#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ga5 n GLU 2 N 0.00 0.00 -3.47 0.03 0.28 -1.26 -4.96 120.64 111.26 2ga5 n GLU 2 Ca 0.00 0.00 -0.29 0.00 -0.16 0.00 0.00 57.16 56.71 2ga5 n GLU 2 Cb 0.00 -0.83 -0.12 0.00 1.43 0.00 0.00 31.44 31.93 2ga5 n GLU 2 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 177.13 175.43 2ga5 s SER 3 N -0.83 2.67 -0.07 -1.84 1.04 -1.26 -5.10 113.70 108.32 2ga5 s SER 3 Ca 0.42 -2.47 -0.03 0.00 0.48 0.00 0.00 55.95 54.36 2ga5 s SER 3 Cb -0.32 -0.48 0.04 0.00 0.10 0.00 0.00 66.02 65.36 2ga5 s SER 3 CO 0.60 -0.27 0.13 -0.94 0.98 0.00 0.00 173.24 173.74 2ga5 s SER 4 N 0.72 0.41 0.00 7.02 1.04 -1.26 -5.05 113.70 116.58 2ga5 s SER 4 Ca 0.22 0.27 0.00 0.00 0.48 0.00 0.00 55.95 56.92 2ga5 s SER 4 Cb -0.16 0.17 0.00 0.00 0.10 0.00 0.00 66.02 66.13 2ga5 s SER 4 CO -0.04 -0.20 0.00 1.07 0.98 0.00 0.00 173.24 175.05 2ga5 n THR 5 N 4.81 0.00 -3.41 2.02 5.66 -1.26 -5.17 114.28 116.92 2ga5 n THR 5 Ca -0.15 0.00 0.03 0.00 -3.05 0.00 0.00 64.05 60.88 2ga5 n THR 5 Cb 0.51 0.00 -0.05 0.00 -1.55 0.00 0.00 70.33 69.23 2ga5 n THR 5 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40 2ga5 s ASP 6 N 0.00 -0.07 -0.39 1.09 -1.08 -1.26 -5.13 116.67 109.83 2ga5 s ASP 6 Ca 0.00 0.11 0.01 0.00 -0.52 0.00 0.00 52.55 52.15 2ga5 s ASP 6 Cb 0.00 1.06 0.14 0.00 -1.46 0.00 0.00 42.92 42.66 2ga5 s ASP 6 CO 0.00 -0.02 0.23 -0.83 0.52 0.00 0.00 175.17 175.08 2ga5 s GLY 7 N 1.56 1.22 -0.26 2.66 0.00 -1.26 -5.07 107.32 106.17 2ga5 s GLY 7 Ca -0.04 -2.21 -0.01 0.00 0.00 0.00 0.00 44.72 42.47 2ga5 s GLY 7 CO -0.13 1.87 0.04 1.62 0.00 0.00 0.00 173.10 176.50 2ga5 s GLN 8 N 0.69 0.95 -0.74 2.90 2.00 -1.26 -5.08 119.66 119.12 2ga5 s GLN 8 Ca 0.19 -0.94 -0.27 0.00 -2.00 0.00 0.00 55.36 52.35 2ga5 s GLN 8 Cb -0.22 -2.23 0.02 0.00 0.80 0.00 0.00 33.01 31.38 2ga5 s GLN 8 CO -0.01 -0.81 1.36 0.08 -0.50 0.00 0.00 175.29 175.42 2ga5 s VAL 9 N 1.58 3.68 -0.33 1.34 1.01 -1.26 -4.77 120.40 121.66 2ga5 s VAL 9 Ca 0.03 0.32 -0.06 0.00 0.00 0.00 0.00 61.98 62.28 2ga5 s VAL 9 Cb -0.18 -4.80 0.24 0.00 0.00 0.00 0.00 36.38 31.64 2ga5 s VAL 9 CO -0.15 -1.74 1.17 1.33 0.00 0.00 0.00 175.10 175.70 2ga5 n VAL 10 N 6.52 0.00 -0.98 2.92 0.24 -1.26 -5.06 118.33 120.70 2ga5 n VAL 10 Ca 0.07 -0.31 -0.37 0.00 -2.04 0.00 0.00 64.34 61.68 2ga5 n VAL 10 Cb 0.49 0.74 -0.05 0.00 -1.47 0.00 0.00 33.84 33.56 2ga5 n VAL 10 CO 0.00 0.00 0.00 -0.81 -2.14 0.00 0.00 176.83 173.88 2ga5 n PRO 11 N 2.20 1.49 0.00 7.34 -0.04 -1.26 -4.47 135.00 140.26 2ga5 n PRO 11 Ca 0.08 -1.66 0.12 0.00 -0.04 0.00 0.00 63.50 62.00 2ga5 n PRO 11 Cb 0.67 -2.76 0.23 0.00 -0.04 0.00 0.00 33.50 31.61 2ga5 n PRO 11 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 2ga5 n GLN 12 N 6.37 0.19 0.03 0.54 6.02 -1.26 -3.88 117.38 125.39 2ga5 n GLN 12 Ca 0.47 -0.12 -0.00 0.00 -0.01 0.00 0.00 57.00 57.33 2ga5 n GLN 12 Cb 0.33 -1.50 -0.09 0.00 1.02 0.00 0.00 30.24 30.01 2ga5 n GLN 12 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 177.06 176.44 2ga5 n GLU 13 N -1.30 0.62 -0.23 -1.09 4.71 -1.26 -4.06 120.64 118.03 2ga5 n GLU 13 Ca 0.07 0.22 0.06 0.00 -0.01 0.00 0.00 57.16 57.49 2ga5 n GLU 13 Cb 0.34 -1.80 0.31 0.00 -1.01 0.00 0.00 31.44 29.28 2ga5 n GLU 13 CO 0.00 0.00 0.00 0.28 0.09 0.00 0.00 177.13 177.50 2ga5 h VAL 14 N 0.00 1.03 -1.17 2.62 2.07 -1.72 -0.69 116.25 118.40 2ga5 h VAL 14 Ca -0.17 -0.29 0.34 0.00 0.82 0.00 0.00 66.70 67.39 2ga5 h VAL 14 Cb 1.60 0.11 -0.05 0.00 -1.52 0.00 0.00 31.29 31.43 2ga5 h VAL 14 CO 0.05 0.16 0.84 -0.07 0.02 0.00 0.00 177.57 178.56 2ga5 h LEU 15 N 0.85 0.01 0.00 2.57 4.07 -1.78 -3.39 115.31 117.65 2ga5 h LEU 15 Ca 0.34 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.31 2ga5 h LEU 15 Cb 0.24 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.99 2ga5 h LEU 15 CO -0.12 0.00 0.00 -0.46 -1.08 0.00 0.00 178.44 176.78 2ga5 n ASN 16 N -4.19 0.00 -4.34 -0.43 0.23 -0.47 -5.13 115.26 100.92 2ga5 n ASN 16 Ca 0.25 0.00 -0.28 0.00 -0.53 0.00 0.00 54.58 54.02 2ga5 n ASN 16 Cb 1.22 0.00 -0.14 0.00 -2.08 0.00 0.00 39.78 38.79 2ga5 n ASN 16 CO 0.00 0.00 0.00 -1.48 -0.93 0.00 0.00 177.26 174.85 