#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1iux s LYS 2 N 0.00 0.32 0.32 0.03 2.20 -1.26 -1.34 119.74 120.01 1iux s LYS 2 Ca 0.00 -0.25 -0.05 0.00 -0.36 0.00 0.00 55.97 55.31 1iux s LYS 2 Cb 0.00 0.13 0.02 0.00 -1.51 0.00 0.00 37.83 36.47 1iux s LYS 2 CO 0.00 -0.07 0.50 -2.37 -0.36 0.00 0.00 175.35 173.05 1iux n THR 3 N 2.02 0.00 -0.11 3.43 5.66 -0.08 -4.93 114.28 120.27 1iux n THR 3 Ca -0.19 -1.37 -0.21 0.00 -3.05 0.00 0.00 64.05 59.22 1iux n THR 3 Cb 0.57 0.94 -0.09 0.00 -1.55 0.00 0.00 70.33 70.20 1iux n THR 3 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1iux n GLN 4 N -0.50 0.55 -4.07 1.09 6.02 -1.20 -3.97 117.38 115.30 1iux n GLN 4 Ca -0.02 0.41 -0.32 0.00 -0.01 0.00 0.00 57.00 57.06 1iux n GLN 4 Cb 0.52 -1.60 -0.16 0.00 1.02 0.00 0.00 30.24 30.01 1iux n GLN 4 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 1iux s VAL 5 N -2.47 1.87 -0.07 5.09 1.01 -0.90 -0.90 120.40 124.03 1iux s VAL 5 Ca -0.31 -0.92 -0.20 0.00 0.00 0.00 0.00 61.98 60.55 1iux s VAL 5 Cb 0.09 -1.77 -0.04 0.00 0.00 0.00 0.00 36.38 34.65 1iux s VAL 5 CO 0.48 0.42 0.57 0.00 0.00 0.00 0.00 175.10 176.57 1iux s ALA 6 N 1.34 3.44 -0.18 5.51 0.00 -0.44 -2.02 121.76 129.42 1iux s ALA 6 Ca 0.03 -0.04 0.00 0.00 0.00 0.00 0.00 51.96 51.96 1iux s ALA 6 Cb -0.14 -2.76 0.01 0.00 0.00 0.00 0.00 23.12 20.23 1iux s ALA 6 CO -0.11 0.02 -0.17 0.42 0.00 0.00 0.00 175.76 175.92 1iux s ILE 7 N 0.43 2.33 -0.37 0.00 1.01 0.27 -0.73 121.20 124.13 1iux s ILE 7 Ca 0.31 -0.86 -0.17 0.00 0.00 0.00 0.00 60.65 59.93 1iux s ILE 7 Cb -0.17 -1.99 0.00 0.00 0.01 0.00 0.00 42.46 40.32 1iux s ILE 7 CO 0.14 0.52 0.43 -0.63 0.00 0.00 0.00 174.94 175.41 1iux s ILE 8 N 1.18 5.09 0.00 2.92 -1.09 -0.59 -0.80 121.20 127.92 1iux s ILE 8 Ca 0.02 -0.01 0.00 0.00 -2.23 0.00 0.00 60.65 58.43 1iux s ILE 8 Cb -0.14 -3.94 0.00 0.00 -1.58 0.00 0.00 42.46 36.80 1iux s ILE 8 CO -0.08 -0.25 0.00 0.61 -1.23 0.00 0.00 174.94 173.99 1iux n GLY 9 N 4.97 2.75 2.32 6.18 0.00 0.14 -0.78 105.19 120.78 1iux n GLY 9 Ca -0.07 -1.25 -0.31 0.00 0.00 0.00 0.00 46.02 44.39 1iux n GLY 9 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1iux n ALA 10 N 1.33 5.75 -2.09 4.61 0.00 -1.26 -3.93 120.51 124.92 1iux n ALA 10 Ca 0.00 -3.78 0.00 0.00 0.00 0.00 0.00 53.44 49.66 1iux n ALA 10 Cb 0.00 -1.14 0.00 0.00 0.00 0.00 0.00 19.45 18.31 1iux n ALA 10 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1iux n GLY 11 N -0.74 0.75 0.23 0.00 0.00 -1.26 -4.76 105.19 99.41 1iux n GLY 11 Ca 0.52 -1.93 -0.00 0.00 0.00 0.00 0.00 46.02 44.60 1iux n GLY 11 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1iux h PRO 12 N 0.00 0.07 0.54 1.61 0.11 -1.93 -2.09 132.00 130.30 1iux h PRO 12 Ca 0.00 -0.00 -0.02 0.00 0.11 0.00 0.00 66.00 66.09 1iux h PRO 12 Cb 0.00 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 31.08 1iux h PRO 12 CO 0.00 0.04 -0.41 0.77 -0.21 0.00 0.00 178.00 178.19 1iux h SER 13 N 0.07 -1.08 -0.70 -2.05 0.02 -1.92 -0.22 113.55 107.67 1iux h SER 13 Ca 0.30 0.08 0.02 0.00 -0.84 0.00 0.00 61.79 61.34 1iux h SER 13 Cb 0.47 0.34 -0.04 0.00 0.14 0.00 0.00 62.40 63.31 1iux h SER 13 CO -0.54 -0.60 0.45 1.23 -1.14 0.00 0.00 176.83 176.23 1iux h GLY 14 N -0.93 1.00 0.90 -3.77 0.00 -1.65 -1.40 103.07 97.22 1iux h GLY 14 Ca -0.06 -0.35 -0.06 0.00 0.00 0.00 0.00 47.33 46.86 1iux h GLY 14 CO 0.01 0.32 -0.05 1.41 0.00 0.00 0.00 176.54 178.23 1iux h LEU 15 N 0.90 0.59 -0.54 3.11 3.38 -1.32 -0.51 115.31 120.92 1iux h LEU 15 Ca 0.27 -0.35 -0.02 0.00 0.09 0.00 0.00 57.88 57.87 1iux h LEU 15 Cb -0.04 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.52 1iux h LEU 15 CO -0.08 0.80 0.25 0.25 0.09 0.00 0.00 178.44 179.75 1iux h LEU 16 N 0.37 0.72 -0.25 1.67 5.85 -0.88 -0.76 115.31 122.03 1iux h LEU 16 Ca 0.08 -0.14 -0.01 0.00 0.84 0.00 0.00 57.88 58.65 1iux h LEU 16 Cb 0.52 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 41.36 1iux h LEU 16 CO 0.03 0.66 0.10 0.25 -0.34 0.00 0.00 178.44 179.14 1iux h LEU 17 N 0.73 0.34 -0.98 2.25 5.85 -1.18 -1.44 115.31 120.89 1iux h LEU 17 Ca 0.18 -0.16 0.02 0.00 0.84 0.00 0.00 57.88 58.77 1iux h LEU 17 Cb 0.14 -0.09 -0.05 0.00 0.37 0.00 0.00 40.66 41.03 1iux h LEU 17 CO -0.02 0.40 0.65 1.23 -0.34 0.00 0.00 178.44 180.36 1iux h GLY 18 N 0.26 1.40 0.79 3.75 0.00 -0.87 -0.53 103.07 107.87 1iux h GLY 18 Ca 0.08 -0.51 -0.03 0.00 0.00 0.00 0.00 47.33 46.87 1iux h GLY 18 CO -0.01 0.47 -0.02 -1.61 0.00 0.00 0.00 176.54 175.37 1iux h GLN 19 N 1.30 0.33 -0.66 4.80 5.75 -0.87 0.14 115.11 125.89 1iux h GLN 19 Ca 0.37 -0.12 -0.01 0.00 -0.15 0.00 0.00 58.65 58.75 1iux h GLN 19 Cb -0.09 -0.02 -0.03 0.00 1.07 0.00 0.00 27.48 28.40 1iux h GLN 19 CO -0.10 0.57 0.39 -0.07 -2.65 0.00 0.00 178.83 176.98 1iux h LEU 20 N 0.06 0.81 -0.37 -2.39 3.38 -1.11 -1.88 115.31 113.80 1iux h LEU 20 Ca 0.05 -0.07 -0.05 0.00 0.09 0.00 0.00 57.88 57.90 1iux h LEU 20 Cb 0.44 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.97 1iux h LEU 20 CO 0.01 0.64 0.03 -0.07 0.09 0.00 0.00 178.44 179.15 1iux h LEU 21 N 0.90 0.61 0.06 1.67 3.38 -0.91 -2.80 115.31 118.22 1iux h LEU 21 Ca 0.24 -0.28 -0.00 0.00 0.09 0.00 0.00 57.88 57.92 1iux h LEU 21 Cb -0.01 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.58 1iux h LEU 21 CO -0.04 0.74 -0.03 -0.74 0.09 0.00 0.00 178.44 178.46 1iux h HIS 22 N 0.46 -0.08 -0.85 1.13 2.76 -0.54 -0.60 115.15 117.44 1iux h HIS 22 Ca 0.11 -0.00 0.17 0.00 -2.20 0.00 0.00 60.37 58.45 1iux h HIS 22 Cb 0.41 0.03 -0.06 0.00 1.55 0.00 0.00 27.41 29.33 1iux h HIS 22 CO 0.03 -0.03 0.56 0.87 -1.30 0.00 0.00 177.93 178.06 1iux h LYS 23 N -0.10 0.45 -0.18 5.26 1.57 -1.29 -0.00 116.57 122.27 1iux h LYS 23 Ca -0.01 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.74 1iux h LYS 23 Cb 0.08 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.29 1iux h LYS 23 CO 0.01 0.29 0.00 0.00 -0.57 0.00 0.00 179.45 179.19 1iux n ALA 24 N -2.50 2.51 -0.69 3.86 0.00 -1.02 -4.91 120.51 117.75 1iux n ALA 24 Ca 0.17 -0.43 0.00 0.00 0.00 0.00 0.00 53.44 53.18 1iux n ALA 24 Cb 0.60 -1.08 0.00 0.00 0.00 0.00 0.00 19.45 18.97 1iux n ALA 24 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1iux n GLY 25 N 0.99 0.60 3.30 0.00 0.00 -0.01 -5.03 105.19 105.03 1iux n GLY 25 Ca 0.13 -0.47 -0.40 0.00 0.00 0.00 0.00 46.02 45.27 1iux n GLY 25 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1iux s ILE 26 N -2.00 4.30 0.52 -0.61 1.01 -0.26 -5.02 121.20 119.15 1iux s ILE 26 Ca 0.00 -1.23 -0.22 0.00 0.00 0.00 0.00 60.65 59.20 1iux s ILE 26 Cb 0.00 -3.55 -0.06 0.00 0.01 0.00 0.00 42.46 38.86 1iux s ILE 26 CO 0.00 -0.41 1.34 -1.81 0.00 0.00 0.00 174.94 174.07 1iux s ASP 27 N 1.92 5.46 -0.04 3.58 1.01 -1.26 -3.60 116.67 123.74 1iux s ASP 27 Ca 0.02 2.73 -0.24 0.00 0.71 0.00 0.00 52.55 55.78 1iux s ASP 27 Cb -0.22 -2.63 0.05 0.00 1.01 0.00 0.00 42.92 41.13 1iux s ASP 27 CO 0.03 -1.44 0.52 0.54 0.21 0.00 0.00 175.17 175.04 1iux s ASN 28 N -0.94 -0.46 -0.06 0.27 2.20 -1.26 -2.11 114.94 112.58 1iux s ASN 28 Ca 0.69 0.47 0.05 0.00 -0.94 0.00 0.00 52.86 53.13 1iux s ASN 28 Cb -0.39 0.46 -0.00 0.00 -2.00 0.00 0.00 41.25 39.31 1iux s ASN 28 CO 0.47 -0.53 -0.21 -0.69 -2.94 0.00 0.00 177.10 173.20 1iux s VAL 29 N -1.21 1.74 -0.16 3.54 1.01 -0.85 -4.26 120.40 120.21 1iux s VAL 29 Ca -0.12 -0.88 -0.05 0.00 0.00 0.00 0.00 61.98 60.93 1iux s VAL 29 Cb -0.02 -1.49 -0.03 0.00 0.00 0.00 0.00 36.38 34.84 1iux s VAL 29 CO 0.07 0.49 