#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gn6 n GLU 3 N 0.00 -0.55 -2.98 0.00 1.02 -1.26 -4.99 120.64 111.88 1gn6 n GLU 3 Ca 0.00 -0.10 -0.36 0.00 -0.02 0.00 0.00 57.16 56.68 1gn6 n GLU 3 Cb 0.00 -2.32 -0.06 0.00 -0.02 0.00 0.00 31.44 29.04 1gn6 n GLU 3 CO 0.00 0.00 0.00 0.71 1.18 0.00 0.00 177.13 179.02 1gn6 s TYR 4 N -2.60 3.61 0.06 -0.32 1.51 -1.26 -5.05 117.35 113.29 1gn6 s TYR 4 Ca 0.66 1.51 0.04 0.00 -1.01 0.00 0.00 57.07 58.27 1gn6 s TYR 4 Cb -0.23 -2.72 -0.03 0.00 -0.11 0.00 0.00 41.96 38.87 1gn6 s TYR 4 CO 0.59 0.24 -0.12 0.95 -1.11 0.00 0.00 175.55 176.11 1gn6 s THR 5 N -1.64 0.92 -0.19 -0.71 -4.23 -1.26 -4.94 115.64 103.59 1gn6 s THR 5 Ca 0.48 -1.19 -0.29 0.00 -1.18 0.00 0.00 61.69 59.50 1gn6 s THR 5 Cb -0.16 -0.91 -0.01 0.00 1.34 0.00 0.00 72.50 72.77 1gn6 s THR 5 CO 0.21 -0.25 1.18 -0.22 -0.54 0.00 0.00 174.62 175.00 1gn6 s LEU 6 N -1.61 4.15 0.65 4.79 2.96 -1.26 -5.00 118.68 123.36 1gn6 s LEU 6 Ca -0.04 1.58 -0.15 0.00 -0.22 0.00 0.00 54.13 55.30 1gn6 s LEU 6 Cb -0.10 -3.54 -0.01 0.00 0.50 0.00 0.00 46.19 43.05 1gn6 s LEU 6 CO 0.02 -0.73 1.11 -2.16 -1.32 0.00 0.00 176.35 173.26 1gn6 s PRO 7 N 3.40 2.88 0.44 0.98 0.04 -1.26 -5.03 135.00 136.44 1gn6 s PRO 7 Ca 0.51 1.39 -0.15 0.00 0.04 0.00 0.00 61.00 62.79 1gn6 s PRO 7 Cb -0.19 -1.96 -0.08 0.00 0.04 0.00 0.00 34.50 32.31 1gn6 s PRO 7 CO 0.12 -1.19 0.87 -0.51 0.04 0.00 0.00 177.00 176.33 1gn6 s ASP 8 N -2.54 6.65 0.46 6.66 1.01 -1.26 -5.06 116.67 122.59 1gn6 s ASP 8 Ca 0.67 1.39 -0.05 0.00 0.71 0.00 0.00 52.55 55.28 1gn6 s ASP 8 Cb -0.20 -2.43 -0.04 0.00 1.01 0.00 0.00 42.92 41.26 1gn6 s ASP 8 CO 0.40 -0.44 0.76 -0.76 0.21 0.00 0.00 175.17 175.34 1gn6 s LEU 9 N -3.72 3.68 0.00 1.23 1.43 -1.26 -4.95 118.68 115.09 1gn6 s LEU 9 Ca 0.56 0.89 0.20 0.00 -1.03 0.00 0.00 54.13 54.75 1gn6 s LEU 9 Cb -0.10 -3.83 0.57 0.00 0.03 0.00 0.00 46.19 42.86 1gn6 s LEU 9 CO 0.27 -0.54 1.46 0.47 0.23 0.00 0.00 176.35 178.24 1gn6 n ASP 10 N -2.16 2.44 -3.85 2.29 8.00 -1.26 -4.92 116.55 117.08 1gn6 n ASP 10 Ca 0.00 -1.87 -0.10 0.00 0.71 0.00 0.00 54.79 53.54 1gn6 n ASP 10 Cb 0.55 -0.20 -0.06 0.00 -0.02 0.00 0.00 41.12 41.40 1gn6 n ASP 10 CO 0.00 0.00 0.00 -1.66 -0.39 0.00 0.00 177.20 175.15 1gn6 s TRP 11 N -1.60 0.15 0.51 1.24 1.48 -1.26 -5.10 118.94 114.35 1gn6 s TRP 11 Ca 0.34 -0.51 -0.20 0.00 -1.06 0.00 0.00 56.10 54.68 1gn6 s TRP 11 Cb 0.19 0.14 -0.07 0.00 -1.16 0.00 0.00 33.47 32.56 1gn6 s TRP 11 CO 0.27 -0.79 1.06 0.34 -4.06 0.00 0.00 176.95 173.77 1gn6 s ASP 12 N -2.92 6.15 0.37 -2.66 -1.08 -1.26 -4.92 116.67 110.34 1gn6 s ASP 12 Ca 0.13 1.98 0.14 0.00 -0.52 0.00 0.00 52.55 54.27 1gn6 s ASP 12 Cb 0.02 -2.56 0.98 0.00 -1.46 0.00 0.00 42.92 39.90 1gn6 s ASP 12 CO -0.02 -0.92 1.78 1.88 0.52 0.00 0.00 175.17 178.41 1gn6 h TYR 13 N 1.38 0.79 -0.49 -5.34 0.05 -1.97 -1.24 116.97 110.16 1gn6 h TYR 13 Ca -0.49 0.03 0.00 0.00 0.05 0.00 0.00 58.73 58.31 1gn6 h TYR 13 Cb 1.23 -0.23 0.00 0.00 1.01 0.00 0.00 36.73 38.74 1gn6 h TYR 13 CO 0.56 0.11 0.00 0.41 -1.05 0.00 0.00 178.16 178.19 1gn6 n GLY 14 N -1.42 1.80 0.13 3.88 0.00 -1.26 -4.04 105.19 104.28 1gn6 n GLY 14 Ca 0.24 -0.59 0.11 0.00 0.00 0.00 0.00 46.02 45.78 1gn6 n GLY 14 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1gn6 n ALA 15 N 0.85 1.47 1.00 4.61 0.00 -0.47 -2.79 120.51 125.18 1gn6 n ALA 15 Ca 0.18 0.11 0.12 0.00 0.00 0.00 0.00 53.44 53.85 1gn6 n ALA 15 Cb 0.59 -1.35 0.10 0.00 0.00 0.00 0.00 19.45 18.80 1gn6 n ALA 15 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1gn6 n LEU 16 N -2.18 3.00 -4.75 0.00 4.77 -1.26 -4.57 117.00 112.00 1gn6 n LEU 16 Ca 0.01 -1.00 -0.36 0.00 -0.03 0.00 0.00 56.01 54.63 1gn6 n LEU 16 Cb 0.17 -0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.29 1gn6 n LEU 16 CO 0.16 0.50 0.84 -1.61 -1.33 0.00 0.00 177.39 175.95 1gn6 s GLU 17 N -2.00 2.99 -0.01 3.23 2.02 -1.12 -1.30 118.70 122.51 1gn6 s GLU 17 Ca 0.28 1.82 0.13 0.00 0.02 0.00 0.00 54.97 57.21 1gn6 s GLU 17 Cb 0.20 -1.93 0.38 0.00 0.10 0.00 0.00 34.13 32.88 1gn6 s GLU 17 CO 0.30 -1.19 1.30 -0.35 0.02 0.00 0.00 175.26 175.34 1gn6 n PRO 18 N -1.58 2.10 -0.07 0.39 -0.04 -1.26 -4.89 135.00 129.65 1gn6 n PRO 18 Ca 0.14 -1.55 -0.14 0.00 -0.04 0.00 0.00 63.50 61.91 1gn6 n PRO 18 Cb 0.50 -1.39 -0.06 0.00 -0.04 0.00 0.00 33.50 32.51 1gn6 n PRO 18 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1gn6 h HIS 19 N 2.45 0.72 -3.18 0.54 3.86 -1.57 -3.42 115.15 114.56 1gn6 h HIS 19 Ca 0.00 -0.24 -0.54 0.00 -1.16 0.00 0.00 60.37 58.43 1gn6 h HIS 19 Cb 0.64 -0.14 -0.37 0.00 1.06 0.00 0.00 27.41 28.60 1gn6 h HIS 19 CO 0.32 0.97 -0.81 0.42 0.86 0.00 0.00 177.93 179.69 1gn6 s ILE 20 N -4.16 1.10 0.61 2.45 1.01 -1.05 -4.92 121.20 116.23 1gn6 s ILE 20 Ca -0.13 -0.34 -0.18 0.00 0.00 0.00 0.00 60.65 60.01 1gn6 s ILE 20 Cb 0.07 -1.10 -0.03 0.00 0.01 0.00 0.00 42.46 41.41 1gn6 s ILE 20 CO 0.81 0.38 1.16 -0.94 0.00 0.00 0.00 174.94 176.35 1gn6 s SER 21 N 1.65 5.25 0.39 3.58 1.04 -1.26 -3.14 113.70 121.20 1gn6 s SER 21 Ca 0.04 2.22 0.12 0.00 0.48 0.00 0.00 55.95 58.81 1gn6 s SER 21 Cb -0.13 -2.58 0.80 0.00 0.10 0.00 0.00 66.02 64.22 1gn6 s SER 21 CO -0.08 -1.54 1.90 1.23 0.98 0.00 0.00 173.24 175.72 1gn6 h GLY 22 N 0.67 0.11 1.31 7.32 0.00 -1.86 -1.71 103.07 108.91 1gn6 h GLY 22 Ca -0.49 -0.07 -0.02 0.00 0.00 0.00 0.00 47.33 46.74 1gn6 h GLY 22 CO 0.55 0.07 0.30 -1.61 0.00 0.00 0.00 176.54 175.85 1gn6 h GLN 23 N 0.09 0.90 -0.19 4.80 4.15 -1.91 -1.54 115.11 121.42 1gn6 h GLN 23 Ca 0.02 -0.12 -0.10 0.00 0.77 0.00 0.00 58.65 59.22 1gn6 h GLN 23 Cb 0.47 -0.17 -0.00 0.00 0.21 0.00 0.00 27.48 27.99 1gn6 h GLN 23 CO 0.03 0.70 -0.27 0.82 -1.93 0.00 0.00 178.83 178.19 1gn6 h ILE 24 N 0.90 1.34 -0.83 2.39 2.04 -1.71 -2.82 117.51 118.82 1gn6 h ILE 24 Ca 0.22 -1.48 0.03 0.00 1.00 0.00 0.00 64.86 64.63 1gn6 h ILE 24 Cb 0.10 1.86 -0.05 0.00 -0.74 0.00 0.00 36.82 37.99 1gn6 h ILE 24 CO -0.03 0.45 0.55 0.78 0.00 0.00 0.00 178.15 179.90 1gn6 h ASN 25 N 0.16 0.90 -0.02 1.72 2.35 -1.12 0.15 115.58 119.73 1gn6 h ASN 25 Ca 0.02 -0.01 -0.18 0.00 -0.55 0.00 0.00 56.30 55.58 1gn6 h ASN 25 Cb 0.84 -0.21 -0.00 0.00 0.05 0.00 0.00 38.32 38.99 1gn6 h ASN 25 CO 0.06 0.63 -0.61 -0.08 -1.65 0.00 0.00 177.43 175.78 1gn6 h GLU 26 N 1.05 0.62 -0.06 0.81 4.81 -1.28 -1.11 114.58 119.42 1gn6 h GLU 26 Ca 0.32 -0.42 -0.07 0.00 -0.13 0.00 0.00 59.36 59.05 1gn6 h GLU 26 Cb -0.01 0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.44 1gn6 h GLU 26 CO -0.09 1.04 -0.25 -0.07 -0.73 0.00 0.00 179.01 178.91 1gn6 h LEU 27 N 0.46 0.33 -0.34 1.64 3.38 -1.19 -1.54 115.31 118.05 1gn6 h LEU 27 Ca -0.01 -0.63 0.07 0.00 0.09 0.00 0.00 57.88 57.40 1gn6 h LEU 27 Cb 1.18 -0.10 -0.07 0.00 0.09 0.00 0.00 40.66 41.77 1gn6 h LEU 27 CO 0.12 0.91 -0.09 -0.74 0.09 0.00 0.00 178.44 