#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 0.66 -2.88 1.61 -0.00 -2.04 -3.40 115.15 109.10 2g5m h HIS 2 Ca 0.00 -0.06 -0.66 0.00 -0.00 0.00 0.00 60.37 59.65 2g5m h HIS 2 Cb 0.00 -0.19 -0.09 0.00 -0.00 0.00 0.00 27.41 27.13 2g5m h HIS 2 CO 0.00 0.59 -0.53 0.00 -0.00 0.00 0.00 177.93 177.99 2g5m s MET 3 N -5.49 3.29 -0.36 5.26 0.00 -1.26 -4.62 119.30 116.11 2g5m s MET 3 Ca -0.13 -0.28 0.00 0.00 0.00 0.00 0.00 55.69 55.28 2g5m s MET 3 Cb 0.10 -3.04 0.10 0.00 0.00 0.00 0.00 34.83 31.99 2g5m s MET 3 CO 0.76 0.72 0.11 -1.21 0.00 0.00 0.00 175.02 175.40 2g5m s GLU 4 N -1.29 1.85 -0.87 3.16 2.02 -1.22 -4.95 118.70 117.40 2g5m s GLU 4 Ca 0.18 -1.76 -0.17 0.00 0.02 0.00 0.00 54.97 53.24 2g5m s GLU 4 Cb -0.12 -3.36 0.15 0.00 0.10 0.00 0.00 34.13 30.91 2g5m s GLU 4 CO 0.08 -0.95 0.98 -0.51 0.02 0.00 0.00 175.26 174.88 2g5m s LEU 5 N 1.06 5.59 0.07 1.80 2.01 -1.25 -0.81 118.68 127.14 2g5m s LEU 5 Ca 0.07 -2.17 0.09 0.00 0.01 0.00 0.00 54.13 52.12 2g5m s LEU 5 Cb -0.21 -2.33 -0.03 0.00 0.01 0.00 0.00 46.19 43.62 2g5m s LEU 5 CO -0.05 -0.93 -0.21 0.72 1.01 0.00 0.00 176.35 176.89 2g5m s PHE 6 N 1.94 2.46 0.30 0.29 -0.12 -0.40 -4.91 117.98 117.53 2g5m s PHE 6 Ca 0.26 -0.31 -0.25 0.00 -0.05 0.00 0.00 56.93 56.58 2g5m s PHE 6 Cb -0.08 -1.39 -0.10 0.00 -0.63 0.00 0.00 43.02 40.82 2g5m s PHE 6 CO -0.08 0.26 0.90 -1.25 -0.05 0.00 0.00 175.22 175.00 2g5m s PRO 7 N -1.61 4.53 -0.05 1.99 0.04 -1.26 -0.14 135.00 138.50 2g5m s PRO 7 Ca 0.14 1.25 0.03 0.00 0.04 0.00 0.00 61.00 62.46 2g5m s PRO 7 Cb -0.10 -2.83 0.00 0.00 0.04 0.00 0.00 34.50 31.61 2g5m s PRO 7 CO 0.05 0.31 -0.14 0.08 0.04 0.00 0.00 177.00 177.34 2g5m s VAL 8 N -1.58 1.23 -0.13 -0.36 1.01 0.86 -4.90 120.40 116.53 2g5m s VAL 8 Ca 0.48 -0.58 0.02 0.00 0.00 0.00 0.00 61.98 61.91 2g5m s VAL 8 Cb -0.18 -1.08 0.01 0.00 0.00 0.00 0.00 36.38 35.13 2g5m s VAL 8 CO 0.23 0.36 -0.21 -0.70 0.00 0.00 0.00 175.10 174.79 2g5m s GLU 9 N 0.25 2.83 0.31 2.72 2.12 -1.26 0.36 118.70 126.03 2g5m s GLU 9 Ca -0.07 -0.79 -0.05 0.00 0.36 0.00 0.00 54.97 54.42 2g5m s GLU 9 Cb -0.12 -2.29 0.00 0.00 0.26 0.00 0.00 34.13 31.97 2g5m s GLU 9 CO 0.02 -0.01 0.46 -0.51 -0.54 0.00 0.00 175.26 174.69 2g5m s LEU 10 N 0.82 0.82 0.33 2.70 1.43 -0.40 -4.89 118.68 119.49 2g5m s LEU 10 Ca -0.08 -1.34 -0.02 0.00 -1.03 0.00 0.00 54.13 51.67 2g5m s LEU 10 Cb -0.16 1.52 -0.00 0.00 0.03 0.00 0.00 46.19 47.58 2g5m s LEU 10 CO -0.01 -1.25 0.44 -1.83 0.23 0.00 0.00 176.35 173.94 2g5m s GLU 11 N -3.32 1.86 0.26 1.70 -1.05 -1.26 -0.56 118.70 116.33 2g5m s GLU 11 Ca 0.29 -1.77 -0.05 0.00 -0.15 0.00 0.00 54.97 53.29 2g5m s GLU 11 Cb -0.00 0.43 -0.05 0.00 -0.44 0.00 0.00 34.13 34.06 2g5m s GLU 11 CO 0.17 -0.76 0.52 0.15 0.95 0.00 0.00 175.26 176.28 2g5m s LYS 12 N -3.16 3.63 0.00 -4.83 1.02 -1.01 -4.26 119.74 111.14 2g5m s LYS 12 Ca 0.32 -0.03 0.00 0.00 0.02 0.00 0.00 55.97 56.28 2g5m s LYS 12 Cb 0.00 -2.69 0.00 0.00 -0.52 0.00 0.00 37.83 34.62 2g5m s LYS 12 CO 0.20 0.27 0.00 -3.47 -0.92 0.00 0.00 175.35 171.43 2g5m n ASP 13 N -0.74 0.32 -0.23 2.83 2.03 -0.70 -4.76 116.55 115.29 2g5m n ASP 13 Ca -0.02 -0.44 -0.00 0.00 0.52 0.00 0.00 54.79 54.85 2g5m n ASP 13 Cb 0.54 0.00 0.12 0.00 -0.72 0.00 0.00 41.12 41.05 2g5m n ASP 13 CO 0.00 0.00 0.00 0.77 -1.92 0.00 0.00 177.20 176.05 2g5m h SER 14 N 0.00 0.46 0.02 1.67 4.64 -1.97 -2.56 113.55 115.81 2g5m h SER 14 Ca 0.00 0.05 -0.04 0.00 -0.47 0.00 0.00 61.79 61.33 2g5m h SER 14 Cb 0.00 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 62.06 2g5m h SER 14 CO 0.00 0.28 -0.17 -0.08 -0.87 0.00 0.00 176.83 175.99 2g5m h GLU 15 N 0.60 0.08 0.00 4.77 4.81 -1.95 -3.50 114.58 