0.02 -0.63 0.00 0.00 0.00 175.10 175.05 1iux s ILE 30 N 0.03 4.41 -0.17 2.22 1.01 -0.87 -0.57 121.20 127.25 1iux s ILE 30 Ca -0.06 -0.18 -0.02 0.00 0.00 0.00 0.00 60.65 60.39 1iux s ILE 30 Cb -0.13 -2.95 -0.01 0.00 0.01 0.00 0.00 42.46 39.37 1iux s ILE 30 CO 0.04 0.49 -0.08 -0.76 0.00 0.00 0.00 174.94 174.63 1iux s LEU 31 N 0.22 2.87 -0.06 2.97 1.43 0.02 -0.53 118.68 125.59 1iux s LEU 31 Ca 0.01 -0.33 0.03 0.00 -1.03 0.00 0.00 54.13 52.81 1iux s LEU 31 Cb -0.13 -1.69 0.01 0.00 0.03 0.00 0.00 46.19 44.41 1iux s LEU 31 CO 0.01 0.09 -0.13 -0.70 0.23 0.00 0.00 176.35 175.85 1iux s GLU 32 N 0.83 1.79 0.17 1.70 2.56 -0.39 0.27 118.70 125.63 1iux s GLU 32 Ca -0.02 -0.46 -0.12 0.00 0.00 0.00 0.00 54.97 54.36 1iux s GLU 32 Cb -0.15 -1.47 0.06 0.00 2.00 0.00 0.00 34.13 34.58 1iux s GLU 32 CO 0.01 0.06 1.72 -0.09 -0.56 0.00 0.00 175.26 176.40 1iux h ARG 33 N 6.87 0.86 0.00 4.30 2.43 -1.86 0.21 114.38 127.19 1iux h ARG 33 Ca -0.30 -0.16 -0.22 0.00 -0.81 0.00 0.00 59.98 58.49 1iux h ARG 33 Cb 1.19 -0.14 0.05 0.00 -0.42 0.00 0.00 29.97 30.65 1iux h ARG 33 CO 0.47 0.75 0.09 1.04 -1.51 0.00 0.00 179.97 180.82 1iux n GLN 34 N -4.48 0.05 -3.57 0.20 1.13 -1.26 -3.36 117.38 106.08 1iux n GLN 34 Ca 0.03 -1.21 -0.23 0.00 -1.94 0.00 0.00 57.00 53.65 1iux n GLN 34 Cb 0.17 -0.40 -0.02 0.00 0.11 0.00 0.00 30.24 30.10 1iux n GLN 34 CO 0.00 0.00 0.00 0.95 -1.44 0.00 0.00 177.06 176.57 1iux s THR 35 N -1.60 5.16 0.25 5.09 -4.23 -1.26 -1.85 115.64 117.19 1iux s THR 35 Ca 0.32 -0.60 -0.04 0.00 -1.18 0.00 0.00 61.69 60.19 1iux s THR 35 Cb -0.02 -3.85 0.22 0.00 1.34 0.00 0.00 72.50 70.19 1iux s THR 35 CO 0.22 -0.46 1.83 -0.65 -0.54 0.00 0.00 174.62 175.01 1iux h PRO 36 N 0.98 0.84 -0.67 3.99 0.11 -1.99 -2.07 132.00 133.19 1iux h PRO 36 Ca -0.50 -0.05 0.02 0.00 0.11 0.00 0.00 66.00 65.58 1iux h PRO 36 Cb 1.22 -0.19 -0.04 0.00 0.11 0.00 0.00 31.00 32.10 1iux h PRO 36 CO 0.62 0.56 0.43 -0.44 -0.21 0.00 0.00 178.00 178.95 1iux h ASP 37 N 0.86 0.72 0.05 -2.05 3.32 -1.98 -1.04 116.42 116.31 1iux h ASP 37 Ca 0.39 -0.01 -0.00 0.00 0.02 0.00 0.00 57.03 57.43 1iux h ASP 37 Cb 0.30 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 39.69 1iux h ASP 37 CO -0.22 0.51 -0.03 0.22 -1.72 0.00 0.00 179.24 178.00 1iux h TYR 38 N 0.86 -0.07 -0.80 4.55 5.03 -1.78 -1.95 116.97 122.80 1iux h TYR 38 Ca 0.26 -0.00 0.07 0.00 2.58 0.00 0.00 58.73 61.64 1iux h TYR 38 Cb -0.03 0.02 -0.06 0.00 1.55 0.00 0.00 36.73 38.21 1iux h TYR 38 CO -0.04 0.04 0.48 0.28 -1.32 0.00 0.00 178.16 177.60 1iux h VAL 39 N -0.15 1.00 0.00 1.81 2.07 -1.13 -0.87 116.25 118.98 1iux h VAL 39 Ca -0.01 -0.30 0.00 0.00 0.82 0.00 0.00 66.70 67.22 1iux h VAL 39 Cb 0.13 0.06 0.00 0.00 -1.52 0.00 0.00 31.29 29.96 1iux h VAL 39 CO 0.01 0.16 0.00 0.18 0.02 0.00 0.00 177.57 177.94 1iux n LEU 40 N -4.69 0.50 0.06 2.57 4.32 -0.42 -2.63 117.00 116.71 1iux n LEU 40 Ca 0.12 0.62 0.13 0.00 -0.02 0.00 0.00 56.01 56.86 1iux n LEU 40 Cb 0.20 -0.55 0.45 0.00 -1.62 0.00 0.00 43.42 41.89 1iux n LEU 40 CO 0.30 -0.47 0.84 0.61 -1.22 0.00 0.00 177.39 177.44 1iux n GLY 41 N 0.04 -1.58 3.65 -0.72 0.00 -0.33 -4.79 105.19 101.45 1iux n GLY 41 Ca 0.03 -0.09 -0.43 0.00 0.00 0.00 0.00 46.02 45.53 1iux n GLY 41 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1iux s ARG 42 N -3.07 4.12 -0.01 1.61 0.52 -1.08 -4.96 118.95 116.08 1iux s ARG 42 Ca 0.11 1.31 -0.06 0.00 -0.52 0.00 0.00 55.73 56.57 1iux s ARG 42 Cb 0.15 -3.75 -0.03 0.00 0.52 0.00 0.00 34.95 31.84 1iux s ARG 42 CO 0.59 -0.83 0.51 0.82 0.02 0.00 0.00 175.30 176.41 1iux h ILE 43 N 5.65 0.00 0.00 1.52 1.08 -1.91 -3.39 117.51 120.47 1iux h ILE 43 Ca -0.22 -0.22 0.00 0.00 -0.39 0.00 0.00 64.86 64.02 1iux h ILE 43 Cb 1.08 0.00 0.00 0.00 -3.07 0.00 0.00 36.82 34.83 1iux h ILE 43 CO 1.01 0.00 0.00 0.54 -0.69 0.00 0.00 178.15 179.01 1iux n ARG 44 N -3.22 0.00 -1.61 2.37 1.74 -1.26 -4.00 116.66 110.68 1iux n ARG 44 Ca -0.03 0.00 -0.38 0.00 -0.77 0.00 0.00 57.85 56.67 1iux n ARG 44 Cb 0.09 0.00 0.05 0.00 -1.02 0.00 0.00 32.46 31.57 1iux n ARG 44 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1iux n ALA 45 N 9.85 0.15 0.00 7.54 0.00 -1.26 -4.81 120.51 131.98 1iux n ALA 45 Ca 0.00 0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.47 1iux n ALA 45 Cb 0.00 -2.10 0.00 0.00 0.00 0.00 0.00 19.45 17.35 1iux n ALA 45 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1iux n GLY 46 N 1.29 0.00 3.40 0.00 0.00 -1.26 -0.68 105.19 107.93 1iux n GLY 46 Ca 0.13 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.81 1iux n GLY 46 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1iux s VAL 47 N -0.74 3.61 -0.06 1.61 1.01 -1.26 -0.93 120.40 123.64 1iux s VAL 47 Ca 0.00 -0.43 0.03 0.00 0.00 0.00 0.00 61.98 61.58 1iux s VAL 47 Cb 0.00 -2.62 -0.02 0.00 0.00 0.00 0.00 36.38 33.74 1iux s VAL 47 CO 0.00 0.45 -0.15 -0.76 0.00 0.00 0.00 175.10 174.64 1iux s LEU 48 N 0.99 2.69 0.67 3.92 1.43 0.16 -4.85 118.68 123.68 1iux s LEU 48 Ca 0.00 -0.23 -0.11 0.00 -1.03 0.00 0.00 54.13 52.76 1iux s LEU 48 Cb -0.15 -1.55 -0.01 0.00 0.03 0.00 0.00 46.19 44.51 1iux s LEU 48 CO 0.01 0.31 1.06 -1.61 0.23 0.00 0.00 176.35 176.35 1iux s GLU 49 N -0.53 3.19 0.38 1.70 2.02 -1.26 -0.69 118.70 123.50 1iux s GLU 49 Ca 0.07 0.65 0.06 0.00 0.02 0.00 0.00 54.97 55.77 1iux s GLU 49 Cb -0.12 -2.04 0.75 0.00 0.10 0.00 0.00 34.13 32.82 1iux s GLU 49 CO 0.01 -0.84 1.99 0.37 0.02 0.00 0.00 175.26 176.82 1iux h GLN 50 N -0.52 0.57 -0.54 1.61 5.75 -1.72 -0.91 115.11 119.35 1iux h GLN 50 Ca -0.44 -0.06 -0.02 0.00 -0.15 0.00 0.00 58.65 57.97 1iux h GLN 50 Cb 1.22 -0.11 -0.03 0.00 1.07 0.00 0.00 27.48 29.63 1iux h GLN 50 CO 0.62 0.44 0.25 0.78 -2.65 0.00 0.00 178.83 178.28 1iux h GLY 51 N 0.68 0.81 1.04 2.39 0.00 -1.93 -0.08 103.07 105.99 1iux h GLY 51 Ca 0.15 -0.37 -0.17 0.00 0.00 0.00 0.00 47.33 46.93 1iux h GLY 51 CO -0.02 0.36 -0.56 1.98 0.00 0.00 0.00 176.54 178.30 1iux h MET 52 N 0.75 0.71 -0.87 4.80 1.85 -1.55 -2.08 114.93 118.55 1iux h MET 52 Ca 0.19 -0.52 0.01 0.00 -0.61 0.00 0.00 59.70 58.77 1iux h MET 52 Cb 0.09 0.09 -0.04 0.00 0.43 0.00 0.00 31.60 32.17 1iux h MET 52 CO -0.02 1.14 0.57 0.28 -0.40 0.00 0.00 176.91 178.47 1iux h VAL 53 N 0.42 1.21 -0.36 -5.77 2.07 -0.91 -1.35 116.25 111.56 1iux h VAL 53 Ca -0.02 -0.40 -0.10 0.00 0.82 0.00 0.00 66.70 67.00 1iux h VAL 53 Cb 1.18 -0.05 -0.02 0.00 -1.52 0.00 0.00 31.29 30.88 1iux h VAL 53 CO 0.12 0.21 -0.20 0.44 0.02 0.00 0.00 177.57 178.16 1iux h ASP 54 N 1.16 0.69 -0.48 0.57 3.32 -0.93 -2.37 116.42 118.37 1iux h ASP 54 Ca 0.32 -0.23 -0.09 0.00 0.02 0.00 0.00 57.03 57.05 1iux h ASP 54 Cb -0.11 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 39.23 1iux h ASP 54 CO -0.08 0.88 -0.05 0.25 -1.72 0.00 0.00 179.24 178.53 1iux h LEU 55 N 0.61 0.91 -0.85 1.55 5.85 -0.89 -0.29 115.31 122.19 1iux h LEU 55 Ca 0.09 -0.26 -0.07 0.00 0.84 0.00 0.00 57.88 58.48 1iux h LEU 55 Cb 0.67 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 41.43 1iux h LEU 55 CO 0.05 1.00 0.11 -0.07 -0.34 0.00 0.00 178.44 179.18 1iux h LEU 56 N 0.84 0.91 -0.46 2.25 4.07 -1.06 -0.69 115.31 121.18 1iux h LEU 56 Ca 0.15 -0.20 -0.07 0.00 0.08 0.00 0.00 57.88 57.84 1iux h LEU 56 Cb 0.57 -0.24 -0.02 0.00 1.08 0.00 0.00 40.66 42.05 1iux h LEU 56 CO 0.03 0.91 -0.00 -0.09 -1.08 0.00 0.00 178.44 178.21 1iux h ARG 57 N 0.91 0.81 -0.47 1.13 2.43 -0.96 0.07 114.38 118.31 1iux h ARG 57 Ca 0.19 -0.26 -0.02 