2ga5 s LEU 17 N -0.33 2.23 -0.71 -4.53 0.05 -0.39 -5.04 118.68 109.96 2ga5 s LEU 17 Ca 0.00 -0.65 -0.22 0.00 0.05 0.00 0.00 54.13 53.31 2ga5 s LEU 17 Cb 0.00 -1.18 -0.17 0.00 -2.05 0.00 0.00 46.19 42.79 2ga5 s LEU 17 CO 0.00 0.20 1.90 -0.81 -0.55 0.00 0.00 176.35 177.09 2ga5 n PRO 18 N 1.41 1.40 -0.23 1.48 -0.04 -1.26 -4.13 135.00 133.64 2ga5 n PRO 18 Ca -0.18 -1.77 0.04 0.00 -0.04 0.00 0.00 63.50 61.55 2ga5 n PRO 18 Cb 0.53 -2.88 0.15 0.00 -0.04 0.00 0.00 33.50 31.25 2ga5 n PRO 18 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 2ga5 h LEU 19 N 13.99 -0.15 -0.39 1.53 3.38 -1.97 -0.27 115.31 131.44 2ga5 h LEU 19 Ca 0.41 0.16 0.07 0.00 0.09 0.00 0.00 57.88 58.61 2ga5 h LEU 19 Cb 0.66 0.25 -0.06 0.00 0.09 0.00 0.00 40.66 41.59 2ga5 h LEU 19 CO 1.96 -0.09 -0.01 -0.08 0.09 0.00 0.00 178.44 180.31 2ga5 h GLU 20 N 0.18 0.09 -0.47 1.13 4.57 -1.96 -0.50 114.58 117.61 2ga5 h GLU 20 Ca 0.38 -0.01 -0.01 0.00 -1.18 0.00 0.00 59.36 58.55 2ga5 h GLU 20 Cb 0.64 -0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 29.18 2ga5 h GLU 20 CO -0.54 0.06 0.27 -0.22 -1.18 0.00 0.00 179.01 177.40 2ga5 h LYS 21 N 0.09 0.64 -0.34 1.92 3.11 -1.49 -1.36 116.57 119.13 2ga5 h LYS 21 Ca 0.19 -0.06 -0.03 0.00 -2.81 0.00 0.00 60.65 57.94 2ga5 h LYS 21 Cb 0.27 -0.14 -0.01 0.00 -1.00 0.00 0.00 32.23 31.35 2ga5 h LYS 21 CO -0.33 0.47 0.09 -0.92 -2.81 0.00 0.00 179.45 175.95 2ga5 h TYR 22 N 0.65 0.58 -0.02 1.91 5.03 0.07 -1.43 116.97 123.76 2ga5 h TYR 22 Ca 0.17 -0.07 -0.09 0.00 2.58 0.00 0.00 58.73 61.33 2ga5 h TYR 22 Cb 0.01 -0.16 -0.01 0.00 1.55 0.00 0.00 36.73 38.11 2ga5 h TYR 22 CO 0.00 0.58 -0.39 1.25 -1.32 0.00 0.00 178.16 178.28 2ga5 h HIS 23 N 0.40 0.05 -0.31 -3.82 2.76 -0.81 -1.14 115.15 112.28 2ga5 h HIS 23 Ca 0.11 -0.01 -0.18 0.00 -2.20 0.00 0.00 60.37 58.09 2ga5 h HIS 23 Cb 0.29 -0.01 -0.00 0.00 1.55 0.00 0.00 27.41 29.24 2ga5 h HIS 23 CO 0.01 0.43 -0.50 0.93 -1.30 0.00 0.00 177.93 177.51 2ga5 h GLU 24 N 0.04 0.87 0.13 5.26 4.39 -0.96 0.31 114.58 124.62 2ga5 h GLU 24 Ca 0.00 -0.53 -0.01 0.00 0.34 0.00 0.00 59.36 59.17 2ga5 h GLU 24 Cb 0.71 0.05 0.00 0.00 -0.10 0.00 0.00 28.75 29.42 2ga5 h GLU 24 CO 0.05 1.16 -0.06 0.93 -1.16 0.00 0.00 179.01 179.93 2ga5 h GLU 25 N 0.68 -0.17 -0.60 2.33 4.39 -1.08 -1.47 114.58 118.65 2ga5 h GLU 25 Ca 0.03 0.01 -0.01 0.00 0.34 0.00 0.00 59.36 59.73 2ga5 h GLU 25 Cb 1.10 0.04 -0.03 0.00 -0.10 0.00 0.00 28.75 29.76 2ga5 h GLU 25 CO 0.11 0.30 0.34 0.00 -1.16 0.00 0.00 179.01 178.61 2ga5 h ALA 26 N -0.21 0.77 -0.40 3.43 0.00 -1.30 0.39 119.26 121.93 2ga5 h ALA 26 Ca -0.02 -0.09 -0.03 0.00 0.00 0.00 0.00 54.91 54.77 2ga5 h ALA 26 Cb 0.55 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 2ga5 h ALA 26 CO 0.03 0.28 0.12 0.22 0.00 0.00 0.00 179.25 179.89 2ga5 h ASP 27 N 0.82 0.60 0.80 0.00 3.58 -1.02 -1.55 116.42 119.64 2ga5 h ASP 27 Ca 0.21 -0.21 -0.09 0.00 0.42 0.00 0.00 57.03 57.36 2ga5 h ASP 27 Cb 0.02 -0.16 -0.01 0.00 1.72 0.00 0.00 39.33 40.90 2ga5 h ASP 27 CO -0.04 0.65 -0.42 0.44 -2.88 0.00 0.00 179.24 177.00 2ga5 h ASP 28 N 0.51 0.00 0.02 2.28 3.32 -1.02 -1.50 116.42 120.03 2ga5 h ASP 28 Ca 0.13 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.18 2ga5 h ASP 28 Cb 0.28 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.83 2ga5 h ASP 28 CO -0.00 0.42 -0.01 1.88 -1.72 0.00 0.00 179.24 179.81 2ga5 h TYR 29 N 0.00 -0.02 -0.25 4.55 0.05 0.11 -1.48 116.97 119.93 2ga5 h TYR 29 Ca -0.00 -0.00 -0.09 0.00 0.05 0.00 0.00 58.73 58.69 2ga5 h TYR 29 Cb 0.93 0.01 -0.01 0.00 1.01 0.00 0.00 36.73 38.68 2ga5 h TYR 29 CO 0.00 0.46 -0.19 -0.07 -1.05 0.00 0.00 178.16 177.31 2ga5 h LEU 30 N -0.52 0.60 -0.44 3.88 3.38 -1.31 -1.15 115.31 119.75 2ga5 h LEU 30 Ca -0.00 -0.45 0.02 0.00 0.09 0.00 0.00 57.88 57.54 2ga5 h LEU 30 Cb 0.50 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 41.05 2ga5 h LEU 30 CO 0.00 0.92 0.25 0.44 0.09 0.00 0.00 178.44 180.15 2ga5 h ASP 31 N 0.29 0.40 0.66 -0.43 3.32 -1.35 -1.13 116.42 118.19 2ga5 h ASP 31 Ca 0.05 0.01 -0.08 0.00 0.02 0.00 0.00 57.03 57.02 2ga5 h ASP 31 Cb 0.73 -0.08 -0.01 0.00 0.22 0.00 0.00 39.33 40.19 2ga5 h ASP 