 175.17 173.69 2g5m s LEU 59 N -5.22 1.08 -0.98 1.23 2.96 -1.26 -0.43 118.68 116.06 2g5m s LEU 59 Ca 0.59 -0.07 -0.23 0.00 -0.22 0.00 0.00 54.13 54.20 2g5m s LEU 59 Cb -0.11 -0.35 0.06 0.00 0.50 0.00 0.00 46.19 46.29 2g5m s LEU 59 CO 0.46 -0.11 1.38 -0.76 -1.32 0.00 0.00 176.35 176.00 2g5m s LEU 60 N 1.21 3.75 0.10 -0.68 1.43 -1.01 -3.21 118.68 120.26 2g5m s LEU 60 Ca -0.07 -1.47 -0.12 0.00 -1.03 0.00 0.00 54.13 51.44 2g5m s LEU 60 Cb -0.14 -2.54 -0.17 0.00 0.03 0.00 0.00 46.19 43.38 2g5m s LEU 60 CO -0.02 -1.46 1.28 0.58 0.23 0.00 0.00 176.35 176.96 2g5m h VAL 61 N 6.57 1.28 -2.52 -1.59 2.07 -1.61 -3.42 116.25 117.03 2g5m h VAL 61 Ca 0.15 -2.07 0.06 0.00 0.82 0.00 0.00 66.70 65.66 2g5m h VAL 61 Cb 1.02 2.12 -0.14 0.00 -1.52 0.00 0.00 31.29 32.76 2g5m h VAL 61 CO 1.36 0.65 0.39 -1.83 0.02 0.00 0.00 177.57 178.16 2g5m s GLU 62 N -3.60 0.98 0.63 1.57 -1.05 -1.08 -2.69 118.70 113.46 2g5m s GLU 62 Ca -0.10 -0.34 0.06 0.00 -0.15 0.00 0.00 54.97 54.44 2g5m s GLU 62 Cb 0.08 0.45 0.10 0.00 -0.44 0.00 0.00 34.13 34.33 2g5m s GLU 62 CO 0.91 -0.43 0.87 0.54 0.95 0.00 0.00 175.26 178.10 2g5m s VAL 63 N -3.28 2.15 0.21 1.83 0.11 -0.48 -0.38 120.40 120.56 2g5m s VAL 63 Ca 0.03 -0.85 -0.19 0.00 -2.93 0.00 0.00 61.98 58.04 2g5m s VAL 63 Cb -0.01 -2.31 0.18 0.00 -1.53 0.00 0.00 36.38 32.71 2g5m s VAL 63 CO -0.10 0.00 1.57 -0.78 -3.33 0.00 0.00 175.10 172.46 2g5m h ASP 64 N -0.08 -1.34 -0.80 3.54 3.58 -0.70 -3.02 116.42 117.60 2g5m h ASP 64 Ca -0.32 0.27 -0.39 0.00 0.42 0.00 0.00 57.03 57.01 2g5m h ASP 64 Cb 1.28 0.68 -0.41 0.00 1.72 0.00 0.00 39.33 42.60 2g5m h ASP 64 CO 0.40 -0.30 -1.01 0.61 -2.88 0.00 0.00 179.24 176.06 2g5m n GLY 65 N -1.45 3.38 3.27 -0.78 0.00 -1.26 -4.91 105.19 103.44 2g5m n GLY 65 Ca 0.07 -1.73 -0.01 0.00 0.00 0.00 0.00 46.02 44.35 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 -4.07 -0.88 -0.43 2.61 2.01 -1.14 -5.13 115.64 108.60 2g5m s THR 66 Ca 0.35 0.01 -0.28 0.00 0.31 0.00 0.00 61.69 62.09 2g5m s THR 66 Cb 0.39 -0.92 0.02 0.00 0.01 0.00 0.00 72.50 72.00 2g5m s THR 66 CO -0.02 -0.01 1.04 -0.44 -0.69 0.00 0.00 174.62 174.50 2g5m s SER 67 N 2.78 6.65 -0.46 3.53 0.01 -1.26 -1.39 113.70 123.56 2g5m s SER 67 Ca 0.09 0.48 -0.29 0.00 1.31 0.00 0.00 55.95 57.53 2g5m s SER 67 Cb -0.14 -2.51 0.03 0.00 0.21 0.00 0.00 66.02 63.61 2g5m s SER 67 CO -0.18 -1.09 1.16 -0.76 0.41 0.00 0.00 173.24 172.78 2g5m