0.00 -0.81 0.00 0.00 59.98 59.07 1iux h ARG 57 Cb 0.38 -0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 29.84 1iux h ARG 57 CO 0.01 0.87 0.19 1.49 -1.51 0.00 0.00 179.97 181.02 1iux h GLU 58 N 0.66 0.67 0.00 0.20 4.81 -0.59 0.27 114.58 120.60 1iux h GLU 58 Ca 0.13 -0.09 0.00 0.00 -0.13 0.00 0.00 59.36 59.27 1iux h GLU 58 Cb 0.50 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 29.76 1iux h GLU 58 CO 0.02 0.55 0.00 0.00 -0.73 0.00 0.00 179.01 178.86 1iux n ALA 59 N -2.46 2.37 -1.42 2.92 0.00 -0.31 -4.89 120.51 116.72 1iux n ALA 59 Ca 0.04 -0.13 -0.07 0.00 0.00 0.00 0.00 53.44 53.28 1iux n ALA 59 Cb 0.15 -1.45 -0.02 0.00 0.00 0.00 0.00 19.45 18.13 1iux n ALA 59 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1iux n GLY 60 N 1.05 0.70 2.68 0.00 0.00 0.08 -4.87 105.19 104.83 1iux n GLY 60 Ca 0.13 -0.71 -0.28 0.00 0.00 0.00 0.00 46.02 45.17 1iux n GLY 60 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1iux n VAL 61 N -3.10 2.75 -0.14 1.61 0.31 -0.05 -4.73 118.33 114.99 1iux n VAL 61 Ca -0.07 -5.21 0.00 0.00 -0.01 0.00 0.00 64.34 59.05 1iux n VAL 61 Cb 0.31 -1.33 0.00 0.00 -0.91 0.00 0.00 33.84 31.91 1iux n VAL 61 CO 0.00 0.00 0.00 -0.90 -1.32 0.00 0.00 176.83 174.61 1iux n ASP 62 N -0.38 1.45 0.17 4.52 5.75 -1.25 -4.75 116.55 122.06 1iux n ASP 62 Ca 0.36 -1.59 -0.11 0.00 -0.01 0.00 0.00 54.79 53.45 1iux n ASP 62 Cb 0.53 0.00 -0.06 0.00 -1.03 0.00 0.00 41.12 40.57 1iux n ASP 62 CO 0.00 0.00 0.00 -0.09 -0.11 0.00 0.00 177.20 177.00 1iux h ARG 63 N 0.00 -0.56 -0.96 0.11 2.43 -1.95 0.55 114.38 114.00 1iux h ARG 63 Ca 0.00 0.04 0.02 0.00 -0.81 0.00 0.00 59.98 59.23 1iux h ARG 63 Cb 0.41 0.13 -0.05 0.00 -0.42 0.00 0.00 29.97 30.04 1iux h ARG 63 CO 0.00 -0.38 0.63 0.00 -1.51 0.00 0.00 179.97 178.72 1iux h ARG 64 N -0.58 1.23 -0.53 0.20 3.08 -2.00 -2.45 114.38 113.34 1iux h ARG 64 Ca -0.04 -0.07 -0.02 0.00 0.07 0.00 0.00 59.98 59.92 1iux h ARG 64 Cb 0.51 -0.28 -0.02 0.00 0.08 0.00 0.00 29.97 30.25 1iux h ARG 64 CO -0.04 0.82 0.24 1.98 -1.07 0.00 0.00 179.97 181.90 1iux h MET 65 N 1.27 0.78 0.00 0.04 4.05 -1.82 0.27 114.93 119.52 1iux h MET 65 Ca 0.36 -0.13 -0.03 0.00 -0.28 0.00 0.00 59.70 59.62 1iux h MET 65 Cb -0.10 -0.13 -0.00 0.00 -0.80 0.00 0.00 31.60 30.56 1iux h MET 65 CO -0.09 0.66 -0.15 0.00 0.23 0.00 0.00 176.91 177.55 1iux h ALA 66 N 1.08 1.72 0.00 0.39 0.00 -0.55 0.26 119.26 122.15 1iux h ALA 66 Ca 0.18 -0.14 -0.04 0.00 0.00 0.00 0.00 54.91 54.91 1iux h ALA 66 Cb 0.15 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 1iux h ALA 66 CO -0.02 0.19 -0.26 -0.09 0.00 0.00 0.00 179.25 179.08 1iux h ARG 67 N 0.00 0.00 0.00 0.00 2.43 -0.95 -3.41 114.38 112.46 1iux h ARG 67 Ca -0.00 0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1iux h ARG 67 Cb 0.28 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 29.83 1iux h ARG 67 CO 0.02 0.84 -1.24 -0.25 -1.51 0.00 0.00 179.97 177.83 1iux n ASP 68 N -4.60 0.65 -4.76 -3.80 8.00 0.91 -4.96 116.55 107.99 1iux n ASP 68 Ca -0.13 0.25 -0.38 0.00 0.71 0.00 0.00 54.79 55.25 1iux n ASP 68 Cb 0.45 0.80 0.01 0.00 -0.02 0.00 0.00 41.12 42.36 1iux n ASP 68 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 1iux s GLY 69 N -4.41 2.82 -0.18 0.44 0.00 0.91 -4.96 107.32 101.93 1iux s GLY 69 Ca -0.02 1.06 -0.06 0.00 0.00 0.00 0.00 44.72 45.70 1iux s GLY 69 CO 0.82 1.54 0.02 1.08 0.00 0.00 0.00 173.10 176.56 1iux s LEU 70 N -3.14 3.51 -0.16 0.66 1.02 -0.60 -4.94 118.68 115.02 1iux s LEU 70 Ca 0.66 -0.06 -0.16 0.00 0.02 0.00 0.00 54.13 54.59 1iux s LEU 70 Cb -0.32 -1.88 -0.04 0.00 0.02 0.00 0.00 46.19 43.96 1iux s LEU 70 CO 0.39 0.13 0.39 -0.69 0.02 0.00 0.00 176.35 176.60 1iux s VAL 71 N 0.59 5.23 -0.10 -1.59 1.01 -1.26 -0.17 120.40 124.11 1iux s VAL 71 Ca 0.01 0.74 0.00 0.00 0.00 0.00 0.00 61.98 62.73 1iux s VAL 71 Cb -0.14 -3.73 -0.02 0.00 0.00 0.00 0.00 36.38 32.49 1iux s VAL 71 CO 0.02 0.32 -0.10 -1.00 0.00 0.00 0.00 175.10 174.34 1iux s HIS 72 N 0.84 2.86 -1.79 5.22 3.76 0.11 -4.99 115.29 121.31 1iux s HIS 72 Ca 0.21 -0.27 0.17 0.00 -0.15 0.00 0.00 55.06 55.02 1iux s HIS 72 Cb -0.14 -1.78 0.06 0.00 1.11 0.00 0.00 32.58 31.83 1iux s HIS 72 CO 0.07 0.08 0.94 0.39 -0.85 0.00 0.00 174.74 175.37 1iux n GLU 73 N 2.86 1.55 -3.81 1.40 1.02 -1.26 -2.37 120.64 120.03 1iux n GLU 73 Ca -0.18 -1.13 -0.06 0.00 -0.02 0.00 0.00 57.16 55.78 1iux n GLU 73 Cb 0.53 -1.30 -0.02 0.00 -0.02 0.00 0.00 31.44 30.62 1iux n GLU 73 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 1iux s GLY 74 N -1.72 -0.16 0.05 0.62 0.00 -1.26 -1.25 107.32 103.60 1iux s GLY 74 Ca 0.16 -0.12 -0.05 0.00 0.00 0.00 0.00 44.72 44.72 1iux s GLY 74 CO 0.33 -0.05 0.07 -1.34 0.00 0.00 0.00 173.10 172.11 1iux s VAL 75 N -3.66 0.15 0.11 1.40 -7.23 -1.10 -4.51 120.40 105.57 1iux s VAL 75 Ca 0.11 -1.26 0.08 0.00 -1.81 0.00 0.00 61.98 59.10 1iux s VAL 75 Cb -0.04 -1.07 -0.04 0.00 0.56 0.00 0.00 36.38 35.79 1iux s VAL 75 CO 0.05 -0.70 -0.13 -1.61 -0.31 0.00 0.00 175.10 172.40 1iux s GLU 76 N -3.03 1.99 -0.12 4.82 2.02 -0.30 -1.35 118.70 122.73 1iux s GLU 76 Ca -0.01 -1.10 0.00 0.00 0.02 0.00 0.00 54.97 53.88 1iux s GLU 76 Cb 0.01 -2.22 0.02 0.00 0.10 0.00 0.00 34.13 32.04 1iux s GLU 76 CO -0.07 0.49 -0.10 0.42 0.02 0.00 0.00 175.26 176.03 1iux s ILE 77 N -1.22 1.19 -0.15 -1.63 1.01 -0.03 -0.55 121.20 119.82 1iux s ILE 77 Ca 0.20 -0.40 -0.05 0.00 0.00 0.00 0.00 60.65 60.40 1iux s ILE 77 Cb -0.11 -1.16 -0.03 0.00 0.01 0.00 0.00 42.46 41.17 1iux s ILE 77 CO 0.12 0.39 0.01 0.00 0.00 0.00 0.00 174.94 175.46 1iux s ALA 78 N 1.54 3.22 -0.12 9.38 0.00 0.80 -0.85 121.76 135.73 1iux s ALA 78 Ca 0.03 -0.79 -0.27 0.00 0.00 0.00 0.00 51.96 50.93 1iux s ALA 78 Cb -0.13 -1.67 0.06 0.00 0.00 0.00 0.00 23.12 21.38 1iux s ALA 78 CO -0.08 0.29 0.64 -0.59 0.00 0.00 0.00 175.76 176.03 1iux s PHE 79 N 0.07 -0.64 -1.46 0.00 -0.71 -0.15 -0.89 117.98 114.20 1iux s PHE 79 Ca 0.02 1.28 -0.03 0.00 -1.04 0.00 0.00 56.93 57.17 1iux s PHE 79 Cb -0.13 0.33 0.02 0.00 -1.21 0.00 0.00 43.02 42.03 1iux s PHE 79 CO 0.02 -0.50 0.46 0.00 -1.34 0.00 0.00 175.22 173.86 1iux n ALA 80 N 1.58 -1.89 -3.79 1.99 0.00 -1.26 -0.97 120.51 116.17 1iux n ALA 80 Ca -0.17 -0.23 -0.28 0.00 0.00 0.00 0.00 53.44 52.76 1iux n ALA 80 Cb 0.56 -1.79 0.05 0.00 0.00 0.00 0.00 19.45 18.27 1iux n ALA 80 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1iux n GLY 81 N -1.93 -0.51 3.23 0.00 0.00 -1.26 -4.98 105.19 99.75 1iux n GLY 81 Ca -0.25 0.21 -0.13 0.00 0.00 0.00 0.00 46.02 45.85 1iux n GLY 81 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1iux s GLN 82 N -6.47 0.44 -0.11 1.61 -2.07 -0.14 -5.11 119.66 107.81 1iux s GLN 82 Ca 0.60 0.37 -0.02 0.00 -1.82 0.00 0.00 55.36 54.49 1iux s GLN 82 Cb -0.29 0.21 -0.03 0.00 -1.09 0.00 0.00 33.01 31.81 1iux s GLN 82 CO 0.79 -0.07 -0.03 1.03 -1.32 0.00 0.00 175.29 175.69 1iux s ARG 83 N -0.06 3.22 -0.07 9.60 0.52 -1.26 -0.98 118.95 129.93 1iux s ARG 83 Ca -0.02 -0.49 0.01 0.00 -0.52 0.00 0.00 55.73 54.72 1iux s ARG 83 Cb -0.03 -2.80 0.02 0.00 0.52 0.00 0.00 34.95 32.66 1iux s ARG 83 CO 0.01 0.50 -0.09 1.03 0.02 0.00 0.00 175.30 176.77 1iux s ARG 84 N -0.34 1.41 -0.09 3.54 1.81 -0.03 -4.97 118.95 120.28 1iux s ARG 84 Ca 0.06 -0.30 -0.13 0.00 -1.72 0.00 0.00 55.73 53.65 1iux s ARG 84 Cb -0.12 -1.26 -0.05 0.00 -0.45 0.00 0.00 34.95 33.07 1iux s ARG 84 CO 0.02 -0.05 0.30 0.50 -0.68 0.00 0.00 175.30 175.39 1iux s ARG 85 N 0.90 3.94 -0.32 