#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gb2 n LYS 2 N 0.00 1.64 -3.86 -1.24 5.02 0.60 -4.85 118.16 115.47 2gb2 n LYS 2 Ca 0.00 -0.96 -0.11 0.00 -2.02 0.00 0.00 58.31 55.22 2gb2 n LYS 2 Cb 0.00 -1.48 -0.10 0.00 -0.02 0.00 0.00 35.03 33.43 2gb2 n LYS 2 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2gb2 s ALA 3 N -2.02 -0.34 0.27 7.82 0.00 -1.25 -0.80 121.76 125.45 2gb2 s ALA 3 Ca 0.37 0.00 0.08 0.00 0.00 0.00 0.00 51.96 52.42 2gb2 s ALA 3 Cb 0.21 0.02 -0.04 0.00 0.00 0.00 0.00 23.12 23.31 2gb2 s ALA 3 CO 0.34 -0.18 0.09 0.95 0.00 0.00 0.00 175.76 176.97 2gb2 s THR 4 N -1.03 3.76 -0.38 0.00 -4.23 0.28 -4.92 115.64 109.12 2gb2 s THR 4 Ca -0.11 -1.70 -0.03 0.00 -1.18 0.00 0.00 61.69 58.67 2gb2 s THR 4 Cb -0.06 -3.06 0.09 0.00 1.34 0.00 0.00 72.50 70.80 2gb2 s THR 4 CO 0.01 -0.34 0.15 -0.63 -0.54 0.00 0.00 174.62 173.27 2gb2 s ILE 5 N -2.27 3.26 0.21 2.99 1.01 -1.26 -0.64 121.20 124.51 2gb2 s ILE 5 Ca 0.33 -1.82 -0.10 0.00 0.00 0.00 0.00 60.65 59.07 2gb2 s ILE 5 Cb -0.06 -3.12 0.16 0.00 0.01 0.00 0.00 42.46 39.45 2gb2 s ILE 5 CO 0.22 -0.51 1.88 -0.65 0.00 0.00 0.00 174.94 175.88 2gb2 h PRO 6 N 8.05 0.98 -3.64 2.79 0.11 -1.96 -3.41 132.00 134.91 2gb2 h PRO 6 Ca -0.16 -0.06 -0.43 0.00 0.11 0.00 0.00 66.00 65.47 2gb2 h PRO 6 Cb 1.05 -0.22 -0.38 0.00 0.11 0.00 0.00 31.00 31.56 2gb2 h PRO 6 CO 0.65 0.65 -0.76 0.45 -0.21 0.00 0.00 178.00 178.77 2gb2 s SER 7 N -5.86 1.54 0.53 -2.05 0.15 -1.26 -5.01 113.70 101.73 2gb2 s SER 7 Ca -0.13 -0.07 0.31 0.00 0.70 0.00 0.00 55.95 56.76 2gb2 s SER 7 Cb 0.15 -0.40 1.31 0.00 -1.71 0.00 0.00 66.02 65.37 2gb2 s SER 7 CO 0.78 -0.20 1.97 -0.33 1.20 0.00 0.00 173.24 176.65 2gb2 h GLU 8 N 8.34 0.00 -6.52 5.44 5.08 -1.96 -3.44 114.58 121.53 2gb2 h GLU 8 Ca -0.18 0.00 -0.53 0.00 -1.00 0.00 0.00 59.36 57.65 2gb2 h GLU 8 Cb 1.12 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.34 2gb2 h GLU 8 CO 0.25 0.06 0.08 0.45 -1.00 0.00 0.00 179.01 178.85 2gb2 s SER 9 N -5.82 7.06 0.99 1.42 0.15 -1.26 -4.59 113.70 111.65 2gb2 s SER 9 Ca 0.01 1.39 -0.12 0.00 0.70 0.00 0.00 55.95 57.93 2gb2 s SER 9 Cb 0.10 -2.41 0.18 0.00 -1.71 0.00 0.00 66.02 62.18 2gb2 s SER 9 CO 0.56 0.07 1.08 -2.84 1.20 0.00 0.00 173.24 173.32 2gb2 s PRO 10 N -1.85 0.49 0.25 5.44 0.02 -1.26 -4.92 135.00 133.18 2gb2 s PRO 10 Ca 0.41 0.82 -0.02 0.00 0.02 0.00 0.00 61.00 62.22 2gb2 s PRO 10 Cb -0.17 -1.72 -0.03 0.00 0.02 0.00 0.00 34.50 32.60 2gb2 s PRO 10 CO 0.21 -2.76 0.27 -0.59 -0.33 0.00 0.00 177.00 173.80 2gb2 s PHE 11 N -2.80 1.08 0.33 6.54 -0.71 -0.53 -4.91 117.98 116.98 2gb2 s PHE 11 Ca 0.65 -1.28 -0.28 0.00 -1.04 0.00 0.00 56.93 54.99 2gb2 s PHE 11 Cb -0.20 -0.37 -0.10 0.00 -1.21 0.00 0.00 43.02 41.15 2gb2 s PHE 11 CO 0.59 -0.82 1.21 0.00 -1.34 0.00 0.00 175.22 174.87 2gb2 s ALA 12 N -3.87 3.38 0.37 1.99 0.00 -1.26 -0.15 121.76 122.22 2gb2 s ALA 12 Ca 0.35 1.08 0.17 0.00 0.00 0.00 0.00 51.96 53.57 2gb2 s ALA 12 Cb 0.04 -3.41 1.10 0.00 0.00 0.00 0.00 23.12 20.85 2gb2 s ALA 12 CO 0.15 -0.48 1.71 0.00 0.00 0.00 0.00 175.76 177.15 2gb2 h ALA 13 N 3.31 2.16 0.00 0.00 0.00 -1.05 0.59 119.26 124.27 2gb2 h ALA 13 Ca -0.48 0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.54 2gb2 h ALA 13 Cb 1.22 0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.10 2gb2 h ALA 13 CO 0.65 -0.66 0.00 0.00 0.00 0.00 0.00 179.25 179.24 2gb2 h ALA 14 N 1.69 1.00 -0.22 0.00 0.00 -1.91 -2.11 119.26 117.71 2gb2 h ALA 14 Ca 0.67 