s LEU 68 N 4.00 3.65 0.35 2.44 1.43 -1.10 -4.87 118.68 124.59 2g5m s LEU 68 Ca 0.43 0.54 0.18 0.00 -1.03 0.00 0.00 54.13 54.25 2g5m s LEU 68 Cb -0.09 -3.55 0.44 0.00 0.03 0.00 0.00 46.19 43.02 2g5m s LEU 68 CO 0.26 -1.25 1.62 1.62 0.23 0.00 0.00 176.35 178.83 2g5m h VAL 69 N 6.22 0.78 0.00 -1.59 3.04 -1.95 -3.42 116.25 119.34 2g5m h VAL 69 Ca -0.23 -1.75 0.00 0.00 -1.01 0.00 0.00 66.70 63.71 2g5m h VAL 69 Cb 1.06 2.13 0.00 0.00 -2.01 0.00 0.00 31.29 32.47 2g5m h VAL 69 CO 1.12 0.39 0.00 0.61 -1.01 0.00 0.00 177.57 178.68 2g5m n GLY 70 N 0.70 -0.42 3.39 3.17 0.00 -1.26 -4.56 105.19 106.21 2g5m n GLY 70 Ca 0.01 -0.06 -0.25 0.00 0.00 0.00 0.00 46.02 45.72 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 -2.10 1.61 0.24 -1.26 -4.03 118.33 112.79 2g5m n VAL 71 Ca 0.00 -0.96 -0.28 0.00 -2.04 0.00 0.00 64.34 61.06 2g5m n VAL 71 Cb 0.00 -1.46 0.05 0.00 -1.47 0.00 0.00 33.84 30.96 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 -3.40 3.13 0.21 3.34 -4.23 -1.26 -4.77 115.64 108.66 2g5m s THR 72 Ca 0.65 0.14 -0.10 0.00 -1.18 0.00 0.00 61.69 61.19 2g5m s THR 72 Cb -0.02 -3.32 0.15 0.00 1.34 0.00 0.00 72.50 70.64 2g5m s THR 72 CO 0.45 -0.38 1.87 -0.61 -0.54 0.00 0.00 174.62 175.41 2g5m h GLN 73 N -0.55 0.92 -0.54 3.99 4.15 -1.93 -0.88 115.11 120.27 2g5m h GLN 73 Ca -0.45 -0.06 -0.10 0.00 0.77 0.00 0.00 58.65 58.81 2g5m h GLN 73 Cb 1.28 -0.21 -0.02 0.00 0.21 0.00 0.00 27.48 28.74 2g5m h GLN 73 CO 0.63 0.61 -0.06 1.03 -1.93 0.00 0.00 178.83 179.11 2g5m h SER 74 N 0.95 0.95 0.02 -0.69 0.87 -1.97 -0.57 113.55 113.11 2g5m h SER 74 Ca 0.27 -0.29 -0.00 0.00 -1.23 0.00 0.00 61.79 60.55 2g5m h SER 74 Cb -0.07 -0.26 0.00 0.00 -0.44 0.00 0.00 62.40 61.63 2g5m h SER 74 CO -0.07 1.04 -0.01 0.15 -0.53 0.00 0.00 176.83 177.41 2g5m h PHE 75 N 0.87 -0.02 -0.70 2.24 3.04 -1.78 -1.59 116.94 118.99 2g5m h PHE 75 Ca 0.15 -0.00 -0.01 0.00 3.98 0.00 0.00 57.97 62.08 2g5m h PHE 75 Cb 0.60 0.01 -0.03 0.00 2.56 0.00 0.00 35.95 39.08 2g5m h PHE 75 CO 0.04 0.14 0.39 0.00 -2.02 0.00 0.00 178.31 176.85 2g5m h ALA 76 N 0.80 1.36 -0.05 2.41 0.00 -1.02 -1.09 119.26 121.67 2g5m h ALA 76 Ca -0.00 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 54.78 2g5m h ALA 76 Cb 0.17 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 2g5m h ALA 76 CO 0.00 0.53 -0.09 0.00 0.00 0.00 0.00 179.25 179.70 2g5m h ALA 77 N 1.45 1.77 0.00 0.00 0.00 -0.74 -2.03 119.26 119.70 2g5m h ALA 77 Ca 0.25 -0.11 -0.17 0.00 0.00 0.00 0.00 54.91 54.88 2g5m h ALA 77 Cb 0.02 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 2g5m h ALA 77 CO -0.04 0.17 -0.93 0.77 0.00 0.00 0.00 179.25 179.22 2g5m h SER 78 N 0.07 0.00 0.49 0.00 0.02 -0.25 -3.29 113.55 110.58 2g5m h SER 78 Ca 0.01 0.00 -0.14 0.00 -0.84 0.00 0.00 61.79 60.83 2g5m h SER 78 Cb 0.20 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 62.73 2g5m h SER 78 CO 0.01 0.75 -0.61 1.62 -1.14 0.00 0.00 176.83 177.47 2g5m h VAL 79 N 0.00 1.41 0.00 2.27 3.04 -0.54 -1.25 116.25 121.18 2g5m h VAL 79 Ca -0.06 -2.03 0.00 0.00 -1.01 0.00 0.00 66.70 63.61 2g5m h VAL 79 Cb 1.62 2.06 0.00 0.00 -2.01 0.00 0.00 31.29 32.96 2g5m h VAL 79 CO 0.09 0.59 0.00 -0.07 -1.01 0.00 0.00 177.57 177.17 2g5m h LEU 80 N 0.09 0.00 -0.40 3.16 3.38 -1.59 -0.51 115.31 119.44 2g5m h LEU 80 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2g5m h LEU 80 Cb 1.09 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.84 2g5m h LEU 80 CO 0.09 0.00 -0.76 0.54 0.09 0.00 0.00 178.44 178.39 2g5m n ARG 81 N -2.67 0.66 0.05 1.13 1.74 -0.53 -3.99 116.66 113.06 2g5m n ARG 81 Ca 0.00 -0.40 0.12 0.00 -0.77 0.00 0.00 57.85 56.81 2g5m n ARG 81 Cb 0.20 -1.46 0.12 0.00 -1.02 0.00 0.00 32.46 30.31 2g5m n ARG 81 CO 0.00 0.00 0.00 -0.91 -1.52 0.00 0.00 177.63 175.20 2g5m h ASN 82 N 0.96 0.00 -2.80 0.55 -0.26 -0.43 -3.47 115.58 110.13 2g5m h ASN 82 Ca 0.00 -0.25 -0.45 0.00 -0.56 0.00 0.00 56.30 55.04 2g5m h ASN 82 Cb 0.58 0.00 0.04 0.00 -1.06 0.00 0.00 38.32 37.89 2g5m h ASN 82 CO 0.00 0.12 -0.02 0.42 -1.06 0.00 0.00 177.43 176.89 2g5m s THR 83 N -3.18 3.29 0.00 2.81 -4.23 -0.91 -5.09 115.64 108.32 2g5m s THR 83 Ca 0.05 -0.50 0.00 0.00 -1.18 0.00 0.00 61.69 60.06 2g5m s THR 83 Cb 0.13 -3.24 0.00 0.00 1.34 0.00 0.00 72.50 70.73 2g5m s THR 83 CO 0.75 -0.18 0.00 0.29 -0.54 0.00 0.00 174.62 174.93 2g5m n LYS 84 N -2.30 0.02 0.06 3.99 4.76 -1.26 -4.97 118.16 118.47 2g5m n LYS 84 Ca 0.05 0.00 0.13 0.00 -2.87 0.00 0.00 58.31 55.62 2g5m n LYS 84 Cb 0.59 0.00 0.40 0.00 -1.84 0.00 0.00 35.03 34.18 2g5m n LYS 84 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2g5m n GLY 85 N 4.22 -1.57 2.70 0.72 0.00 -1.26 -4.58 105.19 105.41 2g5m n GLY 85 Ca 0.00 -0.11 -0.23 0.00 0.00 0.00 0.00 46.02 45.68 2g5m n GLY 85 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2g5m s ARG 86 N -3.08 