#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 3.92 -0.12 0.00 1.02 -1.25 -2.39 119.74 120.91 1rg9 s LYS 2 Ca 0.00 0.40 -0.32 0.00 0.02 0.00 0.00 55.97 56.07 1rg9 s LYS 2 Cb 0.00 -3.02 0.13 0.00 -0.52 0.00 0.00 37.83 34.41 1rg9 s LYS 2 CO 0.00 0.55 1.07 -3.38 -0.92 0.00 0.00 175.35 172.67 1rg9 s HIS 3 N -1.36 -0.24 -0.09 3.18 -3.43 0.84 -4.97 115.29 109.22 1rg9 s HIS 3 Ca 0.33 0.21 -0.01 0.00 -0.80 0.00 0.00 55.06 54.80 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 0.18 -0.34 -0.05 -0.51 -2.00 0.00 0.00 174.74 172.01 1rg9 s LEU 4 N -2.07 3.23 -0.06 5.38 1.43 -1.26 -0.44 118.68 124.89 1rg9 s LEU 4 Ca 0.06 -0.03 0.02 0.00 -1.03 0.00 0.00 54.13 53.14 1rg9 s LEU 4 Cb -0.01 -1.73 0.02 0.00 0.03 0.00 0.00 46.19 44.50 1rg9 s LEU 4 CO -0.06 0.31 -0.10 0.12 0.23 0.00 0.00 176.35 176.86 1rg9 s PHE 5 N -0.51 1.27 -0.01 0.29 2.19 -1.11 -5.01 117.98 115.09 1rg9 s PHE 5 Ca 0.08 -0.46 0.06 0.00 0.33 0.00 0.00 56.93 56.95 1rg9 s PHE 5 Cb -0.12 -0.97 -0.03 0.00 -1.31 0.00 0.00 43.02 40.60 1rg9 s PHE 5 CO 0.02 -0.26 -0.20 0.99 1.83 0.00 0.00 175.22 177.60 1rg9 s THR 6 N 0.78 2.59 0.24 0.12 2.01 -1.26 -1.46 115.64 118.66 1rg9 s THR 6 Ca -0.13 -1.01 0.01 0.00 0.31 0.00 0.00 61.69 60.88 1rg9 s THR 6 Cb -0.15 -2.00 -0.05 0.00 0.01 0.00 0.00 72.50 70.31 1rg9 s THR 6 CO 0.02 0.51 0.08 -0.44 -0.69 0.00 0.00 174.62 174.10 1rg9 s SER 7 N -0.89 1.19 0.14 3.53 0.01 -0.71 -4.87 113.70 112.09 1rg9 s SER 7 Ca 0.12 -1.34 -0.10 0.00 1.31 0.00 0.00 55.95 55.94 1rg9 s SER 7 Cb -0.10 0.15 -0.00 0.00 0.21 0.00 0.00 66.02 66.28 1rg9 s SER 7 CO 0.01 -0.70 0.27 -1.83 0.41 0.00 0.00 173.24 171.41 1rg9 s GLU 8 N -4.01 1.07 0.21 12.44 -1.05 -1.26 -2.24 118.70 123.85 1rg9 s GLU 8 Ca 0.35 -1.07 -0.07 0.00 -0.15 0.00 0.00 54.97 54.03 1rg9 s GLU 8 Cb 0.07 0.38 -0.02 0.00 -0.44 0.00 0.00 34.13 34.12 1rg9 s GLU 8 CO 0.12 -0.38 0.29 0.45 0.95 0.00 0.00 175.26 176.69 1rg9 s SER 9 N -2.92 0.04 0.02 0.83 0.15 0.11 -4.70 113.70 107.23 1rg9 s SER 9 Ca 0.12 -1.12 0.02 0.00 0.70 0.00 0.00 55.95 55.67 1rg9 s SER 9 Cb 0.03 0.47 -0.01 0.00 -1.71 0.00 0.00 66.02 64.80 1rg9 s SER 9 CO -0.04 -0.97 -0.06 0.68 1.20 0.00 0.00 173.24 174.05 1rg9 s VAL 10 N -4.07 0.42 1.00 4.45 -7.23 -1.26 -0.51 120.40 113.19 1rg9 s VAL 10 Ca 0.28 -0.60 -0.12 0.00 -1.81 0.00 0.00 61.98 59.73 1rg9 s VAL 10 Cb 0.03 -0.43 0.19 0.00 0.56 0.00 0.00 36.38 36.73 1rg9 s VAL 10 CO 0.09 -0.14 1.08 -0.94 -0.31 0.00 0.00 175.10 174.88 1rg9 s SER 11 N -0.80 2.52 0.05 4.85 1.04 0.32 -4.61 113.70 117.06 1rg9 s SER 11 Ca -0.04 1.53 0.16 0.00 0.48 0.00 0.00 55.95 58.08 1rg9 s SER 11 Cb -0.06 -2.20 0.69 0.00 0.10 0.00 0.00 66.02 64.55 1rg9 s SER 11 CO 0.00 -3.25 1.51 -1.84 0.98 0.00 0.00 173.24 170.65 1rg9 n GLU 12 N -4.28 0.04 0.00 4.02 0.28 -1.26 -2.15 120.64 117.28 1rg9 n GLU 12 Ca 0.06 0.28 0.14 0.00 -0.16 0.00 0.00 57.16 57.49 1rg9 n GLU 12 Cb 0.55 -1.57 0.59 0.00 1.43 0.00 0.00 31.44 32.44 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 0.00 -0.16 3.73 -1.84 0.00 -1.19 -4.24 105.19 101.49 1rg9 n GLY 13 Ca 0.03 -0.41 -0.41 0.00 0.00 0.00 0.00 46.02 45.23 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 -2.00 3.61 0.24 1.61 5.04 -0.91 -3.65 115.29 119.22 1rg9 s HIS 14 Ca 0.39 1.59 -0.14 0.00 -1.54 0.00 0.00 55.06 55.37 1rg9 s HIS 14 Cb 0.21 -3.24 0.31 0.00 0.04 0.00 0.00 32.58 29.90 1rg9 s HIS 14 CO 0.34 -0.51 1.57 -1.35 -2.34 0.00 0.00 174.74 172.46 1rg9 h PRO 15 N 5.80 -0.02 -0.26 2.88 0.11 -1.88 0.18 132.00 138.81 1rg9 h PRO 15 Ca -0.43 0.00 0.03 0.00 0.11 0.00 0.00 66.00 65.71 1rg9 h PRO 15 Cb 1.21 0.01 -0.03 0.00 0.11 0.00 0.00 31.00 32.30 1rg9 h PRO 15 CO 0.75 -0.01 0.08 -0.44 -0.21 0.00 0.00 178.00 178.16 1rg9 h ASP 16 N -0.02 0.09 -0.28 -2.05 3.32 -1.81 -1.95 116.42 113.71 1rg9 h ASP 16 Ca 0.38 0.03 -0.06 0.00 0.02 0.00 0.00 57.03 57.40 1rg9 h ASP 16 Cb 0.63 0.02 -0.02 0.00 0.22 0.00 0.00 39.33 40.18 1rg9 h ASP 16 CO -0.92 0.08 -0.01 0.11 -1.72 0.00 0.00 179.24 176.78 1rg9 h LYS 17 N 0.20 0.62 -0.44 3.56 1.79 -1.41 -2.20 116.57 118.68 1rg9 h LYS 17 Ca 0.11 -0.15 0.06 0.00 -2.18 0.00 0.00 60.65 58.49 1rg9 h LYS 17 Cb 0.08 -0.08 -0.05 0.00 -1.58 0.00 0.00 32.23 30.60 1rg9 h LYS 17 CO -0.12 0.65 0.15 0.82 -1.08 0.00 0.00 179.45 179.87 1rg9 h ILE 18 N 0.59 0.85 0.27 1.86 2.04 -0.02 0.17 117.51 123.26 1rg9 h ILE 18 Ca 0.12 -0.11 -0.00 0.00 1.00 0.00 0.00 64.86 65.87 1rg9 h ILE 18 Cb 0.39 0.50 -0.02 0.00 -0.74 0.00 0.00 36.82 36.95 1rg9 h ILE 18 CO 0.01 0.06 -0.36 0.00 0.00 0.00 0.00 178.15 177.87 1rg9 h ALA 19 N 1.30 -0.98 -0.84 1.87 0.00 -0.82 -0.22 119.26 119.56 1rg9 h ALA 19 Ca 0.21 -0.12 0.13 0.00 0.00 0.00 0.00 54.91 55.14 1rg9 h ALA 19 Cb 0.21 0.64 -0.14 0.00 0.00 0.00 0.00 17.79 18.50 1rg9 h ALA 19 CO -0.22 -1.02 -0.37 -0.44 0.00 0.00 0.00 179.25 177.19 1rg9 h ASP 20 N -0.64 -1.35 -0.20 0.00 3.45 -0.86 0.49 116.42 117.31 1rg9 h ASP 20 Ca -0.03 0.28 0.05 0.00 0.43 0.00 0.00 57.03 57.76 1rg9 h ASP 20 Cb 0.58 0.69 -0.05 0.00 -0.56 0.00 0.00 39.33 39.99 1rg9 h ASP 20 CO -0.09 -0.29 -0.15 1.56 -1.57 0.00 0.00 179.24 178.70 1rg9 h GLN 21 N -0.07 -0.15 0.23 3.56 4.20 -0.35 0.39 115.11 122.93 1rg9 h GLN 21 Ca 0.30 0.01 0.01 0.00 0.06 0.00 0.00 58.65 59.03 1rg9 h GLN 21 Cb 0.58 0.03 -0.02 0.00 0.30 0.00 0.00 27.48 28.37 1rg9 h GLN 21 CO -0.87 -0.10 -0.28 0.82 -0.67 0.00 0.00 178.83 177.74 1rg9 h ILE 22 N -0.15 0.41 -0.21 2.54 2.04 0.93 0.30 117.51 123.38 1rg9 h ILE 22 Ca 0.12 0.00 0.06 0.00 1.00 0.00 0.00 64.86 66.03 1rg9 h ILE 22 Cb 0.32 0.41 -0.07 0.00 -0.74 0.00 0.00 36.82 36.75 1rg9 h ILE 22 CO -0.29 0.00 -0.26 0.28 0.00 0.00 0.00 178.15 177.89 1rg9 h SER 23 N -0.55 -0.81 0.99 1.72 0.02 0.54 -0.11 113.55 115.35 1rg9 h SER 23 Ca 0.00 0.14 0.00 0.00 -0.84 0.00 0.00 61.79 61.09 1rg9 h SER 23 Cb 0.53 0.37 0.00 0.00 0.14 0.00 0.00 62.40 63.44 1rg9 h SER 23 CO -0.09 -0.29 0.00 0.44 -1.14 0.00 0.00 176.83 175.75 1rg9 h ASP 24 N -0.28 0.00 0.06 3.07 3.32 -0.03 -2.68 116.42 119.87 1rg9 h ASP 24 Ca 0.12 0.00 -0.22 0.00 0.02 0.00 0.00 57.03 56.95 1rg9 h ASP 24 Cb 0.47 0.00 0.01 0.00 0.22 0.00 0.00 39.33 40.03 1rg9 h ASP 24 CO -0.37 0.00 -0.85 0.00 -1.72 0.00 0.00 179.24 176.31 1rg9 h ALA 25 N 2.20 0.35 -0.24 3.45 0.00 0.13 -2.47 119.26 122.68 1rg9 h ALA 25 Ca 0.00 -0.64 -0.05 0.00 0.00 0.00 0.00 54.91 54.22 1rg9 h ALA 25 Cb 0.49 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 1rg9 h ALA 25 CO 0.00 0.72 -0.04 0.28 0.00 0.00 0.00 179.25 180.21 1rg9 h VAL 26 N 0.40 1.28 -0.00 0.00 2.07 -0.80 -2.70 116.25 116.50 1rg9 h VAL 26 Ca -0.07 -1.03 0.02 0.00 0.82 0.00 0.00 66.70 66.45 1rg9 h VAL 26 Cb 1.47 1.47 -0.03 0.00 -1.52 0.00 0.00 31.29 32.68 1rg9 h VAL 26 CO 0.16 0.32 -0.15 0.25 0.02 0.00 0.00 177.57 178.17 1rg9 h LEU 27 N 0.19 -0.44 -0.10 2.57 5.85 -1.50 -0.59 115.31 121.29 1rg9 h LEU 27 Ca 0.06 0.06 0.04 0.00 0.84 0.00 0.00 57.88 58.89 1rg9 h LEU 27 Cb 0.50 0.18 -0.06 0.00 0.37 0.00 0.00 40.66 41.65 1rg9 h LEU 27 CO 0.02 -0.21 -0.29 0.44 -0.34 0.00 0.00 178.44 178.06 1rg9 h ASP 28 N -0.25 -0.88 -0.55 1.25 3.32 -1.46 0.77 116.42 118.62 1rg9 h ASP 28 Ca 0.05 0.13 0.11 0.00 0.02 0.00 0.00 57.03 57.34 1rg9 h ASP 28 Cb 0.31 0.37 -0.09 0.00 0.22 0.00 0.00 39.33 40.15 1rg9 h ASP 28 CO -0.15 -0.34 0.05 0.00 -1.72 0.00 0.00 179.24 177.09 1rg9 h ALA 29 N 0.47 0.58 0.55 3.45 0.00 -1.22 0.23 119.26 123.32 1rg9 h ALA 29 Ca 0.09 0.15 -0.03 0.00 0.00 0.00 0.00 54.91 55.12 1rg9 h ALA 29 Cb 0.51 0.23 0.01 0.00 0.00 0.00 0.00 17.79 18.54 1rg9 h ALA 29 CO -0.31 -0.36 -0.26 0.82 0.00 0.00 0.00 179.25 179.14 1rg9 h ILE 30 N 0.17 0.43 -0.88 0.00 2.04 0.15 -3.09 117.51 116.33 1rg9 h ILE 30 Ca 0.29 -0.16 0.14 0.00 1.00 0.00 0.00 64.86 66.13 1rg9 h ILE 30 Cb 0.43 0.50 -0.09 0.00 -0.74 0.00 0.00 36.82 36.92 1rg9 h ILE 30 CO -0.43 0.03 0.48 -0.07 0.00 0.00 0.00 178.15 178.16 1rg9 h LEU 31 N -0.84 0.61 -1.15 1.44 3.38 0.12 0.27 115.31 119.13 1rg9 h LEU 31 Ca -0.08 0.08 0.25 0.00 0.09 0.00 0.00 57.88 58.23 1rg9 h LEU 31 Cb 0.61 -0.02 -0.11 0.00 0.09 0.00 0.00 40.66 41.23 1rg9 h LEU 31 CO 0.12 0.27 0.63 -0.08 0.09 0.00 0.00 178.44 179.47 1rg9 h GLU 32 N 0.69 0.51 0.07 1.13 4.22 -0.48 -0.57 114.58 120.15 1rg9 h GLU 32 Ca 0.48 -0.03 -0.30 0.00 0.08 0.00 0.00 59.36 59.59 1rg9 h GLU 32 Cb 0.64 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 29.76 1rg9 h GLU 32 CO -0.35 0.34 -1.58 0.37 -2.18 0.00 0.00 179.01 175.62 1rg9 h GLN 33 N 0.53 0.16 -2.14 1.92 4.15 -0.58 -3.45 115.11 115.69 1rg9 h GLN 33 Ca 0.62 -0.27 -0.25 0.00 0.77 0.00 0.00 58.65 59.51 1rg9 h GLN 33 Cb 1.30 0.10 -0.32 0.00 0.21 0.00 0.00 27.48 28.77 1rg9 h GLN 33 CO -0.39 0.95 -0.57 0.34 -1.93 0.00 0.00 178.83 177.22 1rg9 s ASP 34 N -6.72 1.00 0.38 -0.69 2.15 0.22 -4.88 116.67 108.13 1rg9 s ASP 34 Ca -0.08 -0.23 0.14 0.00 0.43 0.00 0.00 52.55 52.81 1rg9 s ASP 34 Cb 0.07 0.72 0.76 0.00 -0.30 0.00 0.00 42.92 44.18 1rg9 s ASP 34 CO 0.83 -0.34 1.83 -0.65 -0.17 0.00 0.00 175.17 176.68 1rg9 h PRO 35 N 8.24 0.00 -0.68 4.34 0.11 -1.74 -3.03 132.00 139.24 1rg9 h PRO 35 Ca -0.16 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.95 1rg9 h PRO 35 Cb 1.13 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.24 1rg9 h PRO 35 CO 0.29 0.36 0.00 1.63 -0.21 0.00 0.00 178.00 180.07 1rg9 n LYS 36 N -4.03 3.69 -1.70 1.05 5.02 -1.26 -4.82 118.16 116.11 1rg9 n LYS 36 Ca -0.02 -2.26 -0.33 0.00 -2.02 0.00 0.00 58.31 53.68 1rg9 n LYS 36 Cb 0.40 -2.00 0.06 0.00 -0.02 0.00 0.00 35.03 33.47 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 -2.18 2.39 -0.34 7.82 0.00 -1.15 -5.02 121.76 123.29 1rg9 s ALA 37 Ca 0.39 0.65 -0.03 0.00 0.00 0.00 0.00 51.96 52.98 1rg9 s ALA 37 Cb 0.29 -3.36 0.07 0.00 0.00 0.00 0.00 23.12 20.12 1rg9 s ALA 37 CO 0.13 -1.40 0.08 1.03 0.00 0.00 0.00 175.76 175.59 1rg9 s ARG 38 N -4.00 2.31 -0.21 0.00 3.00 -0.79 -4.87 118.95 114.39 1rg9 s ARG 38 Ca 0.69 -1.43 -0.01 0.00 0.00 0.00 0.00 55.73 54.98 1rg9 s ARG 38 Cb -0.23 -3.34 0.01 0.00 0.00 0.00 0.00 34.95 31.40 1rg9 s ARG 38 CO 0.42 -0.77 -0.13 0.08 0.00 0.00 0.00 175.30 174.90 1rg9 s VAL 39 N 1.23 2.57 -0.55 3.52 1.01 -1.26 -1.49 120.40 125.44 1rg9 s VAL 39 Ca -0.00 -0.86 0.04 0.00 0.00 0.00 0.00 61.98 61.16 1rg9 s VAL 39 Cb -0.21 -2.17 0.16 0.00 0.00 0.00 0.00 36.38 34.16 1rg9 s VAL 39 CO -0.02 0.42 0.39 0.00 0.00 0.00 0.00 175.10 175.89 1rg9 s ALA 40 N 1.34 2.68 -0.30 5.51 0.00 -0.44 -1.70 121.76 128.85 1rg9 s ALA 40 Ca 0.04 -3.12 -0.10 0.00 0.00 0.00 0.00 51.96 48.78 1rg9 s ALA 40 Cb -0.14 -1.92 -0.02 0.00 0.00 0.00 0.00 23.12 21.04 1rg9 s ALA 40 CO -0.08 -2.05 0.15 0.00 0.00 0.00 0.00 175.76 173.78 1rg9 s GLU 42 N 1.65 3.47 -0.07 0.00 0.41 -0.32 -4.33 118.70 119.52 1rg9 s GLU 42 Ca 0.05 -0.61 0.02 0.00 -0.41 0.00 0.00 54.97 54.02 1rg9 s GLU 42 Cb -0.17 -2.84 -0.03 0.00 -1.78 0.00 0.00 34.13 29.32 1rg9 s GLU 42 CO 0.07 0.09 -0.12 0.99 -0.49 0.00 0.00 175.26 175.80 1rg9 s THR 43 N 0.72 3.25 -0.12 3.63 2.01 -1.26 -1.45 115.64 122.42 1rg9 s THR 43 Ca -0.03 -0.64 0.03 0.00 0.31 0.00 0.00 61.69 61.35 1rg9 s THR 43 Cb -0.15 -2.31 0.00 0.00 0.01 0.00 0.00 72.50 70.06 1rg9 s THR 43 CO 0.02 0.58 -0.21 -0.47 -0.69 0.00 0.00 174.62 173.85 1rg9 s TYR 44 N -0.58 2.65 -0.08 4.92 6.14 0.95 -1.67 117.35 129.68 1rg9 s TYR 44 Ca 0.08 -1.11 0.02 0.00 0.64 0.00 0.00 57.07 56.70 1rg9 s TYR 44 Cb -0.11 -1.78 0.02 0.00 0.42 0.00 0.00 41.96 40.50 1rg9 s TYR 44 CO 0.01 -0.47 -0.11 0.08 0.64 0.00 0.00 175.55 175.71 1rg9 s VAL 45 N 0.55 1.08 0.32 3.14 1.01 0.66 0.11 120.40 127.28 1rg9 s VAL 45 Ca -0.13 -0.41 0.03 0.00 0.00 0.00 0.00 61.98 61.47 1rg9 s VAL 45 Cb -0.17 -1.01 -0.02 0.00 0.00 0.00 0.00 36.38 35.18 1rg9 s VAL 45 CO 0.04 0.35 0.33 -0.54 0.00 0.00 0.00 175.10 175.28 1rg9 s LYS 46 N 0.93 1.76 0.00 2.72 -0.14 -1.09 -0.03 119.74 123.88 1rg9 s LYS 46 Ca -0.10 -1.89 0.00 0.00 -1.36 0.00 0.00 55.97 52.63 1rg9 s LYS 46 Cb -0.15 0.36 0.00 0.00 -1.68 0.00 0.00 37.83 36.36 1rg9 s LYS 46 CO 0.01 -0.67 0.00 0.25 -0.76 0.00 0.00 175.35 174.17 1rg9 n THR 47 N -0.57 0.00 -0.87 2.17 -2.24 -1.15 -1.03 114.28 110.59 1rg9 n THR 47 Ca 0.05 0.00 0.03 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 68.90 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 -0.82 2.16 3.32 3.38 0.00 -1.26 -4.68 105.19 107.29 1rg9 n GLY 48 Ca 0.00 -0.38 -0.18 0.00 0.00 0.00 0.00 46.02 45.46 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 -1.28 1.58 -0.12 1.61 0.23 -0.20 0.86 119.30 121.98 1rg9 s MET 49 Ca 0.11 -1.90 -0.05 0.00 -1.03 0.00 0.00 55.69 52.81 1rg9 s MET 49 Cb 0.09 -0.02 