119.39 2g5m h GLU 15 Ca 0.32 -0.11 0.00 0.00 -0.13 0.00 0.00 59.36 59.44 2g5m h GLU 15 Cb 0.29 0.04 0.00 0.00 0.63 0.00 0.00 28.75 29.71 2g5m h GLU 15 CO -0.24 0.98 0.00 0.41 -0.73 0.00 0.00 179.01 179.43 2g5m n GLY 16 N 1.39 0.57 3.45 1.92 0.00 -0.97 -5.02 105.19 106.53 2g5m n GLY 16 Ca -0.10 -0.59 -0.43 0.00 0.00 0.00 0.00 46.02 44.89 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 4.52 -1.25 0.99 1.43 -1.26 -1.72 118.68 121.38 2g5m s LEU 17 Ca 0.00 -0.94 -0.05 0.00 -1.03 0.00 0.00 54.13 52.11 2g5m s LEU 17 Cb 0.00 -2.47 0.16 0.00 0.03 0.00 0.00 46.19 43.91 2g5m s LEU 17 CO 0.00 -1.32 2.29 0.61 0.23 0.00 0.00 176.35 178.16 2g5m n GLY 18 N 5.28 5.39 3.69 -3.19 0.00 -1.26 -4.82 105.19 110.27 2g5m n GLY 18 Ca -0.04 -2.15 -0.11 0.00 0.00 0.00 0.00 46.02 43.72 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 -1.79 0.00 0.07 -0.61 -4.36 -1.26 0.29 121.20 113.54 2g5m s ILE 19 Ca 0.51 -1.23 -0.24 0.00 -0.26 0.00 0.00 60.65 59.44 2g5m s ILE 19 Cb 0.19 -2.80 0.06 0.00 1.25 0.00 0.00 42.46 41.16 2g5m s ILE 19 CO -0.10 0.00 0.57 -0.44 0.24 0.00 0.00 174.94 175.21 2g5m s SER 20 N -3.14 -0.52 0.29 4.36 0.01 -0.18 -4.87 113.70 109.65 2g5m s SER 20 Ca 0.21 0.20 0.10 0.00 1.31 0.00 0.00 55.95 57.78 2g5m s SER 20 Cb -0.03 0.54 -0.05 0.00 0.21 0.00 0.00 66.02 66.69 2g5m s SER 20 CO 0.15 -0.79 -0.06 0.27 0.41 0.00 0.00 173.24 173.23 2g5m s ILE 21 N -2.70 2.98 -0.02 1.44 -4.36 -1.26 0.43 121.20 117.72 2g5m s ILE 21 Ca -0.04 -2.07 -0.01 0.00 -0.26 0.00 0.00 60.65 58.28 2g5m s ILE 21 Cb -0.00 -2.68 0.01 0.00 1.25 0.00 0.00 42.46 41.04 2g5m s ILE 21 CO -0.04 -0.34 0.03 -0.51 0.24 0.00 0.00 174.94 174.32 2g5m s ILE 22 N -2.42 -0.03 -0.41 8.37 1.10 0.13 -4.45 121.20 123.49 2g5m s ILE 22 Ca 0.32 0.10 -0.23 0.00 -0.51 0.00 0.00 60.65 60.33 2g5m s ILE 22 Cb -0.05 -0.07 0.02 0.00 0.15 0.00 0.00 42.46 42.52 2g5m s ILE 22 CO 0.18 0.04 0.77 -0.83 -2.11 0.00 0.00 174.94 172.99 2g5m s GLY 23 N 0.50 1.63 -0.03 1.50 0.00 -1.26 -0.86 107.32 108.79 2g5m s GLY 23 Ca -0.04 -0.85 0.03 0.00 0.00 0.00 0.00 44.72 43.85 2g5m s GLY 23 CO -0.02 1.75 -0.09 1.06 0.00 0.00 0.00 173.10 175.80 2g5m s MET 24 N 3.17 2.58 0.05 2.90 -1.94 0.06 -5.00 119.30 121.13 2g5m s MET 24 Ca 0.30 -0.67 -0.26 0.00 -1.71 0.00 0.00 55.69 53.35 2g5m s MET 24 Cb -0.13 -2.48 -0.06 0.00 2.01 0.00 0.00 34.83 34.17 2g5m s MET 24 CO 0.20 0.62 0.79 0.20 -0.01 0.00 0.00 175.02 176.82 2g5m s GLY 25 N -1.06 2.82 -0.06 -0.03 0.00 -1.26 -0.53 107.32 107.20 2g5m s GLY 25 Ca 0.14 0.32 0.01 0.00 0.00 0.00 0.00 44.72 45.19 2g5m s GLY 25 CO 0.04 1.13 -0.07 0.00 0.00 0.00 0.00 173.10 174.20 2g5m s ALA 26 N -0.07 0.90 -0.21 3.20 0.00 -1.26 -4.81 121.76 119.51 2g5m s ALA 26 Ca 0.39 -0.21 0.12 0.00 0.00 0.00 0.00 51.96 52.27 2g5m s ALA 26 Cb -0.21 -0.53 0.44 0.00 0.00 0.00 0.00 23.12 22.82 2g5m s ALA 26 CO 0.24 -0.05 1.20 0.41 0.00 0.00 0.00 175.76 177.56 2g5m n GLY 27 N 4.14 4.81 2.78 0.00 0.00 -1.22 -3.43 105.19 112.26 2g5m n GLY 27 Ca -0.22 -1.57 -0.42 0.00 0.00 0.00 0.00 46.02 43.81 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 -0.80 5.54 0.19 4.61 0.00 -0.58 -4.59 120.51 124.87 2g5m n ALA 28 Ca 0.23 -4.08 0.07 0.00 0.00 0.00 0.00 53.44 49.66 2g5m n ALA 28 Cb 0.82 -3.26 0.29 0.00 0.00 0.00 0.00 19.45 17.30 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 5.83 0.00 0.30 0.00 3.58 -1.89 0.20 116.42 124.43 2g5m h ASP 29 Ca 0.50 0.00 -0.01 0.00 0.42 0.00 0.00 57.03 57.93 2g5m h ASP 29 Cb 0.62 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 41.67 2g5m h ASP 29 CO 1.76 0.33 -0.07 0.00 -2.88 0.00 0.00 179.24 178.38 2g5m h MET 30 N 0.00 0.00 0.00 0.28 -0.00 -1.95 -3.32 114.93 