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.58 2gb2 h ALA 14 Cb 1.65 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.44 2gb2 h ALA 14 CO -0.42 0.00 0.00 0.39 0.00 0.00 0.00 179.25 179.22 2gb2 n GLU 15 N -2.47 1.94 -1.70 0.00 1.02 0.20 -4.94 120.64 114.69 2gb2 n GLU 15 Ca 0.01 -1.42 -0.42 0.00 -0.02 0.00 0.00 57.16 55.31 2gb2 n GLU 15 Cb 0.20 -1.42 0.00 0.00 -0.02 0.00 0.00 31.44 30.20 2gb2 n GLU 15 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 2gb2 n VAL 16 N 0.65 2.24 -2.50 2.62 0.31 -0.80 -4.94 118.33 115.91 2gb2 n VAL 16 Ca 0.17 -0.50 -0.38 0.00 -0.01 0.00 0.00 64.34 63.62 2gb2 n VAL 16 Cb 0.41 -1.58 -0.04 0.00 -0.91 0.00 0.00 33.84 31.72 2gb2 n VAL 16 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2gb2 s ALA 17 N -1.14 3.20 0.34 3.52 0.00 -1.26 -5.01 121.76 121.41 2gb2 s ALA 17 Ca 0.58 0.79 -0.29 0.00 0.00 0.00 0.00 51.96 53.04 2gb2 s ALA 17 Cb -0.54 -3.30 -0.12 0.00 0.00 0.00 0.00 23.12 19.16 2gb2 s ALA 17 CO 0.60 -0.22 1.41 -0.25 0.00 0.00 0.00 175.76 177.30 2gb2 n ASP 18 N 0.40 3.25 0.00 0.00 8.00 -1.26 -2.11 116.55 124.82 2gb2 n ASP 18 Ca 0.03 1.20 0.00 0.00 0.71 0.00 0.00 54.79 56.73 2gb2 n ASP 18 Cb 0.48 -1.54 0.00 0.00 -0.02 0.00 0.00 41.12 40.04 2gb2 n ASP 18 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2gb2 n GLY 19 N 0.98 2.40 3.77 0.44 0.00 -1.26 -5.02 105.19 106.50 2gb2 n GLY 19 Ca 0.05 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.69 2gb2 n GLY 19 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2gb2 s ALA 20 N -2.25 2.91 -0.45 4.61 0.00 -0.90 -4.76 121.76 120.93 2gb2 s ALA 20 Ca 0.00 1.03 -0.19 0.00 0.00 0.00 0.00 51.96 52.80 2gb2 s ALA 20 Cb 0.00 -3.43 0.03 0.00 0.00 0.00 0.00 23.12 19.73 2gb2 s ALA 20 CO 0.00 -0.85 0.55 0.42 0.00 0.00 0.00 175.76 175.88 2gb2 s ILE 21 N -1.50 4.96 -0.08 0.00 -1.09 0.60 -4.91 121.20 119.19 2gb2 s ILE 21 Ca 0.66 -0.29 -0.20 0.00 -2.23 0.00 0.00 60.65 58.59 2gb2 s ILE 21 Cb -0.31 -4.16 -0.04 0.00 -1.58 0.00 0.00 42.46 36.36 2gb2 s ILE 21 CO 0.37 -0.59 0.57 -0.69 -1.23 0.00 0.00 174.94 173.38 2gb2 s VAL 22 N 2.45 5.09 -0.24 2.92 1.01 -1.26 -1.19 120.40 129.18 2gb2 s VAL 22 Ca 0.16 1.17 -0.04 0.00 0.00 0.00 0.00 61.98 63.26 2gb2 s VAL 22 Cb -0.17 -3.91 -0.00 0.00 0.00 0.00 0.00 36.38 32.30 2gb2 s VAL 22 CO 0.14 0.32 -0.02 -0.69 0.00 0.00 0.00 175.10 174.86 2gb2 s VAL 23 N 0.49 3.44 0.28 2.92 1.01 -0.05 -4.96 120.40 123.54 2gb2 s VAL 23 Ca 0.31 -0.58 -0.22 0.00 0.00 0.00 0.00 61.98 61.49 2gb2 s VAL 23 Cb -0.17 -2.62 -0.09 0.00 0.00 0.00 0.00 36.38 33.50 2gb2 s VAL 23 CO 0.14 0.34 0.82 -1.81 0.00 0.00 0.00 175.10 174.59 2gb2 s ASP 24 N 1.47 7.12 -0.25 3.32 1.01 -1.26 -1.02 116.67 127.06 2gb2 s ASP 24 Ca 0.05 1.58 -0.04 0.00 0.71 0.00 0.00 52.55 54.85 2gb2 s ASP 24 Cb -0.15 -2.48 0.01 0.00 1.01 0.00 0.00 42.92 41.31 2gb2 s ASP 24 CO -0.02 -0.06 -0.02 -0.63 0.21 0.00 0.00 175.17 174.65 2gb2 s ILE 25 N -1.65 3.34 -0.01 0.77 1.01 0.18 -0.49 121.20 124.35 2gb2 s ILE 25 Ca 0.48 -0.73 -0.25 0.00 0.00 0.00 0.00 60.65 60.15 2gb2 s ILE 25 Cb -0.16 -2.63 0.06 0.00 0.01 0.00 0.00 42.46 39.73 2gb2 s ILE 25 CO 0.21 0.26 0.56 0.00 0.00 0.00 0.00 174.94 175.96 2gb2 s ALA 26 N 1.43 -1.44 -1.46 9.38 0.00 -0.78 -0.63 121.76 128.27 2gb2 s ALA 26 Ca 0.03 0.90 -0.10 0.00 0.00 0.00 0.00 51.96 52.79 2gb2 s ALA 26 Cb -0.16 0.13 0.04 0.00 0.00 0.00 0.00 23.12 23.14 2gb2 s ALA 26 CO -0.02 -0.39 0.94 1.63 0.00 0.00 0.00 175.76 177.92 2gb2 n LYS 27 N 0.83 -6.09 -3.10 0.00 5.02 -1.26 -2.16 118.16 111.41 2gb2 n LYS 27 Ca -0.19 0.72 -0.22 0.00 -2.02 0.00 0.00 58.31 56.60 2gb2 n LYS 27 Cb 0.58 -5.65 0.02 0.00 -0.02 0.00 0.00 35.03 29.95 2gb2 n LYS 27 CO 0.00 0.00 0.00 -1.33 -0.52 0.00 0.00 177.40 175.55 2gb2 n MET 28 N -4.60 -4.19 -3.88 1.97 2.81 -1.26 -4.97 117.12 102.99 2gb2 n MET 28 Ca -0.00 0.75 -0.11 0.00 -1.81 0.00 0.00 57.70 56.53 2gb2 n MET 28 Cb 0.56 -5.54 -0.10 0.00 -0.71 0.00 0.00 33.22 27.43 2gb2 n MET 28 CO 0.00 0.00 0.00 0.15 1.51 0.00 0.00 175.97 177.63 2gb2 s LYS 29 N -5.77 0.50 -0.21 0.03 1.02 -0.92 -4.82 119.74 109.58 2gb2 s LYS 29 Ca 0.32 -0.46 -0.29 0.00 0.02 0.00 0.00 55.97 55.56 2gb2 s LYS 29 Cb -0.15 0.21 -0.01 0.00 -0.52 0.00 0.00 37.83 37.36 2gb2 s LYS 29 CO 0.39 -0.12 1.24 0.71 -0.92 0.00 0.00 175.35 176.65 2gb2 s TYR 30 N -1.58 2.86 0.04 3.18 2.02 -1.26 -1.86 117.35 120.75 2gb2 s TYR 30 Ca -0.13 1.03 0.33 0.00 -0.37 0.00 0.00 57.07 57.92 2gb2 s TYR 30 Cb -0.07 -3.59 1.33 0.00 -0.40 0.00 0.00 41.96 39.23 2gb2 s TYR 30 CO 0.01 -1.55 1.96 0.93 -1.57 0.00 0.00 175.55 175.33 2gb2 h GLU 31 N 8.41 0.00 -3.22 -0.62 5.08 -1.09 -3.17 114.58 119.97 2gb2 h GLU 31 Ca -0.25 0.00 -0.63 0.00 -1.00 0.00 0.00 59.36 57.47 2gb2 h GLU 31 Cb 1.10 0.00 -0.41 0.00 0.50 0.00 0.00 28.75 29.93 2gb2 h GLU 31 CO 0.99 0.00 -0.57 0.99 -1.00 0.00 0.00 179.01 179.42 2gb2 s THR 32 N -3.63 2.87 -0.54 1.13 2.01 -1.26 -4.97 115.64 111.24 2gb2 s THR 32 Ca 0.01 -3.87 0.25 0.00 0.31 0.00 0.00 61.69 58.40 2gb2 s THR 32 Cb 0.09 -2.92 0.27 0.00 0.01 0.00 0.00 72.50 69.95 2gb2 s THR 32 CO 0.53 -0.93 1.74 -0.81 -0.69 0.00 0.00 174.62 174.47 2gb2 n PRO 33 N 2.46 0.23 -3.81 4.92 -0.04 -1.20 -4.30 135.00 133.26 2gb2 n PRO 33 Ca 0.14 0.36 -0.30 0.00 -0.04 0.00 0.00 63.50 63.66 2gb2 n PRO 33 Cb 0.34 -1.87 -0.15 0.00 -0.04 0.00 0.00 33.50 31.78 2gb2 n PRO 33 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 2gb2 s GLU 34 N -3.25 0.98 -0.11 0.54 2.12 -1.26 -0.74 118.70 116.98 2gb2 s GLU 34 Ca 0.06 -1.06 -0.01 0.00 0.36 0.00 0.00 54.97 54.32 2gb2 s GLU 34 Cb 0.10 -2.29 -0.03 0.00 0.26 0.00 0.00 34.13 32.18 2gb2 s GLU 34 CO 0.47 -0.85 -0.07 -1.17 -0.54 0.00 0.00 175.26 173.10 2gb2 s LEU 35 N 1.52 3.08 -0.21 2.70 2.96 -0.57 -5.00 118.68 123.16 2gb2 s LEU 35 Ca 0.05 -0.14 -0.06 0.00 -0.22 0.00 0.00 54.13 53.76 2gb2 s LEU 35 Cb -0.18 -1.70 -0.03 0.00 0.50 0.00 0.00 46.19 44.78 2gb2 s LEU 35 CO -0.17 0.24 0.03 -1.00 -1.32 0.00 0.00 176.35 174.14 2gb2 s HIS 36 N -0.09 3.09 0.27 5.38 3.76 -1.26 -0.49 115.29 125.95 2gb2 s HIS 36 Ca 0.01 -0.35 0.02 0.00 -0.15 0.00 0.00 55.06 54.59 2gb2 s HIS 36 Cb -0.13 -2.13 -0.05 0.00 1.11 0.00 0.00 32.58 31.38 2gb2 s HIS 36 CO 0.03 -0.20 0.11 0.14 -0.85 0.00 0.00 174.74 173.97 2gb2 s VAL 37 N 1.07 0.50 0.18 -0.90 -7.23 -0.11 -4.98 120.40 108.94 2gb2 s VAL 37 Ca 0.03 -2.00 0.02 0.00 -1.81 0.00 0.00 61.98 58.22 2gb2 s VAL 37 Cb -0.14 -2.60 -0.04 0.00 0.56 0.00 0.00 36.38 34.16 2gb2 s VAL 37 CO 0.02 0.00 0.33 -0.54 -0.31 0.00 0.00 175.10 174.61 2gb2 s LYS 38 N -3.98 3.46 0.23 4.82 1.02 -1.26 -0.92 119.74 123.11 2gb2 s LYS 38 Ca 0.37 -0.54 -0.32 0.00 0.02 0.00 0.00 55.97 55.50 2gb2 s LYS 38 Cb 0.07 -2.91 -0.13 0.00 -0.52 0.00 0.00 37.83 34.34 2gb2 s LYS 38 CO 0.14 0.46 1.51 0.28 -0.92 0.00 0.00 175.35 176.82 2gb2 n VAL 39 N -0.75 0.67 0.00 3.17 0.31 -1.26 -1.65 118.33 118.83 2gb2 n VAL 39 Ca -0.07 -0.17 0.00 0.00 -0.01 0.00 0.00 64.34 64.10 2gb2 n VAL 39 Cb 0.54 -1.62 