#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ag9 h ILE 3 N 0.00 0.78 -3.45 0.00 3.07 -1.80 -3.44 117.51 112.68 1ag9 h ILE 3 Ca 0.00 -1.69 -0.64 0.00 1.55 0.00 0.00 64.86 64.08 1ag9 h ILE 3 Cb 0.00 2.08 -0.21 0.00 -0.27 0.00 0.00 36.82 38.43 1ag9 h ILE 3 CO 0.00 0.38 -0.62 -0.89 -1.05 0.00 0.00 178.15 175.96 1ag9 s THR 4 N -3.36 4.29 -0.26 0.16 2.01 -0.55 -3.74 115.64 114.18 1ag9 s THR 4 Ca 0.02 -0.20 -0.04 0.00 0.31 0.00 0.00 61.69 61.78 1ag9 s THR 4 Cb 0.09 -2.95 0.01 0.00 0.01 0.00 0.00 72.50 69.66 1ag9 s THR 4 CO 0.70 0.42 -0.00 -0.83 -0.69 0.00 0.00 174.62 174.21 1ag9 s GLY 5 N 0.93 1.68 -0.24 4.40 0.00 -0.58 -0.19 107.32 113.32 1ag9 s GLY 5 Ca 0.03 -1.37 -0.17 0.00 0.00 0.00 0.00 44.72 43.20 1ag9 s GLY 5 CO 0.02 0.54 0.45 -0.42 0.00 0.00 0.00 173.10 173.69 1ag9 s ILE 6 N 1.43 5.13 -0.22 0.90 1.01 0.10 -1.73 121.20 127.82 1ag9 s ILE 6 Ca 0.03 0.76 0.01 0.00 0.00 0.00 0.00 60.65 61.45 1ag9 s ILE 6 Cb -0.16 -3.77 0.04 0.00 0.01 0.00 0.00 42.46 38.58 1ag9 s ILE 6 CO -0.02 0.15 -0.14 -0.36 0.00 0.00 0.00 174.94 174.58 1ag9 s PHE 7 N 1.94 3.03 0.30 3.97 0.40 -0.20 -0.16 117.98 127.26 1ag9 s PHE 7 Ca 0.19 -1.92 0.10 0.00 -0.60 0.00 0.00 56.93 54.70 1ag9 s PHE 7 Cb -0.15 -1.95 -0.05 0.00 0.51 0.00 0.00 43.02 41.38 1ag9 s PHE 7 CO 0.09 -0.83 -0.09 -0.59 0.70 0.00 0.00 175.22 174.50 1ag9 s PHE 8 N 1.22 2.46 -0.02 0.36 -0.12 -0.42 -0.83 117.98 120.61 1ag9 s PHE 8 Ca -0.02 -0.36 0.02 0.00 -0.05 0.00 0.00 56.93 56.52 1ag9 s PHE 8 Cb -0.17 -1.21 0.01 0.00 -0.63 0.00 0.00 43.02 41.02 1ag9 s PHE 8 CO -0.08 0.62 -0.06 0.20 -0.05 0.00 0.00 175.22 175.85 1ag9 s GLY 9 N -3.61 0.38 -0.18 1.99 0.00 -0.88 -0.08 107.32 104.95 1ag9 s GLY 9 Ca 0.32 -0.17 -0.13 0.00 0.00 0.00 0.00 44.72 44.74 1ag9 s GLY 9 CO 0.17 0.07 0.45 -0.45 0.00 0.00 0.00 173.10 173.34 1ag9 s SER 10 N 0.34 -0.52 -0.22 1.64 0.15 -1.26 -4.23 113.70 109.60 1ag9 s SER 10 Ca -0.04 0.94 -0.18 0.00 0.70 0.00 0.00 55.95 57.37 1ag9 s SER 10 Cb -0.08 0.89 -0.14 0.00 -1.71 0.00 0.00 66.02 64.97 1ag9 s SER 10 CO -0.00 -0.18 -0.03 0.47 1.20 0.00 0.00 173.24 174.70 1ag9 n ASP 11 N 3.50 1.88 -1.00 5.45 9.92 -1.26 -4.55 116.55 130.49 1ag9 n ASP 11 Ca -0.18 0.43 0.08 0.00 -0.53 0.00 0.00 54.79 54.59 1ag9 n ASP 11 Cb 0.56 -0.90 0.25 0.00 -0.64 0.00 0.00 41.12 40.39 1ag9 n ASP 11 CO 0.00 0.00 0.00 0.35 0.13 0.00 0.00 177.20 177.68 1ag9 n THR 12 N -4.41 1.58 -0.48 -3.53 -2.24 -1.26 -4.98 114.28 98.95 1ag9 n THR 12 Ca -0.33 -1.30 0.00 0.00 -2.27 0.00 0.00 64.05 60.15 1ag9 n THR 12 Cb 0.66 0.19 0.00 0.00 -2.10 0.00 0.00 70.33 69.09 1ag9 n THR 12 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ag9 n GLY 13 N 0.45 1.43 0.08 3.38 0.00 -1.26 -4.94 105.19 104.33 1ag9 n GLY 13 Ca 0.19 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.09 1ag9 n GLY 13 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1ag9 h ASN 14 N 0.00 0.15 0.19 1.61 -0.26 -1.95 -0.02 115.58 115.29 1ag9 h ASN 14 Ca 0.00 -0.25 -0.07 0.00 -0.56 0.00 0.00 56.30 55.42 1ag9 h ASN 14 Cb 0.00 -0.04 -0.01 0.00 -1.06 0.00 0.00 38.32 37.21 1ag9 h ASN 14 CO 0.00 0.36 -0.26 0.74 -1.06 0.00 0.00 177.43 177.21 1ag9 h THR 15 N -0.07 1.22 -0.57 2.81 2.02 -1.92 -1.39 112.91 115.00 1ag9 h THR 15 Ca 0.03 -1.05 -0.05 0.00 0.77 0.00 0.00 66.41 66.11 1ag9 h THR 15 Cb 0.27 1.46 -0.02 0.00 -1.74 0.00 0.00 68.15 68.12 1ag9 h THR 15 CO 0.00 0.31 0.18 -0.08 0.37 0.00 0.00 175.52 176.30 1ag9 h GLU 16 N 0.12 0.89 -0.30 6.66 4.81 -1.76 0.03 114.58 125.04 1ag9 h GLU 16 Ca 0.02 -0.19 0.01 0.00 -0.13 0.00 0.00 59.36 59.07 1ag9 h GLU 16 Cb 0.54 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 29.77 1ag9 h GLU 16 CO 0.04 0.80 0.17 -0.91 -0.73 0.00 0.00 179.01 178.38 1ag9 h ASN 17 N 0.81 0.27 -0.69 1.04 2.35 -0.07 -1.75 115.58 117.53 1ag9 h ASN 17 Ca 0.19 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 55.92 1ag9 h ASN 17 Cb 0.28 -0.05 -0.03 0.00 0.05 0.00 0.00 38.32 38.57 1ag9 h ASN 17 CO -0.01 0.20 0.35 0.40 -1.65 0.00 0.00 177.43 176.72 1ag9 h ILE 18 N 0.35 1.22 -0.78 2.81 1.08 -0.84 -2.04 117.51 119.31 1ag9 h ILE 18 Ca 0.12 -0.60 -0.00 0.00 -0.39 0.00 0.00 64.86 63.98 1ag9 h ILE 18 Cb 0.01 0.30 -0.04 0.00 -3.07 0.00 0.00 36.82 34.02 1ag9 h ILE 18 CO -0.06 0.26 0.47 0.00 -0.69 0.00 0.00 178.15 178.13 1ag9 h ALA 19 N 1.39 0.99 -0.16 1.87 0.00 -0.42 -1.59 119.26 121.35 1ag9 h ALA 19 Ca 0.25 -0.09 -0.13 0.00 0.00 0.00 0.00 54.91 54.94 1ag9 h ALA 19 Cb 0.08 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 1ag9 h ALA 19 CO -0.03 0.46 -0.46 0.87 0.00 0.00 0.00 179.25 180.08 1ag9 h LYS 20 N 1.07 0.41 -0.32 0.00 1.57 -0.87 -2.16 116.57 116.26 1ag9 h LYS 20 Ca 0.28 -0.22 -0.02 0.00 -1.87 0.00 0.00 60.65 58.81 1ag9 h LYS 20 Cb -0.04 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.26 1ag9 h LYS 20 CO -0.05 0.79 0.12 0.52 -0.57 0.00 0.00 179.45 180.26 1ag9 h MET 21 N 0.33 0.49 -0.21 3.15 2.86 -0.92 -1.10 114.93 119.53 1ag9 h MET 21 Ca 0.02 -0.10 -0.00 0.00 -2.06 0.00 0.00 59.70 57.56 1ag9 h MET 21 Cb 0.94 -0.08 -0.01 0.00 0.06 0.00 0.00 31.60 32.52 1ag9 h MET 21 CO 0.08 0.51 0.13 0.82 1.06 0.00 0.00 176.91 179.51 1ag9 h ILE 22 N 0.37 1.08 -0.55 -1.22 2.04 -1.20 -0.40 117.51 117.64 1ag9 h ILE 22 Ca 0.11 -0.19 0.02 0.00 1.00 0.00 0.00 64.86 65.80 1ag9 h ILE 22 Cb 0.21 0.82 -0.03 0.00 -0.74 0.00 0.00 36.82 37.08 1ag9 h ILE 22 CO -0.01 0.08 0.34 -0.61 0.00 0.00 0.00 178.15 177.95 1ag9 h GLN 23 N 0.26 0.66 -0.75 2.37 4.15 -1.30 0.53 115.11 121.04 1ag9 h GLN 23 Ca 0.08 -0.04 -0.06 0.00 0.77 0.00 0.00 58.65 59.40 1ag9 h GLN 23 Cb 0.01 -0.15 -0.03 0.00 0.21 0.00 0.00 27.48 27.52 1ag9 h GLN 23 CO -0.01 0.44 0.24 -0.22 -1.93 0.00 0.00 178.83 177.35 1ag9 h LYS 24 N 0.68 1.17 -0.37 1.69 3.64 -1.00 1.26 116.57 123.64 1ag9 h LYS 24 Ca 0.21 -0.25 -0.15 0.00 -1.27 0.00 0.00 60.65 59.19 1ag9 h LYS 24 Cb -0.02 