0.06 0.00 -1.53 0.00 0.00 34.83 33.43 1rg9 s MET 49 CO 0.01 -0.47 0.27 0.08 -2.03 0.00 0.00 175.02 172.88 1rg9 s VAL 50 N -3.64 -0.24 -0.30 5.16 1.01 0.06 -2.69 120.40 119.77 1rg9 s VAL 50 Ca 0.36 0.21 -0.05 0.00 0.00 0.00 0.00 61.98 62.50 1rg9 s VAL 50 Cb 0.05 -0.44 0.02 0.00 0.00 0.00 0.00 36.38 36.02 1rg9 s VAL 50 CO 0.18 0.09 0.05 -0.22 0.00 0.00 0.00 175.10 175.20 1rg9 s LEU 51 N 1.89 3.82 -0.25 3.92 0.20 0.31 -0.11 118.68 128.45 1rg9 s LEU 51 Ca -0.04 -0.89 -0.06 0.00 0.69 0.00 0.00 54.13 53.83 1rg9 s LEU 51 Cb -0.11 -1.82 -0.01 0.00 -0.43 0.00 0.00 46.19 43.82 1rg9 s LEU 51 CO -0.09 -0.21 0.03 -0.69 -0.29 0.00 0.00 176.35 175.10 1rg9 s VAL 52 N 1.42 3.90 0.00 1.68 1.01 -0.13 -0.04 120.40 128.24 1rg9 s VAL 52 Ca 0.00 -0.38 0.00 0.00 0.00 0.00 0.00 61.98 61.60 1rg9 s VAL 52 Cb -0.18 -2.84 0.00 0.00 0.00 0.00 0.00 36.38 33.36 1rg9 s VAL 52 CO 0.01 0.33 0.00 0.61 0.00 0.00 0.00 175.10 176.04 1rg9 n GLY 53 N 4.87 4.12 0.00 4.51 0.00 -0.53 -1.16 105.19 117.00 1rg9 n GLY 53 Ca -0.17 -1.28 0.00 0.00 0.00 0.00 0.00 46.02 44.57 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 0.00 -0.22 3.14 -0.02 0.00 -0.64 -1.17 105.19 106.28 1rg9 n GLY 54 Ca 0.00 -2.15 -0.30 0.00 0.00 0.00 0.00 46.02 43.57 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 2.63 -0.05 1.61 1.03 -0.50 -0.36 118.70 123.06 1rg9 s GLU 55 Ca 0.00 -0.72 0.01 0.00 0.03 0.00 0.00 54.97 54.28 1rg9 s GLU 55 Cb 0.00 -2.10 0.02 0.00 -0.80 0.00 0.00 34.13 31.25 1rg9 s GLU 55 CO 0.00 0.04 -0.03 0.42 -1.33 0.00 0.00 175.26 174.36 1rg9 s ILE 56 N 0.69 0.47 -0.30 1.83 1.01 0.18 -1.32 121.20 123.76 1rg9 s ILE 56 Ca -0.12 -0.07 0.00 0.00 0.00 0.00 0.00 60.65 60.47 1rg9 s ILE 56 Cb -0.16 -0.53 0.09 0.00 0.01 0.00 0.00 42.46 41.88 1rg9 s ILE 56 CO 0.02 0.22 0.07 -0.89 0.00 0.00 0.00 174.94 174.37 1rg9 s THR 57 N 1.06 1.17 0.14 2.92 2.01 -0.55 -4.12 115.64 118.27 1rg9 s THR 57 Ca -0.09 -1.51 -0.07 0.00 0.31 0.00 0.00 61.69 60.32 1rg9 s THR 57 Cb -0.14 -1.83 -0.01 0.00 0.01 0.00 0.00 72.50 70.52 1rg9 s THR 57 CO -0.01 -0.59 0.22 0.28 -0.69 0.00 0.00 174.62 173.84 1rg9 s THR 58 N 1.48 0.09 -2.32 -0.82 -1.32 -1.26 -1.89 115.64 109.59 1rg9 s THR 58 Ca 0.08 -1.44 0.24 0.00 -1.21 0.00 0.00 61.69 59.36 1rg9 s THR 58 Cb -0.18 -1.77 0.13 0.00 -1.51 0.00 0.00 72.50 69.17 1rg9 s THR 58 CO -0.19 -0.41 1.25 -1.54 -2.21 0.00 0.00 174.62 171.52 1rg9 n SER 59 N -0.16 2.15 -4.81 8.08 3.41 -1.26 -4.96 113.62 116.07 1rg9 n SER 59 Ca -0.09 -1.58 -0.32 0.00 -0.26 0.00 0.00 58.87 56.63 1rg9 n SER 59 Cb 0.63 0.26 0.03 0.00 -0.26 0.00 0.00 64.21 64.86 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 -2.30 2.71 -0.22 7.33 0.00 -1.26 -5.05 121.76 122.96 1rg9 s ALA 60 Ca 0.24 0.26 0.01 0.00 0.00 0.00 0.00 51.96 52.46 1rg9 s ALA 60 Cb 0.19 -3.21 0.06 0.00 0.00 0.00 0.00 23.12 20.16 1rg9 s ALA 60 CO 0.47 -0.99 -0.06 -1.58 0.00 0.00 0.00 175.76 173.59 1rg9 s TRP 61 N -2.71 2.37 0.24 0.00 0.52 -1.26 -5.11 118.94 112.98 1rg9 s TRP 61 Ca 0.61 -1.69 0.07 0.00 0.02 0.00 0.00 56.10 55.12 1rg9 s TRP 61 Cb -0.15 -1.58 -0.05 0.00 -1.15 0.00 0.00 33.47 30.54 1rg9 s TRP 61 CO 0.45 -0.76 -0.11 0.14 0.02 0.00 0.00 176.95 176.69 1rg9 s VAL 62 N 1.41 1.68 -0.45 4.03 -7.23 -1.26 -5.06 120.40 113.52 1rg9 s VAL 62 Ca -0.05 -2.17 -0.07 0.00 -1.81 0.00 0.00 61.98 57.88 1rg9 s VAL 62 Cb -0.18 -2.22 0.11 0.00 0.56 0.00 0.00 36.38 34.65 1rg9 s VAL 62 CO -0.07 -0.47 0.29 -0.62 -0.31 0.00 0.00 175.10 173.93 1rg9 s ASP 63 N -3.37 5.55 0.13 4.85 -1.08 -1.26 -4.98 116.67 116.51 1rg9 s ASP 63 Ca 0.26 -1.90 -0.20 0.00 -0.52 0.00 0.00 52.55 50.19 1rg9 s ASP 63 Cb 0.01 -1.95 -0.01 0.00 -1.46 0.00 0.00 42.92 39.51 1rg9 s ASP 63 CO 0.09 -0.63 1.70 0.40 0.52 0.00 0.00 175.17 177.25 1rg9 h ILE 64 N 6.20 0.79 -0.14 4.11 1.08 -1.99 -1.05 117.51 126.52 1rg9 h ILE 64 Ca -0.19 -0.01 0.04 0.00 -0.39 0.00 0.00 64.86 64.32 1rg9 h ILE 64 Cb 1.07 0.77 -0.05 0.00 -3.07 0.00 0.00 36.82 35.54 1rg9 h ILE 64 CO 0.80 0.00 -0.15 -0.08 -0.69 0.00 0.00 178.15 178.03 1rg9 h GLU 65 N 0.02 -0.17 0.17 2.37 4.81 -1.94 0.28 114.58 120.11 1rg9 h GLU 65 Ca 0.11 0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.34 1rg9 h GLU 65 Cb 0.16 0.04 -0.00 0.00 0.63 0.00 0.00 28.75 29.57 1rg9 h GLU 65 CO -0.22 -0.11 -0.10 0.93 -0.73 0.00 0.00 179.01 178.78 1rg9 h GLU 66 N -0.18 -0.25 -0.65 1.92 3.07 -1.95 0.45 114.58 116.99 1rg9 h GLU 66 Ca 0.10 0.02 0.05 0.00 -0.50 0.00 0.00 59.36 59.03 1rg9 h GLU 66 Cb 0.32 0.06 -0.05 0.00 -0.84 0.00 0.00 28.75 28.24 1rg9 h GLU 66 CO -0.25 -0.17 0.37 0.82 -1.40 0.00 0.00 179.01 178.38 1rg9 h ILE 67 N -0.26 0.99 0.75 3.13 2.04 -0.92 -0.51 117.51 122.73 1rg9 h ILE 67 Ca -0.02 -0.24 -0.04 0.00 1.00 0.00 0.00 64.86 65.57 1rg9 h ILE 67 Cb 0.22 0.24 0.01 0.00 -0.74 0.00 0.00 36.82 36.55 1rg9 h ILE 67 CO 0.02 0.13 -0.36 0.74 0.00 0.00 0.00 178.15 178.67 1rg9 h THR 68 N 0.69 0.00 -0.46 -0.27 2.02 -0.17 -0.61 112.91 114.11 1rg9 h THR 68 Ca 0.28 -0.26 0.09 0.00 0.77 0.00 0.00 66.41 67.29 1rg9 h THR 68 Cb 0.15 0.00 -0.09 0.00 -1.74 0.00 0.00 68.15 66.47 1rg9 h THR 68 CO -0.16 0.00 -0.10 0.03 0.37 0.00 0.00 175.52 175.66 1rg9 h ARG 69 N -1.27 0.01 -0.84 6.66 3.08 -0.03 -0.06 114.38 121.93 1rg9 h ARG 69 Ca -0.10 -0.00 0.01 0.00 0.07 0.00 0.00 59.98 59.95 1rg9 h ARG 69 Cb 0.77 -0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.78 1rg9 h ARG 69 CO 0.17 0.01 0.56 -0.91 -1.07 0.00 0.00 179.97 178.72 1rg9 h ASN 70 N 0.01 0.97 -0.50 7.04 2.35 -1.14 0.32 115.58 124.63 1rg9 h ASN 70 Ca 0.22 -0.03 -0.05 0.00 -0.55 0.00 0.00 56.30 55.90 1rg9 h ASN 70 Cb 0.34 -0.24 -0.02 0.00 0.05 0.00 0.00 38.32 38.45 1rg9 h ASN 70 CO -0.46 0.70 0.13 0.74 -1.65 0.00 0.00 177.43 176.89 1rg9 h THR 71 N 1.14 1.24 -0.16 2.81 2.02 0.05 -0.97 112.91 119.03 1rg9 h THR 71 Ca 0.31 -0.83 -0.05 0.00 0.77 0.00 0.00 66.41 66.61 1rg9 h THR 71 Cb -0.13 0.82 -0.00 0.00 -1.74 0.00 0.00 68.15 67.10 1rg9 h THR 71 CO -0.07 0.30 -0.09 0.58 0.37 0.00 0.00 175.52 176.61 1rg9 h VAL 72 N 0.69 1.32 -0.58 3.16 2.07 -0.82 -2.47 116.25 119.62 1rg9 h VAL 72 Ca 0.16 -1.17 0.10 0.00 0.82 0.00 0.00 66.70 66.61 1rg9 h VAL 72 Cb 0.32 1.75 -0.11 0.00 -1.52 0.00 0.00 31.29 31.72 1rg9 h VAL 72 CO 0.00 0.35 -0.34 -0.09 0.02 0.00 0.00 177.57 177.51 1rg9 h ARG 73 N 0.01 -0.17 -0.98 1.57 2.43 -0.19 0.28 114.38 117.33 1rg9 h ARG 73 Ca 0.03 0.01 0.03 0.00 -0.81 0.00 0.00 59.98 59.25 1rg9 h ARG 73 Cb 0.58 0.04 -0.06 0.00 -0.42 0.00 0.00 29.97 30.12 1rg9 h ARG 73 CO 0.03 -0.11 0.65 0.93 -1.51 0.00 0.00 179.97 179.95 1rg9 h GLU 74 N -0.17 1.22 -0.61 0.20 5.08 -1.12 -1.58 114.58 117.60 1rg9 h GLU 74 Ca 0.22 -0.07 0.08 0.00 -1.00 0.00 0.00 59.36 58.60 1rg9 h GLU 74 Cb 0.55 -0.28 -0.07 0.00 0.50 0.00 0.00 28.75 29.46 1rg9 h GLU 74 CO -0.67 0.81 0.26 0.82 -1.00 0.00 0.00 179.01 179.23 1rg9 h ILE 75 N 1.26 0.82 0.00 3.13 2.04 -0.49 -3.47 117.51 120.80 1rg9 h ILE 75 Ca 0.39 -0.16 0.00 0.00 1.00 0.00 0.00 64.86 66.09 1rg9 h ILE 75 Cb -0.02 0.31 0.00 0.00 -0.74 0.00 0.00 36.82 36.38 1rg9 h ILE 75 CO -0.12 0.09 0.00 0.61 0.00 0.00 0.00 178.15 178.73 1rg9 n GLY 76 N -1.29 1.01 3.56 5.37 0.00 -0.59 -4.84 105.19 108.42 1rg9 n GLY 76 Ca 0.08 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.70 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 1.94 -0.05 1.61 2.02 -1.25 -4.76 117.35 116.86 1rg9 s TYR 77 Ca 0.00 0.55 0.08 0.00 -0.37 0.00 0.00 57.07 57.33 1rg9 s TYR 77 Cb 0.00 -4.26 0.12 0.00 -0.40 0.00 0.00 41.96 37.42 1rg9 s TYR 77 CO 0.00 -2.24 1.04 1.33 -1.57 0.00 0.00 175.55 174.11 1rg9 n VAL 78 N 7.00 0.81 -3.63 0.71 0.24 -1.24 -1.33 118.33 120.89 1rg9 n VAL 78 Ca 0.16 -0.97 -0.16 0.00 -2.04 0.00 0.00 64.34 61.33 1rg9 n VAL 78 Cb 0.50 0.22 -0.07 0.00 -1.47 0.00 0.00 33.84 33.02 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 -1.22 -0.53 0.41 6.34 5.65 -1.22 -4.86 115.29 119.86 1rg9 s HIS 79 Ca 0.13 1.01 0.40 0.00 0.25 0.00 0.00 55.06 56.85 1rg9 s HIS 79 Cb 0.11 0.28 1.96 0.00 -1.18 0.00 0.00 32.58 33.75 1rg9 s HIS 79 CO 0.01 -0.47 2.20 0.66 -0.65 0.00 0.00 174.74 176.49 1rg9 h SER 80 N 3.81 0.00 -0.79 9.88 4.64 -1.93 -2.16 113.55 127.00 1rg9 h SER 80 Ca -0.28 0.00 0.05 0.00 -0.47 0.00 0.00 61.79 61.09 1rg9 h SER 80 Cb 1.16 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 63.20 1rg9 h SER 80 CO 0.33 0.00 0.52 0.44 -0.87 0.00 0.00 176.83 177.25 1rg9 h ASP 81 N 0.00 0.79 -0.11 4.97 3.45 -1.95 -0.90 116.42 122.68 1rg9 h ASP 81 Ca 0.00 -0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.46 1rg9 h ASP 81 Cb 0.22 -0.17 0.00 0.00 -0.56 0.00 0.00 39.33 38.82 1rg9 h ASP 81 CO 0.00 0.52 0.00 0.23 -1.57 0.00 0.00 179.24 178.42 1rg9 n MET 82 N -4.47 1.70 0.00 3.56 0.00 -0.81 -4.95 117.12 112.15 1rg9 n MET 82 Ca 0.11 -1.04 0.00 0.00 0.00 0.00 0.00 57.70 56.77 1rg9 n MET 82 Cb 0.18 -1.43 0.00 0.00 0.00 0.00 0.00 33.22 31.97 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 1.15 3.11 3.01 3.03 0.00 -0.34 -4.67 105.19 110.48 1rg9 n GLY 83 Ca 0.17 0.00 -0.09 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 -2.37 0.24 -0.16 1.61 5.36 -1.25 -4.72 117.98 116.69 1rg9 s PHE 84 Ca 0.00 -0.49 -0.04 0.00 -0.96 0.00 0.00 56.93 55.44 1rg9 s PHE 84 Cb 0.00 -0.18 0.08 0.00 -0.34 0.00 0.00 43.02 42.58 1rg9 s PHE 84 CO 0.00 -0.22 0.24 0.34 -1.46 0.00 0.00 175.22 174.12 1rg9 s ASP 85 N -1.53 0.83 0.43 6.13 2.15 -1.26 -3.44 116.67 119.98 1rg9 s ASP 85 Ca -0.15 0.20 0.22 0.00 0.43 0.00 0.00 52.55 53.25 1rg9 s ASP 85 Cb -0.09 0.53 1.20 0.00 -0.30 0.00 0.00 42.92 44.26 1rg9 s ASP 85 CO -0.01 -0.28 1.77 0.00 -0.17 0.00 0.00 175.17 176.48 1rg9 h ALA 86 N 8.30 2.40 0.12 3.66 0.00 -1.51 0.22 119.26 132.45 1rg9 h ALA 86 Ca -0.15 0.05 -0.27 0.00 0.00 0.00 0.00 54.91 54.53 1rg9 h ALA 86 Cb 1.13 0.05 0.01 0.00 0.00 0.00 0.00 17.79 18.97 1rg9 h ALA 86 CO 0.20 -0.81 -1.21 -0.91 0.00 0.00 0.00 179.25 176.53 1rg9 h ASN 87 N 0.31 0.46 -0.14 0.00 2.35 -1.88 -3.38 115.58 113.29 1rg9 h ASN 87 Ca 0.59 -0.47 0.00 0.00 -0.55 0.00 0.00 56.30 55.87 1rg9 h ASN 87 Cb 1.67 -0.15 0.00 0.00 0.05 0.00 0.00 38.32 39.89 1rg9 h ASN 87 CO -0.25 1.35 0.00 -1.54 -1.65 0.00 0.00 177.43 175.34 1rg9 n SER 88 N -3.57 2.36 -4.89 5.81 3.41 -0.66 -5.02 113.62 111.05 1rg9 n SER 88 Ca -0.09 -1.68 -0.29 0.00 -0.26 0.00 0.00 58.87 56.55 1rg9 n SER 88 Cb 1.00 -0.09 0.04 0.00 -0.26 0.00 0.00 64.21 64.90 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 -3.24 3.53 -0.21 0.00 0.00 0.25 -4.97 121.76 117.12 1rg9 s ALA 90 Ca 0.57 -0.02 0.01 0.00 0.00 0.00 0.00 51.96 52.51 1rg9 s ALA 90 Cb -0.11 -2.63 0.05 0.00 0.00 0.00 0.00 23.12 20.43 1rg9 s ALA 90 CO 0.50 0.41 -0.08 0.08 0.00 0.00 0.00 175.76 176.67 1rg9 s VAL 91 N -1.45 1.57 0.14 0.00 1.01 -1.26 -0.76 120.40 119.65 1rg9 s VAL 91 Ca 0.39 -1.09 0.06 0.00 0.00 0.00 0.00 61.98 61.34 1rg9 s VAL 91 Cb -0.16 -1.74 -0.04 0.00 0.00 0.00 0.00 36.38 34.44 1rg9 s VAL 91 CO 0.20 0.05 0.00 -0.76 0.00 0.00 0.00 175.10 174.58 1rg9 s LEU 92 N 1.40 3.38 -0.03 3.92 2.01 0.84 -4.97 118.68 125.22 1rg9 s LEU 92 Ca -0.03 -0.30 -0.00 0.00 0.01 0.00 0.00 54.13 53.80 1rg9 s LEU 92 Cb -0.17 -2.07 0.03 0.00 0.01 0.00 0.00 46.19 43.98 1rg9 s LEU 92 CO -0.07 0.12 0.02 -0.44 1.01 0.00 0.00 176.35 177.00 1rg9 s SER 93 N -2.67 0.57 -0.50 2.29 0.01 -1.26 -0.96 113.70 111.18 1rg9 s SER 93 Ca 0.27 0.01 0.06 0.00 1.31 0.00 0.00 55.95 57.60 1rg9 s SER 93 Cb -0.10 -0.17 0.21 0.00 0.21 0.00 0.00 66.02 66.16 1rg9 s SER 93 CO 0.18 -0.15 0.51 0.00 0.41 0.00 0.00 173.24 174.19 1rg9 n ALA 94 N 4.50 3.06 -3.61 1.44 0.00 -0.31 -4.98 120.51 120.62 1rg9 n ALA 94 Ca -0.20 -3.78 -0.35 0.00 0.00 0.00 0.00 53.44 49.11 1rg9 n ALA 94 Cb 0.50 -0.85 -0.14 0.00 0.00 0.00 0.00 19.45 18.96 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 -1.11 3.12 0.13 0.00 1.01 -1.26 -1.62 121.20 121.47 1rg9 s ILE 95 Ca 0.33 -0.83 0.02 0.00 0.00 0.00 0.00 60.65 60.17 1rg9 s ILE 95 Cb 0.09 -2.53 0.02 0.00 0.01 0.00 0.00 42.46 40.05 1rg9 s ILE 95 CO -0.13 0.26 0.14 0.61 0.00 0.00 0.00 174.94 175.82 1rg9 n GLY 96 N 4.73 2.50 3.95 6.18 0.00 0.51 -4.88 105.19 118.17 1rg9 n GLY 96 Ca -0.17 -2.18 -0.22 0.00 0.00 0.00 0.00 46.02 43.45 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 -2.58 3.39 0.28 1.61 1.02 -1.26 0.48 119.74 122.69 1rg9 s LYS 97 Ca 0.11 -0.76 -0.29 0.00 0.02 0.00 0.00 55.97 55.04 1rg9 s LYS 97 Cb -0.01 -2.87 -0.10 0.00 -0.52 0.00 0.00 37.83 34.33 1rg9 s LYS 97 CO 0.07 0.44 1.39 -1.14 -0.92 0.00 0.00 175.35 175.19 1rg9 s GLN 98 N -3.84 4.30 0.18 1.68 0.74 -1.26 -4.64 119.66 116.81 1rg9 s GLN 98 Ca 0.34 