#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1i7h s LYS 3 N 0.00 4.48 -0.18 -0.52 1.02 -1.26 -0.21 119.74 123.08 1i7h s LYS 3 Ca 0.00 1.04 0.01 0.00 0.02 0.00 0.00 55.97 57.04 1i7h s LYS 3 Cb 0.00 -3.28 0.02 0.00 -0.52 0.00 0.00 37.83 34.05 1i7h s LYS 3 CO 0.00 0.52 -0.18 0.42 -0.92 0.00 0.00 175.35 175.18 1i7h s ILE 4 N -0.87 1.95 -0.21 2.17 1.01 0.60 -1.09 121.20 124.75 1i7h s ILE 4 Ca 0.35 -0.89 -0.13 0.00 0.00 0.00 0.00 60.65 59.98 1i7h s ILE 4 Cb -0.22 -1.78 -0.04 0.00 0.01 0.00 0.00 42.46 40.42 1i7h s ILE 4 CO 0.24 0.50 0.28 -0.69 0.00 0.00 0.00 174.94 175.26 1i7h s VAL 5 N 1.33 5.29 -0.31 2.92 1.01 -0.23 -0.13 120.40 130.28 1i7h s VAL 5 Ca 0.05 0.45 -0.12 0.00 0.00 0.00 0.00 61.98 62.35 1i7h s VAL 5 Cb -0.13 -3.61 -0.03 0.00 0.00 0.00 0.00 36.38 32.60 1i7h s VAL 5 CO -0.12 0.32 0.23 -0.63 0.00 0.00 0.00 175.10 174.89 1i7h s ILE 6 N 1.06 5.29 0.70 2.22 -1.09 0.43 0.21 121.20 130.01 1i7h s ILE 6 Ca 0.13 0.02 -0.15 0.00 -2.23 0.00 0.00 60.65 58.42 1i7h s ILE 6 Cb -0.14 -3.63 0.02 0.00 -1.58 0.00 0.00 42.46 37.14 1i7h s ILE 6 CO 0.05 0.12 1.19 -0.76 -1.23 0.00 0.00 174.94 174.31 1i7h s LEU 7 N 1.77 3.36 0.08 2.97 1.43 -0.26 -1.34 118.68 126.70 1i7h s LEU 7 Ca 0.07 2.28 -0.35 0.00 -1.03 0.00 0.00 54.13 55.10 1i7h s LEU 7 Cb -0.17 -4.58 -0.15 0.00 0.03 0.00 0.00 46.19 41.32 1i7h s LEU 7 CO 0.11 -2.07 1.52 -2.65 0.23 0.00 0.00 176.35 173.50 1i7h n PRO 8 N -2.55 1.70 -3.84 1.29 -0.02 -1.26 -4.55 135.00 125.76 1i7h n PRO 8 Ca 0.13 0.61 -0.28 0.00 -2.02 0.00 0.00 63.50 61.94 1i7h n PRO 8 Cb 0.51 -2.33 -0.16 0.00 -0.02 0.00 0.00 33.50 31.49 1i7h n PRO 8 CO 0.00 0.00 0.00 -1.58 1.98 0.00 0.00 175.50 175.90 1i7h s HIS 9 N 1.21 1.48 0.32 6.00 2.46 0.86 -4.89 115.29 122.71 1i7h s HIS 9 Ca 0.84 -1.00 0.06 0.00 0.47 0.00 0.00 55.06 55.43 1i7h s HIS 9 Cb -0.81 -1.21 0.88 0.00 -0.13 0.00 0.00 32.58 31.30 1i7h s HIS 9 CO 0.44 -0.60 1.59 1.96 -2.47 0.00 0.00 174.74 175.66 1i7h h GLN 10 N 8.16 0.05 0.04 2.88 4.20 -1.84 0.87 115.11 129.46 1i7h h GLN 10 Ca -0.21 -0.00 -0.34 0.00 0.06 0.00 0.00 58.65 58.16 1i7h h GLN 10 Cb 1.11 -0.01 -0.04 0.00 0.30 0.00 0.00 27.48 28.84 1i7h h GLN 10 CO 0.37 0.03 -1.99 -3.47 -0.67 0.00 0.00 178.83 173.10 1i7h n ASP 11 N -5.39 1.26 -0.00 1.46 2.03 -1.26 -4.40 116.55 110.26 1i7h n ASP 11 Ca 0.26 0.23 0.05 0.00 0.52 0.00 0.00 54.79 55.84 1i7h n ASP 11 Cb 0.86 -0.20 -0.06 0.00 -0.72 0.00 0.00 41.12 41.01 1i7h n ASP 11 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 1i7h n LEU 12 N -3.16 0.45 -2.70 -2.67 4.77 -1.11 -4.85 117.00 107.72 1i7h n LEU 12 Ca -0.27 -0.49 -0.06 0.00 -0.03 0.00 0.00 56.01 55.16 1i7h n LEU 12 Cb 1.06 0.00 0.07 0.00 -2.33 0.00 0.00 43.42 42.22 1i7h n LEU 12 CO 0.42 0.11 0.42 0.00 -1.33 0.00 0.00 177.39 177.02 1i7h n PRO 14 N 1.43 -0.08 -0.21 0.00 -0.02 -0.40 -0.10 135.00 135.63 1i7h n PRO 14 Ca 0.04 1.44 0.10 0.00 -2.02 0.00 0.00 63.50 63.07 1i7h n PRO 14 Cb 0.68 -2.16 0.21 0.00 -0.02 0.00 0.00 33.50 32.21 1i7h n PRO 14 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1i7h n ASP 15 N -5.51 3.33 0.00 2.55 8.00 -1.26 -4.28 116.55 119.38 1i7h n ASP 15 Ca 0.15 -1.94 0.00 0.00 0.71 0.00 0.00 54.79 53.71 1i7h n ASP 15 Cb 0.47 -0.27 0.00 0.00 -0.02 0.00 0.00 41.12 41.30 1i7h n ASP 15 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1i7h n GLY 16 N 1.27 -2.56 3.48 0.44 0.00 -0.20 -4.67 105.19 102.95 1i7h n GLY 16 Ca 0.18 -1.62 -0.11 0.00 