#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gg3 s HIS 2 N 0.00 3.47 0.33 2.03 2.46 -1.26 -1.67 115.29 120.65 1gg3 s HIS 2 Ca 0.00 0.92 0.08 0.00 0.47 0.00 0.00 55.06 56.53 1gg3 s HIS 2 Cb 0.00 -2.65 -0.04 0.00 -0.13 0.00 0.00 32.58 29.76 1gg3 s HIS 2 CO 0.00 0.05 0.18 0.00 -2.47 0.00 0.00 174.74 172.49 1gg3 s LYS 4 N -3.87 0.08 -0.18 0.00 1.02 -1.05 -3.28 119.74 112.46 1gg3 s LYS 4 Ca 0.38 0.64 -0.01 0.00 0.02 0.00 0.00 55.97 56.99 1gg3 s LYS 4 Cb -0.04 -0.18 -0.00 0.00 -0.52 0.00 0.00 37.83 37.09 1gg3 s LYS 4 CO 0.24 -0.30 -0.12 0.08 -0.92 0.00 0.00 175.35 174.33 1gg3 s VAL 5 N 2.32 2.91 -0.49 3.17 1.01 0.21 -1.01 120.40 128.52 1gg3 s VAL 5 Ca 0.02 -0.67 -0.25 0.00 0.00 0.00 0.00 61.98 61.08 1gg3 s VAL 5 Cb -0.12 -2.26 0.03 0.00 0.00 0.00 0.00 36.38 34.03 1gg3 s VAL 5 CO -0.07 0.49 0.93 -0.55 0.00 0.00 0.00 175.10 175.90 1gg3 s SER 6 N 1.02 6.45 0.69 3.32 0.15 0.04 0.91 113.70 126.27 1gg3 s SER 6 Ca -0.01 -0.02 -0.11 0.00 0.70 0.00 0.00 55.95 56.51 1gg3 s SER 6 Cb -0.15 -2.45 0.00 0.00 -1.71 0.00 0.00 66.02 61.72 1gg3 s SER 6 CO -0.02 -1.11 1.07 -0.76 1.20 0.00 0.00 173.24 173.62 1gg3 s LEU 7 N 3.83 3.01 0.00 3.45 1.43 0.11 -1.33 118.68 129.19 1gg3 s LEU 7 Ca 0.35 1.33 0.01 0.00 -1.03 0.00 0.00 54.13 54.79 1gg3 s LEU 7 Cb -0.11 -4.21 0.05 0.00 0.03 0.00 0.00 46.19 41.96 1gg3 s LEU 7 CO 0.24 -1.27 0.59 0.18 0.23 0.00 0.00 176.35 176.32 1gg3 n LEU 8 N -2.99 0.00 -0.57 1.79 4.77 -1.26 -1.47 117.00 117.28 1gg3 n LEU 8 Ca 0.07 0.04 0.06 0.00 -0.03 0.00 0.00 56.01 56.15 1gg3 n LEU 8 Cb 0.55 -0.04 0.19 0.00 -2.33 0.00 0.00 43.42 41.79 1gg3 n LEU 8 CO 0.57 -0.04 0.55 -0.90 -1.33 0.00 0.00 177.39 176.24 1gg3 n ASP 9 N -1.04 2.42 0.00 -1.43 3.85 -1.26 -4.75 116.55 114.33 1gg3 n ASP 9 Ca 0.01 -3.46 0.00 0.00 -0.71 0.00 0.00 54.79 50.63 1gg3 n ASP 9 Cb 0.00 -0.52 0.00 0.00 -1.35 0.00 0.00 41.12 39.26 1gg3 n ASP 9 CO 0.00 0.00 0.00 0.47 -1.01 0.00 0.00 177.20 176.66 1gg3 n ASP 10 N -1.14 0.00 -4.81 -1.12 10.43 -0.54 -4.96 116.55 114.40 1gg3 n ASP 10 Ca 0.21 0.00 -0.34 0.00 2.57 0.00 0.00 54.79 57.23 1gg3 n ASP 10 Cb 0.77 -1.35 -0.07 0.00 1.84 0.00 0.00 41.12 42.32 1gg3 n ASP 10 CO 0.00 0.00 0.00 -0.89 -1.07 0.00 0.00 177.20 175.24 1gg3 s THR 11 N -2.27 4.40 -0.15 -3.53 2.01 -1.25 -4.85 115.64 110.00 1gg3 s THR 11 Ca 0.00 1.48 -0.04 0.00 0.31 0.00 0.00 61.69 63.44 1gg3 s THR 11 Cb 0.00 -3.71 -0.03 0.00 0.01 0.00 0.00 72.50 68.77 1gg3 s THR 11 CO 0.00 -0.16 -0.01 -0.69 -0.69 0.00 0.00 174.62 173.06 1gg3 s VAL 12 N -1.98 4.12 -0.10 3.82 1.01 -1.26 0.08 120.40 126.08 1gg3 s VAL 12 Ca 0.57 -0.29 -0.02 0.00 0.00 0.00 0.00 61.98 62.24 1gg3 s VAL 12 Cb -0.12 -2.80 -0.03 0.00 0.00 0.00 0.00 36.38 33.43 1gg3 s VAL 12 CO 0.17 0.51 0.00 -0.47 0.00 0.00 0.00 175.10 175.31 1gg3 s TYR 13 N 0.13 3.16 -0.01 5.22 5.04 0.26 -4.92 117.35 126.23 1gg3 s TYR 13 Ca 0.00 0.15 0.04 0.00 -2.44 0.00 0.00 57.07 54.83 1gg3 s TYR 13 Cb -0.13 -1.82 -0.01 0.00 0.35 0.00 0.00 41.96 40.35 1gg3 s TYR 13 CO 0.02 0.42 -0.14 -1.21 -1.34 0.00 0.00 175.55 173.30 1gg3 s GLU 14 N -0.72 1.08 0.02 4.97 2.02 -1.26 0.64 118.70 125.44 1gg3 s GLU 14 Ca 0.11 -0.50 -0.01 0.00 0.02 0.00 0.00 54.97 54.59 1gg3 s GLU 14 Cb -0.12 -1.05 0.00 0.00 0.10 0.00 0.00 34.13 33.07 1gg3 s GLU 14 CO 0.02 0.29 0.03 0.00 0.02 0.00 0.00 175.26 175.62 1gg3 s VAL 16 N -2.90 0.50 0.23 0.00 1.01 -1.26 -1.40 120.40 116.58 1gg3 s VAL 16 Ca 0.01 -0.16 0.10 0.00 0.00 0.00 0.00 61.98 61.93 1gg3 s VAL 16 Cb -0.00 -0.50 -0.05 0.00 0.00 0.00 0.00 36.38 35.83 1gg3 s VAL 16 CO 0.01 0.19 -0.19 0.68 0.00 0.00 0.00 175.10 175.79 1gg3 s VAL 17 N 0.58 2.19 0.21 2.92 -7.23 -0.67 -4.91 120.40 113.49 1gg3 s VAL 17 Ca -0.07 -2.23 -0.30 0.00 -1.81 0.00 0.00 61.98 57.57 1gg3 s VAL 17 Cb -0.11 -2.14 -0.09 0.00 0.56 0.00 0.00 36.38 34.60 1gg3 s VAL 17 CO 0.00 -0.39 1.29 -0.70 -0.31 0.00 0.00 175.10 175.00 1gg3 s GLU 18 N -3.30 4.40 0.50 4.82 2.56 -1.26 -0.89 118.70 125.53 1gg3 s GLU 18 Ca 0.25 2.04 0.40 0.00 0.00 0.00 0.00 54.97 57.66 1gg3 s GLU 18 Cb -0.05 -3.19 1.58 0.00 2.00 0.00 0.00 34.13 34.48 1gg3 s GLU 18 CO 0.11 -0.22 1.61 -0.22 -0.56 0.00 0.00 175.26 175.98 1gg3 h LYS 19 N 5.17 0.03 -0.49 4.30 3.64 -1.99 0.90 116.57 128.13 1gg3 h LYS 19 Ca -0.45 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.93 1gg3 h LYS 19 Cb 1.22 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 33.03 1gg3 h LYS 19 CO 0.76 0.02 0.00 0.72 -2.27 0.00 0.00 179.45 178.68 1gg3 n HIS 20 N -4.35 1.44 -1.65 1.91 8.25 -1.26 -4.43 115.22 115.12 1gg3 n HIS 20 Ca 0.40 -0.72 -0.47 0.00 -0.26 0.00 0.00 57.72 56.68 1gg3 n HIS 20 Cb 1.69 -0.33 -0.04 0.00 1.12 0.00 0.00 29.99 32.43 1gg3 n HIS 20 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1gg3 n ALA 21 N 0.44 0.78 -1.62 -1.41 0.00 0.31 -4.78 120.51 114.22 1gg3 n ALA 21 Ca 0.24 0.45 -0.36 0.00 0.00 0.00 0.00 53.44 53.77 1gg3 n ALA 21 Cb 0.95 -2.27 0.08 0.00 0.00 0.00 0.00 19.45 18.21 1gg3 n ALA 21 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 1gg3 s LYS 22 N 0.41 2.41 0.51 0.00 2.20 -1.26 -2.76 119.74 121.25 1gg3 s LYS 22 Ca 0.76 2.00 -0.01 0.00 -0.36 0.00 0.00 55.97 58.37 1gg3 s LYS 22 Cb -0.73 -1.84 0.01 0.00 -1.51 0.00 0.00 37.83 33.77 1gg3 s LYS 22 CO 0.43 -1.69 0.03 0.41 -0.36 0.00 0.00 175.35 174.17 1gg3 n GLY 23 N 0.81 -0.13 0.00 5.54 0.00 1.37 -3.20 105.19 109.57 1gg3 n GLY 23 Ca 0.15 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 46.13 1gg3 n GLY 23 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1gg3 n GLN 24 N 2.61 0.00 -0.14 1.61 10.64 -1.26 -0.28 117.38 130.57 1gg3 n GLN 24 Ca 0.00 0.00 -0.02 0.00 -1.83 0.00 0.00 57.00 55.16 1gg3 n GLN 24 Cb 0.02 0.00 -0.00 0.00 -0.86 0.00 0.00 30.24 29.40 1gg3 n GLN 24 CO 0.00 0.00 0.00 -3.47 -1.83 0.00 0.00 177.06 171.76 1gg3 n ASP 25 N -2.48 -0.28 0.01 2.61 2.03 -1.20 0.43 116.55 117.67 1gg3 n ASP 25 Ca 0.00 0.61 -0.05 0.00 0.52 0.00 0.00 54.79 55.87 1gg3 n ASP 25 Cb 0.00 -0.12 -0.04 0.00 -0.72 0.00 0.00 41.12 40.24 1gg3 n ASP 25 CO 0.00 0.00 0.00 -0.07 -1.92 0.00 0.00 177.20 175.21 1gg3 h LEU 26 N 0.00 -0.13 -0.60 -2.67 3.38 -0.60 -2.65 115.31 112.04 1gg3 h LEU 26 Ca 0.10 -0.18 -0.02 0.00 0.09 0.00 0.00 57.88 57.87 1gg3 h LEU 26 Cb 0.19 0.03 -0.03 0.00 0.09 0.00 0.00 40.66 40.94 1gg3 h LEU 26 CO -0.34 0.43 0.31 0.25 0.09 0.00 0.00 178.44 179.18 1gg3 h LEU 27 N -1.01 0.77 0.86 1.67 7.12 -0.96 -1.35 115.31 122.42 1gg3 h LEU 27 Ca -0.02 -0.11 -0.04 0.00 0.13 0.00 0.00 57.88 57.84 1gg3 h LEU 27 Cb 0.30 -0.20 -0.00 0.00 -0.53 0.00 0.00 40.66 40.23 1gg3 h LEU 27 CO 0.03 0.67 -0.50 0.50 -0.13 0.00 0.00 178.44 179.01 1gg3 h LYS 28 N 0.82 -1.21 -0.97 1.25 3.64 0.86 -1.58 116.57 119.36 1gg3 h LYS 28 Ca 0.21 0.08 0.22 0.00 -1.27 0.00 0.00 60.65 59.89 1gg3 h LYS 28 Cb 0.09 0.28 -0.09 0.00 -0.41 0.00 0.00 32.23 32.10 1gg3 h LYS 28 CO -0.03 -0.81 0.62 -0.09 -2.27 0.00 0.00 179.45 176.87 1gg3 h ARG 29 N -1.26 0.50 0.57 1.90 9.65 -1.37 0.80 114.38 125.18 1gg3 h ARG 29 Ca -0.12 -0.03 -0.02 0.00 -1.10 0.00 0.00 59.98 58.71 1gg3 h ARG 29 Cb 1.00 -0.11 -0.01 0.00 -1.39 0.00 0.00 29.97 29.46 1gg3 h ARG 29 CO 0.14 0.33 -0.41 0.28 2.80 0.00 0.00 179.97 183.11 1gg3 h VAL 30 N 0.52 0.00 -0.85 0.20 2.07 -0.58 -2.50 116.25 115.11 1gg3 h VAL 30 Ca 0.54 0.00 0.22 0.00 0.82 0.00 0.00 66.70 68.28 1gg3 h VAL 30 Cb 1.18 0.00 -0.14 0.00 -1.52 0.00 0.00 31.29 30.81 1gg3 h VAL 30 CO -0.27 0.00 0.21 0.00 0.02 0.00 0.00 177.57 177.53 1gg3 h GLU 32 N 0.21 -0.32 -0.20 0.00 4.39 -0.91 0.11 114.58 117.86 1gg3 h GLU 32 Ca 0.52 0.02 0.05 0.00 0.34 0.00 0.00 59.36 60.30 1gg3 h GLU 32 Cb 1.02 0.07 -0.07 0.00 -0.10 0.00 0.00 28.75 29.67 1gg3 h GLU 32 CO -0.64 -0.21 -0.39 0.45 -1.16 0.00 0.00 179.01 177.06 1gg3 h HIS 33 N -0.33 -1.11 -0.58 4.33 3.86 -0.49 0.30 115.15 121.12 1gg3 h HIS 33 Ca 0.14 0.05 0.10 0.00 -1.16 0.00 0.00 60.37 59.49 1gg3 h HIS 33 Cb 0.57 0.52 -0.03 0.00 1.06 0.00 0.00 27.41 29.52 1gg3 h HIS 33 CO -0.55 -0.44 0.39 1.25 0.86 0.00 0.00 177.93 179.44 1gg3 h LEU 34 N -0.42 0.35 0.00 2.43 7.12 -0.91 0.28 115.31 124.16 1gg3 h LEU 34 Ca 0.10 0.01 0.00 0.00 0.13 0.00 0.00 57.88 58.12 1gg3 h LEU 34 Cb 0.59 -0.07 0.00 0.00 -0.53 0.00 0.00 40.66 40.66 1gg3 h LEU 34 CO -0.43 0.21 -0.22 0.59 -0.13 0.00 0.00 178.44 178.46 1gg3 n ASN 35 N -4.47 0.41 -2.14 1.25 3.02 -0.05 -4.94 115.26 108.36 1gg3 n ASN 35 Ca 0.09 0.28 -0.15 0.00 -0.03 0.00 0.00 54.58 54.78 1gg3 n ASN 35 Cb 0.37 -0.28 0.03 0.00 -0.61 0.00 0.00 39.78 39.29 1gg3 n ASN 35 CO 0.00 0.00 0.00 -0.11 -2.62 0.00 0.00 177.26 174.53 1gg3 n LEU 36 N -1.77 -2.42 -4.90 3.41 -0.00 0.99 -5.01 117.00 107.30 1gg3 n LEU 36 Ca 0.06 -0.22 -0.28 0.00 -0.00 0.00 0.00 56.01 55.56 1gg3 n LEU 36 Cb 0.38 -2.12 -0.02 0.00 -0.00 0.00 0.00 43.42 41.66 1gg3 n LEU 36 CO 0.31 0.21 0.36 -0.76 -0.00 0.00 0.00 177.39 177.51 1gg3 s LEU 37 N -4.62 3.83 -0.02 -1.96 1.43 -0.65 -5.01 118.68 111.67 1gg3 s LEU 37 Ca 0.24 0.90 -0.00 0.00 -1.03 0.00 0.00 54.13 54.23 1gg3 s LEU 37 Cb -0.10 -3.79 -0.01 0.00 0.03 0.00 0.00 46.19 42.31 1gg3 s LEU 37 CO 0.29 -0.40 -0.02 1.21 0.23 0.00 0.00 176.35 177.65 1gg3 n GLU 38 N -1.59 0.05 -2.28 1.70 4.07 -1.26 -4.71 120.64 116.61 1gg3 n GLU 38 Ca 0.00 0.02 -0.43 0.00 -0.06 0.00 0.00 57.16 56.69 1gg3 n GLU 38 Cb 0.55 -0.81 0.00 0.00 -0.06 0.00 0.00 31.44 31.11 1gg3 n GLU 38 CO 0.00 0.00 0.00 0.39 -0.06 0.00 0.00 177.13 177.46 1gg3 n GLU 39 N -2.82 3.16 -0.17 5.31 1.02 -1.26 -4.77 120.64 121.12 1gg3 n GLU 39 Ca -0.04 -3.15 -0.03 0.00 -0.02 0.00 0.00 57.16 53.92 1gg3 n GLU 39 Cb 0.53 -3.27 0.06 0.00 -0.02 0.00 0.00 31.44 28.75 1gg3 n GLU 39 CO 0.00 0.00 0.00 -0.44 1.18 0.00 0.00 177.13 177.87 1gg3 h ASP 40 N 6.65 0.28 0.00 1.62 5.19 -1.89 -3.33 116.42 124.93 1gg3 h ASP 40 Ca 0.47 0.05 0.00 0.00 -0.62 0.00 0.00 57.03 56.92 1gg3 h ASP 40 Cb 0.75 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.26 1gg3 h ASP 40 CO 1.61 0.19 0.00 -1.22 -3.12 0.00 0.00 179.24 176.71 1gg3 n TYR 41 N -4.94 0.00 -1.28 4.55 0.53 -1.26 -4.44 117.16 110.31 1gg3 n TYR 41 Ca 0.05 0.00 -0.40 0.00 -1.02 0.00 0.00 57.90 56.53 1gg3 n TYR 41 Cb 0.18 -0.45 -0.13 0.00 -1.03 0.00 0.00 39.34 37.91 1gg3 n TYR 41 CO 0.00 0.00 0.00 1.19 -1.02 0.00 0.00 176.86 177.03 1gg3 n PHE 42 N -1.97 0.62 -1.67 -0.72 0.99 -1.25 -4.25 117.46 109.20 1gg3 n PHE 42 Ca 0.00 0.42 0.00 0.00 -0.00 0.00 0.00 57.45 57.87 1gg3 n PHE 42 Cb 0.00 -2.10 0.00 0.00 -1.00 0.00 0.00 39.48 36.38 1gg3 n PHE 42 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1gg3 n GLY 43 N 5.98 0.77 1.87 1.37 0.00 -0.63 -4.77 105.19 109.78 1gg3 n GLY 43 Ca 0.56 -0.75 -0.01 0.00 0.00 0.00 0.00 46.02 45.82 1gg3 n GLY 43 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1gg3 n LEU 44 N 0.00 -4.41 -3.82 0.99 7.99 -0.54 -4.41 117.00 112.80 1gg3 n LEU 44 Ca 0.00 1.44 -0.04 0.00 -0.01 0.00 0.00 56.01 57.40 1gg3 n LEU 44 Cb 0.00 -2.23 0.00 0.00 -0.11 0.00 0.00 43.42 41.08 1gg3 n LEU 44 CO 0.00 -1.83 0.75 0.00 -1.51 0.00 0.00 177.39 174.80 1gg3 s ALA 45 N -0.34 -1.55 0.13 -1.18 0.00 -0.10 -4.54 121.76 114.18 1gg3 s ALA 45 Ca -0.06 -0.17 0.09 0.00 0.00 0.00 0.00 51.96 51.82 1gg3 s ALA 45 Cb 0.00 0.70 -0.04 0.00 0.00 0.00 0.00 23.12 23.78 1gg3 s ALA 45 CO 0.17 -1.05 -0.21 0.42 0.00 0.00 0.00 175.76 175.09 1gg3 s ILE 46 N -2.66 1.84 0.25 0.00 1.01 -1.26 -1.65 121.20 118.73 1gg3 s ILE 46 Ca 0.17 -1.71 0.01 0.00 0.00 0.00 0.00 60.65 59.12 1gg3 s ILE 46 Cb -0.02 -1.72 -0.04 0.00 0.01 0.00 0.00 42.46 40.68 1gg3 s ILE 46 CO 0.04 -0.12 0.15 -1.66 0.00 0.00 0.00 174.94 173.35 1gg3 s TRP 47 N -1.45 1.39 -0.17 3.97 1.48 -0.94 -0.44 118.94 122.78 1gg3 s TRP 47 Ca 0.11 -1.37 -0.04 0.00 -1.06 0.00 0.00 56.10 53.73 1gg3 s TRP 47 Cb -0.09 -0.70 -0.03 0.00 -1.16 0.00 0.00 33.47 31.50 1gg3 s TRP 47 CO 0.05 -0.58 -0.02 -0.51 -4.06 0.00 0.00 176.95 171.83 1gg3 s ASP 48 N -3.26 4.86 0.00 -2.66 1.11 -0.75 -1.77 116.67 114.20 1gg3 s ASP 48 Ca 0.38 -0.14 0.00 0.00 0.18 0.00 0.00 52.55 52.97 1gg3 s ASP 48 Cb 0.06 -1.81 0.00 0.00 1.07 0.00 0.00 42.92 42.24 1gg3 s ASP 48 CO 0.15 0.13 0.00 -0.46 1.18 0.00 0.00 175.17 176.18 1gg3 n ASN 49 N 3.78 0.00 -1.50 0.27 6.94 -1.26 -3.55 115.26 119.94 1gg3 n ASN 49 Ca -0.17 0.00 0.00 0.00 -0.02 0.00 0.00 54.58 54.39 1gg3 n ASN 49 Cb 0.52 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.94 1gg3 n ASN 49 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1gg3 n ALA 50 N -3.00 -2.70 0.00 -2.53 0.00 -1.26 -4.60 120.51 106.42 1gg3 n ALA 50 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1gg3 n ALA 50 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1gg3 n ALA 50 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1gg3 n THR 51 N -0.60 0.00 -3.90 0.00 -1.04 -1.26 -4.77 114.28 102.72 1gg3 n THR 51 Ca 0.00 0.00 -0.11 0.00 -2.04 0.00 0.00 64.05 61.90 1gg3 n THR 51 Cb 0.10 0.00 -0.11 0.00 -1.82 0.00 0.00 70.33 68.49 1gg3 n THR 51 CO 0.00 0.00 0.00 -0.44 -0.64 0.00 0.00 175.07 173.99 1gg3 s SER 52 N 0.00 0.07 0.52 8.00 0.01 -1.26 -5.16 113.70 115.88 1gg3 s SER 52 Ca 0.00 -0.20 -0.22 0.00 1.31 0.00 0.00 55.95 56.85 1gg3 s SER 52 Cb 0.00 0.15 -0.06 0.00 0.21 0.00 0.00 66.02 66.32 1gg3 s SER 52 CO 0.00 -0.23 1.27 -1.59 0.41 0.00 0.00 173.24 173.09 1gg3 s LYS 53 N -0.95 3.36 -0.14 12.44 -2.85 -1.26 -4.85 119.74 125.49 1gg3 s LYS 53 Ca -0.10 2.01 -0.02 0.00 -1.00 0.00 0.00 55.97 56.86 1gg3 s LYS 53 Cb -0.06 -2.28 0.05 0.00 -2.06 0.00 0.00 37.83 33.48 1gg3 s LYS 53 CO 0.00 -0.95 0.02 0.99 0.10 0.00 0.00 175.35 175.52 1gg3 s THR 54 N -1.43 0.45 0.32 3.79 2.01 -1.23 -4.99 115.64 114.57 1gg3 s THR 54 Ca 0.69 -0.26 -0.29 0.00 0.31 0.00 0.00 61.69 62.15 1gg3 s THR 54 Cb -0.35 -0.81 -0.10 0.00 0.01 0.00 0.00 72.50 71.25 1gg3 s THR 54 CO 0.41 -0.00 1.25 0.26 -0.69 0.00 0.00 174.62 175.85 1gg3 s TRP 55 N 1.91 3.18 0.22 4.92 0.52 -1.26 -1.80 118.94 126.62 1gg3 s TRP 55 Ca 0.02 1.49 -0.30 0.00 0.02 0.00 0.00 56.10 57.33 1gg3 s TRP 55 Cb -0.15 -3.58 -0.09 0.00 -1.15 0.00 0.00 33.47 28.51 1gg3 s TRP 55 CO -0.07 -1.52 1.28 -1.17 0.02 0.00 0.00 176.95 175.49 1gg3 s LEU 56 N -1.73 4.43 -0.18 2.99 0.20 0.41 -4.92 118.68 119.88 1gg3 s LEU 56 Ca 0.48 2.40 -0.28 0.00 0.69 0.00 0.00 54.13 57.43 1gg3 s LEU 56 Cb -0.38 -3.61 -0.00 0.00 -0.43 0.00 0.00 46.19 41.76 1gg3 s LEU 56 CO 0.50 -0.48 0.95 -0.62 -0.29 0.00 0.00 176.35 176.40 1gg3 s ASP 57 N 0.15 7.07 0.12 3.68 -1.08 -1.26 -4.78 116.67 120.56 1gg3 s ASP 57 Ca 0.55 1.33 -0.22 0.00 -0.52 0.00 0.00 52.55 53.68 1gg3 s ASP 57 Cb -0.36 -2.51 -0.07 0.00 -1.46 0.00 0.00 42.92 38.52 1gg3 s ASP 57 CO 0.40 -0.51 1.70 -1.28 0.52 0.00 0.00 175.17 175.99 1gg3 h SER 58 N 7.34 -0.26 0.96 -0.34 0.87 -1.92 -3.10 113.55 117.10 1gg3 h SER 58 Ca -0.26 0.05 0.00 0.00 -1.23 0.00 0.00 61.79 60.35 1gg3 h SER 58 Cb 1.11 0.13 0.00 0.00 -0.44 0.00 0.00 62.40 63.20 1gg3 h SER 58 CO 0.89 -0.12 0.00 0.00 -0.53 0.00 0.00 176.83 177.07 1gg3 h ALA 59 N 0.95 1.00 -1.81 6.23 0.00 -1.92 -3.07 119.26 120.65 1gg3 h ALA 59 Ca 0.06 0.00 -0.44 0.00 0.00 0.00 0.00 54.91 54.53 1gg3 h ALA 59 Cb 0.19 0.00 0.04 0.00 0.00 0.00 0.00 17.79 18.02 1gg3 h ALA 59 CO -0.14 0.00 -0.11 0.15 0.00 0.00 0.00 179.25 179.15 1gg3 s LYS 60 N -3.63 2.73 1.23 0.00 1.02 -1.17 -4.71 119.74 115.21 1gg3 s LYS 60 Ca 0.01 -0.82 -0.17 0.00 0.02 0.00 0.00 55.97 55.01 1gg3 s LYS 60 Cb 0.09 -2.57 0.29 0.00 -0.52 0.00 0.00 37.83 35.12 1gg3 s LYS 60 CO 0.52 -0.50 1.03 -1.21 -0.92 0.00 0.00 175.35 174.27 1gg3 s GLU 61 N -4.61 -1.40 -0.26 1.68 2.02 -1.26 0.41 118.70 115.28 1gg3 s GLU 61 Ca 0.54 0.30 -0.11 0.00 0.02 0.00 0.00 54.97 55.73 1gg3 s GLU 61 Cb -0.10 -1.54 -0.15 0.00 0.10 0.00 0.00 34.13 32.44 1gg3 s GLU 61 CO 0.37 -3.91 -0.21 -0.89 0.02 0.00 0.00 175.26 170.63 1gg3 n ILE 62 N -4.97 1.54 -0.30 -1.63 5.41 -1.11 -3.89 119.36 114.41 1gg3 n ILE 62 Ca 0.09 -0.41 0.09 0.00 1.00 0.00 0.00 62.75 63.53 1gg3 n ILE 62 Cb 0.58 -1.78 0.22 0.00 -0.71 0.00 0.00 39.64 37.95 1gg3 n ILE 62 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 176.55 177.05 1gg3 h LYS 63 N -0.69 0.08 -0.74 0.38 3.64 -1.84 0.06 116.57 117.47 1gg3 h LYS 63 Ca -0.62 -0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 58.75 1gg3 h LYS 63 Cb 1.68 -0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 33.44 1gg3 h LYS 63 CO -0.29 0.05 0.43 0.87 -2.27 0.00 0.00 179.45 178.24 1gg3 h LYS 64 N 0.08 1.01 0.00 1.90 1.57 -1.95 -2.67 116.57 116.51 1gg3 h LYS 64 Ca 0.50 -0.10 0.00 0.00 -1.87 0.00 0.00 60.65 59.17 1gg3 h LYS 64 Cb 0.94 -0.21 0.00 0.00 0.08 0.00 0.00 32.23 33.05 1gg3 h LYS 64 CO -0.77 0.73 0.00 1.04 -0.57 0.00 0.00 179.45 179.89 1gg3 n GLN 65 N -4.49 0.02 -2.31 3.15 6.02 -0.02 -3.63 117.38 116.12 1gg3 n GLN 65 Ca 0.07 0.22 -0.20 0.00 -0.01 0.00 0.00 57.00 57.08 1gg3 n GLN 65 Cb 0.07 -1.54 0.02 0.00 1.02 0.00 0.00 30.24 29.81 1gg3 n GLN 65 CO 0.00 0.00 0.00 1.33 -1.01 0.00 0.00 177.06 177.38 1gg3 n VAL 66 N -1.59 2.20 -2.52 5.09 0.24 -1.01 -5.01 118.33 115.73 1gg3 n VAL 66 Ca 0.04 -4.16 -0.42 0.00 -2.04 0.00 0.00 64.34 57.77 1gg3 n VAL 66 Cb 0.21 -0.71 -0.03 0.00 -1.47 0.00 0.00 33.84 31.84 1gg3 n VAL 66 CO 0.00 0.00 0.00 -0.13 -2.14 0.00 0.00 176.83 174.56 1gg3 s ARG 67 N -3.58 4.52 0.00 7.34 0.52 -1.24 -2.27 118.95 124.25 1gg3 s ARG 67 Ca 0.45 1.67 0.00 0.00 -0.52 0.00 0.00 55.73 57.33 1gg3 s ARG 67 Cb 0.40 -3.35 0.00 0.00 0.52 0.00 0.00 34.95 32.52 1gg3 s ARG 67 CO -0.04 -0.08 0.00 0.41 0.02 0.00 0.00 175.30 175.61 1gg3 n GLY 68 N 2.72 0.79 3.41 -3.53 0.00 -1.26 -4.97 105.19 102.35 1gg3 n GLY 68 Ca 0.06 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.79 1gg3 n GLY 68 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1gg3 s VAL 69 N -3.00 2.43 0.57 1.61 1.01 -0.96 -5.13 120.40 116.92 1gg3 s VAL 69 Ca 0.00 -1.58 -0.15 0.00 0.00 0.00 0.00 61.98 60.26 1gg3 s VAL 69 Cb 0.00 -2.06 -0.05 0.00 0.00 0.00 0.00 36.38 34.27 1gg3 s VAL 69 CO 0.00 0.17 1.02 -2.16 0.00 0.00 0.00 175.10 174.12 1gg3 s PRO 70 N -1.87 3.66 -1.41 2.72 0.04 -1.26 -4.89 135.00 131.99 1gg3 s PRO 70 Ca 0.15 0.95 -0.09 0.00 0.04 0.00 0.00 61.00 62.05 1gg3 s PRO 70 Cb -0.10 -2.09 -0.08 0.00 0.04 0.00 0.00 34.50 32.27 1gg3 s PRO 70 CO 0.06 -0.51 2.70 0.91 0.04 0.00 0.00 177.00 180.19 1gg3 n TRP 71 N -2.08 2.13 -5.19 0.56 7.02 -1.26 -4.86 117.44 113.76 1gg3 n TRP 71 Ca 0.07 -2.76 -0.32 0.00 -1.02 0.00 0.00 57.50 53.47 1gg3 n TRP 71 Cb 0.54 -2.25 -0.17 0.00 -2.42 0.00 0.00 31.31 27.01 1gg3 n TRP 71 CO 0.00 0.00 0.00 -0.80 -2.02 0.00 0.00 177.69 174.87 1gg3 s ASN 72 N 2.57 3.15 0.11 -0.99 0.01 -1.26 -2.54 114.94 115.99 1gg3 s ASN 72 Ca 0.61 -0.54 0.01 0.00 -0.71 0.00 0.00 52.86 52.22 1gg3 s ASN 72 Cb 0.16 -1.40 -0.00 0.00 0.41 0.00 0.00 41.25 40.42 1gg3 s ASN 72 CO -0.05 0.16 0.03 0.49 -1.51 0.00 0.00 177.10 176.23 1gg3 n PHE 73 N 3.49 0.07 -3.82 2.20 3.01 -0.18 -4.60 117.46 117.63 1gg3 n PHE 73 Ca -0.19 -0.69 -0.12 0.00 1.01 0.00 0.00 57.45 57.45 1gg3 n PHE 73 Cb 0.53 -0.01 -0.13 0.00 -0.01 0.00 0.00 39.48 39.86 1gg3 n PHE 73 CO 0.00 0.00 0.00 0.95 1.01 0.00 0.00 176.76 178.72 1gg3 s THR 74 N -1.89 -0.01 -0.10 4.37 -4.23 -0.73 -0.78 115.64 112.27 1gg3 s THR 74 Ca 0.05 0.02 -0.25 0.00 -1.18 0.00 0.00 61.69 60.33 1gg3 s THR 74 Cb 0.00 -0.19 -0.03 0.00 1.34 0.00 0.00 72.50 73.63 1gg3 s THR 74 CO 0.03 0.01 0.77 0.12 -0.54 0.00 0.00 174.62 175.01 1gg3 s PHE 75 N 0.18 3.52 0.34 3.99 2.19 -0.44 -2.20 117.98 125.55 1gg3 s PHE 75 Ca -0.01 1.28 0.02 0.00 0.33 0.00 0.00 56.93 58.54 1gg3 s PHE 75 Cb -0.02 -2.91 -0.01 0.00 -1.31 0.00 0.00 43.02 38.77 1gg3 s PHE 75 CO -0.00 -0.05 0.40 -0.80 1.83 0.00 0.00 175.22 176.60 1gg3 s ASN 76 N 0.97 1.26 -0.16 6.13 -0.87 -0.66 -3.99 114.94 117.62 1gg3 s ASN 76 Ca 0.39 -1.61 -0.11 0.00 -1.57 0.00 0.00 52.86 49.96 1gg3 s ASN 76 Cb -0.18 0.63 -0.05 0.00 -0.02 0.00 0.00 41.25 41.64 1gg3 s ASN 76 CO 0.17 -1.22 0.21 -0.69 -2.57 0.00 0.00 177.10 173.00 1gg3 s VAL 77 N -3.16 5.37 -0.27 1.60 1.01 -1.26 -0.93 120.40 122.76 1gg3 s VAL 77 Ca 0.35 0.36 -0.12 0.00 0.00 0.00 0.00 61.98 62.57 1gg3 s VAL 77 Cb 0.01 -3.53 -0.13 0.00 0.00 0.00 0.00 36.38 32.72 1gg3 s VAL 77 CO 0.24 0.47 -0.29 1.17 0.00 0.00 0.00 175.10 176.68 1gg3 n LYS 78 N 3.10 0.60 -3.87 2.72 4.81 -1.26 -4.56 118.16 119.70 1gg3 n LYS 78 Ca -0.15 0.26 -0.35 0.00 -0.87 0.00 0.00 58.31 57.20 1gg3 n LYS 78 Cb 0.53 -1.51 -0.14 0.00 0.02 0.00 0.00 35.03 33.93 1gg3 n LYS 78 CO 0.00 0.00 0.00 -0.06 1.17 0.00 0.00 177.40 178.51 1gg3 s PHE 79 N -2.50 3.01 -0.33 5.64 0.40 -1.26 -4.82 117.98 118.12 1gg3 s PHE 79 Ca -0.38 -0.94 -0.22 0.00 -0.60 0.00 0.00 56.93 54.79 1gg3 s PHE 79 Cb 0.13 -2.14 0.00 0.00 0.51 0.00 0.00 43.02 41.52 1gg3 s PHE 79 CO 0.52 -0.55 0.72 0.71 0.70 0.00 0.00 175.22 177.32 1gg3 s TYR 80 N 1.48 3.17 0.34 0.36 1.51 -1.26 -1.60 117.35 121.35 1gg3 s TYR 80 Ca 0.05 0.60 -0.29 0.00 -1.01 0.00 0.00 57.07 56.42 1gg3 s TYR 80 Cb -0.15 -3.19 -0.11 0.00 -0.11 0.00 0.00 41.96 38.40 1gg3 s TYR 80 CO -0.02 -0.60 1.50 -1.25 -1.11 0.00 0.00 175.55 174.08 1gg3 s PRO 81 N 2.86 4.15 0.13 -1.71 0.04 -1.26 -4.82 135.00 134.38 1gg3 s PRO 81 Ca 0.29 2.52 -0.19 0.00 0.04 0.00 0.00 61.00 63.66 1gg3 s PRO 81 Cb -0.14 -3.01 -0.06 0.00 0.04 0.00 0.00 34.50 31.34 1gg3 s PRO 81 CO 0.14 -0.53 1.78 -1.35 0.04 0.00 0.00 177.00 177.08 1gg3 h PRO 82 N 3.80 0.31 -3.31 0.56 0.11 -1.99 -3.32 132.00 128.16 1gg3 h PRO 82 Ca -0.49 -0.02 -0.64 0.00 0.11 0.00 0.00 66.00 64.96 1gg3 h PRO 82 Cb 1.23 -0.07 -0.41 0.00 0.11 0.00 0.00 31.00 31.86 1gg3 h PRO 82 CO 0.70 0.21 -0.58 0.34 -0.21 0.00 0.00 178.00 178.46 1gg3 s ASP 83 N -5.42 4.55 0.60 -2.05 2.15 -1.26 -4.93 116.67 110.31 1gg3 s ASP 83 Ca -0.13 -3.26 0.29 0.00 0.43 0.00 0.00 52.55 49.88 1gg3 s ASP 83 Cb 0.09 -1.66 1.50 0.00 -0.30 0.00 0.00 42.92 42.55 1gg3 s ASP 83 CO 0.70 -0.20 1.92 1.55 -0.17 0.00 0.00 175.17 178.97 1gg3 h PRO 84 N 6.22 0.00 -0.64 4.34 0.13 -1.96 0.37 132.00 140.46 1gg3 h PRO 84 Ca -0.01 0.00 0.05 0.00 -0.87 0.00 0.00 66.00 65.17 1gg3 h PRO 84 Cb 0.86 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 31.95 1gg3 h PRO 84 CO 0.70 0.00 0.42 0.00 -0.23 0.00 0.00 178.00 178.90 1gg3 h ALA 85 N 1.48 1.74 0.00 -0.56 0.00 -1.93 -0.31 119.26 119.67 1gg3 h ALA 85 Ca 0.18 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.07 1gg3 h ALA 85 Cb 1.06 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.68 1gg3 h ALA 85 CO -0.00 0.17 0.00 0.94 0.00 0.00 0.00 179.25 180.35 1gg3 n GLN 86 N -4.47 0.08 -2.10 0.00 -0.06 0.13 -4.79 117.38 106.17 1gg3 n GLN 86 Ca 0.09 0.25 -0.41 0.00 -2.00 0.00 0.00 57.00 54.93 1gg3 n GLN 86 Cb 0.20 -1.50 -0.02 0.00 -4.06 0.00 0.00 30.24 24.86 1gg3 n GLN 86 CO 0.00 0.00 0.00 -0.51 -0.20 0.00 0.00 177.06 176.35 1gg3 s LEU 87 N -2.71 4.41 0.61 1.69 1.43 -0.13 -4.93 118.68 119.04 1gg3 s LEU 87 Ca 0.07 2.61 0.36 0.00 -1.03 0.00 0.00 54.13 56.14 1gg3 s LEU 87 Cb 0.06 -3.63 1.97 0.00 0.03 0.00 0.00 46.19 44.62 1gg3 s LEU 87 CO 0.14 -0.59 2.25 0.74 0.23 0.00 0.00 176.35 179.12 1gg3 h THR 88 N 3.39 0.26 -4.44 5.49 2.02 -1.89 -3.45 112.91 114.29 1gg3 h THR 88 Ca -0.47 -0.15 -0.20 0.00 0.77 0.00 0.00 66.41 66.35 1gg3 h THR 88 Cb 1.22 1.12 -0.14 0.00 -1.74 0.00 0.00 68.15 68.60 1gg3 h THR 88 CO 0.73 0.02 -0.58 -1.61 0.37 0.00 0.00 175.52 174.45 1gg3 s GLU 89 N -4.25 1.14 -0.03 6.66 2.02 -1.26 -5.07 118.70 117.91 1gg3 s GLU 89 Ca -0.04 -1.52 -0.01 0.00 0.02 0.00 0.00 54.97 53.42 1gg3 s GLU 89 Cb 0.13 0.28 -0.27 0.00 0.10 0.00 0.00 34.13 34.38 1gg3 s GLU 89 CO 0.50 -0.37 0.72 -0.44 0.02 0.00 0.00 175.26 175.69 1gg3 h ASP 90 N 2.67 0.33 -0.31 -0.19 5.19 -2.00 -3.19 116.42 118.92 1gg3 h ASP 90 Ca -0.35 -0.54 -0.01 0.00 -0.62 0.00 0.00 57.03 55.51 1gg3 h ASP 90 Cb 1.23 -0.11 -0.02 0.00 0.18 0.00 0.00 39.33 40.62 1gg3 h ASP 90 CO 0.53 1.46 0.16 0.16 -3.12 0.00 0.00 179.24 178.43 1gg3 h ILE 91 N 0.06 1.13 0.04 0.35 -0.00 -1.97 0.48 117.51 117.59 1gg3 h ILE 91 Ca -0.29 -0.39 0.01 0.00 -0.00 0.00 0.00 64.86 64.19 1gg3 h ILE 91 Cb 2.02 0.70 -0.02 0.00 -0.00 0.00 0.00 36.82 39.52 1gg3 h ILE 91 CO 0.13 0.15 -0.09 0.74 -0.00 0.00 0.00 178.15 179.08 1gg3 h THR 92 N 0.49 0.77 -0.01 0.16 2.02 -1.96 -0.18 112.91 114.21 1gg3 h THR 92 Ca 0.12 0.00 -0.07 0.00 0.77 0.00 0.00 66.41 67.23 1gg3 h THR 92 Cb 0.08 0.77 -0.01 0.00 -1.74 0.00 0.00 68.15 67.25 1gg3 h THR 92 CO -0.02 0.00 -0.33 0.03 0.37 0.00 0.00 175.52 175.57 1gg3 h ARG 93 N -0.18 0.02 -0.33 6.66 3.08 -1.19 -0.62 114.38 121.82 1gg3 h ARG 93 Ca 0.02 -0.01 -0.02 0.00 0.07 0.00 0.00 59.98 60.04 1gg3 h ARG 93 Cb 0.21 -0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.24 1gg3 h ARG 93 CO -0.07 0.35 0.11 -0.92 -1.07 0.00 0.00 179.97 178.38 1gg3 h TYR 94 N 0.02 0.53 -0.26 3.04 3.20 0.83 0.42 116.97 124.75 1gg3 h TYR 94 Ca -0.00 -0.05 -0.15 0.00 3.14 0.00 0.00 58.73 61.67 1gg3 h TYR 94 Cb 0.60 -0.15 -0.01 0.00 1.54 0.00 0.00 36.73 38.71 1gg3 h TYR 94 CO 0.00 0.51 -0.45 1.88 -1.64 0.00 0.00 178.16 178.46 1gg3 h TYR 95 N 0.39 0.81 -0.69 -3.82 0.99 -0.77 -0.69 116.97 113.20 1gg3 h TYR 95 Ca 0.11 -0.26 0.03 0.00 2.00 0.00 0.00 58.73 60.61 1gg3 h TYR 95 Cb 0.23 -0.17 -0.04 0.00 1.00 0.00 0.00 36.73 37.75 1gg3 h TYR 95 CO 0.00 1.00 0.46 1.25 -0.00 0.00 0.00 178.16 180.87 1gg3 h LEU 96 N 0.54 0.72 -0.02 3.88 6.46 -0.88 -0.90 115.31 125.11 1gg3 h LEU 96 Ca 0.03 -0.01 -0.26 0.00 -0.12 0.00 0.00 57.88 57.53 1gg3 h LEU 96 Cb 1.00 -0.17 0.02 0.00 -0.73 0.00 0.00 40.66 40.78 1gg3 h LEU 96 CO 0.09 0.49 -0.99 0.00 -0.62 0.00 0.00 178.44 177.42 1gg3 h LEU 98 N 0.39 0.57 0.20 0.00 3.38 -0.55 0.10 115.31 119.40 1gg3 h LEU 98 Ca -0.12 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.85 1gg3 h LEU 98 Cb 1.64 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 42.28 1gg3 h LEU 98 CO 0.20 0.37 -0.10 -0.61 0.09 0.00 0.00 178.44 178.39 1gg3 h GLN 99 N 0.65 -0.26 -0.82 1.13 5.75 -1.10 -2.31 115.11 118.15 1gg3 h GLN 99 Ca 0.29 0.02 0.10 0.00 -0.15 0.00 0.00 58.65 58.90 1gg3 h GLN 99 Cb 0.31 0.06 -0.06 0.00 1.07 0.00 0.00 27.48 28.86 1gg3 h GLN 99 CO -0.09 0.13 0.53 -0.07 -2.65 0.00 0.00 178.83 176.68 1gg3 h LEU 100 N -0.89 0.69 -1.10 -2.39 3.38 -1.13 0.89 115.31 114.76 1gg3 h LEU 100 Ca -0.03 0.02 -0.05 0.00 0.09 0.00 0.00 57.88 57.91 1gg3 h LEU 100 Cb 0.51 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.11 1gg3 h LEU 100 CO 0.04 0.41 0.12 0.03 0.09 0.00 0.00 178.44 179.13 1gg3 h ARG 101 N 0.76 0.76 -0.53 1.13 3.08 -0.83 0.11 114.38 118.86 1gg3 h ARG 101 Ca 0.38 -0.15 -0.12 0.00 0.07 0.00 0.00 59.98 60.16 1gg3 h ARG 101 Cb 0.44 -0.12 -0.02 0.00 0.08 0.00 0.00 29.97 30.36 1gg3 h ARG 101 CO -0.15 0.69 -0.12 0.37 -1.07 0.00 0.00 179.97 179.69 1gg3 h GLN 102 N 0.74 1.01 0.23 0.04 5.75 0.68 -2.50 115.11 121.04 1gg3 h GLN 102 Ca 0.16 -0.38 -0.01 0.00 -0.15 0.00 0.00 58.65 58.28 1gg3 h GLN 102 Cb 0.28 -0.06 0.00 0.00 1.07 0.00 0.00 27.48 28.77 1gg3 h GLN 102 CO -0.00 1.06 -0.11 -0.44 -2.65 0.00 0.00 178.83 176.69 1gg3 h ASP 103 N 0.89 -0.26 -0.16 -0.69 3.32 0.15 -3.19 116.42 116.49 1gg3 h ASP 103 Ca 0.14 -0.16 0.05 0.00 0.02 0.00 0.00 57.03 57.07 1gg3 h ASP 103 Cb 0.69 0.07 -0.07 0.00 0.22 0.00 0.00 39.33 40.23 1gg3 h ASP 103 CO 0.05 0.02 -0.40 0.40 -1.72 0.00 0.00 179.24 177.59 1gg3 h ILE 104 N -0.54 0.17 -0.08 0.35 2.04 -0.74 -1.84 117.51 116.87 1gg3 h ILE 104 Ca -0.03 0.00 0.02 0.00 1.00 0.00 0.00 64.86 65.85 1gg3 h ILE 104 Cb 0.40 0.17 -0.00 0.00 -0.74 0.00 0.00 36.82 36.65 1gg3 h ILE 104 CO 0.05 0.00 0.11 0.58 0.00 0.00 0.00 178.15 178.89 1gg3 h VAL 105 N -0.46 0.36 0.00 1.67 2.07 -1.54 -3.16 116.25 115.20 1gg3 h VAL 105 Ca 0.09 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.61 1gg3 h VAL 105 Cb 0.61 0.91 0.00 0.00 -1.52 0.00 0.00 31.29 31.28 1gg3 h VAL 105 CO -0.40 0.00 0.00 0.00 0.02 0.00 0.00 177.57 177.19 1gg3 n ALA 106 N -2.25 -0.13 0.00 1.67 0.00 -0.72 -4.13 120.51 114.95 1gg3 n ALA 106 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.43 1gg3 n ALA 106 Cb 0.20 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.65 1gg3 n ALA 106 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1gg3 n GLY 107 N 1.13 0.00 0.36 0.00 0.00 -1.05 -4.91 105.19 100.72 1gg3 n GLY 107 Ca 0.00 0.00 0.17 0.00 0.00 0.00 0.00 46.02 46.19 1gg3 n GLY 107 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1gg3 h ARG 108 N 0.00 0.09 -4.42 1.61 2.43 -1.72 -3.34 114.38 109.02 1gg3 h ARG 108 Ca 0.00 -0.01 -0.63 0.00 -0.81 0.00 0.00 59.98 58.53 1gg3 h ARG 108 Cb 0.00 -0.02 -0.39 0.00 -0.42 0.00 0.00 29.97 29.14 1gg3 h ARG 108 CO 0.00 0.06 -0.76 -1.17 -1.51 0.00 0.00 179.97 176.59 1gg3 s LEU 109 N -8.93 3.46 0.05 3.80 0.20 -1.19 -4.91 118.68 111.17 1gg3 s LEU 109 Ca -0.06 -1.66 0.01 0.00 0.69 0.00 0.00 54.13 53.12 1gg3 s LEU 109 Cb 0.19 -1.35 -0.04 0.00 -0.43 0.00 0.00 46.19 44.57 1gg3 s LEU 109 CO 0.73 -0.31 0.15 -2.16 -0.29 0.00 0.00 176.35 174.46 1gg3 s PRO 110 N 1.21 3.19 0.27 0.98 0.04 -1.26 -4.41 135.00 135.02 1gg3 s PRO 110 Ca 0.03 -0.53 -0.21 0.00 0.04 0.00 0.00 61.00 60.33 1gg3 s PRO 110 Cb -0.19 -2.91 0.03 0.00 0.04 0.00 0.00 34.50 31.48 1gg3 s PRO 110 CO -0.10 0.60 0.78 0.00 0.04 0.00 0.00 177.00 178.33 1gg3 s SER 112 N -2.96 6.61 0.53 0.00 1.04 -1.26 -4.75 113.70 112.91 1gg3 s SER 112 Ca 0.12 2.30 0.41 0.00 0.48 0.00 0.00 55.95 59.25 1gg3 s SER 112 Cb -0.05 -2.61 1.59 0.00 0.10 0.00 0.00 66.02 65.05 1gg3 s SER 112 CO 0.07 -0.61 1.68 0.15 0.98 0.00 0.00 173.24 175.51 1gg3 h PHE 113 N 2.70 0.11 0.78 5.02 3.57 -2.02 0.90 116.94 128.00 1gg3 h PHE 113 Ca -0.48 0.00 -0.04 0.00 3.53 0.00 0.00 57.97 60.98 1gg3 h PHE 113 Cb 1.23 -0.03 0.01 0.00 2.79 0.00 0.00 35.95 39.95 1gg3 h PHE 113 CO 0.56 -0.03 -0.37 0.00 -2.23 0.00 0.00 178.31 176.24 1gg3 h ALA 114 N 1.28 -1.16 -0.19 2.41 0.00 -1.99 -2.86 119.26 116.75 1gg3 h ALA 114 Ca 0.76 -0.23 -0.02 0.00 0.00 0.00 0.00 54.91 55.43 1gg3 h ALA 114 Cb 2.91 0.40 -0.01 0.00 0.00 0.00 0.00 17.79 21.09 1gg3 h ALA 114 CO -0.08 -1.08 0.06 1.79 0.00 0.00 0.00 179.25 179.93 1gg3 h THR 115 N -1.15 1.19 0.00 0.00 1.35 -1.48 0.11 112.91 112.93 1gg3 h THR 115 Ca -0.11 -0.60 0.00 0.00 -0.55 0.00 0.00 66.41 65.15 1gg3 h THR 115 Cb 0.80 1.23 0.00 0.00 -1.73 0.00 0.00 68.15 68.45 1gg3 h THR 115 CO 0.18 0.19 0.00 -0.11 -0.25 0.00 0.00 175.52 175.52 1gg3 n LEU 116 N -4.80 0.00 0.00 3.87 7.94 0.15 -0.97 117.00 123.18 1gg3 n LEU 116 Ca -0.04 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.86 1gg3 n LEU 116 Cb 0.15 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.10 1gg3 n LEU 116 CO 0.35 0.00 -0.45 0.00 -1.11 0.00 0.00 177.39 176.18 1gg3 n ALA 117 N -0.53 2.53 -0.45 1.96 0.00 -0.66 -4.42 120.51 118.93 1gg3 n ALA 117 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1gg3 n ALA 117 Cb 0.00 0.45 0.00 0.00 0.00 0.00 0.00 19.45 19.90 1gg3 n ALA 117 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 1gg3 n LEU 118 N -2.69 0.00 -0.33 0.00 0.00 0.28 -1.77 117.00 112.49 1gg3 n LEU 118 Ca 0.00 0.78 0.26 0.00 0.00 0.00 0.00 56.01 57.04 1gg3 n LEU 118 Cb 0.45 -0.28 0.48 0.00 0.00 0.00 0.00 43.42 44.08 1gg3 n LEU 118 CO 0.00 -0.28 0.98 -0.07 0.00 0.00 0.00 177.39 178.02 1gg3 h LEU 119 N 0.00 0.07 -2.17 -1.96 3.38 -1.46 1.02 115.31 114.19 1gg3 h LEU 119 Ca 0.00 0.26 -0.00 0.00 0.09 0.00 0.00 57.88 58.23 1gg3 h LEU 119 Cb 0.00 0.33 -0.00 0.00 0.09 0.00 0.00 40.66 41.08 1gg3 h LEU 119 CO 0.00 -0.39 -0.00 1.23 0.09 0.00 0.00 178.44 179.36 1gg3 h GLY 120 N 0.02 0.00 0.62 0.83 0.00 -1.63 0.06 103.07 102.98 1gg3 h GLY 120 Ca 0.76 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 48.05 1gg3 h GLY 120 CO -0.81 0.00 -0.11 1.48 0.00 0.00 0.00 176.54 177.10 1gg3 h SER 121 N 0.00 0.22 -0.17 0.19 4.64 0.19 -1.17 113.55 117.46 1gg3 h SER 121 Ca -0.00 -0.52 -0.02 0.00 -0.47 0.00 0.00 61.79 60.78 1gg3 h SER 121 Cb 0.01 -0.06 -0.01 0.00 -0.31 0.00 0.00 62.40 62.02 1gg3 h SER 121 CO 0.00 0.70 0.05 1.88 -0.87 0.00 0.00 176.83 178.60 1gg3 h TYR 122 N -0.25 0.33 -0.09 4.77 0.99 -1.23 0.37 116.97 121.87 1gg3 h TYR 122 Ca 0.01 -0.01 -0.01 0.00 2.00 0.00 0.00 58.73 60.72 1gg3 h TYR 122 Cb 0.65 -0.10 -0.00 0.00 1.00 0.00 0.00 36.73 38.27 1gg3 h TYR 122 CO 0.10 0.30 0.01 1.15 -0.00 0.00 0.00 178.16 179.73 1gg3 h THR 123 N 0.33 1.22 0.00 -2.88 2.02 -0.87 -2.01 112.91 110.72 1gg3 h THR 123 Ca 0.08 -0.67 -0.05 0.00 0.77 0.00 0.00 66.41 66.54 1gg3 h THR 123 Cb 0.14 1.50 -0.01 0.00 -1.74 0.00 0.00 68.15 68.04 1gg3 h THR 123 CO -0.00 0.19 -0.24 0.40 0.37 0.00 0.00 175.52 176.23 1gg3 h ILE 124 N -0.09 0.96 0.48 3.11 5.03 -0.13 -0.27 117.51 126.59 1gg3 h ILE 124 Ca 0.03 -0.90 -0.02 0.00 -0.12 0.00 0.00 64.86 63.84 1gg3 h ILE 124 Cb 0.28 1.52 0.00 0.00 -3.03 0.00 0.00 36.82 35.60 1gg3 h ILE 124 CO 0.00 0.24 -0.23 1.56 -0.68 0.00 0.00 178.15 179.04 1gg3 h GLN 125 N 0.00 -0.62 -0.82 2.37 1.08 -0.03 0.25 115.11 117.34 1gg3 h GLN 125 Ca -0.00 0.04 0.09 0.00 -1.45 0.00 0.00 58.65 57.33 1gg3 h GLN 125 Cb 0.50 0.14 -0.06 0.00 -0.05 0.00 0.00 27.48 28.01 1gg3 h GLN 125 CO 0.03 -0.41 0.53 0.66 -0.95 0.00 0.00 178.83 178.69 1gg3 h SER 126 N -1.04 0.71 -0.05 1.46 4.64 -1.36 1.45 113.55 119.37 1gg3 h SER 126 Ca -0.07 0.02 -0.21 0.00 -0.47 0.00 0.00 61.79 61.06 1gg3 h SER 126 Cb 0.49 -0.13 0.01 0.00 -0.31 0.00 0.00 62.40 62.46 1gg3 h SER 126 CO 0.11 0.43 -0.80 -0.33 -0.87 0.00 0.00 176.83 175.37 1gg3 h GLU 127 N 0.79 0.62 0.00 4.77 4.39 -1.08 -3.39 114.58 120.69 1gg3 h GLU 127 Ca 0.37 -0.61 0.00 0.00 0.34 0.00 0.00 59.36 59.46 1gg3 h GLU 127 Cb 0.39 0.16 0.00 0.00 -0.10 0.00 0.00 28.75 29.20 1gg3 h GLU 127 CO -0.14 1.22 -1.60 1.28 -1.16 0.00 0.00 179.01 178.60 1gg3 n LEU 128 N -4.02 0.10 0.00 1.33 4.77 0.87 -5.06 117.00 114.99 1gg3 n LEU 128 Ca -0.10 -0.07 0.00 0.00 -0.03 0.00 0.00 56.01 55.81 1gg3 n LEU 128 Cb 0.76 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.85 1gg3 n LEU 128 CO 0.52 0.03 0.00 0.61 -1.33 0.00 0.00 177.39 177.21 1gg3 n GLY 129 N 1.55 -1.94 3.63 -0.72 0.00 0.49 -4.91 105.19 103.29 1gg3 n GLY 129 Ca -0.02 -1.66 -0.38 0.00 0.00 0.00 0.00 46.02 43.96 1gg3 n GLY 129 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1gg3 n ASP 130 N 0.62 1.07 0.00 1.61 8.00 -1.26 -4.64 116.55 121.95 1gg3 n ASP 130 Ca 0.00 0.86 0.00 0.00 0.71 0.00 0.00 54.79 56.36 1gg3 n ASP 130 Cb 0.00 -1.41 0.00 0.00 -0.02 0.00 0.00 41.12 39.69 1gg3 n ASP 130 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1gg3 n TYR 131 N -1.47 0.00 -1.99 1.24 9.36 -1.26 -5.00 117.16 118.04 1gg3 n TYR 131 Ca 0.13 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.35 1gg3 n TYR 131 Cb 0.46 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 39.17 1gg3 n TYR 131 CO 0.00 0.00 0.00 -3.47 0.22 0.00 0.00 176.86 173.61 1gg3 n ASP 132 N -0.18 -8.30 -4.57 2.98 -0.08 -1.26 -4.49 116.55 100.66 1gg3 n ASP 132 Ca 0.00 1.37 -0.28 0.00 -1.51 0.00 0.00 54.79 54.37 1gg3 n ASP 132 Cb 0.00 -4.81 -0.05 0.00 2.34 0.00 0.00 41.12 38.60 1gg3 n ASP 132 CO 0.00 0.00 0.00 -2.84 0.12 0.00 0.00 177.20 174.48 1gg3 s PRO 133 N -1.09 2.56 0.00 -0.67 0.02 -1.26 -2.30 135.00 132.26 1gg3 s PRO 133 Ca 0.00 -0.77 0.00 0.00 0.02 0.00 0.00 61.00 60.25 1gg3 s PRO 133 Cb 0.00 -5.16 0.00 0.00 0.02 0.00 0.00 34.50 29.36 1gg3 s PRO 133 CO 0.00 -3.65 0.00 -0.85 -0.33 0.00 0.00 177.00 172.17 1gg3 n GLU 134 N 8.56 0.30 -1.86 5.54 0.28 -1.26 -4.70 120.64 127.50 1gg3 n GLU 134 Ca 0.43 0.00 -0.36 0.00 -0.16 0.00 0.00 57.16 57.06 1gg3 n GLU 134 Cb 0.47 -0.03 0.04 0.00 1.43 0.00 0.00 31.44 33.36 1gg3 n GLU 134 CO 0.00 0.00 0.00 1.28 -0.16 0.00 0.00 177.13 178.25 1gg3 n LEU 135 N 0.00 7.09 -3.39 -1.84 4.32 -0.97 -5.01 117.00 117.20 1gg3 n LEU 135 Ca 0.00 -4.76 -0.25 0.00 -0.02 0.00 0.00 56.01 50.98 1gg3 n LEU 135 Cb 0.00 -0.94 0.02 0.00 -1.62 0.00 0.00 43.42 40.88 1gg3 n LEU 135 CO 0.00 1.77 -1.40 1.41 -1.22 0.00 0.00 177.39 177.95 1gg3 n HIS 136 N -0.63 -1.10 -0.62 -1.77 8.25 -1.26 -4.66 115.22 113.44 1gg3 n HIS 136 Ca 0.54 0.59 0.07 0.00 -0.26 0.00 0.00 57.72 58.65 1gg3 n HIS 136 Cb 0.42 -1.19 -0.02 0.00 1.12 0.00 0.00 29.99 30.32 1gg3 n HIS 136 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1gg3 n GLY 137 N 2.91 -0.67 2.76 -1.41 0.00 -1.26 -3.73 105.19 103.79 1gg3 n GLY 137 Ca -0.01 -0.42 -0.35 0.00 0.00 0.00 0.00 46.02 45.24 1gg3 n GLY 137 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1gg3 n VAL 138 N -1.82 4.40 0.00 1.61 0.31 -1.26 -4.47 118.33 117.11 1gg3 n VAL 138 Ca 0.00 -5.49 0.00 0.00 -0.01 0.00 0.00 64.34 58.84 1gg3 n VAL 138 Cb 0.23 -1.43 0.00 0.00 -0.91 0.00 0.00 33.84 31.73 1gg3 n VAL 138 CO 0.00 0.00 0.00 -0.90 -1.32 0.00 0.00 176.83 174.61 1gg3 n ASP 139 N -0.24 0.00 -0.09 4.52 5.75 -1.26 -4.98 116.55 120.25 1gg3 n ASP 139 Ca 0.42 0.00 0.07 0.00 -0.01 0.00 0.00 54.79 55.27 1gg3 n ASP 139 Cb 0.34 0.00 0.11 0.00 -1.03 0.00 0.00 41.12 40.54 1gg3 n ASP 139 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1gg3 n TYR 140 N -0.96 0.00 1.43 2.11 4.11 -1.24 0.19 117.16 122.81 1gg3 n TYR 140 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.90 57.90 1gg3 n TYR 140 Cb 0.00 -0.06 0.01 0.00 -0.00 0.00 0.00 39.34 39.29 1gg3 n TYR 140 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 176.86 177.14 1gg3 n VAL 141 N -2.22 0.06 1.17 -3.48 0.31 -1.26 -4.15 118.33 108.76 1gg3 n VAL 141 Ca 0.06 -0.04 0.11 0.00 -0.01 0.00 0.00 64.34 64.47 1gg3 n VAL 141 Cb 0.27 -0.24 0.61 0.00 -0.91 0.00 0.00 33.84 33.56 1gg3 n VAL 141 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 1gg3 n SER 142 N -0.21 0.00 -0.11 4.52 3.41 0.52 -3.24 113.62 118.52 1gg3 n SER 142 Ca 0.01 -0.19 0.01 0.00 -0.26 0.00 0.00 58.87 58.44 1gg3 n SER 142 Cb 0.15 -0.22 0.02 0.00 -0.26 0.00 0.00 64.21 63.89 1gg3 n SER 142 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1gg3 n ASP 143 N -1.22 1.40 -4.26 