3.54 3.52 -1.26 -0.85 118.95 128.42 1iux s ARG 85 Ca -0.11 0.16 -0.08 0.00 -0.13 0.00 0.00 55.73 55.57 1iux s ARG 85 Cb -0.15 -3.30 0.01 0.00 -1.56 0.00 0.00 34.95 29.96 1iux s ARG 85 CO 0.01 0.53 0.13 0.42 -0.81 0.00 0.00 175.30 175.57 1iux s ILE 86 N -0.43 4.21 -0.93 4.11 1.01 -0.46 -5.00 121.20 123.71 1iux s ILE 86 Ca 0.19 -0.74 -0.24 0.00 0.00 0.00 0.00 60.65 59.85 1iux s ILE 86 Cb -0.14 -3.24 0.03 0.00 0.01 0.00 0.00 42.46 39.12 1iux s ILE 86 CO 0.07 -0.04 1.49 -0.62 0.00 0.00 0.00 174.94 175.85 1iux s ASP 87 N 1.52 6.21 0.12 3.58 -1.08 -1.26 -2.70 116.67 123.06 1iux s ASP 87 Ca 0.02 -1.07 -0.19 0.00 -0.52 0.00 0.00 52.55 50.79 1iux s ASP 87 Cb -0.18 -2.56 -0.05 0.00 -1.46 0.00 0.00 42.92 38.67 1iux s ASP 87 CO 0.04 -1.76 1.75 -0.07 0.52 0.00 0.00 175.17 175.65 1iux h LEU 88 N 13.60 0.11 -0.22 -1.34 3.38 -1.51 0.18 115.31 129.50 1iux h LEU 88 Ca 0.06 0.02 0.01 0.00 0.09 0.00 0.00 57.88 58.06 1iux h LEU 88 Cb 1.02 -0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.76 1iux h LEU 88 CO 1.36 0.09 0.12 0.50 0.09 0.00 0.00 178.44 180.60 1iux h LYS 89 N 0.18 0.24 0.05 1.13 3.64 -1.43 0.24 116.57 120.62 1iux h LYS 89 Ca 0.08 -0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.45 1iux h LYS 89 Cb 0.04 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 31.81 1iux h LYS 89 CO -0.08 0.16 -0.02 -0.09 -2.27 0.00 0.00 179.45 177.15 1iux h ARG 90 N 0.25 -0.06 0.00 1.90 2.43 -1.82 0.88 114.38 117.96 1iux h ARG 90 Ca 0.09 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.26 1iux h ARG 90 Cb 0.01 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.57 1iux h ARG 90 CO -0.05 0.31 0.00 -0.07 -1.51 0.00 0.00 179.97 178.65 1iux h LEU 91 N -0.44 0.00 -1.76 3.80 -0.00 -0.85 -3.02 115.31 113.04 1iux h LEU 91 Ca -0.01 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.87 1iux h LEU 91 Cb 0.40 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.06 1iux h LEU 91 CO 0.01 0.00 -0.03 -1.54 -0.00 0.00 0.00 178.44 176.88 1iux n SER 92 N -2.75 2.70 -0.17 -0.43 3.41 0.82 -4.65 113.62 112.55 1iux n SER 92 Ca 0.02 -1.85 0.00 0.00 -0.26 0.00 0.00 58.87 56.78 1iux n SER 92 Cb 0.32 0.03 0.00 0.00 -0.26 0.00 0.00 64.21 64.30 1iux n SER 92 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1iux n GLY 93 N 1.19 0.86 0.00 5.00 0.00 -1.14 -4.40 105.19 106.71 1iux n GLY 93 Ca 0.12 -0.60 0.00 0.00 0.00 0.00 0.00 46.02 45.54 1iux n GLY 93 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1iux n GLY 94 N -0.72 0.32 3.89 -0.02 0.00 0.30 -5.04 105.19 103.93 1iux n GLY 94 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 1iux n GLY 94 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1iux s LYS 95 N -0.99 3.52 0.33 1.61 1.02 -1.26 -4.90 119.74 119.08 1iux s LYS 95 Ca 0.00 0.45 0.07 0.00 0.02 0.00 0.00 55.97 56.50 1iux s LYS 95 Cb 0.00 -2.23 -0.03 0.00 -0.52 0.00 0.00 37.83 35.05 1iux s LYS 95 CO 0.00 -0.41 0.28 0.95 -0.92 0.00 0.00 175.35 175.25 1iux s THR 96 N -2.97 0.00 0.25 2.17 -4.23 -1.26 -3.24 115.64 106.36 1iux s THR 96 Ca 0.51 -1.99 0.10 0.00 -1.18 0.00 0.00 61.69 59.14 1iux s THR 96 Cb -0.11 -2.51 -0.05 0.00 1.34 0.00 0.00 72.50 71.18 1iux s THR 96 CO 0.49 0.00 -0.18 0.68 -0.54 0.00 0.00 174.62 175.07 1iux s VAL 97 N -3.44 2.19 -0.10 2.29 -7.23 -1.00 -4.12 120.40 108.99 1iux s VAL 97 Ca 0.40 -2.30 0.03 0.00 -1.81 0.00 0.00 61.98 58.31 1iux s VAL 97 Cb 0.02 -2.18 0.00 0.00 0.56 0.00 0.00 36.38 34.78 1iux s VAL 97 CO 0.27 -0.45 -0.22 -0.89 -0.31 0.00 0.00 175.10 173.50 1iux s THR 98 N -2.61 1.92 -0.36 5.32 2.01 0.14 -0.71 115.64 121.33 1iux s THR 98 Ca 0.26 -0.93 -0.17 0.00 0.31 0.00 0.00 61.69 61.16 1iux s THR 98 Cb -0.04 -1.67 -0.00 0.00 0.01 0.00 0.00 72.50 70.80 1iux s THR 98 CO 0.12 0.53 0.48 -0.69 -0.69 0.00 0.00 174.62 174.36 1iux s VAL 99 N 0.47 5.05 -0.28 3.82 1.01 0.76 0.36 120.40 131.59 1iux s VAL 99 Ca -0.16 0.17 -0.06 0.00 0.00 0.00 0.00 61.98 61.92 1iux s VAL 99 Cb -0.17 -3.96 0.14 0.00 0.00 0.00 0.00 36.38 32.39 1iux s VAL 99 CO 0.07 -0.24 0.57 -0.47 0.00 0.00 0.00 175.10 175.02 1iux s TYR 100 N 2.30 -1.26 0.59 5.22 5.04 -0.11 -1.56 117.35 127.57 1iux s TYR 100 Ca 0.16 1.88 -0.19 0.00 -2.44 0.00 0.00 57.07 56.49 1iux s TYR 100 Cb -0.16 0.58 -0.05 0.00 0.35 0.00 0.00 41.96 42.68 1iux s TYR 100 CO 0.13 -0.69 1.06 0.41 -1.34 0.00 0.00 175.55 175.12 1iux n GLY 101 N 5.43 -0.07 0.26 8.97 0.00 -1.26 -4.53 105.19 113.99 1iux n GLY 101 Ca -0.08 -0.10 0.01 0.00 0.00 0.00 0.00 46.02 45.86 1iux n GLY 101 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 1iux h GLN 102 N 0.68 0.38 -0.77 1.61 4.15 -1.06 -1.93 115.11 118.17 1iux h GLN 102 Ca -0.49 -0.08 0.02 0.00 0.77 0.00 0.00 58.65 58.87 1iux h GLN 102 Cb 1.35 -0.06 -0.04 0.00 0.21 0.00 0.00 27.48 28.94 1iux h GLN 102 CO 0.52 0.45 0.50 1.79 -1.93 0.00 0.00 178.83 180.16 1iux h THR 103 N 0.36 1.17 -0.29 2.39 1.35 -1.76 -0.58 112.91 115.55 1iux h THR 103 Ca 0.08 -0.35 -0.07 0.00 -0.55 0.00 0.00 66.41 65.52 1iux h THR 103 Cb 0.32 0.07 -0.01 0.00 -1.73 0.00 0.00 68.15 66.80 1iux h THR 103 CO 0.01 0.18 -0.10 -0.33 -0.25 0.00 0.00 175.52 175.03 1iux h GLU 104 N 1.01 0.58 -0.67 4.72 3.07 -1.74 -1.01 114.58 120.54 1iux h GLU 104 Ca 0.29 -0.24 0.00 0.00 -0.50 0.00 0.00 59.36 58.91 1iux h GLU 104 Cb -0.08 -0.02 -0.03 0.00 -0.84 0.00 0.00 28.75 27.78 1iux h GLU 104 CO -0.08 0.80 0.42 0.28 -1.40 0.00 0.00 179.01 179.04 1iux h VAL 105 N 0.34 1.18 -0.63 3.13 2.07 -1.18 0.16 116.25 121.32 1iux h VAL 105 Ca 0.07 -0.37 -0.09 0.00 0.82 0.00 0.00 66.70 67.13 1iux h VAL 105 Cb 0.61 0.23 -0.02 0.00 -1.52 0.00 0.00 31.29 30.58 1iux h VAL 105 CO 0.04 0.18 0.04 0.74 0.02 0.00 0.00 177.57 178.59 1iux h THR 106 N 0.91 1.26 -0.40 2.57 2.02 -0.99 -1.32 112.91 116.96 1iux h THR 106 Ca 0.24 -1.11 -0.03 0.00 0.77 0.00 0.00 66.41 66.28 1iux h THR 106 Cb -0.07 0.73 -0.02 0.00 -1.74 0.00 0.00 68.15 67.06 1iux h THR 106 CO -0.05 0.41 0.11 -0.09 0.37 0.00 0.00 175.52 176.28 1iux h ARG 107 N 1.00 0.63 -0.55 6.66 2.43 -0.88 -1.28 114.38 122.39 1iux h ARG 107 Ca 0.18 -0.14 0.01 0.00 -0.81 0.00 0.00 59.98 59.22 1iux h ARG 107 Cb 0.52 -0.09 -0.03 0.00 -0.42 0.00 0.00 29.97 29.95 1iux h ARG 107 CO 0.02 0.64 0.36 -0.44 -1.51 0.00 0.00 179.97 179.04 1iux h ASP 108 N 0.50 0.62 -0.46 -3.80 3.32 -0.66 -2.06 116.42 113.89 1iux h ASP 108 Ca 0.13 -0.01 -0.08 0.00 0.02 0.00 0.00 57.03 57.08 1iux h ASP 108 Cb 0.28 -0.15 -0.02 0.00 0.22 0.00 0.00 39.33 39.66 1iux h ASP 108 CO -0.00 0.45 -0.03 -0.07 -1.72 0.00 0.00 179.24 177.87 1iux h LEU 109 N 0.74 0.82 -0.53 1.55 3.38 -1.10 -2.04 115.31 118.13 1iux h LEU 109 Ca 0.21 -0.32 -0.00 0.00 0.09 0.00 0.00 57.88 57.85 1iux h LEU 109 Cb -0.07 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.43 1iux h LEU 109 CO -0.05 0.94 0.33 0.24 0.09 0.00 0.00 178.44 179.99 1iux h MET 110 N 0.67 0.71 -0.54 1.13 2.86 -1.07 0.05 114.93 118.74 1iux h MET 110 Ca 0.13 -0.06 -0.03 0.00 -2.06 0.00 0.00 59.70 57.68 1iux h MET 110 Cb 0.54 -0.15 -0.02 0.00 0.06 0.00 0.00 31.60 32.03 1iux h MET 110 CO 0.03 0.50 0.21 0.93 1.06 0.00 0.00 176.91 179.64 1iux h GLU 111 N 0.71 0.81 -0.74 1.72 5.08 -1.36 -1.28 114.58 119.51 1iux h GLU 111 Ca 0.19 -0.15 -0.04 0.00 -1.00 0.00 0.00 59.36 58.36 1iux h GLU 111 Cb -0.04 -0.13 -0.03 0.00 0.50 0.00 0.00 28.75 29.05 1iux h GLU 111 CO -0.04 0.71 0.31 0.00 -1.00 0.00 0.00 179.01 178.99 1iux h ALA 112 N 1.06 0.96 -0.38 3.43 0.00 -1.12 -2.03 119.26 121.18 1iux h