0.00 0.00 0.00 46.02 44.47 1i7h n GLY 16 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i7h s ALA 17 N -1.01 -1.76 -0.22 4.61 0.00 -0.45 -4.93 121.76 118.01 1i7h s ALA 17 Ca 0.00 0.93 0.00 0.00 0.00 0.00 0.00 51.96 52.89 1i7h s ALA 17 Cb 0.00 0.42 0.03 0.00 0.00 0.00 0.00 23.12 23.57 1i7h s ALA 17 CO 0.00 -0.65 -0.12 0.08 0.00 0.00 0.00 175.76 175.07 1i7h s VAL 18 N -2.95 2.44 -0.12 0.00 1.01 -1.26 -0.43 120.40 119.09 1i7h s VAL 18 Ca 0.02 -1.08 -0.03 0.00 0.00 0.00 0.00 61.98 60.88 1i7h s VAL 18 Cb -0.01 -2.19 -0.03 0.00 0.00 0.00 0.00 36.38 34.15 1i7h s VAL 18 CO -0.07 0.30 0.01 -0.76 0.00 0.00 0.00 175.10 174.58 1i7h s LEU 19 N 1.28 3.60 -0.67 3.92 1.43 0.81 -4.94 118.68 124.11 1i7h s LEU 19 Ca 0.01 0.10 -0.17 0.00 -1.03 0.00 0.00 54.13 53.03 1i7h s LEU 19 Cb -0.16 -1.85 0.14 0.00 0.03 0.00 0.00 46.19 44.35 1i7h s LEU 19 CO -0.08 0.31 0.72 -1.61 0.23 0.00 0.00 176.35 175.92 1i7h s GLU 20 N -0.46 3.21 0.31 1.70 0.41 -1.26 -0.29 118.70 122.31 1i7h s GLU 20 Ca 0.08 -1.68 -0.04 0.00 -0.41 0.00 0.00 54.97 52.92 1i7h s GLU 20 Cb -0.12 -4.38 -0.05 0.00 -1.78 0.00 0.00 34.13 27.80 1i7h s GLU 20 CO 0.02 -1.47 0.57 0.00 -0.49 0.00 0.00 175.26 173.89 1i7h s ALA 21 N 1.95 3.61 0.20 5.21 0.00 0.71 -4.93 121.76 128.51 1i7h s ALA 21 Ca 0.13 -0.58 -0.08 0.00 0.00 0.00 0.00 51.96 51.43 1i7h s ALA 21 Cb -0.20 -2.31 -0.07 0.00 0.00 0.00 0.00 23.12 20.54 1i7h s ALA 21 CO 0.01 0.17 0.49 -0.80 0.00 0.00 0.00 175.76 175.63 1i7h s ASN 22 N -3.32 6.57 0.29 0.00 0.01 -1.26 -0.23 114.94 117.01 1i7h s ASN 22 Ca 0.44 0.80 -0.29 0.00 -0.71 0.00 0.00 52.86 53.09 1i7h s ASN 22 Cb -0.11 -2.18 -0.10 0.00 0.41 0.00 0.00 41.25 39.28 1i7h s ASN 22 CO 0.32 -0.04 1.33 -0.44 -1.51 0.00 0.00 177.10 176.76 1i7h s SER 23 N -2.42 6.79 0.00 -1.22 0.01 -1.26 -1.84 113.70 113.75 1i7h s SER 23 Ca 0.45 2.63 0.00 0.00 1.31 0.00 0.00 55.95 60.34 1i7h s SER 23 Cb -0.11 -2.64 0.00 0.00 0.21 0.00 0.00 66.02 63.48 1i7h s SER 23 CO 0.23 -0.55 0.00 0.61 0.41 0.00 0.00 173.24 173.93 1i7h n GLY 24 N 1.33 1.89 3.80 3.44 0.00 0.13 -4.99 105.19 110.79 1i7h n GLY 24 Ca 0.02 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.68 1i7h n GLY 24 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1i7h s GLU 25 N -0.53 4.37 0.53 1.61 2.12 -0.77 -4.71 118.70 121.32 1i7h s GLU 25 Ca 0.00 1.01 -0.18 0.00 0.36 0.00 0.00 54.97 56.16 1i7h s GLU 25 Cb 0.00 -2.89 -0.07 0.00 0.26 0.00 0.00 34.13 31.43 1i7h s GLU 25 CO 0.00 0.38 1.04 0.95 -0.54 0.00 0.00 175.26 177.09 1i7h s THR 26 N -1.51 3.89 0.27 -1.70 -4.23 -1.26 -0.62 115.64 110.47 1i7h s THR 26 Ca 0.44 1.04 -0.03 0.00 -1.18 0.00 0.00 61.69 61.96 1i7h s THR 26 Cb -0.18 -3.45 0.27 0.00 1.34 0.00 0.00 72.50 70.48 1i7h s THR 26 CO 0.22 -0.39 1.89 0.40 -0.54 0.00 0.00 174.62 176.20 1i7h h ILE 27 N 1.07 1.11 -0.09 2.99 2.04 -0.99 -2.32 117.51 121.31 1i7h h ILE 27 Ca -0.48 -0.41 -0.01 0.00 1.00 0.00 0.00 64.86 64.95 1i7h h ILE 27 Cb 1.22 -0.20 -0.00 0.00 -0.74 0.00 0.00 36.82 37.09 1i7h h ILE 27 CO 0.59 0.22 0.01 0.25 0.00 0.00 0.00 178.15 179.21 1i7h h LEU 28 N 1.20 0.15 -1.22 1.44 5.85 -1.54 -1.88 115.31 119.32 1i7h h LEU 28 Ca 0.43 -0.28 -0.01 0.00 0.84 0.00 0.00 57.88 58.86 1i7h h LEU 28 Cb 0.13 -0.04 -0.03 0.00 0.37 0.00 0.00 40.66 41.09 1i7h h LEU 28 CO -0.16 0.40 0.41 0.44 -0.34 0.00 0.00 178.44 179.18 1i7h h ASP 29 N -0.09 0.83 -0.70 1.25 3.32 -1.77 0.17 116.42 119.44 1i7h h ASP 29 Ca 0.03 -0.05 -0.07 0.00 0.02 0.00 0.00 57.03 56.95 1i7h h ASP 29 Cb 0.31 -0.21 -0.03 0.00 0.22 0.00 0.00 39.33 39.62 1i7h h ASP 29 CO 0.00 0.65 0.15 0.00 -1.72 0.00 0.00 179.24 178.32 1i7h h ALA 30 N 1.49 0.94 -0.21 3.45 0.00 -1.34 -1.72 119.26 121.88 1i7h h ALA 30 Ca 0.25 -0.26 -0.05 0.00 0.00 0.00 0.00 54.91 54.85 1i7h h ALA 30 Cb -0.02 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.50 1i7h h ALA 30 CO -0.05 0.67 -0.06 0.00 0.00 0.00 0.00 179.25 179.82 1i7h h ALA 31 N 1.08 0.29 -0.47 0.00 0.00 -0.45 -3.15 119.26 116.56 1i7h h ALA 31 Ca 0.22 -0.26 -0.05 0.00 0.00 0.00 0.00 54.91 54.81 1i7h h ALA 31 Cb 0.40 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 1i7h h ALA 31 CO 0.01 0.08 0.07 -0.07 0.00 0.00 0.00 179.25 179.33 1i7h h LEU 32 N 0.12 0.69 -1.76 0.00 3.38 -0.53 -1.06 115.31 116.16 1i7h h LEU 32 Ca 0.05 -0.13 -0.02 0.00 0.09 0.00 0.00 57.88 57.87 1i7h h LEU 32 Cb 0.52 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.08 1i7h h LEU 32 CO 0.02 0.72 -0.04 0.03 0.09 0.00 0.00 178.44 179.26 1i7h h ARG 33 N 0.71 0.10 -0.62 1.13 3.08 -1.31 -1.24 114.38 116.22 1i7h h ARG 33 Ca 0.15 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.19 1i7h h ARG 33 Cb 0.34 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.37 1i7h h ARG 33 CO 0.01 0.15 0.00 0.09 -1.07 0.00 0.00 179.97 179.15 1i7h n ASN 34 N -4.43 3.52 -0.35 7.04 3.02 -0.74 -4.92 115.26 118.40 1i7h n ASN 34 Ca -0.02 -2.35 -0.05 0.00 -0.03 0.00 0.00 54.58 52.14 1i7h n ASN 34 Cb 0.16 -0.50 -0.02 0.00 -0.61 0.00 0.00 39.78 38.81 1i7h n ASN 34 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1i7h n GLY 35 N 0.81 0.72 3.42 7.41 0.00 -0.47 -4.98 105.19 112.11 1i7h n GLY 35 Ca 0.18 -0.49 -0.44 0.00 0.00 0.00 0.00 46.02 45.27 1i7h n GLY 35 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1i7h s ILE 36 N -2.06 4.74 -1.08 -0.61 1.01 -0.48 -4.97 121.20 117.75 1i7h s ILE 36 Ca 0.00 -0.62 -0.20 0.00 0.00 0.00 0.00 60.65 59.84 1i7h s ILE 36 Cb 0.00 -4.45 -0.07 0.00 0.01 0.00 0.00 42.46 37.96 1i7h s ILE 36 CO 0.00 -1.04 1.98 -0.62 0.00 0.00 0.00 174.94 175.26 1i7h n GLU 37 N 6.54 2.06 -2.55 2.79 -0.58 -1.26 -3.80 120.64 123.84 1i7h n GLU 37 Ca -0.07 -2.32 -0.43 0.00 -0.42 0.00 0.00 57.16 53.93 1i7h n GLU 37 Cb 0.44 -3.23 -0.02 0.00 -0.57 0.00 0.00 31.44 28.06 1i7h n GLU 37 CO 0.00 0.00 0.00 0.42 -0.48 0.00 0.00 177.13 177.07 1i7h s ILE 38 N 5.57 4.48 0.39 -3.67 1.01 -1.26 -4.97 121.20 122.74 1i7h s ILE 38 Ca 0.56 1.78 -0.26 0.00 0.00 0.00 0.00 60.65 62.73 1i7h s ILE 38 Cb 0.10 -4.15 -0.11 0.00 0.01 0.00 0.00 42.46 38.32 1i7h s ILE 38 CO 0.07 -0.04 1.26 1.21 0.00 0.00 0.00 174.94 177.43 1i7h n GLU 39 N 5.49 1.97 -3.03 2.79 2.13 -1.26 -4.94 120.64 123.79 1i7h n GLU 39 Ca 0.11 0.70 -0.18 0.00 0.66 0.00 0.00 57.16 58.44 1i7h n GLU 39 Cb 0.47 -2.33 -0.02 0.00 0.27 0.00 0.00 31.44 29.82 1i7h n GLU 39 CO 0.00 0.00 0.00 -2.39 -0.41 0.00 0.00 177.13 174.33 1i7h n HIS 40 N -0.00 -1.35 -0.21 4.31 1.44 -1.26 -2.53 115.22 115.61 1i7h n HIS 40 Ca 0.06 -2.96 0.02 0.00 -2.01 0.00 0.00 57.72 52.83 1i7h n HIS 40 Cb 0.38 0.32 0.12 0.00 0.12 0.00 0.00 29.99 30.94 1i7h n HIS 40 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1i7h h ALA 41 N 3.87 0.72 -0.27 1.59 0.00 -1.92 -1.82 119.26 121.43 1i7h h ALA 41 Ca -0.00 0.17 0.00 0.00 0.00 0.00 0.00 54.91 55.07 1i7h h ALA 41 Cb 0.94 0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.99 1i7h h ALA 41 CO 