#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rg9 s LYS 2 N 0.00 4.00 -0.12 0.00 1.02 -1.25 -2.43 119.74 120.95 1rg9 s LYS 2 Ca 0.00 0.52 -0.31 0.00 0.02 0.00 0.00 55.97 56.19 1rg9 s LYS 2 Cb 0.00 -2.93 0.13 0.00 -0.52 0.00 0.00 37.83 34.51 1rg9 s LYS 2 CO 0.00 0.47 1.06 -3.38 -0.92 0.00 0.00 175.35 172.58 1rg9 s HIS 3 N -1.46 -0.25 -0.12 3.18 -3.43 0.82 -4.97 115.29 109.06 1rg9 s HIS 3 Ca 0.38 0.24 -0.02 0.00 -0.80 0.00 0.00 55.06 54.86 1rg9 s HIS 3 Cb -0.15 0.51 -0.03 0.00 -1.43 0.00 0.00 32.58 31.48 1rg9 s HIS 3 CO 0.19 -0.34 -0.06 -0.51 -2.00 0.00 0.00 174.74 172.02 1rg9 s LEU 4 N -2.00 3.18 -0.08 5.38 1.43 -1.26 -0.65 118.68 124.68 1rg9 s LEU 4 Ca 0.05 -0.10 0.03 0.00 -1.03 0.00 0.00 54.13 53.08 1rg9 s LEU 4 Cb -0.01 -1.73 0.01 0.00 0.03 0.00 0.00 46.19 44.49 1rg9 s LEU 4 CO -0.05 0.24 -0.17 0.12 0.23 0.00 0.00 176.35 176.72 1rg9 s PHE 5 N -0.09 1.92 -0.05 0.29 2.19 -1.11 -5.00 117.98 116.13 1rg9 s PHE 5 Ca 0.01 -0.77 0.05 0.00 0.33 0.00 0.00 56.93 56.55 1rg9 s PHE 5 Cb -0.13 -1.35 -0.02 0.00 -1.31 0.00 0.00 43.02 40.21 1rg9 s PHE 5 CO 0.03 -0.36 -0.20 0.99 1.83 0.00 0.00 175.22 177.51 1rg9 s THR 6 N 0.60 2.56 0.29 0.12 2.01 -1.26 -1.37 115.64 118.58 1rg9 s THR 6 Ca -0.15 -0.90 0.02 0.00 0.31 0.00 0.00 61.69 60.97 1rg9 s THR 6 Cb -0.16 -1.96 -0.05 0.00 0.01 0.00 0.00 72.50 70.33 1rg9 s THR 6 CO 0.05 0.58 0.08 -0.44 -0.69 0.00 0.00 174.62 174.20 1rg9 s SER 7 N -0.49 1.71 0.13 3.53 0.01 -0.84 -4.90 113.70 112.86 1rg9 s SER 7 Ca 0.06 -1.40 -0.13 0.00 1.31 0.00 0.00 55.95 55.79 1rg9 s SER 7 Cb -0.12 0.08 0.02 0.00 0.21 0.00 0.00 66.02 66.22 1rg9 s SER 7 CO 0.01 -0.69 0.34 -1.83 0.41 0.00 0.00 173.24 171.47 1rg9 s GLU 8 N -3.96 1.05 0.16 12.44 -1.05 -1.26 -2.36 118.70 123.71 1rg9 s GLU 8 Ca 0.37 -0.86 -0.08 0.00 -0.15 0.00 0.00 54.97 54.25 1rg9 s GLU 8 Cb 0.08 0.43 -0.01 0.00 -0.44 0.00 0.00 34.13 34.18 1rg9 s GLU 8 CO 0.15 -0.39 0.25 0.45 0.95 0.00 0.00 175.26 176.66 1rg9 s SER 9 N -2.85 0.08 0.03 0.83 0.15 0.45 -4.67 113.70 107.72 1rg9 s SER 9 Ca 0.06 -0.94 0.03 0.00 0.70 0.00 0.00 55.95 55.81 1rg9 s SER 9 Cb 0.03 0.42 -0.02 0.00 -1.71 0.00 0.00 66.02 64.73 1rg9 s SER 9 CO -0.09 -0.87 -0.10 0.68 1.20 0.00 0.00 173.24 174.06 1rg9 s VAL 10 N -3.99 0.75 0.95 4.45 -7.23 -1.26 -0.47 120.40 113.60 1rg9 s VAL 10 Ca 0.19 -0.85 -0.12 0.00 -1.81 0.00 0.00 61.98 59.39 1rg9 s VAL 10 Cb 0.04 -0.72 0.16 0.00 0.56 0.00 0.00 36.38 36.42 1rg9 s VAL 10 CO 0.01 -0.11 1.09 -0.94 -0.31 0.00 0.00 175.10 174.84 1rg9 s SER 11 N -1.07 2.95 0.01 4.85 1.04 0.11 -4.61 113.70 116.98 1rg9 s SER 11 Ca -0.02 1.47 0.14 0.00 0.48 0.00 0.00 55.95 58.01 1rg9 s SER 11 Cb -0.07 -2.14 0.61 0.00 0.10 0.00 0.00 66.02 64.51 1rg9 s SER 11 CO 0.01 -2.97 1.45 -1.84 0.98 0.00 0.00 173.24 170.87 1rg9 n GLU 12 N -4.10 0.01 -0.04 4.02 0.28 -1.26 -1.70 120.64 117.85 1rg9 n GLU 12 Ca 0.06 0.27 0.12 0.00 -0.16 0.00 0.00 57.16 57.46 1rg9 n GLU 12 Cb 0.55 -1.52 0.42 0.00 1.43 0.00 0.00 31.44 32.32 1rg9 n GLU 12 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1rg9 n GLY 13 N -0.08 0.29 3.72 -1.84 0.00 -1.24 -4.29 105.19 101.75 1rg9 n GLY 13 Ca 0.03 -0.47 -0.42 0.00 0.00 0.00 0.00 46.02 45.16 1rg9 n GLY 13 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1rg9 s HIS 14 N -1.89 3.58 0.17 1.61 5.04 -0.69 -3.72 115.29 119.39 1rg9 s HIS 14 Ca 0.35 1.54 -0.23 0.00 -1.54 0.00 0.00 55.06 55.19 1rg9 s HIS 14 Cb 0.20 -3.25 0.05 0.00 0.04 0.00 0.00 32.58 29.62 1rg9 s HIS 14 CO 0.30 -0.56 1.38 -2.30 -2.34 0.00 0.00 174.74 171.22 1rg9 n PRO 15 N 3.57 -0.32 -0.08 2.88 -0.02 -1.26 -0.28 135.00 139.48 1rg9 n PRO 15 Ca 0.06 1.36 -0.06 0.00 -2.02 0.00 0.00 63.50 62.84 1rg9 n PRO 15 Cb 0.48 -2.01 -0.00 0.00 -0.02 0.00 0.00 33.50 31.95 1rg9 n PRO 15 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 1rg9 h ASP 16 N 0.00 -0.28 -0.60 2.55 3.32 -1.80 -1.15 116.42 118.44 1rg9 h ASP 16 Ca 0.21 0.09 -0.01 0.00 0.02 0.00 0.00 57.03 57.35 1rg9 h ASP 16 Cb 0.43 0.19 -0.03 0.00 0.22 0.00 0.00 39.33 40.14 1rg9 h ASP 16 CO -0.86 -0.10 0.35 0.11 -1.72 0.00 0.00 179.24 177.03 1rg9 h LYS 17 N 0.00 0.84 -0.52 3.56 1.79 -0.92 -1.55 116.57 119.77 1rg9 h LYS 17 Ca 0.15 -0.08 0.07 0.00 -2.18 0.00 0.00 60.65 58.61 1rg9 h LYS 17 Cb 0.23 -0.18 -0.06 0.00 -1.58 0.00 0.00 32.23 30.64 1rg9 h LYS 17 CO -0.32 0.61 0.20 0.82 -1.08 0.00 0.00 179.45 179.68 1rg9 h ILE 18 N 0.85 0.84 0.29 1.86 2.04 0.38 0.11 117.51 123.88 1rg9 h ILE 18 Ca 0.22 -0.13 -0.01 0.00 1.00 0.00 0.00 64.86 65.94 1rg9 h ILE 18 Cb -0.00 0.42 -0.02 0.00 -0.74 0.00 0.00 36.82 36.48 1rg9 h ILE 18 CO -0.04 0.07 -0.31 0.00 0.00 0.00 0.00 178.15 177.87 1rg9 h ALA 19 N 1.34 -0.98 -0.78 1.87 0.00 -0.59 -0.61 119.26 119.51 1rg9 h ALA 19 Ca 0.25 -0.11 0.14 0.00 0.00 0.00 0.00 54.91 55.19 1rg9 h ALA 19 Cb 0.26 0.57 -0.14 0.00 0.00 0.00 0.00 17.79 18.48 1rg9 h ALA 19 CO -0.24 -1.01 -0.29 -0.44 0.00 0.00 0.00 179.25 177.27 1rg9 h ASP 20 N -0.61 -1.05 -0.40 0.00 3.45 -0.90 0.69 116.42 117.61 1rg9 h ASP 20 Ca -0.04 0.25 0.06 0.00 0.43 0.00 0.00 57.03 57.74 1rg9 h ASP 20 Cb 0.53 0.59 -0.06 0.00 -0.56 0.00 0.00 39.33 39.83 1rg9 h ASP 20 CO -0.05 -0.29 0.07 1.56 -1.57 0.00 0.00 179.24 178.96 1rg9 h GLN 21 N -0.06 0.19 0.33 3.56 4.20 -0.57 0.35 115.11 123.11 1rg9 h GLN 21 Ca 0.33 -0.01 -0.02 0.00 0.06 0.00 0.00 58.65 59.01 1rg9 h GLN 21 Cb 0.58 -0.04 0.00 0.00 0.30 0.00 0.00 27.48 28.32 1rg9 h GLN 21 CO -0.82 0.12 -0.16 0.82 -0.67 0.00 0.00 178.83 178.13 1rg9 h ILE 22 N 0.19 0.68 -0.18 2.54 2.04 0.92 0.47 117.51 124.18 1rg9 h ILE 22 Ca 0.19 -0.04 0.05 0.00 1.00 0.00 0.00 64.86 66.07 1rg9 h ILE 22 Cb 0.24 0.71 -0.07 0.00 -0.74 0.00 0.00 36.82 36.96 1rg9 h ILE 22 CO -0.26 0.01 -0.32 0.28 0.00 0.00 0.00 178.15 177.86 1rg9 h SER 23 N -0.46 -1.00 1.00 1.72 0.02 0.10 0.32 113.55 115.25 1rg9 h SER 23 Ca -0.05 0.15 0.00 0.00 -0.84 0.00 0.00 61.79 61.06 1rg9 h SER 23 Cb 0.35 0.43 0.00 0.00 0.14 0.00 0.00 62.40 63.33 1rg9 h SER 23 CO 0.07 -0.35 0.00 0.44 -1.14 0.00 0.00 176.83 175.86 1rg9 h ASP 24 N -0.37 0.00 -0.09 3.07 3.32 -0.21 -2.57 116.42 119.58 1rg9 h ASP 24 Ca 0.11 0.00 -0.18 0.00 0.02 0.00 0.00 57.03 56.98 1rg9 h ASP 24 Cb 0.54 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.09 1rg9 h ASP 24 CO -0.38 0.00 -0.61 0.00 -1.72 0.00 0.00 179.24 176.52 1rg9 h ALA 25 N 2.18 0.53 -0.22 3.45 0.00 0.20 -2.61 119.26 122.79 1rg9 h ALA 25 Ca 0.00 -0.54 -0.07 0.00 0.00 0.00 0.00 54.91 54.30 1rg9 h ALA 25 Cb 0.50 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 1rg9 h ALA 25 CO 0.00 0.69 -0.13 0.28 0.00 0.00 0.00 179.25 180.10 1rg9 h VAL 26 N 0.52 1.31 -0.12 0.00 2.07 -0.82 -2.62 116.25 116.58 1rg9 h VAL 26 Ca -0.01 -1.22 0.02 0.00 0.82 0.00 0.00 66.70 66.32 1rg9 h VAL 26 Cb 1.20 1.64 -0.02 0.00 -1.52 0.00 0.00 31.29 32.58 1rg9 h VAL 26 CO 0.12 0.37 -0.02 0.25 0.02 0.00 0.00 177.57 178.31 1rg9 h LEU 27 N 0.17 -0.10 -0.11 2.57 5.85 -1.53 -0.10 115.31 122.07 1rg9 h LEU 27 Ca 0.05 0.03 0.04 0.00 0.84 0.00 0.00 57.88 58.84 1rg9 h LEU 27 Cb 0.64 0.07 -0.06 0.00 0.37 0.00 0.00 40.66 41.68 1rg9 h LEU 27 CO 0.04 -0.03 -0.27 0.44 -0.34 0.00 0.00 178.44 178.27 1rg9 h ASP 28 N 0.01 -0.84 -0.39 1.25 3.32 -1.48 1.00 116.42 119.29 1rg9 h ASP 28 Ca 0.06 0.13 0.08 0.00 0.02 0.00 0.00 57.03 57.31 1rg9 h ASP 28 Cb 0.08 0.36 -0.07 0.00 0.22 0.00 0.00 39.33 39.93 1rg9 h ASP 28 CO -0.12 -0.32 -0.06 0.00 -1.72 0.00 0.00 179.24 177.02 1rg9 h ALA 29 N 0.52 0.30 0.47 3.45 0.00 -1.16 0.19 119.26 123.03 1rg9 h ALA 29 Ca 0.09 0.14 -0.02 0.00 0.00 0.00 0.00 54.91 55.12 1rg9 h ALA 29 Cb 0.50 0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.54 1rg9 h ALA 29 CO -0.31 -0.43 -0.24 0.82 0.00 0.00 0.00 179.25 179.09 1rg9 h ILE 30 N 0.04 0.51 -0.81 0.00 2.04 0.10 -2.95 117.51 116.45 1rg9 h ILE 30 Ca 0.19 0.00 0.10 0.00 1.00 0.00 0.00 64.86 66.15 1rg9 h ILE 30 Cb 0.28 0.51 -0.08 0.00 -0.74 0.00 0.00 36.82 36.80 1rg9 h ILE 30 CO -0.37 0.00 0.44 -0.07 0.00 0.00 0.00 178.15 178.16 1rg9 h LEU 31 N -0.65 0.61 -1.18 1.44 3.38 0.16 0.11 115.31 119.18 1rg9 h LEU 31 Ca -0.06 0.06 0.28 0.00 0.09 0.00 0.00 57.88 58.25 1rg9 h LEU 31 Cb 0.51 -0.06 -0.12 0.00 0.09 0.00 0.00 40.66 41.08 1rg9 h LEU 31 CO 0.10 0.33 0.64 -0.08 0.09 0.00 0.00 178.44 179.53 1rg9 h GLU 32 N 0.73 0.41 0.08 1.13 4.22 -0.46 0.55 114.58 121.24 1rg9 h GLU 32 Ca 0.40 -0.02 -0.30 0.00 0.08 0.00 0.00 59.36 59.51 1rg9 h GLU 32 Cb 0.41 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.55 1rg9 h GLU 32 CO -0.27 0.27 -1.60 0.37 -2.18 0.00 0.00 179.01 175.60 1rg9 h GLN 33 N 0.42 0.16 -2.19 1.92 4.15 -0.88 -3.45 115.11 115.25 1rg9 h GLN 33 Ca 0.66 -0.28 -0.26 0.00 0.77 0.00 0.00 58.65 59.55 1rg9 h GLN 33 Cb 1.54 0.10 -0.33 0.00 0.21 0.00 0.00 27.48 29.00 1rg9 h GLN 33 CO -0.43 0.95 -0.57 0.34 -1.93 0.00 0.00 178.83 177.19 1rg9 s ASP 34 N -6.72 1.01 0.30 -0.69 2.15 0.16 -4.87 116.67 108.00 1rg9 s ASP 34 Ca -0.09 -0.20 0.04 0.00 0.43 0.00 0.00 52.55 52.73 1rg9 s ASP 34 Cb 0.07 0.70 0.47 0.00 -0.30 0.00 0.00 42.92 43.86 1rg9 s ASP 34 CO 0.83 -0.33 1.75 -0.65 -0.17 0.00 0.00 175.17 176.60 1rg9 h PRO 35 N 8.25 0.43 -0.67 4.34 0.11 -1.76 -2.93 132.00 139.78 1rg9 h PRO 35 Ca -0.17 -0.15 0.00 0.00 0.11 0.00 0.00 66.00 65.79 1rg9 h PRO 35 Cb 1.13 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.21 1rg9 h PRO 35 CO 0.29 0.64 0.00 1.63 -0.21 0.00 0.00 178.00 180.35 1rg9 n LYS 36 N -4.14 2.37 -1.32 1.05 5.02 -1.26 -4.86 118.16 115.01 1rg9 n LYS 36 Ca -0.00 -1.27 -0.32 0.00 -2.02 0.00 0.00 58.31 54.70 1rg9 n LYS 36 Cb 0.39 -1.65 0.09 0.00 -0.02 0.00 0.00 35.03 33.85 1rg9 n LYS 36 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1rg9 s ALA 37 N -1.69 2.12 -0.34 7.82 0.00 -1.10 -5.01 121.76 123.55 1rg9 s ALA 37 Ca 0.22 0.56 -0.00 0.00 0.00 0.00 0.00 51.96 52.74 1rg9 s ALA 37 Cb 0.16 -3.37 0.08 0.00 0.00 0.00 0.00 23.12 19.99 1rg9 s ALA 37 CO 0.09 -1.86 0.07 1.03 0.00 0.00 0.00 175.76 175.09 1rg9 s ARG 38 N -4.39 2.05 -0.22 0.00 3.00 -1.02 -4.89 118.95 113.48 1rg9 s ARG 38 Ca 0.67 -1.60 -0.02 0.00 0.00 0.00 0.00 55.73 54.77 1rg9 s ARG 38 Cb -0.22 -3.30 0.01 0.00 0.00 0.00 0.00 34.95 31.44 1rg9 s ARG 38 CO 0.50 -0.84 -0.08 0.08 0.00 0.00 0.00 175.30 174.96 1rg9 s VAL 39 N 1.12 2.99 -0.50 3.52 1.01 -1.26 -1.59 120.40 125.68 1rg9 s VAL 39 Ca 0.03 -0.72 0.03 0.00 0.00 0.00 0.00 61.98 61.32 1rg9 s VAL 39 Cb -0.21 -2.39 0.15 0.00 0.00 0.00 0.00 36.38 33.93 1rg9 s VAL 39 CO -0.04 0.39 0.31 0.00 0.00 0.00 0.00 175.10 175.75 1rg9 s ALA 40 N 1.40 2.53 -0.23 5.51 0.00 -0.19 -1.74 121.76 129.05 1rg9 s ALA 40 Ca 0.04 -2.91 -0.05 0.00 0.00 0.00 0.00 51.96 49.04 1rg9 s ALA 40 Cb -0.15 -1.94 -0.02 0.00 0.00 0.00 0.00 23.12 21.02 1rg9 s ALA 40 CO -0.06 -2.05 0.01 0.00 0.00 0.00 0.00 175.76 173.66 1rg9 s GLU 42 N 1.48 3.52 -0.05 0.00 0.41 0.44 -4.39 118.70 120.11 1rg9 s GLU 42 Ca 0.06 -0.60 0.04 0.00 -0.41 0.00 0.00 54.97 54.05 1rg9 s GLU 42 Cb -0.15 -2.78 -0.02 0.00 -1.78 0.00 0.00 34.13 29.40 1rg9 s GLU 42 CO 0.00 0.21 -0.16 0.99 -0.49 0.00 0.00 175.26 175.81 1rg9 s THR 43 N 0.40 2.86 -0.11 3.63 2.01 -1.26 -0.92 115.64 122.25 1rg9 s THR 43 Ca -0.07 -0.79 0.03 0.00 0.31 0.00 0.00 61.69 61.17 1rg9 s THR 43 Cb -0.15 -2.11 0.00 0.00 0.01 0.00 0.00 72.50 70.25 1rg9 s THR 43 CO 0.04 0.58 -0.23 -0.47 -0.69 0.00 0.00 174.62 173.85 1rg9 s TYR 44 N -0.56 2.59 -0.07 4.92 6.14 0.12 -1.90 117.35 128.59 1rg9 s TYR 44 Ca 0.08 -1.08 0.01 0.00 0.64 0.00 0.00 57.07 56.73 1rg9 s TYR 44 Cb -0.11 -1.74 0.02 0.00 0.42 0.00 0.00 41.96 40.55 1rg9 s TYR 44 CO 0.01 -0.44 -0.09 0.08 0.64 0.00 0.00 175.55 175.75 1rg9 s VAL 45 N 0.43 0.93 0.32 3.14 1.01 0.12 0.11 120.40 126.46 1rg9 s VAL 45 Ca -0.16 -0.33 0.02 0.00 0.00 0.00 0.00 61.98 61.51 1rg9 s VAL 45 Cb -0.17 -0.89 -0.02 0.00 0.00 0.00 0.00 36.38 35.29 1rg9 s VAL 45 CO 0.07 0.32 0.34 -0.54 0.00 0.00 0.00 175.10 175.28 1rg9 s LYS 46 N 0.93 1.74 0.00 2.72 -0.14 -1.04 0.13 119.74 124.09 1rg9 s LYS 46 Ca -0.10 -1.86 0.00 0.00 -1.36 0.00 0.00 55.97 52.65 1rg9 s LYS 46 Cb -0.15 0.37 0.00 0.00 -1.68 0.00 0.00 37.83 36.37 1rg9 s LYS 46 CO 0.01 -0.67 0.00 0.25 -0.76 0.00 0.00 175.35 174.18 1rg9 n THR 47 N -0.55 0.00 -0.82 2.17 -2.24 -1.10 -0.72 114.28 111.03 1rg9 n THR 47 Ca 0.04 0.00 0.04 0.00 -2.27 0.00 0.00 64.05 61.86 1rg9 n THR 47 Cb 0.62 0.00 0.05 0.00 -2.10 0.00 0.00 70.33 68.91 1rg9 n THR 47 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1rg9 n GLY 48 N -0.84 2.66 3.29 3.38 0.00 -1.26 -4.66 105.19 107.76 1rg9 n GLY 48 Ca 0.00 -0.45 -0.17 0.00 0.00 0.00 0.00 46.02 45.40 1rg9 n GLY 48 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 1rg9 s MET 49 N -1.48 1.50 -0.14 1.61 0.23 0.10 0.79 119.30 121.92 1rg9 s MET 49 Ca 0.13 -1.84 -0.05 0.00 -1.03 0.00 0.00 55.69 52.89 1rg9 s MET 49 Cb 0.11 0.04 0.07 0.00 -1.53 0.00 0.00 34.83 33.51 1rg9 s MET 49 CO 0.01 -0.45 0.30 0.08 -2.03 0.00 0.00 175.02 172.93 1rg9 s VAL 50 N -3.74 -0.40 -0.27 5.16 1.01 -0.54 -2.48 