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 31.63 1ag9 h LYS 24 CO -0.08 0.98 -0.37 0.37 -2.27 0.00 0.00 179.45 178.08 1ag9 h GLN 25 N 1.12 0.91 0.00 1.90 4.15 -0.66 -2.89 115.11 119.63 1ag9 h GLN 25 Ca 0.24 -0.48 -0.09 0.00 0.77 0.00 0.00 58.65 59.09 1ag9 h GLN 25 Cb 0.30 0.02 -0.01 0.00 0.21 0.00 0.00 27.48 27.99 1ag9 h GLN 25 CO -0.01 1.13 -0.45 -0.07 -1.93 0.00 0.00 178.83 177.50 1ag9 h LEU 26 N 0.72 0.00 0.00 -2.39 3.38 -0.69 -3.50 115.31 112.83 1ag9 h LEU 26 Ca 0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.03 1ag9 h LEU 26 Cb 0.97 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.72 1ag9 h LEU 26 CO 0.09 0.45 0.00 0.61 0.09 0.00 0.00 178.44 179.68 1ag9 n GLY 27 N 0.75 0.23 0.35 0.83 0.00 0.43 -4.44 105.19 103.35 1ag9 n GLY 27 Ca 0.01 -1.31 0.18 0.00 0.00 0.00 0.00 46.02 44.90 1ag9 n GLY 27 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ag9 h LYS 28 N 0.00 0.00 0.00 1.61 1.57 -1.77 0.72 116.57 118.70 1ag9 h LYS 28 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1ag9 h LYS 28 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 1ag9 h LYS 28 CO 0.00 0.00 0.00 -0.40 -0.57 0.00 0.00 179.45 178.48 1ag9 n ASP 29 N -3.57 0.57 -0.07 0.86 5.75 -1.26 -3.40 116.55 115.43 1ag9 n ASP 29 Ca 0.02 0.58 -0.07 0.00 -0.01 0.00 0.00 54.79 55.32 1ag9 n ASP 29 Cb 0.41 -0.72 -0.13 0.00 -1.03 0.00 0.00 41.12 39.65 1ag9 n ASP 29 CO 0.00 0.00 0.00 0.52 -0.11 0.00 0.00 177.20 177.61 1ag9 n VAL 30 N -2.07 1.02 -3.98 2.12 0.31 0.20 -4.59 118.33 111.34 1ag9 n VAL 30 Ca 0.05 -0.66 -0.13 0.00 -0.01 0.00 0.00 64.34 63.58 1ag9 n VAL 30 Cb 0.34 -0.52 -0.14 0.00 -0.91 0.00 0.00 33.84 32.60 1ag9 n VAL 30 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1ag9 s ALA 31 N -2.45 0.17 0.15 3.52 0.00 -0.92 -1.49 121.76 120.75 1ag9 s ALA 31 Ca -0.08 -0.10 0.04 0.00 0.00 0.00 0.00 51.96 51.82 1ag9 s ALA 31 Cb 0.05 -0.04 -0.04 0.00 0.00 0.00 0.00 23.12 23.10 1ag9 s ALA 31 CO 0.66 0.04 0.20 -0.51 0.00 0.00 0.00 175.76 176.15 1ag9 s ASP 32 N -0.09 5.91 -0.12 0.00 1.01 0.73 -4.47 116.67 119.65 1ag9 s ASP 32 Ca 0.00 0.02 0.03 0.00 0.71 0.00 0.00 52.55 53.31 1ag9 s ASP 32 Cb -0.01 -1.67 0.00 0.00 1.01 0.00 0.00 42.92 42.25 1ag9 s ASP 32 CO -0.00 0.07 -0.22 -0.69 0.21 0.00 0.00 175.17 174.53 1ag9 s VAL 33 N -1.73 2.16 0.02 -1.27 1.01 -1.26 0.01 120.40 119.34 1ag9 s VAL 33 Ca 0.33 -0.97 0.04 0.00 0.00 0.00 0.00 61.98 61.37 1ag9 s VAL 33 Cb -0.11 -1.84 -0.02 0.00 0.00 0.00 0.00 36.38 34.41 1ag9 s VAL 33 CO 0.26 0.55 -0.11 -1.00 0.00 0.00 0.00 175.10 174.80 1ag9 s HIS 34 N 0.50 1.01 -0.17 5.22 3.76 0.78 -4.96 115.29 121.43 1ag9 s HIS 34 Ca -0.14 -0.31 -0.17 0.00 -0.15 0.00 0.00 55.06 54.29 1ag9 s HIS 34 Cb -0.17 -0.61 -0.04 0.00 1.11 0.00 0.00 32.58 32.87 1ag9 s HIS 34 CO 0.05 0.00 0.43 0.34 -0.85 0.00 0.00 174.74 174.71 1ag9 s ASP 35 N -0.90 6.53 0.49 1.40 -1.08 -1.26 -1.30 116.67 120.54 1ag9 s ASP 35 Ca 0.00 0.63 0.16 0.00 -0.52 0.00 0.00 52.55 52.82 1ag9 s ASP 35 Cb -0.07 -2.25 1.18 0.00 -1.46 0.00 0.00 42.92 40.32 1ag9 s ASP 35 CO 0.01 -0.05 2.08 -0.29 0.52 0.00 0.00 175.17 177.44 1ag9 h ILE 36 N 4.91 0.96 0.00 4.11 6.09 -0.82 -1.49 117.51 131.26 1ag9 h ILE 36 Ca -0.38 -0.06 0.00 0.00 -1.37 0.00 0.00 64.86 63.06 1ag9 h ILE 36 Cb 1.17 0.78 0.00 0.00 0.47 0.00 0.00 36.82 39.24 1ag9 h ILE 36 CO 0.74 0.03 0.00 0.00 -3.07 0.00 0.00 178.15 175.85 1ag9 h ALA 37 N 1.86 1.00 -0.07 0.18 0.00 -1.86 -2.18 119.26 118.19 1ag9 h ALA 37 Ca 0.11 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 1ag9 h ALA 37 Cb 0.25 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.04 1ag9 h ALA 37 CO -0.02 0.00 -0.00 1.63 0.00 0.00 0.00 179.25 180.86 1ag9 n LYS 38 N -2.92 1.71 -4.28 0.00 5.02 -0.57 -5.04 118.16 112.07 1ag9 n LYS 38 Ca -0.01 -2.65 -0.27 0.00 -2.02 0.00 0.00 58.31 53.36 1ag9 n LYS 38 Cb 0.15 -1.59 -0.09 0.00 -0.02 0.00 0.00 35.03 33.48 1ag9 n LYS 38 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 1ag9 s SER 39 N -2.64 4.27 0.42 4.39 0.01 -0.82 -4.92 113.70 114.41 1ag9 s SER 39 Ca 0.35 -0.56 0.07 0.00 1.31 0.00 0.00 55.95 57.11 1ag9 s SER 39 Cb 0.30 -0.73 -0.04 0.00 0.21 0.00 0.00 66.02 65.76 1ag9 s SER 39 CO 0.05 0.11 0.24 -0.94 0.41 0.00 0.00 173.24 173.10 1ag9 s SER 40 N -2.80 4.59 0.31 2.44 1.04 -1.26 -5.01 113.70 113.01 1ag9 s SER 40 Ca 0.25 -1.02 0.02 0.00 0.48 0.00 0.00 55.95 55.68 1ag9 s SER 40 Cb -0.09 -0.43 0.58 0.00 0.10 0.00 0.00 66.02 66.19 1ag9 s SER 40 CO 0.15 -0.61 1.90 0.50 0.98 0.00 0.00 173.24 176.16 1ag9 h LYS 41 N 1.28 0.94 -0.26 4.02 3.64 -2.00 -1.82 116.57 122.38 1ag9 h LYS 41 Ca -0.42 -0.06 -0.09 0.00 -1.27 0.00 0.00 60.65 58.81 1ag9 h LYS 41 Cb 1.26 -0.21 -0.01 0.00 -0.41 0.00 0.00 32.23 32.85 1ag9 h LYS 41 CO 0.66 0.62 -0.24 0.93 -2.27 0.00 0.00 179.45 179.15 1ag9 h GLU 42 N 0.96 0.49 -0.95 1.90 3.07 -1.98 -1.89 114.58 116.17 1ag9 h GLU 42 Ca 0.40 -0.18 0.10 0.00 -0.50 0.00 0.00 59.36 59.18 1ag9 h GLU 42 Cb 0.30 -0.03 -0.07 0.00 -0.84 0.00 0.00 28.75 28.11 1ag9 h GLU 42 CO -0.16 0.69 0.61 -0.44 -1.40 0.00 0.00 179.01 178.31 1ag9 h ASP 43 N 0.43 0.90 0.13 1.42 3.32 -1.72 -0.98 116.42 119.92 1ag9 h ASP 43 Ca 0.07 0.03 -0.18 0.00 0.02 0.00 0.00 57.03 56.97 1ag9 h ASP 43 Cb 0.65 -0.16 0.02 0.00 0.22 0.00 0.00 39.33 40.06 1ag9 h ASP 43 CO 0.05 0.52 -0.78 -0.07 -1.72 0.00 0.00 179.24 177.24 1ag9 h LEU 44 N 0.99 0.43 -2.29 1.55 4.07 -1.50 -3.29 115.31 115.26 1ag9 h LEU 44 Ca 0.44 -0.95 0.04 0.00 0.08 0.00 0.00 57.88 57.49 1ag9 h LEU 44 Cb 0.38 -0.14 -0.01 0.00 1.08 0.00 0.00 40.66 41.97 1ag9 h LEU 44 CO -0.20 1.37 0.15 -0.33 -1.08 0.00 0.00 178.44 178.35 1ag9 h GLU 45 N -0.42 0.00 0.00 1.13 5.08 -1.06 -1.57 114.58 117.74 1ag9 h GLU 45 Ca -0.14 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.22 1ag9 h GLU 45 Cb 1.60 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.85 1ag9 