0.41 -0.35 0.00 0.00 0.00 0.00 0.00 179.25 179.30 1i7h n GLU 43 N 0.33 -6.15 -3.28 0.00 1.02 -0.69 -3.13 120.64 108.75 1i7h n GLU 43 Ca 0.11 0.76 -0.22 0.00 -0.02 0.00 0.00 57.16 57.79 1i7h n GLU 43 Cb 0.49 -5.62 0.06 0.00 -0.02 0.00 0.00 31.44 26.34 1i7h n GLU 43 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1i7h n LYS 44 N -4.30 -6.25 -0.12 3.49 5.02 -1.26 -4.91 118.16 109.83 1i7h n LYS 44 Ca -0.25 0.83 0.11 0.00 -2.02 0.00 0.00 58.31 56.98 1i7h n LYS 44 Cb 0.65 -5.68 0.17 0.00 -0.02 0.00 0.00 35.03 30.15 1i7h n LYS 44 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 1i7h n SER 45 N -2.56 3.16 -3.30 4.39 7.64 -1.18 -4.96 113.62 116.81 1i7h n SER 45 Ca -0.05 -1.94 -0.21 0.00 1.01 0.00 0.00 58.87 57.69 1i7h n SER 45 Cb 0.58 -0.16 0.07 0.00 -1.01 0.00 0.00 64.21 63.69 1i7h n SER 45 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1i7h n ALA 47 N -4.68 1.86 -3.00 0.00 0.00 -1.26 -4.80 120.51 108.63 1i7h n ALA 47 Ca -0.02 -1.33 0.00 0.00 0.00 0.00 0.00 53.44 52.09 1i7h n ALA 47 Cb 0.56 -0.17 0.00 0.00 0.00 0.00 0.00 19.45 19.84 1i7h n ALA 47 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1i7h n THR 49 N 0.00 0.29 0.30 0.00 -2.24 -1.26 -4.84 114.28 106.53 1i7h n THR 49 Ca 0.00 -0.31 0.18 0.00 -2.27 0.00 0.00 64.05 61.65 1i7h n THR 49 Cb 0.00 0.74 0.76 0.00 -2.10 0.00 0.00 70.33 69.74 1i7h n THR 49 CO 0.00 0.00 0.00 0.71 -0.57 0.00 0.00 175.07 175.21 1i7h h THR 50 N 3.04 0.00 -0.58 4.28 1.35 -1.84 -1.87 112.91 117.28 1i7h h THR 50 Ca 0.00 -0.39 0.00 0.00 -0.55 0.00 0.00 66.41 65.47 1i7h h THR 50 Cb 0.99 1.36 0.00 0.00 -1.73 0.00 0.00 68.15 68.77 1i7h h THR 50 CO 0.00 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 175.27 1i7h n HIS 52 N 1.13 2.02 -3.88 0.00 -0.00 -0.71 -1.54 115.22 112.25 1i7h n HIS 52 Ca 0.21 0.52 -0.09 0.00 0.46 0.00 0.00 57.72 58.82 1i7h n HIS 52 Cb 0.62 -2.41 -0.07 0.00 -0.12 0.00 0.00 29.99 28.01 1i7h n HIS 52 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 1i7h s ILE 54 N -3.88 2.56 -0.81 0.00 1.01 0.11 -1.08 121.20 119.12 1i7h s ILE 54 Ca 0.07 -0.78 -0.19 0.00 0.00 0.00 0.00 60.65 59.74 1i7h s ILE 54 Cb 0.05 -2.10 0.12 0.00 0.01 0.00 0.00 42.46 40.54 1i7h s ILE 54 CO -0.09 0.51 1.00 -0.69 0.00 0.00 0.00 174.94 175.66 1i7h s VAL 55 N 1.11 4.71 0.39 2.92 1.01 -0.31 -0.36 120.40 129.88 1i7h s VAL 55 Ca 0.00 -1.26 0.12 0.00 0.00 0.00 0.00 61.98 60.84 1i7h s VAL 55 Cb -0.14 -4.69 0.13 0.00 0.00 0.00 0.00 36.38 31.67 1i7h s VAL 55 CO -0.05 -1.40 1.88 0.03 0.00 0.00 0.00 175.10 175.56 1i7h h ARG 56 N 8.99 0.05 -3.61 2.72 2.47 -1.33 -3.38 114.38 120.27 1i7h h ARG 56 Ca -0.02 -0.01 -0.30 0.00 -1.26 0.00 0.00 59.98 58.39 1i7h h ARG 56 Cb 1.05 -0.00 -0.33 0.00 -1.65 0.00 0.00 29.97 29.03 1i7h h ARG 56 CO 1.10 0.33 -0.73 -1.21 0.56 0.00 0.00 179.97 180.01 1i7h s GLU 57 N -4.40 0.05 0.00 0.04 0.41 -1.06 -4.87 118.70 108.86 1i7h s GLU 57 Ca -0.04 0.13 0.00 0.00 -0.41 0.00 0.00 54.97 54.65 1i7h s GLU 57 Cb 0.15 -0.26 0.00 0.00 -1.78 0.00 0.00 34.13 32.24 1i7h s GLU 57 CO 0.72 -0.13 0.00 0.41 -0.49 0.00 0.00 175.26 175.77 1i7h n GLY 58 N 3.96 0.78 0.33 -1.39 0.00 -1.26 -1.81 105.19 105.80 1i7h n GLY 58 Ca -0.25 0.00 0.08 0.00 0.00 0.00 0.00 46.02 45.85 1i7h n GLY 58 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1i7h h PHE 59 N 0.00 0.95 0.00 1.61 3.57 -1.90 -1.35 116.94 119.82 1i7h h PHE 59 Ca 0.00 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.53 