120.40 119.13 1rg9 s VAL 50 Ca 0.37 0.24 -0.06 0.00 0.00 0.00 0.00 61.98 62.54 1rg9 s VAL 50 Cb 0.05 -0.48 0.01 0.00 0.00 0.00 0.00 36.38 35.96 1rg9 s VAL 50 CO 0.17 0.10 0.04 -0.22 0.00 0.00 0.00 175.10 175.19 1rg9 s LEU 51 N 2.28 3.60 -0.32 3.92 0.20 0.30 -0.16 118.68 128.50 1rg9 s LEU 51 Ca -0.01 -0.66 -0.05 0.00 0.69 0.00 0.00 54.13 54.09 1rg9 s LEU 51 Cb -0.12 -1.83 0.03 0.00 -0.43 0.00 0.00 46.19 43.85 1rg9 s LEU 51 CO -0.09 -0.15 0.07 -0.69 -0.29 0.00 0.00 176.35 175.20 1rg9 s VAL 52 N 1.48 3.63 0.00 1.68 1.01 -0.31 0.14 120.40 128.03 1rg9 s VAL 52 Ca 0.03 -1.07 0.00 0.00 0.00 0.00 0.00 61.98 60.93 1rg9 s VAL 52 Cb -0.17 -3.01 0.00 0.00 0.00 0.00 0.00 36.38 33.20 1rg9 s VAL 52 CO 0.01 -0.09 0.00 0.61 0.00 0.00 0.00 175.10 175.63 1rg9 n GLY 53 N 4.78 4.63 0.00 4.51 0.00 -0.10 -1.65 105.19 117.36 1rg9 n GLY 53 Ca -0.13 -1.62 0.00 0.00 0.00 0.00 0.00 46.02 44.27 1rg9 n GLY 53 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1rg9 n GLY 54 N 0.50 0.13 3.08 -0.02 0.00 -0.87 -0.42 105.19 107.59 1rg9 n GLY 54 Ca 0.00 -2.03 -0.29 0.00 0.00 0.00 0.00 46.02 43.70 1rg9 n GLY 54 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1rg9 s GLU 55 N 0.00 2.30 -0.05 1.61 1.03 -0.19 -0.34 118.70 123.05 1rg9 s GLU 55 Ca 0.00 -0.60 0.00 0.00 0.03 0.00 0.00 54.97 54.41 1rg9 s GLU 55 Cb 0.00 -1.89 0.02 0.00 -0.80 0.00 0.00 34.13 31.46 1rg9 s GLU 55 CO 0.00 -0.01 -0.03 0.42 -1.33 0.00 0.00 175.26 174.31 1rg9 s ILE 56 N 0.82 0.47 -0.36 1.83 1.01 0.20 -1.02 121.20 124.15 1rg9 s ILE 56 Ca -0.10 -0.05 0.02 0.00 0.00 0.00 0.00 60.65 60.52 1rg9 s ILE 56 Cb -0.16 -0.53 0.11 0.00 0.01 0.00 0.00 42.46 41.89 1rg9 s ILE 56 CO 0.01 0.23 0.12 -0.89 0.00 0.00 0.00 174.94 174.41 1rg9 s THR 57 N 1.17 1.59 0.14 2.92 2.01 -0.62 -4.09 115.64 118.77 1rg9 s THR 57 Ca -0.07 -2.11 -0.03 0.00 0.31 0.00 0.00 61.69 59.79 1rg9 s THR 57 Cb -0.14 -2.17 -0.03 0.00 0.01 0.00 0.00 72.50 70.18 1rg9 s THR 57 CO -0.01 -0.71 0.12 0.28 -0.69 0.00 0.00 174.62 173.61 1rg9 s THR 58 N 0.97 0.09 -1.43 -0.82 -1.32 -1.26 -2.44 115.64 109.43 1rg9 s THR 58 Ca 0.12 -1.76 0.22 0.00 -1.21 0.00 0.00 61.69 59.07 1rg9 s THR 58 Cb -0.20 -1.99 -0.10 0.00 -1.51 0.00 0.00 72.50 68.70 1rg9 s THR 58 CO -0.12 -0.41 1.05 -1.54 -2.21 0.00 0.00 174.62 171.38 1rg9 n SER 59 N -0.13 1.34 -4.74 8.08 3.41 -1.26 -4.96 113.62 115.36 1rg9 n SER 59 Ca -0.06 -1.13 -0.31 0.00 -0.26 0.00 0.00 58.87 57.12 1rg9 n SER 59 Cb 0.63 0.70 0.12 0.00 -0.26 0.00 0.00 64.21 65.40 1rg9 n SER 59 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1rg9 s ALA 60 N -2.78 1.92 -0.20 7.33 0.00 -1.26 -5.05 121.76 121.72 1rg9 s ALA 60 Ca 0.13 0.18 -0.00 0.00 0.00 0.00 0.00 51.96 52.26 1rg9 s ALA 60 Cb 0.17 -3.26 0.05 0.00 0.00 0.00 0.00 23.12 20.08 1rg9 s ALA 60 CO 0.73 -2.07 -0.04 -1.58 0.00 0.00 0.00 175.76 172.80 1rg9 s TRP 61 N -2.89 1.86 0.27 0.00 0.52 -1.26 -5.11 118.94 112.34 1rg9 s TRP 61 Ca 0.62 -1.30 0.07 0.00 0.02 0.00 0.00 56.10 55.51 1rg9 s TRP 61 Cb -0.18 -1.37 -0.06 0.00 -1.15 0.00 0.00 33.47 30.71 1rg9 s TRP 61 CO 0.57 -0.68 -0.07 0.14 0.02 0.00 0.00 176.95 176.93 1rg9 s VAL 62 N 1.58 1.62 -0.39 4.03 -7.23 -1.26 -5.06 120.40 113.69 1rg9 s VAL 62 Ca -0.02 -2.13 -0.04 0.00 -1.81 0.00 0.00 61.98 57.98 1rg9 s VAL 62 Cb -0.17 -2.39 0.09 0.00 0.56 0.00 0.00 36.38 34.47 1rg9 s VAL 62 CO -0.07 -0.34 0.17 -0.62 -0.31 0.00 0.00 175.10 173.93 1rg9 s ASP 63 N -3.42 5.26 0.15 4.85 -1.08 -1.26 -4.99 116.67 116.19 1rg9 s ASP 63 Ca 0.29 -1.76 -0.16 0.00 -0.52 0.00 0.00 52.55 50.40 1rg9 s ASP 63 Cb 0.03 -1.84 0.02 0.00 -1.46 0.00 0.00 42.92 39.68 1rg9 s ASP 63 CO 0.11 -0.48 1.79 0.40 0.52 0.00 0.00 175.17 177.51 1rg9 h ILE 64 N 6.32 1.13 -0.05 4.11 1.08 -1.99 -1.43 117.51 126.69 1rg9 h ILE 64 Ca -0.17 -0.29 0.01 0.00 -0.39 0.00 0.00 64.86 64.03 1rg9 h ILE 64 Cb 1.06 0.55 -0.01 0.00 -3.07 0.00 0.00 36.82 35.34 1rg9 h ILE 64 CO 0.68 0.13 -0.04 -0.08 -0.69 0.00 0.00 178.15 178.15 1rg9 h GLU 65 N 0.57 -0.04 0.14 2.37 4.81 -1.94 0.56 114.58 121.05 1rg9 h GLU 65 Ca 0.16 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.38 1rg9 h GLU 65 Cb -0.02 0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.37 1rg9 h GLU 65 CO -0.03 -0.03 -0.07 0.93 -0.73 0.00 0.00 179.01 179.08 1rg9 h GLU 66 N -0.05 -0.18 -0.61 1.92 3.07 -1.97 0.38 114.58 117.14 1rg9 h GLU 66 Ca 0.03 0.01 0.04 0.00 -0.50 0.00 0.00 59.36 58.95 1rg9 h GLU 66 Cb 0.09 0.04 -0.05 0.00 -0.84 0.00 0.00 28.75 28.00 1rg9 h GLU 66 CO -0.07 -0.09 0.35 0.82 -1.40 0.00 0.00 179.01 178.62 1rg9 h ILE 67 N -0.22 1.02 0.37 3.13 2.04 -1.19 -0.87 117.51 121.78 1rg9 h ILE 67 Ca -0.02 -0.23 -0.02 0.00 1.00 0.00 0.00 64.86 65.59 1rg9 h ILE 67 Cb 0.17 0.28 0.00 0.00 -0.74 0.00 0.00 36.82 36.54 1rg9 h ILE 67 CO 0.03 0.12 -0.18 0.74 0.00 0.00 0.00 178.15 178.87 1rg9 h THR 68 N 0.68 0.00 -0.81 -0.27 2.02 -0.64 0.62 112.91 114.51 1rg9 h THR 68 Ca 0.26 -0.08 0.20 0.00 0.77 0.00 0.00 66.41 67.56 1rg9 h THR 68 Cb 0.10 0.00 -0.14 0.00 -1.74 0.00 0.00 68.15 66.37 1rg9 h THR 68 CO -0.14 0.00 0.08 0.03 0.37 0.00 0.00 175.52 175.87 1rg9 h ARG 69 N -0.58 0.13 -0.50 6.66 3.08 -0.22 0.18 114.38 123.13 1rg9 h ARG 69 Ca -0.05 -0.01 -0.05 0.00 0.07 0.00 0.00 59.98 59.94 1rg9 h ARG 69 Cb 0.38 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.38 1rg9 h ARG 69 CO 0.08 0.09 0.12 -0.91 -1.07 0.00 0.00 179.97 178.28 1rg9 h ASN 70 N 0.14 0.76 -0.42 7.04 2.35 -1.16 0.23 115.58 124.51 1rg9 h ASN 70 Ca 0.47 -0.23 -0.01 0.00 -0.55 0.00 0.00 56.30 55.97 1rg9 h ASN 70 Cb 0.88 -0.20 -0.02 0.00 0.05 0.00 0.00 38.32 39.03 1rg9 h ASN 70 CO -0.68 0.80 0.21 0.74 -1.65 0.00 0.00 177.43 176.85 1rg9 h THR 71 N 0.69 1.17 -0.06 2.81 2.02 0.17 -1.64 112.91 118.07 1rg9 h THR 71 Ca 0.16 -0.49 -0.01 0.00 0.77 0.00 0.00 66.41 66.84 1rg9 h THR 71 Cb 0.33 0.72 -0.00 0.00 -1.74 0.00 0.00 68.15 67.46 1rg9 h THR 71 CO 0.00 0.19 -0.00 0.58 0.37 0.00 0.00 175.52 176.66 1rg9 h VAL 72 N 0.55 1.26 -0.78 3.16 2.07 -0.91 -2.26 116.25 119.35 1rg9 h VAL 72 Ca 0.15 -0.82 0.11 0.00 0.82 0.00 0.00 66.70 66.96 1rg9 h VAL 72 Cb 0.11 1.69 -0.13 0.00 -1.52 0.00 0.00 31.29 31.44 1rg9 h VAL 72 CO -0.02 0.23 -0.42 -0.09 0.02 0.00 0.00 177.57 177.29 1rg9 h ARG 73 N -0.19 -0.11 -0.97 1.57 2.43 -0.37 0.39 114.38 117.14 1rg9 h ARG 73 Ca 0.02 0.01 0.05 0.00 -0.81 0.00 0.00 59.98 59.25 1rg9 h ARG 73 Cb 0.36 0.02 -0.06 0.00 -0.42 0.00 0.00 29.97 29.87 1rg9 h ARG 73 CO 0.00 -0.07 0.63 0.93 -1.51 0.00 0.00 179.97 179.96 1rg9 h GLU 74 N -0.11 1.13 -0.53 0.20 5.08 -1.19 -0.95 114.58 118.22 1rg9 h GLU 74 Ca 0.24 -0.07 0.09 0.00 -1.00 0.00 0.00 59.36 58.62 1rg9 h GLU 74 Cb 0.55 -0.26 -0.07 0.00 0.50 0.00 0.00 28.75 29.48 1rg9 h GLU 74 CO -0.82 0.75 0.13 0.82 -1.00 0.00 0.00 179.01 178.89 1rg9 h ILE 75 N 1.17 0.73 0.00 3.13 2.04 0.36 -3.46 117.51 121.47 1rg9 h ILE 75 Ca 0.41 -0.10 0.00 0.00 1.00 0.00 0.00 64.86 66.17 1rg9 h ILE 75 Cb 0.11 0.43 0.00 0.00 -0.74 0.00 0.00 36.82 36.61 1rg9 h ILE 75 CO -0.15 0.05 0.00 0.61 0.00 0.00 0.00 178.15 178.66 1rg9 n GLY 76 N -1.29 1.01 3.56 5.37 0.00 -0.36 -4.83 105.19 108.65 1rg9 n GLY 76 Ca 0.06 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.69 1rg9 n GLY 76 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1rg9 s TYR 77 N 0.00 1.85 -0.06 1.61 2.02 -1.25 -4.77 117.35 116.75 1rg9 s TYR 77 Ca 0.00 0.60 0.09 0.00 -0.37 0.00 0.00 57.07 57.40 1rg9 s TYR 77 Cb 0.00 -4.22 0.15 0.00 -0.40 0.00 0.00 41.96 37.49 1rg9 s TYR 77 CO 0.00 -2.28 1.07 1.33 -1.57 0.00 0.00 175.55 174.11 1rg9 n VAL 78 N 7.05 0.84 -3.59 0.71 0.24 -1.24 -1.13 118.33 121.22 1rg9 n VAL 78 Ca 0.17 -1.07 -0.16 0.00 -2.04 0.00 0.00 64.34 61.24 1rg9 n VAL 78 Cb 0.51 0.19 -0.07 0.00 -1.47 0.00 0.00 33.84 33.00 1rg9 n VAL 78 CO 0.00 0.00 0.00 -2.28 -2.14 0.00 0.00 176.83 172.41 1rg9 s HIS 79 N -1.28 -0.60 0.42 6.34 5.65 -1.21 -4.88 115.29 119.73 1rg9 s HIS 79 Ca 0.16 1.13 0.32 0.00 0.25 0.00 0.00 55.06 56.92 1rg9 s HIS 79 Cb 0.14 0.33 1.66 0.00 -1.18 0.00 0.00 32.58 33.53 1rg9 s HIS 79 CO 0.00 -0.52 2.13 0.66 -0.65 0.00 0.00 174.74 176.37 1rg9 h SER 80 N 3.60 0.00 -0.81 9.88 4.64 -1.93 -2.28 113.55 126.65 1rg9 h SER 80 Ca -0.28 0.00 0.13 0.00 -0.47 0.00 0.00 61.79 61.17 1rg9 h SER 80 Cb 1.15 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 63.18 1rg9 h SER 80 CO 0.33 0.07 0.53 0.44 -0.87 0.00 0.00 176.83 177.33 1rg9 h ASP 81 N 0.00 0.56 -0.06 4.97 3.45 -1.95 0.24 116.42 123.64 1rg9 h ASP 81 Ca -0.00 0.03 0.00 0.00 0.43 0.00 0.00 57.03 57.49 1rg9 h ASP 81 Cb 0.28 -0.09 0.00 0.00 -0.56 0.00 0.00 39.33 38.96 1rg9 h ASP 81 CO 0.01 0.30 0.00 0.23 -1.57 0.00 0.00 179.24 178.21 1rg9 n MET 82 N -4.52 1.81 0.00 3.56 0.00 -0.86 -4.96 117.12 112.15 1rg9 n MET 82 Ca 0.15 -1.19 0.00 0.00 0.00 0.00 0.00 57.70 56.66 1rg9 n MET 82 Cb 0.45 -1.46 0.00 0.00 0.00 0.00 0.00 33.22 32.20 1rg9 n MET 82 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1rg9 n GLY 83 N 1.21 3.20 3.03 3.03 0.00 0.07 -4.61 105.19 111.12 1rg9 n GLY 83 Ca 0.18 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.10 1rg9 n GLY 83 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1rg9 s PHE 84 N -2.79 0.16 -0.15 1.61 5.36 -1.25 -4.70 117.98 116.22 1rg9 s PHE 84 Ca 0.00 -0.35 -0.04 0.00 -0.96 0.00 0.00 56.93 55.58 1rg9 s PHE 84 Cb 0.00 -0.13 0.07 0.00 -0.34 0.00 0.00 43.02 42.63 1rg9 s PHE 84 CO 0.00 -0.22 0.21 0.34 -1.46 0.00 0.00 175.22 174.09 1rg9 s ASP 85 N -1.37 0.97 0.35 6.13 2.15 -1.26 -3.36 116.67 120.27 1rg9 s ASP 85 Ca -0.15 0.12 0.13 0.00 0.43 0.00 0.00 52.55 53.08 1rg9 s ASP 85 Cb -0.09 0.43 0.97 0.00 -0.30 0.00 0.00 42.92 43.93 1rg9 s ASP 85 CO 0.00 -0.28 1.74 0.00 -0.17 0.00 0.00 175.17 176.46 1rg9 h ALA 86 N 8.32 1.96 -0.15 3.66 0.00 -1.43 0.14 119.26 131.76 1rg9 h ALA 86 Ca -0.15 0.10 -0.19 0.00 0.00 0.00 0.00 54.91 54.67 1rg9 h ALA 86 Cb 1.13 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.95 1rg9 h ALA 86 CO 0.21 -0.41 -0.70 -0.91 0.00 0.00 0.00 179.25 177.44 1rg9 h ASN 87 N 0.51 0.73 -0.11 0.00 2.35 -1.88 -3.35 115.58 113.82 1rg9 h ASN 87 Ca 0.63 -0.45 0.00 0.00 -0.55 0.00 0.00 56.30 55.93 1rg9 h ASN 87 Cb 1.35 -0.21 0.00 0.00 0.05 0.00 0.00 38.32 39.50 1rg9 h ASN 87 CO -0.41 1.21 0.00 -1.54 -1.65 0.00 0.00 177.43 175.04 1rg9 n SER 88 N -3.91 2.33 -4.87 5.81 3.41 -0.72 -5.01 113.62 110.66 1rg9 n SER 88 Ca -0.05 -1.66 -0.30 0.00 -0.26 0.00 0.00 58.87 56.60 1rg9 n SER 88 Cb 0.69 -0.07 0.05 0.00 -0.26 0.00 0.00 64.21 64.63 1rg9 n SER 88 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1rg9 s ALA 90 N -3.34 3.48 -0.25 0.00 0.00 0.24 -4.98 121.76 116.91 1rg9 s ALA 90 Ca 0.59 -0.08 0.00 0.00 0.00 0.00 0.00 51.96 52.47 1rg9 s ALA 90 Cb -0.12 -2.61 0.07 0.00 0.00 0.00 0.00 23.12 20.46 1rg9 s ALA 90 CO 0.52 0.42 -0.01 0.08 0.00 0.00 0.00 175.76 176.77 1rg9 s VAL 91 N -1.71 1.37 0.15 0.00 1.01 -1.26 -1.47 120.40 118.49 1rg9 s VAL 91 Ca 0.46 -1.27 0.04 0.00 0.00 0.00 0.00 61.98 61.20 1rg9 s VAL 91 Cb -0.13 -1.76 -0.04 0.00 0.00 0.00 0.00 36.38 34.45 1rg9 s VAL 91 CO 0.20 -0.25 0.17 -0.76 0.00 0.00 0.00 175.10 174.46 1rg9 s LEU 92 N 1.44 3.96 -0.03 3.92 2.01 0.77 -4.97 118.68 125.78 1rg9 s LEU 92 Ca -0.01 -0.03 -0.01 0.00 0.01 0.00 0.00 54.13 54.09 1rg9 s LEU 92 Cb -0.18 -2.56 0.03 0.00 0.01 0.00 0.00 46.19 43.49 1rg9 s LEU 92 CO -0.10 0.07 0.05 -0.44 1.01 0.00 0.00 176.35 176.95 1rg9 s SER 93 N -3.09 0.07 -0.45 2.29 0.01 -1.26 -1.16 113.70 110.11 1rg9 s SER 93 Ca 0.32 0.09 0.07 0.00 1.31 0.00 0.00 55.95 57.74 1rg9 s SER 93 Cb -0.10 -0.02 0.23 0.00 0.21 0.00 0.00 66.02 66.33 1rg9 s SER 93 CO 0.25 -0.14 0.51 0.00 0.41 0.00 0.00 173.24 174.27 1rg9 n ALA 94 N 4.23 2.83 -3.42 1.44 0.00 -0.66 -4.98 120.51 119.96 1rg9 n ALA 94 Ca -0.27 -3.61 -0.36 0.00 0.00 0.00 0.00 53.44 49.20 1rg9 n ALA 94 Cb 0.50 -0.82 -0.13 0.00 0.00 0.00 0.00 19.45 19.00 1rg9 n ALA 94 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1rg9 s ILE 95 N -1.13 3.45 0.00 0.00 1.01 -1.26 -2.06 121.20 121.22 1rg9 s ILE 95 Ca 0.35 -1.01 0.00 0.00 0.00 0.00 0.00 60.65 59.99 1rg9 s ILE 95 Cb 0.13 -2.85 0.00 0.00 0.01 0.00 0.00 42.46 39.74 1rg9 s ILE 95 CO -0.12 0.02 0.00 0.61 0.00 0.00 0.00 174.94 175.45 1rg9 n GLY 96 N 4.76 1.93 3.86 6.18 0.00 0.54 -4.86 105.19 117.60 1rg9 n GLY 96 Ca -0.14 -2.13 -0.25 0.00 0.00 0.00 0.00 46.02 43.50 1rg9 n GLY 96 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1rg9 s LYS 97 N -1.75 3.11 0.34 1.61 1.02 -1.26 0.60 119.74 123.42 1rg9 s LYS 97 Ca 0.00 -0.80 -0.29 0.00 0.02 0.00 0.00 55.97 54.90 1rg9 s LYS 97 Cb 0.00 -2.75 -0.11 0.00 -0.52 0.00 0.00 37.83 34.45 1rg9 s LYS 97 CO 0.00 0.48 1.37 -1.14 -0.92 0.00 0.00 175.35 175.14 1rg9 s GLN 98 N -3.31 4.27 0.18 1.68 0.74 -1.26 -4.67 119.66 117.29 1rg9 s GLN 98 Ca 0.33 2.34 -0.32 0.00 0.05 0.00 0.00 55.36 57.76 1rg9 s GLN 98 Cb -0.10 -3.04 -0.11 0.00 1.10 0.00 0.00 33.01 30.87 1rg9 s GLN 98 CO 0.26 -0.32 1.63 0.45 -0.55 0.00 0.00 175.29 176.76 1rg9 s SER 99 N -0.33 6.51 0.47 