0.00 0.00 -0.91 0.00 0.00 33.84 31.86 2gb2 n VAL 39 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2gb2 n GLY 40 N 2.57 1.52 3.79 2.92 0.00 0.79 -5.02 105.19 111.76 2gb2 n GLY 40 Ca 0.13 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.79 2gb2 n GLY 40 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2gb2 s ASP 41 N -1.66 6.67 -0.27 1.61 1.01 -0.66 -4.74 116.67 118.63 2gb2 s ASP 41 Ca 0.00 1.99 -0.12 0.00 0.71 0.00 0.00 52.55 55.13 2gb2 s ASP 41 Cb 0.00 -2.58 -0.05 0.00 1.01 0.00 0.00 42.92 41.31 2gb2 s ASP 41 CO 0.00 -0.55 0.23 -0.89 0.21 0.00 0.00 175.17 174.17 2gb2 s THR 42 N -1.76 5.28 -0.15 -1.27 2.01 -1.26 -1.17 115.64 117.33 2gb2 s THR 42 Ca 0.60 0.28 -0.09 0.00 0.31 0.00 0.00 61.69 62.80 2gb2 s THR 42 Cb -0.20 -3.57 -0.04 0.00 0.01 0.00 0.00 72.50 68.70 2gb2 s THR 42 CO 0.25 0.25 0.14 -0.69 -0.69 0.00 0.00 174.62 173.88 2gb2 s VAL 43 N 1.69 5.46 -0.12 3.82 1.01 0.37 -0.29 120.40 132.34 2gb2 s VAL 43 Ca 0.09 0.22 0.01 0.00 0.00 0.00 0.00 61.98 62.30 2gb2 s VAL 43 Cb -0.15 -3.44 0.02 0.00 0.00 0.00 0.00 36.38 32.81 2gb2 s VAL 43 CO 0.10 0.54 -0.14 -0.89 0.00 0.00 0.00 175.10 174.71 2gb2 s THR 44 N -0.41 1.45 -0.04 3.92 2.01 -0.33 -1.16 115.64 121.08 2gb2 s THR 44 Ca 0.12 -0.59 -0.20 0.00 0.31 0.00 0.00 61.69 61.34 2gb2 s THR 44 Cb -0.12 -1.35 -0.05 0.00 0.01 0.00 0.00 72.50 70.99 2gb2 s THR 44 CO 0.02 0.43 0.56 0.26 -0.69 0.00 0.00 174.62 175.20 2gb2 s TRP 45 N 1.24 3.64 -0.14 4.92 0.51 -0.04 -0.87 118.94 128.19 2gb2 s TRP 45 Ca -0.01 1.12 0.00 0.00 -2.12 0.00 0.00 56.10 55.09 2gb2 s TRP 45 Cb -0.14 -2.59 0.02 0.00 -0.81 0.00 0.00 33.47 29.95 2gb2 s TRP 45 CO -0.05 0.31 -0.14 0.42 -0.51 0.00 0.00 176.95 176.97 2gb2 s ILE 46 N 0.02 1.56 -0.20 2.03 1.01 -0.19 -1.42 121.20 124.01 2gb2 s ILE 46 Ca 0.30 -0.63 -0.29 0.00 0.00 0.00 0.00 60.65 60.03 2gb2 s ILE 46 Cb -0.17 -1.46 0.01 0.00 0.01 0.00 0.00 42.46 40.84 2gb2 s ILE 46 CO 0.15 0.46 1.04 0.21 0.00 0.00 0.00 174.94 176.80 2gb2 s ASN 47 N 1.43 7.13 0.00 3.58 2.47 0.05 -0.64 114.94 128.95 2gb2 s ASN 47 Ca 0.04 1.42 0.18 0.00 0.42 0.00 0.00 52.86 54.91 2gb2 s ASN 47 Cb -0.13 -2.54 0.33 0.00 -1.45 0.00 0.00 41.25 37.46 2gb2 s ASN 47 CO -0.10 -0.62 1.25 0.54 -3.72 0.00 0.00 177.10 174.45 2gb2 n ARG 48 N 6.05 2.19 -4.41 0.43 5.12 0.20 0.14 116.66 126.38 2gb2 n ARG 48 Ca 0.11 -2.01 -0.24 0.00 -1.93 0.00 0.00 57.85 53.78 2gb2 n ARG 48 Cb 0.47 -1.39 -0.09 0.00 -1.16 0.00 0.00 32.46 30.28 2gb2 n ARG 48 CO 0.00 0.00 0.00 -1.21 -1.93 0.00 0.00 177.63 174.49 2gb2 s GLU 49 N -1.24 1.92 0.21 5.56 2.02 -1.25 -4.83 118.70 121.09 2gb2 s GLU 49 Ca 0.30 -1.68 -0.09 0.00 0.02 0.00 0.00 54.97 53.52 2gb2 s GLU 49 Cb 0.17 -1.90 0.25 0.00 0.10 0.00 0.00 34.13 32.76 2gb2 s GLU 49 CO 0.24 0.30 1.79 0.00 0.02 0.00 0.00 175.26 177.61 2gb2 h ALA 50 N 2.08 0.86 -2.69 5.21 0.00 -1.96 -3.30 119.26 119.46 2gb2 h ALA 50 Ca -0.42 0.04 -0.52 0.00 0.00 0.00 0.00 54.91 54.01 2gb2 h ALA 50 Cb 1.26 -0.07 0.03 0.00 0.00 0.00 0.00 17.79 19.00 2gb2 h ALA 50 CO 0.62 -0.03 0.60 1.41 0.00 0.00 0.00 179.25 181.85 2gb2 s MET 51 N -6.09 4.44 0.41 0.00 0.00 -1.26 -4.49 119.30 112.31 2gb2 s MET 51 Ca -0.13 1.98 -0.26 0.00 0.00 0.00 0.00 55.69 57.29 2gb2 s MET 51 Cb 0.16 -3.20 -0.08 0.00 0.00 0.00 0.00 34.83 31.70 2gb2 s MET 51 CO 0.75 -0.16 1.27 0.20 0.00 0.00 0.00 175.02 177.08 2gb2 s GLY 52 N 0.14 2.91 0.04 2.11 0.00 -1.26 -4.81 107.32 106.45 2gb2 s GLY 52 Ca 0.54 1.16 -0.04 0.00 0.00 0.00 0.00 