1i7h h PHE 59 Cb 0.00 -0.28 0.00 0.00 2.79 0.00 0.00 35.95 38.46 1i7h h PHE 59 CO 0.00 0.29 0.00 -0.44 -2.23 0.00 0.00 178.31 175.93 1i7h h ASP 60 N 0.78 0.00 1.33 0.41 3.32 -1.94 -2.79 116.42 117.53 1i7h h ASP 60 Ca 0.49 0.00 -0.13 0.00 0.02 0.00 0.00 57.03 57.41 1i7h h ASP 60 Cb 0.63 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.16 1i7h h ASP 60 CO -0.33 0.00 -0.64 0.77 -1.72 0.00 0.00 179.24 177.32 1i7h h SER 61 N 0.00 0.00 -4.01 6.45 4.64 -1.66 -3.46 113.55 115.51 1i7h h SER 61 Ca 0.00 0.00 -0.49 0.00 -0.47 0.00 0.00 61.79 60.83 1i7h h SER 61 Cb 0.30 0.00 0.03 0.00 -0.31 0.00 0.00 62.40 62.42 1i7h h SER 61 CO 0.00 0.64 0.42 -0.76 -0.87 0.00 0.00 176.83 176.26 1i7h s LEU 62 N -6.56 4.00 0.37 5.97 1.43 -1.05 -4.64 118.68 118.19 1i7h s LEU 62 Ca 0.03 2.08 -0.28 0.00 -1.03 0.00 0.00 54.13 54.93 1i7h s LEU 62 Cb 0.08 -4.33 -0.11 0.00 0.03 0.00 0.00 46.19 41.86 1i7h s LEU 62 CO 0.76 -0.73 1.44 -2.84 0.23 0.00 0.00 176.35 175.22 1i7h s PRO 63 N -2.81 4.14 0.40 1.29 0.02 -1.26 -4.90 135.00 131.89 1i7h s PRO 63 Ca 0.63 2.49 -0.24 0.00 0.02 0.00 0.00 61.00 63.90 1i7h s PRO 63 Cb -0.22 -2.97 -0.12 0.00 0.02 0.00 0.00 34.50 31.21 1i7h s PRO 63 CO 0.27 -0.47 0.82 -1.91 -0.33 0.00 0.00 177.00 175.38 1i7h n GLU 64 N 0.49 1.00 -2.25 5.54 2.13 -1.26 -4.88 120.64 121.41 1i7h n GLU 64 Ca 0.01 0.36 -0.39 0.00 0.66 0.00 0.00 57.16 57.79 1i7h n GLU 64 Cb 0.40 -1.79 -0.02 0.00 0.27 0.00 0.00 31.44 30.30 1i7h n GLU 64 CO 0.00 0.00 0.00 -1.54 -0.41 0.00 0.00 177.13 175.18 1i7h s SER 65 N -0.82 6.72 1.04 4.31 1.04 -1.26 -5.02 113.70 119.69 1i7h s SER 65 Ca 0.63 2.47 -0.15 0.00 0.48 0.00 0.00 55.95 59.38 1i7h s SER 65 Cb -0.60 -2.63 0.21 0.00 0.10 0.00 0.00 66.02 63.10 1i7h s SER 65 CO 0.57 -0.55 1.13 -0.94 0.98 0.00 0.00 173.24 174.44 1i7h s SER 66 N -0.84 2.38 0.16 7.02 1.04 -1.26 -4.84 113.70 117.36 1i7h s SER 66 Ca 0.52 0.85 -0.09 0.00 0.48 0.00 0.00 55.95 57.71 1i7h s SER 66 Cb -0.34 -1.30 0.02 0.00 0.10 0.00 0.00 66.02 64.50 1i7h s SER 66 CO 0.45 -3.24 1.54 1.05 0.98 0.00 0.00 173.24 174.01 1i7h h GLU 67 N -1.98 0.94 -0.50 4.02 9.09 -1.99 -1.61 114.58 122.55 1i7h h GLU 67 Ca -0.50 -0.43 -0.09 0.00 0.05 0.00 0.00 59.36 58.40 1i7h h GLU 67 Cb 1.31 -0.02 -0.02 0.00 -1.65 0.00 0.00 28.75 28.37 1i7h h GLU 67 CO 0.50 1.09 -0.03 0.37 0.05 0.00 0.00 179.01 180.99 1i7h h GLN 68 N 0.80 0.87 -0.22 1.06 4.15 -1.96 -2.23 115.11 117.57 1i7h h GLN 68 Ca 0.09 -0.26 -0.07 0.00 0.77 0.00 0.00 58.65 59.19 1i7h h GLN 68 Cb 0.84 -0.09 -0.01 0.00 0.21 0.00 0.00 27.48 28.44 1i7h h GLN 68 CO 0.07 0.89 -0.12 1.49 -1.93 0.00 0.00 178.83 179.23 1i7h h GLU 69 N 0.80 0.47 -0.72 1.69 4.81 -1.83 -2.92 114.58 116.88 1i7h h GLU 69 Ca 0.15 -0.21 0.10 0.00 -0.13 0.00 0.00 59.36 59.27 1i7h h GLU 69 Cb 0.52 -0.01 -0.07 0.00 0.63 0.00 0.00 28.75 29.82 1i7h h GLU 69 CO 0.03 0.75 0.35 -0.44 -0.73 0.00 0.00 179.01 178.97 1i7h h ASP 70 N 0.17 0.44 -0.72 1.04 3.32 -1.11 -0.64 116.42 118.92 1i7h h ASP 70 Ca 0.05 0.07 -0.02 0.00 0.02 0.00 0.00 57.03 57.15 1i7h h ASP 70 Cb 0.62 -0.00 -0.04 0.00 0.22 0.00 0.00 39.33 40.13 1i7h h ASP 70 CO 0.03 0.24 0.39 0.44 -1.72 0.00 0.00 179.24 178.62 1i7h h ASP 71 N 0.58 0.92 -0.42 6.45 3.32 -1.35 -2.46 116.42 123.45 1i7h h ASP 71 Ca 0.36 -0.08 -0.14 0.00 0.02 0.00 0.00 57.03 57.19 1i7h h ASP 71 Cb 0.41 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.71 1i7h h ASP 71 CO -0.29 0.75 -0.28 