6.67 0.15 -1.26 -4.90 113.70 121.01 1rg9 s SER 99 Ca 0.51 2.71 0.13 0.00 0.70 0.00 0.00 55.95 60.00 1rg9 s SER 99 Cb -0.42 -2.60 1.08 0.00 -1.71 0.00 0.00 66.02 62.37 1rg9 s SER 99 CO 0.56 -0.88 2.08 1.55 1.20 0.00 0.00 173.24 177.75 1rg9 h PRO 100 N 6.83 0.15 -0.82 5.44 0.13 -1.99 -1.67 132.00 140.07 1rg9 h PRO 100 Ca -0.43 -0.01 0.06 0.00 -0.87 0.00 0.00 66.00 64.75 1rg9 h PRO 100 Cb 1.20 -0.03 -0.06 0.00 0.13 0.00 0.00 31.00 32.24 1rg9 h PRO 100 CO 0.93 0.15 0.50 -0.44 -0.23 0.00 0.00 178.00 178.91 1rg9 h ASP 101 N 0.15 0.77 -0.02 1.44 5.19 -2.02 -1.17 116.42 120.76 1rg9 h ASP 101 Ca 0.04 0.02 -0.01 0.00 -0.62 0.00 0.00 57.03 56.46 1rg9 h ASP 101 Cb 0.08 -0.14 -0.00 0.00 0.18 0.00 0.00 39.33 39.45 1rg9 h ASP 101 CO -0.00 0.49 -0.03 0.40 -3.12 0.00 0.00 179.24 176.97 1rg9 h ILE 102 N 0.90 1.41 -0.87 0.35 2.04 -1.72 -3.31 117.51 116.32 1rg9 h ILE 102 Ca 0.36 -1.27 0.19 0.00 1.00 0.00 0.00 64.86 65.14 1rg9 h ILE 102 Cb 0.19 2.21 -0.06 0.00 -0.74 0.00 0.00 36.82 38.42 1rg9 h ILE 102 CO -0.18 0.34 0.57 -1.13 0.00 0.00 0.00 178.15 177.75 1rg9 h ASN 103 N -0.44 0.42 0.20 1.72 -0.73 -0.72 -1.29 115.58 114.74 1rg9 h ASN 103 Ca 0.00 0.04 -0.04 0.00 1.87 0.00 0.00 56.30 58.17 1rg9 h ASN 103 Cb 0.57 -0.04 -0.01 0.00 0.27 0.00 0.00 38.32 39.11 1rg9 h ASN 103 CO 0.01 0.18 -0.18 0.06 -0.37 0.00 0.00 177.43 177.13 1rg9 h GLN 104 N 0.42 0.00 0.00 6.67 3.07 -1.32 -1.13 115.11 122.82 1rg9 h GLN 104 Ca 0.44 0.00 0.00 0.00 0.09 0.00 0.00 58.65 59.18 1rg9 h GLN 104 Cb 1.07 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.63 1rg9 h GLN 104 CO -0.16 0.18 -0.47 0.78 0.09 0.00 0.00 178.83 179.24 1rg9 h GLY 105 N 0.58 0.00 0.00 0.06 0.00 -1.40 -3.40 103.07 98.91 1rg9 h GLY 105 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1rg9 h GLY 105 CO 0.02 0.00 -0.38 -2.08 0.00 0.00 0.00 176.54 174.10 1rg9 h VAL 106 N 0.00 0.00 -3.15 4.60 2.07 -1.19 -3.09 116.25 115.49 1rg9 h VAL 106 Ca 0.00 -0.84 -0.70 0.00 0.82 0.00 0.00 66.70 65.98 1rg9 h VAL 106 Cb 0.96 0.00 -0.20 0.00 -1.52 0.00 0.00 31.29 30.53 1rg9 h VAL 106 CO 0.00 0.00 -0.01 -1.81 0.02 0.00 0.00 177.57 175.77 1rg9 s ASP 107 N -5.35 6.20 0.49 0.57 -0.00 -0.50 -0.58 116.67 117.50 1rg9 s ASP 107 Ca -0.11 -1.18 0.07 0.00 -0.00 0.00 0.00 52.55 51.33 1rg9 s ASP 107 Cb 0.02 -2.27 0.02 0.00 -0.00 0.00 0.00 42.92 40.68 1rg9 s ASP 107 CO 0.16 -0.92 0.46 -0.13 -0.00 0.00 0.00 175.17 174.74 1rg9 s ARG 108 N 2.44 2.39 0.09 8.23 0.52 -1.26 -4.67 118.95 126.68 1rg9 s ARG 108 Ca 0.12 -1.73 -0.21 0.00 -0.52 0.00 0.00 55.73 53.39 1rg9 s ARG 108 Cb -0.22 -2.32 -0.07 0.00 0.52 0.00 0.00 34.95 32.86 1rg9 s ARG 108 CO 0.09 -0.46 1.35 0.00 0.02 0.00 0.00 175.30 176.29 1rg9 h ALA 109 N 0.78 -0.56 -2.17 2.13 0.00 -1.96 -3.37 119.26 114.11 1rg9 h ALA 109 Ca -0.38 0.01 -0.58 0.00 0.00 0.00 0.00 54.91 53.97 1rg9 h ALA 109 Cb 1.28 1.03 -0.06 0.00 0.00 0.00 0.00 17.79 20.04 1rg9 h ALA 109 CO 0.54 -0.75 0.68 0.34 0.00 0.00 0.00 179.25 180.06 1rg9 s ASP 110 N -4.29 7.08 0.38 0.00 2.15 -1.26 -4.95 116.67 115.79 1rg9 s ASP 110 Ca -0.09 1.35 0.09 0.00 0.43 0.00 0.00 52.55 54.33 1rg9 s ASP 110 Cb 0.06 -2.52 0.84 0.00 -0.30 0.00 0.00 42.92 41.00 1rg9 s ASP 110 CO 0.39 -0.58 1.92 -0.65 -0.17 0.00 0.00 175.17 176.08 1rg9 h PRO 111 N 7.40 0.63 -0.40 4.34 0.11 -2.00 -2.52 132.00 139.55 1rg9 h PRO 111 Ca -0.23 -0.04 -0.08 0.00 0.11 0.00 0.00 66.00 65.77 1rg9 h PRO 111 Cb 1.09 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 32.04 1rg9 h PRO 111 CO 0.93 0.42 -0.05 -0.07 -0.21 0.00 0.00 178.00 179.02 1rg9 h LEU 112 N 0.65 0.74 -0.95 2.35 4.07 -1.92 -2.74 115.31 117.51 1rg9 h LEU 112 Ca 0.37 -0.34 0.00 0.00 0.08 0.00 0.00 57.88 57.99 1rg9 h LEU 112 Cb 0.55 -0.20 0.00 0.00 1.08 0.00 0.00 40.66 42.09 1rg9 h LEU 112 CO -0.14 0.90 0.00 1.05 -1.08 0.00 0.00 178.44 179.17 1rg9 h GLU 113 N 0.57 0.00 -6.16 1.13 4.11 -1.85 -3.42 114.58 108.96 1rg9 h GLU 113 Ca 0.11 0.00 -0.72 0.00 0.07 0.00 0.00 59.36 58.82 1rg9 h GLU 113 Cb 0.55 0.00 0.06 0.00 0.50 0.00 0.00 28.75 29.86 1rg9 h GLU 113 CO 0.03 0.00 0.25 1.04 0.07 0.00 0.00 179.01 180.40 1rg9 n GLN 114 N -2.34 0.67 -2.62 1.06 6.02 -1.04 -4.27 117.38 114.86 1rg9 n GLN 114 Ca 0.01 0.24 -0.25 0.00 -0.01 0.00 0.00 57.00 57.00 1rg9 n GLN 114 Cb 0.20 -1.79 0.03 0.00 1.02 0.00 0.00 30.24 29.69 1rg9 n GLN 114 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.06 176.25 1rg9 s GLY 115 N 0.20 1.62 0.35 1.08 0.00 0.25 -4.35 107.32 106.47 1rg9 s GLY 115 Ca 0.85 -0.91 -0.28 0.00 0.00 0.00 0.00 44.72 44.38 1rg9 s GLY 115 CO 0.52 -0.66 1.42 0.00 0.00 0.00 0.00 173.10 174.38 1rg9 n ALA 116 N -2.40 1.94 0.29 3.20 0.00 -0.90 -4.49 120.51 118.15 1rg9 n ALA 116 Ca 0.04 0.35 0.15 0.00 0.00 0.00 0.00 53.44 53.99 1rg9 n ALA 116 Cb 0.58 -2.36 0.88 0.00 0.00 0.00 0.00 19.45 18.55 1rg9 n ALA 116 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1rg9 h GLY 117 N 2.97 0.00 -1.43 0.00 0.00 -1.77 -0.54 103.07 102.29 1rg9 h GLY 117 Ca -0.49 0.00 0.10 0.00 0.00 0.00 0.00 47.33 46.94 1rg9 h GLY 117 CO 0.65 0.00 0.47 -0.35 0.00 0.00 0.00 176.54 177.31 1rg9 s ASP 118 N -5.98 -0.01 0.62 0.19 2.15 -1.26 -4.81 116.67 107.57 1rg9 s ASP 118 Ca -0.04 -0.82 -0.01 0.00 0.43 0.00 0.00 52.55 52.11 1rg9 s ASP 118 Cb 0.14 0.63 0.06 0.00 -0.30 0.00 0.00 42.92 43.44 1rg9 s ASP 118 CO 0.54 -1.24 0.87 0.00 -0.17 0.00 0.00 175.17 175.17 1rg9 s GLN 119 N -2.30 2.30 0.00 4.34 -2.07 -1.26 -3.32 119.66 117.36 1rg9 s GLN 119 Ca 0.19 -0.71 0.00 0.00 -1.82 0.00 0.00 55.36 53.02 1rg9 s GLN 119 Cb -0.03 -2.38 0.00 0.00 -1.09 0.00 0.00 33.01 29.50 1rg9 s GLN 119 CO 0.07 -0.97 0.00 0.41 -1.32 0.00 0.00 175.29 173.48 1rg9 n GLY 120 N -2.57 2.47 3.18 2.60 0.00 -0.75 -4.86 105.19 105.26 1rg9 n GLY 120 Ca 0.09 -1.81 -0.21 0.00 0.00 0.00 0.00 46.02 44.10 1rg9 n GLY 120 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1rg9 s LEU 121 N 0.00 2.21 0.04 0.99 2.34 -1.26 0.11 118.68 123.11 1rg9 s LEU 121 Ca 0.00 -0.53 0.04 0.00 0.06 0.00 0.00 54.13 53.69 1rg9 s LEU 121 Cb 0.00 -0.66 -0.02 0.00 -0.56 0.00 0.00 46.19 44.95 1rg9 s LEU 121 CO 0.00 0.03 -0.11 0.00 -1.06 0.00 0.00 176.35 175.20 1rg9 s MET 122 N -1.39 0.74 -0.12 1.48 0.23 0.17 -4.15 119.30 116.27 1rg9 s MET 122 Ca 0.02 -0.69 0.01 0.00 -1.03 0.00 0.00 55.69 54.00 1rg9 s MET 122 Cb -0.09 -0.68 -0.01 0.00 -1.53 0.00 0.00 34.83 32.52 1rg9 s MET 122 CO 0.02 0.16 -0.16 -0.06 -2.03 0.00 0.00 175.02 172.96 1rg9 s PHE 123 N -0.91 2.74 0.14 3.16 0.40 -1.26 -1.58 117.98 120.67 1rg9 s PHE 123 Ca -0.02 -0.69 0.06 0.00 -0.60 0.00 0.00 56.93 55.68 1rg9 s PHE 123 Cb -0.08 -1.79 -0.04 0.00 0.51 0.00 0.00 43.02 41.62 1rg9 s PHE 123 CO 0.01 -0.22 0.05 0.20 0.70 0.00 0.00 175.22 175.96 1rg9 s GLY 124 N 0.25 1.79 -0.04 4.36 0.00 0.69 -4.80 107.32 109.57 1rg9 s GLY 124 Ca -0.11 -1.23 -0.20 0.00 0.00 0.00 0.00 44.72 43.19 1rg9 s GLY 124 CO 0.06 -1.23 0.43 -0.47 0.00 0.00 0.00 173.10 171.89 1rg9 s TYR 125 N -1.61 -0.35 -0.05 1.90 5.04 -1.26 -0.74 117.35 120.29 1rg9 s TYR 125 Ca 0.28 0.60 -0.20 0.00 -2.44 0.00 0.00 57.07 55.31 1rg9 s TYR 125 Cb -0.10 0.19 0.04 0.00 0.35 0.00 0.00 41.96 42.44 1rg9 s TYR 125 CO 0.20 -0.44 0.45 0.00 -1.34 0.00 0.00 175.55 174.42 1rg9 s ALA 126 N -1.15 -1.15 -0.13 3.97 0.00 -1.05 -4.47 121.76 117.77 1rg9 s ALA 126 Ca -0.12 0.78 -0.18 0.00 0.00 0.00 0.00 51.96 52.44 1rg9 s ALA 126 Cb -0.04 -0.06 0.04 0.00 0.00 0.00 0.00 23.12 23.07 1rg9 s ALA 126 CO 0.06 -0.29 0.47 -0.08 0.00 0.00 0.00 175.76 175.92 1rg9 s THR 127 N -1.08 0.01 -1.64 0.00 -1.32 -0.80 -2.29 115.64 108.53 1rg9 s THR 127 Ca -0.11 -0.10 0.04 0.00 -1.21 0.00 0.00 61.69 60.31 1rg9 s THR 127 Cb -0.03 -0.70 0.13 0.00 -1.51 0.00 0.00 72.50 70.39 1rg9 s THR 127 CO 0.06 -0.06 0.99 -0.46 -2.21 0.00 0.00 174.62 172.94 1rg9 n ASN 128 N 2.25 1.12 0.31 8.08 0.23 -0.69 -3.50 115.26 123.06 1rg9 n ASN 128 Ca -0.16 -2.06 0.18 0.00 -0.53 0.00 0.00 54.58 52.02 1rg9 n ASN 128 Cb 0.57 -0.24 1.02 0.00 -2.08 0.00 0.00 39.78 39.05 1rg9 n ASN 128 CO 0.00 0.00 0.00 -0.08 -0.93 0.00 0.00 177.26 176.25 1rg9 h GLU 129 N 0.81 0.00 -3.78 -3.83 4.81 -1.86 -3.44 114.58 107.29 1rg9 h GLU 129 Ca 0.00 0.00 -0.09 0.00 -0.13 0.00 0.00 59.36 59.14 1rg9 h GLU 129 Cb 0.38 0.00 -0.13 0.00 0.63 0.00 0.00 28.75 29.63 1rg9 h GLU 129 CO 0.03 0.01 -0.29 0.95 -0.73 0.00 0.00 179.01 178.99 1rg9 s THR 130 N -4.31 0.09 0.23 0.32 -4.23 -1.25 -4.88 115.64 101.61 1rg9 s THR 130 Ca -0.04 -1.21 -0.06 0.00 -1.18 0.00 0.00 61.69 59.20 1rg9 s THR 130 Cb 0.14 -1.61 0.20 0.00 1.34 0.00 0.00 72.50 72.56 1rg9 s THR 130 CO 0.49 -0.39 1.73 0.44 -0.54 0.00 0.00 174.62 176.34 1rg9 h ASP 131 N 2.56 0.22 -0.07 3.99 3.45 -1.90 0.36 116.42 125.03 1rg9 h ASP 131 Ca -0.32 0.11 0.00 0.00 0.43 0.00 0.00 57.03 57.24 1rg9 h ASP 131 Cb 1.22 0.10 0.00 0.00 -0.56 0.00 0.00 39.33 40.09 1rg9 h ASP 131 CO 0.50 0.09 0.00 1.33 -1.57 0.00 0.00 179.24 179.59 1rg9 n VAL 132 N -5.02 0.22 -3.58 -1.35 0.24 -1.26 -4.85 118.33 102.73 1rg9 n VAL 132 Ca 0.13 -0.14 -0.27 0.00 -2.04 0.00 0.00 64.34 62.02 1rg9 n VAL 132 Cb 0.38 -0.24 0.00 0.00 -1.47 0.00 0.00 33.84 32.51 1rg9 n VAL 132 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87 1rg9 n LEU 133 N -0.08 -1.84 -4.60 1.34 7.99 0.13 -4.78 117.00 115.16 1rg9 n LEU 133 Ca 0.03 -0.55 -0.25 0.00 -0.01 0.00 0.00 56.01 55.23 1rg9 n LEU 133 Cb 0.23 -2.26 -0.08 0.00 -0.11 0.00 0.00 43.42 41.20 1rg9 n LEU 133 CO 0.03 0.24 -0.37 -0.04 -1.51 0.00 0.00 177.39 175.74 1rg9 s MET 134 N -6.25 2.17 0.69 3.23 -1.94 -1.23 -1.90 119.30 114.07 1rg9 s MET 134 Ca 0.50 -1.34 -0.15 0.00 -1.71 0.00 0.00 55.69 53.00 1rg9 s MET 134 Cb -0.26 -2.16 0.02 0.00 2.01 0.00 0.00 34.83 34.44 1rg9 s MET 134 CO 0.62 0.40 1.15 -2.14 -0.01 0.00 0.00 175.02 175.04 1rg9 s PRO 135 N -3.21 2.52 -0.07 2.03 0.02 -1.26 -3.75 135.00 131.27 1rg9 s PRO 135 Ca 0.28 1.53 -0.25 0.00 0.02 0.00 0.00 61.00 62.58 1rg9 s PRO 135 Cb -0.08 -1.90 -0.21 0.00 0.02 0.00 0.00 34.50 32.33 1rg9 s PRO 135 CO 0.17 -1.50 0.97 0.00 -0.33 0.00 0.00 177.00 176.32 1rg9 h ALA 136 N -0.13 -0.05 -0.64 -1.55 0.00 -1.96 -3.20 119.26 111.73 1rg9 h ALA 136 Ca -0.47 -0.32 0.13 0.00 0.00 0.00 0.00 54.91 54.25 1rg9 h ALA 136 Cb 1.26 0.02 -0.12 0.00 0.00 0.00 0.00 17.79 18.95 1rg9 h ALA 136 CO 0.52 -0.17 -0.16 -1.35 0.00 0.00 0.00 179.25 178.08 1rg9 h PRO 137 N -0.76 -0.00 -0.49 0.00 0.11 -1.95 -0.83 132.00 128.07 1rg9 h PRO 137 Ca -0.01 0.00 -0.09 0.00 0.11 0.00 0.00 66.00 66.02 1rg9 h PRO 137 Cb 0.66 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.75 1rg9 h PRO 137 CO 0.01 -0.00 -0.05 0.97 -0.21 0.00 0.00 178.00 178.72 1rg9 h ILE 138 N -0.00 1.25 -0.97 4.15 6.09 -1.84 -2.20 117.51 124.00 1rg9 h ILE 138 Ca 0.31 -1.11 0.01 0.00 -1.37 0.00 0.00 64.86 62.70 1rg9 h ILE 138 Cb 0.47 0.93 -0.05 0.00 0.47 0.00 0.00 36.82 38.65 1rg9 h ILE 138 CO -0.66 0.39 0.64 0.71 -3.07 0.00 0.00 178.15 176.16 1rg9 h THR 139 N 0.77 1.25 0.07 2.19 1.35 -1.18 -1.75 112.91 115.61 1rg9 h THR 139 Ca 0.14 -0.45 -0.24 0.00 -0.55 0.00 0.00 66.41 65.31 1rg9 h THR 139 Cb 0.54 -0.18 -0.00 0.00 -1.73 0.00 0.00 68.15 66.78 1rg9 h THR 139 CO 0.03 0.24 -1.09 1.88 -0.25 0.00 0.00 175.52 176.33 1rg9 h TYR 140 N 1.31 0.42 -0.36 4.73 0.05 -1.16 -2.63 116.97 119.33 1rg9 h TYR 140 Ca 0.35 -0.28 -0.01 0.00 0.05 0.00 0.00 58.73 58.84 1rg9 h TYR 140 Cb -0.15 -0.03 -0.02 0.00 1.01 0.00 0.00 36.73 37.55 1rg9 h TYR 140 CO -0.00 1.16 0.18 0.00 -1.05 0.00 0.00 178.16 178.45 1rg9 h ALA 141 N 0.73 0.46 -0.51 3.88 0.00 -1.23 -0.86 119.26 121.74 1rg9 h ALA 141 Ca -0.09 -0.10 0.05 0.00 0.00 0.00 0.00 54.91 54.76 1rg9 h ALA 141 Cb 1.78 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 19.38 1rg9 h ALA 141 CO 0.17 0.02 0.25 0.45 0.00 0.00 0.00 179.25 180.15 1rg9 h HIS 142 N 0.44 0.46 -0.59 0.00 3.86 -1.35 -1.28 115.15 116.69 1rg9 h HIS 142 Ca 0.12 0.02 0.02 0.00 -1.16 0.00 0.00 60.37 59.37 1rg9 h HIS 142 Cb 0.11 -0.13 -0.03 0.00 1.06 0.00 0.00 27.41 28.42 1rg9 h HIS 142 CO -0.02 0.22 0.39 0.00 0.86 0.00 0.00 177.93 179.39 1rg9 h ARG 143 N 0.49 0.73 0.37 2.45 3.08 -1.05 -1.06 114.38 119.39 1rg9 h ARG 143 Ca 0.22 -0.04 -0.02 0.00 0.07 0.00 0.00 59.98 60.21 1rg9 h ARG 143 Cb 0.14 -0.16 0.00 0.00 0.08 0.00 0.00 29.97 30.03 1rg9 h ARG 143 CO -0.16 0.48 -0.18 -0.07 -1.07 0.00 0.00 179.97 178.97 1rg9 h LEU 144 N 0.75 -0.42 -1.13 3.04 3.38 0.02 0.08 115.31 121.03 1rg9 h LEU 144 Ca 0.23 -0.10 -0.07 0.00 0.09 0.00 0.00 57.88 58.03 1rg9 h LEU 144 Cb -0.00 0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.84 1rg9 h LEU 144 CO -0.06 -0.13 -0.11 -0.37 0.09 0.00 0.00 178.44 177.87 1rg9 h VAL 145 N -0.71 1.22 -0.66 1.22 -1.51 -1.35 -2.11 116.25 112.35 1rg9 h VAL 145 Ca -0.05 -0.97 -0.07 0.00 -1.23 0.00 0.00 66.70 64.38 1rg9 h VAL 145 Cb 0.50 1.12 -0.03 0.00 -2.13 0.00 0.00 31.29 30.75 1rg9 h VAL 145 CO 0.08 0.32 0.12 -0.61 -1.23 0.00 0.00 177.57 176.25 1rg9 h GLN 146 N 0.45 1.08 0.01 5.19 4.15 -1.13 -1.86 115.11 123.01 1rg9 h GLN 146 