178.73 1gn6 h HIS 28 N -0.23 -0.19 0.24 1.13 2.76 -0.75 0.11 115.15 118.22 1gn6 h HIS 28 Ca -0.01 0.03 -0.01 0.00 -2.20 0.00 0.00 60.37 58.18 1gn6 h HIS 28 Cb 0.89 0.14 0.00 0.00 1.55 0.00 0.00 27.41 29.99 1gn6 h HIS 28 CO 0.13 -0.15 -0.11 1.25 -1.30 0.00 0.00 177.93 177.74 1gn6 h HIS 29 N -0.01 -0.29 0.00 5.26 -0.00 -1.25 -0.63 115.15 118.23 1gn6 h HIS 29 Ca 0.16 -0.01 -0.01 0.00 -0.00 0.00 0.00 60.37 60.52 1gn6 h HIS 29 Cb 0.26 0.10 -0.00 0.00 -0.00 0.00 0.00 27.41 27.76 1gn6 h HIS 29 CO -0.32 -0.18 -0.04 0.66 -0.00 0.00 0.00 177.93 178.05 1gn6 h SER 30 N -0.66 0.00 0.00 3.26 4.64 -1.33 -3.14 113.55 116.32 1gn6 h SER 30 Ca -0.03 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.28 1gn6 h SER 30 Cb 0.24 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.33 1gn6 h SER 30 CO 0.05 0.04 -0.34 0.29 -0.87 0.00 0.00 176.83 176.01 1gn6 n LYS 31 N -3.26 0.14 0.17 4.77 4.76 0.32 -4.57 118.16 120.50 1gn6 n LYS 31 Ca -0.01 0.06 -0.14 0.00 -2.87 0.00 0.00 58.31 55.34 1gn6 n LYS 31 Cb 0.22 -0.75 -0.08 0.00 -1.84 0.00 0.00 35.03 32.58 1gn6 n LYS 31 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 1gn6 h HIS 32 N -0.26 -0.38 -0.54 2.13 3.86 -1.15 -2.61 115.15 116.20 1gn6 h HIS 32 Ca -0.01 -0.01 0.01 0.00 -1.16 0.00 0.00 60.37 59.20 1gn6 h HIS 32 Cb 0.32 0.13 -0.03 0.00 1.06 0.00 0.00 27.41 28.89 1gn6 h HIS 32 CO -0.11 -0.14 0.34 1.25 0.86 0.00 0.00 177.93 180.14 1gn6 h HIS 33 N -0.57 0.65 -0.91 2.45 -0.00 -1.15 -1.89 115.15 113.73 1gn6 h HIS 33 Ca -0.04 0.02 0.12 0.00 -0.00 0.00 0.00 60.37 60.46 1gn6 h HIS 33 Cb 0.42 -0.21 -0.07 0.00 -0.00 0.00 0.00 27.41 27.54 1gn6 h HIS 33 CO -0.01 0.39 0.58 0.00 -0.00 0.00 0.00 177.93 178.89 1gn6 h ALA 34 N 1.22 1.68 -0.46 5.26 0.00 -1.58 -1.27 119.26 124.11 1gn6 h ALA 34 Ca 0.21 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.11 1gn6 h ALA 34 Cb -0.04 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.55 1gn6 h ALA 34 CO -0.07 0.10 0.23 1.15 0.00 0.00 0.00 179.25 180.67 1gn6 h THR 35 N 0.84 1.18 -0.56 0.00 2.02 -0.94 0.23 112.91 115.68 1gn6 h THR 35 Ca 0.44 -0.50 -0.04 0.00 0.77 0.00 0.00 66.41 67.08 1gn6 h THR 35 Cb 0.52 0.66 -0.03 0.00 -1.74 0.00 0.00 68.15 67.57 1gn6 h THR 35 CO -0.20 0.20 0.19 1.88 0.37 0.00 0.00 175.52 177.96 1gn6 h TYR 36 N 0.60 0.83 -0.10 3.16 0.05 -1.10 0.20 116.97 120.62 1gn6 h TYR 36 Ca 0.16 -0.06 -0.00 0.00 0.05 0.00 0.00 58.73 58.88 1gn6 h TYR 36 Cb 0.10 -0.25 -0.00 0.00 1.01 0.00 0.00 36.73 37.59 1gn6 h TYR 36 CO -0.01 0.67 0.05 0.28 -1.05 0.00 0.00 178.16 178.10 1gn6 h VAL 37 N 0.81 1.08 -0.67 -2.88 2.07 -0.69 0.44 116.25 116.41 1gn6 h VAL 37 Ca 0.19 -0.22 -0.05 0.00 0.82 0.00 0.00 66.70 67.44 1gn6 h VAL 37 Cb 0.21 1.06 -0.03 0.00 -1.52 0.00 0.00 31.29 31.01 1gn6 h VAL 37 CO -0.01 0.07 0.24 0.50 0.02 0.00 0.00 177.57 178.39 1gn6 h LYS 38 N 0.07 1.01 0.00 1.57 3.64 -0.33 -1.83 116.57 120.70 1gn6 h LYS 38 Ca 0.03 -0.19 -0.07 0.00 -1.27 0.00 0.00 60.65 59.16 1gn6 h LYS 38 Cb 0.07 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 31.72 1gn6 h LYS 38 CO -0.01 0.84 -0.32 0.78 -2.27 0.00 0.00 179.45 178.48 1gn6 h GLY 39 N 1.06 0.00 1.39 5.01 0.00 -0.17 -0.84 103.07 109.52 1gn6 h GLY 39 Ca 0.22 0.00 -0.24 0.00 0.00 0.00 0.00 47.33 47.31 1gn6 h GLY 39 CO -0.01 0.00 -0.98 0.00 0.00 0.00 0.00 176.54 175.55 1gn6 h ALA 40 N 1.68 0.26 -0.40 3.60 0.00 -0.49 -1.93 119.26 121.99 1gn6 h ALA 40 Ca -0.00 -0.70 -0.08 0.00 0.00 0.00 0.00 54.91 54.13 1gn6 h ALA 40 Cb 0.57 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.36 1gn6 h ALA 40 CO 0.04 0.75 -0.07 -0.91 0.00 0.00 0.00 179.25 179.06 1gn6 h ASN 41 N 0.31 0.66 -0.30 0.00 2.35 -0.95 -2.36 115.58 115.30 1gn6 h ASN 41 Ca -0.10 -0.17 -0.13 0.00 -0.55 0.00 0.00 56.30 55.35 1gn6 h ASN 41 Cb 1.62 -0.18 -0.00 0.00 0.05 0.00 0.00 38.32 39.81 1gn6 h ASN 41 CO 0.18 0.78 -0.31 0.44 -1.65 0.00 0.00 177.43 176.86 1gn6 h ASP 42 N 0.63 0.79 -0.77 5.81 3.45 -1.10 -2.59 116.42 122.64 1gn6 h ASP 42 Ca 0.12 -0.48 -0.02 0.00 0.43 0.00 0.00 57.03 57.08 1gn6 h ASP 42 Cb 0.50 -0.22 -0.04 0.00 -0.56 0.00 0.00 39.33 39.01 1gn6 h ASP 42 CO 0.03 1.11 0.40 0.00 -1.57 0.00 0.00 179.24 179.20 1gn6 h ALA 43 N 0.71 1.22 -0.47 3.45 0.00 -1.12 0.41 119.26 123.45 1gn6 h ALA 43 Ca 0.04 -0.14 -0.06 0.00 0.00 0.00 0.00 54.91 54.76 1gn6 h ALA 43 Cb 0.89 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 18.35 1gn6 h ALA 43 CO 0.08 0.61 0.07 0.28 0.00 0.00 0.00 179.25 180.28 1gn6 h VAL 44 N 1.11 1.25 -0.57 0.00 2.07 -1.43 -1.36 116.25 117.31 1gn6 h VAL 44 Ca 0.27 -0.93 -0.05 0.00 0.82 0.00 0.00 66.70 66.81 1gn6 h VAL 44 Cb 0.08 0.94 -0.02 0.00 -1.52 0.00 0.00 31.29 30.77 1gn6 h VAL 44 CO -0.04 0.33 0.15 0.00 0.02 0.00 0.00 177.57 178.03 1gn6 h ALA 45 N 0.95 0.75 -0.51 1.67 0.00 -1.00 -1.93 119.26 119.19 1gn6 h ALA 45 Ca 0.14 -0.21 -0.06 0.00 0.00 0.00 0.00 54.91 54.78 1gn6 h ALA 45 Cb 0.40 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 1gn6 h ALA 45 CO 0.01 0.44 0.07 0.87 0.00 0.00 0.00 179.25 180.64 1gn6 h LYS 46 N 0.81 0.82 -0.09 0.00 1.79 -0.76 -1.72 116.57 117.43 1gn6 h LYS 46 Ca 0.18 -0.19 -0.11 0.00 -2.18 0.00 0.00 60.65 58.35 1gn6 h LYS 46 Cb 0.32 -0.11 -0.01 0.00 -1.58 0.00 0.00 32.23 30.85 1gn6 h LYS 46 CO -0.00 0.77 -0.46 -0.07 -1.08 0.00 0.00 179.45 178.62 1gn6 h LEU 47 N 0.78 0.22 -0.47 2.94 3.38 -1.03 -1.48 115.31 119.66 1gn6 h LEU 47 Ca 0.16 -0.10 -0.10 0.00 0.09 0.00 0.00 57.88 57.93 1gn6 h LEU 47 Cb 0.37 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.04 1gn6 h LEU 47 CO 0.01 0.65 -0.11 -0.33 0.09 0.00 0.00 178.44 178.74 1gn6 h GLU 48 N 0.17 0.90 -0.79 1.13 5.08 -0.81 -2.34 114.58 117.92 1gn6 h GLU 48 Ca 0.01 -0.35 -0.05 0.00 -1.00 0.00 0.00 59.36 57.98 1gn6 h GLU 48 Cb 0.87 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 30.04 1gn6 h GLU 48 CO 0.07 0.99 0.30 1.49 -1.00 0.00 0.00 179.01 180.87 1gn6 h GLU 49 N 0.74 1.18 -0.68 2.33 4.81 -1.08 -1.06 114.58 120.83 1gn6 h GLU 49 Ca 0.12 -0.22 -0.05 0.00 -0.13 0.00 0.00 59.36 59.08 1gn6 h GLU 49 Cb 0.66 -0.19 -0.03 0.00 0.63 0.00 0.00 28.75 29.82 1gn6 h GLU 49 CO 0.05 0.96 0.22 0.00 -0.73 0.00 0.00 179.01 179.51 1gn6 h ALA 50 N 1.18 1.11 -0.47 2.92 0.00 -1.17 -0.50 119.26 122.33 1gn6 h ALA 50 Ca 0.26 -0.20 -0.07 0.00 0.00 0.00 0.00 54.91 54.90 1gn6 h ALA 50 Cb 0.23 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 1gn6 h ALA 50 CO -0.02 0.61 0.02 0.00 0.00 0.00 0.00 179.25 179.86 1gn6 h ARG 51 N 1.00 0.82 -0.62 0.00 3.08 -1.03 -0.06 114.38 117.56 1gn6 h ARG 51 Ca 0.22 -0.25 -0.02 0.00 0.07 0.00 0.00 59.98 60.00 1gn6 h ARG 51 Cb 0.27 -0.08 -0.03 0.00 0.08 0.00 0.00 29.97 30.21 1gn6 h ARG 51 CO -0.01 0.86 0.29 0.00 -1.07 0.00 0.00 179.97 180.04 1gn6 h ALA 52 N 0.93 0.80 -0.15 0.04 0.00 -0.62 -2.41 119.26 117.85 1gn6 h ALA 52 Ca 0.14 