109.94 2g5m h MET 30 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.70 2g5m h MET 30 Cb 0.98 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.58 2g5m h MET 30 CO 0.04 0.07 0.00 0.41 -0.00 0.00 0.00 176.91 177.43 2g5m n GLY 31 N -0.80 -0.31 0.00 -3.00 0.00 -1.00 -5.05 105.19 95.02 2g5m n GLY 31 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.00 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 -2.11 0.00 -4.32 0.99 7.94 -0.31 -5.09 117.00 114.11 2g5m n LEU 32 Ca 0.00 0.00 -0.45 0.00 -1.11 0.00 0.00 56.01 54.45 2g5m n LEU 32 Cb 0.00 0.00 -0.01 0.00 0.53 0.00 0.00 43.42 43.94 2g5m n LEU 32 CO 0.00 0.00 0.65 -1.61 -1.11 0.00 0.00 177.39 175.32 2g5m s GLU 33 N 0.00 3.95 0.13 1.96 0.41 0.55 -4.88 118.70 120.81 2g5m s GLU 33 Ca 0.00 -3.02 -0.02 0.00 -0.41 0.00 0.00 54.97 51.52 2g5m s GLU 33 Cb 0.00 -4.47 0.03 0.00 -1.78 0.00 0.00 34.13 27.91 2g5m s GLU 33 CO 0.00 -1.25 0.18 1.63 -0.49 0.00 0.00 175.26 175.32 2g5m n LYS 34 N 3.02 -0.06 -1.35 1.61 4.01 -1.17 -1.53 118.16 122.69 2g5m n LYS 34 Ca 0.21 -0.30 -0.53 0.00 -0.51 0.00 0.00 58.31 57.18 2g5m n LYS 34 Cb 0.41 -0.17 -0.08 0.00 -0.51 0.00 0.00 35.03 34.68 2g5m n LYS 34 CO 0.00 0.00 0.00 1.28 -1.11 0.00 0.00 177.40 177.57 2g5m n LEU 35 N 0.00 0.93 -4.38 -0.35 7.99 -1.22 -4.29 117.00 115.67 2g5m n LEU 35 Ca 0.02 0.91 -0.45 0.00 -0.01 0.00 0.00 56.01 56.48 2g5m n LEU 35 Cb 0.08 -0.69 -0.07 0.00 -0.11 0.00 0.00 43.42 42.63 2g5m n LEU 35 CO 0.06 -0.66 0.11 -0.83 -1.51 0.00 0.00 177.39 174.56 2g5m s GLY 36 N 2.50 2.01 -0.96 -0.72 0.00 0.31 -3.88 107.32 106.57 2g5m s GLY 36 Ca 0.83 -2.17 -0.19 0.00 0.00 0.00 0.00 44.72 43.20 2g5m s GLY 36 CO 0.64 1.17 1.19 -0.42 0.00 0.00 0.00 173.10 175.67 2g5m s ILE 37 N 1.81 4.66 0.83 0.90 -1.09 -1.26 -0.76 121.20 126.29 2g5m s ILE 37 Ca 0.06 -1.57 -0.11 0.00 -2.23 0.00 0.00 60.65 56.79 2g5m s ILE 37 Cb -0.25 -4.82 0.12 0.00 -1.58 0.00 0.00 42.46 35.93 2g5m s ILE 37 CO 0.06 -1.57 1.18 -0.36 -1.23 0.00 0.00 174.94 173.02 2g5m s PHE 38 N 2.86 2.35 0.12 3.97 0.40 -0.04 -3.10 117.98 124.53 2g5m s PHE 38 Ca 0.35 0.44 -0.26 0.00 -0.60 0.00 0.00 56.93 56.86 2g5m s PHE 38 Cb -0.04 -3.60 -0.07 0.00 0.51 0.00 0.00 43.02 39.82 2g5m s PHE 38 CO -0.09 -1.99 0.81 0.08 0.70 0.00 0.00 175.22 174.73 2g5m s VAL 39 N -3.57 4.50 -0.23 -0.44 1.01 -0.79 0.20 120.40 121.08 2g5m s VAL 39 Ca 0.66 1.76 -0.17 0.00 0.00 0.00 0.00 61.98 64.23 2g5m s VAL 39 Cb -0.08 -4.17 -0.17 0.00 0.00 0.00 0.00 36.38 31.96 2g5m s VAL 39 CO 0.49 0.43 0.01 1.17 0.00 0.00 0.00 175.10 177.20 2g5m n LYS 40 N 2.23 0.59 -4.03 2.72 4.81 0.17 -4.56 118.16 120.09 2g5m n LYS 40 Ca -0.03 0.43 -0.10 0.00 -0.87 0.00 0.00 58.31 57.74 2g5m n LYS 40 Cb 0.49 -1.65 -0.06 0.00 0.02 0.00 0.00 35.03 33.84 2g5m n LYS 40 CO 0.00 0.00 0.00 -0.08 1.17 0.00 0.00 177.40 178.49 2g5m s THR 41 N -2.43 0.00 -0.27 3.15 -1.32 -1.18 -4.97 115.64 108.63 2g5m s THR 41 Ca -0.32 -1.50 -0.04 0.00 -1.21 0.00 0.00 61.69 58.62 2g5m s THR 41 Cb 0.09 -2.29 0.15 0.00 -1.51 0.00 0.00 72.50 68.94 2g5m s THR 41 CO 0.57 0.00 0.52 0.54 -2.21 0.00 0.00 174.62 174.04 2g5m s VAL 42 N -3.94 -0.84 0.02 5.08 0.11 -1.26 -1.01 120.40 118.56 2g5m s VAL 42 Ca 0.25 0.01 0.04 0.00 -2.93 0.00 0.00 61.98 59.35 2g5m s VAL 42 Cb 0.00 -0.90 -0.03 0.00 -1.53 0.00 0.00 36.38 33.92 2g5m s VAL 42 CO 0.10 -0.02 -0.09 -0.89 -3.33 0.00 0.00 175.10 170.87 2g5m s THR 43 N 2.74 3.45 -2.00 5.04 2.01 0.14 -4.85 115.64 122.17 2g5m s THR 43 Ca 0.11 -0.89 0.10 0.00 0.31 0.00 0.00 61.69 61.32 2g5m s THR 43 Cb -0.14 -2.50 0.30 0.00 0.01 0.00 0.00 72.50 70.17 2g5m s THR 43 CO -0.18 0.36 1.10 -1.84 -0.69 0.00 0.00 174.62 173.37 2g5m n GLU 44 