ALA 112 Ca 0.18 -0.18 -0.08 0.00 0.00 0.00 0.00 54.91 54.83 1iux h ALA 112 Cb 0.21 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 1iux h ALA 112 CO -0.01 0.57 -0.07 -0.09 0.00 0.00 0.00 179.25 179.65 1iux h ARG 113 N 1.06 0.73 -0.15 0.00 2.43 -0.75 -2.77 114.38 114.92 1iux h ARG 113 Ca 0.25 -0.27 0.01 0.00 -0.81 0.00 0.00 59.98 59.16 1iux h ARG 113 Cb 0.19 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 29.69 1iux h ARG 113 CO -0.02 0.86 0.07 1.49 -1.51 0.00 0.00 179.97 180.86 1iux h GLU 114 N 0.54 0.15 -0.94 0.20 4.81 -1.06 -2.17 114.58 116.10 1iux h GLU 114 Ca 0.10 -0.01 0.07 0.00 -0.13 0.00 0.00 59.36 59.39 1iux h GLU 114 Cb 0.58 -0.03 -0.07 0.00 0.63 0.00 0.00 28.75 29.86 1iux h GLU 114 CO 0.03 0.10 0.59 0.00 -0.73 0.00 0.00 179.01 179.01 1iux h ALA 115 N 1.08 1.32 0.00 2.92 0.00 -1.34 -0.37 119.26 122.86 1iux h ALA 115 Ca 0.06 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1iux h ALA 115 Cb 0.02 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.55 1iux h ALA 115 CO -0.05 0.34 0.00 0.00 0.00 0.00 0.00 179.25 179.54 1iux n GLY 117 N 0.94 0.51 3.83 0.00 0.00 -0.15 -5.02 105.19 105.30 1iux n GLY 117 Ca 0.05 -0.54 -0.32 0.00 0.00 0.00 0.00 46.02 45.22 1iux n GLY 117 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1iux s ALA 118 N -2.42 2.94 0.07 4.61 0.00 -1.15 -5.00 121.76 120.81 1iux s ALA 118 Ca 0.00 0.21 -0.31 0.00 0.00 0.00 0.00 51.96 51.86 1iux s ALA 118 Cb 0.00 -3.15 -0.06 0.00 0.00 0.00 0.00 23.12 19.91 1iux s ALA 118 CO 0.00 -0.55 1.23 0.99 0.00 0.00 0.00 175.76 177.43 1iux s THR 119 N -2.67 3.92 -0.08 0.00 2.01 -1.26 -4.82 115.64 112.74 1iux s THR 119 Ca 0.60 1.38 -0.03 0.00 0.31 0.00 0.00 61.69 63.95 1iux s THR 119 Cb -0.12 -3.89 0.04 0.00 0.01 0.00 0.00 72.50 68.55 1iux s THR 119 CO 0.38 0.11 0.12 -0.89 -0.69 0.00 0.00 174.62 173.65 1iux s THR 120 N 1.03 -0.20 -0.44 -0.82 2.01 -1.26 -2.05 115.64 113.91 1iux s THR 120 Ca 0.59 0.33 -0.10 0.00 0.31 0.00 0.00 61.69 62.83 1iux s THR 120 Cb -0.31 -0.27 0.09 0.00 0.01 0.00 0.00 72.50 72.02 1iux s THR 120 CO 0.30 0.12 0.29 -0.69 -0.69 0.00 0.00 174.62 173.95 1iux s VAL 121 N 2.24 4.31 0.57 3.82 1.01 0.31 -4.97 120.40 127.68 1iux s VAL 121 Ca 0.04 -1.47 -0.07 0.00 0.00 0.00 0.00 61.98 60.48 1iux s VAL 121 Cb -0.12 -3.68 -0.02 0.00 0.00 0.00 0.00 36.38 32.56 1iux s VAL 121 CO -0.05 -0.58 0.91 -0.31 0.00 0.00 0.00 175.10 175.06 1iux s TYR 122 N 1.43 3.46 -1.45 5.22 2.02 -1.26 -1.26 117.35 125.50 1iux s TYR 122 Ca 0.04 0.89 -0.08 0.00 -0.37 0.00 0.00 57.07 57.54 1iux s TYR 122 Cb -0.24 -2.60 0.04 0.00 -0.40 0.00 0.00 41.96 38.76 1iux s TYR 122 CO 0.02 -0.63 0.70 1.04 -1.57 0.00 0.00 175.55 175.11 1iux n GLN 123 N -2.54 -4.90 -2.67 -0.62 6.02 0.57 -4.87 117.38 108.37 1iux n GLN 123 Ca 0.04 0.72 -0.42 0.00 -0.01 0.00 0.00 57.00 57.33 1iux n GLN 123 Cb 0.56 -5.57 -0.03 0.00 1.02 0.00 0.00 30.24 26.22 1iux n GLN 123 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1iux s ALA 124 N -3.14 3.03 0.31 -1.58 0.00 -0.26 -4.71 121.76 115.42 1iux s ALA 124 Ca 0.42 -1.03 -0.15 0.00 0.00 0.00 0.00 51.96 51.20 1iux s ALA 124 Cb -0.20 -3.95 -0.09 0.00 0.00 0.00 0.00 23.12 18.88 1iux s ALA 124 CO 0.52 -2.62 0.73 0.00 0.00 0.00 0.00 175.76 174.38 1iux s ALA 125 N 4.66 3.34 -1.03 0.00 0.00 0.05 -3.98 121.76 124.80 1iux s ALA 125 Ca 0.38 0.04 -0.22 0.00 0.00 0.00 0.00 51.96 52.15 1iux s ALA 125 Cb -0.09 -2.76 0.03 0.00 0.00 0.00 0.00 23.12 20.30 1iux s ALA 125 CO 0.22 0.34 0.62 0.39 0.00 0.00 0.00 175.76 177.33 1iux n GLU 126 N -0.28 -0.68 -2.13 0.00 1.02 -1.26 -0.47 120.64 116.84 1iux n GLU 126 Ca 0.03 0.27 -0.41 0.00 -0.02 0.00 0.00 57.16 57.03 1iux n GLU 126 Cb 0.53 -2.21 -0.03 0.00 -0.02 0.00 0.00 31.44 29.71 1iux n GLU 126 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 1iux s VAL 127 N -3.36 2.94 0.04 2.62 1.01 -1.26 -4.47 120.40 117.93 1iux s VAL 127 Ca 0.30 0.80 0.05 0.00 0.00 0.00 0.00 61.98 63.13 1iux s VAL 127 Cb -0.17 -3.51 -0.02 0.00 0.00 0.00 0.00 36.38 32.68 1iux s VAL 127 CO 0.91 0.13 -0.14 -0.13 0.00 0.00 0.00 175.10 175.87 1iux s ARG 128 N -0.42 0.89 -0.11 2.72 1.81 -0.06 -4.97 118.95 118.81 1iux s ARG 128 Ca 0.57 -0.76 -0.01 0.00 -1.72 0.00 0.00 55.73 53.81 1iux s ARG 128 Cb -0.39 -0.89 -0.03 0.00 -0.45 0.00 0.00 34.95 33.19 1iux s ARG 128 CO 0.42 0.22 -0.08 -0.51 -0.68 0.00 0.00 175.30 174.67 1iux s LEU 129 N -1.17 3.07 0.08 2.53 1.02 -1.26 -1.43 118.68 121.51 1iux s LEU 129 Ca 0.01 -0.13 0.04 0.00 0.02 0.00 0.00 54.13 54.07 1iux s LEU 129 Cb -0.08 -1.69 -0.03 0.00 0.02 0.00 0.00 46.19 44.41 1iux s LEU 129 CO 0.01 0.26 -0.12 -1.00 0.02 0.00 0.00 176.35 175.52 1iux s HIS 130 N -0.20 1.12 -1.35 0.29 3.76 0.00 -4.88 115.29 114.03 1iux s HIS 130 Ca 0.02 -0.53 -0.01 0.00 -0.15 0.00 0.00 55.06 54.39 1iux s HIS 130 Cb -0.13 -0.62 0.00 0.00 1.11 0.00 0.00 32.58 32.94 1iux s HIS 130 CO 0.03 0.03 0.63 -0.25 -0.85 0.00 0.00 174.74 174.33 1iux n ASP 131 N 1.01 -1.05 0.28 1.40 9.92 -1.26 -1.69 116.55 125.16 1iux n ASP 131 Ca -0.19 -0.88 0.13 0.00 -0.53 0.00 0.00 54.79 53.32 1iux n ASP 131 Cb 0.56 -3.74 0.83 0.00 -0.64 0.00 0.00 41.12 38.13 1iux n ASP 131 CO 0.00 0.00 0.00 -0.07 0.13 0.00 0.00 177.20 177.26 1iux h LEU 132 N -1.86 0.00 -1.39 0.64 3.38 -1.93 -2.11 115.31 112.03 1iux h LEU 132 Ca -0.62 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.35 1iux h LEU 132 Cb 1.36 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.11 1iux h LEU 132 CO 0.59 0.03 -0.16 0.00 0.09 0.00 0.00 178.44 178.98 1iux n GLN 133 N -3.94 1.60 -1.66 1.13 6.02 -1.26 -0.77 117.38 118.50 1iux n GLN 133 Ca -0.03 -1.31 -0.30 0.00 -0.01 0.00 0.00 57.00 55.35 1iux n GLN 133 Cb 0.11 -1.35 0.22 0.00 1.02 0.00 0.00 30.24 30.24 1iux n GLN 133 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.06 176.25 1iux s GLY 134 N -1.79 1.75 0.06 1.08 0.00 -0.79 -4.95 107.32 102.67 1iux s GLY 134 Ca 0.19 -1.23 0.25 0.00 0.00 0.00 0.00 44.72 43.94 1iux s GLY 134 CO 0.33 -0.37 1.48 -1.84 0.00 0.00 0.00 173.10 172.70 1iux n GLU 135 N -4.17 0.13 -3.45 2.90 0.28 -1.26 -4.51 120.64 110.56 1iux n GLU 135 Ca 0.16 0.05 -0.27 0.00 -0.16 0.00 0.00 57.16 56.94 1iux n GLU 135 Cb 0.59 -1.59 -0.10 0.00 1.43 0.00 0.00 31.44 31.78 1iux n GLU 135 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 177.13 177.51 1iux n ARG 136 N -1.78 0.68 -1.41 3.44 1.74 -1.26 -4.93 116.66 113.14 1iux n ARG 136 Ca 0.05 -3.49 -0.30 0.00 -0.77 0.00 0.00 57.85 53.34 1iux n ARG 136 Cb 0.38 -1.74 0.10 0.00 -1.02 0.00 0.00 32.46 30.18 1iux n ARG 136 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 1iux s PRO 137 N -0.54 2.03 0.14 5.56 0.04 -1.25 -4.88 135.00 136.10 1iux s PRO 137 Ca 0.32 0.84 -0.13 0.00 0.04 0.00 0.00 61.00 62.06 1iux s PRO 137 Cb 0.05 -1.90 0.02 0.00 0.04 0.00 0.00 34.50 32.71 1iux s PRO 137 CO -0.17 -1.71 0.36 1.52 0.04 0.00 0.00 177.00 177.03 1iux s TYR 138 N -3.03 -0.00 -0.04 0.56 1.13 -0.68 -2.91 117.35 112.37 1iux s TYR 138 Ca 0.61 -0.35 0.06 0.00 -1.41 0.00 0.00 57.07 55.98 1iux s TYR 138 Cb -0.16 0.16 -0.01 0.00 -1.10 0.00 0.00 41.96 40.85 1iux s TYR 138 CO 0.55 -0.71 -0.22 0.08 -2.51 0.00 0.00 175.55 172.75 1iux s VAL 139 N -3.86 1.78 0.08 -3.49 1.01 0.17 -0.82 120.40 115.27 1iux s VAL 139 Ca 0.07 -0.93 0.09 0.00 0.00 0.00 0.00 61.98 61.21 1iux s VAL 139 Cb 0.02 -1.50 -0.03 0.00 0.00 0.00 0.00 36.38 34.86 1iux s VAL 139 CO -0.08 0.50 -0.22 0.42 0.00 0.00 0.00 175.10 175.72 1iux s THR 