h GLU 45 CO 0.14 0.00 0.00 0.00 -1.00 0.00 0.00 179.01 178.15 1ag9 n ALA 46 N -2.32 1.48 -2.57 3.43 0.00 -0.40 -4.74 120.51 115.38 1ag9 n ALA 46 Ca 0.00 0.10 -0.28 0.00 0.00 0.00 0.00 53.44 53.26 1ag9 n ALA 46 Cb 0.26 -1.34 -0.10 0.00 0.00 0.00 0.00 19.45 18.27 1ag9 n ALA 46 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 1ag9 s TYR 47 N -3.34 2.69 -1.08 0.00 1.51 -0.59 -5.00 117.35 111.53 1ag9 s TYR 47 Ca 0.03 -0.19 0.14 0.00 -1.01 0.00 0.00 57.07 56.04 1ag9 s TYR 47 Cb 0.08 -1.37 -0.06 0.00 -0.11 0.00 0.00 41.96 40.51 1ag9 s TYR 47 CO 0.32 0.46 0.72 -0.25 -1.11 0.00 0.00 175.55 175.69 1ag9 n ASP 48 N 0.39 1.21 -3.78 2.29 8.00 -1.26 -4.82 116.55 118.57 1ag9 n ASP 48 Ca -0.12 -1.10 -0.26 0.00 0.71 0.00 0.00 54.79 54.01 1ag9 n ASP 48 Cb 0.54 0.66 -0.17 0.00 -0.02 0.00 0.00 41.12 42.13 1ag9 n ASP 48 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1ag9 s ILE 49 N -1.94 0.61 -0.03 0.53 1.01 -1.25 -0.61 121.20 119.53 1ag9 s ILE 49 Ca 0.10 -0.33 0.07 0.00 0.00 0.00 0.00 60.65 60.48 1ag9 s ILE 49 Cb 0.11 -0.91 -0.01 0.00 0.01 0.00 0.00 42.46 41.65 1ag9 s ILE 49 CO 0.43 0.04 -0.23 -0.76 0.00 0.00 0.00 174.94 174.42 1ag9 s LEU 50 N 1.85 2.03 -0.21 2.97 1.43 -0.35 -1.52 118.68 124.88 1ag9 s LEU 50 Ca 0.02 -0.43 0.02 0.00 -1.03 0.00 0.00 54.13 52.70 1ag9 s LEU 50 Cb -0.15 -1.21 0.04 0.00 0.03 0.00 0.00 46.19 44.90 1ag9 s LEU 50 CO -0.07 0.26 -0.16 -0.76 0.23 0.00 0.00 176.35 175.85 1ag9 s LEU 51 N -0.38 2.67 -0.22 1.79 1.43 -0.71 -1.44 118.68 121.82 1ag9 s LEU 51 Ca 0.04 -0.96 -0.06 0.00 -1.03 0.00 0.00 54.13 52.12 1ag9 s LEU 51 Cb -0.10 -1.49 -0.03 0.00 0.03 0.00 0.00 46.19 44.60 1ag9 s LEU 51 CO 0.01 -0.08 0.03 -0.76 0.23 0.00 0.00 176.35 175.77 1ag9 s LEU 52 N 1.22 3.35 -0.20 1.79 1.43 0.24 -1.04 118.68 125.48 1ag9 s LEU 52 Ca -0.01 -0.19 -0.06 0.00 -1.03 0.00 0.00 54.13 52.85 1ag9 s LEU 52 Cb -0.16 -1.87 -0.03 0.00 0.03 0.00 0.00 46.19 44.17 1ag9 s LEU 52 CO -0.10 0.04 0.02 -0.83 0.23 0.00 0.00 176.35 175.71 1ag9 s GLY 53 N 1.16 1.76 -0.17 -3.19 0.00 -0.01 -1.22 107.32 105.64 1ag9 s GLY 53 Ca 0.03 -0.94 -0.04 0.00 0.00 0.00 0.00 44.72 43.77 1ag9 s GLY 53 CO 0.02 0.20 0.28 -1.50 0.00 0.00 0.00 173.10 172.09 1ag9 s ILE 54 N 0.88 -0.43 0.56 0.90 2.07 0.46 -2.06 121.20 123.57 1ag9 s ILE 54 Ca 0.01 0.10 -0.09 0.00 -1.41 0.00 0.00 60.65 59.26 1ag9 s ILE 54 Cb -0.14 -0.58 -0.04 0.00 0.13 0.00 0.00 42.46 41.82 1ag9 s ILE 54 CO 0.02 -0.02 0.94 -2.16 -1.91 0.00 0.00 174.94 171.81 1ag9 s PRO 55 N 2.42 3.61 -0.18 3.50 0.04 -1.26 -3.99 135.00 139.14 1ag9 s PRO 55 Ca 0.05 0.57 -0.07 0.00 0.04 0.00 0.00 61.00 61.59 1ag9 s PRO 55 Cb -0.14 -2.19 -0.04 0.00 0.04 0.00 0.00 34.50 32.17 1ag9 s PRO 55 CO -0.11 -0.41 0.05 0.99 0.04 0.00 0.00 177.00 177.55 1ag9 s THR 56 N -2.97 4.66 0.27 1.26 2.01 -1.07 -2.35 115.64 117.45 1ag9 s THR 56 Ca 0.53 -0.08 0.04 0.00 0.31 0.00 0.00 61.69 62.48 1ag9 s THR 56 Cb -0.11 -3.09 -0.06 0.00 0.01 0.00 0.00 72.50 69.26 1ag9 s THR 56 CO 0.49 0.47 0.03 0.26 -0.69 0.00 0.00 174.62 175.18 1ag9 s TRP 57 N 0.34 1.74 -1.27 4.92 0.52 0.70 -4.86 118.94 121.03 1ag9 s TRP 57 Ca 0.02 -0.95 -0.29 0.00 0.02 0.00 0.00 56.10 54.90 1ag9 s TRP 57 Cb -0.13 -1.06 0.04 0.00 -1.15 0.00 0.00 33.47 31.17 1ag9 s TRP 57 CO 0.00 -0.04 0.58 0.98 0.02 0.00 0.00 176.95 178.50 1ag9 n TYR 58 N -0.54 -1.39 -3.20 -1.98 9.36 -1.26 -0.09 117.16 118.06 1ag9 n TYR 58 Ca -0.03 0.17 -0.09 0.00 3.32 0.00 0.00 57.90 61.26 1ag9 n TYR 58 Cb 0.65 -2.82 0.04 0.00 -0.63 0.00 0.00 39.34 36.57 1ag9 n TYR 58 CO 0.00 0.00 0.00 0.66 0.22 0.00 0.00 176.86 177.74 1ag9 n TYR 59 N -4.96 -2.66 -0.56 2.98 4.01 -1.26 -3.89 117.16 110.81 1ag9 n TYR 59 Ca -0.14 0.96 0.00 0.00 -0.16 0.00 0.00 57.90 58.56 1ag9 n TYR 59 Cb 0.58 -4.06 0.00 0.00 -0.31 0.00 0.00 39.34 35.56 1ag9 n TYR 59 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1ag9 n GLY 60 N -1.50 0.74 3.88 2.72 0.00 -1.20 -5.03 105.19 104.80 1ag9 n GLY 60 Ca -0.05 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.66 1ag9 n GLY 60 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ag9 s GLU 61 N -0.44 3.75 0.43 1.61 0.41 0.87 -4.50 118.70 120.82 1ag9 s GLU 61 Ca 0.00 0.18 -0.24 0.00 -0.41 0.00 0.00 54.97 54.50 1ag9 s GLU 61 Cb 0.00 -2.69 -0.08 0.00 -1.78 0.00 0.00 34.13 29.58 1ag9 s GLU 61 CO 0.00 0.34 1.18 0.00 -0.49 0.00 0.00 175.26 176.29 1ag9 s ALA 62 N -1.81 3.09 0.22 5.21 0.00 -1.26 -0.22 121.76 126.99 1ag9 s ALA 62 Ca 0.46 0.98 -0.31 0.00 0.00 0.00 0.00 51.96 53.09 1ag9 s ALA 62 Cb -0.11 -3.39 -0.15 0.00 0.00 0.00 0.00 23.12 19.47 1ag9 s ALA 62 CO 0.23 -0.61 1.06 0.94 0.00 0.00 0.00 175.76 177.38 1ag9 n GLN 63 N -0.15 1.15 -0.35 0.00 0.00 -0.99 -4.53 117.38 112.51 1ag9 n GLN 63 Ca 0.05 0.41 0.23 0.00 -0.00 0.00 0.00 57.00 57.69 1ag9 n GLN 63 Cb 0.47 -1.82 0.48 0.00 0.00 0.00 0.00 30.24 29.37 1ag9 n GLN 63 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1ag9 h ASP 65 N 0.39 0.78 -0.49 0.00 3.32 -1.96 -1.79 116.42 116.67 1ag9 h ASP 65 Ca 0.68 -0.47 -0.12 0.00 0.02 0.00 0.00 57.03 57.14 1ag9 h ASP 65 Cb 1.60 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 40.91 1ag9 h ASP 65 CO -0.45 1.23 -0.17 -0.50 -1.72 0.00 0.00 179.24 177.63 1ag9 h TRP 66 N 0.49 1.13 -0.78 4.55 -0.00 -1.45 -2.35 115.95 117.54 1ag9 h TRP 66 Ca -0.02 -0.26 0.00 0.00 -0.00 0.00 0.00 58.89 58.62 1ag9 h TRP 66 Cb 1.25 -0.27 -0.04 0.00 -0.00 0.00 0.00 29.16 30.10 1ag9 h TRP 66 CO 0.06 1.08 0.50 0.22 -0.00 0.00 0.00 178.44 180.30 1ag9 h ASP 67 N 0.87 0.92 -0.32 -3.49 3.58 -0.96 0.29 116.42 117.30 1ag9 h ASP 67 Ca 0.12 -0.04 -0.03 0.00 0.42 0.00 0.00 57.03 57.49 1ag9 h ASP 67 Cb 0.75 -0.23 -0.02 0.00 1.72 0.00 0.00 39.33 41.54 1ag9 h ASP 67 CO 0.06 0.69 0.10 0.44 -2.88 0.00 0.00 179.24 177.65 1ag9 h ASP 68 N 1.07 0.53 1.75 2.28 3.32 -1.15 -2.91 116.42 121.31 1ag9 h ASP 68 Ca 0.28 -0.07 