4.04 10.43 -1.26 -4.92 116.55 120.75 1gg3 n ASP 143 Ca 0.12 -1.28 -0.42 0.00 2.57 0.00 0.00 54.79 55.79 1gg3 n ASP 143 Cb 0.16 -0.01 -0.09 0.00 1.84 0.00 0.00 41.12 43.03 1gg3 n ASP 143 CO 0.00 0.00 0.00 -0.36 -1.07 0.00 0.00 177.20 175.77 1gg3 s PHE 144 N -0.36 3.35 -0.25 1.24 0.40 -1.20 -5.03 117.98 116.13 1gg3 s PHE 144 Ca 0.03 -1.57 -0.29 0.00 -0.60 0.00 0.00 56.93 54.50 1gg3 s PHE 144 Cb 0.02 -3.28 -0.03 0.00 0.51 0.00 0.00 43.02 40.24 1gg3 s PHE 144 CO 0.03 -0.92 1.84 0.15 0.70 0.00 0.00 175.22 177.03 1gg3 s LYS 145 N 1.44 3.49 0.00 0.44 3.01 -1.26 -4.74 119.74 122.12 1gg3 s LYS 145 Ca 0.04 1.71 0.10 0.00 -1.01 0.00 0.00 55.97 56.80 1gg3 s LYS 145 Cb -0.25 -4.18 0.17 0.00 -1.01 0.00 0.00 37.83 32.56 1gg3 s LYS 145 CO 0.02 -1.67 1.01 1.28 0.51 0.00 0.00 175.35 176.49 1gg3 n LEU 146 N 9.81 2.29 -3.49 3.17 4.77 -1.26 -4.89 117.00 127.40 1gg3 n LEU 146 Ca 0.23 -1.48 -0.13 0.00 -0.03 0.00 0.00 56.01 54.60 1gg3 n LEU 146 Cb 0.45 -0.10 -0.04 0.00 -2.33 0.00 0.00 43.42 41.41 1gg3 n LEU 146 CO 0.67 0.52 0.51 0.00 -1.33 0.00 0.00 177.39 177.76 1gg3 s ALA 147 N -0.90 -1.74 0.47 -1.18 0.00 -1.26 -4.82 121.76 112.32 1gg3 s ALA 147 Ca 0.16 1.02 0.18 0.00 0.00 0.00 0.00 51.96 53.33 1gg3 s ALA 147 Cb 0.09 0.28 1.20 0.00 0.00 0.00 0.00 23.12 24.69 1gg3 s ALA 147 CO 0.13 -0.55 2.05 -1.00 0.00 0.00 0.00 175.76 176.39 1gg3 h PRO 148 N 2.43 0.00 0.00 0.00 0.13 -1.75 -3.33 132.00 129.48 1gg3 h PRO 148 Ca -0.27 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.86 1gg3 h PRO 148 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 1gg3 h PRO 148 CO 0.36 0.13 -0.79 0.27 -0.23 0.00 0.00 178.00 177.74 1gg3 n ASN 149 N -4.18 1.59 -2.59 1.44 6.94 -1.26 -5.06 115.26 112.14 1gg3 n ASN 149 Ca -0.02 0.27 -0.04 0.00 -0.02 0.00 0.00 54.58 54.76 1gg3 n ASN 149 Cb 0.21 -0.68 -0.04 0.00 -2.36 0.00 0.00 39.78 36.92 1gg3 n ASN 149 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1gg3 n GLN 150 N -4.10 -4.44 -4.50 -3.83 6.02 -1.25 -5.07 117.38 100.21 1gg3 n GLN 150 Ca -0.11 3.33 -0.21 0.00 -0.01 0.00 0.00 57.00 60.00 1gg3 n GLN 150 Cb 0.41 -4.65 -0.14 0.00 1.02 0.00 0.00 30.24 26.88 1gg3 n GLN 150 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.06 177.00 1gg3 s THR 151 N -0.59 1.03 0.21 5.09 -4.23 -1.26 -5.02 115.64 110.86 1gg3 s THR 151 Ca -0.22 -0.68 0.02 0.00 -1.18 0.00 0.00 61.69 59.63 1gg3 s THR 151 Cb 0.01 -0.88 0.29 0.00 1.34 0.00 0.00 72.50 73.26 1gg3 s THR 151 CO 0.59 0.19 1.07 0.29 -0.54 0.00 0.00 174.62 176.22 1gg3 n LYS 152 N 2.49 -0.05 -0.31 3.99 4.01 -1.26 0.24 118.16 127.27 1gg3 n LYS 152 Ca -0.15 1.02 0.22 0.00 -0.51 0.00 0.00 58.31 58.89 1gg3 n LYS 152 Cb 0.55 -1.63 0.51 0.00 -0.51 0.00 0.00 35.03 33.95 1gg3 n LYS 152 CO 0.00 0.00 0.00 0.93 -1.11 0.00 0.00 177.40 177.22 1gg3 h GLU 153 N 0.00 0.39 0.01 1.97 5.08 -2.00 0.26 114.58 120.29 1gg3 h GLU 153 Ca 0.42 -0.02 -0.00 0.00 -1.00 0.00 0.00 59.36 58.76 1gg3 h GLU 153 Cb 0.88 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 30.04 1gg3 h GLU 153 CO -0.64 0.26 -0.01 1.25 -1.00 0.00 0.00 179.01 178.87 1gg3 h LEU 154 N 0.40 -0.02 -0.73 1.33 7.12 0.28 -3.23 115.31 120.45 1gg3 h LEU 154 Ca 0.57 -0.76 0.16 0.00 0.13 0.00 0.00 57.88 57.99 1gg3 h LEU 154 Cb 1.45 0.00 -0.12 0.00 -0.53 0.00 0.00 40.66 41.47 1gg3 h LEU 154 CO -0.27 0.78 0.11 -0.33 -0.13 0.00 0.00 178.44 178.60 1gg3 h GLU 155 N -0.85 0.19 0.00 1.25 5.08 -0.66 -2.59 114.58 117.01 1gg3 h GLU 155 Ca -0.00 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1gg3 h GLU 155 Cb 0.78 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.98 1gg3 h GLU 155 CO 0.00 0.13 0.00 0.39 -1.00 0.00 0.00 179.01 178.53 1gg3 n GLU 156 N -5.23 0.00 -0.60 2.33 -0.58 -0.08 -0.95 120.64 115.52 1gg3 n GLU 156 Ca 0.14 0.53 0.47 0.00 -0.42 0.00 0.00 57.16 57.87 1gg3 n GLU 156 Cb 0.47 -1.46 0.73 0.00 -0.57 0.00 0.00 31.44 30.61 1gg3 n GLU 156 CO 0.00 0.00 0.00 1.17 -0.48 0.00 0.00 177.13 177.82 1gg3 n LYS 157 N -2.01 -0.01 0.08 3.49 3.00 -1.10 0.92 118.16 122.53 1gg3 n LYS 157 Ca 0.00 1.05 -0.05 0.00 -0.00 0.00 0.00 58.31 59.31 1gg3 n LYS 157 Cb 0.00 -2.33 -0.03 0.00 0.00 0.00 0.00 35.03 32.67 1gg3 n LYS 157 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.40 177.68 1gg3 h VAL 158 N 0.00 0.10 -0.20 3.15 2.07 -1.07 -1.76 116.25 118.54 1gg3 h VAL 158 Ca 0.86 -0.83 0.06 0.00 0.82 0.00 0.00 66.70 67.61 1gg3 h VAL 158 Cb 3.29 0.18 -0.07 0.00 -1.52 0.00 0.00 31.29 33.18 1gg3 h VAL 158 CO -0.13 0.03 -0.27 0.24 0.02 0.00 0.00 177.57 177.46 1gg3 h MET 159 N -1.07 -0.29 -0.74 1.57 2.86 0.24 0.97 114.93 118.47 1gg3 h MET 159 Ca -0.03 0.02 0.15 0.00 -2.06 0.00 0.00 59.70 57.78 1gg3 h MET 159 Cb 0.28 0.07 -0.10 0.00 0.06 0.00 0.00 31.60 31.90 1gg3 h MET 159 CO 0.05 -0.19 0.21 1.49 1.06 0.00 0.00 176.91 179.53 1gg3 h GLU 160 N -0.30 0.31 -0.34 1.72 4.81 -0.01 0.32 114.58 121.08 1gg3 h GLU 160 Ca 0.12 -0.02 -0.15 0.00 -0.13 0.00 0.00 59.36 59.19 1gg3 h GLU 160 Cb 0.49 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.79 1gg3 h GLU 160 CO -0.37 0.20 -0.37 -0.07 -0.73 0.00 0.00 179.01 177.67 1gg3 h LEU 161 N 0.32 0.84 -0.39 1.64 3.38 -0.02 -3.17 115.31 117.90 1gg3 h LEU 161 Ca 0.41 -0.37 0.04 0.00 0.09 0.00 0.00 57.88 58.06 1gg3 h LEU 161 Cb 0.69 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 41.16 1gg3 h LEU 161 CO -0.48 1.12 0.15 -0.74 0.09 0.00 0.00 178.44 178.58 1gg3 h HIS 162 N 0.66 0.26 -0.17 1.13 2.76 0.28 -2.34 115.15 117.73 1gg3 h HIS 162 Ca 0.06 0.02 0.05 0.00 -2.20 0.00 0.00 60.37 58.30 1gg3 h HIS 162 Cb 0.92 -0.06 -0.01 0.00 1.55 0.00 0.00 27.41 29.82 1gg3 h HIS 162 CO 0.05 0.11 0.24 0.87 -1.30 0.00 0.00 177.93 177.90 1gg3 h LYS 163 N 0.31 0.00 -0.03 5.26 1.57 -1.11 0.30 116.57 122.87 1gg3 h LYS 163 Ca 0.18 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.96 1gg3 h LYS 163 Cb 0.15 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.46 1gg3 h LYS 163 CO -0.18 0.00 0.00 -1.13 -0.57 0.00 0.00 179.45 177.57 1gg3 n SER 164 N -3.59 0.53 -4.25 0.86 3.41 -0.88 -4.69 113.62 105.00 1gg3 n SER 164 Ca 0.02 -1.35 -0.38 0.00 -0.26 0.00 0.00 58.87 56.89 1gg3 n SER 164 Cb 0.35 -0.02 -0.12 0.00 -0.26 0.00 0.00 64.21 64.17 1gg3 n SER 164 CO 0.00 0.00 0.00 -0.31 -0.16 0.00 0.00 175.04 174.57 1gg3 s TYR 165 N -1.96 3.32 -0.04 7.33 4.12 0.09 -5.07 117.35 125.14 1gg3 s TYR 165 Ca 0.37 -1.59 0.04 0.00 0.02 0.00 0.00 57.07 55.91 1gg3 s TYR 165 Cb 0.18 -2.59 -0.00 0.00 -1.52 0.00 0.00 41.96 38.03 1gg3 s TYR 165 CO 0.29 -0.80 -0.16 1.03 0.02 0.00 0.00 175.55 175.93 1gg3 s ARG 166 N 1.37 1.64 -1.02 -0.62 1.81 -1.26 -4.09 118.95 116.79 1gg3 s ARG 166 Ca 0.01 -0.57 -0.06 0.00 -1.72 0.00 0.00 55.73 53.39 1gg3 s ARG 166 Cb -0.21 -1.45 -0.06 0.00 -0.45 0.00 0.00 34.95 32.78 1gg3 s ARG 166 CO 0.02 0.24 0.89 0.45 -0.68 0.00 0.00 175.30 176.22 1gg3 n SER 167 N 3.12 -6.75 -3.84 0.23 2.88 -1.26 -5.01 113.62 102.99 1gg3 n SER 167 Ca -0.18 -0.65 -0.26 0.00 -1.33 0.00 0.00 58.87 56.46 1gg3 n SER 167 Cb 0.53 -5.18 -0.17 0.00 -0.75 0.00 0.00 64.21 58.64 1gg3 n SER 167 CO 0.00 0.00 0.00 -0.32 -1.23 0.00 0.00 175.04 173.49 1gg3 s MET 168 N -4.28 1.08 0.52 -1.46 0.00 -1.26 -5.14 119.30 108.77 1gg3 s MET 168 Ca 0.41 -0.17 -0.19 0.00 0.00 0.00 0.00 55.69 55.73 1gg3 s MET 168 Cb -0.06 -1.47 -0.07 0.00 0.00 0.00 0.00 34.83 33.23 1gg3 s MET 168 CO 0.74 -0.34 1.06 0.95 0.00 0.00 0.00 175.02 177.44 1gg3 s THR 169 N 1.81 3.63 0.46 10.11 -4.23 -1.26 -4.76 115.64 121.39 1gg3 s THR 169 Ca 0.04 0.98 0.26 0.00 -1.18 0.00 0.00 61.69 61.78 1gg3 s THR 169 Cb -0.13 -3.39 0.45 0.00 1.34 0.00 0.00 72.50 70.77 1gg3 s THR 169 CO -0.07 -0.25 1.78 -0.65 -0.54 0.00 0.00 174.62 174.89 1gg3 h PRO 170 N 1.30 0.22 0.00 3.99 0.11 -1.89 0.55 132.00 136.29 1gg3 h PRO 170 Ca -0.49 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.60 1gg3 h PRO 170 Cb 1.23 -0.05 -0.00 0.00 0.11 0.00 0.00 31.00 32.29 1gg3 h PRO 170 CO 0.58 0.15 -0.04 0.00 -0.21 0.00 0.00 178.00 178.48 1gg3 h ALA 171 N 1.55 1.02 0.00 -0.75 0.00 -1.97 -1.27 119.26 117.84 1gg3 h ALA 171 Ca 0.58 -0.04 -0.10 0.00 0.00 0.00 0.00 54.91 55.35 1gg3 h ALA 171 Cb 1.81 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.58 1gg3 h ALA 171 CO -0.19 0.05 -0.55 1.96 0.00 0.00 0.00 179.25 180.52 1gg3 h GLN 172 N 0.00 0.01 -0.37 0.00 4.20 -0.27 -1.14 115.11 117.53 1gg3 h GLN 172 Ca -0.00 -0.01 0.07 0.00 0.06 0.00 0.00 58.65 58.76 1gg3 h GLN 172 Cb 0.52 0.01 -0.09 0.00 0.30 0.00 0.00 27.48 28.22 1gg3 h GLN 172 CO 0.01 1.01 -0.42 0.00 -0.67 0.00 0.00 178.83 178.75 1gg3 h ALA 173 N -0.20 -0.43 -0.27 3.87 0.00 -1.26 0.30 119.26 121.26 1gg3 h ALA 173 Ca -0.15 0.06 0.06 0.00 0.00 0.00 0.00 54.91 54.88 1gg3 h ALA 173 Cb 1.15 0.87 -0.08 0.00 0.00 0.00 0.00 17.79 19.73 1gg3 h ALA 173 CO -0.08 -0.86 -0.30 -0.44 0.00 0.00 0.00 179.25 177.56 1gg3 h ASP 174 N -0.34 -0.96 -0.14 0.00 5.19 -1.33 0.38 116.42 119.22 1gg3 h ASP 174 Ca 0.13 0.16 -0.00 0.00 -0.62 0.00 0.00 57.03 56.70 1gg3 h ASP 174 Cb 0.59 0.44 -0.01 0.00 0.18 0.00 0.00 39.33 40.53 1gg3 h ASP 174 CO -0.55 -0.32 0.09 0.25 -3.12 0.00 0.00 179.24 175.59 1gg3 h LEU 175 N -0.29 0.18 0.06 1.55 7.12 0.35 -0.74 115.31 123.53 1gg3 h LEU 175 Ca 0.14 -0.01 -0.11 0.00 0.13 0.00 0.00 57.88 58.03 1gg3 h LEU 175 Cb 0.52 -0.05 0.01 0.00 -0.53 0.00 0.00 40.66 40.61 1gg3 h LEU 175 CO -0.44 0.15 -0.47 -0.33 -0.13 0.00 0.00 178.44 177.22 1gg3 h GLU 176 N 0.21 0.22 -0.58 