#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 0.92 -4.26 1.61 -0.00 -1.26 -4.97 115.22 107.26 2g5m n HIS 2 Ca 0.00 0.40 -0.21 0.00 -0.00 0.00 0.00 57.72 57.91 2g5m n HIS 2 Cb 0.00 -0.87 -0.12 0.00 -0.00 0.00 0.00 29.99 29.00 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 -2.30 1.06 -0.50 -0.41 1.00 -1.26 -4.62 119.30 112.27 2g5m s MET 3 Ca -0.20 -1.18 -0.25 0.00 0.00 0.00 0.00 55.69 54.06 2g5m s MET 3 Cb 0.04 -1.14 0.03 0.00 0.00 0.00 0.00 34.83 33.76 2g5m s MET 3 CO 0.34 0.25 0.95 -1.21 0.00 0.00 0.00 175.02 175.35 2g5m s GLU 4 N -2.20 3.46 -0.98 2.03 2.02 -1.15 -4.78 118.70 117.10 2g5m s GLU 4 Ca 0.07 0.02 -0.20 0.00 0.02 0.00 0.00 54.97 54.87 2g5m s GLU 4 Cb -0.08 -3.98 0.10 0.00 0.10 0.00 0.00 34.13 30.27 2g5m s GLU 4 CO 0.04 -1.34 1.28 -0.51 0.02 0.00 0.00 175.26 174.75 2g5m s LEU 5 N 3.89 4.38 -0.02 1.80 2.01 -1.24 -2.34 118.68 127.17 2g5m s LEU 5 Ca 0.35 -1.84 0.03 0.00 0.01 0.00 0.00 54.13 52.68 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 0.24 -1.24 -0.09 0.72 1.01 0.00 0.00 176.35 176.99 2g5m s PHE 6 N 3.64 2.85 0.11 0.29 -0.12 -0.06 -4.88 117.98 119.80 2g5m s PHE 6 Ca 0.39 -0.06 -0.30 0.00 -0.05 0.00 0.00 56.93 56.91 2g5m s PHE 6 Cb -0.03 -1.63 -0.06 0.00 -0.63 0.00 0.00 43.02 40.68 2g5m s PHE 6 CO -0.09 0.33 1.11 -1.25 -0.05 0.00 0.00 175.22 175.27 2g5m s PRO 7 N -1.16 4.53 -0.17 1.99 0.04 -1.26 -0.44 135.00 138.53 2g5m s PRO 7 Ca 0.15 1.69 0.01 0.00 0.04 0.00 0.00 61.00 62.89 2g5m s PRO 7 Cb -0.11 -3.33 0.02 0.00 0.04 0.00 0.00 34.50 31.12 2g5m s PRO 7 CO 0.05 -0.06 -0.19 0.08 0.04 0.00 0.00 177.00 176.92 2g5m s VAL 8 N 0.41 1.97 -0.20 -0.36 1.01 0.81 -4.93 120.40 119.10 2g5m s VAL 8 Ca 0.53 -0.89 -0.02 0.00 0.00 0.00 0.00 61.98 61.60 2g5m s VAL 8 Cb -0.28 -1.78 0.00 0.00 0.00 0.00 0.00 36.38 34.32 2g5m s VAL 8 CO 0.32 0.53 -0.11 -0.70 0.00 0.00 0.00 175.10 175.13 2g5m s GLU 9 N 1.25 3.22 0.20 2.72 2.12 -1.26 0.02 118.70 126.98 2g5m s GLU 9 Ca 0.03 -0.71 0.02 0.00 0.36 0.00 0.00 54.97 54.67 2g5m s GLU 9 Cb -0.13 -2.82 0.02 0.00 0.26 0.00 0.00 34.13 31.46 2g5m s GLU 9 CO -0.11 -0.20 0.17 1.28 -0.54 0.00 0.00 175.26 175.87 2g5m n LEU 10 N 4.70 0.00 -3.50 2.70 4.77 -1.11 -4.92 117.00 119.64 2g5m n LEU 10 Ca -0.19 -1.04 -0.14 0.00 -0.03 0.00 0.00 56.01 54.61 2g5m n LEU 10 Cb 0.51 -0.04 -0.04 0.00 -2.33 0.00 0.00 43.42 41.52 2g5m n LEU 10 CO 0.28 -0.41 0.37 -0.70 -1.33 0.00 0.00 177.39 175.60 2g5m s GLU 11 N -2.85 1.15 0.59 3.23 2.56 -1.16 -3.82 118.70 118.40 2g5m s GLU 11 Ca 0.13 -0.21 -0.07 0.00 0.00 0.00 0.00 54.97 54.82 2g5m s GLU 11 Cb -0.01 0.53 -0.00 0.00 2.00 0.00 0.00 34.13 36.65 2g5m s GLU 11 CO 0.08 -0.44 0.92 -1.59 -0.56 0.00 0.00 175.26 173.67 2g5m s LYS 12 N -2.70 3.09 0.36 4.30 -2.85 -1.24 -4.74 119.74 115.96 2g5m s LYS 12 Ca -0.04 0.17 0.03 0.00 -1.00 0.00 0.00 55.97 55.13 2g5m s LYS 12 Cb -0.01 -2.24 0.03 0.00 -2.06 0.00 0.00 37.83 33.56 2g5m s LYS 12 CO -0.04 -0.64 0.23 -3.47 0.10 0.00 0.00 175.35 171.53 2g5m n ASP 13 N -2.60 2.26 0.21 0.03 -0.08 0.42 -4.93 116.55 111.86 2g5m n ASP 13 Ca 0.04 -2.27 0.05 0.00 -1.51 0.00 0.00 54.79 51.10 2g5m n ASP 13 Cb 0.57 0.01 0.48 0.00 2.34 0.00 0.00 41.12 44.52 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 0.48 0.04 0.72 1.67 0.02 -1.97 -0.81 113.55 113.70 2g5m h SER 14 Ca -0.24 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.71 2g5m h SER 14 Cb 0.83 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 63.36 2g5m h SER 14 CO 0.37 0.22 -0.58 1.21 -1.14 0.00 0.00 176.83 176.91 2g5m n GLU 15 N -4.31 0.18 0.00 3.45 4.07 -1.26 -5.03 120.64 117.74 2g5m n GLU 15 Ca -0.02 0.05 0.00 