0.00 0.00 0.02 0.00 0.00 57.03 57.26 1ag9 h ASP 68 Cb -0.08 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 39.33 1ag9 h ASP 68 CO -0.06 0.53 -0.25 0.15 -1.72 0.00 0.00 179.24 177.90 1ag9 h PHE 69 N 0.57 0.00 -0.80 4.55 3.57 -0.75 -3.39 116.94 120.69 1ag9 h PHE 69 Ca 0.13 0.00 0.18 0.00 3.53 0.00 0.00 57.97 61.81 1ag9 h PHE 69 Cb 0.21 0.00 -0.14 0.00 2.79 0.00 0.00 35.95 38.81 1ag9 h PHE 69 CO 0.01 0.00 -0.07 0.74 -2.23 0.00 0.00 178.31 176.75 1ag9 h PHE 70 N 0.00 -0.20 -0.83 0.41 0.04 -0.77 0.12 116.94 115.70 1ag9 h PHE 70 Ca 0.00 0.06 0.12 0.00 2.80 0.00 0.00 57.97 60.95 1ag9 h PHE 70 Cb 1.00 0.21 -0.08 0.00 2.20 0.00 0.00 35.95 39.28 1ag9 h PHE 70 CO 0.00 -0.30 0.46 -1.35 -0.60 0.00 0.00 178.31 176.51 1ag9 h PRO 71 N 0.05 0.69 -0.49 1.51 0.11 -1.79 0.15 132.00 132.23 1ag9 h PRO 71 Ca 0.42 -0.04 -0.12 0.00 0.11 0.00 0.00 66.00 66.37 1ag9 h PRO 71 Cb 0.72 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 31.66 1ag9 h PRO 71 CO -0.75 0.46 -0.17 1.15 -0.21 0.00 0.00 178.00 178.48 1ag9 h THR 72 N 0.71 1.27 -0.31 -1.15 2.02 -1.33 -2.70 112.91 111.42 1ag9 h THR 72 Ca 0.43 -1.32 -0.01 0.00 0.77 0.00 0.00 66.41 66.27 1ag9 h THR 72 Cb 0.49 1.09 -0.02 0.00 -1.74 0.00 0.00 68.15 67.98 1ag9 h THR 72 CO -0.30 0.46 0.15 0.25 0.37 0.00 0.00 175.52 176.45 1ag9 h LEU 73 N 0.84 0.38 -0.34 2.58 5.85 0.38 -1.26 115.31 123.75 1ag9 h LEU 73 Ca 0.12 -0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.81 1ag9 h LEU 73 Cb 0.74 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 41.67 1ag9 h LEU 73 CO 0.06 0.33 0.00 -0.62 -0.34 0.00 0.00 178.44 177.87 1ag9 n GLU 74 N -4.43 0.12 -1.07 1.25 1.02 0.37 -2.45 120.64 115.44 1ag9 n GLU 74 Ca 0.02 0.31 -0.14 0.00 -0.02 0.00 0.00 57.16 57.32 1ag9 n GLU 74 Cb 0.11 -1.70 0.17 0.00 -0.02 0.00 0.00 31.44 30.00 1ag9 n GLU 74 CO 0.00 0.00 0.00 -0.85 1.18 0.00 0.00 177.13 177.46 1ag9 n GLU 75 N -1.92 2.15 -4.99 3.49 0.28 -0.47 -4.94 120.64 114.25 1ag9 n GLU 75 Ca 0.03 -3.22 -0.32 0.00 -0.16 0.00 0.00 57.16 53.49 1ag9 n GLU 75 Cb 0.23 -2.00 -0.15 0.00 1.43 0.00 0.00 31.44 30.95 1ag9 n GLU 75 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 177.13 177.39 1ag9 s ILE 76 N -3.51 2.65 -0.30 3.84 1.01 -1.03 -5.08 121.20 118.78 1ag9 s ILE 76 Ca 0.51 -0.83 -0.23 0.00 0.00 0.00 0.00 60.65 60.10 1ag9 s ILE 76 Cb 0.44 -2.05 -0.00 0.00 0.01 0.00 0.00 42.46 40.85 1ag9 s ILE 76 CO 0.03 0.55 0.76 -0.62 0.00 0.00 0.00 174.94 175.66 1ag9 s ASP 77 N 0.06 6.64 0.00 3.58 2.15 -1.26 -4.90 116.67 122.94 1ag9 s ASP 77 Ca -0.07 0.64 0.23 0.00 0.43 0.00 0.00 52.55 53.78 1ag9 s ASP 77 Cb -0.15 -2.39 0.53 0.00 -0.30 0.00 0.00 42.92 40.60 1ag9 s ASP 77 CO 0.05 -0.58 1.46 0.49 -0.17 0.00 0.00 175.17 176.42 1ag9 n PHE 78 N 6.12 0.68 -1.90 -5.34 3.72 -0.09 -4.91 117.46 115.74 1ag9 n PHE 78 Ca 0.03 -0.34 -0.42 0.00 -0.05 0.00 0.00 57.45 56.67 1ag9 n PHE 78 Cb 0.48 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.99 1ag9 n PHE 78 CO 0.00 0.00 0.00 -0.80 -0.05 0.00 0.00 176.76 175.91 1ag9 s ASN 79 N -1.29 6.57 0.00 4.37 0.01 -1.16 -1.27 114.94 122.17 1ag9 s ASN 79 Ca 0.42 2.60 0.00 0.00 -0.71 0.00 0.00 52.86 55.18 1ag9 s ASN 79 Cb 0.23 -2.58 0.00 0.00 0.41 0.00 0.00 41.25 39.31 1ag9 s ASN 79 CO 0.32 -0.86 0.00 0.61 -1.51 0.00 0.00 177.10 175.65 1ag9 n GLY 80 N 3.87 1.04 3.73 0.66 0.00 -1.26 -5.01 105.19 108.23 1ag9 n GLY 80 Ca 0.15 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.84 1ag9 n GLY 80 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ag9 s LYS 81 N -0.50 2.91 -0.11 1.61 1.02 -0.40 -4.94 119.74 119.33 1ag9 s LYS 81 Ca 0.00 -0.57 -0.04 0.00 0.02 0.00 0.00 55.97 55.39 1ag9 s LYS 81 Cb 0.00 -2.75 -0.03 0.00 -0.52 0.00 0.00 37.83 34.52 1ag9 s LYS 81 CO 0.00 0.63 0.02 -0.51 -0.92 0.00 0.00 175.35 174.57 1ag9 s LEU 82 N -1.71 3.66 0.01 3.17 1.43 0.23 -2.25 118.68 123.22 1ag9 s LEU 82 Ca 0.22 0.13 0.01 0.00 -1.03 0.00 0.00 54.13 53.46 1ag9 s LEU 82 Cb -0.12 -1.86 -0.01 0.00 0.03 0.00 0.00 46.19 44.23 1ag9 s LEU 82 CO 0.13 0.32 -0.05 -0.69 0.23 0.00 0.00 176.35 176.29 1ag9 s VAL 83 N -0.53 0.33 0.01 -1.59 1.01 -0.64 -1.21 120.40 117.78 1ag9 s VAL 83 Ca 0.09 -0.52 0.05 0.00 0.00 0.00 0.00 61.98 61.60 1ag9 s VAL 83 Cb -0.12 -0.35 -0.02 0.00 0.00 0.00 0.00 36.38 35.90 1ag9 s VAL 83 CO 0.02 -0.13 -0.14 0.00 0.00 0.00 0.00 175.10 174.85 1ag9 s ALA 84 N -0.64 1.16 0.04 5.51 0.00 -0.52 -1.32 121.76 125.99 1ag9 s ALA 84 Ca -0.04 -0.69 0.08 0.00 0.00 0.00 0.00 51.96 51.30 1ag9 s ALA 84 Cb -0.05 -0.24 -0.03 0.00 0.00 0.00 0.00 23.12 22.79 1ag9 s ALA 84 CO -0.00 0.26 -0.21 -0.51 0.00 0.00 0.00 175.76 175.30 1ag9 s LEU 85 N -0.67 2.48 0.05 0.00 1.43 -1.26 -0.59 118.68 120.12 1ag9 s LEU 85 Ca 0.04 -0.48 -0.11 0.00 -1.03 0.00 0.00 54.13 52.55 1ag9 s LEU 85 Cb -0.06 -1.45 0.01 0.00 0.03 0.00 0.00 46.19 44.72 1ag9 s LEU 85 CO 0.00 0.26 0.25 0.72 0.23 0.00 0.00 176.35 177.81 1ag9 s PHE 86 N -0.89 -0.02 -0.04 0.29 -0.71 -0.36 -1.11 117.98 115.15 1ag9 s PHE 86 Ca 0.14 -0.19 -0.31 0.00 -1.04 0.00 0.00 56.93 55.52 1ag9 s PHE 86 Cb -0.10 0.03 0.13 0.00 -1.21 0.00 0.00 43.02 41.87 1ag9 s PHE 86 CO 0.04 -0.48 1.33 0.20 -1.34 0.00 0.00 175.22 174.97 1ag9 s GLY 87 N -2.18 -0.44 0.28 1.99 0.00 -0.35 -0.40 107.32 106.21 1ag9 s GLY 87 Ca -0.04 0.77 0.10 0.00 0.00 0.00 0.00 44.72 45.55 1ag9 s GLY 87 CO -0.05 0.21 -0.03 0.00 0.00 0.00 0.00 173.10 173.23 1ag9 s GLY 89 N -3.65 -0.10 -0.31 0.00 0.00 -0.30 -2.60 107.32 100.36 1ag9 s GLY 89 Ca 0.32 -0.08 0.03 0.00 0.00 0.00 0.00 44.72 44.98 1ag9 s GLY 89 CO 0.19 0.47 0.01 -0.35 0.00 0.00 0.00 173.10 173.42 1ag9 s ASP 90 N -3.05 4.48 0.27 1.64 -1.08 -1.26 -4.22 116.67 113.45 1ag9 s ASP 90 Ca 0.14 -1.81 0.24 0.00 -0.52 0.00 0.00 52.55 50.60 1ag9 s ASP 90 Cb -0.02 -1.44 1.01 0.00 -1.46 0.00 0.00 42.92 41.00 1ag9 s ASP 90 CO 0.04 -0.33 1.71 0.00 0.52 0.00 0.00 