2.27 -0.32 0.00 0.05 0.00 0.00 55.36 57.70 1rg9 s GLN 98 Cb -0.09 -3.09 -0.11 0.00 1.10 0.00 0.00 33.01 30.81 1rg9 s GLN 98 CO 0.29 -0.34 1.70 0.45 -0.55 0.00 0.00 175.29 176.84 1rg9 s SER 99 N 0.04 6.44 0.51 6.67 0.15 -1.26 -4.87 113.70 121.38 1rg9 s SER 99 Ca 0.55 2.79 0.22 0.00 0.70 0.00 0.00 55.95 60.21 1rg9 s SER 99 Cb -0.41 -2.59 1.37 0.00 -1.71 0.00 0.00 66.02 62.68 1rg9 s SER 99 CO 0.47 -0.94 2.10 1.55 1.20 0.00 0.00 173.24 177.63 1rg9 h PRO 100 N 7.07 0.00 -0.55 5.44 0.13 -1.99 -2.13 132.00 139.96 1rg9 h PRO 100 Ca -0.43 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 1rg9 h PRO 100 Cb 1.20 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.31 1rg9 h PRO 100 CO 0.95 0.09 0.35 -0.44 -0.23 0.00 0.00 178.00 178.72 1rg9 h ASP 101 N 0.00 0.64 0.00 1.44 5.19 -2.02 -1.58 116.42 120.10 1rg9 h ASP 101 Ca -0.00 -0.02 -0.00 0.00 -0.62 0.00 0.00 57.03 56.39 1rg9 h ASP 101 Cb 0.20 -0.16 0.00 0.00 0.18 0.00 0.00 39.33 39.55 1rg9 h ASP 101 CO 0.01 0.48 -0.00 0.40 -3.12 0.00 0.00 179.24 177.01 1rg9 h ILE 102 N 0.75 1.71 -1.03 0.35 2.04 -1.79 -3.36 117.51 116.18 1rg9 h ILE 102 Ca 0.20 -2.11 0.26 0.00 1.00 0.00 0.00 64.86 64.21 1rg9 h ILE 102 Cb -0.07 3.14 -0.11 0.00 -0.74 0.00 0.00 36.82 39.04 1rg9 h ILE 102 CO -0.04 0.55 0.63 -1.13 0.00 0.00 0.00 178.15 178.15 1rg9 h ASN 103 N -0.90 0.57 0.22 1.72 -0.73 -0.94 -0.00 115.58 115.52 1rg9 h ASN 103 Ca -0.00 0.12 -0.02 0.00 1.87 0.00 0.00 56.30 58.26 1rg9 h ASN 103 Cb 0.90 0.03 -0.00 0.00 0.27 0.00 0.00 38.32 39.51 1rg9 h ASN 103 CO 0.00 0.08 -0.11 0.06 -0.37 0.00 0.00 177.43 177.09 1rg9 h GLN 104 N 0.49 0.00 0.00 6.67 3.07 -1.45 -0.71 115.11 123.17 1rg9 h GLN 104 Ca 0.63 0.00 0.00 0.00 0.09 0.00 0.00 58.65 59.37 1rg9 h GLN 104 Cb 1.38 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.94 1rg9 h GLN 104 CO -0.41 0.11 -0.63 0.78 0.09 0.00 0.00 178.83 178.77 1rg9 h GLY 105 N 0.55 0.00 0.00 0.06 0.00 -1.19 -3.40 103.07 99.09 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 0.01 0.00 -0.48 -0.62 0.00 0.00 0.00 176.54 175.46 1rg9 n VAL 106 N -2.52 1.31 -3.22 4.60 0.31 -0.49 -3.19 118.33 115.13 1rg9 n VAL 106 Ca 0.02 0.24 -0.44 0.00 -0.01 0.00 0.00 64.34 64.15 1rg9 n VAL 106 Cb 0.50 -2.33 -0.06 0.00 -0.91 0.00 0.00 33.84 31.04 1rg9 n VAL 106 CO 0.00 0.00 0.00 -1.81 -1.32 0.00 0.00 176.83 173.70 1rg9 s ASP 107 N -5.57 6.19 0.49 4.52 -0.00 -0.40 -0.54 116.67 121.38 1rg9 s ASP 107 Ca -0.14 -1.17 0.07 0.00 -0.00 0.00 0.00 52.55 51.31 1rg9 s ASP 107 Cb 0.02 -2.26 0.02 0.00 -0.00 0.00 0.00 42.92 40.70 1rg9 s ASP 107 CO 0.20 -0.87 0.48 -0.13 -0.00 0.00 0.00 175.17 174.85 1rg9 s ARG 108 N 2.32 2.40 0.07 8.23 0.52 -1.26 -4.67 118.95 126.57 1rg9 s ARG 108 Ca 0.11 -1.71 -0.18 0.00 -0.52 0.00 0.00 55.73 53.43 1rg9 s ARG 108 Cb -0.22 -2.35 -0.06 0.00 0.52 0.00 0.00 34.95 32.84 1rg9 s ARG 108 CO 0.09 -0.48 1.29 0.00 0.02 0.00 0.00 175.30 176.23 1rg9 h ALA 109 N 0.75 -0.56 -2.24 2.13 0.00 -1.96 -3.36 119.26 114.01 1rg9 h ALA 109 Ca -0.37 -0.00 -0.56 0.00 0.00 0.00 0.00 54.91 53.98 1rg9 h ALA 109 Cb 1.28 0.94 -0.04 0.00 0.00 0.00 0.00 17.79 19.97 1rg9 h ALA 109 CO 0.53 -0.70 0.66 0.34 0.00 0.00 0.00 179.25 180.08 1rg9 s ASP 110 N -3.97 7.15 0.35 0.00 2.15 -1.26 -4.93 116.67 116.17 1rg9 s ASP 110 Ca -0.08 1.60 0.02 0.00 0.43 0.00 0.00 52.55 54.53 1rg9 s ASP 110 Cb 0.04 -2.55 0.65 0.00 -0.30 0.00 0.00 42.92 40.76 1rg9 s ASP 110 CO 0.33 -0.54 2.01 -0.65 -0.17 0.00 0.00 175.17 176.16 1rg9 h PRO 111 N 7.32 0.82 -0.56 4.34 0.11 -2.00 -2.79 132.00 139.23 1rg9 h PRO 111 Ca -0.30 -0.05 -0.03 0.00 0.11 0.00 0.00 66.00 65.73 1rg9 h PRO 111 Cb 1.14 -0.18 -0.02 0.00 0.11 0.00 0.00 31.00 32.04 1rg9 h PRO 111 CO 0.89 0.54 0.22 -0.07 -0.21 0.00 0.00 178.00 179.37 1rg9 h LEU 112 N 0.84 0.78 -0.79 2.35 4.07 -1.91 -2.41 115.31 118.24 1rg9 h LEU 112 Ca 0.23 -0.17 0.00 0.00 0.08 0.00 0.00 57.88 58.01 1rg9 h LEU 112 Cb -0.10 -0.20 0.00 0.00 1.08 0.00 0.00 40.66 41.44 1rg9 h LEU 112 CO -0.05 0.74 0.00 -1.84 -1.08 0.00 0.00 178.44 176.21 1rg9 n GLU 113 N -4.49 0.19 -1.55 1.13 0.28 -1.07 -4.56 120.64 110.57 1rg9 n GLU 113 Ca 0.03 0.45 -0.53 0.00 -0.16 0.00 0.00 57.16 56.95 1rg9 n GLU 113 Cb 0.16 -1.89 -0.06 0.00 1.43 0.00 0.00 31.44 31.09 1rg9 n GLU 113 CO 0.00 0.00 0.00 1.04 -0.16 0.00 0.00 177.13 178.01 1rg9 n GLN 114 N -2.25 0.73 -2.75 3.44 6.02 -0.91 -4.27 117.38 117.38 1rg9 n GLN 114 Ca 0.02 0.26 -0.24 0.00 -0.01 0.00 0.00 57.00 57.02 1rg9 n GLN 114 Cb 0.21 -1.77 0.02 0.00 1.02 0.00 0.00 30.24 29.72 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 0.09 1.59 0.39 1.08 0.00 0.30 -4.36 107.32 106.42 1rg9 s GLY 115 Ca 0.82 -0.93 -0.27 0.00 0.00 0.00 0.00 44.72 44.34 1rg9 s GLY 115 CO 0.52 -0.71 1.41 0.00 0.00 0.00 0.00 173.10 174.32 1rg9 n ALA 116 N -2.28 1.98 0.30 3.20 0.00 -0.96 -4.50 120.51 118.26 1rg9 n ALA 116 Ca 0.03 0.31 0.19 0.00 0.00 0.00 0.00 53.44 53.97 1rg9 n ALA 116 Cb 0.58 -2.37 0.88 0.00 0.00 0.00 0.00 19.45 18.54 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 2.63 0.00 -1.90 0.00 0.00 -1.81 -0.92 103.07 101.06 1rg9 h GLY 117 Ca -0.50 0.00 0.17 0.00 0.00 0.00 0.00 47.33 47.01 1rg9 h GLY 117 CO 0.63 0.00 0.55 -0.35 0.00 0.00 0.00 176.54 177.36 1rg9 s ASP 118 N -5.52 -0.07 0.51 0.19 2.15 -1.26 -4.84 116.67 107.83 1rg9 s ASP 118 Ca -0.01 -0.56 -0.03 0.00 0.43 0.00 0.00 52.55 52.38 1rg9 s ASP 118 Cb 0.11 0.49 -0.00 0.00 -0.30 0.00 0.00 42.92 43.21 1rg9 s ASP 118 CO 0.50 -0.95 0.78 0.00 -0.17 0.00 0.00 175.17 175.34 1rg9 s GLN 119 N -2.64 3.09 0.00 4.34 -2.07 -1.26 -3.36 119.66 117.76 1rg9 s GLN 119 Ca 0.17 -0.16 0.00 0.00 -1.82 0.00 0.00 55.36 53.55 1rg9 s GLN 119 Cb -0.02 -2.41 0.00 0.00 -1.09 0.00 0.00 33.01 29.49 1rg9 s GLN 119 CO 0.04 -0.43 0.00 0.41 -1.32 0.00 0.00 175.29 173.99 1rg9 n GLY 120 N -2.32 2.66 3.27 2.60 0.00 -0.69 -4.87 105.19 105.84 1rg9 n GLY 120 Ca 0.02 -1.55 -0.25 0.00 0.00 0.00 0.00 46.02 44.24 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 2.22 0.02 0.99 2.34 -1.26 0.11 118.68 123.11 1rg9 s LEU 121 Ca 0.00 -0.59 0.04 0.00 0.06 0.00 0.00 54.13 53.63 1rg9 s LEU 121 Cb 0.00 -0.93 -0.02 0.00 -0.56 0.00 0.00 46.19 44.68 1rg9 s LEU 121 CO 0.00 0.12 -0.11 0.00 -1.06 0.00 0.00 176.35 175.30 1rg9 s MET 122 N -1.49 0.77 -0.16 1.48 0.23 0.24 -4.12 119.30 116.24 1rg9 s MET 122 Ca 0.07 -0.60 -0.01 0.00 -1.03 0.00 0.00 55.69 54.13 1rg9 s MET 122 Cb -0.09 -0.72 -0.00 0.00 -1.53 0.00 0.00 34.83 32.48 1rg9 s MET 122 CO 0.03 0.18 -0.13 -0.06 -2.03 0.00 0.00 175.02 173.01 1rg9 s PHE 123 N -0.72 2.82 0.19 3.16 0.40 -1.26 -1.57 117.98 121.00 1rg9 s PHE 123 Ca -0.00 -0.97 0.05 0.00 -0.60 0.00 0.00 56.93 55.40 1rg9 s PHE 123 Cb -0.07 -1.92 -0.04 0.00 0.51 0.00 0.00 43.02 41.51 1rg9 s PHE 123 CO 0.01 -0.45 0.22 0.20 0.70 0.00 0.00 175.22 175.89 1rg9 s GLY 124 N 0.86 1.59 -0.04 4.36 0.00 0.75 -4.83 107.32 110.02 1rg9 s GLY 124 Ca -0.04 -1.20 -0.22 0.00 0.00 0.00 0.00 44.72 43.26 1rg9 s GLY 124 CO -0.00 -1.21 0.49 -0.47 0.00 0.00 0.00 173.10 171.90 1rg9 s TYR 125 N -1.85 -0.42 -0.07 1.90 5.04 -1.26 -0.85 117.35 119.85 1rg9 s TYR 125 Ca 0.33 0.73 -0.18 0.00 -2.44 0.00 0.00 57.07 55.51 1rg9 s TYR 125 Cb -0.10 0.24 0.04 0.00 0.35 0.00 0.00 41.96 42.49 1rg9 s TYR 125 CO 0.26 -0.47 0.41 0.00 -1.34 0.00 0.00 175.55 174.41 1rg9 s ALA 126 N -1.13 -1.05 -0.14 3.97 0.00 -1.03 -4.50 121.76 117.88 1rg9 s ALA 126 Ca -0.11 0.78 -0.17 0.00 0.00 0.00 0.00 51.96 52.46 1rg9 s ALA 126 Cb -0.03 -0.18 0.04 0.00 0.00 0.00 0.00 23.12 22.95 1rg9 s ALA 126 CO 0.06 -0.26 0.45 -0.08 0.00 0.00 0.00 175.76 175.93 1rg9 s THR 127 N -0.82 0.01 -1.65 0.00 -1.32 -0.53 -2.31 115.64 109.02 1rg9 s THR 127 Ca -0.09 -0.08 0.03 0.00 -1.21 0.00 0.00 61.69 60.34 1rg9 s THR 127 Cb -0.04 -0.66 0.09 0.00 -1.51 0.00 0.00 72.50 70.39 1rg9 s THR 127 CO 0.04 -0.04 0.94 -0.46 -2.21 0.00 0.00 174.62 172.89 1rg9 n ASN 128 N 2.44 0.86 0.33 8.08 0.23 -0.76 -3.49 115.26 122.96 1rg9 n ASN 128 Ca -0.15 -2.04 0.22 0.00 -0.53 0.00 0.00 54.58 52.08 1rg9 n ASN 128 Cb 0.57 -0.21 1.14 0.00 -2.08 0.00 0.00 39.78 39.20 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 0.54 0.00 -3.39 -3.83 4.81 -1.86 -3.44 114.58 107.41 1rg9 h GLU 129 Ca 0.00 0.00 -0.07 0.00 -0.13 0.00 0.00 59.36 59.16 1rg9 h GLU 129 Cb 0.31 0.00 -0.15 0.00 0.63 0.00 0.00 28.75 29.54 1rg9 h GLU 129 CO 0.02 0.00 -0.17 0.95 -0.73 0.00 0.00 179.01 179.08 1rg9 s THR 130 N -4.08 0.08 0.27 0.32 -4.23 -1.25 -4.86 115.64 101.89 1rg9 s THR 130 Ca -0.04 -0.69 -0.01 0.00 -1.18 0.00 0.00 61.69 59.76 1rg9 s THR 130 Cb 0.12 -1.12 0.28 0.00 1.34 0.00 0.00 72.50 73.12 1rg9 s THR 130 CO 0.43 -0.38 1.67 0.44 -0.54 0.00 0.00 174.62 176.24 1rg9 h ASP 131 N 2.71 0.02 -0.08 3.99 3.45 -1.91 0.93 116.42 125.54 1rg9 h ASP 131 Ca -0.33 0.17 0.00 0.00 0.43 0.00 0.00 57.03 57.30 1rg9 h ASP 131 Cb 1.23 0.23 0.00 0.00 -0.56 0.00 0.00 39.33 40.23 1rg9 h ASP 131 CO 0.48 -0.09 0.00 1.33 -1.57 0.00 0.00 179.24 179.39 1rg9 n VAL 132 N -5.19 0.24 -3.13 -1.35 0.24 -1.26 -4.86 118.33 103.02 1rg9 n VAL 132 Ca 0.18 -0.14 -0.21 0.00 -2.04 0.00 0.00 64.34 62.13 1rg9 n VAL 132 Cb 0.57 -0.24 -0.00 0.00 -1.47 0.00 0.00 33.84 32.70 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 -0.06 -1.56 -4.69 1.34 7.99 0.32 -4.79 117.00 115.55 1rg9 n LEU 133 Ca 0.03 -0.25 -0.24 0.00 -0.01 0.00 0.00 56.01 55.55 1rg9 n LEU 133 Cb 0.24 -2.20 -0.07 0.00 -0.11 0.00 0.00 43.42 41.28 1rg9 n LEU 133 CO 0.03 0.11 -0.30 -0.04 -1.51 0.00 0.00 177.39 175.68 1rg9 s MET 134 N -5.77 2.45 0.70 3.23 -1.94 -1.23 -1.45 119.30 115.29 1rg9 s MET 134 Ca 0.30 -1.26 -0.14 0.00 -1.71 0.00 0.00 55.69 52.89 1rg9 s MET 134 Cb -0.16 -2.30 0.02 0.00 2.01 0.00 0.00 34.83 34.41 1rg9 s MET 134 CO 0.37 0.40 1.13 -2.14 -0.01 0.00 0.00 175.02 174.77 1rg9 s PRO 135 N -3.50 2.53 -0.09 2.03 0.02 -1.26 -3.80 135.00 130.92 1rg9 s PRO 135 Ca 0.31 1.43 -0.24 0.00 0.02 0.00 0.00 61.00 62.52 1rg9 s PRO 135 Cb -0.08 -1.91 -0.20 0.00 0.02 0.00 0.00 34.50 32.33 1rg9 s PRO 135 CO 0.21 -1.47 0.83 0.00 -0.33 0.00 0.00 177.00 176.23 1rg9 h ALA 136 N -0.28 -0.05 -0.73 -1.55 0.00 -1.96 -3.23 119.26 111.46 1rg9 h ALA 136 Ca -0.46 -0.34 0.16 0.00 0.00 0.00 0.00 54.91 54.27 1rg9 h ALA 136 Cb 1.25 0.02 -0.13 0.00 0.00 0.00 0.00 17.79 18.94 1rg9 h ALA 136 CO 0.52 -0.12 -0.02 -1.35 0.00 0.00 0.00 179.25 178.28 1rg9 h PRO 137 N -0.86 0.09 -0.15 0.00 0.11 -1.95 0.32 132.00 129.56 1rg9 h PRO 137 Ca -0.01 -0.01 -0.10 0.00 0.11 0.00 0.00 66.00 66.00 1rg9 h PRO 137 Cb 0.69 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 31.77 1rg9 h PRO 137 CO 0.01 0.06 -0.35 0.97 -0.21 0.00 0.00 178.00 178.48 1rg9 h ILE 138 N 0.09 1.29 -0.38 4.15 6.09 -1.84 -2.50 117.51 124.41 1rg9 h ILE 138 Ca 0.39 -1.40 -0.01 0.00 -1.37 0.00 0.00 64.86 62.47 1rg9 h ILE 138 Cb 0.67 1.56 -0.02 0.00 0.47 0.00 0.00 36.82 39.51 1rg9 h ILE 138 CO -0.65 0.42 0.18 0.71 -3.07 0.00 0.00 178.15 175.74 1rg9 h THR 139 N 0.26 1.17 -0.05 2.19 1.35 -0.98 -2.16 112.91 114.68 1rg9 h THR 139 Ca 0.03 -0.49 -0.17 0.00 -0.55 0.00 0.00 66.41 65.23 1rg9 h THR 139 Cb 0.74 0.80 -0.01 0.00 -1.73 0.00 0.00 68.15 67.95 1rg9 h THR 139 CO 0.06 0.18 -0.71 1.88 -0.25 0.00 0.00 175.52 176.68 1rg9 h TYR 140 N 0.47 0.36 -0.41 4.73 0.05 -1.28 -2.41 116.97 118.48 1rg9 h TYR 140 Ca 0.13 -0.16 -0.05 0.00 0.05 0.00 0.00 58.73 58.70 1rg9 h TYR 140 Cb 0.12 -0.06 -0.02 0.00 1.01 0.00 0.00 36.73 37.79 1rg9 h TYR 140 CO -0.01 0.88 0.06 0.00 -1.05 0.00 0.00 178.16 178.04 1rg9 h ALA 141 N 1.07 0.55 -0.12 3.88 0.00 -1.39 -0.86 119.26 122.39 1rg9 h ALA 141 Ca -0.02 -0.23 0.01 0.00 0.00 0.00 0.00 54.91 54.68 1rg9 h ALA 141 Cb 1.26 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.88 1rg9 h ALA 141 CO 0.11 0.27 0.03 0.45 0.00 0.00 0.00 179.25 180.11 1rg9 h HIS 142 N 0.54 0.05 -0.93 0.00 3.86 -1.37 -2.11 115.15 115.19 1rg9 h HIS 142 Ca 0.12 0.01 0.14 0.00 -1.16 0.00 0.00 60.37 59.48 1rg9 h HIS 142 Cb 0.39 -0.01 -0.08 0.00 1.06 0.00 0.00 27.41 28.78 1rg9 h HIS 142 CO 0.03 0.02 0.59 0.00 0.86 0.00 0.00 177.93 179.44 1rg9 h ARG 143 N 0.08 0.77 0.24 2.45 3.08 -1.13 0.88 114.38 120.76 1rg9 h ARG 143 Ca 0.05 -0.05 -0.01 0.00 0.07 0.00 0.00 59.98 60.04 1rg9 h ARG 143 Cb 0.04 -0.17 0.00 0.00 0.08 0.00 0.00 29.97 29.92 1rg9 h ARG 143 CO -0.06 0.51 -0.11 -0.07 -1.07 0.00 0.00 179.97 179.16 1rg9 h LEU 144 N 0.80 -0.27 -0.97 3.04 3.38 -0.49 0.46 115.31 121.26 1rg9 h LEU 144 Ca 0.47 -0.10 -0.09 0.00 0.09 0.00 0.00 57.88 58.24 1rg9 h LEU 144 Cb 0.65 0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.46 1rg9 