1.25 4.39 0.64 -2.58 114.58 118.13 1gg3 h GLU 176 Ca 0.06 -0.31 0.10 0.00 0.34 0.00 0.00 59.36 59.55 1gg3 h GLU 176 Cb 0.00 0.11 -0.11 0.00 -0.10 0.00 0.00 28.75 28.65 1gg3 h GLU 176 CO -0.01 1.09 -0.33 0.35 -1.16 0.00 0.00 179.01 178.95 1gg3 h PHE 177 N -0.50 -0.91 0.42 4.33 3.04 0.29 -1.60 116.94 122.01 1gg3 h PHE 177 Ca -0.08 0.07 -0.01 0.00 3.98 0.00 0.00 57.97 61.94 1gg3 h PHE 177 Cb 1.30 0.49 -0.02 0.00 2.56 0.00 0.00 35.95 40.28 1gg3 h PHE 177 CO 0.20 -0.38 -0.39 -0.07 -2.02 0.00 0.00 178.31 175.66 1gg3 h LEU 178 N -0.16 -1.04 -1.52 0.59 3.38 -1.22 -1.41 115.31 113.92 1gg3 h LEU 178 Ca 0.23 0.08 0.46 0.00 0.09 0.00 0.00 57.88 58.74 1gg3 h LEU 178 Cb 0.55 0.34 -0.12 0.00 0.09 0.00 0.00 40.66 41.52 1gg3 h LEU 178 CO -0.67 -0.54 0.95 -0.33 0.09 0.00 0.00 178.44 177.93 1gg3 h GLU 179 N -0.82 0.06 0.00 1.13 4.39 -0.89 1.04 114.58 119.49 1gg3 h GLU 179 Ca -0.04 -0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.66 1gg3 h GLU 179 Cb 0.72 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.36 1gg3 h GLU 179 CO -0.04 0.04 -0.00 -0.91 -1.16 0.00 0.00 179.01 176.94 1gg3 h ASN 180 N 0.06 -0.00 -0.22 1.42 2.35 -0.78 -3.33 115.58 115.08 1gg3 h ASN 180 Ca 0.83 -0.64 0.01 0.00 -0.55 0.00 0.00 56.30 55.95 1gg3 h ASN 180 Cb 2.78 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 41.14 1gg3 h ASN 180 CO -0.34 0.82 0.15 0.00 -1.65 0.00 0.00 177.43 176.40 1gg3 h ALA 181 N -0.35 1.87 -0.78 -0.83 0.00 0.17 -1.82 119.26 117.52 1gg3 h ALA 181 Ca -0.00 -0.01 0.17 0.00 0.00 0.00 0.00 54.91 55.06 1gg3 h ALA 181 Cb 0.64 -0.08 -0.11 0.00 0.00 0.00 0.00 17.79 18.25 1gg3 h ALA 181 CO 0.00 0.11 0.27 -0.22 0.00 0.00 0.00 179.25 179.42 1gg3 h LYS 182 N 0.27 0.36 -0.00 0.00 3.64 0.90 -1.63 116.57 120.11 1gg3 h LYS 182 Ca 0.08 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.44 1gg3 h LYS 182 Cb -0.00 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 31.74 1gg3 h LYS 182 CO -0.02 0.24 -0.05 1.63 -2.27 0.00 0.00 179.45 178.98 1gg3 n LYS 183 N -5.07 0.45 -2.70 1.90 5.02 -0.69 -4.87 118.16 112.21 1gg3 n LYS 183 Ca 0.16 -0.06 -0.41 0.00 -2.02 0.00 0.00 58.31 55.98 1gg3 n LYS 183 Cb 0.48 -1.50 -0.05 0.00 -0.02 0.00 0.00 35.03 33.95 1gg3 n LYS 183 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1gg3 s LEU 184 N -2.60 4.55 0.33 -0.35 1.43 -0.61 -5.01 118.68 116.42 1gg3 s LEU 184 Ca 0.27 1.90 -0.28 0.00 -1.03 0.00 0.00 54.13 54.99 1gg3 s LEU 184 Cb 0.20 -3.60 -0.10 0.00 0.03 0.00 0.00 46.19 42.73 1gg3 s LEU 184 CO 0.48 -0.01 1.20 -0.94 0.23 0.00 0.00 176.35 177.30 1gg3 s SER 185 N -0.44 6.89 0.00 2.29 1.04 -1.26 -2.36 113.70 119.87 1gg3 s SER 185 Ca 0.45 2.46 0.00 0.00 0.48 0.00 0.00 55.95 59.34 1gg3 s SER 185 Cb -0.25 -2.63 0.00 0.00 0.10 0.00 0.00 66.02 63.23 1gg3 s SER 185 CO 0.32 -0.43 0.00 0.23 0.98 0.00 0.00 173.24 174.34 1gg3 n MET 186 N 0.76 0.00 -2.39 4.02 2.00 -1.26 -4.86 117.12 115.39 1gg3 n MET 186 Ca 0.01 0.00 -0.43 0.00 0.00 0.00 0.00 57.70 57.28 1gg3 n MET 186 Cb 0.44 -0.25 -0.02 0.00 0.00 0.00 0.00 33.22 33.39 1gg3 n MET 186 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 175.97 175.50 1gg3 s TYR 187 N -2.20 2.76 -1.09 2.03 6.14 -0.99 -3.00 117.35 120.99 1gg3 s TYR 187 Ca 0.00 0.93 0.00 0.00 0.64 0.00 0.00 57.07 58.64 1gg3 s TYR 187 Cb 0.00 -3.60 0.00 0.00 0.42 0.00 0.00 41.96 38.78 1gg3 s TYR 187 CO 0.00 -1.84 0.00 0.41 0.64 0.00 0.00 175.55 174.76 1gg3 n GLY 188 N 3.79 0.62 3.42 8.97 0.00 -1.26 -4.94 105.19 115.78 1gg3 n GLY 188 Ca 0.14 -0.46 -0.39 0.00 0.00 0.00 0.00 46.02 45.31 1gg3 n GLY 188 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1gg3 s VAL 189 N -2.49 4.54 0.01 1.61 1.01 -1.16 -4.43 120.40 119.48 1gg3 s VAL 189 Ca 0.00 -0.51 -0.26 0.00 0.00 0.00 0.00 61.98 61.21 1gg3 s VAL 189 Cb 0.00 -3.35 -0.04 0.00 0.00 0.00 0.00 36.38 32.99 1gg3 s VAL 189 CO 0.00 0.02 0.81 -0.62 0.00 0.00 0.00 175.10 175.31 1gg3 s ASP 190 N 1.59 7.20 -0.05 3.32 2.15 0.15 -4.83 116.67 126.21 1gg3 s ASP 190 Ca 0.04 1.44 0.01 0.00 0.43 0.00 0.00 52.55 54.47 1gg3 s ASP 190 Cb -0.17 -2.48 -0.03 0.00 -0.30 0.00 0.00 42.92 39.93 1gg3 s ASP 190 CO 0.06 -0.09 -0.05 -0.76 -0.17 0.00 0.00 175.17 174.16 1gg3 s LEU 191 N 0.45 3.27 -0.08 -1.34 1.43 -1.26 0.93 118.68 122.08 1gg3 s LEU 191 Ca 0.42 -0.02 -0.01 0.00 -1.03 0.00 0.00 54.13 53.48 1gg3 s LEU 191 Cb -0.20 -1.78 0.03 0.00 0.03 0.00 0.00 46.19 44.27 1gg3 s LEU 191 CO 0.23 0.34 -0.02 -1.00 0.23 0.00 0.00 176.35 176.13 1gg3 s HIS 192 N -0.90 0.86 0.28 0.29 3.76 0.16 -5.00 115.29 114.75 1gg3 s HIS 192 Ca 0.14 -0.30 -0.30 0.00 -0.15 0.00 0.00 55.06 54.45 1gg3 s HIS 192 Cb -0.11 -0.89 -0.11 0.00 1.11 0.00 0.00 32.58 32.58 1gg3 s HIS 192 CO 0.04 -0.36 1.56 0.15 -0.85 0.00 0.00 174.74 175.28 1gg3 s LYS 193 N 1.83 4.16 0.00 1.40 1.02 -1.26 -1.04 119.74 125.85 1gg3 s LYS 193 Ca 0.04 2.51 0.00 0.00 0.02 0.00 0.00 55.97 58.53 1gg3 s LYS 193 Cb -0.12 -3.05 0.00 0.00 -0.52 0.00 0.00 37.83 34.14 1gg3 s LYS 193 CO -0.06 -0.58 0.00 0.00 -0.92 0.00 0.00 175.35 173.80 1gg3 n ALA 194 N 2.26 0.00 -3.56 5.17 0.00 -0.89 -4.68 120.51 118.81 1gg3 n ALA 194 Ca 0.08 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.38 1gg3 n ALA 194 Cb 0.38 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.78 1gg3 n ALA 194 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 1gg3 s LYS 195 N 1.36 0.78 0.22 0.00 2.47 -1.08 -3.15 119.74 120.33 1gg3 s LYS 195 Ca 0.00 0.20 0.09 0.00 -1.56 0.00 0.00 55.97 54.70 1gg3 s LYS 195 Cb 0.00 0.37 -0.04 0.00 -1.46 0.00 0.00 37.83 36.70 1gg3 s LYS 195 CO 0.00 -0.24 -0.05 0.34 0.16 0.00 0.00 175.35 175.56 1gg3 s ASP 196 N -1.11 4.43 -0.77 1.43 2.15 0.53 0.04 116.67 123.38 1gg3 s ASP 196 Ca -0.05 -0.59 -0.25 0.00 0.43 0.00 0.00 52.55 52.09 1gg3 s ASP 196 Cb -0.00 -0.80 -0.17 0.00 -0.30 0.00 0.00 42.92 41.64 1gg3 s ASP 196 CO 0.05 0.06 2.45 0.18 -0.17 0.00 0.00 175.17 177.74 1gg3 n LEU 197 N -0.39 1.06 0.00 -1.34 4.77 -1.26 0.17 117.00 120.02 1gg3 n LEU 197 Ca -0.09 -0.55 0.00 0.00 -0.03 0.00 0.00 56.01 55.35 1gg3 n LEU 197 Cb 0.57 -1.26 0.00 0.00 -2.33 0.00 0.00 43.42 40.40 1gg3 n LEU 197 CO 0.38 -1.56 0.00 1.21 -1.33 0.00 0.00 177.39 176.09 1gg3 n GLU 198 N 8.28 0.00 -1.96 3.23 2.13 -1.26 -4.71 120.64 126.35 1gg3 n GLU 198 Ca 0.52 0.00 -0.19 0.00 0.66 0.00 0.00 57.16 58.15 1gg3 n GLU 198 Cb 0.32 0.00 -0.05 0.00 0.27 0.00 0.00 31.44 31.98 1gg3 n GLU 198 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1gg3 n GLY 199 N 0.00 0.72 3.56 8.31 0.00 0.45 -4.82 105.19 113.41 1gg3 n GLY 199 Ca 0.00 -0.09 -0.19 0.00 0.00 0.00 0.00 46.02 45.74 1gg3 n GLY 199 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1gg3 s VAL 200 N -2.83 3.21 -0.23 1.61 1.01 0.13 -4.63 120.40 118.66 1gg3 s VAL 200 Ca 0.00 -0.17 -0.29 0.00 0.00 0.00 0.00 61.98 61.52 1gg3 s VAL 200 Cb 0.00 -3.48 -0.04 0.00 0.00 0.00 0.00 36.38 32.87 1gg3 s VAL 200 CO 0.00 -0.44 1.95 -0.62 0.00 0.00 0.00 175.10 175.99 1gg3 s ASP 201 N 9.57 5.87 0.00 3.32 2.15 -1.26 0.20 116.67 136.52 1gg3 s ASP 201 Ca 0.82 1.73 0.00 0.00 0.43 0.00 0.00 52.55 55.54 1gg3 s ASP 201 Cb -0.10 -2.52 0.00 0.00 -0.30 0.00 0.00 42.92 40.00 1gg3 s ASP 201 CO 0.04 -1.66 0.00 2.30 -0.17 0.00 0.00 175.17 175.69 1gg3 n ILE 202 N 7.17 0.00 -3.67 4.11 -6.64 -1.19 -4.90 119.36 114.24 1gg3 n ILE 202 Ca 0.24 0.00 -0.18 0.00 -1.77 0.00 0.00 62.75 61.04 1gg3 n ILE 202 Cb 0.45 0.00 -0.17 0.00 -1.44 0.00 0.00 39.64 38.48 1gg3 n ILE 202 CO 0.00 0.00 0.00 -0.63 -1.77 0.00 0.00 176.55 174.15 1gg3 s ILE 203 N -1.33 -0.18 0.07 7.28 1.01 -1.20 -2.09 121.20 124.75 1gg3 s ILE 203 Ca 0.00 0.38 -0.15 0.00 0.00 0.00 0.00 60.65 60.88 1gg3 s ILE 203 Cb 0.00 -0.22 -0.06 0.00 0.01 0.00 0.00 42.46 42.18 1gg3 s ILE 203 CO 0.00 0.16 0.49 -0.76 0.00 0.00 0.00 174.94 174.83 1gg3 s LEU 204 N 2.18 4.43 -0.06 2.97 1.43 -0.21 -0.88 118.68 128.55 1gg3 s LEU 204 Ca 0.03 1.05 0.03 0.00 -1.03 0.00 0.00 54.13 54.21 1gg3 s LEU 204 Cb -0.12 -2.93 0.01 0.00 0.03 0.00 0.00 46.19 43.18 1gg3 s LEU 204 CO -0.04 0.22 -0.14 -0.83 0.23 0.00 0.00 176.35 175.79 1gg3 s GLY 205 N -1.38 0.82 -0.09 -3.19 0.00 0.14 0.40 107.32 104.03 1gg3 s GLY 205 Ca 0.31 -0.50 0.00 0.00 0.00 0.00 0.00 44.72 44.52 1gg3 s GLY 205 CO 0.17 -0.05 -0.07 0.14 0.00 0.00 0.00 173.10 173.29 1gg3 s VAL 206 N 0.43 3.66 0.02 1.40 1.01 0.26 0.26 120.40 127.44 1gg3 s VAL 206 Ca -0.11 -0.48 -0.03 0.00 0.00 0.00 0.00 61.98 61.36 1gg3 s VAL 206 Cb -0.14 -2.51 0.01 0.00 0.00 0.00 0.00 36.38 33.74 1gg3 s VAL 206 CO 0.03 0.58 0.14 0.00 0.00 0.00 0.00 175.10 175.85 1gg3 h SER 208 N 0.25 0.96 -0.34 0.00 4.64 -1.88 -3.15 113.55 114.03 1gg3 h SER 208 Ca -0.03 -0.22 0.07 0.00 -0.47 0.00 0.00 61.79 61.14 1gg3 h SER 208 Cb 0.15 -0.25 -0.08 0.00 -0.31 0.00 0.00 62.40 61.90 1gg3 h SER 208 CO 0.04 0.97 -0.32 0.28 -0.87 0.00 0.00 176.83 176.94 1gg3 h SER 209 N 0.94 -1.04 0.00 4.97 0.02 -1.96 -3.43 113.55 113.06 1gg3 h SER 209 Ca 0.19 0.18 0.00 0.00 -0.84 0.00 0.00 61.79 61.32 1gg3 h SER 209 Cb 0.43 0.48 0.00 0.00 0.14 0.00 0.00 62.40 63.45 1gg3 h SER 209 CO 0.01 -0.32 0.00 0.61 -1.14 0.00 0.00 176.83 175.99 1gg3 n GLY 210 N -1.41 -0.53 3.31 -3.77 0.00 -1.19 -2.97 105.19 98.62 1gg3 n GLY 210 Ca 0.00 -0.09 -0.32 0.00 0.00 0.00 0.00 46.02 45.61 1gg3 n GLY 210 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1gg3 s LEU 211 N 0.00 2.37 0.04 0.99 0.20 0.20 -2.86 118.68 119.62 1gg3 s LEU 211 Ca 0.00 -0.44 0.04 0.00 