175.17 177.11 1ag9 n GLN 91 N 4.43 0.19 -0.06 4.34 10.64 -1.26 -1.95 117.38 133.71 1ag9 n GLN 91 Ca -0.02 0.45 -0.04 0.00 -1.83 0.00 0.00 57.00 55.56 1ag9 n GLN 91 Cb 0.42 -1.89 -0.01 0.00 -0.86 0.00 0.00 30.24 27.90 1ag9 n GLN 91 CO 0.00 0.00 0.00 -1.91 -1.83 0.00 0.00 177.06 173.32 1ag9 n GLU 92 N -2.26 0.38 0.24 2.61 2.13 -1.26 -3.31 120.64 119.17 1ag9 n GLU 92 Ca 0.02 0.47 0.16 0.00 0.66 0.00 0.00 57.16 58.47 1ag9 n GLU 92 Cb 0.21 -1.53 0.67 0.00 0.27 0.00 0.00 31.44 31.06 1ag9 n GLU 92 CO 0.00 0.00 0.00 -0.44 -0.41 0.00 0.00 177.13 176.28 1ag9 h ASP 93 N -0.84 0.00 -0.97 4.31 3.32 -2.00 -3.24 116.42 117.00 1ag9 h ASP 93 Ca 0.00 0.00 -0.38 0.00 0.02 0.00 0.00 57.03 56.67 1ag9 h ASP 93 Cb 0.45 0.00 -0.40 0.00 0.22 0.00 0.00 39.33 39.59 1ag9 h ASP 93 CO 0.00 0.00 -1.09 -1.22 -1.72 0.00 0.00 179.24 175.21 1ag9 n TYR 94 N -2.83 1.62 0.30 4.55 4.01 -0.82 -4.93 117.16 119.07 1ag9 n TYR 94 Ca 0.01 -2.69 0.16 0.00 -0.16 0.00 0.00 57.90 55.22 1ag9 n TYR 94 Cb 0.26 -0.30 0.96 0.00 -0.31 0.00 0.00 39.34 39.95 1ag9 n TYR 94 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1ag9 h ALA 95 N 2.82 1.42 -0.02 -0.72 0.00 -1.58 -0.28 119.26 120.91 1ag9 h ALA 95 Ca -0.02 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1ag9 h ALA 95 Cb 1.17 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.96 1ag9 h ALA 95 CO 0.51 0.01 -0.13 0.39 0.00 0.00 0.00 179.25 180.03 1ag9 n GLU 96 N -3.71 1.51 -0.97 0.00 1.02 -1.26 0.12 120.64 117.35 1ag9 n GLU 96 Ca -0.03 -1.02 0.03 0.00 -0.02 0.00 0.00 57.16 56.12 1ag9 n GLU 96 Cb 0.09 -1.48 0.04 0.00 -0.02 0.00 0.00 31.44 30.07 1ag9 n GLU 96 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 1ag9 n TYR 97 N 0.15 0.00 -1.59 -0.32 4.01 -0.23 -4.48 117.16 114.69 1ag9 n TYR 97 Ca 0.15 -0.49 -0.44 0.00 -0.16 0.00 0.00 57.90 56.96 1ag9 n TYR 97 Cb 0.41 -0.13 -0.03 0.00 -0.31 0.00 0.00 39.34 39.28 1ag9 n TYR 97 CO 0.00 0.00 0.00 0.34 -0.46 0.00 0.00 176.86 176.74 1ag9 n PHE 98 N 0.01 1.95 -3.38 -0.72 7.35 -0.52 -2.53 117.46 119.62 1ag9 n PHE 98 Ca 0.06 -0.10 -0.25 0.00 -0.76 0.00 0.00 57.45 56.41 1ag9 n PHE 98 Cb 0.91 -2.71 0.03 0.00 0.35 0.00 0.00 39.48 38.06 1ag9 n PHE 98 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1ag9 h ASP 100 N -1.54 0.70 -0.06 0.00 5.19 -1.81 -2.67 116.42 116.23 1ag9 h ASP 100 Ca -0.51 -0.01 0.02 0.00 -0.62 0.00 0.00 57.03 55.91 1ag9 h ASP 100 Cb 1.34 -0.16 -0.00 0.00 0.18 0.00 0.00 39.33 40.70 1ag9 h ASP 100 CO 0.58 0.47 0.11 0.00 -3.12 0.00 0.00 179.24 177.28 1ag9 h ALA 101 N 1.60 1.43 -0.61 3.45 0.00 -1.85 -0.14 119.26 123.14 1ag9 h ALA 101 Ca 0.28 -0.00 -0.08 0.00 0.00 0.00 0.00 54.91 55.11 1ag9 h ALA 101 Cb 0.12 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 1ag9 h ALA 101 CO -0.08 -0.14 0.08 -0.07 0.00 0.00 0.00 179.25 179.04 1ag9 h LEU 102 N 0.00 0.99 -0.47 0.00 3.38 -1.74 -1.83 115.31 115.64 1ag9 h LEU 102 Ca 0.03 -0.27 -0.16 0.00 0.09 0.00 0.00 57.88 57.56 1ag9 h LEU 102 Cb 0.24 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.72 1ag9 h LEU 102 CO -0.00 1.01 -0.51 1.23 0.09 0.00 0.00 178.44 180.26 1ag9 h GLY 103 N 0.93 0.74 1.01 0.83 0.00 -1.12 -2.35 103.07 103.11 1ag9 h GLY 103 Ca 0.18 -0.84 -0.01 0.00 0.00 0.00 0.00 47.33 46.67 1ag9 h GLY 103 CO 0.02 0.75 0.41 -0.84 0.00 0.00 0.00 176.54 176.88 1ag9 h THR 104 N 0.53 1.22 0.00 4.70 2.02 -1.16 0.36 112.91 120.57 1ag9 h THR 104 Ca 0.02 -0.52 -0.21 0.00 0.77 0.00 0.00 66.41 66.47 1ag9 h THR 104 Cb 1.07 0.24 -0.01 0.00 -1.74 0.00 0.00 68.15 67.72 1ag9 h THR 104 CO 0.10 0.23 -0.90 -0.29 0.37 0.00 0.00 175.52 175.04 1ag9 h ILE 105 N 1.00 1.45 -0.56 3.11 2.10 -1.35 -3.02 117.51 120.24 1ag9 h ILE 105 Ca 0.26 -2.54 -0.06 0.00 1.08 0.00 0.00 64.86 63.61 1ag9 h ILE 105 Cb 0.01 2.44 -0.03 0.00 -1.09 0.00 0.00 36.82 38.16 1ag9 h ILE 105 CO -0.04 0.75 0.12 -0.09 -1.08 0.00 0.00 178.15 177.80 1ag9 h ARG 106 N 0.16 0.87 0.00 2.19 1.12 -1.06 -0.85 114.38 116.81 1ag9 h ARG 106 Ca -0.06 -0.19 -0.02 0.00 -1.11 0.00 0.00 59.98 58.61 1ag9 h ARG 106 Cb 1.53 -0.12 -0.00 0.00 -0.01 0.00 0.00 29.97 31.37 1ag9 h ARG 106 CO 0.15 0.79 -0.08 -0.44 -3.11 0.00 0.00 179.97 177.27 1ag9 h ASP 107 N 0.83 0.00 0.00 -3.80 3.32 -0.81 -1.16 116.42 114.80 1ag9 h ASP 107 Ca 0.18 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 57.18 1ag9 h ASP 107 Cb 0.32 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.87 1ag9 h ASP 107 CO 0.00 0.08 -0.42 0.40 -1.72 0.00 0.00 179.24 177.58 1ag9 h ILE 108 N 0.00 0.47 -0.22 0.35 2.04 -1.20 -3.40 117.51 115.54 1ag9 h ILE 108 Ca -0.00 -1.45 -0.19 0.00 1.00 0.00 0.00 64.86 64.22 1ag9 h ILE 108 Cb 0.32 0.98 0.00 0.00 -0.74 0.00 0.00 36.82 37.38 1ag9 h ILE 108 CO 0.01 0.16 -0.62 0.16 0.00 0.00 0.00 178.15 177.86 1ag9 h ILE 109 N -1.00 1.29 -0.45 -0.67 3.07 -1.14 -3.26 117.51 115.35 1ag9 h ILE 109 Ca -0.07 -1.83 0.00 0.00 1.55 0.00 0.00 64.86 64.51 1ag9 h ILE 109 Cb 0.59 1.77 -0.02 0.00 -0.27 0.00 0.00 36.82 38.89 1ag9 h ILE 109 CO -0.04 0.59 0.28 -0.08 -1.05 0.00 0.00 178.15 177.85 1ag9 h GLU 110 N 0.58 0.60 0.00 0.16 4.81 -1.45 -1.19 114.58 118.09 1ag9 h GLU 110 Ca -0.01 -0.05 -0.03 0.00 -0.13 0.00 0.00 59.36 59.14 1ag9 h GLU 110 Cb 1.23 -0.13 -0.00 0.00 0.63 0.00 0.00 28.75 30.47 1ag9 h GLU 110 CO 0.13 0.42 -0.15 -1.35 -0.73 0.00 0.00 179.01 177.34 1ag9 h PRO 111 N 0.60 0.00 -0.91 0.92 0.11 -1.77 -1.85 132.00 129.11 1ag9 h PRO 111 Ca 0.16 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 66.21 1ag9 h PRO 111 Cb -0.03 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 31.04 1ag9 h PRO 111 CO -0.03 0.15 0.08 0.54 -0.21 0.00 0.00 178.00 178.52 1ag9 n ARG 112 N -3.83 2.04 -0.62 1.05 1.74 -0.49 -4.88 116.66 111.66 1ag9 n ARG 112 Ca -0.02 -1.08 0.00 0.00 -0.77 0.00 0.00 57.85 55.98 1ag9 n ARG 112 Cb 0.24 -1.64 0.00 0.00 -1.02 0.00 0.00 32.46 30.04 1ag9 n ARG 112 