N 1.49 0.59 0.24 4.92 0.28 -1.26 -1.66 120.64 125.23 2g5m n GLU 44 Ca -0.15 0.00 0.15 0.00 -0.16 0.00 0.00 57.16 56.99 2g5m n GLU 44 Cb 0.52 -1.28 0.45 0.00 1.43 0.00 0.00 31.44 32.56 2g5m n GLU 44 CO 0.00 0.00 0.00 0.78 -0.16 0.00 0.00 177.13 177.75 2g5m h GLY 45 N 3.20 0.00 -1.96 -1.84 0.00 -1.95 -3.45 103.07 97.07 2g5m h GLY 45 Ca 0.00 0.00 -0.56 0.00 0.00 0.00 0.00 47.33 46.77 2g5m h GLY 45 CO 0.00 0.00 -0.49 -0.32 0.00 0.00 0.00 176.54 175.73 2g5m s GLY 46 N -4.13 2.28 0.39 4.60 0.00 -0.67 -4.07 107.32 105.72 2g5m s GLY 46 Ca 0.04 -2.06 0.21 0.00 0.00 0.00 0.00 44.72 42.90 2g5m s GLY 46 CO 0.59 -1.88 1.68 0.00 0.00 0.00 0.00 173.10 173.49 2g5m h ALA 47 N 1.40 0.90 -0.63 3.20 0.00 -1.76 -3.28 119.26 119.09 2g5m h ALA 47 Ca -0.43 -0.27 0.06 0.00 0.00 0.00 0.00 54.91 54.27 2g5m h ALA 47 Cb 1.25 -0.05 -0.06 0.00 0.00 0.00 0.00 17.79 18.94 2g5m h ALA 47 CO 0.68 0.37 0.33 0.00 0.00 0.00 0.00 179.25 180.64 2g5m h ALA 48 N 1.70 0.84 -0.13 0.00 0.00 -1.85 0.26 119.26 120.08 2g5m h ALA 48 Ca -0.00 0.03 -0.20 0.00 0.00 0.00 0.00 54.91 54.74 2g5m h ALA 48 Cb 0.99 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 18.70 2g5m h ALA 48 CO 0.04 -0.01 -0.69 1.25 0.00 0.00 0.00 179.25 179.84 2g5m h HIS 49 N 0.61 0.95 -0.11 0.00 6.17 -1.72 -1.68 115.15 119.38 2g5m h HIS 49 Ca 0.29 -0.42 -0.17 0.00 0.71 0.00 0.00 60.37 60.78 2g5m h HIS 49 Cb 0.20 -0.15 -0.01 0.00 2.52 0.00 0.00 27.41 29.98 2g5m h HIS 49 CO -0.09 1.24 -0.65 0.00 0.71 0.00 0.00 177.93 179.14 2g5m h ARG 50 N 0.39 0.41 -0.00 5.26 3.08 -1.54 -3.16 114.38 118.82 2g5m h ARG 50 Ca -0.05 -0.30 -0.00 0.00 0.07 0.00 0.00 59.98 59.70 2g5m h ARG 50 Cb 1.32 0.05 0.00 0.00 0.08 0.00 0.00 29.97 31.42 2g5m h ARG 50 CO 0.14 0.92 -0.00 0.22 -1.07 0.00 0.00 179.97 180.18 2g5m h ASP 51 N 0.30 0.00 0.00 7.04 3.58 -0.55 -3.48 116.42 123.31 2g5m h ASP 51 Ca -0.01 -0.62 0.00 0.00 0.42 0.00 0.00 57.03 56.82 2g5m h ASP 51 Cb 1.19 -0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.24 2g5m h ASP 51 CO 0.11 0.62 0.00 0.61 -2.88 0.00 0.00 179.24 177.70 2g5m n GLY 52 N 0.59 1.52 0.16 -0.78 0.00 -0.63 -5.01 105.19 101.03 2g5m n GLY 52 Ca -0.09 -0.16 -0.08 0.00 0.00 0.00 0.00 46.02 45.69 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 -1.29 0.48 -2.38 1.61 3.00 -1.23 -4.88 116.66 111.98 2g5m n ARG 53 Ca 0.00 0.19 -0.41 0.00 -0.01 0.00 0.00 57.85 57.62 2g5m n ARG 53 Cb 0.06 -1.35 -0.03 0.00 0.00 0.00 0.00 32.46 31.14 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 -2.82 3.59 0.04 0.55 1.01 -1.26 -4.99 121.20 117.32 2g5m s ILE 54 Ca -0.27 1.33 0.00 0.00 0.00 0.00 0.00 60.65 61.72 2g5m s ILE 54 Cb 0.04 -3.85 0.00 0.00 0.01 0.00 0.00 42.46 38.66 2g5m s ILE 54 CO 0.39 0.21 0.03 0.00 0.00 0.00 0.00 174.94 175.57 2g5m n GLN 55 N 2.57 1.45 -0.18 2.79 1.13 -1.26 -4.59 117.38 119.29 2g5m n GLN 55 Ca 0.05 -0.26 0.12 0.00 -1.94 0.00 0.00 57.00 54.96 2g5m n GLN 55 Cb 0.45 0.03 0.21 0.00 0.11 0.00 0.00 30.24 31.03 2g5m n GLN 55 CO 0.00 0.00 0.00 1.55 -1.44 0.00 0.00 177.06 177.17 2g5m n VAL 56 N -0.59 0.49 -0.76 5.09 3.14 -1.26 -4.44 118.33 119.99 2g5m n VAL 56 Ca -0.00 -0.74 0.00 0.00 -2.96 0.00 0.00 64.34 60.64 2g5m n VAL 56 Cb 0.05 1.01 0.00 0.00 -1.06 0.00 0.00 33.84 33.84 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 1.48 0.68 -3.00 6.55 2.85 -1.26 -4.60 115.26 117.96 2g5m n ASN 57 Ca 0.19 -1.44 -0.08 0.00 -0.11 0.00 0.00 54.58 53.14 2g5m n ASN 57 Cb 0.60 -0.03 0.04 0.00 1.24 0.00 0.00 39.78 41.64 2g5m n ASN 57 CO 0.00 0.00 0.00 -0.90 -2.11 0.00 0.00 177.26 174.25 2g5m n ASP 58 N -0.20 0.60 -3.70 1.20 5.75 -1.26 -4.75 116.55 114.19 2g5m n ASP 58 Ca 0.01 -1.48 -0.14 0.00 -0.01 0.00 0.00 54.79 53.17 2g5m n ASP 58 Cb 0.44 -0.22 -0.14 0.00 -1.03 0.00 0.00 41.12 40.17 2g5m n ASP 58 CO 0.00 0.00 0.00 -0.22 -0.11 0.00 0.00 177.20 176.87 2g5m s LEU 59 N 0.00 0.23 -0.80 -2.12 2.96 -1.26 -1.88 118.68 115.80 2g5m s LEU 59 Ca 0.24 0.43 -0.24 0.00 -0.22 0.00 0.00 54.13 54.34 2g5m s LEU 59 Cb -0.02 0.50 0.06 0.00 0.50 0.00 0.00 46.19 47.24 2g5m s LEU 59 CO 0.16 -0.20 1.20 -0.76 -1.32 0.00 0.00 176.35 175.43 2g5m s LEU 60 N 1.74 3.85 0.06 -0.68 1.43 -1.18 -3.01 118.68 120.90 2g5m s LEU 60 Ca -0.04 -1.04 -0.09 0.00 -1.03 0.00 0.00 54.13 51.92 2g5m s LEU 60 Cb -0.11 -2.50 -0.29 0.00 0.03 0.00 0.00 46.19 43.32 2g5m s LEU 60 CO -0.07 -1.55 1.11 0.58 0.23 0.00 0.00 176.35 176.65 2g5m h VAL 61 N 6.15 1.39 -2.61 -1.59 2.07 -1.56 -3.43 116.25 116.68 2g5m h VAL 61 Ca -0.12 -2.80 -0.06 0.00 0.82 0.00 0.00 66.70 64.53 2g5m h VAL 61 Cb 1.04 2.89 -0.17 0.00 -1.52 0.00 0.00 31.29 33.54 2g5m h VAL 61 CO 1.26 0.83 0.06 -1.83 0.02 0.00 0.00 177.57 177.92 2g5m s GLU 62 N -2.74 1.03 0.28 1.57 -1.05 -1.13 -1.28 118.70 115.37 2g5m s GLU 62 Ca -0.06 -0.12 0.05 0.00 -0.15 0.00 0.00 54.97 54.68 2g5m s GLU 62 Cb 0.06 0.47 0.05 0.00 -0.44 0.00 0.00 34.13 34.27 2g5m s GLU 62 CO 0.91 -0.36 0.37 1.55 0.95 0.00 0.00 175.26 178.68 2g5m n VAL 63 N 0.55 0.00 -0.29 1.83 3.14 -0.09 -0.97 118.33 122.49 2g5m n VAL 63 Ca -0.19 -0.93 0.06 0.00 -2.96 0.00 0.00 64.34 60.32 2g5m n VAL 63 Cb 0.59 -0.74 0.21 0.00 -1.06 0.00 0.00 33.84 32.84 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 0.06 0.58 0.00 6.55 3.58 -0.76 -3.37 116.42 123.06 2g5m h ASP 64 Ca -0.13 0.08 0.00 0.00 0.42 0.00 0.00 57.03 57.40 2g5m h ASP 64 Cb 0.60 -0.02 0.00 0.00 1.72 0.00 0.00 39.33 41.62 2g5m h ASP 64 CO 0.19 0.28 -0.25 0.61 -2.88 0.00 0.00 179.24 177.19 2g5m n GLY 65 N -1.32 -0.31 3.74 -0.78 0.00 -1.26 -4.94 105.19 100.31 2g5m n GLY 65 Ca 0.16 -0.08 -0.41 0.00 0.00 0.00 0.00 46.02 45.69 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 -1.60 3.70 -0.20 2.61 2.01 -1.26 -5.03 115.64 115.88 2g5m s THR 66 Ca -0.07 1.46 -0.14 0.00 0.31 0.00 0.00 61.69 63.25 2g5m s THR 66 Cb 0.01 -3.93 -0.04 0.00 0.01 0.00 0.00 72.50 68.54 2g5m s THR 66 CO 0.11 0.25 0.31 -0.44 -0.69 0.00 0.00 174.62 174.15 2g5m s SER 67 N -0.04 6.35 -0.00 3.53 0.01 -1.26 -0.91 113.70 121.38 2g5m s SER 67 Ca 0.51 0.41 -0.00 0.00 1.31 0.00 0.00 55.95 58.17 2g5m s SER 67 Cb -0.31 -2.19 -0.00 0.00 0.21 0.00 0.00 66.02 63.73 2g5m s SER 67 CO 0.36 0.01 -0.00 -0.07 0.41 0.00 0.00 173.24 173.95 2g5m h LEU 68 N 7.35 0.00 0.00 2.44 3.38 -1.53 -3.47 115.31 123.48 2g5m h LEU 68 Ca -0.38 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.59 2g5m h LEU 68 Cb 1.16 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.91 2g5m h LEU 68 CO 0.71 0.01 0.00 0.52 0.09 0.00 0.00 178.44 179.77 2g5m n VAL 69 N -2.12 0.00 0.00 1.22 0.31 -0.59 -4.20 118.33 112.95 2g5m n VAL 69 Ca -0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 2g5m n VAL 69 Cb 0.00 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 32.93 2g5m n VAL 69 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2g5m n GLY 70 N -0.47 -0.92 3.83 2.92 0.00 -1.25 -3.04 105.19 106.27 2g5m n GLY 70 Ca 0.00 0.50 -0.24 0.00 0.00 0.00 0.00 46.02 46.28 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 -2.12 1.61 0.24 -1.26 -4.49 118.33 112.31 2g5m n VAL 71 Ca 0.00 -2.10 -0.32 0.00 -2.04 0.00 0.00 64.34 59.88 2g5m n VAL 71 Cb 0.00 -0.18 -0.01 0.00 -1.47 0.00 0.00 33.84 32.19 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 -2.69 4.42 0.28 3.34 -4.23 -1.26 -4.78 115.64 110.72 2g5m s THR 72 Ca 0.40 1.02 -0.02 0.00 -1.18 0.00 0.00 61.69 61.91 2g5m