h LEU 144 CO -0.23 -0.06 -0.27 -0.37 0.09 0.00 0.00 178.44 177.59 1rg9 h VAL 145 N -0.48 1.27 -0.44 1.22 -1.51 -1.08 -2.07 116.25 113.17 1rg9 h VAL 145 Ca -0.03 -1.28 -0.07 0.00 -1.23 0.00 0.00 66.70 64.09 1rg9 h VAL 145 Cb 0.36 1.41 -0.02 0.00 -2.13 0.00 0.00 31.29 30.91 1rg9 h VAL 145 CO 0.05 0.40 -0.03 -0.61 -1.23 0.00 0.00 177.57 176.16 1rg9 h GLN 146 N 0.36 0.72 -0.08 5.19 4.15 -0.69 -1.86 115.11 122.91 1rg9 h GLN 146 Ca 0.05 -0.19 -0.02 0.00 0.77 0.00 0.00 58.65 59.25 1rg9 h GLN 146 Cb 0.68 -0.08 -0.00 0.00 0.21 0.00 0.00 27.48 28.28 1rg9 h GLN 146 CO 0.05 0.75 -0.04 -0.09 -1.93 0.00 0.00 178.83 177.57 1rg9 h ARG 147 N 0.67 0.16 -0.93 1.69 9.65 -0.48 -2.26 114.38 122.88 1rg9 h ARG 147 Ca 0.13 -0.07 0.16 0.00 -1.10 0.00 0.00 59.98 59.10 1rg9 h ARG 147 Cb 0.45 -0.00 -0.10 0.00 -1.39 0.00 0.00 29.97 28.93 1rg9 h ARG 147 CO 0.02 0.53 0.53 0.37 2.80 0.00 0.00 179.97 184.23 1rg9 h GLN 148 N -0.22 0.71 -0.22 0.20 -0.00 -1.19 0.15 115.11 114.54 1rg9 h GLN 148 Ca 0.02 -0.04 -0.11 0.00 -0.00 0.00 0.00 58.65 58.51 1rg9 h GLN 148 Cb 0.49 -0.16 -0.01 0.00 0.00 0.00 0.00 27.48 27.80 1rg9 h GLN 148 CO 0.01 0.47 -0.34 0.00 0.00 0.00 0.00 178.83 178.97 1rg9 h ALA 149 N 1.59 1.01 0.04 3.38 0.00 -1.21 -2.37 119.26 121.70 1rg9 h ALA 149 Ca 0.51 -0.39 -0.24 0.00 0.00 0.00 0.00 54.91 54.79 1rg9 h ALA 149 Cb 0.72 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.40 1rg9 h ALA 149 CO -0.35 0.60 -1.03 1.49 0.00 0.00 0.00 179.25 179.96 1rg9 h GLU 150 N 0.40 0.34 0.00 0.00 4.81 -0.49 -1.99 114.58 117.64 1rg9 h GLU 150 Ca 0.05 -0.42 0.00 0.00 -0.13 0.00 0.00 59.36 58.85 1rg9 h GLU 150 Cb 0.79 0.13 0.00 0.00 0.63 0.00 0.00 28.75 30.30 1rg9 h GLU 150 CO 0.06 1.12 0.00 -0.24 -0.73 0.00 0.00 179.01 179.23 1rg9 h VAL 151 N 0.17 0.00 0.00 0.32 3.04 -0.71 -1.26 116.25 117.81 1rg9 h VAL 151 Ca -0.09 -0.55 -0.08 0.00 -1.01 0.00 0.00 66.70 64.97 1rg9 h VAL 151 Cb 1.69 1.49 -0.01 0.00 -2.01 0.00 0.00 31.29 32.45 1rg9 h VAL 151 CO 0.17 0.00 -0.44 -0.09 -1.01 0.00 0.00 177.57 176.20 1rg9 h ARG 152 N 0.00 0.00 -0.48 4.17 2.43 -1.34 -0.99 114.38 118.18 1rg9 h ARG 152 Ca 0.00 0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 59.14 1rg9 h ARG 152 Cb 0.64 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 30.17 1rg9 h ARG 152 CO 0.00 0.85 0.19 0.87 -1.51 0.00 0.00 179.97 180.37 1rg9 h LYS 153 N -1.00 0.72 0.00 0.20 1.57 -1.32 -2.49 116.57 114.25 1rg9 h LYS 153 Ca -0.11 -0.13 0.00 0.00 -1.87 0.00 0.00 60.65 58.53 1rg9 h LYS 153 Cb 0.98 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 33.18 1rg9 h LYS 153 CO -0.07 0.65 0.00 0.27 -0.57 0.00 0.00 179.45 179.73 1rg9 n ASN 154 N -4.57 0.00 0.00 0.86 0.23 -0.48 -4.86 115.26 106.44 1rg9 n ASN 154 Ca 0.01 0.07 0.00 0.00 -0.53 0.00 0.00 54.58 54.13 1rg9 n ASN 154 Cb 0.16 -0.27 0.00 0.00 -2.08 0.00 0.00 39.78 37.59 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 -0.14 0.64 0.05 4.83 0.00 -0.94 -4.93 105.19 104.71 1rg9 n GLY 155 Ca 0.07 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.97 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 1.11 -3.01 2.61 2.02 -1.62 -3.31 112.91 110.70 1rg9 h THR 156 Ca 0.00 -0.31 -0.62 0.00 0.77 0.00 0.00 66.41 66.25 1rg9 h THR 156 Cb 0.00 1.26 -0.42 0.00 -1.74 0.00 0.00 68.15 67.26 1rg9 h THR 156 CO 0.00 0.09 -0.61 -0.76 0.37 0.00 0.00 175.52 174.60 1rg9 s LEU 157 N -9.94 4.49 0.66 2.58 1.43 -0.44 -4.96 118.68 112.51 1rg9 s LEU 157 Ca -0.14 -3.78 0.40 0.00 -1.03 0.00 0.00 54.13 49.58 1rg9 s LEU 157 Cb 0.05 -1.52 2.21 0.00 0.03 0.00 0.00 46.19 46.96 1rg9 s LEU 157 CO 0.67 -0.09 2.25 1.55 0.23 0.00 0.00 176.35 180.96 1rg9 h PRO 158 N 5.42 0.00 -0.09 1.29 0.13 -1.81 -1.82 132.00 135.10 1rg9 h PRO 158 Ca 0.16 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.29 1rg9 h PRO 158 Cb 0.77 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.90 1rg9 h PRO 158 CO 0.68 0.00 0.00 -2.67 -0.23 0.00 0.00 178.00 175.78 1rg9 n TRP 159 N -3.07 0.12 -2.82 1.56 4.27 -1.26 -4.86 117.44 111.37 1rg9 n TRP 159 Ca -0.03 -0.06 -0.37 0.00 -3.89 0.00 0.00 57.50 53.16 1rg9 n TRP 159 Cb 0.15 0.00 -0.06 0.00 -1.36 0.00 0.00 31.31 30.04 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 -1.63 4.35 0.35 5.67 1.43 -0.69 -1.89 118.68 126.27 1rg9 s LEU 160 Ca 0.32 1.79 0.08 0.00 -1.03 0.00 0.00 54.13 55.29 1rg9 s LEU 160 Cb 0.16 -3.95 -0.04 0.00 0.03 0.00 0.00 46.19 42.40 1rg9 s LEU 160 CO 0.26 -0.05 0.19 -0.13 0.23 0.00 0.00 176.35 176.86 1rg9 s ARG 161 N -2.01 2.45 0.25 1.70 3.00 -0.74 -4.92 118.95 118.68 1rg9 s ARG 161 Ca 0.49 -1.51 -0.04 0.00 0.00 0.00 0.00 55.73 54.66 1rg9 s ARG 161 Cb -0.19 -2.24 0.37 0.00 0.00 0.00 0.00 34.95 32.89 1rg9 s ARG 161 CO 0.24 0.07 1.85 -1.35 0.00 0.00 0.00 175.30 176.10 1rg9 h PRO 162 N 1.44 0.94 -6.38 3.54 0.11 -1.89 -3.41 132.00 126.35 1rg9 h PRO 162 Ca -0.44 -0.06 -0.54 0.00 0.11 0.00 0.00 66.00 65.08 1rg9 h PRO 162 Cb 1.25 -0.21 0.00 0.00 0.11 0.00 0.00 31.00 32.15 1rg9 h PRO 162 CO 0.62 0.62 0.91 0.34 -0.21 0.00 0.00 178.00 180.28 1rg9 s ASP 163 N -5.75 6.76 -0.10 -2.05 2.15 -1.24 -3.15 116.67 113.29 1rg9 s ASP 163 Ca -0.12 2.22 -0.30 0.00 0.43 0.00 0.00 52.55 54.77 1rg9 s ASP 163 Cb 0.19 -2.56 0.10 0.00 -0.30 0.00 0.00 42.92 40.35 1rg9 s ASP 163 CO 0.79 -0.79 0.83 0.00 -0.17 0.00 0.00 175.17 175.83 1rg9 s ALA 164 N 2.69 -1.84 0.02 3.66 0.00 -1.26 0.13 121.76 125.16 1rg9 s ALA 164 Ca 0.67 1.42 0.01 0.00 0.00 0.00 0.00 51.96 54.07 1rg9 s ALA 164 Cb -0.34 -0.30 -0.02 0.00 0.00 0.00 0.00 23.12 22.47 1rg9 s ALA 164 CO 0.28 -0.35 -0.04 0.15 0.00 0.00 0.00 175.76 175.79 1rg9 s LYS 165 N -1.23 0.34 -0.01 0.00 1.02 0.11 -0.53 119.74 119.44 1rg9 s LYS 165 Ca -0.06 -0.49 0.02 0.00 0.02 0.00 0.00 55.97 55.46 1rg9 s LYS 165 Cb -0.00 -0.10 -0.00 0.00 -0.52 0.00 0.00 37.83 37.20 1rg9 s LYS 165 CO 0.06 0.01 -0.07 -1.54 -0.92 0.00 0.00 175.35 172.88 1rg9 s SER 166 N -1.06 0.94 -0.03 2.83 1.04 0.33 -0.34 113.70 117.42 1rg9 s SER 166 Ca -0.09 -0.14 0.01 0.00 0.48 0.00 0.00 55.95 56.21 1rg9 s SER 166 Cb -0.07 -0.18 0.01 0.00 0.10 0.00 0.00 66.02 65.88 1rg9 s SER 166 CO -0.00 0.07 -0.04 -1.58 0.98 0.00 0.00 173.24 172.67 1rg9 s GLN 167 N 0.02 0.59 -0.00 4.02 0.74 0.20 0.07 119.66 125.31 1rg9 s GLN 167 Ca 0.00 -0.11 0.01 0.00 0.05 0.00 0.00 55.36 55.31 1rg9 s GLN 167 Cb -0.05 -0.62 -0.00 0.00 1.10 0.00 0.00 33.01 33.43 1rg9 s GLN 167 CO -0.00 -0.01 -0.04 0.08 -0.55 0.00 0.00 175.29 174.77 1rg9 s VAL 168 N 0.54 0.28 -0.11 1.34 1.01 -0.95 0.23 120.40 122.74 1rg9 s VAL 168 Ca -0.06 -0.19 0.02 0.00 0.00 0.00 0.00 61.98 61.74 1rg9 s VAL 168 Cb -0.10 -0.25 0.01 0.00 0.00 0.00 0.00 36.38 36.05 1rg9 s VAL 168 CO -0.00 0.06 -0.15 0.42 0.00 0.00 0.00 175.10 175.42 1rg9 s THR 169 N -0.14 1.49 0.26 3.92 -4.23 -0.89 -1.74 115.64 114.30 1rg9 s THR 169 Ca 0.01 -0.64 -0.01 0.00 -1.18 0.00 0.00 61.69 59.87 1rg9 s THR 169 Cb -0.02 -1.36 -0.04 0.00 1.34 0.00 0.00 72.50 72.42 1rg9 s THR 169 CO -0.00 0.44 0.46 -0.36 -0.54 0.00 0.00 174.62 174.62 1rg9 s PHE 170 N 0.98 3.48 -0.23 3.99 0.40 -0.53 -2.03 117.98 124.04 1rg9 s PHE 170 Ca -0.07 0.38 -0.14 0.00 -0.60 0.00 0.00 56.93 56.51 1rg9 s PHE 170 Cb -0.15 -1.90 -0.04 0.00 0.51 0.00 0.00 43.02 41.44 1rg9 s PHE 170 CO -0.01 0.28 0.30 -0.65 0.70 0.00 0.00 175.22 175.83 1rg9 s GLN 171 N -3.65 4.11 -0.25 0.44 -0.21 0.14 -2.74 119.66 117.50 1rg9 s GLN 171 Ca 0.40 -0.01 0.00 0.00 0.02 0.00 0.00 55.36 55.77 1rg9 s GLN 171 Cb -0.10 -3.56 0.04 0.00 1.00 0.00 0.00 33.01 30.39 1rg9 s GLN 171 CO 0.31 -0.04 -0.09 0.71 -2.12 0.00 0.00 175.29 174.06 1rg9 s TYR 172 N 1.32 3.11 0.02 0.91 2.02 0.42 -1.25 117.35 123.90 1rg9 s TYR 172 Ca 0.14 -1.87 0.06 0.00 -0.37 0.00 0.00 57.07 55.03 1rg9 s TYR 172 Cb -0.14 -2.00 -0.02 0.00 -0.40 0.00 0.00 41.96 39.40 1rg9 s TYR 172 CO 0.07 -0.80 -0.17 0.34 -1.57 0.00 0.00 175.55 173.42 1rg9 s ASP 173 N 1.24 1.98 -1.56 2.29 3.68 -0.11 -0.11 116.67 124.08 1rg9 s ASP 173 Ca -0.03 -0.41 0.00 0.00 2.13 0.00 0.00 52.55 54.24 1rg9 s ASP 173 Cb -0.18 -0.18 0.00 0.00 -1.45 0.00 0.00 42.92 41.12 1rg9 s ASP 173 CO -0.06 0.14 0.00 -0.67 0.13 0.00 0.00 175.17 174.71 1rg9 n ASP 174 N 2.20 -5.03 0.00 -0.34 4.64 -1.01 -0.62 116.55 116.39 1rg9 n ASP 174 Ca -0.16 0.13 0.00 0.00 -1.38 0.00 0.00 54.79 53.38 1rg9 n ASP 174 Cb 0.54 -4.27 0.00 0.00 -1.04 0.00 0.00 41.12 36.35 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 -0.82 0.42 3.54 0.27 0.00 -1.26 -4.98 105.19 102.36 1rg9 n GLY 175 Ca -0.20 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.57 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 -0.66 1.79 0.11 1.61 -0.14 0.21 -5.08 119.74 117.58 1rg9 s LYS 176 Ca 0.00 -1.95 -0.30 0.00 -1.36 0.00 0.00 55.97 52.36 1rg9 s LYS 176 Cb 0.00 -1.53 -0.06 0.00 -1.68 0.00 0.00 37.83 34.56 1rg9 s LYS 176 CO 0.00 0.05 1.01 0.42 -0.76 0.00 0.00 175.35 176.07 1rg9 s ILE 177 N -2.76 4.40 -0.02 2.17 1.09 -1.26 -0.93 121.20 123.88 1rg9 s ILE 177 Ca 0.33 1.94 0.07 0.00 -1.10 0.00 0.00 60.65 61.89 1rg9 s ILE 177 Cb 0.05 -4.24 -0.10 0.00 -1.06 0.00 0.00 42.46 37.11 1rg9 s ILE 177 CO 0.16 0.27 0.12 1.33 -0.10 0.00 0.00 174.94 176.72 1rg9 n VAL 178 N 2.93 0.12 -3.34 2.92 0.24 -0.38 -4.91 118.33 115.91 1rg9 n VAL 178 Ca 0.03 -0.19 0.00 0.00 -2.04 0.00 0.00 64.34 62.14 1rg9 n VAL 178 Cb 0.49 0.03 0.00 0.00 -1.47 0.00 0.00 33.84 32.88 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 2.23 -0.77 2.84 7.63 0.00 -1.24 -4.76 105.19 111.12 1rg9 n GLY 179 Ca -0.04 -0.82 -0.25 0.00 0.00 0.00 0.00 46.02 44.91 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 0.69 -0.09 -0.61 1.01 -0.58 0.27 121.20 118.90 1rg9 s ILE 180 Ca 0.00 -0.08 -0.24 0.00 0.00 0.00 0.00 60.65 60.33 1rg9 s ILE 180 Cb 0.00 -0.78 -0.20 0.00 0.01 0.00 0.00 42.46 41.49 1rg9 s ILE 180 CO 0.00 0.31 0.83 0.44 0.00 0.00 0.00 174.94 176.53 1rg9 h ASP 181 N 8.23 -0.05 -4.23 3.58 3.45 -1.71 -3.38 116.42 122.30 1rg9 h ASP 181 Ca -0.25 -0.63 -0.37 0.00 0.43 0.00 0.00 57.03 56.21 1rg9 h ASP 181 Cb 1.13 0.01 -0.26 0.00 -0.56 0.00 0.00 39.33 39.65 1rg9 h ASP 181 CO 0.34 0.68 -0.77 0.00 -1.57 0.00 0.00 179.24 177.91 1rg9 s ALA 182 N -3.08 0.77 -0.11 3.45 0.00 -1.25 0.26 121.76 121.81 1rg9 s ALA 182 Ca -0.15 -0.55 0.03 0.00 0.00 0.00 0.00 51.96 51.29 1rg9 s ALA 182 Cb -0.01 -0.13 0.01 0.00 0.00 0.00 0.00 23.12 22.99 1rg9 s ALA 182 CO 0.57 0.14 -0.21 0.08 0.00 0.00 0.00 175.76 176.34 1rg9 s VAL 183 N -0.59 1.87 -0.09 0.00 1.01 0.19 -2.10 120.40 120.68 1rg9 s VAL 183 Ca 0.00 -0.89 0.04 0.00 0.00 0.00 0.00 61.98 61.13 1rg9 s VAL 183 Cb -0.06 -1.64 -0.00 0.00 0.00 0.00 0.00 36.38 34.68 1rg9 s VAL 183 CO 0.00 0.52 -0.24 -0.69 0.00 0.00 0.00 175.10 174.69 1rg9 s VAL 184 N 0.59 2.00 -0.20 2.92 1.01 0.64 0.39 120.40 127.75 1rg9 s VAL 184 Ca -0.14 -1.00 -0.04 0.00 0.00 0.00 0.00 61.98 60.81 1rg9 s VAL 184 Cb -0.17 -1.73 0.09 0.00 0.00 0.00 0.00 36.38 34.58 1rg9 s VAL 184 CO 0.04 0.55 0.23 -0.22 0.00 0.00 0.00 175.10 175.70 1rg9 s LEU 185 N 0.25 -0.12 -0.16 3.92 1.98 -0.13 0.62 118.68 125.04 1rg9 s LEU 185 Ca -0.15 -0.20 -0.01 0.00 -2.89 0.00 0.00 54.13 50.88 1rg9 s LEU 185 Cb -0.17 0.40 -0.01 0.00 0.66 0.00 0.00 46.19 47.08 1rg9 s LEU 185 CO 0.08 -0.32 -0.13 -0.44 -1.89 0.00 0.00 176.35 173.64 1rg9 s SER 186 N 2.33 3.88 0.00 3.68 0.01 0.54 -2.65 113.70 121.49 1rg9 s SER 186 Ca 0.07 -0.41 0.01 0.00 1.31 0.00 0.00 55.95 56.93 1rg9 s SER 186 Cb -0.16 -1.61 -0.00 0.00 0.21 0.00 0.00 66.02 64.46 1rg9 s SER 186 CO -0.12 0.09 -0.03 0.28 0.41 0.00 0.00 173.24 173.87 1rg9 s THR 187 N 0.79 0.26 0.67 1.44 -1.32 -1.26 0.07 115.64 116.29 1rg9 s THR 187 Ca -0.05 -0.20 -0.14 0.00 -1.21 0.00 0.00 61.69 60.09 1rg9 s THR 187 Cb -0.15 -0.23 0.01 0.00 -1.51 0.00 0.00 72.50 70.61 1rg9 s THR 187 CO 0.01 0.03 1.10 -1.58 -2.21 0.00 0.00 174.62 171.97 1rg9 s GLN 188 N -0.19 2.75 0.35 7.08 0.74 0.12 -4.79 119.66 125.72 1rg9 s GLN 188 Ca 0.00 1.32 -0.09 0.00 0.05 0.00 0.00 55.36 56.64 1rg9 s GLN 188 Cb -0.02 -1.95 0.02 0.00 1.10 0.00 0.00 33.01 32.16 1rg9 s GLN 188 CO -0.00 -1.28 0.61 -3.38 -0.55 0.00 0.00 175.29 170.69 1rg9 s HIS 189 N -2.48 0.58 0.40 1.67 -3.43 -0.66 -1.78 115.29 109.59 1rg9 s HIS 189 Ca 0.65 -1.01 -0.02 0.00 -0.80 0.00 0.00 55.06 53.89 1rg9 s HIS 189 Cb -0.19 0.34 -0.03 0.00 -1.43 0.00 0.00 32.58 31.26 1rg9 s HIS 189 CO 0.44 -1.30 0.64 -1.54 -2.00 0.00 0.00 174.74 170.98 1rg9 s SER 190 N -3.14 6.26 0.00 7.38 1.04 -0.79 -4.49 113.70 119.95 1rg9 s SER 190 Ca 0.23 0.61 0.12 0.00 0.48 0.00 0.00 55.95 57.39 1rg9 s SER 190 Cb -0.03 -2.08 0.64 0.00 0.10 