Ca 0.09 -0.28 -0.00 0.00 0.77 0.00 0.00 58.65 59.22 1rg9 h GLN 146 Cb 0.46 -0.13 0.00 0.00 0.21 0.00 0.00 27.48 28.02 1rg9 h GLN 146 CO 0.03 0.99 -0.00 -0.09 -1.93 0.00 0.00 178.83 177.82 1rg9 h ARG 147 N 1.00 -0.01 -0.96 1.69 9.65 -0.58 -2.14 114.38 123.03 1rg9 h ARG 147 Ca 0.20 0.00 0.19 0.00 -1.10 0.00 0.00 59.98 59.28 1rg9 h ARG 147 Cb 0.42 0.00 -0.11 0.00 -1.39 0.00 0.00 29.97 28.89 1rg9 h ARG 147 CO 0.01 0.18 0.55 0.37 2.80 0.00 0.00 179.97 183.88 1rg9 h GLN 148 N -0.21 0.65 -0.18 0.20 -0.00 -1.18 0.14 115.11 114.52 1rg9 h GLN 148 Ca -0.00 -0.04 -0.13 0.00 -0.00 0.00 0.00 58.65 58.48 1rg9 h GLN 148 Cb 0.20 -0.15 -0.01 0.00 0.00 0.00 0.00 27.48 27.52 1rg9 h GLN 148 CO 0.00 0.43 -0.43 0.00 0.00 0.00 0.00 178.83 178.83 1rg9 h ALA 149 N 1.65 0.93 0.03 3.38 0.00 -1.08 -2.47 119.26 121.70 1rg9 h ALA 149 Ca 0.57 -0.44 -0.23 0.00 0.00 0.00 0.00 54.91 54.81 1rg9 h ALA 149 Cb 0.93 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.62 1rg9 h ALA 149 CO -0.41 0.64 -0.98 1.49 0.00 0.00 0.00 179.25 179.99 1rg9 h GLU 150 N 0.35 0.30 0.00 0.00 4.81 -0.18 -1.47 114.58 118.39 1rg9 h GLU 150 Ca 0.03 -0.36 0.00 0.00 -0.13 0.00 0.00 59.36 58.90 1rg9 h GLU 150 Cb 0.90 0.11 0.00 0.00 0.63 0.00 0.00 28.75 30.39 1rg9 h GLU 150 CO 0.08 1.07 0.00 -0.24 -0.73 0.00 0.00 179.01 179.19 1rg9 h VAL 151 N 0.16 0.00 0.00 0.32 3.04 -0.86 -1.16 116.25 117.75 1rg9 h VAL 151 Ca -0.08 -0.47 -0.08 0.00 -1.01 0.00 0.00 66.70 65.06 1rg9 h VAL 151 Cb 1.63 1.39 -0.01 0.00 -2.01 0.00 0.00 31.29 32.29 1rg9 h VAL 151 CO 0.16 0.00 -0.49 -0.09 -1.01 0.00 0.00 177.57 176.14 1rg9 h ARG 152 N 0.00 0.00 -0.80 4.17 2.43 -1.30 -0.95 114.38 117.94 1rg9 h ARG 152 Ca 0.00 0.00 -0.04 0.00 -0.81 0.00 0.00 59.98 59.13 1rg9 h ARG 152 Cb 0.63 0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 30.14 1rg9 h ARG 152 CO 0.00 0.74 0.34 0.87 -1.51 0.00 0.00 179.97 180.40 1rg9 h LYS 153 N -1.00 1.19 0.00 0.20 1.57 -1.24 -2.22 116.57 115.07 1rg9 h LYS 153 Ca -0.12 -0.21 0.00 0.00 -1.87 0.00 0.00 60.65 58.45 1rg9 h LYS 153 Cb 0.90 -0.20 0.00 0.00 0.08 0.00 0.00 32.23 33.01 1rg9 h LYS 153 CO -0.07 0.95 0.00 0.27 -0.57 0.00 0.00 179.45 180.03 1rg9 n ASN 154 N -4.30 0.00 -0.01 0.86 0.23 -0.44 -4.87 115.26 106.73 1rg9 n ASN 154 Ca 0.07 0.04 -0.00 0.00 -0.53 0.00 0.00 54.58 54.16 1rg9 n ASN 154 Cb 0.17 -0.31 -0.00 0.00 -2.08 0.00 0.00 39.78 37.57 1rg9 n ASN 154 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1rg9 n GLY 155 N 0.53 0.43 0.15 4.83 0.00 -0.84 -4.92 105.19 105.37 1rg9 n GLY 155 Ca 0.10 -0.67 -0.12 0.00 0.00 0.00 0.00 46.02 45.32 1rg9 n GLY 155 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1rg9 h THR 156 N 0.00 1.29 -3.00 2.61 2.02 -1.51 -3.33 112.91 110.99 1rg9 h THR 156 Ca -0.00 -1.07 -0.62 0.00 0.77 0.00 0.00 66.41 65.49 1rg9 h THR 156 Cb 0.01 1.53 -0.41 0.00 -1.74 0.00 0.00 68.15 67.54 1rg9 h THR 156 CO 0.00 0.33 -0.66 -0.76 0.37 0.00 0.00 175.52 174.81 1rg9 s LEU 157 N -9.32 4.06 0.55 2.58 1.43 -0.46 -4.96 118.68 112.55 1rg9 s LEU 157 Ca -0.14 -3.53 0.36 0.00 -1.03 0.00 0.00 54.13 49.79 1rg9 s LEU 157 Cb 0.07 -1.40 1.97 0.00 0.03 0.00 0.00 46.19 46.86 1rg9 s LEU 157 CO 0.75 -0.13 2.11 1.55 0.23 0.00 0.00 176.35 180.86 1rg9 h PRO 158 N 5.67 0.00 -0.17 1.29 0.13 -1.82 -2.25 132.00 134.86 1rg9 h PRO 158 Ca 0.13 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.26 1rg9 h PRO 158 Cb 0.81 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.94 1rg9 h PRO 158 CO 0.64 0.00 0.00 -2.67 -0.23 0.00 0.00 178.00 175.74 1rg9 n TRP 159 N -2.79 0.21 -2.84 1.56 4.27 -1.26 -4.87 117.44 111.72 1rg9 n TRP 159 Ca -0.02 -0.11 -0.38 0.00 -3.89 0.00 0.00 57.50 53.10 1rg9 n TRP 159 Cb 0.07 0.00 -0.06 0.00 -1.36 0.00 0.00 31.31 29.96 1rg9 n TRP 159 CO 0.00 0.00 0.00 -0.51 -2.29 0.00 0.00 177.69 174.89 1rg9 s LEU 160 N -1.53 4.46 0.29 5.67 1.43 -0.85 -1.84 118.68 126.31 1rg9 s LEU 160 Ca 0.31 1.79 0.08 0.00 -1.03 0.00 0.00 54.13 55.28 1rg9 s LEU 160 Cb 0.17 -3.75 -0.04 0.00 0.03 0.00 0.00 46.19 42.61 1rg9 s LEU 160 CO 0.25 0.05 0.15 -0.13 0.23 0.00 0.00 176.35 176.90 1rg9 s ARG 161 N -1.67 2.61 0.18 1.70 3.00 -0.48 -4.92 118.95 119.36 1rg9 s ARG 161 Ca 0.45 -1.29 -0.16 0.00 0.00 0.00 0.00 55.73 54.72 1rg9 s ARG 161 Cb -0.21 -2.36 0.14 0.00 0.00 0.00 0.00 34.95 32.51 1rg9 s ARG 161 CO 0.26 0.28 1.65 -1.35 0.00 0.00 0.00 175.30 176.14 1rg9 h PRO 162 N 1.56 -0.01 -6.46 3.54 0.11 -1.90 -3.40 132.00 125.44 1rg9 h PRO 162 Ca -0.46 0.00 -0.53 0.00 0.11 0.00 0.00 66.00 65.13 1rg9 h PRO 162 Cb 1.25 0.00 0.03 0.00 0.11 0.00 0.00 31.00 32.39 1rg9 h PRO 162 CO 0.61 -0.00 1.13 0.34 -0.21 0.00 0.00 178.00 179.87 1rg9 s ASP 163 N -5.22 6.45 -0.11 -2.05 2.15 -1.24 -3.64 116.67 113.00 1rg9 s ASP 163 Ca -0.14 2.71 -0.30 0.00 0.43 0.00 0.00 52.55 55.24 1rg9 s ASP 163 Cb 0.16 -2.56 0.10 0.00 -0.30 0.00 0.00 42.92 40.33 1rg9 s ASP 163 CO 0.72 -1.01 0.86 0.00 -0.17 0.00 0.00 175.17 175.57 1rg9 s ALA 164 N 3.19 -1.86 0.02 3.66 0.00 -1.26 0.09 121.76 125.60 1rg9 s ALA 164 Ca 0.82 1.47 0.01 0.00 0.00 0.00 0.00 51.96 54.26 1rg9 s ALA 164 Cb -0.44 -0.40 -0.02 0.00 0.00 0.00 0.00 23.12 22.26 1rg9 s ALA 164 CO 0.37 -0.34 -0.04 0.15 0.00 0.00 0.00 175.76 175.90 1rg9 s LYS 165 N -1.18 0.35 -0.01 0.00 1.02 0.10 -0.71 119.74 119.31 1rg9 s LYS 165 Ca -0.05 -0.53 0.02 0.00 0.02 0.00 0.00 55.97 55.43 1rg9 s LYS 165 Cb -0.00 -0.08 -0.01 0.00 -0.52 0.00 0.00 37.83 37.22 1rg9 s LYS 165 CO 0.05 0.00 -0.08 -1.54 -0.92 0.00 0.00 175.35 172.87 1rg9 s SER 166 N -1.17 0.89 -0.01 2.83 1.04 0.38 -0.41 113.70 117.24 1rg9 s SER 166 Ca -0.10 -0.14 0.01 0.00 0.48 0.00 0.00 55.95 56.20 1rg9 s SER 166 Cb -0.08 -0.10 0.00 0.00 0.10 0.00 0.00 66.02 65.95 1rg9 s SER 166 CO -0.00 0.09 -0.03 -1.58 0.98 0.00 0.00 173.24 172.69 1rg9 s GLN 167 N -0.20 0.36 -0.03 4.02 0.74 0.90 -0.41 119.66 125.04 1rg9 s GLN 167 Ca 0.03 -0.10 -0.04 0.00 0.05 0.00 0.00 55.36 55.30 1rg9 s GLN 167 Cb -0.03 -0.39 0.01 0.00 1.10 0.00 0.00 33.01 33.70 1rg9 s GLN 167 CO -0.00 0.04 0.10 0.08 -0.55 0.00 0.00 175.29 174.95 1rg9 s VAL 168 N 0.18 0.02 -0.11 1.34 1.01 -1.00 0.16 120.40 122.00 1rg9 s VAL 168 Ca -0.02 -0.17 0.01 0.00 0.00 0.00 0.00 61.98 61.81 1rg9 s VAL 168 Cb -0.05 -0.20 0.02 0.00 0.00 0.00 0.00 36.38 36.15 1rg9 s VAL 168 CO -0.00 -0.09 -0.13 0.42 0.00 0.00 0.00 175.10 175.29 1rg9 s THR 169 N -0.27 1.36 0.33 3.92 -4.23 -0.85 -1.98 115.64 113.93 1rg9 s THR 169 Ca -0.03 -0.55 -0.00 0.00 -1.18 0.00 0.00 61.69 59.92 1rg9 s THR 169 Cb -0.02 -1.27 -0.04 0.00 1.34 0.00 0.00 72.50 72.51 1rg9 s THR 169 CO 0.00 0.42 0.55 -0.36 -0.54 0.00 0.00 174.62 174.68 1rg9 s PHE 170 N 1.12 3.50 -0.23 3.99 0.40 -0.47 -2.15 117.98 124.14 1rg9 s PHE 170 Ca -0.05 0.40 -0.11 0.00 -0.60 0.00 0.00 56.93 56.57 1rg9 s PHE 170 Cb -0.14 -1.93 -0.05 0.00 0.51 0.00 0.00 43.02 41.41 1rg9 s PHE 170 CO -0.03 0.13 0.19 -0.65 0.70 0.00 0.00 175.22 175.56 1rg9 s GLN 171 N -4.16 4.09 -0.23 0.44 -0.21 0.19 -2.77 119.66 117.01 1rg9 s GLN 171 Ca 0.41 -0.21 0.02 0.00 0.02 0.00 0.00 55.36 55.60 1rg9 s GLN 171 Cb -0.10 -3.53 0.04 0.00 1.00 0.00 0.00 33.01 30.42 1rg9 s GLN 171 CO 0.35 0.07 -0.14 0.71 -2.12 0.00 0.00 175.29 174.16 1rg9 s TYR 172 N 1.03 3.07 0.03 0.91 2.02 0.18 -1.28 117.35 123.32 1rg9 s TYR 172 Ca 0.09 -1.99 0.06 0.00 -0.37 0.00 0.00 57.07 54.86 1rg9 s TYR 172 Cb -0.13 -1.94 -0.02 0.00 -0.40 0.00 0.00 41.96 39.46 1rg9 s TYR 172 CO 0.04 -0.84 -0.18 0.34 -1.57 0.00 0.00 175.55 173.35 1rg9 s ASP 173 N 1.20 2.13 -1.42 2.29 3.68 -0.21 -0.13 116.67 124.21 1rg9 s ASP 173 Ca -0.03 -0.47 0.00 0.00 2.13 0.00 0.00 52.55 54.19 1rg9 s ASP 173 Cb -0.17 -0.18 0.00 0.00 -1.45 0.00 0.00 42.92 41.12 1rg9 s ASP 173 CO -0.08 0.13 0.00 -0.67 0.13 0.00 0.00 175.17 174.68 1rg9 n ASP 174 N 1.99 -4.51 0.00 -0.34 4.64 -1.02 -0.23 116.55 117.08 1rg9 n ASP 174 Ca -0.17 0.19 0.00 0.00 -1.38 0.00 0.00 54.79 53.43 1rg9 n ASP 174 Cb 0.54 -3.88 0.00 0.00 -1.04 0.00 0.00 41.12 36.74 1rg9 n ASP 174 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 1rg9 n GLY 175 N -0.72 0.57 3.62 0.27 0.00 -1.26 -4.99 105.19 102.68 1rg9 n GLY 175 Ca -0.18 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.59 1rg9 n GLY 175 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1rg9 s LYS 176 N -0.44 2.03 0.08 1.61 -0.14 0.68 -5.07 119.74 118.50 1rg9 s LYS 176 Ca 0.00 -1.83 -0.30 0.00 -1.36 0.00 0.00 55.97 52.48 1rg9 s LYS 176 Cb 0.00 -1.86 -0.05 0.00 -1.68 0.00 0.00 37.83 34.24 1rg9 s LYS 176 CO 0.00 0.10 1.03 0.42 -0.76 0.00 0.00 175.35 176.14 1rg9 s ILE 177 N -2.56 4.41 -0.06 2.17 1.09 -1.26 -1.05 121.20 123.94 1rg9 s ILE 177 Ca 0.35 1.89 0.06 0.00 -1.10 0.00 0.00 60.65 61.84 1rg9 s ILE 177 Cb 0.02 -4.21 -0.08 0.00 -1.06 0.00 0.00 42.46 37.13 1rg9 s ILE 177 CO 0.19 0.23 0.15 1.33 -0.10 0.00 0.00 174.94 176.74 1rg9 n VAL 178 N 3.20 0.00 -3.67 2.92 0.24 -0.40 -4.91 118.33 115.71 1rg9 n VAL 178 Ca 0.04 -0.18 0.00 0.00 -2.04 0.00 0.00 64.34 62.16 1rg9 n VAL 178 Cb 0.49 0.51 0.00 0.00 -1.47 0.00 0.00 33.84 33.37 1rg9 n VAL 178 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1rg9 n GLY 179 N 1.94 -0.97 2.90 7.63 0.00 -1.24 -4.77 105.19 110.68 1rg9 n GLY 179 Ca -0.01 -1.02 -0.26 0.00 0.00 0.00 0.00 46.02 44.73 1rg9 n GLY 179 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1rg9 s ILE 180 N -3.00 0.95 -0.08 -0.61 1.01 -0.31 0.57 121.20 119.73 1rg9 s ILE 180 Ca 0.00 -0.25 -0.15 0.00 0.00 0.00 0.00 60.65 60.25 1rg9 s ILE 180 Cb 0.00 -0.97 -0.11 0.00 0.01 0.00 0.00 42.46 41.39 1rg9 s ILE 180 CO 0.00 0.35 0.54 0.44 0.00 0.00 0.00 174.94 176.27 1rg9 h ASP 181 N 8.05 -0.16 -4.29 3.58 3.45 -1.73 -3.38 116.42 121.93 1rg9 h ASP 181 Ca -0.29 -0.26 -0.51 0.00 0.43 0.00 0.00 57.03 56.40 1rg9 h ASP 181 Cb 1.14 0.04 -0.26 0.00 -0.56 0.00 0.00 39.33 39.68 1rg9 h ASP 181 CO 0.40 0.42 -0.82 0.00 -1.57 0.00 0.00 179.24 177.67 1rg9 s ALA 182 N -3.18 1.41 -0.09 3.45 0.00 -1.25 0.46 121.76 122.56 1rg9 s ALA 182 Ca -0.09 -0.87 0.03 0.00 0.00 0.00 0.00 51.96 51.03 1rg9 s ALA 182 Cb -0.00 -0.28 0.01 0.00 0.00 0.00 0.00 23.12 22.85 1rg9 s ALA 182 CO 0.31 0.31 -0.17 0.08 0.00 0.00 0.00 175.76 176.29 1rg9 s VAL 183 N -0.71 1.52 -0.09 0.00 1.01 0.12 -2.00 120.40 120.26 1rg9 s VAL 183 Ca 0.05 -0.69 0.04 0.00 0.00 0.00 0.00 61.98 61.38 1rg9 s VAL 183 Cb -0.08 -1.36 -0.00 0.00 0.00 0.00 0.00 36.38 34.94 1rg9 s VAL 183 CO 0.01 0.44 -0.22 -0.69 0.00 0.00 0.00 175.10 174.64 1rg9 s VAL 184 N 0.67 1.90 -0.20 2.92 1.01 0.42 0.22 120.40 127.35 1rg9 s VAL 184 Ca -0.13 -0.94 -0.04 0.00 0.00 0.00 0.00 61.98 60.87 1rg9 s VAL 184 Cb -0.16 -1.65 0.09 0.00 0.00 0.00 0.00 36.38 34.66 1rg9 s VAL 184 CO 0.04 0.53 0.19 -0.22 0.00 0.00 0.00 175.10 175.64 1rg9 s LEU 185 N 0.29 -0.02 -0.16 3.92 1.98 0.08 -0.07 118.68 124.70 1rg9 s LEU 185 Ca -0.15 -0.30 -0.02 0.00 -2.89 0.00 0.00 54.13 50.77 1rg9 s LEU 185 Cb -0.17 0.26 -0.02 0.00 0.66 0.00 0.00 46.19 46.92 1rg9 s LEU 185 CO 0.07 -0.33 -0.08 -0.44 -1.89 0.00 0.00 176.35 173.68 1rg9 s SER 186 N 2.29 4.31 -0.02 3.68 0.01 0.45 -2.69 113.70 121.72 1rg9 s SER 186 Ca 0.06 -0.28 -0.01 0.00 1.31 0.00 0.00 55.95 57.02 1rg9 s SER 186 Cb -0.16 -1.69 0.01 0.00 0.21 0.00 0.00 66.02 64.39 1rg9 s SER 186 CO -0.11 0.12 0.06 0.28 0.41 0.00 0.00 173.24 173.99 1rg9 s THR 187 N 0.62 -0.02 0.60 1.44 -1.32 -1.26 0.02 115.64 115.73 1rg9 s THR 187 Ca -0.05 0.07 -0.18 0.00 -1.21 0.00 0.00 61.69 60.32 1rg9 s THR 187 Cb -0.15 -0.10 -0.03 0.00 -1.51 0.00 0.00 72.50 70.71 1rg9 s THR 187 CO 0.03 0.03 1.15 -1.58 -2.21 0.00 0.00 174.62 172.04 1rg9 s GLN 188 N 0.37 3.01 0.31 7.08 0.74 0.11 -4.81 119.66 126.47 1rg9 s GLN 188 Ca -0.03 1.62 -0.06 0.00 0.05 0.00 0.00 55.36 56.94 1rg9 s GLN 188 Cb -0.04 -1.96 0.00 0.00 1.10 0.00 0.00 33.01 32.11 1rg9 s GLN 188 CO -0.01 -1.13 0.47 -3.38 -0.55 0.00 0.00 175.29 170.69 1rg9 s HIS 189 N -1.89 0.80 0.49 1.67 -3.43 -0.60 -1.38 115.29 110.95 1rg9 s HIS 189 Ca 0.73 -1.10 -0.04 0.00 -0.80 0.00 0.00 55.06 53.85 1rg9 s HIS 189 Cb -0.25 0.03 -0.02 0.00 -1.43 0.00 0.00 32.58 30.91 1rg9 s HIS 189 CO 0.34 -1.09 0.77 -1.54 -2.00 0.00 0.00 174.74 171.22 1rg9 s SER 190 N -3.16 5.97 0.00 7.38 1.04 -0.77 -4.47 113.70 119.70 1rg9 s SER 190 Ca 0.28 0.67 0.16 0.00 0.48 0.00 0.00 55.95 57.53 1rg9 s SER 190 Cb -0.00 -1.90 0.93 0.00 0.10 0.00 0.00 66.02 65.14 1rg9 s SER 190 CO 0.16 -0.72 1.39 -0.62 0.98 0.00 0.00 173.24 174.43 1rg9 n GLU 191 N -2.26 0.44 0.04 4.02 -0.58 -1.26 -3.39 120.64 117.65 1rg9 n GLU 191 Ca 0.01 0.03 -0.07 0.00 -0.42 0.00 0.00 57.16 56.71 1rg9 n GLU 191 Cb 0.57 -1.50 -0.12 0.00 -0.57 0.00 0.00 31.44 29.81 1rg9 n GLU 191 CO 0.00 0.00 0.00 0.93 -0.48 0.00 0.00 177.13 177.58 1rg9 h GLU 192 N 0.00 0.00 -6.30 3.49 4.39 -1.96 -3.47 114.58 110.73 1rg9 h GLU 192 Ca 0.00 0.00 -0.62 0.00 0.34 0.00 0.00 59.36 59.08 1rg9 h GLU 192 Cb 0.03 0.00 -0.10 0.00 -0.10 0.00 0.00 28.75 28.58 1rg9 h GLU 192 CO 0.00 0.83 -0.64 -1.50 -1.16 0.00 0.00 179.01 176.55 1rg9 s ILE 