s THR 72 Cb -0.03 -3.68 0.27 0.00 1.34 0.00 0.00 72.50 70.40 2g5m s THR 72 CO 0.26 -0.80 1.91 -0.61 -0.54 0.00 0.00 174.62 174.84 2g5m h GLN 73 N 0.35 1.15 -0.32 3.99 4.15 -1.97 -0.96 115.11 121.51 2g5m h GLN 73 Ca -0.46 -0.07 -0.09 0.00 0.77 0.00 0.00 58.65 58.80 2g5m h GLN 73 Cb 1.19 -0.26 -0.02 0.00 0.21 0.00 0.00 27.48 28.61 2g5m h GLN 73 CO 0.61 0.76 -0.19 0.77 -1.93 0.00 0.00 178.83 178.85 2g5m h SER 74 N 1.18 0.58 -0.04 -0.69 0.02 -1.98 -0.49 113.55 112.13 2g5m h SER 74 Ca 0.39 -0.18 -0.01 0.00 -0.84 0.00 0.00 61.79 61.15 2g5m h SER 74 Cb 0.05 -0.16 -0.00 0.00 0.14 0.00 0.00 62.40 62.43 2g5m h SER 74 CO -0.13 0.78 0.01 0.15 -1.14 0.00 0.00 176.83 176.50 2g5m h PHE 75 N 0.52 0.08 -0.94 3.45 3.04 -1.62 -1.39 116.94 120.07 2g5m h PHE 75 Ca 0.08 -0.01 0.02 0.00 3.98 0.00 0.00 57.97 62.04 2g5m h PHE 75 Cb 0.62 -0.02 -0.05 0.00 2.56 0.00 0.00 35.95 39.06 2g5m h PHE 75 CO 0.02 0.31 0.62 0.00 -2.02 0.00 0.00 178.31 177.25 2g5m h ALA 76 N 0.75 1.21 -0.23 2.41 0.00 -1.00 -0.07 119.26 122.33 2g5m h ALA 76 Ca 0.01 -0.06 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 2g5m h ALA 76 Cb 0.28 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 2g5m h ALA 76 CO 0.00 0.55 0.02 0.00 0.00 0.00 0.00 179.25 179.82 2g5m h ALA 77 N 1.36 1.62 0.00 0.00 0.00 -0.87 -2.11 119.26 119.26 2g5m h ALA 77 Ca 0.35 -0.12 -0.17 0.00 0.00 0.00 0.00 54.91 54.97 2g5m h ALA 77 Cb -0.09 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 2g5m h ALA 77 CO -0.09 0.29 -0.81 0.77 0.00 0.00 0.00 179.25 179.40 2g5m h SER 78 N 0.32 0.00 0.10 0.00 0.02 -0.06 -3.25 113.55 110.69 2g5m h SER 78 Ca 0.08 0.00 -0.18 0.00 -0.84 0.00 0.00 61.79 60.85 2g5m h SER 78 Cb 0.18 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.72 2g5m h SER 78 CO 0.00 0.81 -0.67 1.62 -1.14 0.00 0.00 176.83 177.46 2g5m h VAL 79 N 0.00 1.34 0.00 2.27 3.04 -0.39 -2.03 116.25 120.48 2g5m h VAL 79 Ca -0.01 -1.98 0.00 0.00 -1.01 0.00 0.00 66.70 63.70 2g5m h VAL 79 Cb 1.59 1.96 0.00 0.00 -2.01 0.00 0.00 31.29 32.83 2g5m h VAL 79 CO 0.11 0.61 0.00 0.18 -1.01 0.00 0.00 177.57 177.45 2g5m n LEU 80 N -3.90 0.00 -0.46 3.16 4.77 -1.05 -1.09 117.00 118.43 2g5m n LEU 80 Ca -0.04 0.36 0.07 0.00 -0.03 0.00 0.00 56.01 56.36 2g5m n LEU 80 Cb 0.67 -0.36 0.04 0.00 -2.33 0.00 0.00 43.42 41.45 2g5m n LEU 80 CO 0.48 -0.17 0.39 0.54 -1.33 0.00 0.00 177.39 177.30 2g5m n ARG 81 N -1.36 1.21 -0.06 3.23 1.74 -0.80 -4.33 116.66 116.29 2g5m n ARG 81 Ca 0.06 -1.11 0.03 0.00 -0.77 0.00 0.00 57.85 56.06 2g5m n ARG 81 Cb 0.14 -1.23 0.06 0.00 -1.02 0.00 0.00 32.46 30.41 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 0.46 2.14 -4.59 0.55 3.02 -0.25 -5.04 115.26 111.54 2g5m n ASN 82 Ca 0.07 -1.73 -0.26 0.00 -0.03 0.00 0.00 54.58 52.63 2g5m n ASN 82 Cb 0.32 -0.08 0.12 0.00 -0.61 0.00 0.00 39.78 39.53 2g5m n ASN 82 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 2g5m s THR 83 N -0.82 2.15 0.00 3.41 -4.23 -0.94 -5.07 115.64 110.14 2g5m s THR 83 Ca 0.10 -0.36 0.00 0.00 -1.18 0.00 0.00 61.69 60.25 2g5m s THR 83 Cb 0.06 -2.79 0.00 0.00 1.34 0.00 0.00 72.50 71.11 2g5m s THR 83 CO 0.08 0.00 0.00 0.29 -0.54 0.00 0.00 174.62 174.45 2g5m n LYS 84 N -3.09 -0.32 0.01 3.99 4.76 -1.26 -4.98 118.16 117.26 2g5m n LYS 84 Ca 0.13 0.00 -0.17 0.00 -2.87 0.00 0.00 58.31 55.41 2g5m n LYS 84 Cb 0.60 0.00 -0.06 0.00 -1.84 0.00 0.00 35.03 33.73 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 -0.20 0.77 -5.47 0.72 0.00 -1.99 -3.43 103.07 93.47 2g5m h GLY 85 Ca 0.00 -1.16 -0.60 0.00 0.00 0.00 0.00 47.33 45.57 2g5m h GLY 85 CO 0.00 1.03 -0.85 -1.60 0.00 0.00 0.00 176.54 175.12 2g5m s ARG 86 N -3.60 2.27 0.03 4.80 