0.69 0.00 0.00 54.13 54.42 1gg3 s LEU 211 Cb 0.00 -1.49 -0.04 0.00 -0.43 0.00 0.00 46.19 44.24 1gg3 s LEU 211 CO 0.00 0.19 -0.03 -0.76 -0.29 0.00 0.00 176.35 175.46 1gg3 s LEU 212 N 0.15 3.34 -0.10 -0.68 1.43 0.14 0.15 118.68 123.11 1gg3 s LEU 212 Ca -0.11 -0.15 0.02 0.00 -1.03 0.00 0.00 54.13 52.86 1gg3 s LEU 212 Cb -0.16 -2.00 -0.02 0.00 0.03 0.00 0.00 46.19 44.05 1gg3 s LEU 212 CO 0.06 0.23 -0.15 -0.69 0.23 0.00 0.00 176.35 176.03 1gg3 s VAL 213 N -1.15 2.92 0.44 -1.59 1.01 -0.57 0.25 120.40 121.71 1gg3 s VAL 213 Ca 0.21 -0.74 0.03 0.00 0.00 0.00 0.00 61.98 61.49 1gg3 s VAL 213 Cb -0.11 -2.18 -0.02 0.00 0.00 0.00 0.00 36.38 34.06 1gg3 s VAL 213 CO 0.13 0.55 0.07 -0.31 0.00 0.00 0.00 175.10 175.54 1gg3 s TYR 214 N -0.03 1.86 -0.30 5.22 4.12 -0.06 -0.87 117.35 127.30 1gg3 s TYR 214 Ca -0.04 -1.11 -0.14 0.00 0.02 0.00 0.00 57.07 55.80 1gg3 s TYR 214 Cb -0.14 -1.37 0.18 0.00 -1.52 0.00 0.00 41.96 39.11 1gg3 s TYR 214 CO 0.04 -0.04 1.09 0.21 0.02 0.00 0.00 175.55 176.87 1gg3 s LYS 215 N -3.78 0.16 0.00 -0.62 2.20 -1.25 -3.26 119.74 113.18 1gg3 s LYS 215 Ca 0.18 0.28 0.00 0.00 -0.36 0.00 0.00 55.97 56.07 1gg3 s LYS 215 Cb 0.03 0.16 0.00 0.00 -1.51 0.00 0.00 37.83 36.51 1gg3 s LYS 215 CO 0.10 -0.16 0.00 -0.25 -0.36 0.00 0.00 175.35 174.68 1gg3 n ASP 216 N 5.45 0.00 -0.44 1.43 8.00 -1.26 -4.43 116.55 125.30 1gg3 n ASP 216 Ca -0.08 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.42 1gg3 n ASP 216 Cb 0.54 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.64 1gg3 n ASP 216 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1gg3 n LYS 217 N 0.00 0.00 -2.17 -1.24 4.76 -1.26 -5.15 118.16 113.10 1gg3 n LYS 217 Ca 0.00 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.44 1gg3 n LYS 217 Cb 0.00 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.19 1gg3 n LYS 217 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 1gg3 n LEU 218 N 0.00 -6.11 -4.55 -0.35 7.99 -1.26 -4.74 117.00 107.97 1gg3 n LEU 218 Ca 0.00 3.22 -0.33 0.00 -0.01 0.00 0.00 56.01 58.89 1gg3 n LEU 218 Cb 0.00 -3.19 -0.04 0.00 -0.11 0.00 0.00 43.42 40.08 1gg3 n LEU 218 CO 0.00 -2.04 1.59 -0.13 -1.51 0.00 0.00 177.39 175.30 1gg3 s ARG 219 N -0.53 2.39 0.00 3.23 0.52 -1.26 -3.95 118.95 119.34 1gg3 s ARG 219 Ca 0.00 0.55 0.00 0.00 -0.52 0.00 0.00 55.73 55.76 1gg3 s ARG 219 Cb 0.00 -4.63 0.00 0.00 0.52 0.00 0.00 34.95 30.84 1gg3 s ARG 219 CO 0.00 -3.18 0.90 -0.89 0.02 0.00 0.00 175.30 172.15 1gg3 n ILE 220 N 7.69 0.00 -4.75 1.52 5.41 -0.05 -4.86 119.36 124.33 1gg3 n ILE 220 Ca 0.31 1.40 -0.33 0.00 1.00 0.00 0.00 62.75 65.14 1gg3 n ILE 220 Cb 0.51 -2.24 -0.08 0.00 -0.71 0.00 0.00 39.64 37.12 1gg3 n ILE 220 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 176.55 176.76 1gg3 s ASN 221 N -2.33 4.05 -0.30 4.38 3.84 -1.21 -4.98 114.94 118.39 1gg3 s ASN 221 Ca 0.00 -1.67 -0.08 0.00 0.21 0.00 0.00 52.86 51.33 1gg3 s ASN 221 Cb 0.00 0.55 0.16 0.00 -0.55 0.00 0.00 41.25 41.42 1gg3 s ASN 221 CO 0.00 -0.87 0.72 -0.60 -2.79 0.00 0.00 177.10 173.55 1gg3 s ARG 222 N -3.87 0.50 -0.49 0.43 3.52 -1.26 -1.51 118.95 116.28 1gg3 s ARG 222 Ca 0.06 1.09 -0.17 0.00 -0.13 0.00 0.00 55.73 56.58 1gg3 s ARG 222 Cb 0.01 0.64 0.07 0.00 -1.56 0.00 0.00 34.95 34.11 1gg3 s ARG 222 CO 0.03 -0.34 0.48 -0.06 -0.81 0.00 0.00 175.30 174.60 1gg3 s PHE 223 N 2.83 3.18 0.40 5.12 0.40 0.40 -4.86 117.98 125.44 1gg3 s PHE 223 Ca 0.05 -0.81 -0.27 0.00 -0.60 0.00 0.00 56.93 55.30 1gg3 s PHE 223 Cb -0.12 -3.33 -0.10 0.00 0.51 0.00 0.00 43.02 39.98 1gg3 s PHE 223 CO -0.19 -0.89 1.45 -2.30 0.70 0.00 0.00 175.22 173.99 1gg3 n PRO 224 N 5.54 2.47 0.19 0.24 -0.02 -1.26 0.60 135.00 142.76 1gg3 n PRO 224 Ca -0.11 0.87 -0.12 0.00 -2.02 0.00 0.00 63.50 62.12 1gg3 n PRO 224 Cb 0.44 -2.63 -0.07 0.00 -0.02 0.00 0.00 33.50 31.23 1gg3 n PRO 224 CO 0.00 0.00 0.00 -1.49 1.98 0.00 0.00 175.50 175.99 1gg3 h TRP 225 N 2.66 -0.95 -4.05 6.00 -0.00 -1.80 -3.37 115.95 114.43 1gg3 h TRP 225 Ca -0.50 0.01 -0.56 0.00 -0.00 0.00 0.00 58.89 57.84 1gg3 h TRP 225 Cb 1.26 0.37 0.17 0.00 -0.00 0.00 0.00 29.16 30.95 1gg3 h TRP 225 CO 0.51 -0.45 0.41 -2.30 -0.00 0.00 0.00 178.44 176.62 1gg3 n PRO 226 N -4.44 0.87 -0.46 0.49 -0.02 -1.26 -0.99 135.00 129.18 1gg3 n PRO 226 Ca -0.08 0.36 0.00 0.00 -2.02 0.00 0.00 63.50 61.76 1gg3 n PRO 226 Cb 0.31 -2.46 0.00 0.00 -0.02 0.00 0.00 33.50 31.33 1gg3 n PRO 226 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 1gg3 n LYS 227 N -2.09 0.00 -3.90 -0.52 4.81 -1.26 -5.04 118.16 110.16 1gg3 n LYS 227 Ca 0.15 0.11 -0.21 0.00 -0.87 0.00 0.00 58.31 57.49 1gg3 n LYS 227 Cb 0.49 -1.60 -0.17 0.00 0.02 0.00 0.00 35.03 33.77 1gg3 n LYS 227 CO 0.00 0.00 0.00 0.08 1.17 0.00 0.00 177.40 178.65 1gg3 s VAL 228 N -2.00 0.33 -0.01 3.15 1.01 -0.17 -4.07 120.40 118.64 1gg3 s VAL 228 Ca 0.00 0.08 0.02 0.00 0.00 0.00 0.00 61.98 62.07 1gg3 s VAL 228 Cb 0.00 -0.45 0.03 0.00 0.00 0.00 0.00 36.38 35.95 1gg3 s VAL 228 CO 0.00 0.22 0.79 0.18 0.00 0.00 0.00 175.10 176.29 1gg3 n LEU 229 N 4.65 0.94 -3.20 3.92 7.99 -1.26 -5.02 117.00 125.02 1gg3 n LEU 229 Ca -0.16 -1.11 0.04 0.00 -0.01 0.00 0.00 56.01 54.77 1gg3 n LEU 229 Cb 0.50 -0.04 -0.02 0.00 -0.11 0.00 0.00 43.42 43.76 1gg3 n LEU 229 CO 0.16 0.27 0.43 -0.75 -1.51 0.00 0.00 177.39 176.00 1gg3 s LYS 230 N -0.62 0.35 -0.10 3.23 2.47 -1.26 -5.04 119.74 118.76 1gg3 s LYS 230 Ca 0.03 0.66 0.02 0.00 -1.56 0.00 0.00 55.97 55.12 1gg3 s LYS 230 Cb 0.02 0.37 -0.01 0.00 -1.46 0.00 0.00 37.83 36.76 1gg3 s LYS 230 CO 0.00 -0.33 -0.17 0.42 0.16 0.00 0.00 175.35 175.43 1gg3 s ILE 231 N 2.85 2.69 0.35 5.43 1.01 -1.26 -2.05 121.20 130.21 1gg3 s ILE 231 Ca 0.06 -0.81 -0.11 0.00 0.00 0.00 0.00 60.65 59.79 1gg3 s ILE 231 Cb -0.11 -2.08 0.03 0.00 0.01 0.00 0.00 42.46 40.30 1gg3 s ILE 231 CO -0.16 0.55 0.65 -0.94 0.00 0.00 0.00 174.94 175.04 1gg3 s SER 232 N 0.15 0.29 0.11 3.58 1.04 0.15 -4.99 113.70 114.03 1gg3 s SER 232 Ca -0.09 -1.20 -0.21 0.00 0.48 0.00 0.00 55.95 54.92 1gg3 s SER 232 Cb -0.15 0.76 0.06 0.00 0.10 0.00 0.00 66.02 66.78 1gg3 s SER 232 CO 0.06 -1.48 0.53 -0.72 0.98 0.00 0.00 173.24 172.60 1gg3 s TYR 233 N -2.83 -0.43 -0.15 5.02 1.13 -1.26 -1.06 117.35 117.77 1gg3 s TYR 233 Ca 0.21 0.29 -0.07 0.00 -1.41 0.00 0.00 57.07 56.09 1gg3 s TYR 233 Cb -0.03 0.42 0.06 0.00 -1.10 0.00 0.00 41.96 41.30 1gg3 s TYR 233 CO 0.14 -0.74 0.35 0.21 -2.51 0.00 0.00 175.55 172.99 1gg3 s LYS 234 N -3.29 0.31 3.20 -3.49 2.36 -0.82 -5.02 119.74 112.98 1gg3 s LYS 234 Ca -0.01 0.73 0.00 0.00 -2.55 0.00 0.00 55.97 54.14 1gg3 s LYS 234 Cb -0.00 -0.02 0.00 0.00 -1.05 0.00 0.00 37.83 36.75 1gg3 s LYS 234 CO -0.09 -0.18 0.00 0.54 1.55 0.00 0.00 175.35 177.17 1gg3 n ARG 235 N 4.45 0.00 -0.48 4.03 5.12 -1.26 -0.37 116.66 128.15 1gg3 n ARG 235 Ca -0.21 0.00 0.07 0.00 -1.93 0.00 0.00 57.85 55.78 1gg3 n ARG 235 Cb 0.53 0.00 0.27 0.00 -1.16 0.00 0.00 32.46 32.11 1gg3 n ARG 235 CO 0.00 0.00 0.00 -1.13 -1.93 0.00 0.00 177.63 174.57 1gg3 n SER 236 N 2.14 3.74 -4.49 0.55 3.41 -1.26 -3.71 113.62 114.00 1gg3 n SER 236 Ca 0.00 -2.35 -0.36 0.00 -0.26 0.00 0.00 58.87 55.89 1gg3 n SER 236 Cb 0.00 -0.51 -0.12 0.00 -0.26 0.00 0.00 64.21 63.32 1gg3 n SER 236 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1gg3 s SER 237 N -0.78 5.33 -0.09 4.04 0.01 0.50 0.16 113.70 122.87 1gg3 s SER 237 Ca 0.39 -0.14 -0.12 0.00 1.31 0.00 0.00 55.95 57.39 1gg3 s SER 237 Cb 0.25 -1.96 -0.05 0.00 0.21 0.00 0.00 66.02 64.47 1gg3 s SER 237 CO 0.18 -0.01 0.28 0.12 0.41 0.00 0.00 173.24 174.23 1gg3 s PHE 238 N 1.47 3.61 -0.14 2.43 5.36 0.04 -1.95 117.98 128.79 1gg3 s PHE 238 Ca 0.06 0.72 -0.04 0.00 -0.96 0.00 0.00 56.93 56.71 1gg3 s PHE 238 Cb -0.15 -2.19 0.06 0.00 -0.34 0.00 0.00 43.02 40.40 1gg3 s PHE 238 CO 0.05 0.55 0.12 -0.06 -1.46 0.00 0.00 175.22 174.42 1gg3 s PHE 239 N -0.60 0.01 0.29 10.12 0.40 -0.22 -0.80 117.98 127.18 1gg3 s PHE 239 Ca 0.19 0.05 0.09 0.00 -0.60 0.00 0.00 56.93 56.66 1gg3 s PHE 239 Cb -0.14 -0.52 -0.04 0.00 0.51 0.00 0.00 43.02 42.83 1gg3 s PHE 239 CO 0.07 -0.44 0.03 0.96 0.70 0.00 0.00 175.22 176.54 1gg3 s ILE 240 N 2.21 3.23 0.00 0.64 -4.36 -0.87 -0.67 121.20 121.38 1gg3 s ILE 240 Ca 0.04 -1.88 0.00 0.00 -0.26 0.00 0.00 60.65 58.54 1gg3 s ILE 240 Cb -0.15 -2.86 0.00 0.00 1.25 0.00 0.00 42.46 40.71 1gg3 s ILE 240 CO -0.08 -0.31 0.00 2.29 0.24 0.00 0.00 174.94 177.08 1gg3 n LYS 241 N -0.95 0.00 -0.41 0.37 2.85 -0.87 0.05 118.16 119.19 1gg3 n LYS 241 Ca -0.05 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.21 1gg3 n LYS 241 Cb 0.60 0.00 -0.00 0.00 -0.65 0.00 0.00 35.03 34.98 1gg3 n LYS 241 CO 0.00 0.00 0.00 -0.89 -0.05 0.00 0.00 177.40 176.46 1gg3 n ILE 242 N 0.00 -0.73 -1.58 0.58 -0.00 -0.69 -4.19 119.36 112.75 1gg3 n ILE 242 Ca 0.00 0.37 0.00 0.00 -0.00 0.00 0.00 62.75 63.12 1gg3 n ILE 242 Cb 0.00 -0.62 0.00 0.00 -0.00 0.00 0.00 39.64 39.02 1gg3 n ILE 242 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.55 177.09 1gg3 n ARG 243 N -1.86 -0.32 0.27 0.38 5.12 -1.26 -4.61 116.66 114.38 1gg3 n ARG 243 Ca -0.00 0.44 0.15 0.00 -1.93 0.00 0.00 57.85 56.50 1gg3 n ARG 243 Cb 0.13 -0.41 0.72 0.00 -1.16 0.00 0.00 32.46 31.74 1gg3 n ARG 243 CO 0.00 0.00 0.00 -1.35 -1.93 0.00 0.00 177.63 174.35 1gg3 h PRO 244 N 2.71 0.00 0.00 5.56 0.11 -1.89 -3.47 132.00 135.01 1gg3 h PRO 244 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 1gg3 h PRO 244 Cb 0.