193 N -2.69 4.07 0.38 3.13 2.07 -1.22 -5.13 121.20 121.81 1rg9 s ILE 193 Ca -0.01 -1.12 -0.04 0.00 -1.41 0.00 0.00 60.65 58.07 1rg9 s ILE 193 Cb 0.09 -3.00 -0.04 0.00 0.13 0.00 0.00 42.46 39.64 1rg9 s ILE 193 CO 0.82 0.00 0.65 1.51 -1.91 0.00 0.00 174.94 176.01 1rg9 s ASP 194 N -2.68 6.35 0.11 4.50 1.47 -1.26 -4.93 116.67 120.23 1rg9 s ASP 194 Ca 0.28 0.75 -0.32 0.00 1.18 0.00 0.00 52.55 54.44 1rg9 s ASP 194 Cb -0.11 -2.16 -0.11 0.00 -0.34 0.00 0.00 42.92 40.20 1rg9 s ASP 194 CO 0.20 -0.37 1.58 1.56 0.68 0.00 0.00 175.17 178.82 1rg9 h GLN 195 N 0.91 -0.67 0.09 2.11 1.08 -1.98 0.13 115.11 116.79 1rg9 h GLN 195 Ca -0.48 0.05 0.01 0.00 -1.45 0.00 0.00 58.65 56.78 1rg9 h GLN 195 Cb 1.20 0.15 -0.04 0.00 -0.05 0.00 0.00 27.48 28.74 1rg9 h GLN 195 CO 0.63 -0.45 -0.47 -0.22 -0.95 0.00 0.00 178.83 177.38 1rg9 h LYS 196 N -0.69 -0.63 -0.54 1.46 3.11 -1.98 1.09 116.57 118.39 1rg9 h LYS 196 Ca 0.01 0.04 0.09 0.00 -2.81 0.00 0.00 60.65 57.99 1rg9 h LYS 196 Cb 0.71 0.14 -0.11 0.00 -1.00 0.00 0.00 32.23 31.98 1rg9 h LYS 196 CO -0.25 -0.42 -0.38 0.77 -2.81 0.00 0.00 179.45 176.37 1rg9 h SER 197 N -0.66 -1.28 -0.30 4.20 0.02 -1.94 0.44 113.55 114.03 1rg9 h SER 197 Ca -0.00 0.23 0.07 0.00 -0.84 0.00 0.00 61.79 61.24 1rg9 h SER 197 Cb 0.67 0.60 -0.07 0.00 0.14 0.00 0.00 62.40 63.74 1rg9 h SER 197 CO -0.26 -0.32 -0.16 0.25 -1.14 0.00 0.00 176.83 175.19 1rg9 h LEU 198 N -0.21 -0.53 0.23 5.07 6.46 0.21 0.39 115.31 126.93 1rg9 h LEU 198 Ca 0.20 0.12 -0.00 0.00 -0.12 0.00 0.00 57.88 58.08 1rg9 h LEU 198 Cb 0.56 0.28 -0.01 0.00 -0.73 0.00 0.00 40.66 40.76 1rg9 h LEU 198 CO -0.65 -0.19 -0.19 1.56 -0.62 0.00 0.00 178.44 178.34 1rg9 h GLN 199 N -0.12 -0.42 -0.72 1.25 4.20 0.29 0.16 115.11 119.75 1rg9 h GLN 199 Ca 0.16 0.03 0.07 0.00 0.06 0.00 0.00 58.65 58.96 1rg9 h GLN 199 Cb 0.36 0.10 -0.05 0.00 0.30 0.00 0.00 27.48 28.19 1rg9 h GLN 199 CO -0.37 -0.28 0.47 1.49 -0.67 0.00 0.00 178.83 179.47 1rg9 h GLU 200 N -0.44 0.70 -0.07 1.46 4.57 0.26 -2.07 114.58 118.99 1rg9 h GLU 200 Ca -0.01 -0.04 -0.21 0.00 -1.18 0.00 0.00 59.36 57.92 1rg9 h GLU 200 Cb 0.39 -0.16 0.00 0.00 -0.16 0.00 0.00 28.75 28.83 1rg9 h GLU 200 CO -0.02 0.46 -0.82 0.00 -1.18 0.00 0.00 179.01 177.45 1rg9 h ALA 201 N 1.62 0.43 -0.49 2.92 0.00 0.28 -3.11 119.26 120.92 1rg9 h ALA 201 Ca 0.31 -0.64 -0.04 0.00 0.00 0.00 0.00 54.91 54.55 1rg9 h ALA 201 Cb 0.31 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 1rg9 h ALA 201 CO -0.11 0.75 0.14 0.28 0.00 0.00 0.00 179.25 180.31 1rg9 h VAL 202 N 0.34 1.20 0.24 0.00 2.07 -0.01 -1.49 116.25 118.61 1rg9 h VAL 202 Ca -0.06 -0.71 -0.01 0.00 0.82 0.00 0.00 66.70 66.74 1rg9 h VAL 202 Cb 1.43 0.68 0.00 0.00 -1.52 0.00 0.00 31.29 31.88 1rg9 h VAL 202 CO 0.15 0.26 -0.12 -0.03 0.02 0.00 0.00 177.57 177.86 1rg9 h MET 203 N 0.71 -0.31 0.10 1.57 -1.53 -1.42 0.18 114.93 114.23 1rg9 h MET 203 Ca 0.16 0.02 -0.00 0.00 -3.44 0.00 0.00 59.70 56.44 1rg9 h MET 203 Cb 0.24 0.07 0.00 0.00 -0.55 0.00 0.00 31.60 31.36 1rg9 h MET 203 CO -0.01 -0.05 -0.05 0.93 0.14 0.00 0.00 176.91 177.87 1rg9 h GLU 204 N -0.55 -0.13 0.17 0.39 4.39 -1.47 0.90 114.58 118.28 1rg9 h GLU 204 Ca -0.03 0.01 -0.31 0.00 0.34 0.00 0.00 59.36 59.37 1rg9 h GLU 204 Cb 0.41 0.03 0.01 0.00 -0.10 0.00 0.00 28.75 29.10 1rg9 h GLU 204 CO 0.05 0.05 -1.40 0.93 -1.16 0.00 0.00 179.01 177.48 1rg9 h GLU 205 N -0.28 0.37 0.00 2.33 3.07 -1.36 -3.35 114.58 115.35 1rg9 h GLU 205 Ca -0.01 -0.63 -0.24 0.00 -0.50 0.00 0.00 59.36 57.98 1rg9 h GLU 205 Cb 0.23 0.23 -0.04 0.00 -0.84 0.00 0.00 28.75 28.34 1rg9 h GLU 205 CO 0.02 1.28 -1.88 -0.89 -1.40 0.00 0.00 179.01 176.15 1rg9 n ILE 206 N -3.58 0.88 -0.08 3.13 5.41 0.50 -4.66 119.36 120.95 1rg9 n ILE 206 Ca -0.13 -0.30 -0.10 0.00 1.00 0.00 0.00 62.75 63.21 1rg9 n ILE 206 Cb 1.06 -1.27 -0.06 0.00 -0.71 0.00 0.00 39.64 38.66 1rg9 n ILE 206 CO 0.00 0.00 0.00 0.40 0.00 0.00 0.00 176.55 176.95 1rg9 h ILE 207 N -0.20 0.60 -0.91 1.39 2.04 -0.95 -3.29 117.51 116.18 1rg9 h ILE 207 Ca -0.36 -1.59 0.14 0.00 1.00 0.00 0.00 64.86 64.04 1rg9 h ILE 207 Cb 1.47 1.28 -0.09 0.00 -0.74 0.00 0.00 36.82 38.74 1rg9 h ILE 207 CO -0.12 0.20 0.53 0.11 0.00 0.00 0.00 178.15 178.87 1rg9 h LYS 208 N -1.00 0.75 0.00 2.37 6.56 0.61 0.62 116.57 126.48 1rg9 h LYS 208 Ca -0.10 -0.05 0.00 0.00 -1.06 0.00 0.00 60.65 59.44 1rg9 h LYS 208 Cb 0.72 -0.17 0.00 0.00 -0.57 0.00 0.00 32.23 32.21 1rg9 h LYS 208 CO -0.06 0.50 0.00 -1.35 -2.06 0.00 0.00 179.45 176.48 1rg9 h PRO 209 N 0.78 0.00 0.00 3.15 0.11 -1.75 -3.35 132.00 130.94 1rg9 h PRO 209 Ca 0.48 0.00 -0.33 0.00 0.11 0.00 0.00 66.00 66.26 1rg9 h PRO 209 Cb 0.60 0.00 -0.06 0.00 0.11 0.00 0.00 31.00 31.65 1rg9 h PRO 209 CO -0.32 0.00 -2.24 -0.89 -0.21 0.00 0.00 178.00 174.34 1rg9 n ILE 210 N -2.64 1.24 -2.97 4.15 2.08 -0.08 -4.93 119.36 116.22 1rg9 n ILE 210 Ca 0.03 -0.62 -0.40 0.00 0.56 0.00 0.00 62.75 62.32 1rg9 n ILE 210 Cb 0.36 -0.91 -0.04 0.00 -0.75 0.00 0.00 39.64 38.30 1rg9 n ILE 210 CO 0.00 0.00 0.00 -0.76 0.56 0.00 0.00 176.55 176.35 1rg9 s LEU 211 N -5.79 4.29 -0.01 1.39 1.02 0.01 -4.99 118.68 114.60 1rg9 s LEU 211 Ca -0.19 1.24 -0.34 0.00 0.02 0.00 0.00 54.13 54.85 1rg9 s LEU 211 Cb 0.06 -3.18 -0.13 0.00 0.02 0.00 0.00 46.19 42.97 1rg9 s LEU 211 CO 0.62 -0.20 1.78 -2.65 0.02 0.00 0.00 176.35 175.91 1rg9 n PRO 212 N 4.15 2.14 0.19 1.29 -0.02 -1.26 -4.83 135.00 136.66 1rg9 n PRO 212 Ca 0.01 0.78 0.18 0.00 -2.02 0.00 0.00 63.50 62.45 1rg9 n PRO 212 Cb 0.51 -2.60 0.81 0.00 -0.02 0.00 0.00 33.50 32.20 1rg9 n PRO 212 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1rg9 h ALA 213 N 8.09 1.81 -0.37 3.55 0.00 -1.93 -1.94 119.26 128.47 1rg9 h ALA 213 Ca -0.47 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.38 1rg9 h ALA 213 Cb 1.27 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.06 1rg9 h ALA 213 CO 0.93 -0.44 0.06 0.93 0.00 0.00 0.00 179.25 180.73 1rg9 h GLU 214 N 0.00 0.62 0.00 0.00 5.08 -2.01 -2.94 114.58 115.33 1rg9 h GLU 214 Ca 0.11 -0.17 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 1rg9 h GLU 214 Cb 0.75 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.93 1rg9 h GLU 214 CO -0.00 0.68 0.00 0.91 -1.00 0.00 0.00 179.01 179.60 1rg9 n TRP 215 N -4.55 0.00 -3.61 4.33 8.01 -0.73 -4.68 117.44 116.21 1rg9 n TRP 215 Ca -0.01 0.00 -0.37 0.00 -1.31 0.00 0.00 57.50 55.81 1rg9 n TRP 215 Cb 0.23 -0.37 -0.10 0.00 -2.01 0.00 0.00 31.31 29.06 1rg9 n TRP 215 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.69 176.17 1rg9 s LEU 216 N -2.75 4.08 0.29 -0.99 1.43 -1.11 -1.16 118.68 118.47 1rg9 s LEU 216 Ca 0.17 0.11 0.02 0.00 -1.03 0.00 0.00 54.13 53.40 1rg9 s LEU 216 Cb 0.15 -2.15 -0.04 0.00 0.03 0.00 0.00 46.19 44.18 1rg9 s LEU 216 CO 0.37 0.01 0.13 0.42 0.23 0.00 0.00 176.35 177.51 1rg9 s THR 217 N 1.35 0.46 -0.34 5.49 -4.23 -1.26 -4.96 115.64 112.15 1rg9 s THR 217 Ca 0.08 -2.00 0.14 0.00 -1.18 0.00 0.00 61.69 58.73 1rg9 s THR 217 Cb -0.14 -2.56 0.14 0.00 1.34 0.00 0.00 72.50 71.27 1rg9 s THR 217 CO 0.07 0.00 1.37 -1.20 -0.54 0.00 0.00 174.62 174.32 1rg9 n SER 218 N -0.75 0.35 0.05 3.99 7.64 -1.26 -1.40 113.62 122.24 1rg9 n SER 218 Ca 0.00 0.62 -0.20 0.00 1.01 0.00 0.00 58.87 60.30 1rg9 n SER 218 Cb 0.65 -0.64 -0.15 0.00 -1.01 0.00 0.00 64.21 63.06 1rg9 n SER 218 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1rg9 h ALA 219 N 1.74 -0.09 -1.04 -0.43 0.00 -1.94 -3.46 119.26 114.04 1rg9 h ALA 219 Ca 0.00 -0.70 -0.68 0.00 0.00 0.00 0.00 54.91 53.53 1rg9 h ALA 219 Cb 0.18 0.10 0.10 0.00 0.00 0.00 0.00 17.79 18.17 1rg9 h ALA 219 CO 0.00 0.39 -0.45 2.41 0.00 0.00 0.00 179.25 181.60 1rg9 n THR 220 N -4.10 1.82 -4.85 0.00 -1.04 -0.49 -4.95 114.28 100.66 1rg9 n THR 220 Ca -0.14 -0.45 -0.33 0.00 -2.04 0.00 0.00 64.05 61.09 1rg9 n THR 220 Cb 0.84 -0.04 -0.15 0.00 -1.82 0.00 0.00 70.33 69.16 1rg9 n THR 220 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 1rg9 s LYS 221 N -0.92 3.24 -0.16 -2.82 1.02 0.17 -4.95 119.74 115.31 1rg9 s LYS 221 Ca 0.66 -0.71 -0.04 0.00 0.02 0.00 0.00 55.97 55.91 1rg9 s LYS 221 Cb -0.95 -2.56 -0.03 0.00 -0.52 0.00 0.00 37.83 33.77 1rg9 s LYS 221 CO 0.56 0.26 -0.04 -0.06 -0.92 0.00 0.00 175.35 175.15 1rg9 s PHE 222 N 0.22 3.01 -0.33 3.18 0.40 -1.26 0.12 117.98 123.31 1rg9 s PHE 222 Ca -0.09 -0.37 0.00 0.00 -0.60 0.00 0.00 56.93 55.87 1rg9 s PHE 222 Cb -0.15 -1.97 0.08 0.00 0.51 0.00 0.00 43.02 41.48 1rg9 s PHE 222 CO 0.05 -0.09 0.05 -0.06 0.70 0.00 0.00 175.22 175.87 1rg9 s PHE 223 N 0.49 3.48 -0.27 0.36 0.08 0.13 -4.97 117.98 117.30 1rg9 s PHE 223 Ca -0.03 -2.40 0.01 0.00 0.12 0.00 0.00 56.93 54.63 1rg9 s PHE 223 Cb -0.14 -2.59 0.05 0.00 -0.57 0.00 0.00 43.02 39.77 1rg9 s PHE 223 CO 0.03 -0.90 -0.07 0.42 -0.10 0.00 0.00 175.22 174.59 1rg9 s ILE 224 N 1.10 2.50 -1.34 0.64 1.01 -1.26 -0.75 121.20 123.11 1rg9 s ILE 224 Ca 0.02 -1.47 -0.03 0.00 0.00 0.00 0.00 60.65 59.17 1rg9 s ILE 224 Cb -0.20 -2.42 -0.00 0.00 0.01 0.00 0.00 42.46 39.84 1rg9 s ILE 224 CO -0.04 -0.01 0.55 0.59 0.00 0.00 0.00 174.94 176.03 1rg9 n ASN 225 N 4.52 -1.26 -0.31 3.58 4.13 -1.10 -4.86 115.26 119.98 1rg9 n ASN 225 Ca -0.14 -0.95 0.14 0.00 1.68 0.00 0.00 54.58 55.30 1rg9 n ASN 225 Cb 0.43 -3.39 0.30 0.00 -1.54 0.00 0.00 39.78 35.58 1rg9 n ASN 225 CO 0.00 0.00 0.00 -0.65 0.28 0.00 0.00 177.26 176.89 1rg9 h PRO 226 N -1.85 0.12 0.00 3.52 0.11 -1.89 0.25 132.00 132.25 1rg9 h PRO 226 Ca -0.63 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.47 1rg9 h PRO 226 Cb 1.37 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.45 1rg9 h PRO 226 CO 0.59 0.08 0.12 0.25 -0.21 0.00 0.00 178.00 178.83 1rg9 n THR 227 N -5.32 0.90 -0.12 -1.15 -2.24 -1.26 -4.74 114.28 100.35 1rg9 n THR 227 Ca 0.22 0.73 0.00 0.00 -2.27 0.00 0.00 64.05 62.74 1rg9 n THR 227 Cb 0.73 -1.73 0.00 0.00 -2.10 0.00 0.00 70.33 67.23 1rg9 n THR 227 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1rg9 n GLY 228 N -1.29 1.22 3.63 3.38 0.00 0.87 -5.00 105.19 107.99 1rg9 n GLY 228 Ca -0.01 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.98 1rg9 n GLY 228 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1rg9 s ARG 229 N -0.54 0.59 -0.44 1.61 3.52 -1.25 -4.89 118.95 117.55 1rg9 s ARG 229 Ca 0.00 1.38 0.05 0.00 -0.13 0.00 0.00 55.73 57.03 1rg9 s ARG 229 Cb 0.00 0.69 0.18 0.00 -1.56 0.00 0.00 34.95 34.26 1rg9 s ARG 229 CO 0.00 -0.19 0.38 0.34 -0.81 0.00 0.00 175.30 175.02 1rg9 n PHE 230 N 5.19 -0.35 -0.05 5.12 7.35 -1.26 -4.88 117.46 128.58 1rg9 n PHE 230 Ca -0.14 -3.45 -0.03 0.00 -0.76 0.00 0.00 57.45 53.07 1rg9 n PHE 230 Cb 0.51 0.09 -0.11 0.00 0.35 0.00 0.00 39.48 40.33 1rg9 n PHE 230 CO 0.00 0.00 0.00 0.28 -0.76 0.00 0.00 176.76 176.28 1rg9 n VAL 231 N 2.57 0.67 -3.64 -2.13 0.31 -1.26 -1.56 118.33 113.28 1rg9 n VAL 231 Ca 0.28 -0.51 -0.37 0.00 -0.01 0.00 0.00 64.34 63.73 1rg9 n VAL 231 Cb 0.47 -0.41 -0.11 0.00 -0.91 0.00 0.00 33.84 32.88 1rg9 n VAL 231 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 1rg9 s ILE 232 N -2.53 5.07 0.00 2.52 1.01 -1.26 -4.65 121.20 121.36 1rg9 s ILE 232 Ca -0.06 0.09 0.00 0.00 0.00 0.00 0.00 60.65 60.67 1rg9 s ILE 232 Cb 0.06 -3.40 0.00 0.00 0.01 0.00 0.00 42.46 39.12 1rg9 s ILE 232 CO 0.57 0.28 0.00 0.61 0.00 0.00 0.00 174.94 176.40 1rg9 n GLY 233 N 4.95 4.26 7.00 6.18 0.00 -1.26 -4.70 105.19 121.62 1rg9 n GLY 233 Ca -0.15 -1.10 0.00 0.00 0.00 0.00 0.00 46.02 44.77 1rg9 n GLY 233 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1rg9 n GLY 234 N 0.00 -0.29 0.29 -0.02 0.00 -1.26 -2.82 105.19 101.09 1rg9 n GLY 234 Ca 0.00 -0.97 0.14 0.00 0.00 0.00 0.00 46.02 45.18 1rg9 n GLY 234 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1rg9 h PRO 235 N 0.00 0.00 -0.08 1.61 0.11 -1.89 0.74 132.00 132.49 1rg9 h PRO 235 Ca 0.00 0.00 -0.21 0.00 0.11 0.00 0.00 66.00 65.90 1rg9 h PRO 235 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.11 1rg9 h PRO 235 CO 0.00 0.00 -0.80 1.98 -0.21 0.00 0.00 178.00 178.97 1rg9 h MET 236 N 0.00 0.52 0.00 1.05 1.85 -1.80 -2.90 114.93 113.65 1rg9 h MET 236 Ca 0.00 -0.45 0.00 0.00 -0.61 0.00 0.00 59.70 58.64 1rg9 h MET 236 Cb 0.61 0.11 0.00 0.00 0.43 0.00 0.00 31.60 32.74 1rg9 h MET 236 CO 0.00 1.09 -1.21 0.41 -0.40 0.00 0.00 176.91 176.79 1rg9 n GLY 237 N 0.70 -1.32 3.57 1.39 0.00 0.14 -4.87 105.19 104.80 1rg9 n GLY 237 Ca -0.06 -0.32 -0.06 0.00 0.00 0.00 0.00 46.02 45.57 1rg9 n GLY 237 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1rg9 s ASP 238 N -4.89 -0.89 0.16 1.61 2.15 -0.51 -4.99 116.67 109.31 1rg9 s ASP 238 Ca -0.01 1.42 -0.32 0.00 0.43 0.00 0.00 52.55 54.07 1rg9 s ASP 238 Cb 0.11 1.50 -0.10 0.00 -0.30 0.00 0.00 42.92 44.13 1rg9 s ASP 238 CO 0.82 -0.23 1.65 0.00 -0.17 0.00 0.00 175.17 177.24 1rg9 s GLY 240 N 1.47 2.12 0.07 0.00 0.00 0.12 -4.57 107.32 106.52 1rg9 s GLY 240 Ca 0.73 -0.65 0.02 0.00 0.00 0.00 0.00 44.72 44.82 1rg9 s GLY 240 CO 0.32 -0.15 -0.07 -2.27 0.00 0.00 0.00 173.10 170.92 1rg9 s LEU 241 N -0.45 2.36 