31 CO 0.05 0.29 -0.39 0.45 -1.72 0.00 0.00 179.24 177.92 2ga5 h HIS 32 N 0.51 0.00 0.26 4.55 3.86 -1.25 -1.45 115.15 121.63 2ga5 h HIS 32 Ca 0.18 0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 59.38 2ga5 h HIS 32 Cb 0.03 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.50 2ga5 h HIS 32 CO -0.08 0.39 -0.13 -0.07 0.86 0.00 0.00 177.93 178.90 2ga5 h LEU 33 N 0.00 -0.30 -1.26 2.43 -0.00 -0.34 -1.50 115.31 114.34 2ga5 h LEU 33 Ca -0.00 -0.22 -0.06 0.00 -0.00 0.00 0.00 57.88 57.60 2ga5 h LEU 33 Cb 0.82 0.08 -0.01 0.00 -0.00 0.00 0.00 40.66 41.55 2ga5 h LEU 33 CO 0.05 0.10 -0.31 0.17 -0.00 0.00 0.00 178.44 178.45 2ga5 h LEU 34 N -0.75 0.00 -0.23 1.67 8.10 -1.25 -1.97 115.31 120.88 2ga5 h LEU 34 Ca -0.04 0.00 -0.10 0.00 0.11 0.00 0.00 57.88 57.85 2ga5 h LEU 34 Cb 0.50 0.00 -0.00 0.00 -0.44 0.00 0.00 40.66 40.72 2ga5 h LEU 34 CO 0.06 0.31 -0.25 -0.78 -4.11 0.00 0.00 178.44 173.67 2ga5 h ASP 35 N 0.00 0.62 -0.08 0.17 3.58 -1.22 -1.31 116.42 118.17 2ga5 h ASP 35 Ca -0.00 -0.48 -0.04 0.00 0.42 0.00 0.00 57.03 56.92 2ga5 h ASP 35 Cb 0.70 -0.17 -0.00 0.00 1.72 0.00 0.00 39.33 41.57 2ga5 h ASP 35 CO 0.04 0.97 -0.11 -1.28 -2.88 0.00 0.00 179.24 175.99 2ga5 h SER 36 N 0.27 0.24 0.85 2.28 0.87 -1.14 -2.11 113.55 114.81 2ga5 h SER 36 Ca 0.03 -0.51 -0.04 0.00 -1.23 0.00 0.00 61.79 60.04 2ga5 h SER 36 Cb 0.81 -0.07 0.00 0.00 -0.44 0.00 0.00 62.40 62.70 2ga5 h SER 36 CO 0.06 0.70 -0.44 -0.07 -0.53 0.00 0.00 176.83 176.55 2ga5 h LEU 37 N -0.22 -1.07 -0.87 2.23 -0.00 -1.42 -0.09 115.31 113.86 2ga5 h LEU 37 Ca 0.01 0.05 0.15 0.00 -0.00 0.00 0.00 57.88 58.09 2ga5 h LEU 37 Cb 0.64 0.29 -0.10 0.00 -0.00 0.00 0.00 40.66 41.50 2ga5 h LEU 37 CO 0.03 -0.73 0.46 1.05 -0.00 0.00 0.00 178.44 179.25 2ga5 h GLU 38 N -1.19 0.63 0.00 1.13 -0.00 -1.34 0.33 114.58 114.14 2ga5 h GLU 38 Ca -0.12 -0.04 -0.05 0.00 -0.00 0.00 0.00 59.36 59.16 2ga5 h GLU 38 Cb 0.93 -0.14 -0.01 0.00 -0.00 0.00 0.00 28.75 29.53 2ga5 h GLU 38 CO 0.17 0.42 -0.23 1.49 -0.00 0.00 0.00 179.01 180.86 2ga5 h GLU 39 N 0.65 0.00 0.08 1.06 4.57 -1.14 -1.41 114.58 118.39 2ga5 h GLU 39 Ca 0.48 0.00 -0.26 0.00 -1.18 0.00 0.00 59.36 58.40 2ga5 h GLU 39 Cb 0.68 0.00 0.02 0.00 -0.16 0.00 0.00 28.75 29.29 2ga5 h GLU 39 CO -0.36 0.23 -1.07 -0.07 -1.18 0.00 0.00 179.01 176.56 2ga5 h LEU 40 N 0.00 0.80 -0.91 1.64 3.38 0.15 0.33 115.31 120.70 2ga5 h LEU 40 Ca -0.00 -0.81 -0.05 0.00 0.09 0.00 0.00 57.88 57.11 2ga5 h LEU 40 Cb 0.53 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.02 2ga5 h LEU 40 CO 0.03 1.52 -0.25 0.28 0.09 0.00 0.00 178.44 180.11 2ga5 h SER 41 N 0.18 0.00 0.03 -0.43 0.02 -0.89 0.58 113.55 113.04 2ga5 h SER 41 Ca -0.16 0.00 -0.33 0.00 -0.84 0.00 0.00 61.79 60.46 2ga5 h SER 41 Cb 1.75 0.00 -0.04 0.00 0.14 0.00 0.00 62.40 64.25 2ga5 h SER 41 CO 0.21 0.25 -1.87 -0.62 -1.14 0.00 0.00 176.83 173.66 2ga5 n GLU 42 N -3.35 0.63 -0.03 3.45 1.02 -0.55 -3.16 120.64 118.66 2ga5 n GLU 42 Ca 0.01 0.38 -0.08 0.00 -0.02 0.00 0.00 57.16 57.44 2ga5 n GLU 42 Cb 0.47 -1.66 0.08 0.00 -0.02 0.00 0.00 31.44 30.32 2ga5 n GLU 42 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2ga5 h ALA 43 N -0.38 0.80 -0.30 0.62 0.00 -0.41 -3.42 119.26 116.17 2ga5 h ALA 43 Ca -0.47 -0.44 -0.00 0.00 0.00 0.00 0.00 54.91 54.00 2ga5 h ALA 43 Cb 1.64 -0.11 -0.15 0.00 0.00 0.00 0.00 17.79 19.16 2ga5 h ALA 43 CO -0.16 0.65 -0.17 -1.58 0.00 0.00 0.00 179.25 177.99 2ga5 s HIS 44 N -4.28 -0.49 0.00 0.00 5.65 0.07 -5.05 115.29 111.20 2ga5 s HIS 44 Ca -0.08 -0.15 0.00 0.00 0.25 0.00 0.00 55.06 55.08 2ga5 s HIS 44 Cb 0.12 0.10 0.00 0.00 -1.18 0.00 0.00 32.58 31.62 2ga5 s HIS 44 CO 0.83 -0.38 0.00 -0.35 -0.65 0.00 0.00 174.74 174.19 2ga5 n PRO 45 N 2.72 0.25 0.00 2.88 -0.04 -0.48 -4.54 135.00 135.79 2ga5 n PRO 45 Ca 0.12 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.58 2ga5 n PRO 45 Cb 0.64 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.10 2ga5 n PRO 45 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 2ga5 n ASP 46 N -1.11 0.96 0.00 3.54 -0.08 -1.26 -4.98 116.55 113.62 2ga5 n ASP 46 Ca 0.00 -1.41 0.00 0.00 -1.51 0.00 0.00 54.79 51.87 2ga5 