44.72 46.38 2gb2 s GLY 52 CO 0.39 1.72 0.07 0.30 0.00 0.00 0.00 173.10 175.58 2gb2 s HIS 53 N -1.31 0.25 0.02 1.90 4.02 -1.15 -4.94 115.29 114.09 2gb2 s HIS 53 Ca 0.58 -0.60 0.00 0.00 1.02 0.00 0.00 55.06 56.06 2gb2 s HIS 53 Cb -0.36 -0.18 -0.00 0.00 -1.02 0.00 0.00 32.58 31.02 2gb2 s HIS 53 CO 0.46 -0.36 0.01 0.27 1.02 0.00 0.00 174.74 176.14 2gb2 n ASN 54 N 0.70 0.33 -4.23 1.40 6.94 -1.26 -0.59 115.26 118.54 2gb2 n ASN 54 Ca -0.18 -1.12 -0.29 0.00 -0.02 0.00 0.00 54.58 52.97 2gb2 n ASN 54 Cb 0.59 0.08 -0.16 0.00 -2.36 0.00 0.00 39.78 37.92 2gb2 n ASN 54 CO 0.00 0.00 0.00 0.68 -1.03 0.00 0.00 177.26 176.91 2gb2 s VAL 55 N -1.90 1.77 -0.06 3.53 -7.23 -1.26 -4.34 120.40 110.90 2gb2 s VAL 55 Ca 0.02 -0.93 -0.02 0.00 -1.81 0.00 0.00 61.98 59.23 2gb2 s VAL 55 Cb 0.00 -1.49 0.03 0.00 0.56 0.00 0.00 36.38 35.48 2gb2 s VAL 55 CO 0.01 0.50 0.06 -2.28 -0.31 0.00 0.00 175.10 173.08 2gb2 s HIS 56 N -0.29 0.15 -0.18 2.82 5.04 0.25 -0.48 115.29 122.61 2gb2 s HIS 56 Ca 0.02 0.12 -0.03 0.00 -1.54 0.00 0.00 55.06 53.63 2gb2 s HIS 56 Cb -0.11 -0.55 -0.02 0.00 0.04 0.00 0.00 32.58 31.95 2gb2 s HIS 56 CO 0.01 -0.26 -0.06 -0.06 -2.34 0.00 0.00 174.74 172.03 2gb2 s PHE 57 N 2.14 2.94 0.93 3.88 0.40 0.08 -1.26 117.98 127.08 2gb2 s PHE 57 Ca 0.04 -0.66 -0.12 0.00 -0.60 0.00 0.00 56.93 55.59 2gb2 s PHE 57 Cb -0.13 -1.99 0.15 0.00 0.51 0.00 0.00 43.02 41.56 2gb2 s PHE 57 CO -0.04 -0.31 1.12 0.14 0.70 0.00 0.00 175.22 176.83 2gb2 s VAL 58 N 0.85 2.16 0.43 -0.44 -7.23 -1.26 -0.79 120.40 114.12 2gb2 s VAL 58 Ca -0.02 0.05 -0.25 0.00 -1.81 0.00 0.00 61.98 59.96 2gb2 s VAL 58 Cb -0.15 -2.71 -0.10 0.00 0.56 0.00 0.00 36.38 33.98 2gb2 s VAL 58 CO 0.01 -0.07 1.17 0.00 -0.31 0.00 0.00 175.10 175.91 2gb2 n ALA 59 N -3.86 0.88 -0.32 1.32 0.00 -1.26 -2.17 120.51 115.09 2gb2 n ALA 59 Ca 0.06 0.24 0.00 0.00 0.00 0.00 0.00 53.44 53.74 2gb2 n ALA 59 Cb 0.58 -2.20 0.00 0.00 0.00 0.00 0.00 19.45 17.83 2gb2 n ALA 59 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2gb2 n GLY 60 N 0.95 1.54 0.07 0.00 0.00 -0.27 -4.87 105.19 102.61 2gb2 n GLY 60 Ca 0.08 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.05 2gb2 n GLY 60 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2gb2 n VAL 61 N -2.00 1.37 1.34 1.61 0.31 -0.92 -4.47 118.33 115.57 2gb2 n VAL 61 Ca 0.00 0.22 0.13 0.00 -0.01 0.00 0.00 64.34 64.68 2gb2 n VAL 61 Cb 0.00 -2.35 0.41 0.00 -0.91 0.00 0.00 33.84 30.98 2gb2 n VAL 61 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 2gb2 n LEU 62 N -4.51 1.92 0.00 7.52 4.77 -1.26 -4.91 117.00 120.53 2gb2 n LEU 62 Ca -0.08 -0.65 0.00 0.00 -0.03 0.00 0.00 56.01 55.25 2gb2 n LEU 62 Cb 0.29 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.37 2gb2 n LEU 62 CO 0.12 0.33 0.00 0.61 -1.33 0.00 0.00 177.39 177.11 2gb2 n GLY 63 N 1.22 -0.67 0.13 -0.72 0.00 -1.26 -0.29 105.19 103.59 2gb2 n GLY 63 Ca 0.18 -1.29 -0.11 0.00 0.00 0.00 0.00 46.02 44.80 2gb2 n GLY 63 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2gb2 h GLU 64 N 0.66 0.34 -6.98 1.61 5.08 -1.95 -0.70 114.58 112.64 2gb2 h GLU 64 Ca 0.00 -0.09 -0.48 0.00 -1.00 0.00 0.00 59.36 57.79 2gb2 h GLU 64 Cb 0.00 -0.04 0.01 0.00 0.50 0.00 0.00 28.75 29.21 2gb2 h GLU 64 CO 0.00 0.48 0.23 0.00 -1.00 0.00 0.00 179.01 178.71 2gb2 s ALA 65 N -5.23 3.22 0.51 3.43 0.00 -1.26 -2.95 121.76 119.48 2gb2 s ALA 65 Ca -0.14 -0.00 -0.23 0.00 0.00 0.00 0.00 51.96 51.59 2gb2 s ALA 65 Cb 0.07 -2.89 -0.07 0.00 0.00 0.00 