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.36 1gg3 h PRO 244 CO 0.00 0.10 0.00 0.41 -0.21 0.00 0.00 178.00 178.30 1gg3 n GLY 245 N -0.36 -0.40 0.00 -0.55 0.00 -1.26 -5.02 105.19 97.60 1gg3 n GLY 245 Ca -0.01 0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1gg3 n GLY 245 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1gg3 n GLU 246 N 0.00 0.00 -1.50 1.61 4.07 -1.26 -4.70 120.64 118.86 1gg3 n GLU 246 Ca 0.00 0.38 -0.31 0.00 -0.06 0.00 0.00 57.16 57.17 1gg3 n GLU 246 Cb 0.00 -1.17 -0.19 0.00 -0.06 0.00 0.00 31.44 30.02 1gg3 n GLU 246 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 1gg3 n GLN 247 N -1.65 0.00 -0.42 5.31 0.00 -1.26 -4.89 117.38 114.48 1gg3 n GLN 247 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 57.00 56.70 1gg3 n GLN 247 Cb 0.00 -1.24 0.28 0.00 0.00 0.00 0.00 30.24 29.28 1gg3 n GLN 247 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.06 175.06 1gg3 s GLU 248 N 7.98 -2.74 0.00 2.61 2.56 -1.26 -3.65 118.70 124.19 1gg3 s GLU 248 Ca 1.34 0.18 0.00 0.00 0.00 0.00 0.00 54.97 56.48 1gg3 s GLU 248 Cb -1.05 -1.40 0.00 0.00 2.00 0.00 0.00 34.13 33.68 1gg3 s GLU 248 CO 0.53 -4.76 0.00 1.04 -0.56 0.00 0.00 175.26 171.51 1gg3 n GLN 249 N -5.56 0.00 -2.05 4.30 1.13 -1.26 -4.87 117.38 109.07 1gg3 n GLN 249 Ca 0.12 0.00 -0.43 0.00 -1.94 0.00 0.00 57.00 54.75 1gg3 n GLN 249 Cb 0.60 -0.05 -0.03 0.00 0.11 0.00 0.00 30.24 30.87 1gg3 n GLN 249 CO 0.00 0.00 0.00 0.71 -1.44 0.00 0.00 177.06 176.33 1gg3 s TYR 250 N 0.00 1.98 -0.45 1.08 2.02 -1.24 -4.95 117.35 115.79 1gg3 s TYR 250 Ca 0.00 0.50 0.03 0.00 -0.37 0.00 0.00 57.07 57.23 1gg3 s TYR 250 Cb 0.00 -4.02 0.13 0.00 -0.40 0.00 0.00 41.96 37.67 1gg3 s TYR 250 CO 0.00 -3.12 0.22 -1.21 -1.57 0.00 0.00 175.55 169.86 1gg3 s GLU 251 N 4.88 1.53 0.00 -0.62 2.02 -1.26 -4.08 118.70 121.17 1gg3 s GLU 251 Ca 0.75 -2.17 0.00 0.00 0.02 0.00 0.00 54.97 53.57 1gg3 s GLU 251 Cb -0.26 -2.78 0.00 0.00 0.10 0.00 0.00 34.13 31.19 1gg3 s GLU 251 CO 0.31 -1.10 0.00 0.45 0.02 0.00 0.00 175.26 174.93 1gg3 n SER 252 N 3.54 -1.33 -3.62 -0.19 2.88 -1.26 -4.60 113.62 109.04 1gg3 n SER 252 Ca 0.06 -0.20 -0.01 0.00 -1.33 0.00 0.00 58.87 57.39 1gg3 n SER 252 Cb 0.35 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 63.77 1gg3 n SER 252 CO 0.00 0.00 0.00 -0.89 -1.23 0.00 0.00 175.04 172.92 1gg3 s THR 253 N -0.87 -0.99 0.27 2.46 2.01 -1.26 -1.70 115.64 115.56 1gg3 s THR 253 Ca 0.00 0.00 0.07 0.00 0.31 0.00 0.00 61.69 62.07 1gg3 s THR 253 Cb 0.00 -1.00 -0.03 0.00 0.01 0.00 0.00 72.50 71.48 1gg3 s THR 253 CO 0.00 0.00 0.23 -0.63 -0.69 0.00 0.00 174.62 173.53 1gg3 s ILE 254 N 2.89 4.38 -0.07 1.82 1.09 0.11 -4.97 121.20 126.45 1gg3 s ILE 254 Ca -0.05 -1.35 -0.28 0.00 -1.10 0.00 0.00 60.65 57.87 1gg3 s ILE 254 Cb -0.12 -3.42 0.06 0.00 -1.06 0.00 0.00 42.46 37.93 1gg3 s ILE 254 CO -0.19 -0.32 0.64 -0.83 -0.10 0.00 0.00 174.94 174.15 1gg3 s GLY 255 N -3.89 -0.53 0.22 6.18 0.00 -1.26 -2.04 107.32 106.00 1gg3 s GLY 255 Ca 0.35 1.29 0.02 0.00 0.00 0.00 0.00 44.72 46.38 1gg3 s GLY 255 CO 0.26 0.96 0.02 -1.36 0.00 0.00 0.00 173.10 172.98 1gg3 s PHE 256 N -1.01 1.43 -0.21 1.90 0.40 0.02 -4.03 117.98 116.48 1gg3 s PHE 256 Ca -0.10 -1.01 0.02 0.00 -0.60 0.00 0.00 56.93 55.23 1gg3 s PHE 256 Cb -0.01 -0.83 0.04 0.00 0.51 0.00 0.00 43.02 42.73 1gg3 s PHE 256 CO 0.08 -0.17 -0.14 -1.59 0.70 0.00 0.00 175.22 174.11 1gg3 s LYS 257 N -3.92 2.44 0.45 0.44 0.00 0.11 -0.78 119.74 118.48 1gg3 s LYS 257 Ca 0.29 -0.98 -0.03 0.00 0.00 0.00 0.00 55.97 55.25 1gg3 s LYS 257 Cb 0.06 -2.60 -0.03 0.00 0.00 0.00 0.00 37.83 35.27 1gg3 s LYS 257 CO 0.08 -0.39 0.72 -0.51 0.00 0.00 0.00 175.35 175.26 1gg3 s LEU 258 N 1.27 3.69 0.62 2.77 1.43 0.41 -2.64 118.68 126.24 1gg3 s LEU 258 Ca -0.01 0.71 0.33 0.00 -1.03 0.00 0.00 54.13 54.13 1gg3 s LEU 258 Cb -0.16 -3.62 1.84 0.00 0.03 0.00 0.00 46.19 44.28 1gg3 s LEU 258 CO -0.09 -0.57 2.13 -0.65 0.23 0.00 0.00 176.35 177.40 1gg3 h PRO 259 N 0.34 0.00 -2.31 1.29 0.11 -1.83 -3.43 132.00 126.16 1gg3 h PRO 259 Ca -0.47 0.00 0.13 0.00 0.11 0.00 0.00 66.00 65.77 1gg3 h PRO 259 Cb 1.22 0.00 -0.13 0.00 0.11 0.00 0.00 31.00 32.20 1gg3 h PRO 259 CO 0.61 0.00 0.49 -1.54 -0.21 0.00 0.00 178.00 177.35 1gg3 s SER 260 N -5.36 -0.30 0.25 -2.05 1.04 -1.26 -4.98 113.70 101.04 1gg3 s SER 260 Ca -0.04 -0.14 -0.05 0.00 0.48 0.00 0.00 55.95 56.19 1gg3 s SER 260 Cb 0.13 0.42 0.29 0.00 0.10 0.00 0.00 66.02 66.97 1gg3 s SER 260 CO 0.46 -0.73 1.93 0.10 0.98 0.00 0.00 173.24 175.98 1gg3 h TYR 261 N 2.00 1.25 0.09 5.02 -0.00 -1.88 -0.57 116.97 122.89 1gg3 h TYR 261 Ca -0.23 0.03 0.02 0.00 0.00 0.00 0.00 58.73 58.55 1gg3 h TYR 261 Cb 1.24 -0.42 -0.05 0.00 0.00 0.00 0.00 36.73 37.50 1gg3 h TYR 261 CO 0.30 0.77 -0.49 -0.09 -0.00 0.00 0.00 178.16 178.65 1gg3 h ARG 262 N 1.33 -0.67 -0.06 0.10 2.43 -1.95 0.91 114.38 116.47 1gg3 h ARG 262 Ca 0.38 0.05 0.02 0.00 -0.81 0.00 0.00 59.98 59.61 1gg3 h ARG 262 Cb -0.11 0.15 -0.00 0.00 -0.42 0.00 0.00 29.97 29.59 1gg3 h ARG 262 CO -0.09 -0.45 0.06 0.00 -1.51 0.00 0.00 179.97 177.98 1gg3 h ALA 263 N -0.36 1.67 0.00 2.80 0.00 -1.71 0.95 119.26 122.61 1gg3 h ALA 263 Ca 0.01 -0.00 -0.08 0.00 0.00 0.00 0.00 54.91 54.84 1gg3 h ALA 263 Cb 0.73 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.51 1gg3 h ALA 263 CO -0.29 -0.10 -1.56 0.00 0.00 0.00 0.00 179.25 177.31 1gg3 n ALA 264 N -2.35 2.36 0.11 0.00 0.00 -0.31 -2.83 120.51 117.49 1gg3 n ALA 264 Ca -0.01 -0.51 -0.23 0.00 0.00 0.00 0.00 53.44 52.68 1gg3 n ALA 264 Cb 0.16 -0.87 -0.14 0.00 0.00 0.00 0.00 19.45 18.60 1gg3 n ALA 264 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 1gg3 h LYS 265 N 0.00 0.58 -0.34 0.00 3.64 0.16 0.19 116.57 120.79 1gg3 h LYS 265 Ca -0.10 -0.85 0.06 0.00 -1.27 0.00 0.00 60.65 58.50 1gg3 h LYS 265 Cb 1.27 0.30 -0.06 0.00 -0.41 0.00 0.00 32.23 33.33 1gg3 h LYS 265 CO 0.01 1.39 -0.03 -0.22 -2.27 0.00 0.00 179.45 178.34 1gg3 h LYS 266 N 0.18 0.06 -0.15 1.90 3.64 -0.96 0.48 116.57 121.73 1gg3 h LYS 266 Ca -0.21 -0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 59.14 1gg3 h LYS 266 Cb 1.98 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 33.78 1gg3 h LYS 266 CO 0.25 0.04 -0.01 1.25 -2.27 0.00 0.00 179.45 178.71 1gg3 h LEU 267 N 0.06 0.27 -0.80 5.20 5.85 -1.54 -2.47 115.31 121.89 1gg3 h LEU 267 Ca 0.17 -0.32 0.10 0.00 0.84 0.00 0.00 57.88 58.67 1gg3 h LEU 267 Cb 0.24 -0.07 -0.08 0.00 0.37 0.00 0.00 40.66 41.12 1gg3 h LEU 267 CO -0.30 0.53 0.44 -0.25 -0.34 0.00 0.00 178.44 178.51 1gg3 h TRP 268 N 0.01 0.79 -0.25 1.25 7.01 -0.10 -1.00 115.95 123.65 1gg3 h TRP 268 Ca 0.04 0.03 -0.05 0.00 2.11 0.00 0.00 58.89 61.02 1gg3 h TRP 268 Cb 0.39 -0.23 -0.01 0.00 -2.10 0.00 0.00 29.16 27.21 1gg3 h TRP 268 CO 0.04 0.30 -0.04 -0.22 -2.79 0.00 0.00 178.44 175.72 1gg3 h LYS 269 N 0.72 0.48 0.39 2.65 3.64 0.04 -2.31 116.57 122.17 1gg3 h LYS 269 Ca 0.39 -0.18 -0.01 0.00 -1.27 0.00 0.00 60.65 59.59 1gg3 h LYS 269 Cb 0.40 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.18 1gg3 h LYS 269 CO -0.27 0.69 -0.30 0.28 -2.27 0.00 0.00 179.45 177.58 1gg3 h VAL 270 N 0.23 0.38 -0.48 2.00 2.07 -0.99 -1.33 116.25 118.13 1gg3 h VAL 270 Ca 0.07 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.68 1gg3 h VAL 270 Cb 0.50 0.38 -0.09 0.00 -1.52 0.00 0.00 31.29 30.55 1gg3 h VAL 270 CO 0.02 0.00 -0.14 0.00 0.02 0.00 0.00 177.57 177.47 1gg3 h VAL 272 N -0.03 0.67 -0.43 0.00 2.07 -1.22 0.65 116.25 117.95 1gg3 h VAL 272 Ca 0.23 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.84 1gg3 h VAL 272 Cb 0.38 0.67 -0.09 0.00 -1.52 0.00 0.00 31.29 30.73 1gg3 h VAL 272 CO -0.51 0.00 -0.26 -0.33 0.02 0.00 0.00 177.57 176.49 1gg3 h GLU 273 N -0.26 -0.17 0.16 1.57 5.08 0.03 -0.21 114.58 120.78 1gg3 h GLU 273 Ca 0.03 0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 58.40 1gg3 h GLU 273 Cb 0.29 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.57 1gg3 h GLU 273 CO -0.10 -0.11 -0.12 0.45 -1.00 0.00 0.00 179.01 178.13 1gg3 h HIS 274 N -0.18 -0.30 -1.11 4.33 3.86 -0.51 0.86 115.15 122.10 1gg3 h HIS 274 Ca 0.20 -0.00 0.32 0.00 -1.16 0.00 0.00 60.37 59.72 1gg3 h HIS 274 Cb 0.49 0.11 -0.06 0.00 1.06 0.00 0.00 27.41 29.02 1gg3 h HIS 274 CO -0.50 -0.18 0.78 1.25 0.86 0.00 0.00 177.93 180.14 1gg3 h HIS 275 N -0.28 0.15 0.00 2.45 -0.00 0.19 -0.83 115.15 116.83 1gg3 h HIS 275 Ca -0.01 0.01 -0.04 0.00 -0.00 0.00 0.00 60.37 60.32 1gg3 h HIS 275 Cb 0.25 -0.04 -0.01 0.00 -0.00 0.00 0.00 27.41 27.61 1gg3 h HIS 275 CO -0.10 0.01 -0.24 1.15 -0.00 0.00 0.00 177.93 178.76 1gg3 h THR 276 N 0.09 1.46 0.47 6.26 2.02 -0.02 -2.94 112.91 120.25 1gg3 h THR 276 Ca 0.55 -2.18 -0.02 0.00 0.77 0.00 0.00 66.41 65.53 1gg3 h THR 276 Cb 2.02 2.84 -0.01 0.00 -1.74 0.00 0.00 68.15 71.26 1gg3 h THR 276 CO -0.08 0.49 -0.37 0.15 0.37 0.00 0.00 175.52 176.09 1gg3 h PHE 277 N -1.00 -1.02 0.00 3.16 3.57 0.21 -2.45 116.94 119.41 1gg3 h PHE 277 Ca -0.06 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.44 1gg3 h PHE 277 Cb 0.96 0.38 0.00 0.00 2.79 0.00 0.00 35.95 40.09 1gg3 h PHE 277 CO 0.21 -0.52 0.00 1.19 -2.23 0.00 0.00 178.31 176.96 1gg3 n PHE 278 N -4.68 0.00 0.00 0.41 0.99 -0.42 -5.10 117.46 108.66 1gg3 n PHE 278 Ca -0.10 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.35 1gg3 n PHE 278 Cb 0.36 0.00 0.00 0.00 -1.00 0.00 0.00 39.48 38.84 1gg3 n PHE 278 CO 0.00 0.00 0.00 -2.13 -0.00 0.00 0.00 176.76 174.63