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1ag9 n GLY 113 N 0.12 0.81 3.77 -0.13 0.00 -0.69 -0.92 105.19 108.14 1ag9 n GLY 113 Ca 0.14 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.76 1ag9 n GLY 113 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ag9 s ALA 114 N -3.24 3.30 -0.44 4.61 0.00 -0.95 -3.98 121.76 121.06 1ag9 s ALA 114 Ca 0.00 1.28 -0.13 0.00 0.00 0.00 0.00 51.96 53.10 1ag9 s ALA 114 Cb 0.00 -3.50 0.06 0.00 0.00 0.00 0.00 23.12 19.68 1ag9 s ALA 114 CO 0.00 -0.86 0.32 0.99 0.00 0.00 0.00 175.76 176.22 1ag9 s THR 115 N -1.24 4.91 -0.03 0.00 2.01 -0.95 -4.69 115.64 115.65 1ag9 s THR 115 Ca 0.56 -1.04 -0.22 0.00 0.31 0.00 0.00 61.69 61.30 1ag9 s THR 115 Cb -0.39 -3.89 -0.05 0.00 0.01 0.00 0.00 72.50 68.18 1ag9 s THR 115 CO 0.51 -0.47 0.63 -0.63 -0.69 0.00 0.00 174.62 173.97 1ag9 s ILE 116 N 1.59 4.96 0.31 1.82 1.01 -1.26 -1.62 121.20 128.00 1ag9 s ILE 116 Ca 0.04 1.31 0.06 0.00 0.00 0.00 0.00 60.65 62.06 1ag9 s ILE 116 Cb -0.22 -3.97 -0.06 0.00 0.01 0.00 0.00 42.46 38.21 1ag9 s ILE 116 CO 0.06 0.36 -0.02 0.68 0.00 0.00 0.00 174.94 176.02 1ag9 s VAL 117 N 0.19 1.57 0.00 2.92 -7.23 -0.43 -4.91 120.40 112.50 1ag9 s VAL 117 Ca 0.33 -2.08 0.00 0.00 -1.81 0.00 0.00 61.98 58.43 1ag9 s VAL 117 Cb -0.18 -2.62 0.00 0.00 0.56 0.00 0.00 36.38 34.15 1ag9 s VAL 117 CO 0.17 -0.18 0.00 0.61 -0.31 0.00 0.00 175.10 175.39 1ag9 n GLY 118 N -0.66 0.84 3.73 2.32 0.00 -1.26 -4.35 105.19 105.81 1ag9 n GLY 118 Ca -0.04 -0.43 -0.38 0.00 0.00 0.00 0.00 46.02 45.16 1ag9 n GLY 118 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1ag9 n HIS 119 N -2.37 2.14 -4.58 1.61 8.25 -1.25 -4.03 115.22 114.98 1ag9 n HIS 119 Ca 0.00 0.43 -0.23 0.00 -0.26 0.00 0.00 57.72 57.66 1ag9 n HIS 119 Cb 0.03 -2.33 -0.16 0.00 1.12 0.00 0.00 29.99 28.65 1ag9 n HIS 119 CO 0.00 0.00 0.00 -0.46 0.64 0.00 0.00 176.34 176.52 1ag9 s TRP 120 N -1.31 1.29 0.51 4.41 -0.11 -0.64 -4.91 118.94 118.17 1ag9 s TRP 120 Ca 0.73 -0.37 -0.23 0.00 1.22 0.00 0.00 56.10 57.46 1ag9 s TRP 120 Cb -0.42 -0.91 -0.06 0.00 -1.50 0.00 0.00 33.47 30.59 1ag9 s TRP 120 CO 0.48 -0.15 1.31 -2.14 -4.62 0.00 0.00 176.95 171.83 1ag9 s PRO 121 N 0.21 3.40 0.00 5.86 0.02 -1.26 0.10 135.00 143.33 1ag9 s PRO 121 Ca -0.05 2.13 0.28 0.00 0.02 0.00 0.00 61.00 63.38 1ag9 s PRO 121 Cb -0.11 -2.36 1.08 0.00 0.02 0.00 0.00 34.50 33.13 1ag9 s PRO 121 CO 0.01 -0.95 1.79 0.25 -0.33 0.00 0.00 177.00 177.77 1ag9 n THR 122 N -0.74 0.00 -1.69 0.99 -2.24 -0.78 -4.71 114.28 105.10 1ag9 n THR 122 Ca 0.09 -0.02 -0.44 0.00 -2.27 0.00 0.00 64.05 61.41 1ag9 n THR 122 Cb 0.45 -0.18 -0.03 0.00 -2.10 0.00 0.00 70.33 68.48 1ag9 n THR 122 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ag9 n ALA 123 N -1.30 1.70 0.00 6.98 0.00 -1.26 -1.43 120.51 125.20 1ag9 n ALA 123 Ca 0.10 0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.94 1ag9 n ALA 123 Cb 0.31 -2.36 0.00 0.00 0.00 0.00 0.00 19.45 17.40 1ag9 n ALA 123 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ag9 n GLY 124 N 2.57 0.97 3.78 0.00 0.00 -1.26 -5.04 105.19 106.21 1ag9 n GLY 124 Ca 0.12 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.82 1ag9 n GLY 124 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1ag9 s TYR 125 N -2.26 3.25 -0.34 1.61 1.51 -0.51 -5.09 117.35 115.53 1ag9 s TYR 125 Ca 0.00 0.16 0.00 0.00 -1.01 0.00 0.00 57.07 56.22 1ag9 s TYR 125 Cb 0.00 -1.69 0.11 0.00 -0.11 0.00 0.00 41.96 40.27 1ag9 s TYR 125 CO 0.00 0.54 0.13 -3.38 -1.11 0.00 0.00 175.55 171.72 1ag9 s HIS 126 N -1.28 1.90 0.26 2.71 -3.43 -1.26 -5.06 115.29 109.13 1ag9 s HIS 126 Ca 0.26 -1.98 0.02 0.00 -0.80 0.00 0.00 55.06 52.57 1ag9 s HIS 126 Cb -0.12 -1.83 -0.04 0.00 -1.43 0.00 0.00 32.58 29.16 1ag9 s HIS 126 CO 0.18 -0.86 0.18 -0.59 -2.00 0.00 0.00 174.74 171.65 1ag9 s PHE 127 N 1.29 1.43 -0.18 0.38 -0.71 -1.26 -4.65 117.98 114.27 1ag9 s PHE 127 Ca 0.12 -1.47 0.14 0.00 -1.04 0.00 0.00 56.93 54.68 1ag9 s PHE 127 Cb -0.19 -0.67 -0.21 0.00 -1.21 0.00 0.00 43.02 40.74 1ag9 s PHE 127 CO -0.18 -0.69 0.03 0.39 -1.34 0.00 0.00 175.22 173.43 1ag9 n GLU 128 N -0.44 1.02 -3.53 1.99 1.02 0.12 -5.02 120.64 115.80 1ag9 n GLU 128 Ca 0.04 0.01 -0.17 0.00 -0.02 0.00 0.00 57.16 57.01 1ag9 n GLU 128 Cb 0.65 -1.46 -0.06 0.00 -0.02 0.00 0.00 31.44 30.55 1ag9 n GLU 128 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1ag9 s ALA 129 N -2.44 -1.79 -0.18 0.62 0.00 0.45 -4.93 121.76 113.49 1ag9 s ALA 129 Ca -0.12 1.35 -0.13 0.00 0.00 0.00 0.00 51.96 53.06 1ag9 s ALA 129 Cb 0.06 -0.09 0.05 0.00 0.00 0.00 0.00 23.12 23.14 1ag9 s ALA 129 CO 0.70 -0.36 0.47 0.45 0.00 0.00 0.00 175.76 177.02 1ag9 s SER 130 N -1.17 -0.54 0.00 0.00 0.15 -1.26 -2.37 113.70 108.51 1ag9 s SER 130 Ca -0.10 0.98 0.28 0.00 0.70 0.00 0.00 55.95 57.81 1ag9 s SER 130 Cb -0.00 0.92 1.11 0.00 -1.71 0.00 0.00 66.02 66.35 1ag9 s SER 130 CO 0.09 -0.18 1.78 0.29 1.20 0.00 0.00 173.24 176.42 1ag9 n LYS 131 N 3.53 1.16 -0.50 5.44 4.76 -1.26 -4.02 118.16 127.27 1ag9 n LYS 131 Ca -0.18 -0.57 0.00 0.00 -2.87 0.00 0.00 58.31 54.69 1ag9 n LYS 131 Cb 0.56 -1.49 0.18 0.00 -1.84 0.00 0.00 35.03 32.45 1ag9 n LYS 131 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1ag9 n GLY 132 N 1.22 2.49 3.82 0.72 0.00 -1.25 -3.75 105.19 108.44 1ag9 n GLY 132 Ca 0.17 -0.49 -0.36 0.00 0.00 0.00 0.00 46.02 45.34 1ag9 n GLY 132 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ag9 s LEU 133 N -1.48 4.32 -0.12 0.99 1.43 -1.26 0.06 118.68 122.63 1ag9 s LEU 133 Ca 0.28 1.33 0.18 0.00 -1.03 0.00 0.00 54.13 54.89 1ag9 s LEU 133 Cb 0.22 -3.54 -0.25 0.00 0.03 0.00 0.00 46.19 42.64 1ag9 s LEU 133 CO 0.08 0.03 0.30 0.00 0.23 0.00 0.00 176.35 176.99 1ag9 n ALA 134 N 0.67 1.84 -3.53 4.21 0.00 0.11 -4.53 120.51 119.27 1ag9 n ALA 134 Ca -0.03 -1.02 0.04 0.00 0.00 0.00 0.00 53.44 52.44 1ag9 n ALA 134 Cb 0.51 -0.45 