0.00 23.12 20.23 2gb2 s ALA 65 CO 0.72 -0.07 1.30 0.00 0.00 0.00 0.00 175.76 177.72 2gb2 n ALA 66 N -1.30 1.42 -3.53 0.00 0.00 -1.26 -4.31 120.51 111.53 2gb2 n ALA 66 Ca 0.04 0.17 -0.38 0.00 0.00 0.00 0.00 53.44 53.27 2gb2 n ALA 66 Cb 0.54 -2.31 -0.11 0.00 0.00 0.00 0.00 19.45 17.57 2gb2 n ALA 66 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 2gb2 s LEU 67 N -2.74 5.09 -0.48 0.00 0.20 0.03 -4.88 118.68 115.90 2gb2 s LEU 67 Ca 0.68 -1.70 -0.14 0.00 0.69 0.00 0.00 54.13 53.66 2gb2 s LEU 67 Cb -0.44 -1.90 0.10 0.00 -0.43 0.00 0.00 46.19 43.51 2gb2 s LEU 67 CO 0.52 -0.52 0.40 -0.75 -0.29 0.00 0.00 176.35 175.71 2gb2 s LYS 68 N 1.30 2.84 0.78 1.98 2.20 -1.26 -0.75 119.74 126.83 2gb2 s LYS 68 Ca 0.04 -1.54 -0.11 0.00 -0.36 0.00 0.00 55.97 54.00 2gb2 s LYS 68 Cb -0.23 -4.09 0.06 0.00 -1.51 0.00 0.00 37.83 32.06 2gb2 s LYS 68 CO -0.01 -1.13 1.08 0.20 -0.36 0.00 0.00 175.35 175.13 2gb2 s GLY 69 N 2.83 1.66 0.57 5.54 0.00 0.37 -5.00 107.32 113.29 2gb2 s GLY 69 Ca 0.04 0.10 -0.18 0.00 0.00 0.00 0.00 44.72 44.68 2gb2 s GLY 69 CO 0.04 0.47 1.11 2.56 0.00 0.00 0.00 173.10 177.27 2gb2 s PRO 70 N -4.98 3.27 0.05 2.90 0.04 -1.26 -4.64 135.00 130.39 2gb2 s PRO 70 Ca 0.61 1.49 -0.31 0.00 0.04 0.00 0.00 61.00 62.83 2gb2 s PRO 70 Cb -0.16 -2.01 -0.07 0.00 0.04 0.00 0.00 34.50 32.30 2gb2 s PRO 70 CO 0.56 -0.89 1.47 -1.64 0.04 0.00 0.00 177.00 176.54 2gb2 s MET 71 N -3.54 4.27 -0.21 4.56 -1.94 -1.26 -4.55 119.30 116.63 2gb2 s MET 71 Ca 0.70 2.10 -0.15 0.00 -1.71 0.00 0.00 55.69 56.63 2gb2 s MET 71 Cb -0.21 -3.48 -0.04 0.00 2.01 0.00 0.00 34.83 33.11 2gb2 s MET 71 CO 0.30 -0.58 0.37 -1.64 -0.01 0.00 0.00 175.02 173.47 2gb2 s MET 72 N 2.06 4.15 0.97 2.03 -1.94 0.24 -4.82 119.30 121.99 2gb2 s MET 72 Ca 0.67 0.14 -0.16 0.00 -1.71 0.00 0.00 55.69 54.64 2gb2 s MET 72 Cb -0.35 -3.54 0.19 0.00 2.01 0.00 0.00 34.83 33.13 2gb2 s MET 72 CO 0.29 -0.04 1.26 0.15 -0.01 0.00 0.00 175.02 176.67 2gb2 s LYS 73 N 1.33 0.63 0.34 2.03 1.02 -1.26 -2.92 119.74 120.91 2gb2 s LYS 73 Ca 0.18 -0.24 -0.29 0.00 0.02 0.00 0.00 55.97 55.64 2gb2 s LYS 73 Cb -0.15 -1.83 -0.11 0.00 -0.52 0.00 0.00 37.83 35.22 2gb2 s LYS 73 CO 0.08 -2.45 1.54 0.21 -0.92 0.00 0.00 175.35 173.80 2gb2 s LYS 74 N -5.74 4.12 -1.71 1.68 2.20 -1.24 -1.33 119.74 117.72 2gb2 s LYS 74 Ca 0.71 2.57 0.00 0.00 -0.36 0.00 0.00 55.97 58.89 2gb2 s LYS 74 Cb -0.06 -3.00 0.00 0.00 -1.51 0.00 0.00 37.83 33.26 2gb2 s LYS 74 CO 0.53 -0.58 0.00 0.39 -0.36 0.00 0.00 175.35 175.33 2gb2 n GLU 75 N 1.29 -1.28 -4.03 4.03 -0.58 0.12 -5.01 120.64 115.18 2gb2 n GLU 75 Ca 0.04 1.01 -0.21 0.00 -0.42 0.00 0.00 57.16 57.58 2gb2 n GLU 75 Cb 0.38 -5.34 -0.04 0.00 -0.57 0.00 0.00 31.44 25.88 2gb2 n GLU 75 CO 0.00 0.00 0.00 -0.65 -0.48 0.00 0.00 177.13 176.00 2gb2 s GLN 76 N -4.03 3.05 0.07 3.49 -0.21 -0.44 -0.45 119.66 121.13 2gb2 s GLN 76 Ca 0.00 -1.00 -0.01 0.00 0.02 0.00 0.00 55.36 54.37 2gb2 s GLN 76 Cb 0.00 -2.65 -0.04 0.00 1.00 0.00 0.00 33.01 31.32 2gb2 s GLN 76 CO 0.00 0.37 -0.01 0.00 -2.12 0.00 0.00 175.29 173.53 2gb2 s ALA 77 N -2.11 0.60 -0.20 6.09 0.00 0.79 -0.77 121.76 126.16 2gb2 s ALA 77 Ca 0.34 -1.27 -0.15 0.00 0.00 0.00 0.00 51.96 50.88 2gb2 s ALA 77 Cb -0.08 0.40 0.06 0.00 0.00 0.00 0.00 23.12 23.50 2gb2 s ALA 77 CO 0.26 -0.39 0.50 -0.47 0.00 0.00 0.00 175.76 175.66 2gb2 s TYR 78 N -3.94 -0.63 0.15 0.00 5.04 -0.51 -1.45 117.35 116.02 2gb2 s TYR 78 Ca 0.11 1.43 0.11 0.00 -2.44 0.00 0.00 57.07 56.28 2gb2 