0.24 -1.72 0.00 0.00 179.24 177.94 1i7h h MET 72 N 1.03 0.95 0.00 3.56 2.86 -1.04 -3.03 114.93 119.26 1i7h h MET 72 Ca 0.26 -0.44 -0.01 0.00 -2.06 0.00 0.00 59.70 57.44 1i7h h MET 72 Cb 0.05 -0.01 -0.00 0.00 0.06 0.00 0.00 31.60 31.69 1i7h h MET 72 CO -0.04 1.11 -0.06 -0.07 1.06 0.00 0.00 176.91 178.90 1i7h h LEU 73 N 0.81 0.00 0.00 1.22 3.38 -0.72 -0.04 115.31 119.96 1i7h h LEU 73 Ca 0.09 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.06 1i7h h LEU 73 Cb 0.86 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.61 1i7h h LEU 73 CO 0.08 0.06 0.00 0.47 0.09 0.00 0.00 178.44 179.14 1i7h n ASP 74 N -4.41 0.00 -0.00 -0.43 8.00 -1.01 -0.74 116.55 117.97 1i7h n ASP 74 Ca -0.03 0.48 0.08 0.00 0.71 0.00 0.00 54.79 56.03 1i7h n ASP 74 Cb 0.14 -0.48 -0.10 0.00 -0.02 0.00 0.00 41.12 40.66 1i7h n ASP 74 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1i7h n LYS 75 N -1.48 1.54 -2.23 -1.24 5.02 -0.04 -5.00 118.16 114.72 1i7h n LYS 75 Ca 0.02 -0.01 -0.41 0.00 -2.02 0.00 0.00 58.31 55.89 1i7h n LYS 75 Cb 0.08 -1.28 -0.03 0.00 -0.02 0.00 0.00 35.03 33.79 1i7h n LYS 75 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1i7h s ALA 76 N -2.59 3.49 0.14 7.82 0.00 0.09 -4.88 121.76 125.83 1i7h s ALA 76 Ca 0.05 1.13 -0.29 0.00 0.00 0.00 0.00 51.96 52.85 1i7h s ALA 76 Cb 0.12 -3.45 -0.07 0.00 0.00 0.00 0.00 23.12 19.72 1i7h s ALA 76 CO 0.67 -0.51 0.93 -0.46 0.00 0.00 0.00 175.76 176.40 1i7h s TRP 77 N -0.65 3.86 -0.72 0.00 -0.00 -1.26 -3.78 118.94 116.39 1i7h s TRP 77 Ca 0.51 1.80 -0.03 0.00 -0.00 0.00 0.00 56.10 58.39 1i7h s TRP 77 Cb -0.37 -3.00 0.00 0.00 -0.00 0.00 0.00 33.47 30.10 1i7h s TRP 77 CO 0.45 0.29 0.33 0.41 -0.00 0.00 0.00 176.95 178.43 1i7h n GLY 78 N 2.03 0.13 3.76 5.86 0.00 -1.26 -4.89 105.19 110.81 1i7h n GLY 78 Ca 0.00 -0.33 -0.41 0.00 0.00 0.00 0.00 46.02 45.28 1i7h n GLY 78 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1i7h s LEU 79 N -3.52 4.38 0.14 0.99 2.96 -1.25 -5.03 118.68 117.36 1i7h s LEU 79 Ca 0.17 2.79 0.02 0.00 -0.22 0.00 0.00 54.13 56.88 1i7h s LEU 79 Cb -0.07 -3.64 -0.04 0.00 0.50 0.00 0.00 46.19 42.93 1i7h s LEU 79 CO 0.20 -0.70 -0.03 -1.61 -1.32 0.00 0.00 176.35 172.89 1i7h s GLU 80 N -1.27 0.99 0.52 1.98 2.02 -1.26 -5.03 118.70 116.65 1i7h s GLU 80 Ca 0.55 -1.45 0.24 0.00 0.02 0.00 0.00 54.97 54.33 1i7h s GLU 80 Cb -0.43 -0.25 1.37 0.00 0.10 0.00 0.00 34.13 34.92 1i7h s GLU 80 CO 0.52 -0.08 2.00 -1.35 0.02 0.00 0.00 175.26 176.37 1i7h h PRO 81 N 2.81 0.03 -0.64 0.39 0.11 -2.01 -1.19 132.00 131.50 1i7h h PRO 81 Ca -0.36 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.75 1i7h h PRO 81 Cb 1.19 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.29 1i7h h PRO 81 CO 0.63 0.02 0.00 0.39 -0.21 0.00 0.00 178.00 178.83 1i7h n GLU 82 N -4.39 3.84 -2.44 1.05 1.02 -1.26 -4.97 120.64 113.49 1i7h n GLU 82 Ca 0.10 -2.61 -0.36 0.00 -0.02 0.00 0.00 57.16 54.28 1i7h n GLU 82 Cb 0.59 -1.98 -0.03 0.00 -0.02 0.00 0.00 31.44 30.01 1i7h n GLU 82 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 1i7h s SER 83 N -0.76 6.32 0.04 1.62 0.01 -0.45 -1.16 113.70 119.32 1i7h s SER 83 Ca 0.46 2.08 -0.17 0.00 1.31 0.00 0.00 55.95 59.63 1i7h s SER 83 Cb 0.32 -2.58 0.03 0.00 0.21 0.00 0.00 66.02 64.00 1i7h s SER 83 CO 0.18 -0.80 0.37 -0.13 0.41 0.00 0.00 173.24 173.28 1i7h s ARG 84 N -2.92 0.88 -0.24 12.44 1.81 -0.24 -4.92 118.95 125.76 1i7h s ARG 84 Ca 0.65 -0.41 -0.23 0.00 -1.72 0.00 0.00 55.73 54.02 1i7h s ARG 84 Cb -0.22 0.39 -0.01 0.00 -0.45 0.00 0.00 34.95 34.66 1i7h s ARG 84 CO 0.26 -0.30 0.74 -0.51 -0.68 0.00 0.00 175.30 174.82 1i7h s LEU 85 N -2.03 4.08 0.64 2.53 1.43 -1.26 -1.24 118.68 122.83 1i7h s LEU 85 Ca -0.05 0.90 0.41 0.00 -1.03 0.00 0.00 54.13 54.35 1i7h s LEU 85 Cb -0.01 -3.05 2.20 0.00 0.03 0.00 0.00 46.19 45.36 1i7h s LEU 85 CO -0.03 -0.45 2.31 0.77 0.23 0.00 0.00 176.35 179.18 1i7h h SER 86 N 7.75 0.00 0.66 2.29 4.64 -1.61 -0.77 113.55 126.52 1i7h h SER 86 Ca -0.25 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.07 1i7h h SER 86 Cb 1.11 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.20 1i7h h SER 86 CO 0.83 0.01 -0.07 0.00 -0.87 0.00 0.00 176.83 176.73 1i7h n GLN 88 N -1.31 2.62 -2.41 0.00 1.13 -0.38 -4.95 117.38 112.08 1i7h n GLN 88 Ca 0.11 -0.00 -0.43 0.00 -1.94 0.00 0.00 57.00 54.74 1i7h n GLN 88 Cb 0.29 -1.21 -0.02 0.00 0.11 0.00 0.00 30.24 29.40 1i7h n GLN 88 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1i7h s ALA 89 N -2.20 3.63 -0.15 -1.58 0.00 -0.66 -4.99 121.76 115.82 1i7h s ALA 89 Ca -0.04 0.43 -0.03 0.00 0.00 0.00 0.00 51.96 52.32 1i7h s ALA 89 Cb 0.02 -3.64 -0.03 0.00 0.00 0.00 0.00 23.12 19.48 1i7h s ALA 89 CO 0.34 -1.25 -0.04 1.03 0.00 0.00 0.00 175.76 175.84 1i7h s ARG 90 N 3.59 3.57 0.49 0.00 0.52 -1.26 -1.09 118.95 124.77 1i7h s ARG 90 Ca 0.56 -0.52 -0.22 0.00 -0.52 0.00 0.00 55.73 55.02 1i7h s ARG 90 Cb -0.22 -2.87 -0.06 0.00 0.52 0.00 0.00 34.95 32.32 1i7h s ARG 90 CO 0.16 0.29 1.23 0.08 0.02 0.00 0.00 175.30 177.08 1i7h s VAL 91 N 0.22 2.77 0.00 3.52 1.01 0.21 -4.26 120.40 123.87 1i7h s VAL 91 Ca -0.03 0.58 0.00 0.00 0.00 0.00 0.00 61.98 62.53 1i7h s VAL 91 Cb -0.14 -3.29 0.00 0.00 0.00 0.00 0.00 36.38 32.95 1i7h s VAL 91 CO 0.03 -0.01 0.00 0.35 0.00 0.00 0.00 175.10 175.47 1i7h n THR 92 N -0.68 0.00 -0.92 3.92 -2.24 -1.26 0.18 114.28 113.28 1i7h n THR 92 Ca 0.08 0.00 0.08 0.00 -2.27 0.00 0.00 64.05 61.94 1i7h n THR 92 Cb 0.47 0.00 0.11 0.00 -2.10 0.00 0.00 70.33 68.81 1i7h n THR 92 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1i7h n ASP 93 N 0.00 2.19 -4.13 3.42 5.75 -1.26 -4.46 116.55 118.06 1i7h n ASP 93 Ca 0.00 -2.85 -0.21 0.00 -0.01 0.00 0.00 54.79 51.73 1i7h n ASP 93 Cb 0.00 -0.34 -0.14 0.00 -1.03 0.00 0.00 41.12 39.61 1i7h n ASP 93 CO 0.00 0.00 0.00 -0.70 -0.11 0.00 0.00 177.20 176.39 1i7h s GLU 94 N -2.43 1.00 0.46 0.11 2.12 -1.26 -4.98 118.70 113.72 1i7h s GLU 94 Ca 0.25 -0.66 -0.23 0.00 0.36 0.00 0.00 54.97 54.69 1i7h s GLU 94 Cb 0.22 -1.00 -0.07 0.00 0.26 0.00 0.00 34.13 33.54 1i7h s GLU 94 CO 0.02 0.26 1.19 -0.51 -0.54 0.00 0.00 175.26 175.68 1i7h s ASP 95 N -0.83 6.13 0.23 -1.70 1.11 -1.26 -4.75 116.67 115.60 1i7h s ASP 95 Ca 0.03 2.36 0.10 0.00 0.18 0.00 0.00 52.55 55.22 1i7h s ASP 95 Cb -0.07 -2.61 -0.05 0.00 1.07 0.00 0.00 42.92 41.27 1i7h s ASP 95 CO 0.01 -0.95 -0.17 -0.76 1.18 0.00 0.00 175.17 174.47 1i7h s LEU 96 N -3.00 2.56 -0.13 1.23 1.43 -0.25 -4.38 118.68 116.14 1i7h s LEU 96 Ca 0.63 -1.01 0.01 0.00 -1.03 0.00 0.00 54.13 52.74 1i7h s LEU 96 Cb -0.30 -0.88 0.02 0.00 0.03 0.00 0.00 46.19 45.06 1i7h s LEU 96 CO 0.37 -0.06 -0.14 -0.69 0.23 0.00 0.00 176.35 176.05 1i7h s VAL 97 N -2.67 1.51 -0.02 -1.59 1.01 -0.75 -1.07 120.40 116.83 1i7h s VAL 97 Ca 0.25 -0.62 0.07 0.00 0.00 0.00 0.00 61.98 61.68 1i7h s VAL 97 Cb -0.03 -1.41 -0.02 0.00 0.00 0.00 0.00 36.38 34.93 1i7h