0.00 0.00 66.02 64.66 1rg9 s SER 190 CO 0.15 -0.42 1.25 -0.62 0.98 0.00 0.00 173.24 174.58 1rg9 n GLU 191 N -1.97 0.24 0.06 4.02 -0.58 -1.26 -3.33 120.64 117.82 1rg9 n GLU 191 Ca -0.03 0.12 -0.08 0.00 -0.42 0.00 0.00 57.16 56.75 1rg9 n GLU 191 Cb 0.56 -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 0.03 -6.21 3.49 4.39 -1.96 -3.47 114.58 110.85 1rg9 h GLU 192 Ca 0.00 -0.05 -0.65 0.00 0.34 0.00 0.00 59.36 59.00 1rg9 h GLU 192 Cb 0.07 0.02 -0.10 0.00 -0.10 0.00 0.00 28.75 28.64 1rg9 h GLU 192 CO 0.00 1.00 -0.62 -1.50 -1.16 0.00 0.00 179.01 176.73 1rg9 s ILE 193 N -2.70 4.38 0.45 3.13 2.07 -1.21 -5.12 121.20 122.20 1rg9 s ILE 193 Ca 0.00 -0.78 -0.06 0.00 -1.41 0.00 0.00 60.65 58.40 1rg9 s ILE 193 Cb 0.10 -3.08 -0.04 0.00 0.13 0.00 0.00 42.46 39.56 1rg9 s ILE 193 CO 0.83 0.16 0.75 1.51 -1.91 0.00 0.00 174.94 176.28 1rg9 s ASP 194 N -2.25 6.32 0.08 4.50 1.47 -1.26 -4.93 116.67 120.59 1rg9 s ASP 194 Ca 0.27 0.91 -0.29 0.00 1.18 0.00 0.00 52.55 54.62 1rg9 s ASP 194 Cb -0.12 -2.24 -0.13 0.00 -0.34 0.00 0.00 42.92 40.10 1rg9 s ASP 194 CO 0.19 -0.51 1.45 1.56 0.68 0.00 0.00 175.17 178.55 1rg9 h GLN 195 N 0.51 -0.67 -0.39 2.11 1.08 -1.98 0.03 115.11 115.79 1rg9 h GLN 195 Ca -0.47 0.05 0.07 0.00 -1.45 0.00 0.00 58.65 56.84 1rg9 h GLN 195 Cb 1.20 0.15 -0.09 0.00 -0.05 0.00 0.00 27.48 28.69 1rg9 h GLN 195 CO 0.62 -0.45 -0.43 -0.22 -0.95 0.00 0.00 178.83 177.41 1rg9 h LYS 196 N -0.69 -0.32 -0.05 1.46 3.11 -1.98 0.60 116.57 118.70 1rg9 h LYS 196 Ca -0.02 0.02 0.03 0.00 -2.81 0.00 0.00 60.65 57.87 1rg9 h LYS 196 Cb 0.66 0.07 -0.06 0.00 -1.00 0.00 0.00 32.23 31.90 1rg9 h LYS 196 CO -0.17 -0.21 -0.46 0.77 -2.81 0.00 0.00 179.45 176.57 1rg9 h SER 197 N -0.33 -1.41 -0.49 4.20 0.02 -1.94 0.31 113.55 113.90 1rg9 h SER 197 Ca 0.14 0.17 0.09 0.00 -0.84 0.00 0.00 61.79 61.35 1rg9 h SER 197 Cb 0.58 0.55 -0.10 0.00 0.14 0.00 0.00 62.40 63.58 1rg9 h SER 197 CO -0.57 -0.47 -0.32 0.25 -1.14 0.00 0.00 176.83 174.59 1rg9 h LEU 198 N -0.58 -1.07 0.07 5.07 6.46 0.20 0.50 115.31 125.95 1rg9 h LEU 198 Ca 0.05 0.20 0.02 0.00 -0.12 0.00 0.00 57.88 58.03 1rg9 h LEU 198 Cb 0.67 0.52 -0.03 0.00 -0.73 0.00 0.00 40.66 41.10 1rg9 h LEU 198 CO -0.36 -0.30 -0.17 1.56 -0.62 0.00 0.00 178.44 178.55 1rg9 h GLN 199 N -0.20 -0.30 -0.82 1.25 4.20 0.10 0.28 115.11 119.63 1rg9 h GLN 199 Ca 0.21 0.02 0.05 0.00 0.06 0.00 0.00 58.65 58.99 1rg9 h GLN 199 Cb 0.54 0.07 -0.05 0.00 0.30 0.00 0.00 27.48 28.33 1rg9 h GLN 199 CO -0.60 -0.20 0.54 1.49 -0.67 0.00 0.00 178.83 179.38 1rg9 h GLU 200 N -0.32 0.92 -0.18 1.46 4.57 0.65 -1.91 114.58 119.76 1rg9 h GLU 200 Ca 0.03 -0.06 -0.19 0.00 -1.18 0.00 0.00 59.36 57.97 1rg9 h GLU 200 Cb 0.35 -0.21 -0.00 0.00 -0.16 0.00 0.00 28.75 28.73 1rg9 h GLU 200 CO -0.12 0.61 -0.64 0.00 -1.18 0.00 0.00 179.01 177.68 1rg9 h ALA 201 N 1.54 0.53 -0.52 2.92 0.00 0.52 -3.02 119.26 121.23 1rg9 h ALA 201 Ca 0.34 -0.55 -0.03 0.00 0.00 0.00 0.00 54.91 54.67 1rg9 h ALA 201 Cb 0.15 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.85 1rg9 h ALA 201 CO -0.11 0.70 0.18 0.28 0.00 0.00 0.00 179.25 180.30 1rg9 h VAL 202 N 0.49 1.20 0.12 0.00 2.07 0.30 -1.28 116.25 119.16 1rg9 h VAL 202 Ca -0.01 -0.66 -0.01 0.00 0.82 0.00 0.00 66.70 66.84 1rg9 h VAL 202 Cb 1.22 0.61 0.00 0.00 -1.52 0.00 0.00 31.29 31.60 1rg9 h VAL 202 CO 0.13 0.25 -0.06 -0.03 0.02 0.00 0.00 177.57 177.88 1rg9 h MET 203 N 0.75 -0.16 -0.03 1.57 -1.53 -1.34 0.14 114.93 114.33 1rg9 h MET 203 Ca 0.18 0.01 -0.00 0.00 -3.44 0.00 0.00 59.70 56.45 1rg9 h MET 203 Cb 0.19 0.04 -0.00 0.00 -0.55 0.00 0.00 31.60 31.27 1rg9 h MET 203 CO -0.01 0.10 0.01 0.93 0.14 0.00 0.00 176.91 178.08 1rg9 h GLU 204 N -0.42 0.04 0.19 0.39 4.39 -1.40 0.79 114.58 118.56 1rg9 h GLU 204 Ca -0.02 -0.01 -0.31 0.00 0.34 0.00 0.00 59.36 59.36 1rg9 h GLU 204 Cb 0.34 -0.01 0.02 0.00 -0.10 0.00 0.00 28.75 29.00 1rg9 h GLU 204 CO 0.03 0.22 -1.45 0.93 -1.16 0.00 0.00 179.01 177.58 1rg9 h GLU 205 N -0.14 0.39 0.00 2.33 3.07 -1.32 -3.35 114.58 115.56 1rg9 h GLU 205 Ca 0.01 -0.67 -0.22 0.00 -0.50 0.00 0.00 59.36 57.98 1rg9 h GLU 205 Cb 0.19 0.25 -0.04 0.00 -0.84 0.00 0.00 28.75 28.32 1rg9 h GLU 205 CO -0.00 1.30 -1.82 -0.89 -1.40 0.00 0.00 179.01 176.21 1rg9 n ILE 206 N -3.60 0.82 -0.07 3.13 5.41 0.35 -4.65 119.36 120.75 1rg9 n ILE 206 Ca -0.15 -0.29 -0.08 0.00 1.00 0.00 0.00 62.75 63.23 1rg9 n ILE 206 Cb 1.07 -1.17 -0.05 0.00 -0.71 0.00 0.00 39.64 38.78 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 -0.13 0.43 -0.74 1.39 2.04 -1.05 -3.29 117.51 116.15 1rg9 h ILE 207 Ca -0.33 -1.42 0.14 0.00 1.00 0.00 0.00 64.86 64.25 1rg9 h ILE 207 Cb 1.45 0.91 -0.09 0.00 -0.74 0.00 0.00 36.82 38.35 1rg9 h ILE 207 CO -0.09 0.15 0.29 0.11 0.00 0.00 0.00 178.15 178.61 1rg9 h LYS 208 N -1.00 0.43 0.00 2.37 6.56 0.38 -0.57 116.57 124.74 1rg9 h LYS 208 Ca -0.06 -0.03 -0.01 0.00 -1.06 0.00 0.00 60.65 59.49 1rg9 h LYS 208 Cb 0.57 -0.10 -0.00 0.00 -0.57 0.00 0.00 32.23 32.13 1rg9 h LYS 208 CO -0.04 0.28 -0.04 -1.35 -2.06 0.00 0.00 179.45 176.25 1rg9 h PRO 209 N 0.44 0.00 0.04 3.15 0.11 -1.75 -3.34 132.00 130.64 1rg9 h PRO 209 Ca 0.41 0.00 -0.38 0.00 0.11 0.00 0.00 66.00 66.13 1rg9 h PRO 209 Cb 0.61 0.00 -0.05 0.00 0.11 0.00 0.00 31.00 31.66 1rg9 h PRO 209 CO -0.40 0.04 -2.27 -0.89 -0.21 0.00 0.00 178.00 174.27 1rg9 n ILE 210 N -3.15 1.58 -2.81 4.15 2.08 -0.43 -4.93 119.36 115.85 1rg9 n ILE 210 Ca 0.01 -0.54 -0.41 0.00 0.56 0.00 0.00 62.75 62.37 1rg9 n ILE 210 Cb 0.34 -1.61 -0.04 0.00 -0.75 0.00 0.00 39.64 37.59 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 -6.88 4.36 -0.01 1.39 1.02 -0.35 -4.98 118.68 113.23 1rg9 s LEU 211 Ca -0.32 1.53 -0.34 0.00 0.02 0.00 0.00 54.13 55.02 1rg9 s LEU 211 Cb 0.09 -3.42 -0.13 0.00 0.02 0.00 0.00 46.19 42.75 1rg9 s LEU 211 CO 0.63 -0.20 1.77 -2.65 0.02 0.00 0.00 176.35 175.92 1rg9 n PRO 212 N 3.77 2.11 0.13 1.29 -0.02 -1.26 -4.83 135.00 136.18 1rg9 n PRO 212 Ca 0.03 0.77 0.19 0.00 -2.02 0.00 0.00 63.50 62.47 1rg9 n PRO 212 Cb 0.51 -2.58 0.77 0.00 -0.02 0.00 0.00 33.50 32.18 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 7.97 2.04 -0.45 3.55 0.00 -1.92 -1.91 119.26 128.54 1rg9 h ALA 213 Ca -0.47 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.41 1rg9 h ALA 213 Cb 1.27 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 19.06 1rg9 h ALA 213 CO 0.92 -0.50 0.21 0.93 0.00 0.00 0.00 179.25 180.81 1rg9 h GLU 214 N 0.00 0.65 0.00 0.00 5.08 -2.00 -2.69 114.58 115.62 1rg9 h GLU 214 Ca 0.16 -0.10 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 1rg9 h GLU 214 Cb 0.81 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.95 1rg9 h GLU 214 CO -0.00 0.56 0.00 0.91 -1.00 0.00 0.00 179.01 179.48 1rg9 n TRP 215 N -4.64 0.00 -3.58 4.33 8.01 -0.72 -4.68 117.44 116.16 1rg9 n TRP 215 Ca 0.01 0.00 -0.37 0.00 -1.31 0.00 0.00 57.50 55.82 1rg9 n TRP 215 Cb 0.12 -0.38 -0.10 0.00 -2.01 0.00 0.00 31.31 28.95 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 0.33 -0.99 1.43 -1.01 -1.53 118.68 118.24 1rg9 s LEU 216 Ca 0.18 0.13 0.03 0.00 -1.03 0.00 0.00 54.13 53.44 1rg9 s LEU 216 Cb 0.16 -2.19 -0.04 0.00 0.03 0.00 0.00 46.19 44.15 1rg9 s LEU 216 CO 0.39 -0.02 0.13 0.42 0.23 0.00 0.00 176.35 177.51 1rg9 s THR 217 N 1.44 0.54 -0.51 5.49 -4.23 -1.26 -4.95 115.64 112.16 1rg9 s THR 217 Ca 0.09 -2.00 0.14 0.00 -1.18 0.00 0.00 61.69 58.74 1rg9 s THR 217 Cb -0.15 -2.52 0.14 0.00 1.34 0.00 0.00 72.50 71.32 1rg9 s THR 217 CO 0.08 0.00 1.43 -1.20 -0.54 0.00 0.00 174.62 174.39 1rg9 n SER 218 N -0.97 0.36 0.09 3.99 7.64 -1.26 -1.79 113.62 121.68 1rg9 n SER 218 Ca -0.01 0.66 -0.22 0.00 1.01 0.00 0.00 58.87 60.31 1rg9 n SER 218 Cb 0.65 -0.71 -0.15 0.00 -1.01 0.00 0.00 64.21 62.99 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 2.03 -0.11 -1.17 -0.43 0.00 -1.94 -3.47 119.26 114.17 1rg9 h ALA 219 Ca 0.00 -0.78 -0.66 0.00 0.00 0.00 0.00 54.91 53.47 1rg9 h ALA 219 Cb 0.03 0.15 0.11 0.00 0.00 0.00 0.00 17.79 18.08 1rg9 h ALA 219 CO 0.00 0.53 -0.40 2.41 0.00 0.00 0.00 179.25 181.78 1rg9 n THR 220 N -3.95 1.96 -4.79 0.00 -1.04 -0.74 -4.94 114.28 100.78 1rg9 n THR 220 Ca -0.16 -0.49 -0.33 0.00 -2.04 0.00 0.00 64.05 61.03 1rg9 n THR 220 Cb 0.94 -0.17 -0.15 0.00 -1.82 0.00 0.00 70.33 69.12 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 -1.07 3.26 -0.19 -2.82 1.02 0.14 -4.96 119.74 115.11 1rg9 s LYS 221 Ca 0.64 -0.75 -0.06 0.00 0.02 0.00 0.00 55.97 55.82 1rg9 s LYS 221 Cb -0.90 -2.56 -0.03 0.00 -0.52 0.00 0.00 37.83 33.82 1rg9 s LYS 221 CO 0.57 0.14 0.03 -0.06 -0.92 0.00 0.00 175.35 175.11 1rg9 s PHE 222 N 0.51 3.14 -0.33 3.18 0.40 -1.26 0.56 117.98 124.17 1rg9 s PHE 222 Ca -0.11 -0.17 -0.01 0.00 -0.60 0.00 0.00 56.93 56.04 1rg9 s PHE 222 Cb -0.16 -2.08 0.08 0.00 0.51 0.00 0.00 43.02 41.36 1rg9 s PHE 222 CO 0.04 -0.04 0.06 -0.06 0.70 0.00 0.00 175.22 175.92 1rg9 s PHE 223 N 0.70 3.45 -0.26 0.36 0.08 0.16 -4.97 117.98 117.50 1rg9 s PHE 223 Ca 0.02 -2.27 0.01 0.00 0.12 0.00 0.00 56.93 54.81 1rg9 s PHE 223 Cb -0.14 -2.56 0.05 0.00 -0.57 0.00 0.00 43.02 39.81 1rg9 s PHE 223 CO 0.02 -0.89 -0.10 0.42 -0.10 0.00 0.00 175.22 174.58 1rg9 s ILE 224 N 1.14 2.37 -1.38 0.64 1.01 -1.26 -0.95 121.20 122.77 1rg9 s ILE 224 Ca 0.01 -1.45 -0.01 0.00 0.00 0.00 0.00 60.65 59.20 1rg9 s ILE 224 Cb -0.21 -2.33 -0.00 0.00 0.01 0.00 0.00 42.46 39.94 1rg9 s ILE 224 CO -0.04 0.04 0.47 0.59 0.00 0.00 0.00 174.94 176.00 1rg9 n ASN 225 N 4.51 -0.54 -0.36 3.58 4.13 -1.08 -4.85 115.26 120.65 1rg9 n ASN 225 Ca -0.15 -0.98 0.03 0.00 1.68 0.00 0.00 54.58 55.16 1rg9 n ASN 225 Cb 0.44 -3.21 0.09 0.00 -1.54 0.00 0.00 39.78 35.56 1rg9 n ASN 225 CO 0.00 0.00 0.00 -2.65 0.28 0.00 0.00 177.26 174.89 1rg9 n PRO 226 N -4.38 -0.15 0.11 3.52 -0.02 -1.26 0.06 135.00 132.88 1rg9 n PRO 226 Ca -0.31 1.49 0.05 0.00 -2.02 0.00 0.00 63.50 62.71 1rg9 n PRO 226 Cb 0.68 -2.22 0.26 0.00 -0.02 0.00 0.00 33.50 32.20 1rg9 n PRO 226 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 1rg9 n THR 227 N -5.50 0.87 -0.08 3.45 -2.24 -1.26 -4.71 114.28 104.82 1rg9 n THR 227 Ca 0.13 0.66 0.00 0.00 -2.27 0.00 0.00 64.05 62.57 1rg9 n THR 227 Cb 0.44 -1.66 0.00 0.00 -2.10 0.00 0.00 70.33 67.00 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 1.62 3.52 3.38 0.00 0.11 -4.98 105.19 107.55 1rg9 n GLY 228 Ca -0.01 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.99 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 -0.42 0.52 -0.48 1.61 3.52 -1.25 -4.88 118.95 117.56 1rg9 s ARG 229 Ca 0.00 1.32 0.05 0.00 -0.13 0.00 0.00 55.73 56.97 1rg9 s ARG 229 Cb 0.00 0.72 0.18 0.00 -1.56 0.00 0.00 34.95 34.29 1rg9 s ARG 229 CO 0.00 -0.24 0.41 0.34 -0.81 0.00 0.00 175.30 175.00 1rg9 n PHE 230 N 5.43 0.19 -0.07 5.12 7.35 -1.26 -4.87 117.46 129.35 1rg9 n PHE 230 Ca -0.10 -3.58 -0.08 0.00 -0.76 0.00 0.00 57.45 52.93 1rg9 n PHE 230 Cb 0.49 -0.03 -0.11 0.00 0.35 0.00 0.00 39.48 40.19 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 2.40 0.99 -3.45 -2.13 0.31 -1.26 -1.65 118.33 113.54 1rg9 n VAL 231 Ca 0.27 -0.56 -0.38 0.00 -0.01 0.00 0.00 64.34 63.66 1rg9 n VAL 231 Cb 0.46 -0.73 -0.08 0.00 -0.91 0.00 0.00 33.84 32.58 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 -2.35 5.23 0.00 2.52 1.01 -1.26 -4.59 121.20 121.76 1rg9 s ILE 232 Ca -0.11 0.58 0.00 0.00 0.00 0.00 0.00 60.65 61.12 1rg9 s ILE 232 Cb 0.05 -3.67 0.00 0.00 0.01 0.00 0.00 42.46 38.84 1rg9 s ILE 232 CO 0.55 0.27 0.00 0.61 0.00 0.00 0.00 174.94 176.37 1rg9 n GLY 233 N 4.05 3.69 7.00 6.18 0.00 -1.26 -4.73 105.19 120.11 1rg9 n GLY 233 Ca -0.10 -0.92 0.00 0.00 0.00 0.00 0.00 46.02 45.00 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 -0.47 0.35 -0.02 0.00 -1.26 -2.51 105.19 101.27 1rg9 n GLY 234 Ca 0.00 -0.99 0.15 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 -0.30 1.61 0.11 -1.89 0.56 132.00 132.10 1rg9 h PRO 235 Ca 0.00 0.00 -0.17 0.00 0.11 0.00 0.00 66.00 65.94 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 -0.48 1.98 -0.21 0.00 0.00 178.00 179.29 1rg9 h MET 236 N 0.00 0.85 0.00 1.05 1.85 -1.80 -3.04 114.93 113.83 1rg9 h MET 236 Ca 0.04 -0.52 0.00 0.00 -0.61 0.00 0.00 59.70 58.61 1rg9 h MET 236 Cb 0.92 0.05 0.00 0.00 0.43 0.00 0.00 31.60 33.01 1rg9 h MET 236 CO -0.00 1.15 -0.89 0.78 -0.40 0.00 0.00 176.91 177.56 1rg9 h GLY 237 N 0.63 0.00 -5.01 1.39 0.00 -0.66 -3.47 103.07 95.95 1rg9 h GLY 237 Ca 0.02 0.00 0.03 0.00 0.00 0.00 0.00 47.33 47.38 1rg9 h GLY 237 CO 0.11 0.00 -0.01 -0.35 0.00 0.00 0.00 176.54 176.29 1rg9 s ASP 238 N -5.17 -0.98 0.15 0.19 2.15 -0.21 -4.98 116.67 107.81 1rg9 s ASP 238 Ca 0.01 1.53 -0.31 0.00 0.43 0.00 0.00 52.55 54.20 1rg9 s ASP 238 Cb 0.10 1.56 -0.10 0.00 -0.30 0.00 0.00 42.92 44.18 1rg9 s ASP 238 CO 0.77 -0.24 1.69 0.00 -0.17 0.00 0.00 175.17 177.23 1rg9 s GLY 240 N 1.80 2.16 0.03 0.00 0.00 0.95 -4.59 107.32 107.67 1rg9 s GLY 240 Ca 0.75 -0.64 -0.02 0.00 0.00 0.00 0.00 44.72 44.81 1rg9 s GLY 240 CO 0.33 -0.38 0.01 -2.27 0.00 0.00 0.00 173.10 170.79 1rg9 s LEU 241 N -1.03 2.15 0.31 0.66 2.96 -1.26 -0.24 118.68 122.23 1rg9 s LEU 241 Ca 0.15 -0.58 -0.28 0.00 -0.22 0.00 0.00 54.13 53.20 1rg9 s LEU 241 Cb -0.12 0.26 -0.09 0.00 0.50 0.00 0.00 46.19 46.74 1rg9 s LEU 241 CO 0.04 -0.41 1.06 -0.89 -1.32 0.00 0.00 176.35 174.83 1rg9 s THR 242 N -2.16 3.66 -0.94 3.68 2.01 -0.67 -3.99 115.64 117.24 1rg9 s THR 242 Ca -0.09 1.54 -0.04 0.00 0.31 0.00 0.00 61.69 63.41 1rg9 s THR 242 Cb -0.05 -3.93 0.00 0.00 0.01 0.00 0.00 72.50 68.54 1rg9 s THR 242 CO -0.03 0.27 0.48 0.61 -0.69 0.00 0.00 174.62 175.25 1rg9 n GLY 243 N 0.95 -0.05 0.30 4.40 0.00 -1.26 -4.93 105.19 104.61 1rg9 n GLY 243 Ca 0.01 -0.18 0.05 0.00 0.00 0.00 0.00 46.02 45.90 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 -2.93 2.51 -0.51 1.61 5.12 -1.26 -4.45 116.66 116.76 1rg9 n ARG 244 Ca -0.05 -2.11 0.07 0.00 -1.93 0.00 0.00 57.85 53.82 1rg9 n ARG 244 Cb 0.57 -1.32 0.16 0.00 -1.16 0.00 0.00 32.46 30.70 1rg9 n ARG 244 CO 0.00 0.00 0.00 1.17 -1.93 0.00 0.00 177.63 176.87 1rg9 n LYS 245 N -0.53 1.27 -0.25 5.56 3.00 -1.26 -4.88 118.16 121.06 1rg9 n LYS 245 Ca 0.10 -2.85 0.10 0.00 -0.00 0.00 0.00 58.31 55.66 1rg9 n LYS 245 Cb 0.49 -1.38 0.19 0.00 0.00 0.00 0.00 35.03 34.34 1rg9 n LYS 245 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.40 176.51 1rg9 n ILE 246 N -1.01 -0.31 0.03 3.15 5.41 -1.26 -1.14 119.36 124.23 1rg9 n ILE 246 Ca 0.16 1.62 -0.19 0.00 1.00 0.00 0.00 62.75 65.34 1rg9 n ILE 246 Cb 0.72 -2.34 -0.14 0.00 -0.71 0.00 0.00 39.64 37.17 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 1.53 0.00 1.39 1.08 -1.98 -3.20 117.51 116.34 1rg9 h ILE 247 Ca 0.42 -2.46 -0.01 0.00 -0.39 0.00 0.00 64.86 62.42 1rg9 h ILE 247 Cb 0.83 3.15 -0.00 0.00 -3.07 0.00 0.00 36.82 37.73 1rg9 h ILE 247 CO -0.70 0.69 -0.05 -0.37 -0.69 0.00 0.00 178.15 177.03 1rg9 h VAL 248 N -0.40 0.16 0.00 1.67 -1.51 -1.75 -1.51 116.25 112.92 1rg9 h VAL 248 Ca -0.12 -0.57 -0.09 0.00 -1.23 0.00 0.00 66.70 64.69 1rg9 h VAL 248 Cb 1.53 1.49 -0.01 0.00 -2.13 0.00 0.00 31.29 32.17 1rg9 h VAL 248 CO 0.13 0.05 -0.44 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 -1.17 -3.39 116.42 119.50 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 0.48 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.25 1rg9 h ASP 249 CO 0.01 0.44 0.00 0.35 -1.57 0.00 0.00 179.24 178.47 1rg9 n THR 250 N -4.01 0.00 -1.04 0.35 -2.24 -0.61 -1.12 114.28 105.61 1rg9 n THR 250 Ca -0.02 0.00 0.03 0.00 -2.27 0.00 0.00 64.05 61.80 1rg9 n THR 250 Cb 0.47 -0.67 0.05 0.00 -2.10 0.00 0.00 70.33 68.08 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 -0.74 0.00 -0.96 4.78 4.01 -1.13 -4.62 117.16 118.50 1rg9 n TYR 251 Ca 0.00 -0.45 0.00 0.00 -0.16 0.00 0.00 57.90 57.29 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 -0.60 0.28 0.00 2.72 0.00 -0.92 -2.61 105.19 104.07 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 -1.07 0.42 0.22 -0.02 0.00 -1.26 -4.49 105.19 98.99 1rg9 n GLY 253 Ca 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.85 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 4.44 0.78 0.00 1.61 -1.53 -1.86 -3.46 114.93 114.91 1rg9 h MET 254 Ca 0.00 -0.63 -0.23 0.00 -3.44 0.00 0.00 59.70 55.40 1rg9 h MET 254 Cb 0.00 0.13 -0.00 0.00 -0.55 0.00 0.00 31.60 31.18 1rg9 h MET 254 CO 0.00 1.24 -0.07 0.00 0.14 0.00 0.00 176.91 178.22 1rg9 n ALA 255 N -2.60 0.48 -1.99 0.39 0.00 -1.26 -5.14 120.51 110.39 1rg9 n ALA 255 Ca -0.07 -0.96 -0.23 0.00 0.00 0.00 0.00 53.44 52.18 1rg9 n ALA 255 Cb 0.73 0.32 0.10 0.00 0.00 0.00 0.00 19.45 20.60 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 -3.11 1.78 -0.12 0.00 3.00 -1.26 -5.00 118.95 114.24 1rg9 s ARG 256 Ca 0.22 -1.11 -0.20 0.00 0.00 0.00 0.00 55.73 54.64 1rg9 s ARG 256 Cb -0.02 -2.36 0.05 0.00 0.00 0.00 0.00 34.95 32.62 1rg9 s ARG 256 CO 0.14 -1.36 0.51 -1.58 0.00 0.00 0.00 175.30 173.01 1rg9 s HIS 257 N -3.09 -0.50 -0.20 -0.53 2.46 -1.26 -4.72 115.29 107.45 1rg9 s HIS 257 Ca 0.65 1.08 0.22 0.00 0.47 0.00 0.00 55.06 57.48 1rg9 s HIS 257 Cb -0.06 0.22 -0.14 0.00 -0.13 0.00 0.00 32.58 32.47 1rg9 s HIS 257 CO 0.44 -0.37 0.80 0.41 -2.47 0.00 0.00 174.74 173.55 1rg9 n GLY 258 N 2.04 -1.24 0.00 1.59 0.00 -1.26 -4.95 105.19 101.36 1rg9 n GLY 258 Ca -0.17 -0.37 0.00 0.00 0.00 0.00 0.00 46.02 45.48 1rg9 n GLY 258 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1rg9 n GLY 259 N 1.24 1.04 3.66 -0.02 0.00 -1.26 -4.77 105.19 105.08 1rg9 n GLY 259 Ca -0.01 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.63 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 -1.06 2.04 0.84 -0.02 0.00 -1.26 -5.08 107.32 102.78 1rg9 s GLY 260 Ca 0.00 -0.65 -0.12 0.00 0.00 0.00 0.00 44.72 43.95 1rg9 s GLY 260 CO 0.00 0.71 1.12 0.00 0.00 0.00 0.00 173.10 174.93 1rg9 s ALA 261 N 1.30 2.12 -0.20 3.20 0.00 -1.26 -4.88 121.76 122.04 1rg9 s ALA 261 Ca 0.15 -0.39 -0.12 0.00 0.00 0.00 0.00 51.96 51.60 1rg9 s ALA 261 Cb -0.14 -3.06 -0.08 0.00 0.00 0.00 0.00 23.12 19.83 1rg9 s ALA 261 CO 0.07 -1.93 -0.29 1.19 0.00 0.00 0.00 175.76 174.80 1rg9 n PHE 262 N -3.54 0.00 -1.88 0.00 3.72 -1.26 -4.35 117.46 110.15 1rg9 n PHE 262 Ca 0.07 0.00 -0.39 0.00 -0.05 0.00 0.00 57.45 57.08 1rg9 n PHE 262 Cb 0.58 -0.70 0.02 0.00 -0.94 0.00 0.00 39.48 38.44 1rg9 n PHE 262 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 176.76 175.59 1rg9 s SER 263 N -6.73 5.63 0.00 4.37 0.01 -1.26 -3.41 113.70 112.31 1rg9 s SER 263 Ca -0.29 2.73 0.00 0.00 1.31 0.00 0.00 55.95 59.69 1rg9 s SER 263 Cb 0.10 -2.64 0.00 0.00 0.21 0.00 0.00 66.02 63.69 1rg9 s SER 263 CO 0.38 -1.32 0.00 0.61 0.41 0.00 0.00 173.24 173.32 1rg9 n GLY 264 N 0.65 1.57 3.55 3.44 0.00 -1.26 -4.83 105.19 108.30 1rg9 n GLY 264 Ca 0.08 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.78 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 -0.54 2.52 0.75 1.61 1.02 -1.22 -0.30 119.74 123.57 1rg9 s LYS 265 Ca 0.00 -0.72 -0.12 0.00 0.02 0.00 0.00 55.97 55.16 1rg9 s LYS 265 Cb 0.00 -2.45 0.04 0.00 -0.52 0.00 0.00 37.83 34.90 1rg9 s LYS 265 CO 0.00 0.61 1.11 0.16 -0.92 0.00 0.00 175.35 176.31 1rg9 s ASP 266 N -1.14 5.00 0.63 2.83 1.47 -0.69 -4.93 116.67 119.84 1rg9 s ASP 266 Ca 0.15 1.15 0.32 0.00 1.18 0.00 0.00 52.55 55.35 1rg9 s ASP 266 Cb -0.11 -1.89 1.77 0.00 -0.34 0.00 0.00 42.92 42.35 1rg9 s ASP 266 CO 0.04 -1.63 2.07 -0.65 0.68 0.00 0.00 175.17 175.69 1rg9 h PRO 267 N -0.85 0.00 0.00 2.11 0.11 -1.91 -1.19 132.00 130.26 1rg9 h PRO 267 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1rg9 h PRO 267 Cb 1.27 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.38 1rg9 h PRO 267 CO 0.63 0.00 0.00 -1.13 -0.21 0.00 0.00 178.00 177.29 1rg9 n SER 268 N -3.38 0.00 -4.40 -2.05 3.41 -1.26 -4.24 113.62 101.71 1rg9 n SER 268 Ca 0.00 0.04 -0.44 0.00 -0.26 0.00 0.00 58.87 58.21 1rg9 n SER 268 Cb 0.33 -0.23 -0.05 0.00 -0.26 0.00 0.00 64.21 64.01 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 -2.45 3.07 0.58 4.33 3.01 -0.45 -2.33 119.74 125.50 1rg9 s LYS 269 Ca 0.11 -1.18 0.30 0.00 -1.01 0.00 0.00 55.97 54.20 1rg9 s LYS 269 Cb 0.07 -4.23 1.39 0.00 -1.01 0.00 0.00 37.83 34.05 1rg9 s LYS 269 CO 0.15 -1.52 1.76 -0.39 0.51 0.00 0.00 175.35 175.86 1rg9 h VAL 270 N 5.92 0.30 -0.98 3.17 -1.51 -1.88 0.05 116.25 121.34 1rg9 h VAL 270 Ca -0.29 0.00 0.14 0.00 -1.23 0.00 0.00 66.70 65.32 1rg9 h VAL 270 Cb 1.09 0.45 -0.09 0.00 -2.13 0.00 0.00 31.29 30.61 1rg9 h VAL 270 CO 1.09 0.00 0.59 0.44 -1.23 0.00 0.00 177.57 178.46 1rg9 h ASP 271 N 0.00 0.82 0.01 4.19 3.45 -1.92 -1.51 116.42 121.47 1rg9 h ASP 271 Ca 0.35 0.07 -0.37 0.00 0.43 0.00 0.00 57.03 57.51 1rg9 h ASP 271 Cb 1.77 -0.09 -0.05 0.00 -0.56 0.00 0.00 39.33 40.40 1rg9 h ASP 271 CO -0.00 0.39 -2.08 -1.14 -1.57 0.00 0.00 179.24 174.84 1rg9 n ARG 272 N -4.70 0.61 -0.11 3.56 0.63 -0.03 -3.95 116.66 112.67 1rg9 n ARG 272 Ca 0.20 0.34 -0.13 0.00 -0.92 0.00 0.00 57.85 57.34 1rg9 n ARG 272 Cb 0.43 -1.60 -0.03 0.00 0.45 0.00 0.00 32.46 31.71 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 -0.73 0.91 0.72 6.15 4.64 -1.50 -1.67 113.55 122.07 1rg9 h SER 273 Ca -0.54 -0.46 -0.13 0.00 -0.47 0.00 0.00 61.79 60.18 1rg9 h SER 273 Cb 1.61 -0.26 -0.02 0.00 -0.31 0.00 0.00 62.40 63.43 1rg9 h SER 273 CO -0.25 1.19 -0.61 0.00 -0.87 0.00 0.00 176.83 176.29 1rg9 h ALA 274 N 0.75 0.92 0.34 5.18 0.00 -1.52 -0.68 119.26 124.25 1rg9 h ALA 274 Ca 0.06 -0.55 -0.02 0.00 0.00 0.00 0.00 54.91 54.40 1rg9 h ALA 274 Cb 0.93 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.62 1rg9 h ALA 274 CO 0.09 0.76 -0.16 0.00 0.00 0.00 0.00 179.25 179.93 1rg9 h ALA 275 N 1.39 -0.45 -0.23 0.00 0.00 -1.50 -1.47 119.26 117.01 1rg9 h ALA 275 Ca -0.01 -0.19 0.05 0.00 0.00 0.00 0.00 54.91 54.77 1rg9 h ALA 275 Cb 1.13 0.17 -0.05 0.00 0.00 0.00 0.00 17.79 19.04 1rg9 h ALA 275 CO 0.08 -0.57 -0.11 1.88 0.00 0.00 0.00 179.25 180.53 1rg9 h TYR 276 N -0.82 -0.27 -0.41 0.00 0.05 -1.23 0.27 116.97 114.56 1rg9 h TYR 276 Ca -0.05 0.03 0.10 0.00 0.05 0.00 0.00 58.73 58.86 1rg9 h TYR 276 Cb 0.52 0.16 -0.02 0.00 1.01 0.00 0.00 36.73 38.40 1rg9 h TYR 276 CO 0.02 -0.17 0.29 0.00 -1.05 0.00 0.00 178.16 177.25 1rg9 h ALA 277 N 1.11 2.26 -0.18 3.88 0.00 -1.13 -0.28 119.26 124.91 1rg9 h ALA 277 Ca 0.12 -0.01 -0.17 0.00 0.00 0.00 0.00 54.91 54.85 1rg9 h ALA 277 Cb 0.27 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.06 1rg9 h ALA 277 CO -0.29 -0.37 -0.59 0.00 0.00 0.00 0.00 179.25 178.01 1rg9 h ALA 278 N 1.79 0.63 -0.07 0.00 0.00 0.14 -2.07 119.26 119.67 1rg9 h ALA 278 Ca 0.19 -0.53 -0.13 0.00 0.00 0.00 0.00 54.91 54.44 1rg9 h ALA 278 Cb 0.64 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 1rg9 h ALA 278 CO -0.02 0.70 -0.56 -0.09 0.00 0.00 0.00 179.25 179.28 1rg9 h ARG 279 N 0.45 0.21 0.15 0.00 9.65 -0.17 -2.49 114.38 122.17 1rg9 h ARG 279 Ca -0.00 -0.13 -0.00 0.00 -1.10 0.00 0.00 59.98 58.75 1rg9 h ARG 279 Cb 1.15 0.01 -0.01 0.00 -1.39 0.00 0.00 29.97 29.74 1rg9 h ARG 279 CO 0.11 0.71 -0.11 -0.92 2.80 0.00 0.00 179.97 182.57 1rg9 h TYR 280 N 0.16 -0.27 -0.15 2.20 3.20 -0.81 0.14 116.97 121.44 1rg9 h TYR 280 Ca -0.00 -0.00 -0.23 0.00 3.14 0.00 0.00 58.73 61.64 1rg9 h TYR 280 Cb 1.03 0.10 0.01 0.00 1.54 0.00 0.00 36.73 39.41 1rg9 h TYR 280 CO 0.02 -0.17 -0.79 -0.39 -1.64 0.00 0.00 178.16 175.19 1rg9 h VAL 281 N -0.26 1.28 -0.38 1.81 -1.51 -1.38 -1.29 116.25 114.52 1rg9 h VAL 281 Ca -0.01 -1.99 0.00 0.00 -1.23 0.00 0.00 66.70 63.47 1rg9 h VAL 281 Cb 0.23 2.00 -0.02 0.00 -2.13 0.00 0.00 31.29 31.37 1rg9 h VAL 281 CO 0.00 0.63 0.25 0.00 -1.23 0.00 0.00 177.57 177.22 1rg9 h ALA 282 N 0.56 0.48 0.03 5.19 0.00 -1.41 0.38 119.26 124.49 1rg9 h ALA 282 Ca -0.06 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.82 1rg9 h ALA 282 Cb 1.42 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 19.06 1rg9 h ALA 282 CO 0.16 -0.05 -0.01 -0.22 0.00 0.00 0.00 179.25 179.13 1rg9 h LYS 283 N 0.52 -0.04 -0.44 0.00 3.64 -1.00 -2.52 116.57 116.73 1rg9 h LYS 283 Ca 0.14 0.00 0.05 0.00 -1.27 0.00 0.00 60.65 59.58 1rg9 h LYS 283 Cb -0.05 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 31.75 1rg9 h LYS 283 CO -0.03 0.15 0.29 -0.91 -2.27 0.00 0.00 179.45 176.69 1rg9 h ASN 284 N -0.22 0.32 -0.14 4.20 2.35 -0.85 -0.02 115.58 121.22 1rg9 h ASN 284 Ca -0.00 -0.00 -0.04 0.00 -0.55 0.00 0.00 56.30 55.71 1rg9 h ASN 284 Cb 0.21 -0.07 -0.00 0.00 0.05 0.00 0.00 38.32 38.50 1rg9 h ASN 284 CO 0.01 0.21 -0.06 0.40 -1.65 0.00 0.00 177.43 176.34 1rg9 h ILE 285 N 0.37 1.31 -0.44 2.81 2.04 -0.05 0.42 117.51 123.96 1rg9 h ILE 285 Ca 0.19 -1.08 -0.09 0.00 1.00 0.00 0.00 64.86 64.87 1rg9 h ILE 285 Cb 0.28 1.74 -0.02 0.00 -0.74 0.00 0.00 36.82 38.08 1rg9 h ILE 285 CO -0.04 0.31 -0.10 0.58 0.00 0.00 0.00 178.15 178.90 1rg9 h VAL 286 N -0.05 1.26 -0.57 1.67 2.07 -0.96 -1.80 116.25 117.87 1rg9 h VAL 286 Ca 0.03 -1.17 -0.09 0.00 0.82 0.00 0.00 66.70 66.30 1rg9 h VAL 286 Cb 0.52 1.03 -0.02 0.00 -1.52 0.00 0.00 31.29 31.30 1rg9 h VAL 286 CO 0.02 0.40 0.02 0.00 0.02 0.00 0.00 177.57 178.03 1rg9 h ALA 287 N 1.16 0.95 0.00 1.67 0.00 -0.97 0.17 119.26 122.24 1rg9 