0.33 0.66 2.96 -1.26 0.16 118.68 123.43 1rg9 s LEU 241 Ca 0.12 -0.74 -0.27 0.00 -0.22 0.00 0.00 54.13 53.03 1rg9 s LEU 241 Cb -0.12 -0.14 -0.09 0.00 0.50 0.00 0.00 46.19 46.34 1rg9 s LEU 241 CO 0.02 -0.31 1.03 -0.89 -1.32 0.00 0.00 176.35 174.88 1rg9 s THR 242 N -2.28 3.80 -1.10 3.68 2.01 -0.80 -3.97 115.64 116.98 1rg9 s THR 242 Ca -0.01 1.58 -0.07 0.00 0.31 0.00 0.00 61.69 63.50 1rg9 s THR 242 Cb -0.04 -3.92 0.01 0.00 0.01 0.00 0.00 72.50 68.56 1rg9 s THR 242 CO -0.02 0.21 0.93 0.61 -0.69 0.00 0.00 174.62 175.66 1rg9 n GLY 243 N 0.80 -0.26 0.28 4.40 0.00 -1.26 -4.91 105.19 104.25 1rg9 n GLY 243 Ca 0.02 0.07 0.05 0.00 0.00 0.00 0.00 46.02 46.15 1rg9 n GLY 243 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1rg9 n ARG 244 N -4.08 2.59 -0.36 1.61 5.12 -1.25 -4.44 116.66 115.85 1rg9 n ARG 244 Ca 0.00 -2.04 0.08 0.00 -1.93 0.00 0.00 57.85 53.96 1rg9 n ARG 244 Cb 0.55 -1.28 0.17 0.00 -1.16 0.00 0.00 32.46 30.74 1rg9 n ARG 244 CO 0.00 0.00 0.00 1.63 -1.93 0.00 0.00 177.63 177.33 1rg9 n LYS 245 N -0.46 1.40 -0.25 5.56 4.01 -1.26 -4.89 118.16 122.27 1rg9 n LYS 245 Ca 0.09 -2.92 0.01 0.00 -0.51 0.00 0.00 58.31 54.98 1rg9 n LYS 245 Cb 0.46 -1.53 0.05 0.00 -0.51 0.00 0.00 35.03 33.51 1rg9 n LYS 245 CO 0.00 0.00 0.00 -0.89 -1.11 0.00 0.00 177.40 175.40 1rg9 n ILE 246 N -1.24 -0.33 -0.03 -0.18 5.41 -1.26 -0.95 119.36 120.78 1rg9 n ILE 246 Ca 0.17 1.57 -0.14 0.00 1.00 0.00 0.00 62.75 65.36 1rg9 n ILE 246 Cb 0.67 -2.12 -0.10 0.00 -0.71 0.00 0.00 39.64 37.39 1rg9 n ILE 246 CO 0.00 0.00 0.00 0.40 0.00 0.00 0.00 176.55 176.95 1rg9 h ILE 247 N 0.00 1.45 0.00 1.39 1.08 -1.98 -3.09 117.51 116.36 1rg9 h ILE 247 Ca 0.27 -1.55 -0.02 0.00 -0.39 0.00 0.00 64.86 63.18 1rg9 h ILE 247 Cb 0.44 2.34 -0.00 0.00 -3.07 0.00 0.00 36.82 36.53 1rg9 h ILE 247 CO -0.68 0.43 -0.07 -0.37 -0.69 0.00 0.00 178.15 176.76 1rg9 h VAL 248 N -0.34 0.26 0.00 1.67 -1.51 -1.71 -0.90 116.25 113.72 1rg9 h VAL 248 Ca -0.00 -0.54 -0.08 0.00 -1.23 0.00 0.00 66.70 64.85 1rg9 h VAL 248 Cb 0.77 1.42 -0.01 0.00 -2.13 0.00 0.00 31.29 31.34 1rg9 h VAL 248 CO 0.03 0.07 -0.37 0.44 -1.23 0.00 0.00 177.57 176.52 1rg9 h ASP 249 N 0.00 0.00 0.00 4.19 3.45 -1.03 -3.38 116.42 119.66 1rg9 h ASP 249 Ca -0.00 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.46 1rg9 h ASP 249 Cb 0.41 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.18 1rg9 h ASP 249 CO 0.01 0.37 0.00 0.35 -1.57 0.00 0.00 179.24 178.40 1rg9 n THR 250 N -3.63 0.00 -0.99 0.35 -2.24 -0.37 -1.17 114.28 106.23 1rg9 n THR 250 Ca -0.01 0.00 0.03 0.00 -2.27 0.00 0.00 64.05 61.80 1rg9 n THR 250 Cb 0.48 -0.64 0.04 0.00 -2.10 0.00 0.00 70.33 68.11 1rg9 n THR 250 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 1rg9 n TYR 251 N -0.73 0.00 -0.96 4.78 4.01 -1.12 -4.59 117.16 118.56 1rg9 n TYR 251 Ca 0.00 -0.42 0.00 0.00 -0.16 0.00 0.00 57.90 57.32 1rg9 n TYR 251 Cb 0.00 -0.07 0.00 0.00 -0.31 0.00 0.00 39.34 38.96 1rg9 n TYR 251 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1rg9 n GLY 252 N -0.54 0.32 0.00 2.72 0.00 -1.06 -2.76 105.19 103.87 1rg9 n GLY 252 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 1rg9 n GLY 252 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1rg9 n GLY 253 N -1.30 0.33 0.12 -0.02 0.00 -1.26 -4.51 105.19 98.55 1rg9 n GLY 253 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.89 1rg9 n GLY 253 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 1rg9 h MET 254 N 4.64 0.29 0.00 1.61 -1.53 -1.89 -3.45 114.93 114.60 1rg9 h MET 254 Ca 0.00 -0.17 -0.29 0.00 -3.44 0.00 0.00 59.70 55.80 1rg9 h MET 254 Cb 0.00 0.02 0.03 0.00 -0.55 0.00 0.00 31.60 31.09 1rg9 h MET 254 CO 0.00 0.74 -0.01 0.00 0.14 0.00 0.00 176.91 177.78 1rg9 n ALA 255 N -2.43 0.58 -1.99 0.39 0.00 -1.26 -5.13 120.51 110.66 1rg9 n ALA 255 Ca -0.07 -1.26 -0.22 0.00 0.00 0.00 0.00 53.44 51.89 1rg9 n ALA 255 Cb 0.38 0.31 0.07 0.00 0.00 0.00 0.00 19.45 20.20 1rg9 n ALA 255 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1rg9 s ARG 256 N -3.73 2.13 -0.09 0.00 3.00 -1.26 -5.00 118.95 113.99 1rg9 s ARG 256 Ca 0.38 -1.08 -0.13 0.00 0.00 0.00 0.00 55.73 54.90 1rg9 s ARG 256 Cb -0.03 -2.45 0.03 0.00 0.00 0.00 0.00 34.95 32.50 1rg9 s ARG 256 CO 0.25 -1.05 0.34 -1.58 0.00 0.00 0.00 175.30 173.26 1rg9 s HIS 257 N -2.90 -0.32 -0.19 -0.53 2.46 -1.26 -4.70 115.29 107.84 1rg9 s HIS 257 Ca 0.62 0.73 0.20 0.00 0.47 0.00 0.00 55.06 57.08 1rg9 s HIS 257 Cb -0.07 0.12 -0.05 0.00 -0.13 0.00 0.00 32.58 32.45 1rg9 s HIS 257 CO 0.41 -0.25 0.97 0.78 -2.47 0.00 0.00 174.74 174.18 1rg9 h GLY 258 N 5.04 0.00 0.00 1.59 0.00 -1.92 -3.48 103.07 104.30 1rg9 h GLY 258 Ca -0.27 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.06 1rg9 h GLY 258 CO 0.32 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.47 1rg9 n GLY 259 N 1.27 1.23 3.67 4.60 0.00 -1.26 -4.77 105.19 109.93 1rg9 n GLY 259 Ca -0.04 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.62 1rg9 n GLY 259 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1rg9 s GLY 260 N -1.71 1.98 0.79 -0.02 0.00 -1.26 -5.09 107.32 102.00 1rg9 s GLY 260 Ca 0.00 -0.81 -0.12 0.00 0.00 0.00 0.00 44.72 43.79 1rg9 s GLY 260 CO 0.00 0.26 1.13 0.00 0.00 0.00 0.00 173.10 174.48 1rg9 s ALA 261 N 0.73 2.51 -0.13 3.20 0.00 -1.26 -4.91 121.76 121.91 1rg9 s ALA 261 Ca 0.07 -0.44 -0.14 0.00 0.00 0.00 0.00 51.96 51.45 1rg9 s ALA 261 Cb -0.13 -3.02 -0.05 0.00 0.00 0.00 0.00 23.12 19.92 1rg9 s ALA 261 CO 0.02 -1.61 -0.28 1.19 0.00 0.00 0.00 175.76 175.08 1rg9 n PHE 262 N -3.31 0.00 -1.64 0.00 3.72 -1.26 -4.35 117.46 110.62 1rg9 n PHE 262 Ca 0.07 0.00 -0.44 0.00 -0.05 0.00 0.00 57.45 57.03 1rg9 n PHE 262 Cb 0.58 -0.42 -0.01 0.00 -0.94 0.00 0.00 39.48 38.69 1rg9 n PHE 262 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 1rg9 n SER 263 N -4.24 2.04 0.00 4.37 7.64 -1.26 -3.26 113.62 118.91 1rg9 n SER 263 Ca -0.13 1.19 0.00 0.00 1.01 0.00 0.00 58.87 60.94 1rg9 n SER 263 Cb 0.43 -1.38 0.00 0.00 -1.01 0.00 0.00 64.21 62.25 1rg9 n SER 263 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1rg9 n GLY 264 N 1.17 1.45 3.53 0.23 0.00 -1.26 -4.83 105.19 105.48 1rg9 n GLY 264 Ca 0.08 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.77 1rg9 n GLY 264 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1rg9 s LYS 265 N -0.70 2.56 0.83 1.61 1.02 -1.20 -0.66 119.74 123.20 1rg9 s LYS 265 Ca 0.00 -0.67 -0.12 0.00 0.02 0.00 0.00 55.97 55.21 1rg9 s LYS 265 Cb 0.00 -2.45 0.09 0.00 -0.52 0.00 0.00 37.83 34.95 1rg9 s LYS 265 CO 0.00 0.63 1.12 0.16 -0.92 0.00 0.00 175.35 176.34 1rg9 s ASP 266 N -0.89 4.24 0.63 2.83 1.47 -0.71 -4.92 116.67 119.32 1rg9 s ASP 266 Ca 0.13 1.15 0.34 0.00 1.18 0.00 0.00 52.55 55.35 1rg9 s ASP 266 Cb -0.11 -1.82 1.94 0.00 -0.34 0.00 0.00 42.92 42.59 1rg9 s ASP 266 CO 0.02 -2.11 2.19 -0.65 0.68 0.00 0.00 175.17 175.30 1rg9 h PRO 267 N -1.19 0.00 0.00 2.11 0.11 -1.91 -1.81 132.00 129.31 1rg9 h PRO 267 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1rg9 h PRO 267 Cb 1.29 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.40 1rg9 h PRO 267 CO 0.61 0.00 0.00 -1.13 -0.21 0.00 0.00 178.00 177.27 1rg9 n SER 268 N -3.42 0.00 -4.40 -2.05 3.41 -1.26 -4.26 113.62 101.64 1rg9 n SER 268 Ca -0.01 -0.01 -0.44 0.00 -0.26 0.00 0.00 58.87 58.14 1rg9 n SER 268 Cb 0.21 -0.20 -0.05 0.00 -0.26 0.00 0.00 64.21 63.90 1rg9 n SER 268 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 1rg9 s LYS 269 N -2.41 3.06 0.62 4.33 3.01 -0.68 -2.12 119.74 125.55 1rg9 s LYS 269 Ca 0.12 -1.19 0.28 0.00 -1.01 0.00 0.00 55.97 54.17 1rg9 s LYS 269 Cb 0.08 -4.20 1.44 0.00 -1.01 0.00 0.00 37.83 34.14 1rg9 s LYS 269 CO 0.16 -1.37 1.84 -0.39 0.51 0.00 0.00 175.35 176.10 1rg9 h VAL 270 N 5.89 0.21 -0.98 3.17 -1.51 -1.88 -0.51 116.25 120.64 1rg9 h VAL 270 Ca -0.29 0.00 0.11 0.00 -1.23 0.00 0.00 66.70 65.30 1rg9 h VAL 270 Cb 1.09 0.58 -0.08 0.00 -2.13 0.00 0.00 31.29 30.75 1rg9 h VAL 270 CO 1.03 0.00 0.62 0.44 -1.23 0.00 0.00 177.57 178.43 1rg9 h ASP 271 N 0.00 0.89 0.01 4.19 3.45 -1.92 -1.26 116.42 121.78 1rg9 h ASP 271 Ca 0.14 0.04 -0.37 0.00 0.43 0.00 0.00 57.03 57.27 1rg9 h ASP 271 Cb 1.11 -0.14 -0.05 0.00 -0.56 0.00 0.00 39.33 39.69 1rg9 h ASP 271 CO -0.00 0.49 -2.05 -1.14 -1.57 0.00 0.00 179.24 174.97 1rg9 n ARG 272 N -4.59 0.60 -0.08 3.56 0.63 -0.23 -4.05 116.66 112.51 1rg9 n ARG 272 Ca 0.18 0.36 -0.13 0.00 -0.92 0.00 0.00 57.85 57.34 1rg9 n ARG 272 Cb 0.35 -1.60 -0.05 0.00 0.45 0.00 0.00 32.46 31.60 1rg9 n ARG 272 CO 0.00 0.00 0.00 0.66 -2.51 0.00 0.00 177.63 175.78 1rg9 h SER 273 N -0.81 0.58 0.52 6.15 4.64 -1.52 -1.43 113.55 121.67 1rg9 h SER 273 Ca -0.55 -0.45 -0.10 0.00 -0.47 0.00 0.00 61.79 60.22 1rg9 h SER 273 Cb 1.57 -0.16 -0.01 0.00 -0.31 0.00 0.00 62.40 63.49 1rg9 h SER 273 CO -0.28 0.91 -0.48 0.00 -0.87 0.00 0.00 176.83 176.11 1rg9 h ALA 274 N 0.69 1.17 0.34 5.18 0.00 -1.47 -0.28 119.26 124.89 1rg9 h ALA 274 Ca 0.05 -0.44 -0.02 0.00 0.00 0.00 0.00 54.91 54.50 1rg9 h ALA 274 Cb 0.72 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.44 1rg9 h ALA 274 CO 0.05 0.60 -0.16 0.00 0.00 0.00 0.00 179.25 179.74 1rg9 h ALA 275 N 1.52 -0.46 -0.39 0.00 0.00 -1.52 -1.14 119.26 117.27 1rg9 h ALA 275 Ca -0.00 -0.18 0.06 0.00 0.00 0.00 0.00 54.91 54.79 1rg9 h ALA 275 Cb 0.87 0.18 -0.05 0.00 0.00 0.00 0.00 17.79 18.78 1rg9 h ALA 275 CO 0.06 -0.60 0.08 1.88 0.00 0.00 0.00 179.25 180.67 1rg9 h TYR 276 N -0.77 0.12 -0.18 0.00 0.05 -1.10 0.13 116.97 115.23 1rg9 h TYR 276 Ca -0.05 0.02 0.05 0.00 0.05 0.00 0.00 58.73 58.81 1rg9 h TYR 276 Cb 0.51 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.25 1rg9 h TYR 276 CO 0.02 0.01 0.13 0.00 -1.05 0.00 0.00 178.16 177.27 1rg9 h ALA 277 N 1.30 2.11 -0.01 3.88 0.00 -1.00 -0.69 119.26 124.84 1rg9 h ALA 277 Ca 0.19 -0.01 -0.19 0.00 0.00 0.00 0.00 54.91 54.90 1rg9 h ALA 277 Cb 0.23 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 1rg9 h ALA 277 CO -0.25 -0.23 -0.83 0.00 0.00 0.00 0.00 179.25 177.94 1rg9 h ALA 278 N 1.90 0.57 -0.05 0.00 0.00 0.33 -2.49 119.26 119.51 1rg9 h ALA 278 Ca 0.08 -0.69 -0.16 0.00 0.00 0.00 0.00 54.91 54.14 1rg9 h ALA 278 Cb 0.35 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 1rg9 h ALA 278 CO -0.00 0.88 -0.69 -0.09 0.00 0.00 0.00 179.25 179.35 1rg9 h ARG 279 N 0.13 0.25 -0.11 0.00 9.65 -0.55 -2.56 114.38 121.19 1rg9 h ARG 279 Ca -0.04 -0.20 0.02 0.00 -1.10 0.00 0.00 59.98 58.66 1rg9 h ARG 279 Cb 1.44 0.04 -0.02 0.00 -1.39 0.00 0.00 29.97 30.04 1rg9 h ARG 279 CO 0.13 0.84 0.01 -0.92 2.80 0.00 0.00 179.97 182.83 1rg9 h TYR 280 N 0.17 0.01 0.04 2.20 3.20 -0.97 0.76 116.97 122.38 1rg9 h TYR 280 Ca -0.02 0.01 -0.26 0.00 3.14 0.00 0.00 58.73 61.60 1rg9 h TYR 280 Cb 1.24 0.01 0.02 0.00 1.54 0.00 0.00 36.73 39.54 1rg9 h TYR 280 CO 0.03 -0.01 -1.05 -0.39 -1.64 0.00 0.00 178.16 175.11 1rg9 h VAL 281 N 0.05 1.30 0.07 1.81 -1.51 -1.49 -1.82 116.25 114.66 1rg9 h VAL 281 Ca 0.05 -2.30 0.02 0.00 -1.23 0.00 0.00 66.70 63.25 1rg9 h VAL 281 Cb 0.06 2.53 -0.03 0.00 -2.13 0.00 0.00 31.29 31.71 1rg9 h VAL 281 CO -0.08 0.70 -0.23 0.00 -1.23 0.00 0.00 177.57 176.72 1rg9 h ALA 282 N 0.34 -0.36 0.01 5.19 0.00 -1.38 0.65 119.26 123.71 1rg9 h ALA 282 Ca -0.14 -0.02 0.01 0.00 0.00 0.00 0.00 54.91 54.75 1rg9 h ALA 282 Cb 1.72 0.39 -0.01 0.00 0.00 0.00 0.00 17.79 19.89 1rg9 h ALA 282 CO 0.20 -0.75 -0.04 -0.22 0.00 0.00 0.00 179.25 178.44 1rg9 h LYS 283 N -0.41 -0.07 -0.26 0.00 3.64 -0.93 -2.22 116.57 116.32 1rg9 h LYS 283 Ca 0.04 0.00 0.05 0.00 -1.27 0.00 0.00 60.65 59.48 1rg9 h LYS 283 Cb 0.45 0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.28 1rg9 h LYS 283 CO -0.16 -0.05 0.18 -0.91 -2.27 0.00 0.00 179.45 176.24 1rg9 h ASN 284 N -0.07 0.10 -0.14 4.20 2.35 -0.66 0.35 115.58 121.71 1rg9 h ASN 284 Ca 0.01 -0.00 -0.05 0.00 -0.55 0.00 0.00 56.30 55.72 1rg9 h ASN 284 Cb 0.09 -0.02 -0.00 0.00 0.05 0.00 0.00 38.32 38.43 1rg9 h ASN 284 CO -0.03 0.07 -0.09 0.40 -1.65 0.00 0.00 177.43 176.12 1rg9 h ILE 285 N 0.12 1.33 -0.47 2.81 2.04 0.86 0.01 117.51 124.20 1rg9 h ILE 285 Ca 0.12 -1.17 -0.06 0.00 1.00 0.00 0.00 64.86 64.74 1rg9 h ILE 285 Cb 0.32 1.80 -0.02 0.00 -0.74 0.00 0.00 36.82 38.18 1rg9 h ILE 285 CO -0.01 0.34 0.04 0.58 0.00 0.00 0.00 178.15 179.10 1rg9 h VAL 286 N -0.04 1.26 -0.93 1.67 2.07 -0.86 -1.59 116.25 117.83 1rg9 h VAL 286 Ca 0.03 -0.98 -0.00 0.00 0.82 0.00 0.00 66.70 66.56 1rg9 h VAL 286 Cb 0.58 0.97 -0.05 0.00 -1.52 0.00 0.00 31.29 31.27 1rg9 h VAL 286 CO 0.03 0.34 0.57 0.00 0.02 0.00 0.00 177.57 178.53 1rg9 h ALA 287 N 0.94 1.26 0.00 1.67 0.00 -0.95 0.37 119.26 122.55 1rg9 h ALA 287 Ca 0.14 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1rg9 h ALA 287 Cb 0.44 -0.37 0.00 0.00 0.00 0.00 0.00 17.79 17.86 1rg9 h ALA 287 CO 0.02 0.65 0.00 0.00 0.00 0.00 0.00 179.25 179.91 1rg9 n ALA 288 N -2.40 1.55 -1.20 0.00 0.00 -0.02 -4.84 120.51 113.60 1rg9 n ALA 288 Ca 0.10 -0.04 -0.07 0.00 0.00 0.00 0.00 53.44 53.43 