0.00 -0.06 0.00 0.00 57.16 57.13 2g5m n GLU 15 Cb 0.25 -1.61 0.00 0.00 -0.06 0.00 0.00 31.44 30.02 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 1.40 1.16 3.99 8.31 0.00 -0.31 -4.99 105.19 114.75 2g5m n GLY 16 Ca 0.04 -0.96 -0.20 0.00 0.00 0.00 0.00 46.02 44.90 2g5m n GLY 16 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2g5m s LEU 17 N 0.00 3.29 -0.36 0.99 2.01 -1.26 -0.43 118.68 122.91 2g5m s LEU 17 Ca 0.00 -0.30 0.14 0.00 0.01 0.00 0.00 54.13 53.98 2g5m s LEU 17 Cb 0.00 -2.48 0.41 0.00 0.01 0.00 0.00 46.19 44.14 2g5m s LEU 17 CO 0.00 -1.21 0.89 0.61 1.01 0.00 0.00 176.35 177.65 2g5m n GLY 18 N -2.30 2.83 3.24 -3.19 0.00 -1.26 -4.33 105.19 100.17 2g5m n GLY 18 Ca 0.10 -1.64 -0.09 0.00 0.00 0.00 0.00 46.02 44.40 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 0.00 0.00 -3.68 -0.61 -5.35 -1.26 -1.87 119.36 106.60 2g5m n ILE 19 Ca 0.18 -1.00 -0.12 0.00 -0.27 0.00 0.00 62.75 61.55 2g5m n ILE 19 Cb 0.73 0.89 -0.06 0.00 -1.74 0.00 0.00 39.64 39.45 2g5m n ILE 19 CO 0.00 0.00 0.00 -0.44 -1.76 0.00 0.00 176.55 174.35 2g5m s SER 20 N -2.83 -0.23 0.26 7.28 0.01 -0.35 -4.86 113.70 112.98 2g5m s SER 20 Ca 0.16 -0.13 0.11 0.00 1.31 0.00 0.00 55.95 57.40 2g5m s SER 20 Cb -0.04 0.42 -0.05 0.00 0.21 0.00 0.00 66.02 66.57 2g5m s SER 20 CO 0.12 -0.70 -0.13 0.27 0.41 0.00 0.00 173.24 173.20 2g5m s ILE 21 N -2.86 2.84 -0.12 1.44 -4.36 -1.26 0.19 121.20 117.07 2g5m s ILE 21 Ca -0.03 -2.15 -0.09 0.00 -0.26 0.00 0.00 60.65 58.12 2g5m s ILE 21 Cb 0.00 -2.48 0.04 0.00 1.25 0.00 0.00 42.46 41.27 2g5m s ILE 21 CO -0.05 -0.34 0.31 -0.51 0.24 0.00 0.00 174.94 174.59 2g5m s ILE 22 N -2.30 -0.01 -0.12 8.37 1.10 0.99 -4.43 121.20 124.80 2g5m s ILE 22 Ca 0.29 0.05 -0.30 0.00 -0.51 0.00 0.00 60.65 60.18 2g5m s ILE 22 Cb -0.06 -0.45 -0.02 0.00 0.15 0.00 0.00 42.46 42.08 2g5m s ILE 22 CO 0.16 0.02 1.24 -0.83 -2.11 0.00 0.00 174.94 173.42 2g5m s GLY 23 N 0.59 1.82 0.04 1.50 0.00 -1.26 -0.62 107.32 109.39 2g5m s GLY 23 Ca -0.04 0.53 0.06 0.00 0.00 0.00 0.00 44.72 45.28 2g5m s GLY 23 CO -0.04 2.39 -0.19 1.06 0.00 0.00 0.00 173.10 176.33 2g5m s MET 24 N 2.98 1.26 0.00 2.90 -1.94 -1.26 -4.92 119.30 118.32 2g5m s MET 24 Ca 0.55 -0.86 0.00 0.00 -1.71 0.00 0.00 55.69 53.67 2g5m s MET 24 Cb -0.23 -1.33 0.00 0.00 2.01 0.00 0.00 34.83 35.28 2g5m s MET 24 CO 0.18 0.34 0.00 0.41 -0.01 0.00 0.00 175.02 175.94 2g5m n GLY 25 N 1.92 0.38 3.21 -0.03 0.00 -1.26 -4.64 105.19 104.77 2g5m n GLY 25 Ca -0.17 -1.74 -0.13 0.00 0.00 0.00 0.00 46.02 43.98 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 -1.01 1.23 -1.10 4.61 0.00 -1.26 -5.05 121.76 119.18 2g5m s ALA 26 Ca 0.00 -1.70 -0.18 0.00 0.00 0.00 0.00 51.96 50.08 2g5m s ALA 26 Cb 0.00 1.26 -0.07 0.00 0.00 0.00 0.00 23.12 24.32 2g5m s ALA 26 CO 0.00 -0.55 2.09 0.41 0.00 0.00 0.00 175.76 177.71 2g5m n GLY 27 N -0.28 3.45 2.78 0.00 0.00 -1.26 -4.69 105.19 105.19 2g5m n GLY 27 Ca 0.01 -1.41 -0.40 0.00 0.00 0.00 0.00 46.02 44.22 2g5m n GLY 27 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2g5m n ALA 28 N 6.66 6.36 0.62 4.61 0.00 -1.26 -4.70 120.51 132.80 2g5m n ALA 28 Ca 0.51 -4.26 0.01 0.00 0.00 0.00 0.00 53.44 49.71 2g5m n ALA 28 Cb 0.38 -2.10 0.08 0.00 0.00 0.00 0.00 19.45 17.82 2g5m n ALA 28 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2g5m n ASP 29 N -0.23 1.96 -1.27 0.00 5.75 -1.26 -0.80 116.55 120.70 2g5m n ASP 29 Ca 0.51 -2.19 -0.02 0.00 -0.01 0.00 0.00 54.79 53.08 2g5m n ASP 29 Cb 0.26 -0.54 0.14 0.00 -1.03 0.00 0.00 41.12 39.95 2g5m n ASP 29 CO 0.00 0.00 0.00 1.15 -0.11 0.00 0.00 177.20 178.24 2g5m n MET 30 N 0.13 2.29 0.00 0.11 0.00 -1.26 -4.67 117.12 113.71 2g5m n MET 30 Ca 0.06 -1.36 0.00 0.00 0.00 0.00 0.00 57.70 56.39 2g5m n MET 30 Cb 0.44 -1.72 0.00 0.00 0.00 0.00 0.00 33.22 31.94 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 0.09 1.37 0.58 3.17 0.00 -1.26 -5.03 105.19 104.11 2g5m n GLY 31 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 2g5m n GLY 31 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2g5m n LEU 32 N 0.00 0.00 -4.14 0.99 7.94 -1.18 -5.04 117.00 115.57 2g5m n LEU 32 Ca 0.00 0.00 -0.33 0.00 -1.11 0.00 0.00 56.01 54.57 2g5m n LEU 32 Cb 0.00 0.00 -0.02 0.00 0.53 0.00 0.00 43.42 43.93 2g5m n LEU 32 CO 0.00 -0.14 -0.06 -0.62 -1.11 0.00 0.00 177.39 175.45 2g5m n GLU 33 N -1.43 -3.41 -2.24 1.96 1.02 0.02 -4.85 120.64 111.71 2g5m n GLU 33 Ca 0.00 0.40 -0.32 0.00 -0.02 0.00 0.00 57.16 57.22 2g5m n GLU 33 Cb 0.00 -5.00 -0.04 0.00 -0.02 0.00 0.00 31.44 26.38 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 -6.83 2.96 0.07 3.49 1.02 -1.24 -3.51 119.74 115.70 2g5m s LYS 34 Ca 0.57 -0.84 0.00 0.00 0.02 0.00 0.00 55.97 55.71 2g5m s LYS 34 Cb -0.31 -5.22 -0.00 0.00 -0.52 0.00 0.00 37.83 31.78 2g5m s LYS 34 CO 0.91 -3.07 0.01 1.28 -0.92 0.00 0.00 175.35 173.56 2g5m n LEU 35 N 12.16 0.00 0.00 3.17 4.32 -0.94 -4.95 117.00 130.76 2g5m n LEU 35 Ca 0.40 -0.48 0.00 0.00 -0.02 0.00 0.00 56.01 55.91 2g5m n LEU 35 Cb 0.48 0.11 0.00 0.00 -1.62 0.00 0.00 43.42 42.39 2g5m n LEU 35 CO 0.65 -0.07 0.00 0.61 -1.22 0.00 0.00 177.39 177.35 2g5m n GLY 36 N 2.86 0.45 1.86 -0.72 0.00 -1.26 -3.06 105.19 105.31 2g5m n GLY 36 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.00 2g5m n GLY 36 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2g5m n ILE 37 N 0.00-10.71 -2.40 -0.61 2.08 -1.26 -4.24 119.36 102.22 2g5m n ILE 37 Ca 0.00 2.49 -0.25 0.00 0.56 0.00 0.00 62.75 65.55 2g5m n ILE 37 Cb 0.13 -5.04 0.11 0.00 -0.75 0.00 0.00 39.64 34.09 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 -0.42 1.86 0.22 1.39 0.40 0.21 -2.94 117.98 118.70 2g5m s PHE 38 Ca 0.00 -0.03 -0.23 0.00 -0.60 0.00 0.00 56.93 56.07 2g5m s PHE 38 Cb 0.00 -3.24 -0.08 0.00 0.51 0.00 0.00 43.02 40.20 2g5m s PHE 38 CO 0.00 -1.81 0.79 0.08 0.70 0.00 0.00 175.22 174.98 2g5m s VAL 39 N -3.29 4.42 -0.22 -0.44 1.01 -0.33 -0.00 120.40 121.54 2g5m s VAL 39 Ca 0.66 1.55 -0.14 0.00 0.00 0.00 0.00 61.98 64.05 2g5m s VAL 39 Cb -0.06 -3.99 -0.18 0.00 0.00 0.00 0.00 36.38 32.15 2g5m s VAL 39 CO 0.46 0.31 0.01 1.17 0.00 0.00 0.00 175.10 177.04 2g5m n LYS 40 N 0.99 0.62 -3.82 2.72 4.81 0.13 -4.52 118.16 119.08 2g5m n LYS 40 Ca -0.03 0.37 -0.06 0.00 -0.87 0.00 0.00 58.31 57.73 2g5m n LYS 40 Cb 0.50 -1.63 -0.01 0.00 0.02 0.00 0.00 35.03 33.91 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 -2.46 0.00 -0.36 3.15 -1.32 -1.14 -4.95 115.64 108.55 2g5m s THR 41 Ca -0.32 -0.88 0.03 0.00 -1.21 0.00 0.00 61.69 59.31 2g5m s THR 41 Cb 0.09 -2.18 0.15 0.00 -1.51 0.00 0.00 72.50 69.06 2g5m s THR 41 CO 0.59 0.00 0.37 0.54 -2.21 0.00 0.00 174.62 173.91 2g5m s VAL 42 N -3.41 -0.33 0.18 5.08 0.11 -1.26 -1.21 120.40 119.56 2g5m s VAL 42 Ca 0.13 -0.94 -0.32 0.00 -2.93 0.00 0.00 61.98 57.91 2g5m s VAL 42 Cb -0.04 -0.72 -0.12 0.00 -1.53 0.00 0.00 36.38 33.97 2g5m s VAL 42 CO 0.06 -0.58 1.73 0.41 -3.33 0.00 0.00 175.10 173.40 2g5m n THR 43 N 4.37 0.08 0.32 5.04 -1.04 -0.78 -4.79 114.28 117.48 2g5m n THR 43 Ca 0.10 -0.01 0.15 0.00 -2.04 0.00 0.00 64.05 62.24 2g5m n THR 43 Cb 0.45 -1.97 0.65 0.00 -1.82 0.00 0.00 70.33 67.65 2g5m n THR 43 CO 0.00 0.00 0.00 1.05 -0.64 0.00 0.00 175.07 175.48 2g5m h GLU 44 N 7.07 0.00 -0.01 -2.82 4.11 -1.97 -0.40 114.58 120.56 2g5m h