h ALA 287 Ca 0.12 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.74 1rg9 h ALA 287 Cb 0.59 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.16 1rg9 h ALA 287 CO 0.04 0.63 0.00 0.00 0.00 0.00 0.00 179.25 179.92 1rg9 n ALA 288 N -2.48 1.63 -1.10 0.00 0.00 0.13 -4.85 120.51 113.84 1rg9 n ALA 288 Ca 0.03 -0.05 -0.03 0.00 0.00 0.00 0.00 53.44 53.39 1rg9 n ALA 288 Cb 0.32 -1.20 -0.01 0.00 0.00 0.00 0.00 19.45 18.56 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 -0.23 0.63 0.00 0.00 0.00 0.05 -4.74 105.19 100.91 1rg9 n GLY 289 Ca 0.04 -0.42 0.13 0.00 0.00 0.00 0.00 46.02 45.77 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 -0.40 0.03 -3.53 0.99 4.77 -0.75 -4.78 117.00 113.35 1rg9 n LEU 290 Ca -0.03 0.50 -0.10 0.00 -0.03 0.00 0.00 56.01 56.35 1rg9 n LEU 290 Cb 0.18 -0.49 -0.03 0.00 -2.33 0.00 0.00 43.42 40.75 1rg9 n LEU 290 CO 0.05 -0.04 0.69 0.00 -1.33 0.00 0.00 177.39 176.77 1rg9 s ALA 291 N -3.01 -1.85 0.03 -1.18 0.00 -1.26 -0.44 121.76 114.07 1rg9 s ALA 291 Ca 0.13 1.20 0.10 0.00 0.00 0.00 0.00 51.96 53.39 1rg9 s ALA 291 Cb 0.18 0.06 -0.19 0.00 0.00 0.00 0.00 23.12 23.16 1rg9 s ALA 291 CO 0.50 -0.55 1.07 -0.44 0.00 0.00 0.00 175.76 176.34 1rg9 h ASP 292 N 2.24 0.00 -2.78 0.00 3.45 -1.86 -3.38 116.42 114.09 1rg9 h ASP 292 Ca -0.21 0.00 0.04 0.00 0.43 0.00 0.00 57.03 57.29 1rg9 h ASP 292 Cb 1.21 0.00 -0.22 0.00 -0.56 0.00 0.00 39.33 39.77 1rg9 h ASP 292 CO 0.32 0.93 0.04 0.00 -1.57 0.00 0.00 179.24 178.96 1rg9 s ARG 293 N -2.71 0.65 -0.04 3.56 1.70 -1.26 -1.82 118.95 119.03 1rg9 s ARG 293 Ca -0.01 1.19 -0.05 0.00 -0.47 0.00 0.00 55.73 56.40 1rg9 s ARG 293 Cb 0.09 0.24 0.01 0.00 -0.57 0.00 0.00 34.95 34.72 1rg9 s ARG 293 CO 0.81 -0.15 0.13 0.00 -1.08 0.00 0.00 175.30 175.02 1rg9 s GLU 295 N -0.16 3.67 0.14 0.00 2.12 0.12 -2.46 118.70 122.14 1rg9 s GLU 295 Ca -0.02 -0.43 0.07 0.00 0.36 0.00 0.00 54.97 54.95 1rg9 s GLU 295 Cb -0.02 -3.01 -0.04 0.00 0.26 0.00 0.00 34.13 31.32 1rg9 s GLU 295 CO 0.00 0.33 -0.07 0.42 -0.54 0.00 0.00 175.26 175.41 1rg9 s ILE 296 N 0.15 3.48 -0.14 -3.70 -1.09 -0.03 -0.15 121.20 119.72 1rg9 s ILE 296 Ca 0.01 -1.36 -0.06 0.00 -2.23 0.00 0.00 60.65 57.01 1rg9 s ILE 296 Cb -0.13 -2.68 0.06 0.00 -1.58 0.00 0.00 42.46 38.13 1rg9 s ILE 296 CO 0.02 0.01 0.31 -1.58 -1.23 0.00 0.00 174.94 172.47 1rg9 s GLN 297 N -2.52 0.22 0.24 2.79 0.74 -0.57 -0.18 119.66 120.39 1rg9 s GLN 297 Ca 0.24 0.76 0.11 0.00 0.05 0.00 0.00 55.36 56.52 1rg9 s GLN 297 Cb -0.10 0.01 -0.05 0.00 1.10 0.00 0.00 33.01 33.97 1rg9 s GLN 297 CO 0.16 -0.24 -0.20 0.14 -0.55 0.00 0.00 175.29 174.60 1rg9 s VAL 298 N 2.07 2.30 0.02 1.34 -7.23 -0.61 -1.54 120.40 116.75 1rg9 s VAL 298 Ca -0.03 -2.25 -0.01 0.00 -1.81 0.00 0.00 61.98 57.88 1rg9 s VAL 298 Cb -0.11 -2.18 -0.02 0.00 0.56 0.00 0.00 36.38 34.63 1rg9 s VAL 298 CO -0.10 -0.34 0.00 -0.94 -0.31 0.00 0.00 175.10 173.41 1rg9 s SER 299 N -3.20 0.19 0.31 4.85 1.04 -0.73 0.80 113.70 116.96 1rg9 s SER 299 Ca 0.25 -0.43 0.03 0.00 0.48 0.00 0.00 55.95 56.28 1rg9 s SER 299 Cb -0.05 0.12 -0.05 0.00 0.10 0.00 0.00 66.02 66.13 1rg9 s SER 299 CO 0.12 -0.30 0.10 -0.31 0.98 0.00 0.00 173.24 173.82 1rg9 s TYR 300 N -1.40 1.72 -0.09 5.02 1.51 0.31 -0.75 117.35 123.67 1rg9 s TYR 300 Ca -0.15 -1.15 0.01 0.00 -1.01 0.00 0.00 57.07 54.77 1rg9 s TYR 300 Cb -0.09 -1.05 0.02 0.00 -0.11 0.00 0.00 41.96 40.73 1rg9 s TYR 300 CO -0.01 -0.25 -0.10 0.00 -1.11 0.00 0.00 175.55 174.09 1rg9 s ALA 301 N -3.52 1.31 0.16 3.71 0.00 -1.26 -1.71 121.76 120.45 1rg9 s ALA 301 Ca 0.35 -0.50 -0.33 0.00 0.00 0.00 0.00 51.96 51.49 1rg9 s ALA 301 Cb 0.07 -0.76 -0.17 0.00 0.00 0.00 0.00 23.12 22.26 1rg9 s ALA 301 CO 0.15 -0.18 0.97 1.51 0.00 0.00 0.00 175.76 178.21 1rg9 n ILE 302 N 4.43 1.10 -0.66 0.00 3.06 -1.21 -0.43 119.36 125.64 1rg9 n ILE 302 Ca -0.17 -0.27 0.00 0.00 -2.50 0.00 0.00 62.75 59.80 1rg9 n ILE 302 Cb 0.51 -0.49 0.00 0.00 0.54 0.00 0.00 39.64 40.20 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 1.84 0.93 3.47 4.50 0.00 -0.35 -4.87 105.19 110.70 1rg9 n GLY 303 Ca 0.16 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.83 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 -2.83 4.09 0.14 1.61 1.01 0.42 -4.44 120.40 120.41 1rg9 s VAL 304 Ca 0.00 -0.26 -0.03 0.00 0.00 0.00 0.00 61.98 61.69 1rg9 s VAL 304 Cb 0.00 -2.86 -0.16 0.00 0.00 0.00 0.00 36.38 33.36 1rg9 s VAL 304 CO 0.00 0.42 1.34 0.00 0.00 0.00 0.00 175.10 176.86 1rg9 h ALA 305 N 7.53 0.43 -2.53 5.51 0.00 -1.77 -2.54 119.26 125.89 1rg9 h ALA 305 Ca -0.36 -0.69 -0.59 0.00 0.00 0.00 0.00 54.91 53.26 1rg9 h ALA 305 Cb 1.18 -0.04 -0.09 0.00 0.00 0.00 0.00 17.79 18.84 1rg9 h ALA 305 CO 0.61 0.82 0.17 -2.00 0.00 0.00 0.00 179.25 178.85 1rg9 s GLU 306 N -3.32 4.20 0.16 0.00 2.56 -1.26 -3.79 118.70 117.25 1rg9 s GLU 306 Ca -0.05 0.66 -0.32 0.00 0.00 0.00 0.00 54.97 55.26 1rg9 s GLU 306 Cb 0.09 -3.59 -0.17 0.00 2.00 0.00 0.00 34.13 32.46 1rg9 s GLU 306 CO 0.86 -0.28 0.88 -2.30 -0.56 0.00 0.00 175.26 173.85 1rg9 n PRO 307 N 5.20 0.50 0.17 4.30 -0.02 -1.26 -4.80 135.00 139.10 1rg9 n PRO 307 Ca -0.00 0.18 0.10 0.00 -2.02 0.00 0.00 63.50 61.75 1rg9 n PRO 307 Cb 0.49 -1.47 0.10 0.00 -0.02 0.00 0.00 33.50 32.60 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 2.01 0.17 -1.98 3.45 1.35 -1.27 -3.47 112.91 113.17 1rg9 h THR 308 Ca -0.38 -1.26 -0.05 0.00 -0.55 0.00 0.00 66.41 64.17 1rg9 h THR 308 Cb 1.40 1.98 -0.20 0.00 -1.73 0.00 0.00 68.15 69.60 1rg9 h THR 308 CO 0.63 0.10 0.20 -0.94 -0.25 0.00 0.00 175.52 175.25 1rg9 s SER 309 N -6.06 -0.66 -0.15 5.36 1.04 -1.18 -4.94 113.70 107.10 1rg9 s SER 309 Ca 0.04 0.85 -0.11 0.00 0.48 0.00 0.00 55.95 57.22 1rg9 s SER 309 Cb 0.07 0.72 0.05 0.00 0.10 0.00 0.00 66.02 66.95 1rg9 s SER 309 CO 0.71 -0.52 0.38 -0.63 0.98 0.00 0.00 173.24 174.17 1rg9 s ILE 310 N -0.86 -0.01 -0.22 -1.02 1.01 -1.25 -1.77 121.20 117.09 1rg9 s ILE 310 Ca -0.08 0.05 -0.14 0.00 0.00 0.00 0.00 60.65 60.47 1rg9 s ILE 310 Cb -0.01 -0.55 0.06 0.00 0.01 0.00 0.00 42.46 41.97 1rg9 s ILE 310 CO 0.08 0.02 0.54 -0.32 0.00 0.00 0.00 174.94 175.26 1rg9 s MET 311 N 0.73 0.56 -0.12 2.79 1.75 -0.59 -4.99 119.30 119.44 1rg9 s MET 311 Ca -0.04 0.92 -0.02 0.00 -1.25 0.00 0.00 55.69 55.30 1rg9 s MET 311 Cb -0.05 0.12 -0.03 0.00 2.84 0.00 0.00 34.83 37.71 1rg9 s MET 311 CO -0.05 -0.13 -0.03 0.14 -0.65 0.00 0.00 175.02 174.29 1rg9 s VAL 312 N 1.17 3.96 -0.16 10.11 -7.23 -1.26 -1.50 120.40 125.47 1rg9 s VAL 312 Ca -0.07 -0.36 0.01 0.00 -1.81 0.00 0.00 61.98 59.75 1rg9 s VAL 312 Cb -0.06 -2.69 0.03 0.00 0.56 0.00 0.00 36.38 34.22 1rg9 s VAL 312 CO -0.11 0.55 -0.14 -0.70 -0.31 0.00 0.00 175.10 174.39 1rg9 s GLU 313 N -0.24 2.28 0.00 4.82 2.56 0.79 -4.97 118.70 123.94 1rg9 s GLU 313 Ca 0.04 -0.65 0.13 0.00 0.00 0.00 0.00 54.97 54.49 1rg9 s GLU 313 Cb -0.13 -2.22 0.26 0.00 2.00 0.00 0.00 34.13 34.05 1rg9 s GLU 313 CO 0.02 -0.28 1.16 0.25 -0.56 0.00 0.00 175.26 175.85 1rg9 n THR 314 N 4.74 0.64 -3.53 -1.70 -2.24 -1.26 0.14 114.28 111.06 1rg9 n THR 314 Ca -0.17 -0.82 -0.26 0.00 -2.27 0.00 0.00 64.05 60.54 1rg9 n THR 314 Cb 0.49 0.78 -0.00 0.00 -2.10 0.00 0.00 70.33 69.50 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 0.70 -1.84 0.00 4.78 3.01 -1.26 -0.33 117.46 122.52 1rg9 n PHE 315 Ca 0.11 0.56 0.00 0.00 1.01 0.00 0.00 57.45 59.13 1rg9 n PHE 315 Cb 0.41 -3.09 0.00 0.00 -0.01 0.00 0.00 39.48 36.79 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 -1.26 2.32 0.00 1.37 0.00 -1.26 -4.82 105.19 101.54 1rg9 n GLY 316 Ca 0.00 0.00 0.07 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 -1.00 2.61 -2.24 0.55 -4.85 114.28 107.47 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 -0.45 0.14 0.00 -2.10 0.00 0.00 70.33 67.92 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 1.25 0.00 -0.78 1.03 -1.25 -2.98 118.70 113.98 1rg9 s GLU 318 Ca 0.20 1.15 0.00 0.00 0.03 0.00 0.00 54.97 56.35 1rg9 s GLU 318 Cb 0.09 -1.78 0.00 0.00 -0.80 0.00 0.00 34.13 31.64 1rg9 s GLU 318 CO 0.16 -2.34 0.25 1.63 -1.33 0.00 0.00 175.26 173.62 1rg9 n LYS 319 N -3.99 2.11 -4.14 -4.83 4.76 0.42 -4.90 118.16 107.59 1rg9 n LYS 319 Ca 0.09 -0.25 -0.17 0.00 -2.87 0.00 0.00 58.31 55.11 1rg9 n LYS 319 Cb 0.53 -0.72 -0.15 0.00 -1.84 0.00 0.00 35.03 32.86 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 -0.37 0.41 0.07 -0.18 -7.23 -1.26 -5.08 120.40 106.76 1rg9 s VAL 320 Ca 0.00 -0.17 -0.37 0.00 -1.81 0.00 0.00 61.98 59.63 1rg9 s VAL 320 Cb 0.00 -0.38 -0.17 0.00 0.56 0.00 0.00 36.38 36.38 1rg9 s VAL 320 CO 0.00 0.14 1.28 -2.65 -0.31 0.00 0.00 175.10 173.56 1rg9 n PRO 321 N 3.32 0.89 -0.28 4.82 -0.02 -1.26 -4.65 135.00 137.81 1rg9 n PRO 321 Ca -0.17 0.32 0.15 0.00 -2.02 0.00 0.00 63.50 61.78 1rg9 n PRO 321 Cb 0.56 -1.93 0.29 0.00 -0.02 0.00 0.00 33.50 32.40 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 2.28 -0.02 -0.06 2.55 7.64 -1.26 -1.43 113.62 123.32 1rg9 n SER 322 Ca 0.19 1.40 -0.02 0.00 1.01 0.00 0.00 58.87 61.45 1rg9 n SER 322 Cb 0.17 -0.54 -0.02 0.00 -1.01 0.00 0.00 64.21 62.81 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 -5.12 -0.07 0.25 1.43 2.13 -1.26 0.12 120.64 118.12 1rg9 n GLU 323 Ca 0.22 0.93 0.11 0.00 0.66 0.00 0.00 57.16 59.08 1rg9 n GLU 323 Cb 0.72 -1.39 0.65 0.00 0.27 0.00 0.00 31.44 31.69 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 -1.58 -1.04 115.11 120.87 1rg9 h GLN 324 Ca 0.02 0.00 -0.10 0.00 0.09 0.00 0.00 58.65 58.67 1rg9 h GLN 324 Cb 0.06 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 27.61 1rg9 h GLN 324 CO -0.14 0.16 -0.46 1.25 0.09 0.00 0.00 178.83 179.72 1rg9 h LEU 325 N 0.00 0.00 0.01 0.06 5.85 0.73 0.10 115.31 122.05 1rg9 h LEU 325 Ca -0.00 0.00 -0.29 0.00 0.84 0.00 0.00 57.88 58.42 1rg9 h LEU 325 Cb 0.41 0.00 -0.05 0.00 0.37 0.00 0.00 40.66 41.39 1rg9 h LEU 325 CO 0.02 0.46 -1.71 0.41 -0.34 0.00 0.00 178.44 177.28 1rg9 n THR 326 N -3.76 1.62 0.22 1.05 -1.04 0.32 -3.18 114.28 109.51 1rg9 n THR 326 Ca -0.01 -0.79 0.12 0.00 -2.04 0.00 0.00 64.05 61.33 1rg9 n THR 326 Cb 0.52 -1.08 0.27 0.00 -1.82 0.00 0.00 70.33 68.22 1rg9 n THR 326 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 1rg9 h LEU 327 N 0.00 0.00 -0.02 -4.42 4.07 -1.16 -3.01 115.31 110.78 1rg9 h LEU 327 Ca -0.29 0.00 -0.26 0.00 0.08 0.00 0.00 57.88 57.41 1rg9 h LEU 327 Cb 2.01 0.00 0.02 0.00 1.08 0.00 0.00 40.66 43.77 1rg9 h LEU 327 CO 0.08 0.08 -1.07 0.25 -1.08 0.00 0.00 178.44 176.71 1rg9 h LEU 328 N 0.00 0.79 0.33 1.67 5.85 -1.05 -3.04 115.31 119.86 1rg9 h LEU 328 Ca -0.00 -0.66 -0.01 0.00 0.84 0.00 0.00 57.88 58.05 1rg9 h LEU 328 Cb 0.94 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 41.71 1rg9 h LEU 328 CO 0.01 1.46 -0.40 0.58 -0.34 0.00 0.00 178.44 179.75 1rg9 h VAL 329 N 0.32 0.00 0.00 1.05 2.07 -1.48 0.29 116.25 118.50 1rg9 h VAL 329 Ca -0.13 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.39 1rg9 h VAL 329 Cb 1.72 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 31.49 1rg9 h VAL 329 CO 0.20 0.00 0.00 -2.11 0.02 0.00 0.00 177.57 175.68 1rg9 n ARG 330 N -4.80 0.01 -0.02 1.57 -4.01 -1.22 -1.63 116.66 106.56 1rg9 n ARG 330 Ca -0.09 0.30 -0.18 0.00 -1.04 0.00 0.00 57.85 56.85 1rg9 n ARG 330 Cb 0.35 -1.53 -0.14 0.00 -3.04 0.00 0.00 32.46 28.11 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 0.14 0.08 2.89 5.08 -1.09 -3.41 114.58 118.28 1rg9 h GLU 331 Ca 0.00 -0.24 -0.17 0.00 -1.00 0.00 0.00 59.36 57.95 1rg9 h GLU 331 Cb 0.22 0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.56 1rg9 h GLU 331 CO 0.00 1.12 -0.81 0.74 -1.00 0.00 0.00 179.01 179.05 1rg9 h PHE 332 N -0.69 0.32 -2.48 4.33 -1.00 -0.11 -3.48 116.94 113.83 1rg9 h PHE 332 Ca -0.11 -0.23 -0.53 0.00 2.81 0.00 0.00 57.97 59.91 1rg9 h PHE 332 Cb 1.34 -0.01 -0.04 0.00 3.61 0.00 0.00 35.95 40.85 1rg9 h PHE 332 CO 0.22 1.32 -0.51 -0.06 -1.61 0.00 0.00 178.31 177.67 1rg9 s PHE 333 N -2.38 3.28 -0.37 -0.55 0.08 -0.65 -5.09 117.98 112.30 1rg9 s PHE 333 Ca -0.18 0.00 -0.08 0.00 0.12 0.00 0.00 56.93 56.79 1rg9 s PHE 333 Cb 0.01 -1.54 0.05 0.00 -0.57 0.00 0.00 43.02 40.98 1rg9 s PHE 333 CO 0.75 0.51 0.18 0.34 -0.10 0.00 0.00 175.22 176.89 1rg9 s ASP 334 N -3.42 5.48 -0.03 1.36 3.68 -1.26 -4.59 116.67 117.88 1rg9 s ASP 334 Ca 0.33 -1.29 0.16 0.00 2.13 0.00 0.00 52.55 53.87 1rg9 s ASP 334 Cb -0.10 -1.93 0.50 0.00 -1.45 0.00 0.00 42.92 39.95 1rg9 s ASP 334 CO 0.26 -0.42 1.40 0.18 0.13 0.00 0.00 175.17 176.72 1rg9 n LEU 335 N 4.86 3.19 -4.76 -1.34 4.32 -1.26 -3.20 117.00 118.81 1rg9 n LEU 335 Ca -0.11 -1.60 -0.39 0.00 -0.02 0.00 0.00 56.01 53.89 1rg9 n LEU 335 Cb 0.44 -0.41 -0.04 0.00 -1.62 0.00 0.00 43.42 41.78 1rg9 n LEU 335 CO 0.35 0.69 0.77 -0.13 -1.22 0.00 0.00 177.39 177.85 1rg9 s ARG 336 N -1.46 4.53 0.14 3.23 0.52 -1.26 -4.73 118.95 119.93 1rg9 s ARG 336 Ca 0.37 1.72 -0.19 0.00 -0.52 0.00 0.00 55.73 57.11 1rg9 s ARG 336 Cb 0.21 -3.04 0.05 0.00 0.52 0.00 0.00 34.95 32.69 1rg9 s ARG 336 CO 0.22 0.14 1.17 -2.30 0.02 0.00 0.00 175.30 174.55 1rg9 n PRO 337 N 0.90 -0.27 -0.29 3.54 -0.01 -1.25 0.47 135.00 138.09 1rg9 n PRO 337 Ca 0.00 1.16 -0.01 0.00 -0.01 0.00 0.00 63.50 64.64 1rg9 n PRO 337 Cb 0.46 -1.71 0.10 0.00 -0.01 0.00 0.00 33.50 32.34 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 -5.02 0.70 -0.02 6.00 4.02 -1.26 -3.25 117.16 118.32 1rg9 n TYR 338 Ca 0.04 -0.42 -0.03 0.00 -0.01 0.00 0.00 57.90 57.48 1rg9 n TYR 338 Cb 0.24 -0.29 -0.02 0.00 -0.02 0.00 0.00 39.34 39.25 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 0.13 -0.10 0.12 2.72 0.00 0.18 -4.55 105.19 103.70 1rg9 n GLY 339 Ca 0.11 -0.04 -0.06 0.00 0.00 0.00 0.00 46.02 46.03 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 0.15 -0.64 0.99 4.07 -1.41 0.83 115.31 119.30 1rg9 h LEU 340 Ca -0.11 -0.11 -0.10 0.00 0.08 0.00 0.00 57.88 57.64 1rg9 h LEU 340 Cb 1.18 -0.04 -0.02 0.00 1.08 0.00 0.00 40.66 42.86 1rg9 h LEU 340 CO -0.01 0.87 -0.07 0.40 -1.08 0.00 0.00 178.44 178.56 1rg9 h ILE 341 N 0.07 1.26 -0.03 1.22 2.04 -1.82 0.11 117.51 120.36 1rg9 h ILE 341 Ca -0.02 -1.21 -0.16 0.00 1.00 0.00 0.00 64.86 64.47 1rg9 h ILE 341 Cb 1.38 0.91 0.01 0.00 -0.74 0.00 0.00 36.82 38.38 1rg9 h ILE 341 CO 0.11 0.43 -0.61 1.56 0.00 0.00 0.00 178.15 179.64 1rg9 h GLN 342 N 0.90 0.47 -0.94 2.37 1.08 -1.79 0.69 115.11 117.89 1rg9 h GLN 342 Ca 0.15 -0.46 0.21 0.00 -1.45 0.00 0.00 58.65 57.10 1rg9 h GLN 342 Cb 0.62 0.12 -0.12 0.00 -0.05 0.00 0.00 27.48 28.05 1rg9 h GLN 342 CO 0.04 1.11 0.49 1.98 -0.95 0.00 0.00 178.83 181.50 1rg9 h MET 343 N 0.01 0.52 -0.09 1.46 1.85 -0.56 -2.03 114.93 116.08 1rg9 h MET 343 Ca -0.07 -0.03 0.00 0.00 -0.61 0.00 0.00 59.70 58.99 1rg9 h MET 343 Cb 1.30 -0.12 0.00 0.00 0.43 0.00 0.00 31.60 33.21 1rg9 h MET 343 CO 0.12 0.34 0.00 1.28 -0.40 0.00 0.00 176.91 178.25 1rg9 n LEU 344 N -4.94 2.04 -3.67 3.39 4.77 0.35 -5.02 117.00 113.93 1rg9 n LEU 344 Ca 0.23 -1.32 -0.29 0.00 -0.03 0.00 0.00 56.01 54.60 1rg9 n LEU 344 Cb 0.65 -0.06 0.04 0.00 -2.33 0.00 0.00 43.42 41.72 1rg9 n LEU 344 CO 0.16 0.45 -0.08 -0.67 -1.33 0.00 0.00 177.39 175.92 1rg9 n ASP 345 N 0.42 -4.67 -0.01 -1.43 -0.08 0.23 -4.84 116.55 106.17 1rg9 n ASP 345 Ca 0.06 -0.97 0.15 0.00 -1.51 0.00 0.00 54.79 52.52 1rg9 n ASP 345 Cb 0.27 -3.57 0.82 0.00 2.34 0.00 0.00 41.12 40.98 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 -4.13 0.02 -3.66 -2.67 4.77 -0.35 -4.49 117.00 106.50 1rg9 n LEU 346 Ca -0.13 0.17 -0.41 0.00 -0.03 0.00 0.00 56.01 55.61 1rg9 n LEU 346 Cb 0.61 -0.18 -0.00 0.00 -2.33 0.00 0.00 43.42 41.51 1rg9 n LEU 346 CO 0.67 0.00 2.49 0.18 -1.33 0.00 0.00 177.39 179.40 1rg9 n LEU 347 N -1.17 7.34 -3.64 2.23 7.99 -1.26 -4.78 117.00 123.71 1rg9 n LEU 347 Ca 0.18 -4.51 -0.12 0.00 -0.01 0.00 0.00 56.01 51.55 1rg9 n LEU 347 Cb 0.20 -1.52 -0.06 0.00 -0.11 0.00 0.00 43.42 41.93 1rg9 n LEU 347 CO 0.21 1.55 0.17 -1.00 -1.51 0.00 0.00 177.39 176.82 1rg9 s HIS 348 N 1.16 -0.27 -1.20 -1.77 3.76 -1.26 -4.82 115.29 110.88 1rg9 s HIS 348 Ca 0.49 0.18 -0.17 0.00 -0.15 0.00 0.00 55.06 55.41 1rg9 s HIS 348 Cb 0.14 0.25 0.11 0.00 1.11 0.00 0.00 32.58 34.19 1rg9 s HIS 348 CO -0.05 -0.61 1.53 -1.25 -0.85 0.00 0.00 174.74 173.51 1rg9 s PRO 349 N -2.80 3.96 -0.04 8.40 0.04 -1.26 -4.55 135.00 138.74 1rg9 s PRO 349 Ca -0.03 -2.13 0.06 0.00 0.04 0.00 0.00 61.00 58.94 1rg9 s PRO 349 Cb -0.00 -5.27 0.10 0.00 0.04 0.00 0.00 34.50 29.36 1rg9 s PRO 349 CO -0.05 -2.01 0.99 0.44 0.04 0.00 0.00 177.00 176.41 1rg9 n ILE 350 N 5.64 1.08 -0.05 0.56 -5.35 -1.26 -4.87 119.36 115.11 1rg9 n ILE 350 Ca 0.40 -1.20 -0.13 0.00 -0.27 0.00 0.00 62.75 61.55 1rg9 n ILE 350 Cb 0.45 0.32 -0.14 0.00 -1.74 0.00 0.00 39.64 38.53 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 -0.70 0.69 -0.21 4.28 4.01 -1.26 -4.28 117.16 119.68 1rg9 n TYR 351 Ca 0.05 0.21 -0.02 0.00 -0.16 0.00 0.00 57.90 57.99 1rg9 n TYR 351 Cb 0.45 -1.11 0.05 0.00 -0.31 0.00 0.00 39.34 38.42 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 0.01 -0.04 -0.50 -0.72 3.64 -1.90 0.57 116.57 117.64 1rg9 h LYS 352 Ca -0.41 0.00 0.14 0.00 -1.27 0.00 0.00 60.65 59.11 1rg9 h LYS 352 Cb 2.06 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 33.87 1rg9 h LYS 352 CO 0.05 -0.03 0.53 1.49 -2.27 0.00 0.00 179.45 179.22 1rg9 h GLU 353 N -0.04 0.00 -0.00 1.90 4.81 -1.93 0.23 114.58 119.54 1rg9 h GLU 353 Ca 0.29 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.52 1rg9 h GLU 353 Cb 0.49 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.87 1rg9 h GLU 353 CO -0.66 0.00 -0.35 -2.37 -0.73 0.00 0.00 179.01 174.90 1rg9 n THR 354 N -3.70 0.00 0.75 0.32 5.66 0.20 -4.23 114.28 113.28 1rg9 n THR 354 Ca 0.09 -0.00 0.09 0.00 -3.05 0.00 0.00 64.05 61.18 1rg9 n THR 354 Cb 0.72 0.03 0.43 0.00 -1.55 0.00 0.00 70.33 69.97 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 -1.48 1.92 -3.02 1.79 0.00 0.79 -4.36 120.51 116.16 1rg9 n ALA 355 Ca 0.06 -0.08 -0.12 0.00 0.00 0.00 0.00 53.44 53.30 1rg9 n ALA 355 Cb 0.34 -1.30 -0.14 0.00 0.00 0.00 0.00 19.45 18.34 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 -2.82 -0.14 -0.64 0.00 0.00 -1.26 -4.53 121.76 112.38 1rg9 s ALA 356 Ca 0.13 0.20 -0.02 0.00 0.00 0.00 0.00 51.96 52.26 1rg9 s ALA 356 Cb 0.12 -0.12 0.00 0.00 0.00 0.00 0.00 23.12 23.13 1rg9 s ALA 356 CO 0.32 -0.04 0.29 0.66 0.00 0.00 0.00 175.76 176.99 1rg9 n TYR 357 N 3.17 -0.89 0.00 0.00 4.01 -1.26 -4.91 117.16 117.29 1rg9 n TYR 357 Ca -0.14 0.25 0.00 0.00 -0.16 0.00 0.00 57.90 57.85 1rg9 n TYR 357 Cb 0.59 -2.51 0.00 0.00 -0.31 0.00 0.00 39.34 37.11 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 -1.08 -0.35 0.12 2.72 0.00 -1.26 -4.85 105.19 100.49 1rg9 n GLY 358 Ca -0.04 -1.39 0.11 0.00 0.00 0.00 0.00 46.02 44.71 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 0.52 0.00 -4.26 1.61 8.25 -0.27 -4.85 115.22 116.22 1rg9 n HIS 359 Ca 0.00 0.00 -0.20 0.00 -0.26 0.00 0.00 57.72 57.26 1rg9 n HIS 359 Cb 0.00 -0.10 -0.11 0.00 1.12 0.00 0.00 29.99 30.89 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 -2.83 1.54 0.00 4.41 0.08 -1.26 -4.79 117.98 115.13 1rg9 s PHE 360 Ca 0.13 -0.50 0.00 0.00 0.12 0.00 0.00 56.93 56.68 1rg9 s PHE 360 Cb 0.17 -0.81 0.00 0.00 -0.57 0.00 0.00 43.02 41.82 1rg9 s PHE 360 CO 0.71 0.19 0.00 0.41 -0.10 0.00 0.00 175.22 176.43 1rg9 n GLY 361 N 0.65 2.22 3.38 4.36 0.00 -1.26 -5.05 105.19 109.49 1rg9 n GLY 361 Ca -0.16 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.41 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 -0.48 3.22 0.27 1.61 1.81 -1.26 -4.93 118.95 119.19 1rg9 s ARG 362 Ca 0.00 -1.59 0.13 0.00 -1.72 0.00 0.00 55.73 52.55 1rg9 s ARG 362 Cb 0.00 -4.40 0.68 0.00 -0.45 0.00 0.00 34.95 30.78 1rg9 s ARG 362 CO 0.00 -1.54 1.29 0.39 -0.68 0.00 0.00 175.30 174.76 1rg9 n GLU 363 N 5.97 0.08 0.00 3.54 1.02 -1.26 -0.81 120.64 129.18 1rg9 n GLU 363 Ca -0.00 0.54 0.13 0.00 -0.02 0.00 0.00 57.16 57.81 1rg9 n GLU 363 Cb 0.44 -2.00 0.41 0.00 -0.02 0.00 0.00 31.44 30.27 1rg9 n GLU 363 CO 0.00 0.00 0.00 -2.39 1.18 0.00 0.00 177.13 175.92 1rg9 n HIS 364 N -1.97 0.00 -2.44 -0.32 1.44 -1.26 -4.27 115.22 106.40 1rg9 n HIS 364 Ca -0.01 0.00 -0.37 0.00 -2.01 0.00 0.00 57.72 55.33 1rg9 n HIS 364 Cb 0.24 -0.28 -0.03 0.00 0.12 0.00 0.00 29.99 30.04 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 -2.86 3.14 0.55 -1.40 0.08 0.01 -4.92 117.98 112.57 1rg9 s PHE 365 Ca 0.16 1.60 0.24 0.00 0.12 0.00 0.00 56.93 59.05 1rg9 s PHE 365 Cb 0.18 -3.23 1.50 0.00 -0.57 0.00 0.00 43.02 40.91 1rg9 s PHE 365 CO 0.61 -0.95 2.11 -1.35 -0.10 0.00 0.00 175.22 175.54 1rg9 h PRO 366 N 2.39 0.00 -0.00 0.24 0.11 -1.88 -1.91 132.00 130.95 1rg9 h PRO 366 Ca -0.49 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1rg9 h PRO 366 Cb 1.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.34 1rg9 h PRO 366 CO 0.62 0.00 -0.32 -2.67 -0.21 0.00 0.00 178.00 175.42 1rg9 n TRP 367 N -4.16 0.00 0.69 0.65 2.14 -1.26 -3.65 117.44 111.85 1rg9 n TRP 367 Ca 0.01 0.00 0.12 0.00 2.07 0.00 0.00 57.50 59.70 1rg9 n TRP 367 Cb 0.29 -0.23 0.17 0.00 -0.81 0.00 0.00 31.31 30.73 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 -1.18 0.21 -2.35 -2.67 -0.58 -0.72 -3.95 120.64 109.40 1rg9 n GLU 368 Ca 0.09 0.05 -0.38 0.00 -0.42 0.00 0.00 57.16 56.49 1rg9 n GLU 368 Cb 0.33 -1.62 -0.02 0.00 -0.57 0.00 0.00 31.44 29.56 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 -3.13 4.11 -0.57 3.49 -0.14 -1.21 -4.84 119.74 117.46 1rg9 s LYS 369 Ca 0.07 1.78 0.04 0.00 -1.36 0.00 0.00 55.97 56.50 1rg9 s LYS 369 Cb 0.15 -2.69 0.15 0.00 -1.68 0.00 0.00 37.83 33.76 1rg9 s LYS 369 CO 0.73 -0.25 0.35 0.95 -0.76 0.00 0.00 175.35 176.37 1rg9 s THR 370 N -1.44 2.35 -0.20 2.17 -4.23 -1.26 -4.84 115.64 108.19 1rg9 s THR 370 Ca 0.56 -3.51 0.10 0.00 -1.18 0.00 0.00 61.69 57.66 1rg9 s THR 370 Cb -0.29 -2.60 -0.19 0.00 1.34 0.00 0.00 72.50 70.76 1rg9 s THR 370 CO 0.37 -0.92 -0.05 -0.90 -0.54 0.00 0.00 174.62 172.57 1rg9 n ASP 371 N 2.74 1.28 0.00 3.99 5.68 -1.26 -4.42 116.55 124.56 1rg9 n ASP 371 Ca 0.13 -0.05 0.10 0.00 -0.50 0.00 0.00 54.79 54.47 1rg9 n ASP 371 Cb 0.35 0.37 0.45 0.00 -1.14 0.00 0.00 41.12 41.15 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 -2.89 0.01 0.12 0.11 5.02 -1.26 -4.08 118.16 115.19 1rg9 n LYS 372 Ca -0.34 0.14 -0.07 0.00 -2.02 0.00 0.00 58.31 56.01 1rg9 n LYS 372 Cb 1.02 -1.50 -0.04 0.00 -0.02 0.00 0.00 35.03 34.49 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 2.73 -0.93 -1.03 7.82 0.00 -1.77 0.94 119.26 127.03 1rg9 h ALA 373 Ca 0.00 -0.08 0.26 0.00 0.00 0.00 0.00 54.91 55.09 1rg9 h ALA 373 Cb 0.36 0.42 -0.09 0.00 0.00 0.00 0.00 17.79 18.48 1rg9 h ALA 373 CO 0.00 -0.93 0.67 1.96 0.00 0.00 0.00 179.25 180.94 1rg9 h GLN 374 N -0.40 0.38 0.00 0.00 7.50 -1.88 0.66 115.11 121.36 1rg9 h GLN 374 Ca -0.03 -0.02 -0.16 0.00 0.50 0.00 0.00 58.65 58.94 1rg9 h GLN 374 Cb 0.35 -0.08 -0.02 0.00 0.05 0.00 0.00 27.48 27.77 1rg9 h GLN 374 CO -0.02 0.25 -0.76 -0.07 -1.50 0.00 0.00 178.83 176.73 1rg9 h LEU 375 N 0.39 0.00 -0.41 1.46 3.38 -1.66 -2.13 115.31 116.33 1rg9 h LEU 375 Ca 0.58 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.55 1rg9 h LEU 375 Cb 1.48 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.23 1rg9 h LEU 375 CO -0.27 0.76 0.00 -0.07 0.09 0.00 0.00 178.44 178.95 1rg9 h LEU 376 N 0.00 0.00 0.11 1.67 3.38 0.63 -2.95 115.31 118.15 1rg9 h LEU 376 Ca -0.01 0.00 -0.23 0.00 0.09 0.00 0.00 57.88 57.73 1rg9 h LEU 376 Cb 1.51 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.27 1rg9 h LEU 376 CO 0.10 0.00 -1.13 -0.09 0.09 0.00 0.00 178.44 177.41 1rg9 h ARG 377 N 0.00 0.23 -0.89 1.13 2.43 0.08 -3.33 114.38 114.03 1rg9 h ARG 377 Ca 0.00 -0.39 0.16 0.00 -0.81 0.00 0.00 59.98 58.94 1rg9 h ARG 377 Cb 0.59 0.15 -0.07 0.00 -0.42 0.00 0.00 29.97 30.22 1rg9 h ARG 377 CO 0.00 1.19 0.57 -0.44 -1.51 0.00 0.00 179.97 179.78 1rg9 h ASP 378 N -0.41 0.57 0.00 -3.80 3.45 -1.23 0.35 116.42 115.35 1rg9 h ASP 378 Ca -0.24 0.04 0.00 0.00 0.43 0.00 0.00 57.03 57.27 1rg9 h ASP 378 Cb 1.65 -0.07 0.00 0.00 -0.56 0.00 0.00 39.33 40.35 1rg9 h ASP 378 CO 0.07 0.27 0.00 0.00 -1.57 0.00 0.00 179.24 178.01 1rg9 n ALA 379 N -2.46 2.10 -3.46 3.45 0.00 -1.16 -4.31 120.51 114.68 1rg9 n ALA 379 Ca 0.18 -0.07 0.01 0.00 0.00 0.00 0.00 53.44 53.56 1rg9 n ALA 379 Cb 0.54 -1.18 -0.03 0.00 0.00 0.00 0.00 19.45 18.78 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 -2.14 -0.35 0.00 0.00 0.12 -5.02 121.76 112.38 1rg9 s ALA 380 Ca 0.17 2.15 -0.13 0.00 0.00 0.00 0.00 51.96 54.15 1rg9 s ALA 380 Cb 0.08 -1.93 0.02 0.00 0.00 0.00 0.00 23.12 21.28 1rg9 s ALA 380 CO 0.13 -1.08 0.36 0.41 0.00 0.00 0.00 175.76 175.58 1rg9 n GLY 381 N 5.44 -0.26 0.00 0.00 0.00 -1.26 -4.79 105.19 104.32 1rg9 n GLY 381 Ca -0.08 0.53 0.00 0.00 0.00 0.00 0.00 46.02 46.47 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 -0.80 0.00 0.00 0.99 7.94 -1.24 -4.86 117.00 119.03 1rg9 n LEU 382 Ca -0.11 0.69 0.00 0.00 -1.11 0.00 0.00 56.01 55.48 1rg9 n LEU 382 Cb 0.40 -0.19 0.00 0.00 0.53 0.00 0.00 43.42 44.16 1rg9 n LEU 382 CO 0.34 -0.19 0.00 0.29 -1.11 0.00 0.00 177.39 176.72