n ASP 46 Cb 0.00 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.46 2ga5 n ASP 46 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2ga5 n ILE 48 N 0.00 0.04 -1.21 0.00 5.41 -1.26 -5.13 119.36 117.21 2ga5 n ILE 48 Ca 0.00 -1.52 -0.30 0.00 1.00 0.00 0.00 62.75 61.93 2ga5 n ILE 48 Cb 0.00 0.99 0.13 0.00 -0.71 0.00 0.00 39.64 40.05 2ga5 n ILE 48 CO 0.00 0.00 0.00 -2.16 0.00 0.00 0.00 176.55 174.39 2ga5 s PRO 49 N 0.08 1.40 -0.19 0.38 0.04 -1.26 -4.62 135.00 130.83 2ga5 s PRO 49 Ca 0.21 0.88 -0.06 0.00 0.04 0.00 0.00 61.00 62.07 2ga5 s PRO 49 Cb 0.41 -1.82 0.09 0.00 0.04 0.00 0.00 34.50 33.22 2ga5 s PRO 49 CO -0.09 -2.16 0.37 -0.51 0.04 0.00 0.00 177.00 174.66 2ga5 s ASP 50 N -3.41 0.01 -0.29 6.66 1.01 -0.24 -4.98 116.67 115.43 2ga5 s ASP 50 Ca 0.63 0.73 -0.10 0.00 0.71 0.00 0.00 52.55 54.51 2ga5 s ASP 50 Cb -0.18 1.14 -0.04 0.00 1.01 0.00 0.00 42.92 44.86 2ga5 s ASP 50 CO 0.57 -0.25 0.17 -0.69 0.21 0.00 0.00 175.17 175.18 2ga5 s VAL 51 N 2.55 5.00 -0.13 -1.27 1.01 -1.26 -0.22 120.40 126.09 2ga5 s VAL 51 Ca 0.02 -0.03 0.01 0.00 0.00 0.00 0.00 61.98 61.98 2ga5 s VAL 51 Cb -0.13 -3.42 -0.01 0.00 0.00 0.00 0.00 36.38 32.82 2ga5 s VAL 51 CO -0.12 0.21 -0.16 -0.70 0.00 0.00 0.00 175.10 174.33 2ga5 s GLU 52 N 1.71 3.28 -0.24 2.72 2.12 0.15 -4.88 118.70 123.56 2ga5 s GLU 52 Ca 0.06 -0.74 -0.03 0.00 0.36 0.00 0.00 54.97 54.62 2ga5 s GLU 52 Cb -0.16 -2.57 0.01 0.00 0.26 0.00 0.00 34.13 31.67 2ga5 s GLU 52 CO 0.09 0.16 -0.04 -1.17 -0.54 0.00 0.00 175.26 173.77 2ga5 s LEU 53 N 0.45 3.11 -0.28 2.70 1.98 -1.26 0.72 118.68 126.10 2ga5 s LEU 53 Ca -0.11 -0.61 0.01 0.00 -2.89 0.00 0.00 54.13 50.53 2ga5 s LEU 53 Cb -0.16 -1.73 0.06 0.00 0.66 0.00 0.00 46.19 45.02 2ga5 s LEU 53 CO 0.05 -0.08 -0.06 -0.44 -1.89 0.00 0.00 176.35 173.93 2ga5 s SER 54 N 1.42 4.65 -0.02 3.68 0.01 -0.02 -4.99 113.70 118.44 2ga5 s SER 54 Ca 0.03 -1.34 -0.00 0.00 1.31 0.00 0.00 55.95 55.95 2ga5 s SER 54 Cb -0.15 -1.62 -0.01 0.00 0.21 0.00 0.00 66.02 64.44 2ga5 s SER 54 CO -0.03 -0.22 0.05 1.57 0.41 0.00 0.00 173.24 175.01 2ga5 n HIS 55 N 4.52 0.00 0.00 2.43 -0.00 -1.26 0.29 115.22 121.20 2ga5 n HIS 55 Ca -0.14 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.05 2ga5 n HIS 55 Cb 0.43 -0.02 0.00 0.00 -0.12 0.00 0.00 29.99 30.28 2ga5 n HIS 55 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 2ga5 n GLY 56 N 0.11 1.25 3.48 1.57 0.00 -1.26 -5.10 105.19 105.24 2ga5 n GLY 56 Ca 0.01 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.89 2ga5 n GLY 56 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2ga5 s VAL 57 N -2.00 0.00 -0.43 1.61 1.01 0.84 -3.41 120.40 118.02 2ga5 s VAL 57 Ca 0.00 0.00 0.03 0.00 0.00 0.00 0.00 61.98 62.01 2ga5 s VAL 57 Cb 0.00 -1.00 0.16 0.00 0.00 0.00 0.00 36.38 35.54 2ga5 s VAL 57 CO 0.00 0.00 0.32 -0.32 0.00 0.00 0.00 175.10 175.10 2ga5 s MET 58 N -2.41 1.05 0.36 2.72 1.75 0.53 -0.84 119.30 122.46 2ga5 s MET 58 Ca -0.05 -2.07 -0.25 0.00 -1.25 0.00 0.00 55.69 52.07 2ga5 s MET 58 Cb -0.01 -1.73 -0.09 0.00 2.84 0.00 0.00 34.83 35.84 2ga5 s MET 58 CO -0.01 -1.31 1.01 0.95 -0.65 0.00 0.00 175.02 175.01 2ga5 s THR 59 N 0.14 3.88 -0.20 10.11 -4.23 0.22 -0.72 115.64 124.85 2ga5 s THR 59 Ca 0.27 1.53 -0.04 0.00 -1.18 0.00 0.00 61.69 62.26 2ga5 s THR 59 Cb -0.06 -3.83 0.10 0.00 1.34 0.00 0.00 72.50 70.05 2ga5 s THR 59 CO -0.13 0.09 0.32 -0.22 -0.54 0.00 0.00 174.62 174.15 2ga5 s LEU 60 N -2.30 -0.44 -0.29 4.79 2.96 0.37 0.31 118.68 124.08 2ga5 s LEU 60 Ca 0.54 0.36 -0.14 0.00 -0.22 0.00 0.00 54.13 54.66 2ga5 s LEU 60 Cb -0.22 0.89 -0.03 0.00 0.50 0.00 0.00 46.19 47.34 2ga5 s LEU 60 CO 0.27 -0.28 0.33 -0.70 -1.32 0.00 0.00 176.35 174.66 2ga5 s GLU 61 N 2.48 3.87 -0.51 1.98 2.12 0.70 0.20 118.70 129.54 2ga5 s GLU 61 Ca 0.06 -0.17 0.01 0.00 0.36 0.00 0.00 54.97 55.23 2ga5 s GLU 61 Cb -0.14 -3.70 0.13 0.00 0.26 0.00 0.00 34.13 30.68 2ga5 s GLU 61 CO -0.13 -0.33 0.28 0.42 -0.54 0.00 0.00 175.26 174.97 2ga5 s ILE 62 N 1.99 3.05 -0.76 -3.70 -1.09 0.96 -1.08 121.20 120.58 2ga5 s ILE 62 Ca 0.12 -2.86 -0.13 0.00 -2.23 0.00 0.00 60.65 55.55 2ga5 s ILE 62 Cb -0.16 -3.07 -0.11 0.00 -1.58 