140 N -0.20 2.54 0.27 3.92 -4.23 -0.52 0.15 115.64 117.57 1iux s THR 140 Ca -0.00 -1.43 -0.14 0.00 -1.18 0.00 0.00 61.69 58.93 1iux s THR 140 Cb -0.12 -2.09 0.00 0.00 1.34 0.00 0.00 72.50 71.64 1iux s THR 140 CO 0.02 0.24 0.55 0.72 -0.54 0.00 0.00 174.62 175.61 1iux s PHE 141 N -0.98 0.25 -0.12 3.99 -0.71 -0.62 -0.88 117.98 118.91 1iux s PHE 141 Ca 0.15 -0.64 0.02 0.00 -1.04 0.00 0.00 56.93 55.41 1iux s PHE 141 Cb -0.10 0.33 -0.00 0.00 -1.21 0.00 0.00 43.02 42.04 1iux s PHE 141 CO 0.06 -1.09 -0.20 -1.21 -1.34 0.00 0.00 175.22 171.44 1iux s GLU 142 N -3.87 3.16 -0.16 1.99 2.02 0.38 -0.05 118.70 122.17 1iux s GLU 142 Ca 0.20 -0.81 0.00 0.00 0.02 0.00 0.00 54.97 54.38 1iux s GLU 142 Cb -0.02 -2.45 0.03 0.00 0.10 0.00 0.00 34.13 31.79 1iux s GLU 142 CO 0.09 0.14 -0.12 0.50 0.02 0.00 0.00 175.26 175.90 1iux s ARG 143 N 0.47 2.05 -1.70 1.61 3.52 -0.78 -0.77 118.95 123.35 1iux s ARG 143 Ca -0.14 -0.57 -0.15 0.00 -0.13 0.00 0.00 55.73 54.74 1iux s ARG 143 Cb -0.17 -2.09 0.14 0.00 -1.56 0.00 0.00 34.95 31.27 1iux s ARG 143 CO 0.06 -0.30 0.55 -0.40 -0.81 0.00 0.00 175.30 174.40 1iux n ASP 144 N 4.79 -1.76 0.00 -2.12 5.68 -1.26 -1.71 116.55 120.16 1iux n ASP 144 Ca -0.15 -1.13 0.00 0.00 -0.50 0.00 0.00 54.79 53.01 1iux n ASP 144 Cb 0.49 -2.26 0.00 0.00 -1.14 0.00 0.00 41.12 38.21 1iux n ASP 144 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1iux n GLY 145 N -1.57 2.94 3.73 6.12 0.00 -1.26 -5.05 105.19 110.11 1iux n GLY 145 Ca -0.03 -0.04 -0.38 0.00 0.00 0.00 0.00 46.02 45.57 1iux n GLY 145 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1iux s GLU 146 N 0.00 4.33 -0.34 1.61 -1.05 -0.69 -5.04 118.70 117.52 1iux s GLU 146 Ca 0.00 0.56 -0.27 0.00 -0.15 0.00 0.00 54.97 55.11 1iux s GLU 146 Cb 0.00 -3.41 0.01 0.00 -0.44 0.00 0.00 34.13 30.29 1iux s GLU 146 CO 0.00 0.21 0.96 0.50 0.95 0.00 0.00 175.26 177.88 1iux s ARG 147 N 0.43 3.96 0.20 -4.83 6.06 -1.26 -1.87 118.95 121.64 1iux s ARG 147 Ca 0.28 0.79 0.07 0.00 -2.50 0.00 0.00 55.73 54.37 1iux s ARG 147 Cb -0.16 -3.76 -0.04 0.00 0.06 0.00 0.00 34.95 31.05 1iux s ARG 147 CO 0.13 -0.88 0.08 -0.51 -2.50 0.00 0.00 175.30 171.61 1iux s LEU 148 N 3.45 3.54 -0.06 -0.88 1.43 0.93 -4.94 118.68 122.15 1iux s LEU 148 Ca 0.40 -0.32 0.05 0.00 -1.03 0.00 0.00 54.13 53.23 1iux s LEU 148 Cb -0.12 -2.14 -0.02 0.00 0.03 0.00 0.00 46.19 43.94 1iux s LEU 148 CO 0.16 0.05 -0.22 -0.60 0.23 0.00 0.00 176.35 175.97 1iux s ARG 149 N -3.25 2.54 -0.17 1.70 3.52 -1.26 -1.59 118.95 120.43 1iux s ARG 149 Ca 0.30 -0.85 0.01 0.00 -0.13 0.00 0.00 55.73 55.06 1iux s ARG 149 Cb -0.09 -2.23 0.02 0.00 -1.56 0.00 0.00 34.95 31.09 1iux s ARG 149 CO 0.21 0.45 -0.19 -1.17 -0.81 0.00 0.00 175.30 173.79 1iux s LEU 150 N -0.31 2.02 0.05 -0.88 2.96 0.12 -2.69 118.68 119.95 1iux s LEU 150 Ca 0.01 -0.61 -0.13 0.00 -0.22 0.00 0.00 54.13 53.18 1iux s LEU 150 Cb -0.13 -1.40 -0.06 0.00 0.50 0.00 0.00 46.19 45.10 1iux s LEU 150 CO 0.02 -0.01 0.43 -1.81 -1.32 0.00 0.00 176.35 173.66 1iux s ASP 151 N 1.31 6.76 0.34 3.68 1.01 -0.45 -0.65 116.67 128.67 1iux s ASP 151 Ca 0.04 0.93 -0.10 0.00 0.71 0.00 0.00 52.55 54.13 1iux s ASP 151 Cb -0.13 -2.23 0.02 0.00 1.01 0.00 0.00 42.92 41.59 1iux s ASP 151 CO -0.12 0.25 0.60 0.00 0.21 0.00 0.00 175.17 176.11 1iux n ASP 153 N -1.16 2.04 -4.06 0.00 8.00 -0.08 -3.95 116.55 117.33 1iux n ASP 153 Ca -0.03 0.04 -0.08 0.00 0.71 0.00 0.00 54.79 55.43 1iux n ASP 153 Cb 0.61 -0.63 -0.10 0.00 -0.02 0.00 0.00 41.12 40.98 1iux n ASP 153 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 1iux s TYR 154 N -2.54 0.46 -0.06 1.24 2.02 -1.03 -4.69 117.35 112.74 1iux s TYR 154 Ca -0.28 -0.93 0.02 0.00 -0.37 0.00 0.00 57.07 55.51 1iux s TYR 154 Cb 0.08 -0.34 0.01 0.00 -0.40 0.00 0.00 41.96 41.31 1iux s TYR 154 CO 0.69 -0.33 -0.12 0.42 -1.57 0.00 0.00 175.55 174.64 1iux s ILE 155 N -3.27 1.12 -0.25 2.71 1.01 -0.14 -1.33 121.20 121.05 1iux s ILE 155 Ca 0.01 -0.47 -0.05 0.00 0.00 0.00 0.00 60.65 60.14 1iux s ILE 155 Cb 0.03 -1.03 -0.00 0.00 0.01 0.00 0.00 42.46 41.47 1iux s ILE 155 CO -0.08 0.35 0.01 0.00 0.00 0.00 0.00 174.94 175.23 1iux s ALA 156 N 0.65 2.93 -0.72 9.38 0.00 0.09 -1.51 121.76 132.57 1iux s ALA 156 Ca -0.14 -1.30 -0.24 0.00 0.00 0.00 0.00 51.96 50.28 1iux s ALA 156 Cb -0.16 -1.90 0.06 0.00 0.00 0.00 0.00 23.12 21.12 1iux s ALA 156 CO 0.04 -0.65 1.11 0.20 0.00 0.00 0.00 175.76 176.46 1iux s GLY 157 N 1.48 1.20 -0.36 0.00 0.00 0.74 -1.55 107.32 108.83 1iux s GLY 157 Ca 0.04 -1.72 0.05 0.00 0.00 0.00 0.00 44.72 43.09 1iux s GLY 157 CO -0.01 2.31 1.36 0.00 0.00 0.00 0.00 173.10 176.76 1iux n ASP 159 N -0.77 4.34 -0.47 0.00 5.75 -0.79 -4.32 116.55 120.30 1iux n ASP 159 Ca 0.47 -2.46 0.04 0.00 -0.01 0.00 0.00 54.79 52.83 1iux n ASP 159 Cb 0.91 -0.56 -0.01 0.00 -1.03 0.00 0.00 41.12 40.43 1iux n ASP 159 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1iux n GLY 160 N 0.94 -1.89 0.36 6.12 0.00 -1.26 -2.98 105.19 106.48 1iux n GLY 160 Ca 0.23 -1.33 0.05 0.00 0.00 0.00 0.00 46.02 44.96 1iux n GLY 160 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1iux h PHE 161 N -0.26 0.92 -0.60 1.61 3.57 -1.85 -2.45 116.94 117.90 1iux h PHE 161 Ca 0.01 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.53 1iux h PHE 161 Cb 0.25 -0.30 0.00 0.00 2.79 0.00 0.00 35.95 38.69 1iux h PHE 161 CO 0.00 0.50 0.00 0.72 -2.23 0.00 0.00 178.31 177.30 1iux n HIS 162 N -4.48 1.67 -1.21 0.41 8.25 -1.26 -4.94 115.22 113.66 1iux n HIS 162 Ca 0.12 -0.62 -0.29 0.00 -0.26 0.00 0.00 57.72 56.67 1iux n HIS 162 Cb 0.19 -0.34 0.17 0.00 1.12 0.00 0.00 29.99 31.13 1iux n HIS 162 CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 1iux s GLY 163 N -0.82 1.57 0.19 -1.41 0.00 -0.92 -4.99 107.32 100.94 1iux s GLY 163 Ca 0.51 -0.37 0.13 0.00 0.00 0.00 0.00 44.72 44.99 1iux s GLY 163 CO 0.20 0.23 1.25 1.19 0.00 0.00 0.00 173.10 175.97 1iux h ILE 164 N -1.84 0.98 -0.26 0.90 6.09 -1.89 -3.38 117.51 118.10 1iux h ILE 164 Ca -0.54 -2.46 -0.00 0.00 -1.37 0.00 0.00 64.86 60.49 1iux h ILE 164 Cb 1.33 2.44 -0.01 0.00 0.47 0.00 0.00 36.82 41.04 1iux h ILE 164 CO 0.58 0.56 0.16 0.77 -3.07 0.00 0.00 178.15 177.14 1iux h SER 165 N 0.00 0.31 -0.14 2.19 4.64 -1.94 -2.22 113.55 116.39 1iux h SER 165 Ca -0.05 -0.04 -0.06 0.00 -0.47 0.00 0.00 61.79 61.17 1iux h SER 165 Cb 1.54 -0.08 -0.02 0.00 -0.31 0.00 0.00 62.40 63.53 1iux h SER 165 CO 0.08 0.26 -0.07 -0.09 -0.87 0.00 0.00 176.83 176.13 1iux h ARG 166 N 0.32 0.45 0.00 4.77 2.43 -1.85 -1.89 114.38 118.61 1iux h ARG 166 Ca 0.09 -0.11 0.00 0.00 -0.81 0.00 0.00 59.98 59.15 1iux h ARG 166 Cb 0.01 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 29.50 1iux h ARG 166 CO -0.02 0.53 0.00 1.96 -1.51 0.00 0.00 179.97 180.93 1iux h GLN 167 N 0.42 0.00 -0.01 0.20 4.20 -1.61 -2.95 115.11 115.36 1iux h GLN 167 Ca 0.09 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.80 1iux h GLN 167 Cb 0.40 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.18 1iux h GLN 167 CO 0.02 0.00 -0.17 0.43 -0.67 0.00 0.00 178.83 178.44 1iux n SER 168 N -2.37 0.67 -4.72 1.46 7.64 -0.71 -4.80 113.62 110.79 1iux n SER 168 Ca 0.02 -0.67 -0.37 0.00 1.01 0.00 0.00 58.87 58.86 1iux n SER 168 Cb 0.23 -0.00 -0.07 0.00 -1.01 0.00 0.00 64.21 63.37 1iux n SER 168 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 1iux s ILE 169 N -2.50 5.24 -0.25 0.44 1.01 -1.12 -5.00 121.20 119.02 1iux s ILE 169 Ca 0.27 0.75 -0.39 0.00 0.00 