3.52 -1.26 -2.40 118.95 122.30 2g5m s ARG 86 Ca -0.09 -0.66 -0.03 0.00 -0.13 0.00 0.00 55.73 54.81 2g5m s ARG 86 Cb 0.08 -1.82 -0.02 0.00 -1.56 0.00 0.00 34.95 31.64 2g5m s ARG 86 CO 0.90 0.16 0.04 0.14 -0.81 0.00 0.00 175.30 175.73 2g5m s VAL 87 N 0.35 0.13 0.39 7.11 -7.23 0.27 -4.99 120.40 116.43 2g5m s VAL 87 Ca -0.13 -1.06 0.03 0.00 -1.81 0.00 0.00 61.98 59.01 2g5m s VAL 87 Cb -0.16 -0.68 -0.01 0.00 0.56 0.00 0.00 36.38 36.10 2g5m s VAL 87 CO 0.05 -0.58 0.57 -0.13 -0.31 0.00 0.00 175.10 174.70 2g5m s ARG 88 N -2.18 3.14 0.06 4.82 0.52 -1.26 -1.28 118.95 122.78 2g5m s ARG 88 Ca -0.09 -0.67 -0.07 0.00 -0.52 0.00 0.00 55.73 54.38 2g5m s ARG 88 Cb -0.04 -2.68 -0.01 0.00 0.52 0.00 0.00 34.95 32.74 2g5m s ARG 88 CO -0.03 -0.08 0.14 -0.06 0.02 0.00 0.00 175.30 175.29 2g5m s PHE 89 N -2.37 0.18 -0.22 -0.53 0.08 0.16 0.02 117.98 115.30 2g5m s PHE 89 Ca 0.46 -0.54 -0.04 0.00 0.12 0.00 0.00 56.93 56.93 2g5m s PHE 89 Cb -0.10 -0.11 -0.01 0.00 -0.57 0.00 0.00 43.02 42.24 2g5m s PHE 89 CO 0.35 -0.45 -0.05 -1.64 -0.10 0.00 0.00 175.22 173.33 2g5m s MET 90 N -3.21 3.36 -0.29 0.44 -1.94 -0.15 -0.10 119.30 117.41 2g5m s MET 90 Ca 0.00 -0.64 -0.13 0.00 -1.71 0.00 0.00 55.69 53.22 2g5m s MET 90 Cb 0.02 -2.98 -0.04 0.00 2.01 0.00 0.00 34.83 33.84 2g5m s MET 90 CO -0.07 -0.19 0.26 0.42 -0.01 0.00 0.00 175.02 175.42 2g5m s ILE 91 N 1.45 5.26 -0.76 2.53 1.09 0.80 -1.40 121.20 130.17 2g5m s ILE 91 Ca 0.06 0.22 -0.16 0.00 -1.10 0.00 0.00 60.65 59.67 2g5m s ILE 91 Cb -0.14 -3.62 0.17 0.00 -1.06 0.00 0.00 42.46 37.80 2g5m s ILE 91 CO -0.04 0.16 0.79 -0.83 -0.10 0.00 0.00 174.94 174.93 2g5m s GLY 92 N 1.72 2.27 -0.31 6.18 0.00 -1.16 -1.28 107.32 114.74 2g5m s GLY 92 Ca 0.09 -2.90 -0.28 0.00 0.00 0.00 0.00 44.72 41.64 2g5m s GLY 92 CO 0.11 1.46 2.12 -1.60 0.00 0.00 0.00 173.10 175.18 2g5m s ARG 93 N 1.34 2.99 -0.89 2.90 6.06 0.01 -4.53 118.95 126.82 2g5m s ARG 93 Ca 0.18 1.69 -0.25 0.00 -2.50 0.00 0.00 55.73 54.84 2g5m s ARG 93 Cb -0.14 -4.36 0.04 0.00 0.06 0.00 0.00 34.95 30.54 2g5m s ARG 93 CO -0.05 -2.27 1.41 -2.00 -2.50 0.00 0.00 175.30 169.90 2g5m s GLU 94 N 6.51 3.37 -0.16 5.12 -6.30 -1.26 -3.44 118.70 122.54 2g5m s GLU 94 Ca 0.93 -0.69 -0.14 0.00 -2.50 0.00 0.00 54.97 52.57 2g5m s GLU 94 Cb -0.26 -4.84 -0.10 0.00 0.00 0.00 0.00 34.13 28.92 2g5m s GLU 94 CO 0.32 -2.24 0.02 -0.09 0.02 0.00 0.00 175.26 173.30 2g5m h ARG 95 N 10.07 0.00 -5.69 4.30 2.43 -1.90 -3.46 114.38 120.14 2g5m h ARG 95 Ca -0.01 0.00 -0.63 0.00 -0.81 0.00 0.00 59.98 58.53 2g5m h ARG 95 Cb 1.03 0.00 -0.13 0.00 -0.42 0.00 0.00 29.97 30.45 2g5m h ARG 95 CO 1.36 0.41 0.36 -1.25 -1.51 0.00 0.00 179.97 179.33 2g5m s PRO 96 N -2.23 3.35 -0.00 0.20 0.04 -1.26 -4.72 135.00 130.37 2g5m s PRO 96 Ca -0.19 -0.24 0.07 0.00 0.04 0.00 0.00 61.00 60.67 2g5m s PRO 96 Cb 0.03 -3.98 -0.08 0.00 0.04 0.00 0.00 34.50 30.51 2g5m s PRO 96 CO 0.36 -1.21 0.28 0.41 0.04 0.00 0.00 177.00 176.88 2g5m n GLY 97 N 5.04 0.25 0.71 0.56 0.00 -1.26 -4.37 105.19 106.11 2g5m n GLY 97 Ca 0.01 -0.19 0.05 0.00 0.00 0.00 0.00 46.02 45.89 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 -1.25 1.93 -4.77 1.61 0.28 -1.26 -4.71 120.64 112.46 2g5m n GLU 98 Ca 0.01 -1.30 -0.25 0.00 -0.16 0.00 0.00 57.16 55.46 2g5m n GLU 98 Cb 0.12 -1.34 -0.16 0.00 1.43 0.00 0.00 31.44 31.49 2g5m n GLU 98 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 177.13 176.32 2g5m s GLN 99 N -1.56 1.68 0.92 3.44 -0.21 -1.26 -5.14 119.66 117.53 2g5m s GLN 99 Ca 0.24 -0.57 -0.15 0.00 0.02 0.00 0.00 55.36 54.90 2g5m s GLN 99 Cb 0.13 -1.47 0.17 0.00 1.00 0.00 0.00 33.01 32.84 2g5m s GLN 99 CO 0.15 0.22 1.27 -1.12 -2.12 0.00 0.00 