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1gn6 h ALA 52 Cb 0.48 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.02 1gn6 h ALA 52 CO 0.02 0.37 0.00 1.63 0.00 0.00 0.00 179.25 181.27 1gn6 n LYS 53 N -4.49 1.64 -3.73 0.00 5.02 -0.25 -4.93 118.16 111.41 1gn6 n LYS 53 Ca 0.04 -0.97 -0.29 0.00 -2.02 0.00 0.00 58.31 55.08 1gn6 n LYS 53 Cb 0.13 -1.37 -0.00 0.00 -0.02 0.00 0.00 35.03 33.77 1gn6 n LYS 53 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1gn6 n GLU 54 N 0.20 -3.89 -3.86 1.97 -0.58 -0.13 -4.95 120.64 109.40 1gn6 n GLU 54 Ca 0.16 0.49 -0.30 0.00 -0.42 0.00 0.00 57.16 57.08 1gn6 n GLU 54 Cb 0.30 -5.25 -0.16 0.00 -0.57 0.00 0.00 31.44 25.76 1gn6 n GLU 54 CO 0.00 0.00 0.00 0.34 -0.48 0.00 0.00 177.13 176.99 1gn6 s ASP 55 N -3.01 3.84 -0.51 1.62 2.15 -0.65 -5.00 116.67 115.10 1gn6 s ASP 55 Ca 0.56 -1.34 0.02 0.00 0.43 0.00 0.00 52.55 52.22 1gn6 s ASP 55 Cb -0.30 -1.05 0.46 0.00 -0.30 0.00 0.00 42.92 41.74 1gn6 s ASP 55 CO 0.69 -0.31 1.71 1.41 -0.17 0.00 0.00 175.17 178.50 1gn6 n HIS 56 N 4.73 2.95 0.29 -5.34 8.25 -1.26 -4.60 115.22 120.24 1gn6 n HIS 56 Ca -0.07 -2.64 0.17 0.00 -0.26 0.00 0.00 57.72 54.92 1gn6 n HIS 56 Cb 0.44 -1.00 0.65 0.00 1.12 0.00 0.00 29.99 31.19 1gn6 n HIS 56 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 1gn6 h SER 57 N 1.97 0.00 -0.39 0.41 4.64 -1.98 -2.59 113.55 115.61 1gn6 h SER 57 Ca 0.51 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.83 1gn6 h SER 57 Cb 1.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.27 1gn6 h SER 57 CO 1.23 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 177.19 1gn6 n ALA 58 N -2.06 3.16 -0.30 5.18 0.00 -1.26 -4.75 120.51 120.48 1gn6 n ALA 58 Ca 0.01 -2.03 0.12 0.00 0.00 0.00 0.00 53.44 51.53 1gn6 n ALA 58 Cb 0.31 -0.82 0.28 0.00 0.00 0.00 0.00 19.45 19.22 1gn6 n ALA 58 CO 0.00 0.00 0.00 0.97 0.00 0.00 0.00 177.50 178.47 1gn6 h ILE 59 N 2.62 0.51 -0.59 0.00 6.09 -1.80 -0.56 117.51 123.78 1gn6 h ILE 59 Ca 0.00 -0.14 -0.02 0.00 -1.37 0.00 0.00 64.86 63.33 1gn6 h ILE 59 Cb 1.52 0.06 -0.03 0.00 0.47 0.00 0.00 36.82 38.85 1gn6 h ILE 59 CO 0.27 0.07 0.31 0.25 -3.07 0.00 0.00 178.15 175.99 1gn6 h LEU 60 N 0.41 0.75 -0.09 2.19 6.46 -1.86 -0.17 115.31 123.00 1gn6 h LEU 60 Ca 0.53 -0.11 -0.01 0.00 -0.12 0.00 0.00 57.88 58.17 1gn6 h LEU 60 Cb 0.97 -0.19 -0.00 0.00 -0.73 0.00 0.00 40.66 40.70 1gn6 h LEU 60 CO -0.51 0.64 0.02 0.25 -0.62 0.00 0.00 178.44 178.22 1gn6 h LEU 61 N 0.80 0.14 -0.49 2.25 5.85 -1.63 -2.07 115.31 120.17 1gn6 h LEU 61 Ca 0.20 -0.24 0.02 0.00 0.84 0.00 0.00 57.88 58.71 1gn6 h LEU 61 Cb 0.07 -0.04 -0.03 0.00 0.37 0.00 0.00 40.66 41.03 1gn6 h LEU 61 CO -0.03 0.35 0.28 0.78 -0.34 0.00 0.00 178.44 179.48 1gn6 h ASN 62 N -0.07 0.45 0.56 1.25 -0.26 -0.97 0.96 115.58 117.51 1gn6 h ASN 62 Ca 0.03 0.01 -0.06 0.00 -0.56 0.00 0.00 56.30 55.72 1gn6 h ASN 62 Cb 0.26 -0.09 -0.01 0.00 -1.06 0.00 0.00 38.32 37.43 1gn6 h ASN 62 CO 0.00 0.32 -0.29 -0.33 -1.06 0.00 0.00 177.43 176.07 1gn6 h GLU 63 N 0.57 0.00 0.07 0.81 4.39 -1.05 -0.65 114.58 118.72 1gn6 h GLU 63 Ca 0.20 0.00 -0.26 0.00 0.34 0.00 0.00 59.36 59.64 1gn6 h GLU 63 Cb 0.03 0.00 0.02 0.00 -0.10 0.00 0.00 28.75 28.71 1gn6 h GLU 63 CO -0.10 0.29 -1.07 -0.22 -1.16 0.00 0.00 179.01 176.75 1gn6 h LYS 64 N 0.00 0.59 -0.52 2.33 3.64 -0.56 -2.34 116.57 119.71 1gn6 h LYS 64 Ca -0.00 -0.74 -0.08 0.00 -1.27 0.00 0.00 60.65 58.56 1gn6 h LYS 64 Cb 0.65 0.23 -0.02 0.00 -0.41 0.00 0.00 32.23 32.68 1gn6 h LYS 64 CO 0.04 1.32 0.03 -0.91 -2.27 0.00 0.00 179.45 177.65 1gn6 h ASN 65 N 0.20 0.87 0.41 4.20 2.35 -0.66 -0.22 115.58 122.73 1gn6 h ASN 65 Ca -0.15 -0.29 -0.01 0.00 -0.55 0.00 0.00 56.30 55.29 1gn6 h ASN 65 Cb 1.75 -0.23 -0.01 0.00 0.05 0.00 0.00 38.32 39.88 1gn6 h ASN 65 CO 0.21 0.95 -0.30 0.25 -1.65 0.00 0.00 177.43 176.89 1gn6 h LEU 66 N 0.77 -0.76 -0.26 1.61 5.85 -1.18 -1.83 115.31 119.50 1gn6 h LEU 66 Ca 0.15 0.05 0.01 0.00 0.84 0.00 0.00 57.88 58.94 1gn6 h LEU 66 Cb 0.49 0.24 -0.02 0.00 0.37 0.00 0.00 40.66 41.74 1gn6 h LEU 66 CO 0.02 -0.45 0.13 0.00 -0.34 0.00 0.00 178.44 177.81 1gn6 h ALA 67 N -0.18 0.31 0.16 1.25 0.00 -1.30 0.13 119.26 119.63 1gn6 h ALA 67 Ca -0.04 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 1gn6 h ALA 67 Cb 0.59 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.33 1gn6 h ALA 67 CO 0.01 -0.26 -0.08 0.35 0.00 0.00 0.00 179.25 179.27 1gn6 h PHE 68 N 0.28 -0.20 -0.15 0.00 3.57 -0.98 -1.52 116.94 117.94 1gn6 h PHE 68 Ca 0.10 -0.00 -0.15 0.00 3.53 0.00 0.00 57.97 61.45 1gn6 h PHE 68 Cb 0.02 0.06 -0.01 0.00 2.79 0.00 0.00 35.95 38.82 1gn6 h PHE 68 CO -0.09 -0.00 -0.54 -0.91 -2.23 0.00 0.00 178.31 174.54 1gn6 h ASN 69 N -0.35 0.49 -0.57 0.41 2.35 -1.35 -0.26 115.58 116.29 1gn6 h ASN 69 Ca -0.02 -0.26 -0.09 0.00 -0.55 0.00 0.00 56.30 55.38 1gn6 h ASN 69 Cb 0.28 -0.14 -0.02 0.00 0.05 0.00 0.00 38.32 38.49 1gn6 h ASN 69 CO 0.04 0.93 0.01 0.25 -1.65 0.00 0.00 177.43 177.01 1gn6 h LEU 70 N 0.34 0.98 -0.65 1.61 5.85 -0.98 -1.47 115.31 121.00 1gn6 h LEU 70 Ca 0.01 -0.30 -0.13 0.00 0.84 0.00 0.00 57.88 58.30 1gn6 h LEU 70 Cb 1.05 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.81 1gn6 h LEU 70 CO 0.09 1.05 -0.30 0.00 -0.34 0.00 0.00 178.44 178.94 1gn6 h ALA 71 N 0.97 0.83 -0.63 1.25 0.00 -1.15 0.18 119.26 120.71 1gn6 h ALA 71 Ca 0.16 -0.40 0.00 0.00 0.00 0.00 0.00 54.91 54.67 1gn6 h ALA 71 Cb 0.54 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.16 1gn6 h ALA 71 CO 0.03 0.64 0.41 0.78 0.00 0.00 0.00 179.25 181.10 1gn6 h GLY 72 N 0.96 0.89 1.00 0.00 0.00 -0.72 0.40 103.07 105.60 1gn6 h GLY 72 Ca 0.07 -0.34 -0.02 0.00 0.00 0.00 0.00 47.33 47.04 1gn6 h GLY 72 CO 0.07 0.33 -0.18 0.84 0.00 0.00 0.00 176.54 177.60 1gn6 h HIS 73 N 0.85 -0.47 0.50 5.60 6.17 -0.99 -1.02 115.15 125.79 1gn6 h HIS 73 Ca 0.23 -0.01 -0.02 0.00 0.71 0.00 0.00 60.37 61.28 1gn6 h HIS 73 Cb -0.08 0.15 -0.01 0.00 2.52 0.00 0.00 27.41 30.00 1gn6 h HIS 73 CO -0.03 -0.29 -0.32 0.28 0.71 0.00 0.00 177.93 178.29 1gn6 h VAL 74 N -0.51 0.34 -0.67 5.26 2.07 -0.42 -1.75 116.25 120.57 1gn6 h VAL 74 Ca -0.05 0.00 0.12 0.00 0.82 0.00 0.00 66.70 67.59 1gn6 h VAL 74 Cb 0.39 0.34 -0.09 0.00 -1.52 0.00 0.00 31.29 30.42 1gn6 h VAL 74 CO 0.08 0.00 0.23 0.78 0.02 0.00 0.00 177.57 178.68 1gn6 h ASN 75 N -0.78 0.18 0.46 0.57 4.21 -0.87 -2.39 115.58 116.96 1gn6 h ASN 75 Ca -0.06 0.10 -0.17 0.00 1.21 0.00 0.00 56.30 57.38 1gn6 h ASN 75 Cb 0.64 0.10 -0.01 0.00 -1.12 0.00 0.00 38.32 37.93 1gn6 h ASN 75 CO 0.05 0.09 -0.74 0.45 -1.29 0.00 0.00 177.43 175.98 1gn6 h HIS 76 N 0.38 0.32 -0.98 1.19 3.86 -1.11 -2.09 115.15 116.72 1gn6 h HIS 76 Ca 0.35 -0.15 0.04 0.00 -1.16 0.00 0.00 60.37 59.46 1gn6 h HIS 76 Cb 0.51 -0.05 -0.06 0.00 1.06 0.00 0.00 27.41 28.87 1gn6 h HIS 76 CO -0.19 0.89 0.64 