s TYR 78 Cb 0.08 0.26 -0.04 0.00 0.35 0.00 0.00 41.96 42.61 2gb2 s TYR 78 CO -0.07 -0.32 -0.26 -1.12 -1.34 0.00 0.00 175.55 172.44 2gb2 s SER 79 N 0.72 3.31 -0.03 4.32 0.01 -1.26 -0.86 113.70 119.91 2gb2 s SER 79 Ca -0.04 -0.79 0.02 0.00 1.31 0.00 0.00 55.95 56.45 2gb2 s SER 79 Cb -0.05 -0.23 0.01 0.00 0.21 0.00 0.00 66.02 65.97 2gb2 s SER 79 CO -0.05 0.15 -0.07 -0.76 0.41 0.00 0.00 173.24 172.93 2gb2 s LEU 80 N -2.25 1.58 -0.32 2.44 1.43 -0.31 -4.19 118.68 117.05 2gb2 s LEU 80 Ca 0.16 -0.15 -0.11 0.00 -1.03 0.00 0.00 54.13 52.99 2gb2 s LEU 80 Cb -0.09 -0.48 -0.02 0.00 0.03 0.00 0.00 46.19 45.62 2gb2 s LEU 80 CO 0.07 0.00 0.20 -0.89 0.23 0.00 0.00 176.35 175.96 2gb2 s THR 81 N 0.54 5.05 -0.09 5.49 2.01 0.19 -0.48 115.64 128.35 2gb2 s THR 81 Ca -0.08 -0.20 -0.25 0.00 0.31 0.00 0.00 61.69 61.47 2gb2 s THR 81 Cb -0.11 -3.54 -0.03 0.00 0.01 0.00 0.00 72.50 68.83 2gb2 s THR 81 CO 0.01 0.08 0.80 -0.36 -0.69 0.00 0.00 174.62 174.46 2gb2 s PHE 82 N 1.69 3.54 -0.86 4.92 0.40 -0.31 -0.55 117.98 126.80 2gb2 s PHE 82 Ca 0.06 1.34 0.08 0.00 -0.60 0.00 0.00 56.93 57.81 2gb2 s PHE 82 Cb -0.17 -2.94 0.02 0.00 0.51 0.00 0.00 43.02 40.44 2gb2 s PHE 82 CO 0.09 -0.05 0.63 0.25 0.70 0.00 0.00 175.22 176.85 2gb2 n THR 83 N 4.14 0.00 -3.78 0.64 -2.24 0.02 -0.15 114.28 112.91 2gb2 n THR 83 Ca 0.02 -0.44 -0.13 0.00 -2.27 0.00 0.00 64.05 61.24 2gb2 n THR 83 Cb 0.50 1.12 -0.13 0.00 -2.10 0.00 0.00 70.33 69.73 2gb2 n THR 83 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 2gb2 s GLU 84 N -1.06 0.18 0.45 -0.78 2.12 -1.23 -4.80 118.70 113.59 2gb2 s GLU 84 Ca 0.08 0.32 -0.24 0.00 0.36 0.00 0.00 54.97 55.50 2gb2 s GLU 84 Cb 0.07 0.00 -0.09 0.00 0.26 0.00 0.00 34.13 34.37 2gb2 s GLU 84 CO 0.18 -0.08 1.09 0.00 -0.54 0.00 0.00 175.26 175.91 2gb2 n ALA 85 N 3.47 0.54 0.00 6.30 0.00 -1.26 -4.84 120.51 124.72 2gb2 n ALA 85 Ca -0.18 0.20 0.00 0.00 0.00 0.00 0.00 53.44 53.46 2gb2 n ALA 85 Cb 0.56 -2.15 0.00 0.00 0.00 0.00 0.00 19.45 17.87 2gb2 n ALA 85 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2gb2 n GLY 86 N 1.08 -1.32 3.01 0.00 0.00 -0.67 -4.97 105.19 102.33 2gb2 n GLY 86 Ca 0.09 -1.19 -0.29 0.00 0.00 0.00 0.00 46.02 44.63 2gb2 n GLY 86 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2gb2 s THR 87 N -3.00 1.41 -0.31 2.61 2.01 -1.26 -0.32 115.64 116.78 2gb2 s THR 87 Ca 0.00 -0.56 0.02 0.00 0.31 0.00 0.00 61.69 61.46 2gb2 s THR 87 Cb 0.00 -1.33 0.09 0.00 0.01 0.00 0.00 72.50 71.28 2gb2 s THR 87 CO 0.00 0.43 0.04 -0.31 -0.69 0.00 0.00 174.62 174.09 2gb2 s TYR 88 N 1.29 2.91 0.31 4.92 2.02 0.10 -4.99 117.35 123.91 2gb2 s TYR 88 Ca -0.01 -2.40 -0.25 0.00 -0.37 0.00 0.00 57.07 54.04 2gb2 s TYR 88 Cb -0.14 -2.31 -0.10 0.00 -0.40 0.00 0.00 41.96 39.01 2gb2 s TYR 88 CO -0.06 -0.90 0.91 -0.51 -1.57 0.00 0.00 175.55 173.42 2gb2 s ASP 89 N 1.20 7.29 0.16 2.29 -0.00 -1.26 -1.16 116.67 125.18 2gb2 s ASP 89 Ca 0.07 1.76 -0.06 0.00 -0.00 0.00 0.00 52.55 54.32 2gb2 s ASP 89 Cb -0.18 -2.55 -0.02 0.00 -0.00 0.00 0.00 42.92 40.16 2gb2 s ASP 89 CO -0.13 -0.05 0.21 -0.72 -0.00 0.00 0.00 175.17 174.48 2gb2 s TYR 90 N -1.60 0.56 0.26 4.23 1.13 -0.25 -4.54 117.35 117.13 2gb2 s TYR 90 Ca 0.49 -0.92 -0.04 0.00 -1.41 0.00 0.00 57.07 55.19 2gb2 s TYR 90 Cb -0.18 -0.19 -0.02 0.00 -1.10 0.00 0.00 41.96 40.47 2gb2 s TYR 90 CO 0.23 -0.66 0.33 -3.38 -2.51 0.00 0.00 175.55 169.56 2gb2 s HIS 91 N -4.00 0.94 -0.21 -3.49 -3.43 -0.39 -1.03 115.29 103.68 2gb2 s HIS 91 