0.00 0.00 42.46 37.54 2ga5 s ILE 62 CO 0.11 -0.78 1.93 -0.81 -1.23 0.00 0.00 174.94 174.16 2ga5 n PRO 63 N 3.64 1.61 0.00 2.79 -0.04 -1.26 -1.11 135.00 140.63 2ga5 n PRO 63 Ca 0.05 -1.55 0.00 0.00 -0.04 0.00 0.00 63.50 61.96 2ga5 n PRO 63 Cb 0.37 -2.63 0.00 0.00 -0.04 0.00 0.00 33.50 31.20 2ga5 n PRO 63 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2ga5 n ALA 64 N 5.88 0.00 0.00 0.55 0.00 -1.26 -4.74 120.51 120.94 2ga5 n ALA 64 Ca 0.44 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.88 2ga5 n ALA 64 Cb 0.25 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.70 2ga5 n ALA 64 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 2ga5 n PHE 65 N -0.54 0.00 0.00 0.00 3.72 -1.06 -5.12 117.46 114.46 2ga5 n PHE 65 Ca 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.40 2ga5 n PHE 65 Cb 0.00 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.54 2ga5 n PHE 65 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2ga5 n GLY 66 N 2.03 0.30 2.89 1.37 0.00 -0.26 -4.63 105.19 106.88 2ga5 n GLY 66 Ca 0.00 -1.21 -0.25 0.00 0.00 0.00 0.00 46.02 44.55 2ga5 n GLY 66 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2ga5 s THR 67 N -4.00 0.88 -0.02 2.61 2.01 -1.13 -0.02 115.64 115.97 2ga5 s THR 67 Ca 0.00 -0.21 -0.16 0.00 0.31 0.00 0.00 61.69 61.62 2ga5 s THR 67 Cb 0.00 -0.92 -0.06 0.00 0.01 0.00 0.00 72.50 71.54 2ga5 s THR 67 CO 0.00 0.34 0.45 -0.31 -0.69 0.00 0.00 174.62 174.41 2ga5 s TYR 68 N 1.64 3.69 -0.01 4.92 2.02 0.54 -3.18 117.35 126.97 2ga5 s TYR 68 Ca 0.03 1.02 0.01 0.00 -0.37 0.00 0.00 57.07 57.76 2ga5 s TYR 68 Cb -0.13 -2.39 0.00 0.00 -0.40 0.00 0.00 41.96 39.04 2ga5 s TYR 68 CO -0.06 0.51 -0.04 0.08 -1.57 0.00 0.00 175.55 174.47 2ga5 s VAL 69 N -0.66 0.35 -0.19 0.71 1.01 -0.13 0.14 120.40 121.63 2ga5 s VAL 69 Ca 0.25 -0.15 -0.04 0.00 0.00 0.00 0.00 61.98 62.04 2ga5 s VAL 69 Cb -0.17 -0.32 0.08 0.00 0.00 0.00 0.00 36.38 35.97 2ga5 s VAL 69 CO 0.14 0.12 0.20 -0.63 0.00 0.00 0.00 175.10 174.92 2ga5 s ILE 70 N 0.14 -0.28 0.29 2.22 1.01 0.10 0.53 121.20 125.21 2ga5 s ILE 70 Ca -0.01 -0.08 0.11 0.00 0.00 0.00 0.00 60.65 60.67 2ga5 s ILE 70 Cb -0.05 -0.63 -0.05 0.00 0.01 0.00 0.00 42.46 41.74 2ga5 s ILE 70 CO -0.00 -0.19 -0.18 0.21 0.00 0.00 0.00 174.94 174.78 2ga5 s ASN 71 N 2.30 3.61 -0.44 3.58 3.84 -0.27 0.20 114.94 127.75 2ga5 s ASN 71 Ca 0.06 -1.07 0.07 0.00 0.21 0.00 0.00 52.86 52.14 2ga5 s ASN 71 Cb -0.15 -0.31 0.27 0.00 -0.55 0.00 0.00 41.25 40.51 2ga5 s ASN 71 CO -0.11 -0.01 0.78 1.17 -2.79 0.00 0.00 177.10 176.14 2ga5 n LYS 72 N -0.65 0.82 -2.73 0.43 0.00 -1.22 -0.84 118.16 113.96 2ga5 n LYS 72 Ca -0.05 -2.46 -0.03 0.00 0.00 0.00 0.00 58.31 55.76 2ga5 n LYS 72 Cb 0.61 -1.35 0.09 0.00 0.00 0.00 0.00 35.03 34.38 2ga5 n LYS 72 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.40 178.44 2ga5 n GLN 73 N 1.20 1.42 -1.16 1.64 1.13 -1.26 -4.92 117.38 115.44 2ga5 n GLN 73 Ca 0.15 -2.35 -0.29 0.00 -1.94 0.00 0.00 57.00 52.57 2ga5 n GLN 73 Cb 0.61 -0.55 0.18 0.00 0.11 0.00 0.00 30.24 30.60 2ga5 n GLN 73 CO 0.00 0.00 0.00 -1.25 -1.44 0.00 0.00 177.06 174.37 2ga5 s PRO 74 N -1.60 0.26 0.00 -1.09 0.04 -1.26 -4.89 135.00 126.45 2ga5 s PRO 74 Ca 0.20 0.46 0.11 0.00 0.04 0.00 0.00 61.00 61.81 2ga5 s PRO 74 Cb 0.40 -1.72 0.63 0.00 0.04 0.00 0.00 34.50 33.85 2ga5 s PRO 74 CO -0.07 -2.84 1.07 -0.35 0.04 0.00 0.00 177.00 174.85 2ga5 n PRO 75 N -4.24 0.49 0.00 0.56 -0.04 -1.26 -4.53 135.00 125.98 2ga5 n PRO 75 Ca 0.05 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.51 2ga5 n PRO 75 Cb 0.57 -1.34 0.00 0.00 -0.04 0.00 0.00 33.50 32.70 2ga5 n PRO 75 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73 2ga5 n ASN 76 N -0.84 0.00 -3.06 3.54 0.23 -1.26 -5.13 115.26 108.74 2ga5 n ASN 76 Ca 0.08 0.00 0.03 0.00 -0.53 0.00 0.00 54.58 54.16 2ga5 n ASN 76 Cb 0.04 0.00 -0.00 0.00 -2.08 0.00 0.00 39.78 37.73 2ga5 n ASN 76 CO 0.00 0.00 0.00 -1.59 -0.93 0.00 0.00 177.26 174.74 2ga5 s LYS 77 N 0.42 0.45 0.15 -3.83 0.00 -1.26 -5.09 119.74 110.57 2ga5 s LYS 77 Ca 0.00 0.05 -0.25 0.00 0.00 0.00 0.00 55.97 55.78 2ga5 s LYS 77 Cb 0.00 0.10 0.06 0.00 0.00 0.00 0.00 37.83 