s VAL 97 CO 0.10 0.45 -0.21 -0.69 0.00 0.00 0.00 175.10 174.75 1i7h s VAL 98 N 1.27 1.69 -0.09 2.92 1.01 0.13 -0.92 120.40 126.40 1i7h s VAL 98 Ca -0.00 -0.91 0.03 0.00 0.00 0.00 0.00 61.98 61.09 1i7h s VAL 98 Cb -0.14 -1.40 -0.01 0.00 0.00 0.00 0.00 36.38 34.83 1i7h s VAL 98 CO -0.06 0.48 -0.19 -0.70 0.00 0.00 0.00 175.10 174.62 1i7h s GLU 99 N -0.50 2.99 -0.13 2.72 2.12 0.51 -1.10 118.70 125.31 1i7h s GLU 99 Ca 0.08 -0.79 -0.18 0.00 0.36 0.00 0.00 54.97 54.44 1i7h s GLU 99 Cb -0.08 -2.40 -0.04 0.00 0.26 0.00 0.00 34.13 31.87 1i7h s GLU 99 CO -0.01 0.29 0.49 0.42 -0.54 0.00 0.00 175.26 175.91 1i7h s ILE 100 N 0.10 5.17 0.84 -3.70 1.01 -1.26 -0.71 121.20 122.64 1i7h s ILE 100 Ca -0.09 0.97 -0.13 0.00 0.00 0.00 0.00 60.65 61.40 1i7h s ILE 100 Cb -0.15 -3.83 0.08 0.00 0.01 0.00 0.00 42.46 38.57 1i7h s ILE 100 CO 0.06 0.30 1.06 -2.65 0.00 0.00 0.00 174.94 173.71 1i7h n PRO 101 N 3.84 0.02 0.26 2.79 -0.02 -1.26 -4.91 135.00 135.71 1i7h n PRO 101 Ca -0.07 0.08 0.15 0.00 -2.02 0.00 0.00 63.50 61.64 1i7h n PRO 101 Cb 0.51 -2.32 0.62 0.00 -0.02 0.00 0.00 33.50 32.29 1i7h n PRO 101 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1i7h h ARG 102 N -1.12 0.00 -2.69 -0.52 2.47 -1.96 -3.45 114.38 107.10 1i7h h ARG 102 Ca -0.45 0.00 -0.05 0.00 -1.26 0.00 0.00 59.98 58.21 1i7h h ARG 102 Cb 1.30 0.00 -0.16 0.00 -1.65 0.00 0.00 29.97 29.46 1i7h h ARG 102 CO 0.44 0.08 0.08 -0.47 0.56 0.00 0.00 179.97 180.65 1i7h s TYR 103 N -3.70 -0.47 0.00 3.04 5.04 -1.26 -5.13 117.35 114.87 1i7h s TYR 103 Ca 0.01 0.55 0.00 0.00 -2.44 0.00 0.00 57.07 55.19 1i7h s TYR 103 Cb 0.10 0.38 -0.00 0.00 0.35 0.00 0.00 41.96 42.78 1i7h s TYR 103 CO 0.57 -0.67 -0.01 0.95 -1.34 0.00 0.00 175.55 175.05 1i7h s THR 104 N -2.44 0.09 0.04 4.34 -4.23 -1.26 -4.77 115.64 107.41 1i7h s THR 104 Ca -0.05 -0.19 -0.29 0.00 -1.18 0.00 0.00 61.69 59.97 1i7h s THR 104 Cb -0.01 -0.11 -0.04 0.00 1.34 0.00 0.00 72.50 73.68 1i7h s THR 104 CO -0.02 -0.06 0.95 -0.63 -0.54 0.00 0.00 174.62 174.32 1i7h s ILE 105 N -0.26 4.73 -0.39 2.99 1.01 -1.26 -4.99 121.20 123.02 1i7h s ILE 105 Ca -0.02 2.02 0.05 0.00 0.00 0.00 0.00 60.65 62.70 1i7h s ILE 105 Cb -0.02 -4.30 0.17 0.00 0.01 0.00 0.00 42.46 38.32 1i7h s ILE 105 CO -0.00 0.23 0.49 0.21 0.00 0.00 0.00 174.94 175.87 1i7h s ASN 106 N 0.56 -0.03 0.35 3.58 3.84 -1.26 -4.51 114.94 117.47 1i7h s ASN 106 Ca 0.49 -1.25 0.16 0.00 0.21 0.00 0.00 52.86 52.46 1i7h s ASN 106 Cb -0.22 1.18 0.85 0.00 -0.55 0.00 0.00 41.25 42.51 1i7h s ASN 106 CO 0.28 -0.22 1.40 0.45 -2.79 0.00 0.00 177.10 176.22 1i7h h HIS 107 N 7.01 0.00 -0.00 0.43 3.86 -2.05 0.10 115.15 124.50 1i7h h HIS 107 Ca 0.05 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.26 1i7h h HIS 107 Cb 1.11 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.58 1i7h h HIS 107 CO 0.25 0.00 -0.67 0.00 0.86 0.00 0.00 177.93 178.37 1i7h n ALA 108 N -1.62 3.99 -1.75 2.45 0.00 -1.26 -4.96 120.51 117.35 1i7h n ALA 108 Ca -0.01 -0.51 -0.39 0.00 0.00 0.00 0.00 53.44 52.54 1i7h n ALA 108 Cb 0.28 -0.93 0.03 0.00 0.00 0.00 0.00 19.45 18.84 1i7h n ALA 108 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 1i7h s ARG 109 N -2.85 3.27 0.00 0.00 3.52 0.34 -5.27 118.95 117.96 1i7h s ARG 109 Ca 0.13 2.24 0.25 0.00 -0.13 0.00 0.00 55.73 58.22 1i7h s ARG 109 Cb 0.17 -2.33 0.48 0.00 -1.56 0.00 0.00 34.95 31.70 1i7h s ARG 109 CO 0.73 -1.09 1.42 0.39 -0.81 0.00 0.00 175.30 175.94