Ca 0.20 -1.18 -0.18 0.00 -0.80 0.00 0.00 55.06 53.09 2gb2 s HIS 91 Cb 0.05 -0.24 -0.03 0.00 -1.43 0.00 0.00 32.58 30.93 2gb2 s HIS 91 CO 0.01 -0.88 0.51 0.00 -2.00 0.00 0.00 174.74 172.38 2gb2 h THR 93 N 5.17 0.44 0.00 0.00 2.02 -1.92 -2.06 112.91 116.56 2gb2 h THR 93 Ca -0.33 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 66.81 2gb2 h THR 93 Cb 1.15 0.44 -0.01 0.00 -1.74 0.00 0.00 68.15 67.99 2gb2 h THR 93 CO 0.73 0.00 -0.19 1.55 0.37 0.00 0.00 175.52 177.99 2gb2 h PRO 94 N -0.55 0.00 -2.21 6.66 0.13 -1.95 -3.36 132.00 130.72 2gb2 h PRO 94 Ca -0.00 0.00 -0.59 0.00 -0.87 0.00 0.00 66.00 64.54 2gb2 h PRO 94 Cb 0.52 0.00 -0.41 0.00 0.13 0.00 0.00 31.00 31.24 2gb2 h PRO 94 CO -0.07 0.19 -0.74 0.72 -0.23 0.00 0.00 178.00 177.87 2gb2 n HIS 95 N -3.40 2.43 0.30 1.56 8.25 -0.83 -4.97 115.22 118.57 2gb2 n HIS 95 Ca -0.00 -3.99 0.04 0.00 -0.26 0.00 0.00 57.72 53.51 2gb2 n HIS 95 Cb 0.38 -0.49 0.19 0.00 1.12 0.00 0.00 29.99 31.20 2gb2 n HIS 95 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 2gb2 n PRO 96 N 1.12 0.00 0.10 -0.41 -0.04 -0.88 -0.67 135.00 134.23 2gb2 n PRO 96 Ca 0.27 0.35 0.10 0.00 -0.04 0.00 0.00 63.50 64.18 2gb2 n PRO 96 Cb 0.44 -1.50 0.45 0.00 -0.04 0.00 0.00 33.50 32.85 2gb2 n PRO 96 CO 0.00 0.00 0.00 1.97 -0.04 0.00 0.00 175.50 177.43 2gb2 n PHE 97 N -1.50 0.62 -2.75 0.54 1.16 -1.26 -4.47 117.46 109.80 2gb2 n PHE 97 Ca 0.02 0.25 -0.43 0.00 -1.87 0.00 0.00 57.45 55.43 2gb2 n PHE 97 Cb 0.10 -0.91 -0.03 0.00 -1.61 0.00 0.00 39.48 37.03 2gb2 n PHE 97 CO 0.00 0.00 0.00 -1.64 -1.87 0.00 0.00 176.76 173.25 2gb2 s MET 98 N -3.27 3.72 0.02 3.97 -1.94 0.16 -5.03 119.30 116.93 2gb2 s MET 98 Ca 0.04 0.47 0.07 0.00 -1.71 0.00 0.00 55.69 54.56 2gb2 s MET 98 Cb 0.09 -3.87 -0.02 0.00 2.01 0.00 0.00 34.83 33.04 2gb2 s MET 98 CO 0.34 -1.15 -0.20 1.03 -0.01 0.00 0.00 175.02 175.03 2gb2 s ARG 99 N 3.84 1.44 0.29 2.03 1.81 -1.26 -2.13 118.95 124.97 2gb2 s ARG 99 Ca 0.41 -0.83 -0.05 0.00 -1.72 0.00 0.00 55.73 53.53 2gb2 s ARG 99 Cb -0.10 -1.49 -0.01 0.00 -0.45 0.00 0.00 34.95 32.91 2gb2 s ARG 99 CO 0.24 0.39 0.41 0.20 -0.68 0.00 0.00 175.30 175.86 2gb2 s GLY 100 N -0.89 1.22 -0.01 -3.53 0.00 -0.20 -4.78 107.32 99.13 2gb2 s GLY 100 Ca 0.07 -1.37 -0.13 0.00 0.00 0.00 0.00 44.72 43.28 2gb2 s GLY 100 CO 0.01 -0.97 0.28 -1.59 0.00 0.00 0.00 173.10 170.82 2gb2 s LYS 101 N -3.57 0.63 -0.19 2.90 -2.85 0.09 -1.09 119.74 115.66 2gb2 s LYS 101 Ca 0.30 -0.23 -0.02 0.00 -1.00 0.00 0.00 55.97 55.03 2gb2 s LYS 101 Cb 0.01 0.28 -0.00 0.00 -2.06 0.00 0.00 37.83 36.05 2gb2 s LYS 101 CO 0.16 -0.17 -0.11 0.08 0.10 0.00 0.00 175.35 175.41 2gb2 s VAL 102 N -1.33 2.92 -0.29 1.79 1.01 -0.31 -1.51 120.40 122.68 2gb2 s VAL 102 Ca -0.14 -0.66 -0.09 0.00 0.00 0.00 0.00 61.98 61.09 2gb2 s VAL 102 Cb -0.06 -2.28 -0.01 0.00 0.00 0.00 0.00 36.38 34.03 2gb2 s VAL 102 CO 0.04 0.48 0.13 -0.69 0.00 0.00 0.00 175.10 175.06 2gb2 s VAL 103 N 1.14 4.49 -0.24 2.92 1.01 0.36 -0.73 120.40 129.35 2gb2 s VAL 103 Ca 0.01 -0.37 -0.08 0.00 0.00 0.00 0.00 61.98 61.54 2gb2 s VAL 103 Cb -0.14 -3.25 -0.04 0.00 0.00 0.00 0.00 36.38 32.95 2gb2 s VAL 103 CO -0.03 0.14 0.09 -0.69 0.00 0.00 0.00 175.10 174.60 2gb2 s VAL 104 N 1.61 4.63 0.00 2.92 1.01 0.57 -0.93 120.40 130.20 2gb2 s VAL 104 Ca 0.05 -0.07 0.00 0.00 0.00 0.00 0.00 61.98 61.96 2gb2 s VAL 104 Cb -0.17 -3.16 0.00 0.00 0.00 0.00 0.00 36.38 33.06 2gb2 s VAL 104 CO 0.05 0.35 0.00 -1.84 0.00 0.00 0.00 175.10 173.66