0.00 0.00 60.65 61.27 1iux s ILE 169 Cb 0.20 -3.73 -0.15 0.00 0.01 0.00 0.00 42.46 38.79 1iux s ILE 169 CO 0.49 0.34 1.78 -2.65 0.00 0.00 0.00 174.94 174.91 1iux n PRO 170 N 3.76 1.33 -0.27 2.79 -0.02 -1.26 -4.80 135.00 136.53 1iux n PRO 170 Ca -0.09 0.49 0.34 0.00 -2.02 0.00 0.00 63.50 62.21 1iux n PRO 170 Cb 0.52 -2.20 0.72 0.00 -0.02 0.00 0.00 33.50 32.51 1iux n PRO 170 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1iux h ALA 171 N 7.66 3.01 0.00 3.55 0.00 -1.93 0.60 119.26 132.15 1iux h ALA 171 Ca -0.46 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.41 1iux h ALA 171 Cb 1.31 0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.18 1iux h ALA 171 CO 0.96 -1.45 0.00 0.93 0.00 0.00 0.00 179.25 179.69 1iux h GLU 172 N 0.00 0.00 0.00 0.00 5.08 -2.04 -2.88 114.58 114.74 1iux h GLU 172 Ca 0.53 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.89 1iux h GLU 172 Cb 2.27 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.52 1iux h GLU 172 CO -0.01 0.00 -0.35 0.54 -1.00 0.00 0.00 179.01 178.19 1iux n ARG 173 N -2.79 0.15 -4.14 2.33 3.00 0.20 -4.90 116.66 110.52 1iux n ARG 173 Ca 0.02 0.07 -0.34 0.00 -0.01 0.00 0.00 57.85 57.59 1iux n ARG 173 Cb 0.36 -1.62 -0.08 0.00 0.00 0.00 0.00 32.46 31.12 1iux n ARG 173 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 1iux s LEU 174 N -3.72 3.91 -0.16 0.55 1.43 -1.09 -4.46 118.68 115.15 1iux s LEU 174 Ca 0.10 0.22 -0.01 0.00 -1.03 0.00 0.00 54.13 53.41 1iux s LEU 174 Cb 0.15 -2.09 -0.01 0.00 0.03 0.00 0.00 46.19 44.28 1iux s LEU 174 CO 0.65 0.34 -0.13 -0.75 0.23 0.00 0.00 176.35 176.69 1iux s LYS 175 N -1.31 3.30 -0.10 1.70 2.20 0.05 -4.97 119.74 120.61 1iux s LYS 175 Ca 0.18 -0.71 0.00 0.00 -0.36 0.00 0.00 55.97 55.09 1iux s LYS 175 Cb -0.12 -2.69 -0.02 0.00 -1.51 0.00 0.00 37.83 33.49 1iux s LYS 175 CO 0.08 0.05 -0.10 0.08 -0.36 0.00 0.00 175.35 175.10 1iux s VAL 176 N 0.77 3.42 -0.13 4.02 1.01 -1.26 -1.10 120.40 127.11 1iux s VAL 176 Ca -0.05 -0.56 0.01 0.00 0.00 0.00 0.00 61.98 61.38 1iux s VAL 176 Cb -0.15 -2.41 0.02 0.00 0.00 0.00 0.00 36.38 33.83 1iux s VAL 176 CO 0.01 0.56 -0.15 -0.36 0.00 0.00 0.00 175.10 175.16 1iux s PHE 177 N -0.27 2.11 -0.04 5.22 0.40 -0.17 -5.00 117.98 120.23 1iux s PHE 177 Ca 0.03 -1.12 -0.08 0.00 -0.60 0.00 0.00 56.93 55.16 1iux s PHE 177 Cb -0.13 -1.54 0.01 0.00 0.51 0.00 0.00 43.02 41.87 1iux s PHE 177 CO 0.03 -0.60 0.19 -2.00 0.70 0.00 0.00 175.22 173.53 1iux s GLU 178 N 1.31 0.39 -0.03 0.44 2.12 -1.26 -0.97 118.70 120.69 1iux s GLU 178 Ca 0.01 -0.06 -0.00 0.00 0.36 0.00 0.00 54.97 55.28 1iux s GLU 178 Cb -0.14 0.17 0.03 0.00 0.26 0.00 0.00 34.13 34.45 1iux s GLU 178 CO -0.07 -0.08 0.02 0.50 -0.54 0.00 0.00 175.26 175.09 1iux s ARG 179 N -0.67 0.11 -0.15 4.30 3.52 -0.36 -4.99 118.95 120.70 1iux s ARG 179 Ca -0.08 0.18 -0.04 0.00 -0.13 0.00 0.00 55.73 55.67 1iux s ARG 179 Cb -0.04 -0.42 -0.03 0.00 -1.56 0.00 0.00 34.95 32.90 1iux s ARG 179 CO 0.01 -0.20 -0.02 0.08 -0.81 0.00 0.00 175.30 174.37 1iux s VAL 180 N 1.32 4.06 0.15 7.11 1.01 -1.26 -0.32 120.40 132.46 1iux s VAL 180 Ca -0.06 -0.30 -0.08 0.00 0.00 0.00 0.00 61.98 61.54 1iux s VAL 180 Cb -0.13 -2.77 -0.06 0.00 0.00 0.00 0.00 36.38 33.42 1iux s VAL 180 CO -0.03 0.51 0.44 -0.31 0.00 0.00 0.00 175.10 175.70 1iux s TYR 181 N 0.18 3.50 0.00 5.22 1.51 -0.89 -4.99 117.35 121.88 1iux s TYR 181 Ca -0.01 0.73 0.00 0.00 -1.01 0.00 0.00 57.07 56.78 1iux s TYR 181 Cb -0.13 -2.13 0.00 0.00 -0.11 0.00 0.00 41.96 39.58 1iux s TYR 181 CO 0.02 0.42 0.93 -0.35 -1.11 0.00 0.00 175.55 175.46 1iux n PRO 182 N 0.30 0.90 -3.71 -1.71 -0.04 -1.26 -4.68 135.00 124.80 1iux n PRO 182 Ca -0.03 0.00 -0.09 0.00 -0.04 0.00 0.00 63.50 63.34 1iux n PRO 182 Cb 0.52 -1.05 -0.02 0.00 -0.04 0.00 0.00 33.50 32.91 1iux n PRO 182 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 1iux s PHE 183 N 0.10 -0.26 0.31 0.54 -0.12 -1.26 -4.10 117.98 113.19 1iux s PHE 183 Ca 0.00 -0.10 0.03 0.00 -0.05 0.00 0.00 56.93 56.81 1iux s PHE 183 Cb 0.00 0.59 -0.04 0.00 -0.63 0.00 0.00 43.02 42.94 1iux s PHE 183 CO 0.00 -1.06 0.14 0.20 -0.05 0.00 0.00 175.22 174.45 1iux s GLY 184 N -2.86 2.10 -0.20 1.99 0.00 0.59 -2.65 107.32 106.29 1iux s GLY 184 Ca 0.08 -1.73 -0.05 0.00 0.00 0.00 0.00 44.72 43.03 1iux s GLY 184 CO -0.01 -1.63 -0.01 -0.98 0.00 0.00 0.00 173.10 170.48 1iux s TRP 185 N -3.55 3.03 -0.35 1.90 0.52 0.14 -1.07 118.94 119.56 1iux s TRP 185 Ca 0.34 -0.46 -0.17 0.00 0.02 0.00 0.00 56.10 55.83 1iux s TRP 185 Cb 0.05 -2.07 -0.00 0.00 -1.15 0.00 0.00 33.47 30.30 1iux s TRP 185 CO 0.17 -0.23 0.48 -1.17 0.02 0.00 0.00 176.95 176.22 1iux s LEU 186 N 0.94 4.39 0.06 2.99 2.96 0.31 -0.32 118.68 130.01 1iux s LEU 186 Ca 0.01 -0.11 0.03 0.00 -0.22 0.00 0.00 54.13 53.85 1iux s LEU 186 Cb -0.14 -2.53 -0.04 0.00 0.50 0.00 0.00 46.19 43.98 1iux s LEU 186 CO 0.02 -0.46 0.02 -0.83 -1.32 0.00 0.00 176.35 173.78 1iux s GLY 187 N 1.76 1.94 -0.05 7.98 0.00 0.13 -1.24 107.32 117.85 1iux s GLY 187 Ca 0.17 -1.04 0.00 0.00 0.00 0.00 0.00 44.72 43.85 1iux s GLY 187 CO 0.13 -0.99 -0.03 -2.27 0.00 0.00 0.00 173.10 169.94 1iux s LEU 188 N -2.12 1.17 -0.15 0.66 0.20 -0.11 -2.23 118.68 116.10 1iux s LEU 188 Ca 0.25 -0.11 -0.04 0.00 0.69 0.00 0.00 54.13 54.92 1iux s LEU 188 Cb -0.12 -0.42 -0.03 0.00 -0.43 0.00 0.00 46.19 45.19 1iux s LEU 188 CO 0.17 -0.09 0.00 -0.22 -0.29 0.00 0.00 176.35 175.92 1iux s LEU 189 N 1.13 3.49 0.02 -0.68 2.96 0.13 -1.34 118.68 124.39 1iux s LEU 189 Ca -0.08 -0.01 -0.04 0.00 -0.22 0.00 0.00 54.13 53.79 1iux s LEU 189 Cb -0.14 -1.84 -0.01 0.00 0.50 0.00 0.00 46.19 44.69 1iux s LEU 189 CO -0.01 0.21 0.05 0.00 -1.32 0.00 0.00 176.35 175.29 1iux s ALA 190 N 0.10 -0.03 -1.32 5.97 0.00 -0.61 0.39 121.76 126.27 1iux s ALA 190 Ca 0.02 -0.50 -0.06 0.00 0.00 0.00 0.00 51.96 51.42 1iux s ALA 190 Cb -0.13 0.18 0.10 0.00 0.00 0.00 0.00 23.12 23.27 1iux s ALA 190 CO 0.02 -0.24 2.45 -0.25 0.00 0.00 0.00 175.76 177.75 1iux n ASP 191 N 1.20 8.07 -4.29 0.00 8.00 -1.26 -0.82 116.55 127.45 1iux n ASP 191 Ca -0.21 -3.09 -0.21 0.00 0.71 0.00 0.00 54.79 51.99 1iux n ASP 191 Cb 0.57 -1.37 -0.11 0.00 -0.02 0.00 0.00 41.12 40.18 1iux n ASP 191 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 1iux s THR 192 N -0.90 1.63 0.27 -3.53 -4.23 -1.07 -4.85 115.64 102.96 1iux s THR 192 Ca 0.56 -1.80 -0.29 0.00 -1.18 0.00 0.00 61.69 58.97 1iux s THR 192 Cb 0.19 -1.70 -0.09 0.00 1.34 0.00 0.00 72.50 72.24 1iux s THR 192 CO -0.10 -0.32 1.16 -2.16 -0.54 0.00 0.00 174.62 172.66 1iux s PRO 193 N -2.65 4.55 0.57 3.99 0.04 -1.26 -2.77 135.00 137.48 1iux s PRO 193 Ca 0.12 1.90 -0.20 0.00 0.04 0.00 0.00 61.00 62.86 1iux s PRO 193 Cb -0.06 -3.18 -0.04 0.00 0.04 0.00 0.00 34.50 31.26 1iux s PRO 193 CO 0.05 0.07 1.23 -0.35 0.04 0.00 0.00 177.00 178.04 1iux n PRO 194 N 1.38 1.36 0.16 0.56 -0.04 -1.26 -4.61 135.00 132.56 1iux n PRO 194 Ca 0.00 0.51 0.13 0.00 -0.04 0.00 0.00 63.50 64.11 1iux n PRO 194 Cb 0.44 -2.43 0.51 0.00 -0.04 0.00 0.00 33.50 31.97 1iux n PRO 194 CO 0.00 0.00 0.00 -0.24 -0.04 0.00 0.00 175.50 175.22 1iux h VAL 195 N 1.03 0.00 -3.51 0.52 3.04 -1.90 -3.45 116.25 111.98 1iux h VAL 195 Ca -0.50 -0.37 -0.08 0.00 -1.01 0.00 0.00 66.70 64.74 1iux h VAL 195 Cb 1.33 1.22 -0.15 0.00 -2.01 0.00 0.00 31.29 31.68 1iux h VAL 195 CO 0.55 0.00 -0.25 -0.55 -1.01 0.00 0.00 177.57 176.31 1iux s SER 196 N -4.71 -0.06 0.01 3.17 0.15 -1.26 -4.96 113.70 106.04 1iux