1.15 0.86 0.00 0.00 177.93 181.27 1gn6 h THR 77 N 0.15 1.16 -0.22 2.45 2.02 -0.83 -1.70 112.91 115.95 1gn6 h THR 77 Ca -0.03 -0.42 -0.13 0.00 0.77 0.00 0.00 66.41 66.60 1gn6 h THR 77 Cb 1.31 -0.17 0.00 0.00 -1.74 0.00 0.00 68.15 67.54 1gn6 h THR 77 CO 0.11 0.22 -0.38 0.40 0.37 0.00 0.00 175.52 176.25 1gn6 h ILE 78 N 1.22 1.32 -0.47 3.11 2.04 -1.39 -3.26 117.51 120.08 1gn6 h ILE 78 Ca 0.39 -1.60 0.09 0.00 1.00 0.00 0.00 64.86 64.75 1gn6 h ILE 78 Cb 0.03 1.81 -0.08 0.00 -0.74 0.00 0.00 36.82 37.83 1gn6 h ILE 78 CO -0.13 0.50 -0.04 -0.25 0.00 0.00 0.00 178.15 178.23 1gn6 h TRP 79 N 0.33 -0.10 -0.07 1.37 2.91 -0.78 -0.50 115.95 119.12 1gn6 h TRP 79 Ca 0.01 0.04 -0.02 0.00 1.13 0.00 0.00 58.89 60.05 1gn6 h TRP 79 Cb 0.98 0.12 -0.01 0.00 -0.51 0.00 0.00 29.16 29.74 1gn6 h TRP 79 CO 0.09 -0.14 -0.04 -1.49 -1.03 0.00 0.00 178.44 175.83 1gn6 h TRP 80 N 0.08 0.09 0.05 2.65 -0.00 -1.37 -2.58 115.95 114.86 1gn6 h TRP 80 Ca 0.23 -0.00 -0.23 0.00 -0.00 0.00 0.00 58.89 58.89 1gn6 h TRP 80 Cb 0.35 -0.03 -0.01 0.00 -0.00 0.00 0.00 29.16 29.47 1gn6 h TRP 80 CO -0.33 0.14 -1.07 0.87 -0.00 0.00 0.00 178.44 178.05 1gn6 h LYS 81 N 0.09 0.13 0.00 0.49 1.79 -1.36 -3.23 116.57 114.47 1gn6 h LYS 81 Ca 0.02 -0.20 0.00 0.00 -2.18 0.00 0.00 60.65 58.29 1gn6 h LYS 81 Cb 0.14 0.07 0.00 0.00 -1.58 0.00 0.00 32.23 30.86 1gn6 h LYS 81 CO 0.01 1.07 0.00 0.09 -1.08 0.00 0.00 179.45 179.54 1gn6 n ASN 82 N -3.46 0.00 -4.70 0.86 5.03 -0.29 -4.74 115.26 107.96 1gn6 n ASN 82 Ca -0.04 0.10 -0.34 0.00 0.87 0.00 0.00 54.58 55.18 1gn6 n ASN 82 Cb 0.95 -0.34 -0.09 0.00 -1.02 0.00 0.00 39.78 39.28 1gn6 n ASN 82 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 1gn6 s LEU 83 N -2.69 3.60 -0.10 3.41 1.43 -1.10 0.43 118.68 123.66 1gn6 s LEU 83 Ca 0.19 0.08 -0.30 0.00 -1.03 0.00 0.00 54.13 53.07 1gn6 s LEU 83 Cb 0.16 -1.98 0.07 0.00 0.03 0.00 0.00 46.19 44.47 1gn6 s LEU 83 CO 0.38 0.32 0.69 -0.55 0.23 0.00 0.00 176.35 177.42 1gn6 s SER 84 N -1.32 -0.68 0.24 2.29 0.15 0.66 -4.71 113.70 110.33 1gn6 s SER 84 Ca 0.18 0.89 0.02 0.00 0.70 0.00 0.00 55.95 57.73 1gn6 s SER 84 Cb -0.11 0.75 0.27 0.00 -1.71 0.00 0.00 66.02 65.22 1gn6 s SER 84 CO 0.08 -0.52 1.59 -0.65 1.20 0.00 0.00 173.24 174.94 1gn6 h PRO 85 N 3.46 0.36 -1.06 5.44 0.11 -1.84 -2.74 132.00 135.73 1gn6 h PRO 85 Ca -0.27 -0.21 -0.56 0.00 0.11 0.00 0.00 66.00 65.07 1gn6 h PRO 85 Cb 1.14 0.02 -0.27 0.00 0.11 0.00 0.00 31.00 32.00 1gn6 h PRO 85 CO 0.31 0.78 0.72 0.09 -0.21 0.00 0.00 178.00 179.69 1gn6 n ASN 86 N -3.96 6.01 -0.62 -2.05 3.02 -1.26 -4.94 115.26 111.47 1gn6 n ASN 86 Ca -0.02 -3.58 0.00 0.00 -0.03 0.00 0.00 54.58 50.95 1gn6 n ASN 86 Cb 0.56 -0.92 0.00 0.00 -0.61 0.00 0.00 39.78 38.80 1gn6 n ASN 86 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1gn6 n GLY 87 N -0.81 3.85 1.98 7.41 0.00 -1.03 -5.02 105.19 111.57 1gn6 n GLY 87 Ca 0.56 -2.08 0.00 0.00 0.00 0.00 0.00 46.02 44.51 1gn6 n GLY 87 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1gn6 n GLY 88 N 5.00 -1.80 7.00 -0.02 0.00 -0.25 -4.74 105.19 110.38 1gn6 n GLY 88 Ca 0.00 -1.82 0.00 0.00 0.00 0.00 0.00 46.02 44.20 1gn6 n GLY 88 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1gn6 n ASP 89 N 0.02 -0.10 -4.35 1.61 9.92 -1.26 -4.87 116.55 117.52 1gn6 n ASP 89 Ca 0.00 0.00 -0.18 0.00 -0.53 0.00 0.00 54.79 54.08 1gn6 n ASP 89 Cb 0.00 0.00 -0.10 0.00 -0.64 0.00 0.00 41.12 40.38 1gn6 n ASP 89 CO 0.00 0.00 0.00 -0.54 0.13 0.00 0.00 177.20 176.79 1gn6 s LYS 90 N 0.00 1.37 0.89 -1.24 1.02 -1.26 -5.01 119.74 115.51 1gn6 s LYS 90 Ca 0.00 -1.69 -0.12 0.00 0.02 0.00 0.00 55.97 54.19 1gn6 s LYS 90 Cb 0.00 -0.74 0.12 0.00 -0.52 0.00 0.00 37.83 36.70 1gn6 s LYS 90 CO 0.00 -0.06 1.10 -1.25 -0.92 0.00 0.00 175.35 174.22 1gn6 s PRO 91 N -3.83 1.34 0.14 -1.68 0.04 -1.26 -5.00 135.00 124.75 1gn6 s PRO 91 Ca 0.28 0.66 0.00 0.00 0.04 0.00 0.00 61.00 61.98 1gn6 s PRO 91 Cb 0.05 -1.83 -0.04 0.00 0.04 0.00 0.00 34.50 32.72 1gn6 s PRO 91 CO 0.09 -2.14 0.03 0.95 0.04 0.00 0.00 177.00 175.97 1gn6 s THR 92 N -3.04 0.32 0.00 1.26 -4.23 -1.26 -4.68 115.64 104.00 1gn6 s THR 92 Ca 0.63 -1.93 0.00 0.00 -1.18 0.00 0.00 61.69 59.21 1gn6 s THR 92 Cb -0.17 -2.06 0.00 0.00 1.34 0.00 0.00 72.50 71.61 1gn6 s THR 92 CO 0.56 -0.48 0.00 0.61 -0.54 0.00 0.00 174.62 174.76 1gn6 n GLY 93 N -0.14 2.48 0.21 3.99 0.00 -1.26 -3.43 105.19 107.04 1gn6 n GLY 93 Ca -0.06 -0.47 -0.01 0.00 0.00 0.00 0.00 46.02 45.48 1gn6 n GLY 93 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1gn6 h GLU 94 N 0.00 0.24 -0.42 1.61 5.08 -1.99 -1.44 114.58 117.67 1gn6 h GLU 94 Ca 0.00 -0.01 0.02 0.00 -1.00 0.00 0.00 59.36 58.36 1gn6 h GLU 94 Cb 0.00 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.17 1gn6 h GLU 94 CO 0.00 0.16 0.25 1.25 -1.00 0.00 0.00 179.01 179.67 1gn6 h LEU 95 N 0.25 0.41 -1.33 1.33 5.85 -1.94 0.31 115.31 120.19 1gn6 h LEU 95 Ca 0.27 0.00 0.08 0.00 0.84 0.00 0.00 57.88 59.08 1gn6 h LEU 95 Cb 0.38 -0.09 -0.05 0.00 0.37 0.00 0.00 40.66 41.27 1gn6 h LEU 95 CO -0.35 0.30 0.52 0.00 -0.34 0.00 0.00 178.44 178.56 1gn6 h ALA 96 N 1.18 1.71 0.10 1.25 0.00 -1.38 0.38 119.26 122.50 1gn6 h ALA 96 Ca 0.16 -0.01 -0.28 0.00 0.00 0.00 0.00 54.91 54.78 1gn6 h ALA 96 Cb -0.00 -0.19 0.03 0.00 0.00 0.00 0.00 17.79 17.63 1gn6 h ALA 96 CO -0.07 0.14 -1.15 0.00 0.00 0.00 0.00 179.25 178.17 1gn6 h ALA 97 N 1.59 -0.00 -0.22 0.00 0.00 -0.71 -2.52 119.26 117.40 1gn6 h ALA 97 Ca 0.35 -0.74 0.03 0.00 0.00 0.00 0.00 54.91 54.55 1gn6 h ALA 97 Cb 0.36 0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.23 1gn6 h ALA 97 CO -0.13 0.63 0.05 0.00 0.00 0.00 0.00 179.25 179.80 1gn6 h ALA 98 N 0.28 0.23 -0.49 0.00 0.00 0.78 -1.28 119.26 118.79 1gn6 h ALA 98 Ca -0.17 0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.72 1gn6 h ALA 98 Cb 1.83 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 19.65 1gn6 h ALA 98 CO 0.22 -0.38 0.10 0.82 0.00 0.00 0.00 179.25 180.01 1gn6 h ILE 99 N 0.14 1.24 -0.24 0.00 2.04 -0.38 0.53 117.51 120.84 1gn6 h ILE 99 Ca 0.10 -0.88 -0.06 0.00 1.00 0.00 0.00 64.86 65.02 1gn6 h ILE 99 Cb 0.09 0.88 -0.01 0.00 -0.74 0.00 0.00 36.82 37.04 1gn6 h ILE 99 CO -0.13 0.31 -0.10 0.00 0.00 0.00 0.00 178.15 178.24 1gn6 h ALA 100 N 0.97 1.39 -0.12 1.87 0.00 -1.21 -1.06 119.26 121.10 1gn6 h ALA 100 Ca 0.15 -0.22 -0.22 0.00 0.00 0.00 0.00 54.91 54.61 1gn6 h ALA 100 Cb 0.36 -0.12 0.01 0.00 0.00 0.00 0.00 17.79 18.05 1gn6 h ALA 100 CO 0.01 0.42 -0.80 0.22 0.00 0.00 0.00 179.25 179.10 1gn6 h ASP 101 N 0.37 0.92 1.20 0.00 -0.00 -1.04 0.26 116.42 118.12 1gn6 h ASP 101 Ca 0.07 -0.65 -0.16 0.00 -0.00 0.00 0.00 57.03 56.29 1gn6 h ASP 101 Cb 0.40 -0.27 -0.02 0.00 -0.00 0.00 0.00 39.33 39.43 1gn6 h ASP 101 CO 0.02 1.42 -0.81 0.00 -0.00 0.00 0.00 179.24 179.88 1gn6 h ALA 102 N 0.52 0.53 -0.00 -0.78 0.00 -0.60 -3.37 119.26 115.55 1gn6 h ALA 102 Ca -0.06 -0.71 0.00 0.00 0.00 0.00 0.00 54.91 54.14 1gn6 h ALA 102 Cb 1.43 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.15 1gn6 h ALA 102 CO 0.16 0.95 -0.12 1.19 0.00 0.00 0.00 179.25 181.43 1gn6 n PHE 103 N -3.26 0.00 0.00 0.00 3.72 -0.43 -5.02 117.46 112.47 1gn6 n PHE 103 Ca -0.00 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.40 1gn6 n PHE 103 Cb 0.84 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.38 1gn6 n PHE 103 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1gn6 n GLY 104 N 0.79 2.39 3.75 1.37 0.00 0.90 -4.52 105.19 109.87 1gn6 n GLY 104 Ca 0.01 -0.70 -0.08 0.00 0.00 0.00 0.00 46.02 45.25 1gn6 n GLY 104 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1gn6 s SER 105 N 0.00 -0.18 0.12 1.61 1.04 -1.24 -4.61 113.70 110.45 1gn6 s SER 105 Ca 0.00 -0.75 -0.20 0.00 0.48 0.00 0.00 55.95 55.48 1gn6 s SER 105 Cb 0.00 0.68 -0.05 0.00 0.10 0.00 0.00 66.02 66.75 1gn6 s SER 105 CO 0.00 -1.28 1.75 0.15 0.98 0.00 0.00 173.24 174.84 1gn6 h PHE 106 N 2.10 0.14 -0.82 5.02 3.57 -1.91 -1.58 116.94 123.45 1gn6 h PHE 106 Ca -0.22 0.01 0.04 0.00 3.53 0.00 0.00 57.97 61.33 1gn6 h PHE 106 Cb 1.25 -0.03 -0.05 0.00 2.79 0.00 0.00 35.95 39.91 1gn6 h PHE 106 CO 0.45 0.07 0.54 -0.44 -2.23 0.00 0.00 178.31 176.71 1gn6 h ASP 107 N 0.17 0.86 0.37 0.41 3.32 -1.97 0.34 116.42 119.92 1gn6 h ASP 107 Ca 0.08 -0.01 -0.09 0.00 0.02 0.00 0.00 57.03 57.03 1gn6 h ASP 107 Cb 0.04 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.38 1gn6 h ASP 107 CO -0.07 0.59 -0.40 0.11 -1.72 0.00 0.00 179.24 177.75 1gn6 h LYS 108 N 1.00 0.04 -0.31 3.56 1.57 -1.69 -1.71 116.57 119.03 1gn6 h LYS 108 Ca 0.33 -0.02 -0.18 0.00 -1.87 0.00 0.00 60.65 58.92 1gn6 h LYS 108 Cb 0.07 -0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.37 1gn6 h LYS 108 CO -0.10 0.44 -0.50 0.35 -0.57 0.00 0.00 179.45 179.06 1gn6 h PHE 109 N 0.04 1.08 -0.71 -1.35 3.57 -0.21 -2.73 116.94 116.63 1gn6 h PHE 109 Ca 0.00 -0.37 -0.06 0.00 3.53 0.00 0.00 57.97 61.07 1gn6 h PHE 109 Cb 0.72 -0.21 -0.03 0.00 2.79 0.00 0.00 35.95 39.22 1gn6 h PHE 109 CO 0.00 1.19 0.20 -0.09 -2.23 0.00 0.00 178.31 177.38 1gn6 h ARG 110 N 0.68 1.13 -0.20 1.11 2.43 -0.69 -1.16 114.38 117.68 1gn6 h ARG 110 Ca 0.03 -0.26 -0.13 0.00 -0.81 0.00 0.00 59.98 58.81 1gn6 h ARG 110 Cb 1.10 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 30.49 1gn6 h ARG 110 CO 0.11 0.98 -0.42 0.00 -1.51 0.00 0.00 179.97 179.14 1gn6 h ALA 111 N 1.10 0.91 -0.16 2.80 0.00 -1.27 0.20 119.26 122.84 1gn6 h ALA 111 Ca 0.23 -0.44 -0.11 0.00 0.00 0.00 0.00 54.91 54.58 1gn6 h ALA 111 Cb 0.34 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.03 1gn6 h ALA 111 CO -0.00 0.64 -0.34 0.37 0.00 0.00 0.00 179.25 179.91 1gn6 h GLN 112 N 0.38 0.52 -0.85 0.00 4.15 -1.19 -1.59 115.11 116.53 1gn6 h GLN 112 Ca 0.03 -0.34 -0.00 0.00 0.77 0.00 0.00 58.65 59.11 1gn6 h GLN 112 Cb 0.89 0.04 -0.04 0.00 0.21 0.00 0.00 27.48 28.59 1gn6 h GLN 112 CO 0.08 0.95 0.53 0.35 -1.93 0.00 0.00 178.83 178.80 1gn6 h PHE 113 N 0.16 1.10 -0.22 3.99 3.57 -1.14 0.25 116.94 124.65 1gn6 h PHE 113 Ca 0.00 0.01 -0.06 0.00 3.53 0.00 0.00 57.97 61.45 1gn6 h PHE 113 Cb 0.94 -0.36 -0.01 0.00 2.79 0.00 0.00 35.95 39.30 1gn6 h PHE 113 CO 0.10 0.72 -0.11 1.25 -2.23 0.00 0.00 178.31 178.04 1gn6 h HIS 114 N 1.16 0.37 -0.01 0.41 2.76 -0.46 -0.77 115.15 118.61 1gn6 h HIS 114 Ca 0.31 -0.04 -0.24 0.00 -2.20 0.00 0.00 60.37 58.19 1gn6 h HIS 114 Cb -0.07 -0.10 0.01 0.00 1.55 0.00 0.00 27.41 28.79 1gn6 h HIS 114 CO -0.01 0.46 -0.97 0.00 -1.30 0.00 0.00 177.93 176.11 1gn6 h ALA 115 N 1.56 0.27 -0.58 5.26 0.00 -0.53 -2.03 119.26 123.21 1gn6 h ALA 115 Ca 0.07 -0.70 -0.08 0.00 0.00 0.00 0.00 54.91 54.19 1gn6 h ALA 115 Cb 0.40 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 1gn6 h ALA 115 CO 0.02 0.76 0.04 0.00 0.00 0.00 0.00 179.25 180.07 1gn6 h ALA 116 N 0.61 0.96 -0.26 0.00 0.00 -0.66 -2.63 119.26 117.28 1gn6 h ALA 116 Ca -0.10 -0.28 -0.15 0.00 0.00 0.00 0.00 54.91 54.38 1gn6 h ALA 116 Cb 1.62 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 19.17 1gn6 h ALA 116 CO 0.18 0.64 -0.45 0.00 0.00 0.00 0.00 179.25 179.61 1gn6 h ALA 117 N 1.12 0.73 -0.03 0.00 0.00 -1.14 -3.29 119.26 116.65 1gn6 h ALA 117 Ca 0.17 -0.47 0.00 0.00 0.00 0.00 0.00 54.91 54.62 1gn6 h ALA 117 Cb 0.48 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.17 1gn6 h ALA 117 CO 0.02 0.67 0.00 0.25 0.00 0.00 0.00 179.25 180.19 1gn6 n THR 118 N -4.01 0.02 -0.27 0.00 -2.24 -0.77 -4.19 114.28 102.82 1gn6 n THR 118 Ca -0.02 -0.31 0.06 0.00 -2.27 0.00 0.00 64.05 61.50 1gn6 n THR 118 Cb 0.55 0.69 0.16 0.00 -2.10 0.00 0.00 70.33 69.64 1gn6 n THR 118 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1gn6 n THR 119 N 0.43 1.15 -1.95 4.28 -2.24 -1.00 -5.02 114.28 109.93 1gn6 n THR 119 Ca 0.18 -1.10 -0.40 0.00 -2.27 0.00 0.00 64.05 60.46 1gn6 n THR 119 Cb 0.40 0.41 0.00 0.00 -2.10 0.00 0.00 70.33 69.05 1gn6 n THR 119 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1gn6 s VAL 120 N -1.22 2.40 -0.97 2.28 1.01 -1.26 -4.93 120.40 117.72 1gn6 s VAL 120 Ca 0.25 0.36 -0.04 0.00 0.00 0.00 0.00 61.98 62.56 1gn6 s VAL 120 Cb 0.15 -3.21 0.25 0.00 0.00 0.00 0.00 36.38 33.56 1gn6 s VAL 120 CO 0.15 0.05 0.95 0.00 0.00 0.00 0.00 175.10 176.25 1gn6 n GLN 121 N -0.01 3.07 0.00 2.72 6.02 -1.26 -4.91 117.38 123.01 1gn6 n GLN 121 Ca 0.04 -4.49 0.00 0.00 -0.01 0.00 0.00 57.00 52.54 1gn6 n GLN 121 Cb 0.43 -2.45 0.00 0.00 1.02 0.00 0.00 30.24 29.24 1gn6 n GLN 121 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1gn6 n GLY 122 N 2.23 0.71 3.78 1.08 0.00 -1.26 -5.06 105.19 106.67 1gn6 n GLY 122 Ca 0.23 -2.03 -0.37 0.00 0.00 0.00 0.00 46.02 43.85 1gn6 n GLY 122 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1gn6 s SER 123 N -4.00 6.89 0.00 1.61 0.01 -1.26 -4.93 113.70 112.01 1gn6 s SER 123 Ca 0.00 2.02 0.00 0.00 1.31 0.00 0.00 55.95 59.28 1gn6 s SER 123 Cb 0.00 -2.59 0.00 0.00 0.21 0.00 0.00 66.02 63.64 1gn6 s SER 123 CO 0.00 -0.40 0.00 0.61 0.41 0.00 0.00 173.24 173.86 1gn6 n GLY 124 N 0.43 -1.27 3.37 3.44 0.00 -1.26 -0.55 105.19 109.36 1gn6 n GLY 124 Ca 0.04 -0.91 -0.10 0.00 0.00 0.00 0.00 46.02 45.06 1gn6 n GLY 124 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1gn6 s TRP 125 N -2.70 0.34 -0.07 1.61 0.52 -0.44 -0.26 118.94 117.93 1gn6 s TRP 125 Ca 0.00 -0.70 -0.01 0.00 0.02 0.00 0.00 56.10 55.42 1gn6 s TRP 125 Cb 0.00 0.01 -0.03 0.00 -1.15 0.00 0.00 33.47 32.29 1gn6 s TRP 125 CO 0.00 -0.76 -0.02 0.00 0.02 0.00 0.00 176.95 176.20 1gn6 s ALA 126 N -3.96 3.20 -0.02 0.98 0.00 -0.59 -1.76 121.76 119.60 1gn6 s ALA 126 Ca 0.16 -0.85 -0.01 0.00 0.00 0.00 0.00 51.96 51.27 1gn6 s ALA 126 Cb 0.03 -1.39 0.02 0.00 0.00 0.00 0.00 23.12 21.77 1gn6 