38.00 2ga5 s LYS 77 CO 0.00 -0.71 0.83 -0.65 0.00 0.00 0.00 175.35 174.82 2ga5 s GLN 78 N 2.32 1.26 -0.17 1.78 1.11 -1.26 -4.21 119.66 120.49 2ga5 s GLN 78 Ca 0.17 -0.62 -0.00 0.00 0.01 0.00 0.00 55.36 54.92 2ga5 s GLN 78 Cb -0.03 0.48 0.00 0.00 -1.01 0.00 0.00 33.01 32.45 2ga5 s GLN 78 CO -0.17 -0.57 -0.14 0.42 0.01 0.00 0.00 175.29 174.85 2ga5 s ILE 79 N -3.47 2.68 -0.19 1.08 1.01 -0.14 -4.33 121.20 117.83 2ga5 s ILE 79 Ca 0.08 -0.75 -0.18 0.00 0.00 0.00 0.00 60.65 59.80 2ga5 s ILE 79 Cb -0.02 -2.15 -0.04 0.00 0.01 0.00 0.00 42.46 40.26 2ga5 s ILE 79 CO -0.02 0.50 0.49 0.26 0.00 0.00 0.00 174.94 176.17 2ga5 s TRP 80 N 1.03 3.40 -0.33 3.97 0.52 -0.02 0.00 118.94 127.51 2ga5 s TRP 80 Ca -0.01 0.76 0.03 0.00 0.02 0.00 0.00 56.10 56.90 2ga5 s TRP 80 Cb -0.15 -2.62 0.09 0.00 -1.15 0.00 0.00 33.47 29.64 2ga5 s TRP 80 CO -0.03 -0.04 0.03 -1.17 0.02 0.00 0.00 176.95 175.76 2ga5 s LEU 81 N 1.40 4.54 -0.49 2.99 0.20 0.22 -1.12 118.68 126.41 2ga5 s LEU 81 Ca 0.23 -1.98 -0.23 0.00 0.69 0.00 0.00 54.13 52.84 2ga5 s LEU 81 Cb -0.15 -1.64 0.04 0.00 -0.43 0.00 0.00 46.19 44.01 2ga5 s LEU 81 CO 0.09 -0.36 0.83 0.00 -0.29 0.00 0.00 176.35 176.63 2ga5 s ALA 82 N 0.97 3.25 1.19 5.97 0.00 0.19 0.55 121.76 133.88 2ga5 s ALA 82 Ca 0.07 -1.16 -0.13 0.00 0.00 0.00 0.00 51.96 50.73 2ga5 s ALA 82 Cb -0.20 -3.57 0.29 0.00 0.00 0.00 0.00 23.12 19.65 2ga5 s ALA 82 CO -0.07 -2.11 0.98 0.43 0.00 0.00 0.00 175.76 174.98 2ga5 n SER 83 N 6.96 -1.86 0.00 0.00 7.64 -0.04 -0.95 113.62 125.36 2ga5 n SER 83 Ca 0.01 -0.19 0.08 0.00 1.01 0.00 0.00 58.87 59.78 2ga5 n SER 83 Cb 0.48 -1.24 0.42 0.00 -1.01 0.00 0.00 64.21 62.85 2ga5 n SER 83 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 2ga5 n PRO 84 N -4.92 0.34 -1.17 1.43 -0.04 -1.19 -2.42 135.00 127.02 2ga5 n PRO 84 Ca 0.02 0.08 -0.01 0.00 -0.04 0.00 0.00 63.50 63.55 2ga5 n PRO 84 Cb 0.54 -1.50 0.13 0.00 -0.04 0.00 0.00 33.50 32.63 2ga5 n PRO 84 CO 0.00 0.00 0.00 1.47 -0.04 0.00 0.00 175.50 176.93 2ga5 n LEU 85 N -1.16 2.87 -2.78 1.53 -0.00 -1.26 -2.86 117.00 113.34 2ga5 n LEU 85 Ca 0.09 -3.75 -0.00 0.00 -0.00 0.00 0.00 56.01 52.35 2ga5 n LEU 85 Cb 0.09 -0.35 0.00 0.00 -0.00 0.00 0.00 43.42 43.16 2ga5 n LEU 85 CO 0.10 1.40 0.27 -0.24 -0.00 0.00 0.00 177.39 178.93 2ga5 n SER 86 N -0.76 -6.83 -3.30 1.45 2.88 -1.02 -5.03 113.62 101.02 2ga5 n SER 86 Ca 0.22 -0.02 -0.21 0.00 -1.33 0.00 0.00 58.87 57.53 2ga5 n SER 86 Cb 0.83 -4.59 -0.08 0.00 -0.75 0.00 0.00 64.21 59.62 2ga5 n SER 86 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2ga5 s GLY 87 N -2.79 0.42 0.20 0.46 0.00 -1.25 -4.86 107.32 99.49 2ga5 s GLY 87 Ca 0.02 -1.63 -0.30 0.00 0.00 0.00 0.00 44.72 42.80 2ga5 s GLY 87 CO 0.62 2.53 1.30 2.56 0.00 0.00 0.00 173.10 180.12 2ga5 s PRO 88 N 0.72 4.39 -0.18 2.90 0.04 -1.23 -0.86 135.00 140.78 2ga5 s PRO 88 Ca 0.26 2.05 0.01 0.00 0.04 0.00 0.00 61.00 63.35 2ga5 s PRO 88 Cb -0.06 -3.20 0.03 0.00 0.04 0.00 0.00 34.50 31.31 2ga5 s PRO 88 CO -0.09 -0.25 -0.18 -0.80 0.04 0.00 0.00 177.00 175.72 2ga5 s ASN 89 N 0.33 3.21 -0.48 6.66 0.02 0.19 -4.80 114.94 120.07 2ga5 s ASN 89 Ca 0.56 -0.71 -0.25 0.00 -1.02 0.00 0.00 52.86 51.44 2ga5 s ASN 89 Cb -0.36 -1.44 0.03 0.00 0.02 0.00 0.00 41.25 39.50 2ga5 s ASN 89 CO 0.38 -0.03 0.91 -0.13 0.02 0.00 0.00 177.10 178.25 2ga5 s ARG 90 N 1.30 3.48 -0.07 -0.60 3.00 -1.26 -0.61 118.95 124.19 2ga5 s ARG 90 Ca 0.03 0.05 -0.11 0.00 0.00 0.00 0.00 55.73 55.70 2ga5 s ARG 90 Cb -0.14 -3.95 -0.05 0.00 0.00 0.00 0.00 34.95 30.81 2ga5 s ARG 90 CO -0.12 -1.25 0.27 -0.06 0.00 0.00 0.00 175.30 174.14 2ga5 s PHE 91 N 3.72 3.65 0.11 -0.53 0.40 0.10 -4.70 117.98 120.73 2ga5 s PHE 91 Ca 0.35 0.75 0.01 0.00 -0.60 0.00 0.00 56.93 57.44 2ga5 s PHE 91 Cb -0.11 -2.13 -0.04 0.00 0.51 0.00 0.00 43.02 41.26 2ga5 s PHE 91 CO 0.25 0.67 0.25 0.34 0.70 0.00 0.00 175.22 177.42 2ga5 s ASP 92 N -0.96 6.33 -0.28 1.36 -1.08 -0.26 -0.97 116.67 120.81 2ga5 s ASP 92 Ca 0.19 0.21 -0.29 0.00 -0.52 0.00 0.00 52.55 52.14 2ga5 s ASP 92 Cb -0.14 -1.92 -0.02 0.00 -1.46 0.00 0.00 42.92 39.37 2ga5 s ASP 92 CO 0.08 0.11 1.70 -1.48 0.52 0.00 0.00 175.17 176.10 