GLU 44 Ca -0.44 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.99 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 0.95 0.00 -0.00 0.41 0.07 0.00 0.00 179.01 180.44 2g5m n GLY 45 N -0.23 -0.28 3.79 1.06 0.00 -1.26 -4.59 105.19 103.67 2g5m n GLY 45 Ca 0.01 -0.38 -0.23 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 -2.00 2.23 0.11 -0.02 0.00 -0.16 -5.03 107.32 102.45 2g5m s GLY 46 Ca 0.41 -2.01 -0.27 0.00 0.00 0.00 0.00 44.72 42.85 2g5m s GLY 46 CO 0.35 -1.82 1.63 0.00 0.00 0.00 0.00 173.10 173.26 2g5m h ALA 47 N 1.29 -0.46 -0.72 3.20 0.00 -1.78 -2.99 119.26 117.81 2g5m h ALA 47 Ca -0.42 -0.04 0.10 0.00 0.00 0.00 0.00 54.91 54.54 2g5m h ALA 47 Cb 1.26 0.45 -0.05 0.00 0.00 0.00 0.00 17.79 19.45 2g5m h ALA 47 CO 0.65 -0.81 0.47 0.00 0.00 0.00 0.00 179.25 179.56 2g5m h ALA 48 N 0.24 1.87 -0.01 0.00 0.00 -1.85 0.29 119.26 119.80 2g5m h ALA 48 Ca 0.03 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.85 2g5m h ALA 48 Cb 0.51 -0.13 0.01 0.00 0.00 0.00 0.00 17.79 18.18 2g5m h ALA 48 CO -0.16 -0.02 -0.32 1.25 0.00 0.00 0.00 179.25 180.00 2g5m h HIS 49 N 0.60 0.34 -0.08 0.00 6.17 -1.71 -1.58 115.15 118.89 2g5m h HIS 49 Ca 0.33 -0.18 -0.18 0.00 0.71 0.00 0.00 60.37 61.05 2g5m h HIS 49 Cb 0.49 -0.04 -0.00 0.00 2.52 0.00 0.00 27.41 30.37 2g5m h HIS 49 CO -0.00 0.97 -0.73 0.00 0.71 0.00 0.00 177.93 178.88 2g5m h ARG 50 N -0.39 0.40 0.10 5.26 3.08 -1.26 -3.10 114.38 118.47 2g5m h ARG 50 Ca -0.04 -0.33 -0.00 0.00 0.07 0.00 0.00 59.98 59.68 2g5m h ARG 50 Cb 1.05 0.07 0.00 0.00 0.08 0.00 0.00 29.97 31.17 2g5m h ARG 50 CO 0.06 0.97 -0.05 0.22 -1.07 0.00 0.00 179.97 180.11 2g5m h ASP 51 N 0.27 -0.11 -0.55 7.04 1.82 -0.51 -3.48 116.42 120.89 2g5m h ASP 51 Ca -0.03 -0.26 0.00 0.00 -0.39 0.00 0.00 57.03 56.35 2g5m h ASP 51 Cb 1.31 0.03 0.00 0.00 0.68 0.00 0.00 39.33 41.34 2g5m h ASP 51 CO 0.13 0.20 0.00 0.61 -1.61 0.00 0.00 179.24 178.57 2g5m n GLY 52 N -0.33 0.60 1.07 -0.78 0.00 -0.62 -5.07 105.19 100.07 2g5m n GLY 52 Ca -0.08 -0.28 0.00 0.00 0.00 0.00 0.00 46.02 45.66 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 -0.28 0.00 -2.71 1.61 5.12 -1.07 -5.05 116.66 114.29 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 0.12 0.00 -0.03 0.00 -1.16 0.00 0.00 32.46 31.39 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 -0.72 4.86 0.33 0.55 1.01 -1.26 -5.03 121.20 120.94 2g5m s ILE 54 Ca 0.00 2.05 0.09 0.00 0.00 0.00 0.00 60.65 62.80 2g5m s ILE 54 Cb 0.00 -4.32 -0.05 0.00 0.01 0.00 0.00 42.46 38.10 2g5m s ILE 54 CO 0.00 0.13 -0.02 -1.10 0.00 0.00 0.00 174.94 173.95 2g5m s GLN 55 N 1.19 2.02 0.42 2.79 -0.21 -1.26 -4.55 119.66 120.06 2g5m s GLN 55 Ca 0.51 -1.76 0.09 0.00 0.02 0.00 0.00 55.36 54.22 2g5m s GLN 55 Cb -0.20 -1.90 0.90 0.00 1.00 0.00 0.00 33.01 32.81 2g5m s GLN 55 CO 0.26 0.17 2.04 -0.24 -2.12 0.00 0.00 175.29 175.40 2g5m h VAL 56 N 1.88 1.06 -0.31 1.09 3.04 -1.91 -2.92 116.25 118.18 2g5m h VAL 56 Ca -0.43 -0.18 0.00 0.00 -1.01 0.00 0.00 66.70 65.09 2g5m h VAL 56 Cb 1.25 0.49 0.00 0.00 -2.01 0.00 0.00 31.29 31.02 2g5m h VAL 56 CO 0.66 0.09 0.00 0.59 -1.01 0.00 0.00 177.57 177.91 2g5m n ASN 57 N -4.48 2.99 -4.82 3.17 4.13 -1.26 -3.95 115.26 111.05 2g5m n ASN 57 Ca 0.05 -1.87 -0.28 0.00 1.68 0.00 0.00 54.58 54.15 2g5m n ASN 57 Cb 0.13 -0.20 0.09 0.00 -1.54 0.00 0.00 39.78 38.27 2g5m n ASN 57 CO 0.00 0.00 0.00 -1.81 0.28 0.00 0.00 177.26 175.73 2g5m s ASP 58 N -1.20 4.44 -0.04 6.41 1.11 -1.10 -4.76 116.67 121.53 2g5m s ASP 58 Ca 0.29 0.59 0.02 0.00 0.18 0.00 0.00 52.55 53.63 2g5m s ASP 58 Cb 0.17 -1.08 0.01 0.00 1.07 0.00 0.00 42.92 43.09 2g5m s ASP 58 CO 0.23 -1.90 -0.09 -0.22 1.18 0.00 0.00 175.17 174.37 2g5m s LEU 59 N -5.50 1.66 -0.77 1.23 2.96 -1.26 -1.19 118.68 115.82 2g5m s LEU 59 Ca 0.63 -0.21 -0.22 0.00 -0.22 0.00 0.00 54.13 54.11 2g5m s LEU 59 Cb -0.10 -0.61 0.08 0.00 0.50 0.00 0.00 46.19 46.06 2g5m s LEU 59 CO 0.48 0.04 1.07 -0.76 -1.32 0.00 0.00 176.35 175.86 2g5m s LEU 60 N 0.45 4.41 0.12 -0.68 1.43 -1.15 -2.50 118.68 120.76 2g5m s LEU 60 Ca -0.08 -1.29 -0.09 0.00 -1.03 0.00 0.00 54.13 51.64 2g5m s LEU 60 Cb -0.12 -2.44 -0.11 0.00 0.03 0.00 0.00 46.19 43.56 2g5m s LEU 60 CO 0.01 -1.37 1.32 0.58 0.23 0.00 0.00 176.35 177.13 2g5m h VAL 61 N 6.01 1.31 -2.67 -1.59 2.07 -1.22 -3.41 116.25 116.75 2g5m h VAL 61 Ca -0.12 -2.08 -0.03 0.00 0.82 0.00 0.00 66.70 65.28 2g5m h VAL 61 Cb 1.05 2.09 -0.14 0.00 -1.52 0.00 0.00 31.29 32.77 2g5m h VAL 61 CO 1.19 0.65 0.20 -1.83 0.02 0.00 0.00 177.57 177.80 2g5m s GLU 62 N -3.63 1.21 0.55 1.57 -1.05 -1.16 -1.64 118.70 114.55 2g5m s GLU 62 Ca -0.09 -0.23 0.09 0.00 -0.15 0.00 0.00 54.97 54.60 2g5m s GLU 62 Cb 0.09 0.56 0.07 0.00 -0.44 0.00 0.00 34.13 34.41 2g5m s GLU 62 CO 0.89 -0.48 0.74 0.54 0.95 0.00 0.00 175.26 177.90 2g5m s VAL 63 N -2.90 2.24 0.16 1.83 0.11 0.07 -0.73 120.40 121.18 2g5m s VAL 63 Ca -0.03 -1.03 -0.27 0.00 -2.93 0.00 0.00 61.98 57.73 2g5m s VAL 63 Cb -0.01 -2.27 0.01 0.00 -1.53 0.00 0.00 36.38 32.59 2g5m s VAL 63 CO -0.05 0.00 1.57 -0.78 -3.33 0.00 0.00 175.10 172.51 2g5m h ASP 64 N 0.27 -1.43 -0.09 3.54 3.58 -1.74 -2.92 116.42 117.63 2g5m h ASP 64 Ca -0.32 0.22 -0.04 0.00 0.42 0.00 0.00 57.03 57.32 2g5m h ASP 64 Cb 1.29 0.63 -0.02 0.00 1.72 0.00 0.00 39.33 42.95 2g5m h ASP 64 CO 0.42 -0.36 -0.28 0.61 -2.88 0.00 0.00 179.24 176.75 2g5m n GLY 65 N -1.41 4.99 3.37 -0.78 0.00 -1.26 -4.94 105.19 105.15 2g5m n GLY 65 Ca -0.00 -1.24 -0.08 0.00 0.00 0.00 0.00 46.02 44.70 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 -3.15 -0.46 -0.17 2.61 2.01 -1.10 -5.14 115.64 110.23 2g5m s THR 66 Ca 0.38 0.10 -0.14 0.00 0.31 0.00 0.00 61.69 62.35 2g5m s THR 66 Cb 0.36 -0.74 -0.05 0.00 0.01 0.00 0.00 72.50 72.08 2g5m s THR 66 CO -0.03 0.04 0.29 -0.55 -0.69 0.00 0.00 174.62 173.68 2g5m s SER 67 N 2.22 6.40 -0.20 3.53 0.15 -1.26 -0.75 113.70 123.79 2g5m s SER 67 Ca -0.05 0.46 -0.18 0.00 0.70 0.00 0.00 55.95 56.88 2g5m s SER 67 Cb -0.10 -2.18 -0.03 0.00 -1.71 0.00 0.00 66.02 62.00 2g5m s SER 67 CO -0.15 0.08 0.50 -0.76 1.20 0.00 0.00 173.24 174.12 2g5m s LEU 68 N 0.60 4.15 0.01 3.45 1.43 -0.65 -4.92 118.68 122.75 2g5m s LEU 68 Ca 0.16 0.65 0.18 0.00 -1.03 0.00 0.00 54.13 54.09 2g5m s LEU 68 Cb -0.13 -2.68 -0.18 0.00 0.03 0.00 0.00 46.19 43.23 2g5m s LEU 68 CO 0.04 -0.17 0.67 0.55 0.23 0.00 0.00 176.35 177.66 2g5m n VAL 69 N 4.54 1.03 0.00 -1.59 3.14 -1.26 -4.68 118.33 119.51 2g5m n VAL 69 Ca -0.05 -0.69 0.00 0.00 -2.96 0.00 0.00 64.34 60.64 2g5m n VAL 69 Cb 0.50 -0.58 0.00 0.00 -1.06 0.00 0.00 33.84 32.71 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 1.42 -0.77 4.00 7.55 0.00 -1.17 -2.21 105.19 114.00 2g5m n GLY 70 Ca -0.12 0.31 -0.23 0.00 0.00 0.00 0.00 46.02 45.98 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 2.10 0.62 1.61 -7.23 -1.26 -4.73 120.40 111.51 2g5m s VAL 71 Ca 0.00 -0.66 -0.10 0.00 -1.81 0.00 0.00 61.98 59.41 2g5m s VAL 71 Cb 0.00 -2.44 -0.03 0.00 0.56 0.00 0.00 36.38 34.47 2g5m s VAL 71 CO 0.00 0.00 1.02 0.42 -0.31 0.00 0.00 175.10 176.23 2g5m s THR 72 N -3.09 4.47 0.33 5.32 -4.23 -1.26 -4.66 115.64 112.53 2g5m s THR 72 Ca 0.66 0.72 0.03 0.00 -1.18 0.00 0.00 61.69 61.92 2g5m s THR 72 Cb -0.05 -3.78 0.19 0.00 1.34 0.00 0.00 72.50 70.20 2g5m s THR 72 CO 0.44 -1.01 1.91 -0.61 -0.54 0.00 0.00 174.62 174.82 2g5m h GLN 73 N -0.33 0.67 -0.59 3.99 4.15 -1.97 -0.31 115.11 120.71 2g5m h GLN 73 Ca -0.44 -0.10 -0.10 0.00 0.77 0.00 0.00 58.65 58.77 2g5m h GLN 73 Cb 1.21 -0.12 -0.02 0.00 0.21 0.00 0.00 27.48 28.76 2g5m h GLN 73 CO 0.62 0.58 -0.02 0.77 -1.93 0.00 0.00 178.83 178.85 2g5m h SER 74 N 0.66 1.04 -0.27 -0.69 0.02 -1.99 -0.53 113.55 111.79 2g5m h SER 74 Ca 0.16 -0.32 -0.02 0.00 -0.84 0.00 0.00 61.79 60.77 2g5m h SER 74 Cb 0.18 -0.28 -0.01 0.00 0.14 0.00 0.00 62.40 62.43 2g5m h SER 74 CO -0.01 1.11 0.07 0.15 -1.14 0.00 0.00 176.83 177.01 2g5m h PHE 75 N 0.96 0.44 -0.38 3.45 3.04 -1.72 -0.36 116.94 122.36 2g5m h PHE 75 Ca 0.17 -0.05 0.03 0.00 3.98 0.00 0.00 57.97 62.10 2g5m h PHE 75 Cb 0.59 -0.13 -0.03 0.00 2.56 0.00 0.00 35.95 38.94 2g5m h PHE 75 CO 0.04 0.49 0.18 0.00 -2.02 0.00 0.00 178.31 177.00 2g5m h ALA 76 N 0.90 0.47 -0.82 2.41 0.00 -0.91 -0.01 119.26 121.30 2g5m h ALA 76 Ca 0.09 0.02 0.04 0.00 0.00 0.00 0.00 54.91 55.05 2g5m h ALA 76 Cb 0.26 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 17.95 2g5m h ALA 76 CO -0.00 -0.18 0.52 0.00 0.00 0.00 0.00 179.25 179.59 2g5m h ALA 77 N 1.21 1.09 -0.12 0.00 0.00 -0.81 -1.78 119.26 118.85 2g5m h ALA 77 Ca 0.16 -0.03 -0.11 0.00 0.00 0.00 0.00 54.91 54.94 2g5m h ALA 77 Cb 0.08 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 2g5m h ALA 77 CO -0.12 0.34 -0.39 1.03 0.00 0.00 0.00 179.25 180.10 2g5m h SER 78 N 1.01 0.28 0.21 0.00 0.87 -0.40 -2.31 113.55 113.20 2g5m h SER 78 Ca 0.33 -0.11 -0.30 0.00 -1.23 0.00 0.00 61.79 60.48 2g5m h SER 78 Cb 0.03 -0.08 0.03 0.00 -0.44 0.00 0.00 62.40 61.94 2g5m h SER 78 CO -0.12 0.65 -1.25 1.62 -0.53 0.00 0.00 176.83 177.20 2g5m h VAL 79 N 0.22 1.31 -0.31 2.23 3.04 -0.27 -1.47 116.25 121.01 2g5m h VAL 79 Ca 0.02 -2.54 -0.05 0.00 -1.01 0.00 0.00 66.70 63.12 2g5m h VAL 79 Cb 0.80 2.73 -0.02 0.00 -2.01 0.00 0.00 31.29 32.79 2g5m h VAL 79 CO 0.06 0.77 -0.02 -0.07 -1.01 0.00 0.00 177.57 177.30 2g5m h LEU 80 N 0.24 0.44 -0.37 3.16 3.38 -1.33 -0.89 115.31 119.94 2g5m h LEU 80 Ca -0.18 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 57.70 2g5m h LEU 80 Cb 1.93 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 42.56 2g5m h LEU 80 CO 0.23 0.52 -0.19 0.54 0.09 0.00 0.00 178.44 179.64 2g5m n ARG 81 N -4.28 0.75 0.01 1.13 1.74 -0.87 -3.34 116.66 111.80 2g5m n ARG 81 Ca 0.01 -0.37 -0.18 0.00 -0.77 0.00 0.00 57.85 56.54 2g5m n ARG 81 Cb 0.24 -1.49 -0.14 0.00 -1.02 0.00 0.00 32.46 30.05 2g5m n ARG 81 CO 0.00 0.00 0.00 -0.97 -1.52 0.00 0.00 177.63 175.14 2g5m h ASN 82 N 0.90 0.33 -4.25 0.55 -1.24 -0.13 -3.47 115.58 108.27 2g5m h ASN 82 Ca 0.00 -0.67 -0.46 0.00 0.71 0.00 0.00 56.30 55.88 2g5m h ASN 82 Cb 0.44 -0.11 0.13 0.00 0.73 0.00 0.00 38.32 39.52 2g5m h ASN 82 CO 0.00 1.60 0.35 0.42 -1.29 0.00 0.00 177.43 178.50 2g5m s THR 83 N -2.58 1.97 0.48 -3.57 -4.23 -0.46 -5.07 115.64 102.18 2g5m s THR 83 Ca -0.16 0.00 -0.08 0.00 -1.18 0.00 0.00 61.69 60.27 2g5m s THR 83 Cb 0.07 -2.86 0.12 0.00 1.34 0.00 0.00 72.50 71.17 2g5m s THR 83 CO 0.80 0.00 0.41 0.29 -0.54 0.00 0.00 174.62 175.58 2g5m n LYS 84 N -3.71 -1.92 0.07 3.99 4.76 -1.26 -4.95 118.16 115.14 2g5m n LYS 84 Ca 0.09 -0.66 -0.05 0.00 -2.87 0.00 0.00 58.31 54.83 2g5m n LYS 84 Cb 0.60 -0.63 -0.09 0.00 -1.84 0.00 0.00 35.03 33.07 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 -1.40 0.00 -7.58 0.72 0.00 -1.93 -3.41 103.07 89.47 2g5m h GLY 85 Ca -0.16 0.00 -0.70 0.00 0.00 0.00 0.00 47.33 46.48 2g5m h GLY 85 CO 0.10 0.00 -0.57 -1.60 0.00 0.00 0.00 176.54 174.48 2g5m s ARG 86 N -2.77 2.84 0.01 4.80 3.52 -1.26 -2.98 118.95 123.12 2g5m s ARG 86 Ca 0.01 -1.05 -0.11 0.00 -0.13 0.00 0.00 55.73 54.45 2g5m s ARG 86 Cb 0.09 -3.57 0.01 0.00 -1.56 0.00 0.00 34.95 29.92 2g5m s ARG 86 CO 0.80 -0.62 0.24 0.14 -0.81 0.00 0.00 175.30 175.04 2g5m s VAL 87 N 1.50 0.08 -0.40 7.11 -7.23 -1.25 -4.96 120.40 115.25 2g5m s VAL 87 Ca 0.01 -0.66 -0.14 0.00 -1.81 0.00 0.00 61.98 59.39 2g5m s VAL 87 Cb -0.19 -0.67 0.02 0.00 0.56 0.00 0.00 36.38 36.10 2g5m s VAL 87 CO 0.05 -0.36 0.27 -0.13 -0.31 0.00 0.00 175.10 174.62 2g5m s ARG 88 N -1.78 2.95 0.31 4.82 0.52 -1.25 -2.77 118.95 121.75 2g5m s ARG 88 Ca -0.11 -1.02 0.01 0.00 -0.52 0.00 0.00 55.73 54.09 2g5m s ARG 88 Cb -0.04 -3.90 -0.03 0.00 0.52 0.00 0.00 34.95 31.49 2g5m s ARG 88 CO 0.01 -0.72 0.51 -0.06 0.02 0.00 0.00 175.30 175.05 2g5m s PHE 89 N 1.65 3.49 -0.31 -0.53 0.08 0.10 -2.01 117.98 120.45 2g5m s PHE 89 Ca 0.04 0.32 -0.07 0.00 0.12 0.00 0.00 56.93 57.34 2g5m s PHE 89 Cb -0.19 -1.86 0.01 0.00 -0.57 0.00 0.00 43.02 40.41 2g5m s PHE 89 CO 0.09 0.20 0.10 -1.64 -0.10 0.00 0.00 175.22 173.87 2g5m s MET 90 N -4.10 3.05 -0.08 0.44 -1.94 0.09 -0.14 119.30 116.63 2g5m s MET 90 Ca 0.39 -0.89 -0.13 0.00 -1.71 0.00 0.00 55.69 53.35 2g5m s MET 90 Cb -0.10 -3.43 -0.05 0.00 2.01 0.00 0.00 34.83 33.27 2g5m s MET 90 CO 0.34 -0.48 0.32 0.42 -0.01 0.00 0.00 175.02 175.61 2g5m s ILE 91 N 1.50 5.22 -0.33 2.53 1.09 0.41 -0.79 121.20 130.83 2g5m s ILE 91 Ca 0.02 0.63 0.03 0.00 -1.10 0.00 0.00 60.65 60.23 2g5m s ILE 91 Cb -0.18 -3.63 0.10 0.00 -1.06 0.00 0.00 42.46 37.69 2g5m s ILE 91 CO 0.03 0.52 0.04 -0.83 -0.10 0.00 0.00 174.94 174.61 2g5m s GLY 92 N -0.56 1.78 -0.28 6.18 0.00 -1.04 -0.89 107.32 112.51 2g5m s GLY 92 Ca 0.20 -2.33 -0.18 0.00 0.00 0.00 0.00 44.72 42.40 2g5m s GLY 92 CO 0.09 1.02 0.82 -1.60 0.00 0.00 0.00 173.10 173.42 2g5m s ARG 93 N 1.03 0.61 -0.80 2.90 6.06 -0.99 -4.24 118.95 123.52 2g5m s ARG 93 Ca 0.09 0.96 -0.15 0.00 -2.50 0.00 0.00 55.73 54.13 2g5m s ARG 93 Cb -0.19 0.18 0.20 0.00 0.06 0.00 0.00 34.95 35.20 2g5m s ARG 93 CO -0.10 -0.11 0.76 -2.00 -2.50 0.00 0.00 175.30 171.35 2g5m s GLU 94 N 1.19 3.54 0.07 5.12 2.12 -1.26 -2.92 118.70 126.56 2g5m s GLU 94 Ca -0.07 -2.34 -0.36 0.00 0.36 0.00 0.00 54.97 52.56 2g5m s GLU 94 Cb -0.05 -4.44 -0.19 0.00 0.26 0.00 0.00 34.13 29.72 2g5m s GLU 94 CO -0.14 -1.32 1.58 -0.09 -0.54 0.00 0.00 175.26 174.75 2g5m h ARG 95 N 7.96 -1.09 0.00 4.30 2.43 -1.97 -3.44 114.38 122.55 2g5m h ARG 95 Ca 0.07 0.07 -0.11 0.00 -0.81 0.00 0.00 59.98 59.20 2g5m h ARG 95 Cb 1.05 0.25 0.03 0.00 -0.42 0.00 0.00 29.97 30.87 2g5m h ARG 95 CO 0.80 -0.73 0.05 -0.35 -1.51 0.00 0.00 179.97 178.24 2g5m n PRO 96 N -5.60 0.17 0.00 0.20 -0.04 -1.26 -5.09 135.00 123.39 2g5m n PRO 96 Ca -0.14 -0.61 0.00 0.00 -0.04 0.00 0.00 63.50 62.71 2g5m n PRO 96 Cb 0.48 -0.22 0.00 0.00 -0.04 0.00 0.00 33.50 33.71 2g5m n PRO 96 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2g5m n GLY 97 N 3.04 -0.08 3.01 0.55 0.00 -1.26 -4.90 105.19 105.55 2g5m n GLY 97 Ca 0.04 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.74 2g5m n GLY 97 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2g5m s GLU 98 N 0.00 2.88 0.49 1.61 2.02 -1.26 -5.08 118.70 119.36 2g5m s GLU 98 Ca 0.00 -3.29 -0.21 0.00 0.02 0.00 0.00 54.97 51.49 2g5m s GLU 98 Cb 0.00 -3.70 -0.07 0.00 0.10 0.00 0.00 34.13 30.45 2g5m s GLU 98 CO 0.00 -1.27 1.10 -1.14 0.02 0.00 0.00 175.26 173.97 2g5m s GLN 99 N -1.36 3.67 0.53 1.61 0.74 -1.26 -4.88 119.66 118.71 2g5m s GLN 99 Ca 0.26 1.55 0.00 0.00 0.05 0.00 0.00 55.36 57.22 2g5m s GLN 99 Cb -0.07 -2.17 0.00 0.00 1.10 0.00 0.00 33.01 31.87 2g5m s