s ALA 126 CO 0.00 0.59 0.05 0.00 0.00 0.00 0.00 175.76 176.40 1gn6 s ALA 127 N -0.89 -0.07 -0.34 0.00 0.00 0.11 -1.94 121.76 118.63 1gn6 s ALA 127 Ca 0.14 0.25 -0.13 0.00 0.00 0.00 0.00 51.96 52.21 1gn6 s ALA 127 Cb -0.11 -0.17 -0.02 0.00 0.00 0.00 0.00 23.12 22.82 1gn6 s ALA 127 CO 0.03 -0.06 0.26 -1.17 0.00 0.00 0.00 175.76 174.81 1gn6 s LEU 128 N 0.49 4.52 0.24 0.00 2.96 -0.48 0.37 118.68 126.80 1gn6 s LEU 128 Ca -0.04 -0.40 0.02 0.00 -0.22 0.00 0.00 54.13 53.49 1gn6 s LEU 128 Cb -0.06 -2.17 -0.05 0.00 0.50 0.00 0.00 46.19 44.42 1gn6 s LEU 128 CO -0.02 -0.25 0.04 -0.83 -1.32 0.00 0.00 176.35 173.97 1gn6 s GLY 129 N 1.72 1.63 -0.18 7.98 0.00 0.08 0.28 107.32 118.83 1gn6 s GLY 129 Ca 0.07 -1.81 -0.02 0.00 0.00 0.00 0.00 44.72 42.95 1gn6 s GLY 129 CO 0.11 -1.63 -0.08 0.86 0.00 0.00 0.00 173.10 172.35 1gn6 s TRP 130 N -3.58 2.90 -0.50 1.90 -0.11 -0.05 -1.24 118.94 118.27 1gn6 s TRP 130 Ca 0.32 -0.86 -0.25 0.00 1.22 0.00 0.00 56.10 56.53 1gn6 s TRP 130 Cb 0.07 -2.00 0.03 0.00 -1.50 0.00 0.00 33.47 30.07 1gn6 s TRP 130 CO 0.11 -0.43 0.96 0.34 -4.62 0.00 0.00 176.95 173.31 1gn6 s ASP 131 N 1.03 6.45 0.41 5.86 2.15 0.17 -2.50 116.67 130.24 1gn6 s ASP 131 Ca -0.00 -0.02 0.11 0.00 0.43 0.00 0.00 52.55 53.07 1gn6 s ASP 131 Cb -0.15 -2.46 0.88 0.00 -0.30 0.00 0.00 42.92 40.90 1gn6 s ASP 131 CO -0.01 -1.15 1.97 0.71 -0.17 0.00 0.00 175.17 176.52 1gn6 h THR 132 N 6.08 1.14 0.44 1.71 1.35 -1.86 0.39 112.91 122.15 1gn6 h THR 132 Ca -0.25 -0.62 -0.02 0.00 -0.55 0.00 0.00 66.41 64.97 1gn6 h THR 132 Cb 1.07 1.16 0.00 0.00 -1.73 0.00 0.00 68.15 68.66 1gn6 h THR 132 CO 1.06 0.19 -0.21 0.25 -0.25 0.00 0.00 175.52 176.57 1gn6 h LEU 133 N 0.18 -0.50 -2.63 3.87 5.85 -1.92 -3.27 115.31 116.89 1gn6 h LEU 133 Ca 0.04 -0.10 0.00 0.00 0.84 0.00 0.00 57.88 58.66 1gn6 h LEU 133 Cb 0.29 0.13 0.00 0.00 0.37 0.00 0.00 40.66 41.45 1gn6 h LEU 133 CO 0.02 -0.15 0.00 0.61 -0.34 0.00 0.00 178.44 178.58 1gn6 n GLY 134 N -0.51 2.33 3.94 3.75 0.00 -1.21 -4.97 105.19 108.54 1gn6 n GLY 134 Ca -0.10 -0.78 -0.28 0.00 0.00 0.00 0.00 46.02 44.85 1gn6 n GLY 134 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1gn6 n ASN 135 N 1.61 -2.59 -4.32 1.61 4.13 0.13 -4.99 115.26 110.84 1gn6 n ASN 135 Ca 0.24 -0.89 -0.20 0.00 1.68 0.00 0.00 54.58 55.40 1gn6 n ASN 135 Cb 0.61 -3.48 -0.11 0.00 -1.54 0.00 0.00 39.78 35.27 1gn6 n ASN 135 CO 0.00 0.00 0.00 -0.54 0.28 0.00 0.00 177.26 177.00 1gn6 s LYS 136 N -6.54 1.25 -0.20 3.52 1.02 -1.11 -4.94 119.74 112.76 1gn6 s LYS 136 Ca 0.37 -1.44 -0.15 0.00 0.02 0.00 0.00 55.97 54.78 1gn6 s LYS 136 Cb -0.19 -1.21 -0.04 0.00 -0.52 0.00 0.00 37.83 35.86 1gn6 s LYS 136 CO 0.86 0.23 0.38 -0.51 -0.92 0.00 0.00 175.35 175.39 1gn6 s LEU 137 N -2.82 4.16 0.11 3.17 1.43 -1.26 0.44 118.68 123.91 1gn6 s LEU 137 Ca 0.17 0.50 0.03 0.00 -1.03 0.00 0.00 54.13 53.80 1gn6 s LEU 137 Cb -0.04 -2.48 -0.04 0.00 0.03 0.00 0.00 46.19 43.66 1gn6 s LEU 137 CO 0.06 -0.05 -0.09 -0.76 0.23 0.00 0.00 176.35 175.74 1gn6 s LEU 138 N 1.20 2.44 -0.12 1.79 1.43 -0.37 -4.94 118.68 120.11 1gn6 s LEU 138 Ca 0.18 -0.88 -0.04 0.00 -1.03 0.00 0.00 54.13 52.37 1gn6 s LEU 138 Cb -0.14 -0.27 -0.03 0.00 0.03 0.00 0.00 46.19 45.77 1gn6 s LEU 138 CO 0.07 -0.31 0.03 -0.63 0.23 0.00 0.00 176.35 175.74 1gn6 s ILE 139 N -2.78 4.50 0.06 -0.59 1.01 -1.26 -0.74 121.20 121.40 1gn6 s ILE 139 Ca 0.08 -0.16 0.08 0.00 0.00 0.00 0.00 60.65 60.65 1gn6 s ILE 139 Cb -0.01 -2.94 -0.03 0.00 0.01 0.00 0.00 42.46 39.49 1gn6 s ILE 139 CO -0.01 0.56 -0.23 -0.36 0.00 0.00 0.00 174.94 174.90 1gn6 s PHE 140 N -0.47 2.01 -0.30 3.97 0.08 0.16 -4.97 117.98 118.46 1gn6 s PHE 140 Ca 0.09 -0.39 -0.06 0.00 0.12 0.00 0.00 56.93 56.68 1gn6 s PHE 140 Cb -0.12 -1.17 0.01 0.00 -0.57 0.00 0.00 43.02 41.17 1gn6 s PHE 140 CO 0.02 0.15 0.07 -1.14 -0.10 0.00 0.00 175.22 174.22 1gn6 s GLN 141 N -1.40 3.03 -0.10 0.44 0.74 -1.26 -0.71 119.66 120.39 1gn6 s GLN 141 Ca 0.09 -0.90 -0.13 0.00 0.05 0.00 0.00 55.36 54.48 1gn6 s GLN 141 Cb -0.09 -3.36 -0.05 0.00 1.10 0.00 0.00 33.01 30.61 1gn6 s GLN 141 CO 0.03 -0.46 0.31 0.08 -0.55 0.00 0.00 175.29 174.70 1gn6 s VAL 142 N 1.48 5.24 -0.10 1.34 1.01 -0.73 -4.73 120.40 123.91 1gn6 s VAL 142 Ca 0.02 0.61 -0.14 0.00 0.00 0.00 0.00 61.98 62.47 1gn6 s VAL 142 Cb -0.17 -3.63 -0.05 0.00 0.00 0.00 0.00 36.38 32.53 1gn6 s VAL 142 CO 0.02 0.49 0.34 -0.31 0.00 0.00 0.00 175.10 175.64 1gn6 s TYR 143 N -0.33 3.56 0.00 5.22 2.02 -0.51 -1.33 117.35 125.98 1gn6 s TYR 143 Ca 0.19 0.75 0.00 0.00 -0.37 0.00 0.00 57.07 57.64 1gn6 s TYR 143 Cb -0.14 -2.31 0.00 0.00 -0.40 0.00 0.00 41.96 39.10 1gn6 s TYR 143 CO 0.07 0.40 0.00 -0.25 -1.57 0.00 0.00 175.55 174.21 1gn6 n ASP 144 N 2.90 0.00 0.00 2.29 8.00 0.29 -2.49 116.55 127.54 1gn6 n ASP 144 Ca -0.13 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.37 1gn6 n ASP 144 Cb 0.52 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.62 1gn6 n ASP 144 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 1gn6 n HIS 145 N 5.36 0.00 -1.32 1.24 8.25 -1.26 -4.13 115.22 123.36 1gn6 n HIS 145 Ca 0.00 0.00 0.08 0.00 -0.26 0.00 0.00 57.72 57.54 1gn6 n HIS 145 Cb 0.00 0.00 0.17 0.00 1.12 0.00 0.00 29.99 31.28 1gn6 n HIS 145 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1gn6 n GLN 146 N -1.30 1.45 -4.14 -0.41 0.00 -1.22 -4.81 117.38 106.95 1gn6 n GLN 146 Ca 0.00 -2.93 -0.14 0.00 0.00 0.00 0.00 57.00 53.92 1gn6 n GLN 146 Cb 0.23 -1.56 -0.11 0.00 0.00 0.00 0.00 30.24 28.80 1gn6 n GLN 146 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.06 178.05 1gn6 s THR 147 N -3.05 0.82 -0.07 -0.39 2.01 -1.04 -4.93 115.64 109.00 1gn6 s THR 147 Ca 0.35 -1.40 -0.00 0.00 0.31 0.00 0.00 61.69 60.95 1gn6 s THR 147 Cb 0.32 -1.06 0.00 0.00 0.01 0.00 0.00 72.50 71.77 1gn6 s THR 147 CO -0.02 -0.45 0.06 -3.20 -0.69 0.00 0.00 174.62 170.32 1gn6 n ASN 148 N 0.98 -2.08 -3.54 3.53 5.15 -1.26 -1.42 115.26 116.62 1gn6 n ASN 148 Ca -0.19 -0.03 -0.08 0.00 -0.60 0.00 0.00 54.58 53.67 1gn6 n ASN 148 Cb 0.56 -0.74 -0.02 0.00 -0.53 0.00 0.00 39.78 39.05 1gn6 n ASN 148 CO 0.00 0.00 0.00 0.72 1.40 0.00 0.00 177.26 179.38 1gn6 s PHE 149 N -3.02 -0.35 0.61 1.20 -0.71 -1.26 -4.42 117.98 110.03 1gn6 s PHE 149 Ca 0.01 0.16 -0.03 0.00 -1.04 0.00 0.00 56.93 56.03 1gn6 s PHE 149 Cb -0.00 0.56 0.04 0.00 -1.21 0.00 0.00 43.02 42.40 1gn6 s PHE 149 CO 0.04 -0.66 0.88 -1.25 -1.34 0.00 0.00 175.22 172.89 1gn6 s PRO 150 N -3.29 2.52 0.56 1.99 0.04 -1.26 -5.07 135.00 130.49 1gn6 s PRO 150 Ca 0.05 -0.41 -0.17 0.00 0.04 0.00 0.00 61.00 60.51 1gn6 s PRO 150 Cb -0.01 -2.33 -0.05 0.00 0.04 0.00 0.00 34.50 32.14 1gn6 s PRO 150 CO -0.08 -0.88 1.05 -0.51 0.04 0.00 0.00 177.00 176.63 1gn6 s LEU 151 N -4.97 3.61 0.00 -3.56 1.43 -1.26 -3.82 118.68 110.11 1gn6 s LEU 151 Ca 0.57 1.84 0.00 0.00 -1.03 0.00 0.00 54.13 55.51 1gn6 s LEU 151 Cb -0.10 -4.54 0.00 0.00 0.03 0.00 0.00 46.19 41.58 1gn6 s LEU 151 CO 0.42 -1.01 0.00 0.00 0.23 0.00 0.00 176.35 175.99 1gn6 n ALA 152 N -1.68 0.00 -1.77 4.21 0.00 -1.26 -5.02 120.51 115.00 1gn6 n ALA 152 Ca 0.09 0.00 -0.38 0.00 0.00 0.00 0.00 53.44 53.15 1gn6 n ALA 152 Cb 0.53 -0.68 -0.06 0.00 0.00 0.00 0.00 19.45 19.24 1gn6 n ALA 152 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1gn6 s ILE 153 N -1.73 4.07 -0.24 0.00 -1.09 -1.25 -4.48 121.20 116.48 1gn6 s ILE 153 Ca 0.00 1.82 -0.06 0.00 -2.23 0.00 0.00 60.65 60.17 1gn6 s ILE 153 Cb 0.00 -4.05 -0.02 0.00 -1.58 0.00 0.00 42.46 36.81 1gn6 s ILE 153 CO 0.00 0.23 0.04 -0.69 -1.23 0.00 0.00 174.94 173.30 1gn6 s VAL 154 N -1.48 4.08 0.19 2.92 1.01 -1.04 -4.90 120.40 121.19 1gn6 s VAL 154 Ca 0.48 -0.26 -0.30 0.00 0.00 0.00 0.00 61.98 61.91 1gn6 s VAL 154 Cb -0.22 -2.90 -0.08 0.00 0.00 0.00 0.00 36.38 33.17 1gn6 s VAL 154 CO 0.27 0.35 1.25 -2.16 0.00 0.00 0.00 175.10 174.82 1gn6 s PRO 155 N 1.58 4.44 -0.11 2.72 0.04 -1.26 -0.87 135.00 141.54 1gn6 s PRO 155 Ca 0.06 1.96 -0.04 0.00 0.04 0.00 0.00 61.00 63.02 1gn6 s PRO 155 Cb -0.15 -3.22 -0.05 0.00 0.04 0.00 0.00 34.50 31.12 1gn6 s PRO 155 CO 0.02 -0.16 -0.13 1.28 0.04 0.00 0.00 177.00 178.05 1gn6 n LEU 156 N 2.53 1.29 -3.92 -3.56 4.77 0.14 -4.95 117.00 113.30 1gn6 n LEU 156 Ca 0.05 0.09 -0.16 0.00 -0.03 0.00 0.00 56.01 55.95 1gn6 n LEU 156 Cb 0.44 -0.33 -0.15 0.00 -2.33 0.00 0.00 43.42 41.05 1gn6 n LEU 156 CO 0.57 0.33 -0.40 -0.22 -1.33 0.00 0.00 177.39 176.34 1gn6 s LEU 157 N -6.35 1.78 0.03 2.23 2.96 -1.12 -4.57 118.68 113.63 1gn6 s LEU 157 Ca -0.15 -0.09 0.02 0.00 -0.22 0.00 0.00 54.13 53.70 1gn6 s LEU 157 Cb 0.05 -0.28 -0.02 0.00 0.50 0.00 0.00 46.19 46.45 1gn6 s LEU 157 CO 0.20 0.02 -0.07 -0.76 -1.32 0.00 0.00 176.35 174.42 1gn6 s LEU 158 N 0.21 2.19 -0.19 -0.68 1.43 -1.26 -1.38 118.68 119.00 1gn6 s LEU 158 Ca -0.02 -0.43 0.01 0.00 -1.03 0.00 0.00 54.13 52.65 1gn6 s LEU 158 Cb -0.06 -0.20 0.04 0.00 0.03 0.00 0.00 46.19 46.01 1gn6 s LEU 158 CO -0.00 -0.13 -0.11 -0.22 0.23 0.00 0.00 176.35 176.12 1gn6 s LEU 159 N -1.20 2.22 -0.32 1.79 2.96 -0.82 -4.84 118.68 118.46 1gn6 s LEU 159 Ca -0.07 -0.85 -0.29 0.00 -0.22 0.00 0.00 54.13 52.71 1gn6 s LEU 159 Cb -0.08 -1.22 -0.02 0.00 0.50 0.00 0.00 46.19 45.37 1gn6 s LEU 159 CO 0.00 -0.14 1.70 -0.62 -1.32 0.00 0.00 176.35 175.98 1gn6 s ASP 160 N 1.41 6.06 -0.15 3.68 -1.08 -1.26 -1.54 116.67 123.79 1gn6 s ASP 160 Ca -0.01 1.29 0.15 0.00 -0.52 0.00 0.00 52.55 53.47 1gn6 s ASP 160 Cb -0.16 -2.53 0.54 0.00 -1.46 0.00 0.00 42.92 39.31 1gn6 s ASP 160 CO -0.08 -1.57 1.45 0.23 0.52 0.00 0.00 175.17 175.71 1gn6 n MET 161 N 8.23 3.23 -2.48 4.34 2.81 0.65 -4.83 117.12 129.06 1gn6 n MET 161 Ca 0.21 -2.74 -0.37 0.00 -1.81 0.00 0.00 57.70 52.99 1gn6 n MET 161 Cb 0.47 -1.80 -0.03 0.00 -0.71 0.00 0.00 33.22 31.14 1gn6 n MET 161 CO 0.00 0.00 0.00 -1.58 1.51 0.00 0.00 175.97 175.90 1gn6 s TRP 162 N -2.40 3.21 0.30 2.03 0.52 -1.19 -4.38 118.94 117.03 1gn6 s TRP 162 Ca 0.41 1.62 0.05 0.00 0.02 0.00 0.00 56.10 58.20 1gn6 s TRP 162 Cb 0.31 -3.19 0.76 0.00 -1.15 0.00 0.00 33.47 30.20 1gn6 s TRP 162 CO 0.12 -0.80 1.70 0.93 0.02 0.00 0.00 176.95 178.92 1gn6 h GLU 163 N 2.52 0.40 0.00 4.98 5.08 -1.93 0.58 114.58 126.22 1gn6 h GLU 163 Ca -0.48 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 57.85 1gn6 h GLU 163 Cb 1.22 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 30.38 1gn6 h GLU 163 CO 0.62 0.27 0.09 1.12 -1.00 0.00 0.00 179.01 180.11 1gn6 h HIS 164 N 0.42 0.00 0.00 4.33 2.07 -1.98 0.20 115.15 120.19 1gn6 h HIS 164 Ca 0.58 0.00 -0.05 0.00 -2.85 0.00 0.00 60.37 58.04 1gn6 h HIS 164 Cb 1.10 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 31.08 1gn6 h HIS 164 CO -0.12 0.00 -0.26 0.00 -3.07 0.00 0.00 177.93 174.48 1gn6 h ALA 165 N 1.79 0.93 0.00 6.11 0.00 -1.20 -3.40 119.26 123.50 1gn6 h ALA 165 Ca 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.67 1gn6 h ALA 165 Cb 0.18 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.93 1gn6 h ALA 165 CO 0.00 0.33 0.00 1.97 0.00 0.00 0.00 179.25 181.55 1gn6 n PHE 166 N -3.30 0.00 -0.26 0.00 1.16 -0.67 -4.97 117.46 109.41 1gn6 n PHE 166 Ca 0.01 0.00 0.03 0.00 -1.87 0.00 0.00 57.45 55.62 1gn6 n PHE 166 Cb 0.52 0.00 0.11 0.00 -1.61 0.00 0.00 39.48 38.49 1gn6 n PHE 166 CO 0.00 0.00 0.00 -0.92 -1.87 0.00 0.00 176.76 173.97 1gn6 h TYR 167 N 0.00 -0.34 -0.67 2.97 3.20 -0.85 0.15 116.97 121.43 1gn6 h TYR 167 Ca 0.00 0.07 0.01 0.00 3.14 0.00 0.00 58.73 61.95 1gn6 h TYR 167 Cb 0.00 0.27 -0.03 0.00 1.54 0.00 0.00 36.73 38.50 1gn6 h TYR 167 CO 0.00 -0.32 0.45 -0.07 -1.64 0.00 0.00 178.16 176.58 1gn6 h LEU 168 N 0.02 0.76 0.00 2.82 3.38 -1.88 0.60 115.31 121.00 1gn6 h LEU 168 Ca 0.38 -0.02 -0.20 0.00 0.09 0.00 0.00 57.88 58.13 1gn6 h LEU 168 Cb 0.60 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 41.13 1gn6 h LEU 168 CO -0.77 0.54 -1.19 1.67 0.09 0.00 0.00 178.44 178.79 1gn6 n GLN 169 N -4.44 0.55 0.00 1.13 7.27 -0.83 -4.56 117.38 116.50 1gn6 n GLN 169 Ca 0.07 0.56 0.11 0.00 0.07 0.00 0.00 57.00 57.81 1gn6 n GLN 169 Cb 0.06 -1.73 0.02 0.00 2.41 0.00 0.00 30.24 31.00 1gn6 n GLN 169 CO 0.00 0.00 0.00 0.66 0.07 0.00 0.00 177.06 177.79 1gn6 n TYR 170 N -4.46 0.00 -1.12 3.69 4.01 0.46 -5.05 117.16 114.70 1gn6 n TYR 170 Ca -0.29 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.45 1gn6 n TYR 170 Cb 0.62 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.65 1gn6 n TYR 170 CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 1gn6 n LYS 171 N 0.33 0.00 0.00 -0.72 4.01 0.20 -1.53 118.16 120.46 1gn6 n LYS 171 Ca 0.10 0.00 0.13 0.00 -0.51 0.00 0.00 58.31 58.03 1gn6 n LYS 171 Cb 0.50 0.00 0.61 0.00 -0.51 0.00 0.00 35.03 35.63 1gn6 n LYS 171 CO 0.00 0.00 0.00 0.27 -1.11 0.00 0.00 177.40 176.56 1gn6 n ASN 172 N 2.83 0.00 -4.14 4.39 6.94 -1.26 -4.44 115.26 119.59 1gn6 n ASN 172 Ca 0.00 0.31 -0.41 0.00 -0.02 0.00 0.00 54.58 54.46 1gn6 n ASN 172 Cb 0.00 -0.43 -0.01 0.00 -2.36 0.00 0.00 39.78 36.98 1gn6 n ASN 172 CO 0.00 0.00 0.00 0.52 -1.03 0.00 0.00 177.26 176.75 1gn6 n VAL 173 N -1.43 3.34 0.24 3.53 0.31 -0.58 -4.74 118.33 119.00 1gn6 n VAL 173 Ca 0.08 -3.21 0.07 0.00 -0.01 0.00 0.00 64.34 61.28 1gn6 n VAL 173 Cb 0.28 -2.44 0.58 0.00 -0.91 0.00 0.00 33.84 31.35 1gn6 n VAL 173 CO 0.00 0.00 0.00 0.07 -1.32 0.00 0.00 176.83 175.58 1gn6 h LYS 174 N 7.16 0.00 -0.31 5.55 2.10 -1.83 -2.83 116.57 126.41 1gn6 h LYS 174 Ca 0.47 0.00 -0.07 0.00 -2.00 0.00 0.00 60.65 59.05 1gn6 h LYS 174 Cb 0.76 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 32.08 1gn6 h LYS 174 CO 1.66 0.14 -0.11 -0.39 -2.00 0.00 0.00 179.45 178.75 1gn6 h VAL 175 N 0.00 1.23 -0.53 0.07 -1.51 -1.96 -0.35 116.25 113.20 1gn6 h