2ga5 s LEU 93 N -2.90 3.70 -0.28 -1.34 0.05 -1.26 -1.01 118.68 115.64 2ga5 s LEU 93 Ca 0.35 1.45 0.01 0.00 0.05 0.00 0.00 54.13 55.98 2ga5 s LEU 93 Cb -0.12 -3.53 0.08 0.00 -2.05 0.00 0.00 46.19 40.57 2ga5 s LEU 93 CO 0.28 -1.48 0.02 -0.22 -0.55 0.00 0.00 176.35 174.40 2ga5 s LEU 94 N 6.01 2.82 -0.45 1.48 1.98 0.38 -4.92 118.68 125.98 2ga5 s LEU 94 Ca 0.75 -1.49 -0.34 0.00 -2.89 0.00 0.00 54.13 50.17 2ga5 s LEU 94 Cb -0.23 -1.14 0.05 0.00 0.66 0.00 0.00 46.19 45.53 2ga5 s LEU 94 CO 0.32 -0.32 0.62 0.59 -1.89 0.00 0.00 176.35 175.66 2ga5 n ASN 95 N 4.66 -5.02 -1.13 3.68 3.02 -1.26 0.12 115.26 119.33 2ga5 n ASN 95 Ca -0.06 -0.22 -0.06 0.00 -0.03 0.00 0.00 54.58 54.21 2ga5 n ASN 95 Cb 0.43 -1.48 -0.03 0.00 -0.61 0.00 0.00 39.78 38.10 2ga5 n ASN 95 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2ga5 n GLY 96 N -0.29 0.59 2.86 7.41 0.00 -1.26 -4.85 105.19 109.65 2ga5 n GLY 96 Ca -0.10 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.76 2ga5 n GLY 96 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2ga5 s GLU 97 N -2.46 0.05 -0.29 1.61 2.56 0.32 -4.97 118.70 115.52 2ga5 s GLU 97 Ca 0.00 0.43 -0.27 0.00 0.00 0.00 0.00 54.97 55.14 2ga5 s GLU 97 Cb 0.00 -0.24 0.01 0.00 2.00 0.00 0.00 34.13 35.90 2ga5 s GLU 97 CO 0.00 -0.23 0.94 -1.58 -0.56 0.00 0.00 175.26 173.83 2ga5 s TRP 98 N 1.66 3.22 0.07 5.30 0.52 -1.26 0.14 118.94 128.59 2ga5 s TRP 98 Ca -0.04 1.12 0.03 0.00 0.02 0.00 0.00 56.10 57.23 2ga5 s TRP 98 Cb -0.12 -3.37 -0.03 0.00 -1.15 0.00 0.00 33.47 28.80 2ga5 s TRP 98 CO -0.05 -0.60 -0.10 0.14 0.02 0.00 0.00 176.95 176.36 2ga5 s VAL 99 N 3.23 0.82 -0.11 4.03 -7.23 -0.18 -3.45 120.40 117.51 2ga5 s VAL 99 Ca 0.39 -1.33 -0.03 0.00 -1.81 0.00 0.00 61.98 59.21 2ga5 s VAL 99 Cb -0.14 -0.99 -0.03 0.00 0.56 0.00 0.00 36.38 35.78 2ga5 s VAL 99 CO 0.12 -0.40 -0.00 -0.55 -0.31 0.00 0.00 175.10 173.95 2ga5 s SER 100 N -1.91 5.15 0.27 4.85 0.15 0.15 -1.10 113.70 121.25 2ga5 s SER 100 Ca -0.03 0.07 0.13 0.00 0.70 0.00 0.00 55.95 56.83 2ga5 s SER 100 Cb -0.07 -1.58 0.94 0.00 -1.71 0.00 0.00 66.02 63.60 2ga5 s SER 100 CO 0.01 0.31 1.18 -0.11 1.20 0.00 0.00 173.24 175.83 2ga5 n LEU 101 N 2.60 0.21 -3.36 3.45 7.94 -1.26 -1.29 117.00 125.28 2ga5 n LEU 101 Ca -0.18 1.25 -0.21 0.00 -1.11 0.00 0.00 56.01 55.76 2ga5 n LEU 101 Cb 0.53 -0.58 -0.15 0.00 0.53 0.00 0.00 43.42 43.75 2ga5 n LEU 101 CO 0.30 -1.38 1.60 -1.14 -1.11 0.00 0.00 177.39 175.66 2ga5 n ARG 102 N -4.75 0.00 -2.30 1.96 0.63 -1.26 -0.24 116.66 110.70 2ga5 n ARG 102 Ca 0.27 0.00 -0.05 0.00 -0.92 0.00 0.00 57.85 57.15 2ga5 n ARG 102 Cb 0.90 -0.88 -0.01 0.00 0.45 0.00 0.00 32.46 32.93 2ga5 n ARG 102 CO 0.00 0.00 0.00 -1.71 -2.51 0.00 0.00 177.63 173.41 2ga5 n ASN 103 N 5.39 -0.86 -2.67 6.15 5.15 -1.26 -0.71 115.26 126.45 2ga5 n ASN 103 Ca 0.50 0.19 -0.01 0.00 -0.60 0.00 0.00 54.58 54.66 2ga5 n ASN 103 Cb 0.08 -0.84 0.01 0.00 -0.53 0.00 0.00 39.78 38.49 2ga5 n ASN 103 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2ga5 n GLY 104 N -0.46 -0.95 3.92 8.20 0.00 0.67 -5.04 105.19 111.53 2ga5 n GLY 104 Ca 0.01 0.30 -0.24 0.00 0.00 0.00 0.00 46.02 46.09 2ga5 n GLY 104 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2ga5 s THR 105 N -3.03 5.09 0.25 2.61 -4.23 0.11 -4.89 115.64 111.54 2ga5 s THR 105 Ca 0.04 -0.91 0.10 0.00 -1.18 0.00 0.00 61.69 59.74 2ga5 s THR 105 Cb -0.01 -3.68 -0.05 0.00 1.34 0.00 0.00 72.50 70.11 2ga5 s THR 105 CO 0.55 -0.20 -0.17 -0.54 -0.54 0.00 0.00 174.62 173.72 2ga5 s LYS 106 N -3.51 1.52 0.00 3.99 1.02 -1.26 0.29 119.74 121.79 2ga5 s LYS 106 Ca 0.34 -1.69 0.00 0.00 0.02 0.00 0.00 55.97 54.64 2ga5 s LYS 106 Cb -0.10 -1.47 0.00 0.00 -0.52 0.00 0.00 37.83 35.74 2ga5 s LYS 106 CO 0.28 0.26 0.65 -0.11 -0.92 0.00 0.00 175.35 175.51 2ga5 n LEU 107 N -0.51 0.00 0.31 3.17 0.00 -1.22 -0.12 117.00 118.63 2ga5 n LEU 107 Ca -0.06 0.65 0.10 0.00 0.00 0.00 0.00 56.01 56.70 2ga5 n LEU 107 Cb 0.60 -0.15 0.50 0.00 0.00 0.00 0.00 43.42 44.37 2ga5 n LEU 107 CO 0.37 -0.15 1.09 0.00 0.00 0.00 0.00 177.39 178.69 2ga5 h THR 108 N 0.00 0.02 0.06 1.96 1.03 -1.97 0.41 112.91 114.41 2ga5 h THR 108 Ca 0.00 0.00 -0.11 0.00 -0.01 0.00 0.00 66.41 66.29 2ga5 h THR 108 Cb 0.00 0.40 0.01 0.00 -1.07 0.00 0.00 68.15 67.49 2ga5 h THR 108 CO 0.00 0.00 -0.49 -0.78 -0.01 0.00 0.00 175.52 174.24 2ga5 h ASP 109 N 0.00 0.32 0.69 0.00 3.58 -1.87 -1.47 116.42 117.66 2ga5 h ASP 109 Ca 0.02 -0.90 -0.18 0.00 0.42 0.00 0.00 57.03 56.39 2ga5 h ASP 109 Cb 1.25 -0.10 -0.02 0.00 1.72 0.00 0.00 39.33 42.18 2ga5 h ASP 109 CO -0.00 1.19 -0.82 0.40 -2.88 0.00 0.00 179.24 177.14 2ga5 h ILE 110 N -0.50 1.53 0.07 2.25 1.08 0.32 -1.62 117.51 120.63 2ga5 h ILE 110 Ca -0.08 -2.64 -0.27 0.00 -0.39 0.00 0.00 64.86 61.48 2ga5 h ILE 110 Cb 1.32 2.44 0.02 0.00 -3.07 0.00 0.00 36.82 37.53 2ga5 h ILE 110 CO 0.09 0.76 -1.12 0.25 -0.69 0.00 0.00 178.15 177.44 2ga5 h LEU 111 N 0.05 0.71 -0.12 1.44 7.12 -0.81 -0.43 115.31 123.27 2ga5 h LEU 111 Ca -0.02 -0.63 -0.18 0.00 0.13 0.00 0.00 57.88 57.18 2ga5 h LEU 111 Cb 1.43 -0.22 0.01 0.00 -0.53 0.00 0.00 40.66 41.35 2ga5 h LEU 111 CO 0.11 1.44 -0.61 0.74 -0.13 0.00 0.00 178.44 180.00 2ga5 h THR 112 N 0.25 1.33 -0.05 1.05 2.02 -1.30 -1.27 112.91 114.94 2ga5 h THR 112 Ca -0.14 -1.89 -0.22 0.00 0.77 0.00 0.00 66.41 64.93 2ga5 h THR 112 Cb 1.79 2.14 0.00 0.00 -1.74 0.00 0.00 68.15 70.34 2ga5 h THR 112 CO 0.21 0.58 -0.86 -0.08 0.37 0.00 0.00 175.52 175.74 2ga5 h GLU 113 N 0.26 0.52 -0.11 6.66 4.81 -1.39 -1.55 114.58 123.78 2ga5 h GLU 113 Ca -0.04 -0.48 -0.04 0.00 -0.13 0.00 0.00 59.36 58.66 2ga5 h GLU 113 Cb 1.25 0.12 -0.00 0.00 0.63 0.00 0.00 28.75 30.75 2ga5 h GLU 113 CO 0.13 1.12 -0.08 1.49 -0.73 0.00 0.00 179.01 180.94 2ga5 h GLU 114 N 0.33 0.25 -0.11 1.92 4.57 -1.13 -1.53 114.58 118.87 2ga5 h GLU 114 Ca -0.06 -0.12 -0.10 0.00 -1.18 0.00 0.00 59.36 57.90 2ga5 h GLU 114 Cb 1.47 -0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 30.05 2ga5 h GLU 114 CO 0.16 0.63 -0.38 -0.39 -1.18 0.00 0.00 179.01 177.85 2ga5 h VAL 115 N -0.12 1.29 -0.15 0.32 -1.51 -1.30 0.96 116.25 115.75 2ga5 h VAL 115 Ca 0.02 -1.43 -0.05 0.00 -1.23 0.00 0.00 66.70 64.01 2ga5 h VAL 115 Cb 0.56 1.63 -0.00 0.00 -2.13 0.00 0.00 31.29 31.35 2ga5 h VAL 115 CO 0.02 0.43 -0.12 -0.08 -1.23 0.00 0.00 177.57 176.59 2ga5 h GLU 116 N 0.20 0.34 0.00 5.19 4.81 -1.23 -1.43 114.58 122.45 2ga5 h GLU 116 Ca 0.02 -0.17 0.00 0.00 -0.13 0.00 0.00 59.36 59.08 2ga5 h GLU 116 Cb 0.76 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.14 2ga5 h GLU 116 CO 0.06 0.70 0.00 1.63 -0.73 0.00 0.00 179.01 180.67 2ga5 n LYS 117 N -4.59 0.22 0.02 1.92 5.02 -0.58 -0.39 118.16 119.78 2ga5 n LYS 117 Ca -0.06 0.19 -0.08 0.00 -2.02 0.00 0.00 58.31 56.34 2ga5 n LYS 117 Cb 0.34 -1.77 -0.13 0.00 -0.02 0.00 0.00 35.03 33.45 2ga5 n LYS 117 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2ga5 h ALA 118 N 2.58 0.57 0.00 7.82 0.00 -0.68 -2.39 119.26 127.16 2ga5 h ALA 118 Ca 0.00 -1.22 -0.30 0.00 0.00 0.00 0.00 54.91 53.39 2ga5 h ALA 118 Cb 0.69 0.21 -0.06 0.00 0.00 0.00 0.00 17.79 18.63 2ga5 h ALA 118 CO 0.00 1.43 -2.26 -0.89 0.00 0.00 0.00 179.25 177.53 2ga5 n ILE 119 N -3.19 1.12 -0.08 0.00 5.41 -0.55 -4.08 119.36 117.99 2ga5 n ILE 119 Ca -0.10 -0.76 -0.09 0.00 1.00 0.00 0.00 62.75 62.80 2ga5 n ILE 119 Cb 1.00 -0.42 -0.03 0.00 -0.71 0.00 0.00 39.64 39.48 2ga5 n ILE 119 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 176.55 176.31 2ga5 n SER 120 N -2.64 1.87 0.19 4.38 2.88 0.48 -1.97 113.62 118.81 2ga5 n SER 120 Ca -0.27 0.49 0.12 0.00 -1.33 0.00 0.00 58.87 57.88 2ga5 n SER 120 Cb 1.04 -0.83 0.66 0.00 -0.75 0.00 0.00 64.21 64.33 2ga5 n SER 120 CO 0.00 0.00 0.00 0.50 -1.23 0.00 0.00 175.04 174.31 2ga5 h LYS 121 N -1.00 0.00 0.00 -1.46 3.11 -1.48 -3.01 116.57 112.73 2ga5 h LYS 121 Ca -0.07 0.00 -0.18 0.00 -2.81 0.00 0.00 60.65 57.59 2ga5 h LYS 121 Cb 0.82 0.00 -0.03 0.00 -1.00 0.00 0.00 32.23 32.02 2ga5 h LYS 121 CO -0.04 0.00 -1.50 0.45 -2.81 0.00 0.00 179.45 175.55 2ga5 n SER 122 N -2.37 1.69 0.00 4.20 2.88 -1.19 -4.99 113.62 113.84 2ga5 n SER 122 Ca -0.02 0.28 0.00 0.00 -1.33 0.00 0.00 58.87 57.81 2ga5 n SER 122 Cb 0.09 -0.66 0.00 0.00 -0.75 0.00 0.00 64.21 62.89 2ga5 n SER 122 CO 0.00 0.00 0.00 1.67 -1.23 0.00 0.00 175.04 175.48