0.28 0.07 1.61 6.06 -1.26 0.03 118.95 122.67 2g5m s ARG 86 Ca 0.11 0.07 -0.12 0.00 -2.50 0.00 0.00 55.73 53.29 2g5m s ARG 86 Cb 0.14 -1.19 0.01 0.00 0.06 0.00 0.00 34.95 33.98 2g5m s ARG 86 CO 0.61 -0.44 0.27 0.14 -2.50 0.00 0.00 175.30 173.37 2g5m s VAL 87 N 2.05 0.11 0.50 7.11 -7.23 -1.00 -5.02 120.40 116.91 2g5m s VAL 87 Ca 0.03 -0.87 0.04 0.00 -1.81 0.00 0.00 61.98 59.38 2g5m s VAL 87 Cb -0.14 -1.12 0.03 0.00 0.56 0.00 0.00 36.38 35.71 2g5m s VAL 87 CO -0.06 -0.48 0.69 -0.13 -0.31 0.00 0.00 175.10 174.81 2g5m s ARG 88 N -3.24 2.65 0.14 4.82 0.52 -1.26 -1.68 118.95 120.90 2g5m s ARG 88 Ca -0.00 -0.99 -0.13 0.00 -0.52 0.00 0.00 55.73 54.09 2g5m s ARG 88 Cb 0.02 -2.60 0.01 0.00 0.52 0.00 0.00 34.95 32.90 2g5m s ARG 88 CO -0.08 -0.54 0.34 -0.06 0.02 0.00 0.00 175.30 174.99 2g5m s PHE 89 N -2.59 0.05 -0.25 -0.53 0.08 0.14 0.09 117.98 114.96 2g5m s PHE 89 Ca 0.57 -0.41 -0.01 0.00 0.12 0.00 0.00 56.93 57.19 2g5m s PHE 89 Cb -0.10 0.13 0.03 0.00 -0.57 0.00 0.00 43.02 42.51 2g5m s PHE 89 CO 0.36 -0.71 -0.06 -1.64 -0.10 0.00 0.00 175.22 173.07 2g5m s MET 90 N -3.87 2.76 -0.20 0.44 -1.94 0.49 -0.62 119.30 116.36 2g5m s MET 90 Ca 0.08 -1.03 -0.13 0.00 -1.71 0.00 0.00 55.69 52.91 2g5m s MET 90 Cb 0.02 -2.99 -0.05 0.00 2.01 0.00 0.00 34.83 33.83 2g5m s MET 90 CO -0.07 -0.43 0.26 0.42 -0.01 0.00 0.00 175.02 175.19 2g5m s ILE 91 N 1.30 5.31 -0.27 2.53 1.09 0.94 -1.56 121.20 130.55 2g5m s ILE 91 Ca -0.01 0.43 -0.07 0.00 -1.10 0.00 0.00 60.65 59.90 2g5m s ILE 91 Cb -0.17 -3.59 -0.01 0.00 -1.06 0.00 0.00 42.46 37.62 2g5m s ILE 91 CO -0.04 0.35 0.08 -0.83 -0.10 0.00 0.00 174.94 174.39 2g5m s GLY 92 N 0.78 1.77 -0.90 6.18 0.00 -1.20 -0.42 107.32 113.53 2g5m s GLY 92 Ca 0.13 -1.25 -0.24 0.00 0.00 0.00 0.00 44.72 43.36 2g5m s GLY 92 CO 0.04 0.58 1.78 -1.60 0.00 0.00 0.00 173.10 173.90 2g5m s ARG 93 N 1.58 2.87 -1.32 2.90 6.06 0.28 -4.43 118.95 126.88 2g5m s ARG 93 Ca 0.05 -0.44 -0.13 0.00 -2.50 0.00 0.00 55.73 52.71 2g5m s ARG 93 Cb -0.16 -5.05 0.12 0.00 0.06 0.00 0.00 34.95 29.91 2g5m s ARG 93 CO 0.03 -2.96 1.88 -1.91 -2.50 0.00 0.00 175.30 169.84 2g5m n GLU 94 N 8.91 3.28 -0.06 5.12 2.13 -1.26 -3.22 120.64 135.55 2g5m n GLU 94 Ca 0.35 -3.28 -0.04 0.00 0.66 0.00 0.00 57.16 54.85 2g5m n GLU 94 Cb 0.49 -3.15 -0.04 0.00 0.27 0.00 0.00 31.44 29.01 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 6.37 0.00 -7.00 5.31 2.43 -1.89 -3.48 114.38 116.13 2g5m h ARG 95 Ca 0.44 0.00 -0.48 0.00 -0.81 0.00 0.00 59.98 59.13 2g5m h ARG 95 Cb 0.72 0.00 0.05 0.00 -0.42 0.00 0.00 29.97 30.31 2g5m h ARG 95 CO 1.61 0.27 0.11 -1.25 -1.51 0.00 0.00 179.97 179.20 2g5m s PRO 96 N -1.79 3.10 0.00 0.20 0.04 -1.26 -5.02 135.00 130.26 2g5m s PRO 96 Ca -0.07 -0.04 0.00 0.00 0.04 0.00 0.00 61.00 60.93 2g5m s PRO 96 Cb -0.00 -2.35 0.00 0.00 0.04 0.00 0.00 34.50 32.19 2g5m s PRO 96 CO 0.20 -0.50 0.00 0.41 0.04 0.00 0.00 177.00 177.15 2g5m n GLY 97 N -2.41 -0.09 2.71 0.56 0.00 -1.26 -4.92 105.19 99.78 2g5m n GLY 97 Ca 0.03 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.63 2g5m n GLY 97 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2g5m n GLU 98 N -1.64 3.15 -0.07 1.61 0.28 -1.26 -4.57 120.64 118.15 2g5m n GLU 98 Ca 0.00 -2.79 0.00 0.00 -0.16 0.00 0.00 57.16 54.21 2g5m n GLU 98 Cb 0.00 -3.15 0.00 0.00 1.43 0.00 0.00 31.44 29.72 2g5m n GLU 98 CO 0.00 0.00 0.00 1.04 -0.16 0.00 0.00 177.13 178.01 2g5m n GLN 99 N 5.25 0.00 -0.97 3.44 1.13 -1.26 -5.15 117.38 119.83 2g5m n GLN 99 Ca 0.52 0.00 -0.32 0.00 -1.94 0.00 0.00 57.00 55.26 2g5m n GLN 99 Cb 0.37 0.00 0.14 0.00 0.11 0.00 0.00 30.24 30.85 2g5m n GLN 99 CO 0.00 0.00 0.00 -1.12 -1.44 0.00 0.00 177.06 174.50 2g5m s SER 100 N 1.00 3.47 -0.48 1.08 0.01 -1.26 -4.07 113.70 113.46 2g5m s SER 100 Ca 0.00 2.18 -0.08 0.00 1.31 0.00 0.00 55.95 59.36 2g5m s SER 100 Cb 0.00 -2.57 0.01 0.00 0.21 0.00 0.00 66.02 63.67 2g5m s SER 100 CO 0.00 -2.74 0.56 1.21 0.41 0.00 0.00 173.24 172.68 2g5m n GLU 101 N -3.75 -1.72 -2.16 12.44 4.07 -1.26 -4.84 120.64 123.42 2g5m n GLU 101 Ca 0.12 1.71 -0.30 0.00 -0.06 0.00 0.00 57.16 58.62 2g5m n GLU 101 Cb 0.52 -5.18 -0.05 0.00 -0.06 0.00 0.00 31.44 26.67 2g5m n GLU 101 CO 0.00 0.00 0.00 0.14 -0.06 0.00 0.00 177.13 177.21 2g5m s VAL 102 N -2.64 3.58 -0.29 6.31 -7.23 -1.26 -4.90 120.40 113.97 2g5m s VAL 102 Ca 0.13 -0.67 -0.00 0.00 -1.81 0.00 0.00 61.98 59.63 2g5m s VAL 102 Cb -0.04 -4.38 0.05 0.00 0.56 0.00 0.00 36.38 32.58 2g5m s VAL 102 CO 0.67 -1.17 -0.03 0.00 -0.31 0.00 0.00 175.10 174.26 2g5m s ALA 103 N 9.21 2.75 -0.32 1.32 0.00 -1.26 -4.87 121.76 128.59 2g5m s ALA 103 Ca 0.65 -1.79 -0.08 0.00 0.00 0.00 0.00 51.96 50.74 2g5m s ALA 103 Cb -0.03 -1.85 0.01 0.00 0.00 0.00 0.00 23.12 21.25 2g5m s ALA 103 CO 0.02 -1.27 0.24 0.94 0.00 0.00 0.00 175.76 175.70 2g5m n GLN 104 N 4.56 -2.63 -4.03 0.00 -0.06 -1.18 -4.60 117.38 109.44 2g5m n GLN 104 Ca -0.13 2.23 -0.27 0.00 -2.00 0.00 0.00 57.00 56.83 2g5m n GLN 104 Cb 0.43 -4.67 -0.05 0.00 -4.06 0.00 0.00 30.24 21.89 2g5m n GLN 104 CO 0.00 0.00 0.00 -0.51 -0.20 0.00 0.00 177.06 176.35 2g5m s LEU 105 N -1.93 3.97 0.00 1.69 2.01 -1.26 -4.91 118.68 118.25 2g5m s LEU 105 Ca 0.11 -0.01 0.00 0.00 0.01 0.00 0.00 54.13 54.24 2g5m s LEU 105 Cb -0.03 -2.58 0.00 0.00 0.01 0.00 0.00 46.19 43.59 2g5m s LEU 105 CO 0.69 0.09 0.00 -0.38 1.01 0.00 0.00 176.35 177.76 2g5m n ILE 106 N -0.21 0.00 -2.63 -0.59 2.08 -1.26 -5.06 119.36 111.69 2g5m n ILE 106 Ca -0.08 0.20 -0.04 0.00 0.56 0.00 0.00 62.75 63.39 2g5m n ILE 106 Cb 0.54 -0.64 -0.04 0.00 -0.75 0.00 0.00 39.64 38.75 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 -1.16 -4.20 -0.06 0.38 7.27 -1.26 -4.92 117.38 113.43 2g5m n GLN 107 Ca 0.00 3.17 0.12 0.00 0.07 0.00 0.00 57.00 60.36 2g5m n GLN 107 Cb 0.00 -4.42 0.25 0.00 2.41 0.00 0.00 30.24 28.48 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 1.86 2.17 -4.19 3.69 7.27 -1.26 -4.84 117.38 122.07 2g5m n GLN 108 Ca -0.33 -1.72 -0.26 0.00 0.07 0.00 0.00 57.00 54.76 2g5m n GLN 108 Cb 0.50 -1.47 -0.06 0.00 2.41 0.00 0.00 30.24 31.62 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 -1.84 1.97 0.00 1.69 -1.32 -1.26 -4.68 115.64 110.20 2g5m s THR 109 Ca 0.33 -1.71 0.00 0.00 -1.21 0.00 0.00 61.69 59.10 2g5m s THR 109 Cb 0.21 -2.68 0.00 0.00 -1.51 0.00 0.00 72.50 68.52 2g5m s THR 109 CO 0.31 0.00 0.00 0.18 -2.21 0.00 0.00 174.62 172.90 2g5m n LEU 110 N -1.35 0.00 -4.45 9.08 4.77 -1.26 -3.96 117.00 119.83 2g5m n LEU 110 Ca -0.04 0.00 -0.43 0.00 -0.03 0.00 0.00 56.01 55.50 2g5m n LEU 110 Cb 0.65 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.74 2g5m n LEU 110 CO 0.43 0.00 1.79 -1.84 -1.33 0.00 0.00 177.39 176.44 2g5m n GLU 111 N 0.00 3.27 -0.76 3.23 0.28 -1.26 -4.66 120.64 120.74 2g5m n GLU 111 Ca 0.00 -3.48 0.02 0.00 -0.16 0.00 0.00 57.16 53.54 2g5m n GLU 111 Cb 0.00 -3.28 0.29 0.00 1.43 0.00 0.00 31.44 29.89 2g5m n GLU 111 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2g5m n GLN 112 N 6.93 3.39 0.00 3.44 10.64 -1.25 -4.92 117.38 135.61 2g5m n GLN 112 Ca 0.44 -3.03 0.12 0.00 -1.83 0.00 0.00 57.00 52.71 2g5m n GLN 112 Cb 0.44 -2.04 0.18 0.00 -0.86 0.00 0.00 30.24 27.96 2g5m n GLN 112 CO 0.00 0.00 0.00 -1.91 -1.83 0.00 0.00 177.06 173.32