175.29 173.70 2g5m s SER 100 N 0.07 3.46 -1.36 5.90 0.01 -1.26 -4.93 113.70 115.58 2g5m s SER 100 Ca -0.04 0.44 -0.11 0.00 1.31 0.00 0.00 55.95 57.55 2g5m s SER 100 Cb -0.11 -0.63 0.11 0.00 0.21 0.00 0.00 66.02 65.59 2g5m s SER 100 CO 0.02 -2.54 2.06 1.21 0.41 0.00 0.00 173.24 174.40 2g5m n GLU 101 N -3.67 3.33 -4.16 12.44 2.13 -1.26 -4.86 120.64 124.59 2g5m n GLU 101 Ca 0.13 -3.12 -0.19 0.00 0.66 0.00 0.00 57.16 54.65 2g5m n GLU 101 Cb 0.60 -3.07 -0.16 0.00 0.27 0.00 0.00 31.44 29.09 2g5m n GLU 101 CO 0.00 0.00 0.00 0.54 -0.41 0.00 0.00 177.13 177.26 2g5m s VAL 102 N 1.53 0.48 0.13 6.31 0.11 -1.26 -5.00 120.40 122.71 2g5m s VAL 102 Ca 0.43 -0.15 0.00 0.00 -2.93 0.00 0.00 61.98 59.34 2g5m s VAL 102 Cb 0.12 -0.48 0.00 0.00 -1.53 0.00 0.00 36.38 34.48 2g5m s VAL 102 CO -0.04 0.19 0.00 0.00 -3.33 0.00 0.00 175.10 171.92 2g5m n ALA 103 N 3.69 2.71 -3.58 1.54 0.00 -1.26 -5.11 120.51 118.50 2g5m n ALA 103 Ca -0.22 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.21 2g5m n ALA 103 Cb 0.53 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.94 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 -1.42 0.51 -0.09 0.00 2.00 -1.26 -5.16 119.66 114.24 2g5m s GLN 104 Ca 0.00 1.24 -0.01 0.00 -2.00 0.00 0.00 55.36 54.59 2g5m s GLN 104 Cb 0.00 0.71 -0.03 0.00 0.80 0.00 0.00 33.01 34.49 2g5m s GLN 104 CO 0.00 -0.17 -0.05 -0.51 -0.50 0.00 0.00 175.29 174.07 2g5m s LEU 105 N 2.68 3.28 -0.10 3.68 2.01 -1.26 -5.01 118.68 123.96 2g5m s LEU 105 Ca -0.05 -0.00 -0.12 0.00 0.01 0.00 0.00 54.13 53.96 2g5m s LEU 105 Cb -0.10 -1.74 -0.10 0.00 0.01 0.00 0.00 46.19 44.26 2g5m s LEU 105 CO -0.19 0.33 0.38 0.40 1.01 0.00 0.00 176.35 178.29 2g5m h ILE 106 N 4.39 0.63 -2.55 -0.59 1.08 -2.01 -3.41 117.51 115.05 2g5m h ILE 106 Ca -0.46 -1.37 -0.57 0.00 -0.39 0.00 0.00 64.86 62.06 2g5m h ILE 106 Cb 1.18 1.16 -0.02 0.00 -3.07 0.00 0.00 36.82 36.07 2g5m h ILE 106 CO 0.55 0.20 1.31 -1.10 -0.69 0.00 0.00 178.15 178.42 2g5m s GLN 107 N -2.12 3.27 0.00 2.37 -0.21 -1.26 -2.56 119.66 119.15 2g5m s GLN 107 Ca -0.08 1.46 0.00 0.00 0.02 0.00 0.00 55.36 56.77 2g5m s GLN 107 Cb -0.01 -4.23 0.00 0.00 1.00 0.00 0.00 33.01 29.77 2g5m s GLN 107 CO 0.28 -1.93 0.00 0.94 -2.12 0.00 0.00 175.29 172.45 2g5m n GLN 108 N 8.50 0.00 0.07 2.91 -0.06 -0.53 -4.93 117.38 123.33 2g5m n GLN 108 Ca 0.24 0.00 0.09 0.00 -2.00 0.00 0.00 57.00 55.33 2g5m n GLN 108 Cb 0.47 0.00 0.40 0.00 -4.06 0.00 0.00 30.24 27.05 2g5m n GLN 108 CO 0.00 0.00 0.00 -2.37 -0.20 0.00 0.00 177.06 174.49 2g5m n THR 109 N 0.00 0.94 -2.35 1.69 5.66 -1.06 -4.89 114.28 114.27 2g5m n THR 109 Ca 0.00 0.26 -0.07 0.00 -3.05 0.00 0.00 64.05 61.19 2g5m n THR 109 Cb 0.00 -1.11 0.01 0.00 -1.55 0.00 0.00 70.33 67.68 2g5m n THR 109 CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 175.07 172.20 2g5m n LEU 110 N -1.89 -1.65 0.05 1.09 4.77 -0.33 -4.90 117.00 114.14 2g5m n LEU 110 Ca 0.03 -0.06 0.13 0.00 -0.03 0.00 0.00 56.01 56.08 2g5m n LEU 110 Cb 0.19 -1.28 0.51 0.00 -2.33 0.00 0.00 43.42 40.51 2g5m n LEU 110 CO 0.16 0.02 0.90 -0.62 -1.33 0.00 0.00 177.39 176.52 2g5m n GLU 111 N -1.72 0.12 0.00 3.23 -0.58 -1.26 -4.56 120.64 115.87 2g5m n GLU 111 Ca -0.05 0.10 0.00 0.00 -0.42 0.00 0.00 57.16 56.78 2g5m n GLU 111 Cb 0.55 -1.64 0.00 0.00 -0.57 0.00 0.00 31.44 29.78 2g5m n GLU 111 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2g5m n GLN 112 N -1.85 0.00 0.00 3.49 10.64 -1.26 -5.19 117.38 123.21 2g5m n GLN 112 Ca 0.06 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.23 2g5m n GLN 112 Cb 0.38 0.00 0.00 0.00 -0.86 0.00 0.00 30.24 29.76 2g5m n GLN 112 CO 0.00 0.00 0.00 0.39 -1.83 0.00 0.00 177.06 175.62