VAL 175 Ca -0.00 -1.02 -0.10 0.00 -1.23 0.00 0.00 66.70 64.35 1gn6 h VAL 175 Cb 0.26 1.12 -0.02 0.00 -2.13 0.00 0.00 31.29 30.52 1gn6 h VAL 175 CO 0.02 0.34 -0.05 0.44 -1.23 0.00 0.00 177.57 177.08 1gn6 h ASP 176 N 0.49 0.93 -0.40 4.19 3.32 -1.91 0.13 116.42 123.18 1gn6 h ASP 176 Ca 0.09 -0.27 -0.05 0.00 0.02 0.00 0.00 57.03 56.82 1gn6 h ASP 176 Cb 0.49 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.78 1gn6 h ASP 176 CO 0.03 1.02 0.06 0.15 -1.72 0.00 0.00 179.24 178.77 1gn6 h PHE 177 N 0.86 0.71 0.00 4.55 3.57 -1.48 -0.24 116.94 124.91 1gn6 h PHE 177 Ca 0.15 -0.10 -0.04 0.00 3.53 0.00 0.00 57.97 61.50 1gn6 h PHE 177 Cb 0.58 -0.19 -0.01 0.00 2.79 0.00 0.00 35.95 39.12 1gn6 h PHE 177 CO 0.04 0.70 -0.21 0.00 -2.23 0.00 0.00 178.31 176.61 1gn6 h ALA 178 N 0.92 1.53 0.14 2.41 0.00 -0.79 -2.30 119.26 121.18 1gn6 h ALA 178 Ca 0.12 -0.19 -0.30 0.00 0.00 0.00 0.00 54.91 54.54 1gn6 h ALA 178 Cb 0.38 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.14 1gn6 h ALA 178 CO 0.01 0.26 -1.40 0.87 0.00 0.00 0.00 179.25 178.99 1gn6 h LYS 179 N 0.00 0.30 -0.06 0.00 1.57 -0.05 -3.31 116.57 115.02 1gn6 h LYS 179 Ca -0.00 -0.51 -0.04 0.00 -1.87 0.00 0.00 60.65 58.22 1gn6 h LYS 179 Cb 0.40 0.19 -0.01 0.00 0.08 0.00 0.00 32.23 32.89 1gn6 h LYS 179 CO 0.03 1.21 -0.16 0.00 -0.57 0.00 0.00 179.45 179.96 1gn6 h ALA 180 N 0.48 1.62 -0.95 3.86 0.00 -0.72 -2.95 119.26 120.60 1gn6 h ALA 180 Ca -0.20 -0.18 0.21 0.00 0.00 0.00 0.00 54.91 54.73 1gn6 h ALA 180 Cb 2.02 -0.05 -0.08 0.00 0.00 0.00 0.00 17.79 19.67 1gn6 h ALA 180 CO 0.20 0.28 0.61 0.35 0.00 0.00 0.00 179.25 180.69 1gn6 h PHE 181 N 0.09 0.73 -0.22 0.00 3.57 -1.51 -1.01 116.94 118.59 1gn6 h PHE 181 Ca 0.02 0.02 0.06 0.00 3.53 0.00 0.00 57.97 61.60 1gn6 h PHE 181 Cb 0.35 -0.22 -0.01 0.00 2.79 0.00 0.00 35.95 38.86 1gn6 h PHE 181 CO 0.00 0.17 0.21 -1.49 -2.23 0.00 0.00 178.31 174.97 1gn6 h TRP 182 N 0.53 0.00 0.00 0.41 4.06 -1.71 -1.34 115.95 117.90 1gn6 h TRP 182 Ca 0.52 0.00 -0.03 0.00 2.06 0.00 0.00 58.89 61.44 1gn6 h TRP 182 Cb 1.12 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 29.27 1gn6 h TRP 182 CO -0.00 0.00 -0.15 -0.91 -3.56 0.00 0.00 178.44 173.82 1gn6 h ASN 183 N 0.00 0.00 -0.12 -3.49 2.35 -1.39 -3.28 115.58 109.65 1gn6 h ASN 183 Ca 0.10 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.85 1gn6 h ASN 183 Cb 0.51 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.88 1gn6 h ASN 183 CO -0.00 0.15 0.00 1.33 -1.65 0.00 0.00 177.43 177.26 1gn6 n VAL 184 N -3.27 1.48 -2.38 2.81 0.24 -0.51 -3.00 118.33 113.70 1gn6 n VAL 184 Ca 0.01 -1.51 -0.41 0.00 -2.04 0.00 0.00 64.34 60.39 1gn6 n VAL 184 Cb 0.41 0.16 -0.03 0.00 -1.47 0.00 0.00 33.84 32.91 1gn6 n VAL 184 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 1gn6 s VAL 185 N -1.85 3.51 -1.16 3.34 1.01 -1.15 -0.24 120.40 123.86 1gn6 s VAL 185 Ca 0.21 1.32 -0.10 0.00 0.00 0.00 0.00 61.98 63.41 1gn6 s VAL 185 Cb 0.17 -3.84 0.24 0.00 0.00 0.00 0.00 36.38 32.94 1gn6 s VAL 185 CO 0.06 0.23 1.28 -3.20 0.00 0.00 0.00 175.10 173.47 1gn6 n ASN 186 N 2.22 5.45 0.11 3.32 5.15 0.17 -1.09 115.26 130.59 1gn6 n ASN 186 Ca 0.03 -3.04 0.20 0.00 -0.60 0.00 0.00 54.58 51.17 1gn6 n ASN 186 Cb 0.45 -1.45 0.76 0.00 -0.53 0.00 0.00 39.78 39.00 1gn6 n ASN 186 CO 0.00 0.00 0.00 -0.50 1.40 0.00 0.00 177.26 178.16 1gn6 h TRP 187 N 6.72 0.00 -0.35 1.20 4.06 -1.89 -0.15 115.95 125.54 1gn6 h TRP 187 Ca 0.24 0.00 -0.01 0.00 2.06 0.00 0.00 58.89 61.18 1gn6 h TRP 187 Cb 0.85 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 28.99 1gn6 h TRP 187 CO 0.91 0.00 0.19 0.00 -3.56 0.00 0.00 178.44 175.98 1gn6 h ALA 188 N 1.53 0.45 -0.11 1.49 0.00 -1.96 0.24 119.26 120.89 1gn6 h ALA 188 Ca 0.18 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 1gn6 h ALA 188 Cb 0.99 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.63 1gn6 h ALA 188 CO -0.00 -0.03 0.05 0.22 0.00 0.00 0.00 179.25 179.50 1gn6 h ASP 189 N 0.44 0.14 -0.83 0.00 1.82 -1.32 -2.04 116.42 114.62 1gn6 h ASP 189 Ca 0.12 -0.11 0.00 0.00 -0.39 0.00 0.00 57.03 56.66 1gn6 h ASP 189 Cb 0.06 -0.04 -0.04 0.00 0.68 0.00 0.00 39.33 39.99 1gn6 h ASP 189 CO -0.02 0.21 0.53 0.58 -1.61 0.00 0.00 179.24 178.92 1gn6 h VAL 190 N 0.06 1.22 -0.63 2.25 2.07 -1.32 -0.89 116.25 119.01 1gn6 h VAL 190 Ca 0.04 -0.45 0.03 0.00 0.82 0.00 0.00 66.70 67.13 1gn6 h VAL 190 Cb 0.10 0.03 -0.04 0.00 -1.52 0.00 0.00 31.29 29.86 1gn6 h VAL 190 CO -0.01 0.22 0.39 1.56 0.02 0.00 0.00 177.57 179.76 1gn6 h GLN 191 N 1.14 0.75 -0.01 1.57 4.20 -0.79 -1.40 115.11 120.55 1gn6 h GLN 191 Ca 0.30 -0.04 -0.00 0.00 0.06 0.00 0.00 58.65 58.97 1gn6 h GLN 191 Cb -0.09 -0.17 -0.00 0.00 0.30 0.00 0.00 27.48 27.52 1gn6 h GLN 191 CO -0.06 0.49 0.01 1.03 -0.67 0.00 0.00 178.83 179.63 1gn6 h SER 192 N 0.77 0.02 -0.96 1.46 0.87 -0.98 -0.93 113.55 113.80 1gn6 h SER 192 Ca 0.25 -0.14 0.02 0.00 -1.23 0.00 0.00 61.79 60.69 1gn6 h SER 192 Cb 0.01 -0.00 -0.05 0.00 -0.44 0.00 0.00 62.40 61.92 1gn6 h SER 192 CO -0.10 0.15 0.63 0.03 -0.53 0.00 0.00 176.83 177.02 1gn6 h ARG 193 N -0.11 1.24 -0.67 2.24 3.08 -0.92 -2.17 114.38 117.07 1gn6 h ARG 193 Ca 0.00 -0.07 -0.05 0.00 0.07 0.00 0.00 59.98 59.93 1gn6 h ARG 193 Cb 0.14 -0.28 -0.03 0.00 0.08 0.00 0.00 29.97 29.88 1gn6 h ARG 193 CO -0.00 0.82 0.22 -0.92 -1.07 0.00 0.00 179.97 179.01 1gn6 h TYR 194 N 1.27 1.07 -0.47 3.04 3.20 -0.94 -0.59 116.97 123.55 1gn6 h TYR 194 Ca 0.36 -0.11 -0.01 0.00 3.14 0.00 0.00 58.73 62.11 1gn6 h TYR 194 Cb -0.10 -0.31 -0.02 0.00 1.54 0.00 0.00 36.73 37.83 1gn6 h TYR 194 CO -0.00 0.86 0.25 0.00 -1.64 0.00 0.00 178.16 177.64 1gn6 h ALA 195 N 1.09 0.61 -0.24 1.82 0.00 -0.66 -1.50 119.26 120.38 1gn6 h ALA 195 Ca 0.22 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 1gn6 h ALA 195 Cb 0.29 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 1gn6 h ALA 195 CO -0.01 0.14 0.14 0.00 0.00 0.00 0.00 179.25 179.51 1gn6 h ALA 196 N 1.10 0.31 -0.41 0.00 0.00 -1.18 -1.96 119.26 117.11 1gn6 h ALA 196 Ca 0.17 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 55.00 1gn6 h ALA 196 Cb 0.06 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 1gn6 h ALA 196 CO -0.03 -0.17 0.19 0.00 0.00 0.00 0.00 179.25 179.25 1gn6 h ALA 197 N 1.03 1.56 -0.03 0.00 0.00 -0.89 -2.26 119.26 118.66 1gn6 h ALA 197 Ca 0.09 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1gn6 h ALA 197 Cb 0.05 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.67 1gn6 h ALA 197 CO -0.01 0.35 0.00 0.25 0.00 0.00 0.00 179.25 179.84 1gn6 n THR 198 N -4.40 0.02 1.61 0.00 -2.24 -0.58 -5.01 114.28 103.68 1gn6 n THR 198 Ca 0.03 -0.32 0.14 0.00 -2.27 0.00 0.00 64.05 61.64 1gn6 n THR 198 Cb 0.12 0.72 0.62 0.00 -2.10 0.00 0.00 70.33 69.70 1gn6 n THR 198 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30