1rg9 n ALA 288 Cb 0.05 -1.17 -0.03 0.00 0.00 0.00 0.00 19.45 18.30 1rg9 n ALA 288 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1rg9 n GLY 289 N -0.43 0.89 0.01 0.00 0.00 0.13 -4.74 105.19 101.06 1rg9 n GLY 289 Ca 0.04 -0.51 0.14 0.00 0.00 0.00 0.00 46.02 45.68 1rg9 n GLY 289 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1rg9 n LEU 290 N -0.78 0.12 -3.56 0.99 4.77 -0.67 -4.78 117.00 113.09 1rg9 n LEU 290 Ca -0.07 0.47 -0.10 0.00 -0.03 0.00 0.00 56.01 56.28 1rg9 n LEU 290 Cb 0.27 -0.46 -0.04 0.00 -2.33 0.00 0.00 43.42 40.86 1rg9 n LEU 290 CO 0.10 -0.01 0.76 0.00 -1.33 0.00 0.00 177.39 176.92 1rg9 s ALA 291 N -3.01 -1.91 0.10 -1.18 0.00 -1.26 -0.46 121.76 114.05 1rg9 s ALA 291 Ca 0.13 1.43 0.08 0.00 0.00 0.00 0.00 51.96 53.60 1rg9 s ALA 291 Cb 0.18 -0.35 -0.18 0.00 0.00 0.00 0.00 23.12 22.77 1rg9 s ALA 291 CO 0.55 -0.43 1.30 -0.44 0.00 0.00 0.00 175.76 176.73 1rg9 h ASP 292 N 2.37 0.00 -3.26 0.00 3.45 -1.84 -3.37 116.42 113.77 1rg9 h ASP 292 Ca -0.19 0.00 0.01 0.00 0.43 0.00 0.00 57.03 57.28 1rg9 h ASP 292 Cb 1.18 0.00 -0.21 0.00 -0.56 0.00 0.00 39.33 39.74 1rg9 h ASP 292 CO 0.31 0.96 0.08 0.00 -1.57 0.00 0.00 179.24 179.02 1rg9 s ARG 293 N -2.74 0.72 -0.11 3.56 1.70 -1.26 -1.71 118.95 119.11 1rg9 s ARG 293 Ca 0.01 1.12 -0.11 0.00 -0.47 0.00 0.00 55.73 56.28 1rg9 s ARG 293 Cb 0.10 0.22 0.03 0.00 -0.57 0.00 0.00 34.95 34.72 1rg9 s ARG 293 CO 0.81 -0.13 0.31 0.00 -1.08 0.00 0.00 175.30 175.21 1rg9 s GLU 295 N 0.07 3.71 0.18 0.00 2.12 0.14 -2.54 118.70 122.38 1rg9 s GLU 295 Ca -0.01 -0.38 0.08 0.00 0.36 0.00 0.00 54.97 55.02 1rg9 s GLU 295 Cb -0.02 -3.07 -0.04 0.00 0.26 0.00 0.00 34.13 31.26 1rg9 s GLU 295 CO 0.01 0.37 -0.03 0.42 -0.54 0.00 0.00 175.26 175.48 1rg9 s ILE 296 N 0.07 3.51 -0.19 -3.70 -1.09 0.08 0.24 121.20 120.12 1rg9 s ILE 296 Ca 0.04 -1.54 -0.07 0.00 -2.23 0.00 0.00 60.65 56.84 1rg9 s ILE 296 Cb -0.13 -2.77 0.09 0.00 -1.58 0.00 0.00 42.46 38.07 1rg9 s ILE 296 CO 0.01 -0.13 0.42 -1.58 -1.23 0.00 0.00 174.94 172.43 1rg9 s GLN 297 N -2.96 0.34 0.27 2.79 0.74 -0.63 -0.22 119.66 119.99 1rg9 s GLN 297 Ca 0.27 1.00 0.12 0.00 0.05 0.00 0.00 55.36 56.79 1rg9 s GLN 297 Cb -0.09 0.27 -0.05 0.00 1.10 0.00 0.00 33.01 34.24 1rg9 s GLN 297 CO 0.17 -0.23 -0.20 0.14 -0.55 0.00 0.00 175.29 174.62 1rg9 s VAL 298 N 2.39 2.49 0.02 1.34 -7.23 -0.61 -1.74 120.40 117.07 1rg9 s VAL 298 Ca -0.03 -2.35 -0.02 0.00 -1.81 0.00 0.00 61.98 57.77 1rg9 s VAL 298 Cb -0.11 -2.29 -0.02 0.00 0.56 0.00 0.00 36.38 34.52 1rg9 s VAL 298 CO -0.13 -0.37 0.01 -0.94 -0.31 0.00 0.00 175.10 173.37 1rg9 s SER 299 N -3.42 0.23 0.28 4.85 1.04 -0.89 0.46 113.70 116.25 1rg9 s SER 299 Ca 0.29 -0.52 0.02 0.00 0.48 0.00 0.00 55.95 56.22 1rg9 s SER 299 Cb -0.05 0.14 -0.05 0.00 0.10 0.00 0.00 66.02 66.16 1rg9 s SER 299 CO 0.15 -0.37 0.12 -0.31 0.98 0.00 0.00 173.24 173.80 1rg9 s TYR 300 N -1.86 1.56 -0.07 5.02 1.51 0.30 -1.09 117.35 122.71 1rg9 s TYR 300 Ca -0.12 -1.25 0.02 0.00 -1.01 0.00 0.00 57.07 54.72 1rg9 s TYR 300 Cb -0.07 -0.89 0.01 0.00 -0.11 0.00 0.00 41.96 40.91 1rg9 s TYR 300 CO -0.02 -0.40 -0.13 0.00 -1.11 0.00 0.00 175.55 173.89 1rg9 s ALA 301 N -3.70 1.36 0.20 3.71 0.00 -1.26 -1.81 121.76 120.26 1rg9 s ALA 301 Ca 0.37 -0.48 -0.31 0.00 0.00 0.00 0.00 51.96 51.54 1rg9 s ALA 301 Cb 0.07 -0.61 -0.16 0.00 0.00 0.00 0.00 23.12 22.42 1rg9 s ALA 301 CO 0.15 0.10 1.01 1.51 0.00 0.00 0.00 175.76 178.53 1rg9 n ILE 302 N 3.85 1.34 -0.63 0.00 3.06 -1.21 -0.93 119.36 124.84 1rg9 n ILE 302 Ca -0.22 -0.34 0.00 0.00 -2.50 0.00 0.00 62.75 59.69 1rg9 n ILE 302 Cb 0.52 -0.70 0.00 0.00 0.54 0.00 0.00 39.64 40.00 1rg9 n ILE 302 CO 0.00 0.00 0.00 0.61 -2.50 0.00 0.00 176.55 174.66 1rg9 n GLY 303 N 1.75 0.62 3.52 4.50 0.00 -0.21 -4.86 105.19 110.51 1rg9 n GLY 303 Ca 0.14 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.82 1rg9 n GLY 303 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1rg9 s VAL 304 N -2.36 4.25 0.10 1.61 1.01 -0.11 -4.34 120.40 120.56 1rg9 s VAL 304 Ca 0.00 -0.22 -0.04 0.00 0.00 0.00 0.00 61.98 61.72 1rg9 s VAL 304 Cb 0.00 -2.92 -0.25 0.00 0.00 0.00 0.00 36.38 33.22 1rg9 s VAL 304 CO 0.00 0.44 1.20 0.00 0.00 0.00 0.00 175.10 176.74 1rg9 h ALA 305 N 7.15 0.19 -2.40 5.51 0.00 -1.78 -2.39 119.26 125.54 1rg9 h ALA 305 Ca -0.35 -0.82 -0.59 0.00 0.00 0.00 0.00 54.91 53.15 1rg9 h ALA 305 Cb 1.18 0.00 -0.09 0.00 0.00 0.00 0.00 17.79 18.88 1rg9 h ALA 305 CO 0.64 0.91 0.34 -2.00 0.00 0.00 0.00 179.25 179.14 1rg9 s GLU 306 N -2.87 4.22 0.15 0.00 2.56 -1.26 -3.73 118.70 117.77 1rg9 s GLU 306 Ca -0.05 0.86 -0.32 0.00 0.00 0.00 0.00 54.97 55.46 1rg9 s GLU 306 Cb 0.08 -3.61 -0.17 0.00 2.00 0.00 0.00 34.13 32.43 1rg9 s GLU 306 CO 0.88 -0.38 0.92 -2.30 -0.56 0.00 0.00 175.26 173.81 1rg9 n PRO 307 N 5.51 0.54 0.15 4.30 -0.02 -1.26 -4.79 135.00 139.43 1rg9 n PRO 307 Ca 0.03 0.19 0.12 0.00 -2.02 0.00 0.00 63.50 61.83 1rg9 n PRO 307 Cb 0.49 -1.51 0.26 0.00 -0.02 0.00 0.00 33.50 32.71 1rg9 n PRO 307 CO 0.00 0.00 0.00 1.79 1.98 0.00 0.00 175.50 179.27 1rg9 h THR 308 N 2.13 0.00 -1.88 3.45 1.35 -1.44 -3.47 112.91 113.05 1rg9 h THR 308 Ca -0.40 -0.73 0.01 0.00 -0.55 0.00 0.00 66.41 64.74 1rg9 h THR 308 Cb 1.39 1.66 -0.20 0.00 -1.73 0.00 0.00 68.15 69.27 1rg9 h THR 308 CO 0.64 0.00 0.35 -0.94 -0.25 0.00 0.00 175.52 175.32 1rg9 s SER 309 N -5.26 -0.52 -0.14 5.36 1.04 -1.20 -4.95 113.70 108.02 1rg9 s SER 309 Ca 0.08 0.52 -0.16 0.00 0.48 0.00 0.00 55.95 56.87 1rg9 s SER 309 Cb 0.09 0.44 0.04 0.00 0.10 0.00 0.00 66.02 66.69 1rg9 s SER 309 CO 0.65 -0.52 0.44 -0.63 0.98 0.00 0.00 173.24 174.17 1rg9 s ILE 310 N -1.36 0.01 -0.25 -1.02 1.01 -1.25 -2.09 121.20 116.24 1rg9 s ILE 310 Ca -0.06 -0.07 -0.17 0.00 0.00 0.00 0.00 60.65 60.35 1rg9 s ILE 310 Cb -0.00 -0.64 0.07 0.00 0.01 0.00 0.00 42.46 41.89 1rg9 s ILE 310 CO 0.05 -0.04 0.64 -0.32 0.00 0.00 0.00 174.94 175.27 1rg9 s MET 311 N -0.06 0.68 -0.11 2.79 1.75 -0.71 -4.99 119.30 118.66 1rg9 s MET 311 Ca -0.02 1.06 -0.01 0.00 -1.25 0.00 0.00 55.69 55.46 1rg9 s MET 311 Cb -0.03 0.20 -0.03 0.00 2.84 0.00 0.00 34.83 37.81 1rg9 s MET 311 CO 0.02 -0.13 -0.07 0.14 -0.65 0.00 0.00 175.02 174.33 1rg9 s VAL 312 N 1.17 3.66 -0.18 10.11 -7.23 -1.26 -1.60 120.40 125.08 1rg9 s VAL 312 Ca -0.07 -0.47 0.01 0.00 -1.81 0.00 0.00 61.98 59.65 1rg9 s VAL 312 Cb -0.05 -2.54 0.02 0.00 0.56 0.00 0.00 36.38 34.37 1rg9 s VAL 312 CO -0.12 0.55 -0.18 -0.70 -0.31 0.00 0.00 175.10 174.34 1rg9 s GLU 313 N -0.18 2.77 0.00 4.82 2.56 0.14 -4.97 118.70 123.83 1rg9 s GLU 313 Ca 0.02 -0.79 0.12 0.00 0.00 0.00 0.00 54.97 54.32 1rg9 s GLU 313 Cb -0.13 -2.47 0.21 0.00 2.00 0.00 0.00 34.13 33.74 1rg9 s GLU 313 CO 0.03 -0.24 1.07 0.25 -0.56 0.00 0.00 175.26 175.81 1rg9 n THR 314 N 4.65 0.48 -3.79 -1.70 -2.24 -1.26 0.23 114.28 110.65 1rg9 n THR 314 Ca -0.20 -0.74 -0.29 0.00 -2.27 0.00 0.00 64.05 60.55 1rg9 n THR 314 Cb 0.50 0.89 -0.00 0.00 -2.10 0.00 0.00 70.33 69.62 1rg9 n THR 314 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 1rg9 n PHE 315 N 0.65 -1.90 0.00 4.78 3.01 -1.26 -0.06 117.46 122.67 1rg9 n PHE 315 Ca 0.10 0.69 0.00 0.00 1.01 0.00 0.00 57.45 59.25 1rg9 n PHE 315 Cb 0.37 -3.21 0.00 0.00 -0.01 0.00 0.00 39.48 36.63 1rg9 n PHE 315 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1rg9 n GLY 316 N -1.38 2.26 0.00 1.37 0.00 -1.26 -4.81 105.19 101.38 1rg9 n GLY 316 Ca 0.03 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.09 1rg9 n GLY 316 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1rg9 n THR 317 N -1.88 0.00 -1.18 2.61 -2.24 0.91 -4.85 114.28 107.65 1rg9 n THR 317 Ca 0.00 0.00 -0.30 0.00 -2.27 0.00 0.00 64.05 61.48 1rg9 n THR 317 Cb 0.00 -0.30 0.12 0.00 -2.10 0.00 0.00 70.33 68.06 1rg9 n THR 317 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 1rg9 s GLU 318 N -2.00 1.59 0.00 -0.78 1.03 -1.25 -2.78 118.70 114.51 1rg9 s GLU 318 Ca 0.11 1.00 0.00 0.00 0.03 0.00 0.00 54.97 56.11 1rg9 s GLU 318 Cb 0.05 -1.83 0.00 0.00 -0.80 0.00 0.00 34.13 31.55 1rg9 s GLU 318 CO 0.09 -2.06 0.26 1.63 -1.33 0.00 0.00 175.26 173.84 1rg9 n LYS 319 N -3.79 2.13 -4.18 -4.83 4.76 0.40 -4.90 118.16 107.76 1rg9 n LYS 319 Ca 0.08 -0.26 -0.17 0.00 -2.87 0.00 0.00 58.31 55.09 1rg9 n LYS 319 Cb 0.54 -0.74 -0.15 0.00 -1.84 0.00 0.00 35.03 32.84 1rg9 n LYS 319 CO 0.00 0.00 0.00 0.14 -1.37 0.00 0.00 177.40 176.17 1rg9 s VAL 320 N -0.38 0.45 -0.06 -0.18 -7.23 -1.26 -5.08 120.40 106.67 1rg9 s VAL 320 Ca 0.00 -0.22 -0.38 0.00 -1.81 0.00 0.00 61.98 59.57 1rg9 s VAL 320 Cb 0.00 -0.40 -0.16 0.00 0.56 0.00 0.00 36.38 36.38 1rg9 s VAL 320 CO 0.00 0.14 1.57 -2.65 -0.31 0.00 0.00 175.10 173.85 1rg9 n PRO 321 N 3.11 1.34 -0.21 4.82 -0.02 -1.26 -4.68 135.00 138.09 1rg9 n PRO 321 Ca -0.15 0.49 0.12 0.00 -2.02 0.00 0.00 63.50 61.93 1rg9 n PRO 321 Cb 0.57 -2.17 0.23 0.00 -0.02 0.00 0.00 33.50 32.10 1rg9 n PRO 321 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 1rg9 n SER 322 N 4.06 -0.01 -0.06 2.55 7.64 -1.26 -1.01 113.62 125.54 1rg9 n SER 322 Ca 0.22 1.05 -0.02 0.00 1.01 0.00 0.00 58.87 61.13 1rg9 n SER 322 Cb 0.19 -0.41 -0.01 0.00 -1.01 0.00 0.00 64.21 62.96 1rg9 n SER 322 CO 0.00 0.00 0.00 1.21 -3.01 0.00 0.00 175.04 173.24 1rg9 n GLU 323 N -4.72 -0.06 0.26 1.43 2.13 -1.26 0.13 120.64 118.55 1rg9 n GLU 323 Ca 0.17 0.93 0.13 0.00 0.66 0.00 0.00 57.16 59.05 1rg9 n GLU 323 Cb 0.55 -1.39 0.71 0.00 0.27 0.00 0.00 31.44 31.58 1rg9 n GLU 323 CO 0.00 0.00 0.00 -0.56 -0.41 0.00 0.00 177.13 176.16 1rg9 h GLN 324 N 0.00 0.00 0.00 5.31 3.07 -1.41 -0.65 115.11 121.43 1rg9 h GLN 324 Ca 0.02 0.00 -0.11 0.00 0.09 0.00 0.00 58.65 58.65 1rg9 h GLN 324 Cb 0.06 0.00 -0.02 0.00 0.08 0.00 0.00 27.48 27.60 1rg9 h GLN 324 CO -0.14 0.12 -0.52 1.25 0.09 0.00 0.00 178.83 179.64 1rg9 h LEU 325 N 0.00 0.00 0.03 0.06 5.85 0.86 -0.50 115.31 121.60 1rg9 h LEU 325 Ca -0.00 0.00 -0.30 0.00 0.84 0.00 0.00 57.88 58.42 1rg9 h LEU 325 Cb 0.40 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 41.39 1rg9 h LEU 325 CO 0.02 0.52 -1.69 0.74 -0.34 0.00 0.00 178.44 177.68 1rg9 h THR 326 N 0.00 0.89 0.00 1.05 2.02 0.22 -3.13 112.91 113.96 1rg9 h THR 326 Ca -0.01 -2.70 0.00 0.00 0.77 0.00 0.00 66.41 64.47 1rg9 h THR 326 Cb 1.02 2.49 0.00 0.00 -1.74 0.00 0.00 68.15 69.92 1rg9 h THR 326 CO 0.07 0.61 0.00 -0.07 0.37 0.00 0.00 175.52 176.50 1rg9 h LEU 327 N 0.02 0.00 0.10 2.58 4.07 -1.12 -3.01 115.31 117.94 1rg9 h LEU 327 Ca -0.28 0.00 -0.30 0.00 0.08 0.00 0.00 57.88 57.38 1rg9 h LEU 327 Cb 2.00 0.00 0.03 0.00 1.08 0.00 0.00 40.66 43.77 1rg9 h LEU 327 CO 0.09 0.00 -1.23 0.25 -1.08 0.00 0.00 178.44 176.47 1rg9 h LEU 328 N 0.00 0.86 0.30 1.67 5.85 -1.16 -3.08 115.31 119.75 1rg9 h LEU 328 Ca 0.00 -0.79 -0.00 0.00 0.84 0.00 0.00 57.88 57.93 1rg9 h LEU 328 Cb 0.81 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 41.55 1rg9 h LEU 328 CO 0.00 1.59 -0.41 0.58 -0.34 0.00 0.00 178.44 179.86 1rg9 h VAL 329 N 0.28 0.00 0.00 1.05 2.07 -1.47 0.11 116.25 118.30 1rg9 h VAL 329 Ca -0.18 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.34 1rg9 h VAL 329 Cb 1.90 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 31.67 1rg9 h VAL 329 CO 0.23 0.00 0.00 -2.11 0.02 0.00 0.00 177.57 175.71 1rg9 n ARG 330 N -4.84 0.07 -0.01 1.57 -4.01 -1.22 -1.81 116.66 106.40 1rg9 n ARG 330 Ca -0.09 0.38 -0.17 0.00 -1.04 0.00 0.00 57.85 56.94 1rg9 n ARG 330 Cb 0.35 -1.66 -0.13 0.00 -3.04 0.00 0.00 32.46 27.98 1rg9 n ARG 330 CO 0.00 0.00 0.00 0.93 -3.04 0.00 0.00 177.63 175.52 1rg9 h GLU 331 N 0.00 0.15 0.15 2.89 5.08 -1.15 -3.40 114.58 118.30 1rg9 h GLU 331 Ca 0.00 -0.24 -0.28 0.00 -1.00 0.00 0.00 59.36 57.84 1rg9 h GLU 331 Cb 0.22 0.09 0.01 0.00 0.50 0.00 0.00 28.75 29.57 1rg9 h GLU 331 CO 0.00 1.09 -1.35 0.74 -1.00 0.00 0.00 179.01 178.49 1rg9 h PHE 332 N -0.67 0.59 -2.87 4.33 -1.00 -0.43 -3.48 116.94 113.41 1rg9 h PHE 332 Ca -0.06 -0.43 -0.60 0.00 2.81 0.00 0.00 57.97 59.69 1rg9 h PHE 332 Cb 1.27 -0.02 -0.08 0.00 3.61 0.00 0.00 35.95 40.72 1rg9 h PHE 332 CO 0.23 1.53 -0.59 -0.06 -1.61 0.00 0.00 178.31 177.81 1rg9 s PHE 333 N -2.50 3.13 -0.39 -0.55 0.08 -0.75 -5.09 117.98 111.90 1rg9 s PHE 333 Ca -0.16 -0.00 -0.09 0.00 0.12 0.00 0.00 56.93 56.79 1rg9 s PHE 333 Cb 0.04 -1.53 0.06 0.00 -0.57 0.00 0.00 43.02 41.02 1rg9 s PHE 333 CO 0.82 0.52 0.21 0.34 -0.10 0.00 0.00 175.22 177.01 1rg9 s ASP 334 N -2.87 5.58 0.00 1.36 3.68 -1.26 -4.62 116.67 118.53 1rg9 s ASP 334 Ca 0.30 -1.34 0.17 0.00 2.13 0.00 0.00 52.55 53.81 1rg9 s ASP 334 Cb -0.11 -1.96 0.51 0.00 -1.45 0.00 0.00 42.92 39.91 1rg9 s ASP 334 CO 0.22 -0.46 1.41 0.18 0.13 0.00 0.00 175.17 176.65 1rg9 n LEU 335 N 4.90 2.35 -4.77 -1.34 4.32 -1.26 -2.94 117.00 118.26 1rg9 n LEU 335 Ca -0.11 -1.10 -0.39 0.00 -0.02 0.00 0.00 56.01 54.39 1rg9 n LEU 335 Cb 0.44 -0.24 -0.03 0.00 -1.62 0.00 0.00 43.42 41.97 1rg9 n LEU 335 CO 0.37 0.55 0.82 -0.13 -1.22 0.00 0.00 177.39 177.77 1rg9 s ARG 336 N -1.52 4.33 0.10 3.23 0.52 -1.26 -4.74 