0.01 0.00 0.00 0.00 0.00 19.45 19.53 1ag9 n ALA 134 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1ag9 n ASP 135 N -2.68 -1.08 -0.35 0.00 5.68 -1.14 -4.99 116.55 111.99 1ag9 n ASP 135 Ca -0.23 -1.59 0.23 0.00 -0.50 0.00 0.00 54.79 52.70 1ag9 n ASP 135 Cb 0.98 1.76 0.47 0.00 -1.14 0.00 0.00 41.12 43.19 1ag9 n ASP 135 CO 0.00 0.00 0.00 0.44 -1.33 0.00 0.00 177.20 176.31 1ag9 h ASP 136 N 1.19 0.53 -0.15 -1.12 3.32 -2.02 -2.92 116.42 115.25 1ag9 h ASP 136 Ca -0.17 0.14 -0.16 0.00 0.02 0.00 0.00 57.03 56.86 1ag9 h ASP 136 Cb 0.73 0.07 -0.24 0.00 0.22 0.00 0.00 39.33 40.11 1ag9 h ASP 136 CO 0.22 -0.01 -0.80 -0.90 -1.72 0.00 0.00 179.24 176.04 1ag9 n ASP 137 N -4.87 1.88 -3.73 6.45 5.68 -1.26 -4.99 116.55 115.70 1ag9 n ASP 137 Ca 0.29 -3.02 -0.12 0.00 -0.50 0.00 0.00 54.79 51.44 1ag9 n ASP 137 Cb 0.92 -0.42 -0.13 0.00 -1.14 0.00 0.00 41.12 40.35 1ag9 n ASP 137 CO 0.00 0.00 0.00 -1.00 -1.33 0.00 0.00 177.20 174.87 1ag9 s HIS 138 N -2.23 -0.33 0.68 2.11 3.76 -1.10 -1.87 115.29 116.31 1ag9 s HIS 138 Ca 0.37 0.79 -0.11 0.00 -0.15 0.00 0.00 55.06 55.96 1ag9 s HIS 138 Cb 0.38 0.05 -0.00 0.00 1.11 0.00 0.00 32.58 34.12 1ag9 s HIS 138 CO -0.09 -0.23 1.05 -0.06 -0.85 0.00 0.00 174.74 174.57 1ag9 s PHE 139 N 1.19 3.20 -0.57 1.40 0.08 0.29 0.10 117.98 123.66 1ag9 s PHE 139 Ca -0.09 1.40 0.26 0.00 0.12 0.00 0.00 56.93 58.62 1ag9 s PHE 139 Cb -0.10 -2.85 0.78 0.00 -0.57 0.00 0.00 43.02 40.28 1ag9 s PHE 139 CO -0.08 -1.14 1.75 -0.24 -0.10 0.00 0.00 175.22 175.41 1ag9 h VAL 140 N -0.63 0.00 -3.64 -0.44 3.04 -0.61 -1.70 116.25 112.27 1ag9 h VAL 140 Ca -0.44 -0.55 -0.20 0.00 -1.01 0.00 0.00 66.70 64.50 1ag9 h VAL 140 Cb 1.21 1.51 -0.04 0.00 -2.01 0.00 0.00 31.29 31.95 1ag9 h VAL 140 CO 0.58 0.00 -0.04 0.61 -1.01 0.00 0.00 177.57 177.71 1ag9 n GLY 141 N 0.97 1.88 3.69 3.17 0.00 -1.26 -3.97 105.19 109.67 1ag9 n GLY 141 Ca 0.04 -1.51 -0.42 0.00 0.00 0.00 0.00 46.02 44.13 1ag9 n GLY 141 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1ag9 s LEU 142 N 0.00 4.32 -0.21 0.99 2.96 -0.26 -4.25 118.68 122.23 1ag9 s LEU 142 Ca 0.24 2.15 -0.07 0.00 -0.22 0.00 0.00 54.13 56.23 1ag9 s LEU 142 Cb -0.02 -3.56 -0.03 0.00 0.50 0.00 0.00 46.19 43.08 1ag9 s LEU 142 CO 0.17 -0.72 0.05 0.00 -1.32 0.00 0.00 176.35 174.53 1ag9 s ALA 143 N 2.33 3.21 -0.06 5.97 0.00 -1.26 -1.21 121.76 130.74 1ag9 s ALA 143 Ca 0.64 -0.95 0.05 0.00 0.00 0.00 0.00 51.96 51.70 1ag9 s ALA 143 Cb -0.32 -1.94 -0.02 0.00 0.00 0.00 0.00 23.12 20.84 1ag9 s ALA 143 CO 0.27 -0.15 -0.21 0.42 0.00 0.00 0.00 175.76 176.09 1ag9 s ILE 144 N 1.00 2.45 -0.35 0.00 -1.09 0.24 -4.98 121.20 118.47 1ag9 s ILE 144 Ca 0.03 -0.93 0.02 0.00 -2.23 0.00 0.00 60.65 57.54 1ag9 s ILE 144 Cb -0.14 -1.93 0.10 0.00 -1.58 0.00 0.00 42.46 38.92 1ag9 s ILE 144 CO 0.03 0.57 0.10 -0.62 -1.23 0.00 0.00 174.94 173.79 1ag9 s ASP 145 N -0.31 4.31 0.24 3.58 -1.08 -1.26 -1.15 116.67 121.00 1ag9 s ASP 145 Ca 0.01 -2.02 0.25 0.00 -0.52 0.00 0.00 52.55 50.28 1ag9 s ASP 145 Cb -0.13 -1.23 0.68 0.00 -1.46 0.00 0.00 42.92 40.78 1ag9 s ASP 145 CO 0.02 -0.38 1.70 -0.33 0.52 0.00 0.00 175.17 176.71 1ag9 h GLU 146 N 7.68 0.00 0.13 4.34 4.39 -1.85 -0.94 114.58 128.33 1ag9 h GLU 146 Ca -0.08 0.00 -0.28 0.00 0.34 0.00 0.00 59.36 59.34 1ag9 h GLU 146 Cb 1.00 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.65 1ag9 h GLU 146 CO 0.50 0.00 -1.40 -0.44 -1.16 0.00 0.00 179.01 176.51 1ag9 h ASP 147 N 0.00 0.42 0.00 1.42 3.32 -1.93 -3.36 116.42 116.29 1ag9 h ASP 147 Ca 0.00 -0.87 -0.09 0.00 0.02 0.00 0.00 57.03 56.09 1ag9 h ASP 147 Cb 0.79 -0.14 -0.02 0.00 0.22 0.00 0.00 39.33 40.19 1ag9 h ASP 147 CO 0.00 1.62 -1.70 0.54 -1.72 0.00 0.00 179.24 177.98 1ag9 n ARG 148 N -3.90 1.02 -2.65 3.56 5.12 -1.25 -4.75 116.66 113.81 1ag9 n ARG 148 Ca -0.24 -0.08 -0.10 0.00 -1.93 0.00 0.00 57.85 55.50 1ag9 n ARG 148 Cb 0.91 -1.32 0.03 0.00 -1.16 0.00 0.00 32.46 30.93 1ag9 n ARG 148 CO 0.00 0.00 0.00 1.04 -1.93 0.00 0.00 177.63 176.74 1ag9 n GLN 149 N -2.15 1.52 0.30 5.56 6.02 -0.39 -4.89 117.38 123.34 1ag9 n GLN 149 Ca -0.09 -3.44 0.18 0.00 -0.01 0.00 0.00 57.00 53.63 1ag9 n GLN 149 Cb 0.56 -1.42 0.91 0.00 1.02 0.00 0.00 30.24 31.31 1ag9 n GLN 149 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 177.06 175.05 1ag9 h PRO 150 N 2.89 0.00 0.00 -1.09 0.13 -1.61 -1.29 132.00 131.03 1ag9 h PRO 150 Ca -0.05 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.08 1ag9 h PRO 150 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 1ag9 h PRO 150 CO 0.50 0.04 0.00 -0.85 -0.23 0.00 0.00 178.00 177.46 1ag9 n GLU 151 N -3.30 0.18 -0.00 0.86 0.00 -1.26 -2.81 120.64 114.31 1ag9 n GLU 151 Ca -0.02 0.12 0.07 0.00 0.00 0.00 0.00 57.16 57.33 1ag9 n GLU 151 Cb 0.19 -1.50 -0.09 0.00 0.00 0.00 0.00 31.44 30.04 1ag9 n GLU 151 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.13 178.41 1ag9 n LEU 152 N -1.37 0.50 -0.12 -1.84 4.77 -0.49 -4.68 117.00 113.78 1ag9 n LEU 152 Ca 0.08 -0.37 -0.05 0.00 -0.03 0.00 0.00 56.01 55.63 1ag9 n LEU 152 Cb 0.19 0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.31 1ag9 n LEU 152 CO 0.17 0.12 0.93 0.74 -1.33 0.00 0.00 177.39 178.02 1ag9 h THR 153 N 0.00 0.86 -0.08 -5.08 2.02 -1.55 -0.75 112.91 108.33 1ag9 h THR 153 Ca 0.00 -0.09 0.04 0.00 0.77 0.00 0.00 66.41 67.12 1ag9 h THR 153 Cb 0.42 0.57 -0.04 0.00 -1.74 0.00 0.00 68.15 67.36 1ag9 h THR 153 CO 0.00 0.05 -0.17 0.00 0.37 0.00 0.00 175.52 175.77 1ag9 h ALA 154 N 1.27 -0.14 -0.28 6.16 0.00 -1.83 -1.32 119.26 123.12 1ag9 h ALA 154 Ca 0.18 0.03 -0.15 0.00 0.00 0.00 0.00 54.91 54.98 1ag9 h ALA 154 Cb 0.18 0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 1ag9 h ALA 154 CO -0.20 -0.64 -0.42 1.05 0.00 0.00 0.00 179.25 179.04 1ag9 h GLU 155 N -0.24 0.68 -0.11 0.00 4.11 -1.84 -2.34 114.58 114.85 1ag9 h GLU 155 Ca 0.08 -0.36 0.00 0.00 0.07 0.00 