GLN 99 CO -0.14 -0.57 0.00 0.43 -0.55 0.00 0.00 175.29 174.46 2g5m n SER 100 N -0.89 -7.37 -0.21 6.67 7.64 -1.26 -4.91 113.62 113.29 2g5m n SER 100 Ca 0.09 1.57 0.07 0.00 1.01 0.00 0.00 58.87 61.62 2g5m n SER 100 Cb 0.51 -4.40 0.11 0.00 -1.01 0.00 0.00 64.21 59.41 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 -2.91 0.98 -4.64 1.43 -0.58 -1.26 -5.03 120.64 108.63 2g5m n GLU 101 Ca -0.02 -2.24 -0.32 0.00 -0.42 0.00 0.00 57.16 54.15 2g5m n GLU 101 Cb 0.48 -1.25 -0.17 0.00 -0.57 0.00 0.00 31.44 29.93 2g5m n GLU 101 CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 2g5m s VAL 102 N -2.19 2.01 0.00 2.62 1.01 -1.26 -4.99 120.40 117.59 2g5m s VAL 102 Ca 0.25 -0.95 0.00 0.00 0.00 0.00 0.00 61.98 61.28 2g5m s VAL 102 Cb 0.22 -1.78 0.00 0.00 0.00 0.00 0.00 36.38 34.82 2g5m s VAL 102 CO 0.02 0.54 0.00 0.00 0.00 0.00 0.00 175.10 175.66 2g5m n ALA 103 N 4.09 0.00 -1.63 5.51 0.00 -1.26 -4.83 120.51 122.39 2g5m n ALA 103 Ca -0.20 -0.06 0.06 0.00 0.00 0.00 0.00 53.44 53.24 2g5m n ALA 103 Cb 0.51 0.00 0.11 0.00 0.00 0.00 0.00 19.45 20.08 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 -1.62 0.92 -1.52 0.00 1.13 -1.26 -4.87 117.38 110.16 2g5m n GLN 104 Ca 0.00 -2.39 -0.40 0.00 -1.94 0.00 0.00 57.00 52.27 2g5m n GLN 104 Cb 0.00 -1.10 -0.02 0.00 0.11 0.00 0.00 30.24 29.23 2g5m n GLN 104 CO 0.00 0.00 0.00 1.28 -1.44 0.00 0.00 177.06 176.90 2g5m n LEU 105 N -0.76 8.39 0.08 1.08 7.99 -1.26 -3.56 117.00 128.96 2g5m n LEU 105 Ca 0.12 -4.46 0.00 0.00 -0.01 0.00 0.00 56.01 51.66 2g5m n LEU 105 Cb 0.75 -1.53 0.00 0.00 -0.11 0.00 0.00 43.42 42.53 2g5m n LEU 105 CO -0.01 1.96 0.00 -0.38 -1.51 0.00 0.00 177.39 177.45 2g5m n ILE 106 N 3.33 0.80 -1.60 -0.08 2.08 -1.26 -5.03 119.36 117.61 2g5m n ILE 106 Ca 0.72 0.26 -0.31 0.00 0.56 0.00 0.00 62.75 63.98 2g5m n ILE 106 Cb 0.25 -1.21 0.05 0.00 -0.75 0.00 0.00 39.64 37.98 2g5m n ILE 106 CO 0.00 0.00 0.00 -1.10 0.56 0.00 0.00 176.55 176.01 2g5m s GLN 107 N -1.96 2.89 -0.01 0.38 1.11 -1.23 -5.06 119.66 115.77 2g5m s GLN 107 Ca 0.00 1.03 -0.01 0.00 0.01 0.00 0.00 55.36 56.39 2g5m s GLN 107 Cb 0.00 -1.98 0.01 0.00 -1.01 0.00 0.00 33.01 30.03 2g5m s GLN 107 CO 0.00 -1.14 0.03 -1.14 0.01 0.00 0.00 175.29 173.05 2g5m s GLN 108 N -4.86 0.02 -0.07 2.91 0.74 -1.26 -5.07 119.66 112.07 2g5m s GLN 108 Ca 0.59 0.07 -0.30 0.00 0.05 0.00 0.00 55.36 55.77 2g5m s GLN 108 Cb -0.15 -0.03 -0.03 0.00 1.10 0.00 0.00 33.01 33.90 2g5m s GLN 108 CO 0.52 -0.03 1.24 -0.08 -0.55 0.00 0.00 175.29 176.39 2g5m s THR 109 N 0.19 4.19 -1.80 -0.34 -1.32 -1.26 -4.82 115.64 110.48 2g5m s THR 109 Ca -0.01 1.50 0.17 0.00 -1.21 0.00 0.00 61.69 62.14 2g5m s THR 109 Cb -0.02 -3.97 0.33 0.00 -1.51 0.00 0.00 72.50 67.33 2g5m s THR 109 CO -0.01 -0.03 1.25 0.18 -2.21 0.00 0.00 174.62 173.80 2g5m n LEU 110 N 5.51 3.01 -3.82 9.08 4.77 -1.26 -4.43 117.00 129.86 2g5m n LEU 110 Ca 0.12 -1.55 -0.41 0.00 -0.03 0.00 0.00 56.01 54.14 2g5m n LEU 110 Cb 0.46 -0.20 0.00 0.00 -2.33 0.00 0.00 43.42 41.35 2g5m n LEU 110 CO 0.56 0.67 1.11 -0.62 -1.33 0.00 0.00 177.39 177.78 2g5m n GLU 111 N 1.05 4.57 -3.41 3.23 1.02 -1.26 -4.82 120.64 121.01 2g5m n GLU 111 Ca 0.15 -4.61 -0.22 0.00 -0.02 0.00 0.00 57.16 52.46 2g5m n GLU 111 Cb 0.49 -2.47 -0.10 0.00 -0.02 0.00 0.00 31.44 29.34 2g5m n GLU 111 CO 0.00 0.00 0.00 -1.14 1.18 0.00 0.00 177.13 177.17 2g5m s GLN 112 N -3.23 0.50 0.00 3.49 0.74 -1.26 -5.26 119.66 114.64 2g5m s GLN 112 Ca 0.34 -0.81 0.00 0.00 0.05 0.00 0.00 55.36 54.94 2g5m s GLN 112 Cb 0.10 -0.91 0.00 0.00 1.10 0.00 0.00 33.01 33.30 2g5m s GLN 112 CO 0.03 -1.15 0.44 0.39 -0.55 0.00 0.00 175.29 174.45