118.95 119.60 1rg9 s ARG 336 Ca 0.32 1.80 -0.20 0.00 -0.52 0.00 0.00 55.73 57.13 1rg9 s ARG 336 Cb 0.17 -2.89 -0.04 0.00 0.52 0.00 0.00 34.95 32.71 1rg9 s ARG 336 CO 0.24 -0.07 1.06 -2.30 0.02 0.00 0.00 175.30 174.25 1rg9 n PRO 337 N 0.54 -0.28 -0.17 3.54 -0.01 -1.24 0.49 135.00 137.87 1rg9 n PRO 337 Ca 0.02 1.04 0.01 0.00 -0.01 0.00 0.00 63.50 64.56 1rg9 n PRO 337 Cb 0.46 -1.53 0.07 0.00 -0.01 0.00 0.00 33.50 32.49 1rg9 n PRO 337 CO 0.00 0.00 0.00 0.66 -0.01 0.00 0.00 175.50 176.15 1rg9 n TYR 338 N -4.67 0.41 -0.05 6.00 4.02 -1.26 -3.14 117.16 118.47 1rg9 n TYR 338 Ca 0.01 -0.20 -0.07 0.00 -0.01 0.00 0.00 57.90 57.64 1rg9 n TYR 338 Cb 0.17 -0.20 -0.04 0.00 -0.02 0.00 0.00 39.34 39.24 1rg9 n TYR 338 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1rg9 n GLY 339 N 0.12 -0.14 0.15 2.72 0.00 0.18 -4.48 105.19 103.74 1rg9 n GLY 339 Ca 0.06 -0.06 -0.05 0.00 0.00 0.00 0.00 46.02 45.97 1rg9 n GLY 339 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1rg9 h LEU 340 N 0.00 0.19 -0.77 0.99 4.07 -1.29 0.36 115.31 118.86 1rg9 h LEU 340 Ca -0.22 -0.12 -0.07 0.00 0.08 0.00 0.00 57.88 57.56 1rg9 h LEU 340 Cb 1.34 -0.06 -0.03 0.00 1.08 0.00 0.00 40.66 42.99 1rg9 h LEU 340 CO -0.03 0.80 0.17 0.40 -1.08 0.00 0.00 178.44 178.70 1rg9 h ILE 341 N 0.11 1.26 0.12 1.22 2.04 -1.81 0.19 117.51 120.64 1rg9 h ILE 341 Ca -0.01 -0.95 -0.28 0.00 1.00 0.00 0.00 64.86 64.62 1rg9 h ILE 341 Cb 1.19 0.55 0.03 0.00 -0.74 0.00 0.00 36.82 37.85 1rg9 h ILE 341 CO 0.10 0.37 -1.15 1.56 0.00 0.00 0.00 178.15 179.03 1rg9 h GLN 342 N 1.04 0.57 -1.00 2.37 1.08 -1.77 0.49 115.11 117.90 1rg9 h GLN 342 Ca 0.22 -0.77 0.18 0.00 -1.45 0.00 0.00 58.65 56.82 1rg9 h GLN 342 Cb 0.36 0.26 -0.10 0.00 -0.05 0.00 0.00 27.48 27.94 1rg9 h GLN 342 CO 0.00 1.34 0.61 1.98 -0.95 0.00 0.00 178.83 181.81 1rg9 h MET 343 N 0.17 0.77 -0.06 1.46 1.85 -0.59 -2.43 114.93 116.09 1rg9 h MET 343 Ca -0.18 -0.05 0.00 0.00 -0.61 0.00 0.00 59.70 58.87 1rg9 h MET 343 Cb 1.84 -0.17 0.00 0.00 0.43 0.00 0.00 31.60 33.70 1rg9 h MET 343 CO 0.22 0.51 0.00 1.28 -0.40 0.00 0.00 176.91 178.52 1rg9 n LEU 344 N -4.75 1.82 -3.60 3.39 4.77 0.03 -5.02 117.00 113.63 1rg9 n LEU 344 Ca 0.22 -1.26 -0.26 0.00 -0.03 0.00 0.00 56.01 54.68 1rg9 n LEU 344 Cb 0.54 -0.04 0.05 0.00 -2.33 0.00 0.00 43.42 41.63 1rg9 n LEU 344 CO 0.22 0.40 -0.06 -0.67 -1.33 0.00 0.00 177.39 175.96 1rg9 n ASP 345 N 0.30 -4.83 0.00 -1.43 -0.08 0.16 -4.84 116.55 105.83 1rg9 n ASP 345 Ca 0.05 -0.92 0.13 0.00 -1.51 0.00 0.00 54.79 52.53 1rg9 n ASP 345 Cb 0.22 -3.85 0.63 0.00 2.34 0.00 0.00 41.12 40.46 1rg9 n ASP 345 CO 0.00 0.00 0.00 0.18 0.12 0.00 0.00 177.20 177.50 1rg9 n LEU 346 N -4.00 0.00 -1.78 -2.67 4.77 -0.46 -4.37 117.00 108.48 1rg9 n LEU 346 Ca -0.13 0.33 -0.04 0.00 -0.03 0.00 0.00 56.01 56.15 1rg9 n LEU 346 Cb 0.61 -0.33 -0.05 0.00 -2.33 0.00 0.00 43.42 41.33 1rg9 n LEU 346 CO 0.66 -0.05 1.02 0.18 -1.33 0.00 0.00 177.39 177.88 1rg9 n LEU 347 N -1.33 4.27 -4.11 2.23 7.99 -1.26 -4.77 117.00 120.02 1rg9 n LEU 347 Ca 0.11 -2.20 -0.08 0.00 -0.01 0.00 0.00 56.01 53.83 1rg9 n LEU 347 Cb 0.22 -0.99 -0.10 0.00 -0.11 0.00 0.00 43.42 42.44 1rg9 n LEU 347 CO 0.21 0.98 -0.37 -1.00 -1.51 0.00 0.00 177.39 175.70 1rg9 s HIS 348 N 0.76 0.63 -1.13 -1.77 3.76 -1.26 -4.77 115.29 111.51 1rg9 s HIS 348 Ca 0.20 -1.03 -0.17 0.00 -0.15 0.00 0.00 55.06 53.90 1rg9 s HIS 348 Cb 0.09 -0.43 0.12 0.00 1.11 0.00 0.00 32.58 33.47 1rg9 s HIS 348 CO 0.00 -0.32 1.44 -1.25 -0.85 0.00 0.00 174.74 173.76 1rg9 s PRO 349 N -3.90 3.87 -0.03 8.40 0.04 -1.26 -4.55 135.00 137.57 1rg9 s PRO 349 Ca 0.09 -2.00 0.04 0.00 0.04 0.00 0.00 61.00 59.16 1rg9 s PRO 349 Cb 0.07 -5.19 0.06 0.00 0.04 0.00 0.00 34.50 29.48 1rg9 s PRO 349 CO -0.08 -1.96 0.90 0.44 0.04 0.00 0.00 177.00 176.33 1rg9 n ILE 350 N 5.63 0.77 -0.05 0.56 -5.35 -1.26 -4.88 119.36 114.79 1rg9 n ILE 350 Ca 0.36 -0.85 -0.13 0.00 -0.27 0.00 0.00 62.75 61.86 1rg9 n ILE 350 Cb 0.46 0.48 -0.14 0.00 -1.74 0.00 0.00 39.64 38.70 1rg9 n ILE 350 CO 0.00 0.00 0.00 -1.22 -1.76 0.00 0.00 176.55 173.57 1rg9 n TYR 351 N -0.49 0.69 -0.15 4.28 4.01 -1.26 -4.29 117.16 119.95 1rg9 n TYR 351 Ca 0.03 0.21 -0.08 0.00 -0.16 0.00 0.00 57.90 57.90 1rg9 n TYR 351 Cb 0.46 -1.11 -0.03 0.00 -0.31 0.00 0.00 39.34 38.35 1rg9 n TYR 351 CO 0.00 0.00 0.00 -0.22 -0.46 0.00 0.00 176.86 176.18 1rg9 h LYS 352 N 0.02 -0.26 -0.67 -0.72 3.64 -1.90 0.65 116.57 117.33 1rg9 h LYS 352 Ca -0.42 0.02 0.19 0.00 -1.27 0.00 0.00 60.65 59.18 1rg9 h LYS 352 Cb 2.06 0.06 -0.03 0.00 -0.41 0.00 0.00 32.23 33.92 1rg9 h LYS 352 CO 0.05 -0.17 0.78 1.49 -2.27 0.00 0.00 179.45 179.33 1rg9 h GLU 353 N -0.27 0.00 -0.00 1.90 4.81 -1.93 0.72 114.58 119.80 1rg9 h GLU 353 Ca 0.17 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.40 1rg9 h GLU 353 Cb 0.57 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.95 1rg9 h GLU 353 CO -0.60 0.00 -0.34 -2.37 -0.73 0.00 0.00 179.01 174.97 1rg9 n THR 354 N -3.47 0.00 0.88 0.32 5.66 0.23 -4.27 114.28 113.62 1rg9 n THR 354 Ca 0.14 -0.01 0.10 0.00 -3.05 0.00 0.00 64.05 61.24 1rg9 n THR 354 Cb 1.02 0.03 0.50 0.00 -1.55 0.00 0.00 70.33 70.32 1rg9 n THR 354 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1rg9 n ALA 355 N -1.46 2.04 -2.91 1.79 0.00 0.25 -4.39 120.51 115.83 1rg9 n ALA 355 Ca 0.06 -0.09 -0.12 0.00 0.00 0.00 0.00 53.44 53.29 1rg9 n ALA 355 Cb 0.33 -1.34 -0.14 0.00 0.00 0.00 0.00 19.45 18.30 1rg9 n ALA 355 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1rg9 s ALA 356 N -2.77 -0.03 -0.56 0.00 0.00 -1.26 -4.53 121.76 112.60 1rg9 s ALA 356 Ca 0.16 0.05 -0.03 0.00 0.00 0.00 0.00 51.96 52.13 1rg9 s ALA 356 Cb 0.14 -0.03 0.00 0.00 0.00 0.00 0.00 23.12 23.23 1rg9 s ALA 356 CO 0.35 -0.01 0.49 0.66 0.00 0.00 0.00 175.76 177.25 1rg9 n TYR 357 N 3.11 -1.17 0.00 0.00 4.01 -1.26 -4.92 117.16 116.93 1rg9 n TYR 357 Ca -0.13 0.42 0.00 0.00 -0.16 0.00 0.00 57.90 58.04 1rg9 n TYR 357 Cb 0.60 -2.78 0.00 0.00 -0.31 0.00 0.00 39.34 36.85 1rg9 n TYR 357 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1rg9 n GLY 358 N -1.12 -2.21 0.02 2.72 0.00 -1.26 -4.85 105.19 98.49 1rg9 n GLY 358 Ca -0.01 -1.23 0.12 0.00 0.00 0.00 0.00 46.02 44.89 1rg9 n GLY 358 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1rg9 n HIS 359 N -0.54 0.18 -4.33 1.61 8.25 -0.32 -4.87 115.22 115.20 1rg9 n HIS 359 Ca 0.00 0.05 -0.24 0.00 -0.26 0.00 0.00 57.72 57.28 1rg9 n HIS 359 Cb 0.00 -0.36 -0.12 0.00 1.12 0.00 0.00 29.99 30.64 1rg9 n HIS 359 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 1rg9 s PHE 360 N -3.10 1.91 0.00 4.41 0.08 -1.26 -4.75 117.98 115.27 1rg9 s PHE 360 Ca 0.07 -0.43 0.00 0.00 0.12 0.00 0.00 56.93 56.69 1rg9 s PHE 360 Cb 0.16 -0.99 0.00 0.00 -0.57 0.00 0.00 43.02 41.62 1rg9 s PHE 360 CO 0.76 0.31 0.00 0.41 -0.10 0.00 0.00 175.22 176.60 1rg9 n GLY 361 N 0.62 2.64 3.41 4.36 0.00 -1.26 -5.04 105.19 109.92 1rg9 n GLY 361 Ca -0.16 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.42 1rg9 n GLY 361 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1rg9 s ARG 362 N -0.44 3.50 0.63 1.61 1.81 -1.26 -4.91 118.95 119.88 1rg9 s ARG 362 Ca 0.00 -1.81 0.14 0.00 -1.72 0.00 0.00 55.73 52.34 1rg9 s ARG 362 Cb 0.00 -4.68 0.76 0.00 -0.45 0.00 0.00 34.95 30.59 1rg9 s ARG 362 CO 0.00 -1.63 1.41 0.93 -0.68 0.00 0.00 175.30 175.33 1rg9 h GLU 363 N 8.68 0.00 -0.00 3.54 4.39 -1.96 0.14 114.58 129.36 1rg9 h GLU 363 Ca 0.06 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.76 1rg9 h GLU 363 Cb 1.04 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.69 1rg9 h GLU 363 CO 1.03 0.00 -0.15 -2.39 -1.16 0.00 0.00 179.01 176.34 1rg9 n HIS 364 N -2.60 0.00 -2.52 4.33 1.44 -1.26 -4.14 115.22 110.47 1rg9 n HIS 364 Ca -0.01 0.00 -0.38 0.00 -2.01 0.00 0.00 57.72 55.32 1rg9 n HIS 364 Cb 0.67 -0.28 -0.04 0.00 0.12 0.00 0.00 29.99 30.46 1rg9 n HIS 364 CO 0.00 0.00 0.00 -0.06 -2.81 0.00 0.00 176.34 173.47 1rg9 s PHE 365 N -2.71 3.40 0.48 -1.40 0.08 0.48 -4.93 117.98 113.37 1rg9 s PHE 365 Ca 0.22 1.67 0.20 0.00 0.12 0.00 0.00 56.93 59.14 1rg9 s PHE 365 Cb 0.19 -3.19 1.22 0.00 -0.57 0.00 0.00 43.02 40.67 1rg9 s PHE 365 CO 0.53 -0.58 1.95 -1.35 -0.10 0.00 0.00 175.22 175.67 1rg9 h PRO 366 N 3.05 0.21 -0.00 0.24 0.11 -1.88 -1.70 132.00 132.03 1rg9 h PRO 366 Ca -0.48 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1rg9 h PRO 366 Cb 1.21 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1rg9 h PRO 366 CO 0.64 0.14 -0.16 -2.67 -0.21 0.00 0.00 178.00 175.75 1rg9 n TRP 367 N -4.43 0.00 0.29 0.65 2.14 -1.26 -3.45 117.44 111.38 1rg9 n TRP 367 Ca 0.12 0.00 0.11 0.00 2.07 0.00 0.00 57.50 59.81 1rg9 n TRP 367 Cb 0.58 -0.28 0.02 0.00 -0.81 0.00 0.00 31.31 30.82 1rg9 n TRP 367 CO 0.00 0.00 0.00 0.39 2.07 0.00 0.00 177.69 180.15 1rg9 n GLU 368 N -1.21 0.48 -2.15 -2.67 -0.58 -0.64 -3.86 120.64 110.00 1rg9 n GLU 368 Ca 0.11 0.05 -0.38 0.00 -0.42 0.00 0.00 57.16 56.52 1rg9 n GLU 368 Cb 0.30 -1.72 -0.00 0.00 -0.57 0.00 0.00 31.44 29.46 1rg9 n GLU 368 CO 0.00 0.00 0.00 0.15 -0.48 0.00 0.00 177.13 176.80 1rg9 s LYS 369 N -3.30 3.72 -0.52 3.49 -0.14 -1.20 -4.85 119.74 116.94 1rg9 s LYS 369 Ca 0.01 1.92 0.03 0.00 -1.36 0.00 0.00 55.97 56.58 1rg9 s LYS 369 Cb 0.12 -2.47 0.14 0.00 -1.68 0.00 0.00 37.83 33.94 1rg9 s LYS 369 CO 0.79 -0.62 0.30 0.95 -0.76 0.00 0.00 175.35 176.01 1rg9 s THR 370 N -1.44 2.09 -0.18 2.17 -4.23 -1.26 -4.84 115.64 107.95 1rg9 s THR 370 Ca 0.63 -3.20 0.09 0.00 -1.18 0.00 0.00 61.69 58.03 1rg9 s THR 370 Cb -0.32 -2.44 -0.17 0.00 1.34 0.00 0.00 72.50 70.91 1rg9 s THR 370 CO 0.40 -0.90 -0.04 -0.90 -0.54 0.00 0.00 174.62 172.63 1rg9 n ASP 371 N 3.02 1.62 0.00 3.99 5.68 -1.26 -4.43 116.55 125.18 1rg9 n ASP 371 Ca 0.11 -0.05 0.10 0.00 -0.50 0.00 0.00 54.79 54.45 1rg9 n ASP 371 Cb 0.34 0.39 0.46 0.00 -1.14 0.00 0.00 41.12 41.18 1rg9 n ASP 371 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 1rg9 n LYS 372 N -2.80 0.07 0.10 0.11 5.02 -1.26 -4.07 118.16 115.33 1rg9 n LYS 372 Ca -0.30 0.13 -0.06 0.00 -2.02 0.00 0.00 58.31 56.06 1rg9 n LYS 372 Cb 0.96 -1.50 -0.03 0.00 -0.02 0.00 0.00 35.03 34.44 1rg9 n LYS 372 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1rg9 h ALA 373 N 2.77 -0.91 -1.04 7.82 0.00 -1.77 0.87 119.26 127.00 1rg9 h ALA 373 Ca 0.00 -0.06 0.27 0.00 0.00 0.00 0.00 54.91 55.12 1rg9 h ALA 373 Cb 0.32 0.36 -0.08 0.00 0.00 0.00 0.00 17.79 18.39 1rg9 h ALA 373 CO 0.00 -0.91 0.69 1.96 0.00 0.00 0.00 179.25 180.98 1rg9 h GLN 374 N -0.33 0.31 0.01 0.00 7.50 -1.89 0.75 115.11 121.47 1rg9 h GLN 374 Ca -0.02 -0.02 -0.21 0.00 0.50 0.00 0.00 58.65 58.90 1rg9 h GLN 374 Cb 0.28 -0.07 -0.03 0.00 0.05 0.00 0.00 27.48 27.71 1rg9 h GLN 374 CO -0.01 0.21 -0.98 -0.07 -1.50 0.00 0.00 178.83 176.48 1rg9 h LEU 375 N 0.32 0.03 -0.56 1.46 3.38 -1.69 -2.06 115.31 116.20 1rg9 h LEU 375 Ca 0.57 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.51 1rg9 h LEU 375 Cb 1.59 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 42.33 1rg9 h LEU 375 CO -0.24 0.99 0.00 -0.07 0.09 0.00 0.00 178.44 179.21 1rg9 h LEU 376 N 0.01 0.00 0.05 1.67 3.38 0.68 -2.81 115.31 118.29 1rg9 h LEU 376 Ca -0.02 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.83 1rg9 h LEU 376 Cb 1.72 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.47 1rg9 h LEU 376 CO 0.13 0.00 -0.59 0.03 0.09 0.00 0.00 178.44 178.10 1rg9 h ARG 377 N 0.00 0.10 -1.04 1.13 3.08 -0.08 -3.32 114.38 114.26 1rg9 h ARG 377 Ca 0.00 -0.17 0.26 0.00 0.07 0.00 0.00 59.98 60.14 1rg9 h ARG 377 Cb 0.51 0.06 -0.09 0.00 0.08 0.00 0.00 29.97 30.53 1rg9 h ARG 377 CO 0.00 1.08 0.67 -0.44 -1.07 0.00 0.00 179.97 180.21 1rg9 h ASP 378 N -0.76 0.44 0.00 7.04 3.45 -1.12 0.40 116.42 125.87 1rg9 h ASP 378 Ca -0.13 0.08 0.00 0.00 0.43 0.00 0.00 57.03 57.41 1rg9 h ASP 378 Cb 1.30 0.01 0.00 0.00 -0.56 0.00 0.00 39.33 40.08 1rg9 h ASP 378 CO 0.01 0.09 0.00 0.00 -1.57 0.00 0.00 179.24 177.77 1rg9 n ALA 379 N -2.48 2.11 -3.40 3.45 0.00 -1.17 -4.31 120.51 114.72 1rg9 n ALA 379 Ca 0.25 -0.08 0.02 0.00 0.00 0.00 0.00 53.44 53.62 1rg9 n ALA 379 Cb 0.88 -1.21 -0.03 0.00 0.00 0.00 0.00 19.45 19.09 1rg9 n ALA 379 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1rg9 s ALA 380 N -2.00 -2.24 -0.43 0.00 0.00 0.14 -5.02 121.76 112.22 1rg9 s ALA 380 Ca 0.19 2.08 -0.11 0.00 0.00 0.00 0.00 51.96 54.12 1rg9 s ALA 380 Cb 0.09 -2.00 0.02 0.00 0.00 0.00 0.00 23.12 21.23 1rg9 s ALA 380 CO 0.15 -1.13 0.41 0.41 0.00 0.00 0.00 175.76 175.60 1rg9 n GLY 381 N 5.41 -0.43 0.00 0.00 0.00 -1.26 -4.79 105.19 104.12 1rg9 n GLY 381 Ca -0.07 0.55 0.00 0.00 0.00 0.00 0.00 46.02 46.50 1rg9 n GLY 381 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1rg9 n LEU 382 N -1.12 0.00 0.00 0.99 7.94 -1.25 -4.87 117.00 118.69 1rg9 n LEU 382 Ca -0.15 0.66 0.00 0.00 -1.11 0.00 0.00 56.01 55.42 1rg9 n LEU 382 Cb 0.45 -0.16 0.00 0.00 0.53 0.00 0.00 43.42 44.24 1rg9 n LEU 382 CO 0.39 -0.16 0.00 0.29 -1.11 0.00 0.00 177.39 176.80