0.00 59.36 59.15 1ag9 h GLU 155 Cb 0.35 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.61 1ag9 h GLU 155 CO -0.22 0.97 0.07 0.00 0.07 0.00 0.00 179.01 179.91 1ag9 h ARG 156 N 0.56 0.15 -0.21 1.06 3.08 -0.92 -1.08 114.38 117.01 1ag9 h ARG 156 Ca 0.04 -0.01 -0.01 0.00 0.07 0.00 0.00 59.98 60.07 1ag9 h ARG 156 Cb 0.96 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.97 1ag9 h ARG 156 CO 0.09 0.11 0.10 0.28 -1.07 0.00 0.00 179.97 179.48 1ag9 h VAL 157 N 0.14 1.13 -0.37 2.04 2.07 -1.24 -0.37 116.25 119.65 1ag9 h VAL 157 Ca 0.04 -0.39 0.02 0.00 0.82 0.00 0.00 66.70 67.19 1ag9 h VAL 157 Cb -0.00 1.01 -0.03 0.00 -1.52 0.00 0.00 31.29 30.75 1ag9 h VAL 157 CO -0.01 0.13 0.21 -0.08 0.02 0.00 0.00 177.57 177.84 1ag9 h GLU 158 N 0.20 0.42 -0.57 1.57 4.81 -1.30 -0.28 114.58 119.44 1ag9 h GLU 158 Ca 0.07 -0.03 -0.09 0.00 -0.13 0.00 0.00 59.36 59.19 1ag9 h GLU 158 Cb 0.12 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 29.38 1ag9 h GLU 158 CO -0.01 0.28 0.01 -0.22 -0.73 0.00 0.00 179.01 178.34 1ag9 h LYS 159 N 0.43 0.99 -0.59 1.92 3.11 -1.07 -2.00 116.57 119.37 1ag9 h LYS 159 Ca 0.15 -0.31 -0.10 0.00 -2.81 0.00 0.00 60.65 57.58 1ag9 h LYS 159 Cb 0.02 -0.09 -0.02 0.00 -1.00 0.00 0.00 32.23 31.13 1ag9 h LYS 159 CO -0.08 0.98 -0.04 2.35 -2.81 0.00 0.00 179.45 179.86 1ag9 h TRP 160 N 0.88 1.17 -0.50 1.91 7.01 -0.78 -0.37 115.95 125.27 1ag9 h TRP 160 Ca 0.16 -0.22 -0.05 0.00 2.11 0.00 0.00 58.89 60.90 1ag9 h TRP 160 Cb 0.53 -0.30 -0.02 0.00 -2.10 0.00 0.00 29.16 27.27 1ag9 h TRP 160 CO 0.04 1.04 0.13 0.28 -2.79 0.00 0.00 178.44 177.14 1ag9 h VAL 161 N 0.96 1.24 -0.74 2.65 2.07 -0.97 -0.34 116.25 121.12 1ag9 h VAL 161 Ca 0.16 -0.83 -0.00 0.00 0.82 0.00 0.00 66.70 66.85 1ag9 h VAL 161 Cb 0.60 0.82 -0.04 0.00 -1.52 0.00 0.00 31.29 31.16 1ag9 h VAL 161 CO 0.04 0.30 0.45 0.11 0.02 0.00 0.00 177.57 178.49 1ag9 h LYS 162 N 0.69 1.01 0.68 1.57 1.57 -1.19 -1.52 116.57 119.37 1ag9 h LYS 162 Ca 0.16 -0.09 -0.03 0.00 -1.87 0.00 0.00 60.65 58.81 1ag9 h LYS 162 Cb 0.32 -0.21 0.01 0.00 0.08 0.00 0.00 32.23 32.43 1ag9 h LYS 162 CO 0.00 0.71 -0.33 0.37 -0.57 0.00 0.00 179.45 179.64 1ag9 h GLN 163 N 1.01 -0.88 0.00 3.15 4.15 -0.63 -2.74 115.11 119.17 1ag9 h GLN 163 Ca 0.27 0.06 -0.01 0.00 0.77 0.00 0.00 58.65 59.73 1ag9 h GLN 163 Cb -0.03 0.20 -0.00 0.00 0.21 0.00 0.00 27.48 27.85 1ag9 h GLN 163 CO -0.05 -0.56 -0.06 -0.84 -1.93 0.00 0.00 178.83 175.39 1ag9 h ILE 164 N -1.01 0.76 -0.68 2.39 3.07 -1.03 -0.57 117.51 120.43 1ag9 h ILE 164 Ca -0.09 -0.24 -0.04 0.00 1.55 0.00 0.00 64.86 66.04 1ag9 h ILE 164 Cb 0.72 1.14 -0.03 0.00 -0.27 0.00 0.00 36.82 38.38 1ag9 h ILE 164 CO 0.15 0.06 0.28 0.28 -1.05 0.00 0.00 178.15 177.87 1ag9 h SER 165 N 0.00 0.93 -0.05 2.16 0.02 -1.14 0.35 113.55 115.83 1ag9 h SER 165 Ca -0.00 -0.17 -0.02 0.00 -0.84 0.00 0.00 61.79 60.77 1ag9 h SER 165 Cb 0.13 -0.24 -0.00 0.00 0.14 0.00 0.00 62.40 62.43 1ag9 h SER 165 CO 0.01 0.85 -0.03 -0.33 -1.14 0.00 0.00 176.83 176.18 1ag9 h GLU 166 N 0.97 0.11 -0.91 3.45 5.08 -0.99 -0.87 114.58 121.41 1ag9 h GLU 166 Ca 0.23 -0.05 0.02 0.00 -1.00 0.00 0.00 59.36 58.55 1ag9 h GLU 166 Cb 0.20 -0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.40 1ag9 h GLU 166 CO -0.02 0.53 0.60 0.93 -1.00 0.00 0.00 179.01 180.05 1ag9 h GLU 167 N -0.31 1.16 0.00 2.33 5.08 -0.93 -1.51 114.58 120.40 1ag9 h GLU 167 Ca 0.01 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 1ag9 h GLU 167 Cb 0.50 -0.26 0.00 0.00 0.50 0.00 0.00 28.75 29.49 1ag9 h GLU 167 CO 0.01 0.77 0.00 -0.07 -1.00 0.00 0.00 179.01 178.72 1ag9 h LEU 168 N 1.20 0.00 -1.52 1.33 3.38 -0.32 -3.48 115.31 115.91 1ag9 h LEU 168 Ca 0.34 0.00 -0.27 0.00 0.09 0.00 0.00 57.88 58.05 1ag9 h LEU 168 Cb -0.09 0.00 0.12 0.00 0.09 0.00 0.00 40.66 40.79 1ag9 h LEU 168 CO -0.09 0.00 -0.57 1.41 0.09 0.00 0.00 178.44 179.28 1ag9 n HIS 169 N -2.75 -1.81 0.25 1.13 8.25 -0.43 -4.82 115.22 115.04 1ag9 n HIS 169 Ca 0.04 0.74 0.10 0.00 -0.26 0.00 0.00 57.72 58.33 1ag9 n HIS 169 Cb 0.44 -4.30 0.65 0.00 1.12 0.00 0.00 29.99 27.90 1ag9 n HIS 169 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 1ag9 h LEU 170 N -1.61 0.00 -1.65 2.41 3.38 -1.57 0.67 115.31 116.94 1ag9 h LEU 170 Ca -0.45 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.51 1ag9 h LEU 170 Cb 1.27 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.00 1ag9 h LEU 170 CO 0.39 0.14 0.07 0.44 0.09 0.00 0.00 178.44 179.57 1ag9 h ASP 171 N 0.00 0.26 0.00 -0.43 3.32 -1.91 -3.20 116.42 114.45 1ag9 h ASP 171 Ca -0.00 -0.02 -0.42 0.00 0.02 0.00 0.00 57.03 56.61 1ag9 h ASP 171 Cb 0.32 -0.07 -0.06 0.00 0.22 0.00 0.00 39.33 39.74 1ag9 h ASP 171 CO 0.02 0.26 -2.31 -0.62 -1.72 0.00 0.00 179.24 174.86 1ag9 n GLU 172 N -4.43 0.58 -0.18 3.56 4.71 -0.77 -4.32 120.64 119.80 1ag9 n GLU 172 Ca 0.00 0.30 0.29 0.00 -0.01 0.00 0.00 57.16 57.74 1ag9 n GLU 172 Cb 0.13 -1.52 0.62 0.00 -1.01 0.00 0.00 31.44 29.66 1ag9 n GLU 172 CO 0.00 0.00 0.00 0.97 0.09 0.00 0.00 177.13 178.19 1ag9 h ILE 173 N -1.00 0.18 0.06 -3.67 2.10 -0.97 -1.51 117.51 112.70 1ag9 h ILE 173 Ca -0.63 0.00 -0.35 0.00 1.08 0.00 0.00 64.86 64.96 1ag9 h ILE 173 Cb 1.55 0.27 -0.04 0.00 -1.09 0.00 0.00 36.82 37.51 1ag9 h ILE 173 CO -0.38 0.00 -2.00 0.18 -1.08 0.00 0.00 178.15 174.87 1ag9 n LEU 174 N -3.59 1.95 -2.58 2.19 4.77 -1.21 -4.86 117.00 113.66 1ag9 n LEU 174 Ca 0.20 0.21 -0.04 0.00 -0.03 0.00 0.00 56.01 56.35 1ag9 n LEU 174 Cb 1.24 -0.58 0.04 0.00 -2.33 0.00 0.00 43.42 41.79 1ag9 n LEU 174 CO 0.29 0.70 0.56 -0.46 -1.33 0.00 0.00 177.39 177.15 1ag9 n ASN 175 N -3.27 -1.31 0.00 -1.43 0.23 -0.82 -5.17 115.26 103.50 1ag9 n ASN 175 Ca -0.29 -1.89 0.00 0.00 -0.53 0.00 0.00 54.58 51.87 1ag9 n ASN 175 Cb 1.05 0.91 0.00 0.00 -2.08 0.00 0.00 39.78 39.66 1ag9 n ASN 175 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33