s SER 196 Ca 0.05 -0.39 0.27 0.00 0.70 0.00 0.00 55.95 56.57 1iux s SER 196 Cb 0.09 0.38 1.13 0.00 -1.71 0.00 0.00 66.02 65.91 1iux s SER 196 CO 0.47 -0.72 1.85 1.41 1.20 0.00 0.00 173.24 177.46 1iux n HIS 197 N 0.14 0.06 -4.22 3.44 -0.00 -1.26 -4.78 115.22 108.59 1iux n HIS 197 Ca -0.17 0.02 -0.13 0.00 -0.00 0.00 0.00 57.72 57.44 1iux n HIS 197 Cb 0.62 -0.53 -0.10 0.00 -0.00 0.00 0.00 29.99 29.98 1iux n HIS 197 CO 0.00 0.00 0.00 -1.21 -0.00 0.00 0.00 176.34 175.13 1iux s GLU 198 N -3.01 0.98 0.69 -0.41 2.02 -1.26 -5.02 118.70 112.69 1iux s GLU 198 Ca 0.13 -1.39 -0.15 0.00 0.02 0.00 0.00 54.97 53.57 1iux s GLU 198 Cb 0.17 -0.50 0.01 0.00 0.10 0.00 0.00 34.13 33.92 1iux s GLU 198 CO 0.49 0.05 1.15 -0.51 0.02 0.00 0.00 175.26 176.46 1iux s LEU 199 N -3.07 3.37 -0.17 1.80 1.02 -1.26 -4.87 118.68 115.50 1iux s LEU 199 Ca 0.14 2.15 -0.02 0.00 0.02 0.00 0.00 54.13 56.43 1iux s LEU 199 Cb 0.03 -4.57 0.05 0.00 0.02 0.00 0.00 46.19 41.72 1iux s LEU 199 CO -0.01 -1.89 0.02 -0.63 0.02 0.00 0.00 176.35 173.87 1iux s ILE 200 N -2.17 0.55 -0.10 -0.59 1.01 -0.96 -1.15 121.20 117.79 1iux s ILE 200 Ca 0.70 -0.44 -0.16 0.00 0.00 0.00 0.00 60.65 60.76 1iux s ILE 200 Cb -0.24 -0.96 -0.05 0.00 0.01 0.00 0.00 42.46 41.22 1iux s ILE 200 CO 0.42 -0.09 0.40 -0.31 0.00 0.00 0.00 174.94 175.37 1iux s TYR 201 N 1.86 3.56 -0.07 3.97 1.51 0.28 -1.57 117.35 126.90 1iux s TYR 201 Ca 0.00 0.83 0.02 0.00 -1.01 0.00 0.00 57.07 56.91 1iux s TYR 201 Cb -0.16 -2.41 0.02 0.00 -0.11 0.00 0.00 41.96 39.30 1iux s TYR 201 CO -0.07 0.33 -0.10 0.00 -1.11 0.00 0.00 175.55 174.59 1iux s ALA 202 N 0.07 1.18 -0.26 3.71 0.00 0.26 -0.14 121.76 126.58 1iux s ALA 202 Ca 0.23 -0.38 -0.11 0.00 0.00 0.00 0.00 51.96 51.70 1iux s ALA 202 Cb -0.15 -0.59 -0.05 0.00 0.00 0.00 0.00 23.12 22.33 1iux s ALA 202 CO 0.09 0.02 0.17 1.21 0.00 0.00 0.00 175.76 177.25 1iux s ASN 203 N 0.85 6.03 0.06 0.00 3.84 -0.07 -2.14 114.94 123.51 1iux s ASN 203 Ca -0.11 0.04 0.02 0.00 0.21 0.00 0.00 52.86 53.01 1iux s ASN 203 Cb -0.15 -2.11 -0.03 0.00 -0.55 0.00 0.00 41.25 38.41 1iux s ASN 203 CO 0.01 0.00 -0.07 -2.28 -2.79 0.00 0.00 177.10 171.97 1iux s HIS 204 N 1.44 0.73 0.49 0.43 2.46 -1.23 -4.29 115.29 115.33 1iux s HIS 204 Ca 0.07 -0.64 0.20 0.00 0.47 0.00 0.00 55.06 55.16 1iux s HIS 204 Cb -0.15 -0.43 1.24 0.00 -0.13 0.00 0.00 32.58 33.10 1iux s HIS 204 CO 0.08 -0.11 2.00 -1.35 -2.47 0.00 0.00 174.74 172.89 1iux h PRO 205 N 4.00 0.16 0.00 2.88 0.11 -1.97 -0.35 132.00 136.83 1iux h PRO 205 Ca -0.36 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.74 1iux h PRO 205 Cb 1.19 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.26 1iux h PRO 205 CO 0.49 0.11 0.00 0.54 -0.21 0.00 0.00 178.00 178.92 1iux n ARG 206 N -4.44 0.09 0.00 1.05 1.74 -1.26 -4.98 116.66 108.87 1iux n ARG 206 Ca 0.09 0.15 0.00 0.00 -0.77 0.00 0.00 57.85 57.32 1iux n ARG 206 Cb 0.46 -1.62 0.00 0.00 -1.02 0.00 0.00 32.46 30.28 1iux n ARG 206 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1iux n GLY 207 N 1.02 3.14 3.77 -0.13 0.00 -0.14 -5.00 105.19 107.84 1iux n GLY 207 Ca 0.05 -1.86 -0.37 0.00 0.00 0.00 0.00 46.02 43.85 1iux n GLY 207 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1iux s PHE 208 N -2.08 2.75 -0.00 1.61 5.36 -1.26 -3.49 117.98 120.87 1iux s PHE 208 Ca 0.00 1.52 -0.03 0.00 -0.96 0.00 0.00 56.93 57.46 1iux s PHE 208 Cb 0.00 -3.41 -0.00 0.00 -0.34 0.00 0.00 43.02 39.26 1iux s PHE 208 CO 0.00 -1.70 0.06 0.00 -1.46 0.00 0.00 175.22 172.12 1iux s ALA 209 N -1.56 -0.12 -0.03 11.12 0.00 -0.91 -0.33 121.76 129.93 1iux s ALA 209 Ca 0.67 -0.18 -0.01 0.00 0.00 0.00 0.00 51.96 52.44 1iux s ALA 209 Cb -0.29 0.05 0.03 0.00 0.00 0.00 0.00 23.12 22.91 1iux s ALA 209 CO 0.34 -0.13 0.06 -1.17 0.00 0.00 0.00 175.76 174.86 1iux s LEU 210 N -0.94 0.86 -0.39 0.00 2.96 -0.42 -0.57 118.68 120.19 1iux s LEU 210 Ca -0.10 0.10 -0.11 0.00 -0.22 0.00 0.00 54.13 53.80 1iux s LEU 210 Cb -0.06 0.01 0.04 0.00 0.50 0.00 0.00 46.19 46.68 1iux s LEU 210 CO 0.00 -0.15 0.22 0.00 -1.32 0.00 0.00 176.35 175.10 1iux n SER 212 N 4.98 1.92 -3.72 0.00 2.88 0.12 -2.27 113.62 117.54 1iux n SER 212 Ca -0.11 -0.97 -0.09 0.00 -1.33 0.00 0.00 58.87 56.36 1iux n SER 212 Cb 0.45 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 63.88 1iux n SER 212 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1iux s GLN 213 N -1.92 1.54 0.00 -1.46 -2.07 -1.26 -2.45 119.66 112.04 1iux s GLN 213 Ca 0.00 -0.83 0.00 0.00 -1.82 0.00 0.00 55.36 52.71 1iux s GLN 213 Cb 0.00 0.58 0.00 0.00 -1.09 0.00 0.00 33.01 32.50 1iux s GLN 213 CO 0.00 -0.68 0.00 0.54 -1.32 0.00 0.00 175.29 173.83 1iux n ARG 214 N -0.40 2.22 -1.69 9.60 5.12 0.44 -4.73 116.66 127.22 1iux n ARG 214 Ca -0.09 0.00 -0.00 0.00 -1.93 0.00 0.00 57.85 55.83 1iux n ARG 214 Cb 0.62 -0.86 0.00 0.00 -1.16 0.00 0.00 32.46 31.06 1iux n ARG 214 CO 0.00 0.00 0.00 -1.13 -1.93 0.00 0.00 177.63 174.57 1iux n SER 215 N -1.32 -0.17 0.27 0.55 3.41 -1.10 -4.71 113.62 110.57 1iux n SER 215 Ca 0.00 -1.09 0.18 0.00 -0.26 0.00 0.00 58.87 57.70 1iux n SER 215 Cb 0.17 0.27 0.77 0.00 -0.26 0.00 0.00 64.21 65.16 1iux n SER 215 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1iux h ALA 216 N 2.00 1.00 0.00 7.33 0.00 -1.96 -3.17 119.26 124.47 1iux h ALA 216 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1iux h ALA 216 Cb 0.12 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.91 1iux h ALA 216 CO 0.04 0.00 -0.11 0.25 0.00 0.00 0.00 179.25 179.43 1iux n THR 217 N -2.99 0.96 -3.88 0.00 -2.24 -1.26 -4.39 114.28 100.48 1iux n THR 217 Ca -0.00 -1.10 -0.19 0.00 -2.27 0.00 0.00 64.05 60.48 1iux n THR 217 Cb 0.24 0.30 -0.17 0.00 -2.10 0.00 0.00 70.33 68.61 1iux n THR 217 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 1iux s ARG 218 N -1.33 0.40 0.21 -0.78 3.52 -1.17 -2.60 118.95 117.19 1iux s ARG 218 Ca 0.12 0.10 0.09 0.00 -0.13 0.00 0.00 55.73 55.91 1iux s ARG 218 Cb 0.10 -0.66 -0.04 0.00 -1.56 0.00 0.00 34.95 32.79 1iux s ARG 218 CO 0.01 -0.20 -0.08 -1.12 -0.81 0.00 0.00 175.30 173.10 1iux s SER 219 N 1.42 4.28 -0.10 -2.12 0.01 0.00 -0.42 113.70 116.78 1iux s SER 219 Ca -0.04 -0.63 -0.02 0.00 1.31 0.00 0.00 55.95 56.57 1iux s SER 219 Cb -0.13 -0.72 0.03 0.00 0.21 0.00 0.00 66.02 65.41 1iux s SER 219 CO -0.03 0.07 0.01 -0.60 0.41 0.00 0.00 173.24 173.10 1iux s ARG 220 N -3.10 0.61 0.16 12.44 6.06 -1.02 -1.58 118.95 132.51 1iux s ARG 220 Ca 0.27 0.01 0.11 0.00 -2.50 0.00 0.00 55.73 53.62 1iux s ARG 220 Cb -0.08 -1.20 -0.04 0.00 0.06 0.00 0.00 34.95 33.69 1iux s ARG 220 CO 0.16 -0.37 -0.25 0.71 -2.50 0.00 0.00 175.30 173.05 1iux s TYR 221 N 1.96 2.32 0.02 5.12 2.02 -0.45 0.15 117.35 128.48 1iux s TYR 221 Ca 0.04 -0.37 0.00 0.00 -0.37 0.00 0.00 57.07 56.38 1iux s TYR 221 Cb -0.13 -1.21 -0.02 0.00 -0.40 0.00 0.00 41.96 40.20 1iux s TYR 221 CO -0.06 0.41 -0.03 0.71 -1.57 0.00 0.00 175.55 175.01 1iux s TYR 222 N -1.33 0.29 0.01 2.71 2.02 -0.43 -0.94 117.35 119.68 1iux s TYR 222 Ca 0.17 -0.48 0.01 0.00 -0.37 0.00 0.00 57.07 56.40 1iux s TYR 222 Cb -0.09 -0.20 -0.01 0.00 -0.40 0.00 0.00 41.96 41.26 1iux s TYR 222 CO 0.08 -0.16 -0.03 0.14 -1.57 0.00 0.00 175.55 174.00 1iux s VAL 223 N -1.33 0.23 0.22 0.71 -7.23 -0.37 -1.30 120.40 111.32 1iux s VAL 223 Ca -0.14 -0.45 -0.30 0.00 -1.81 0.00 0.00 61.98 59.28 1iux s VAL 223 Cb -0.09 -0.26 -0.08 0.00 0.56 0.00 0.00 36.38 36.50 1iux s VAL 223 CO -0.01 -0.15 1.12 -1.58 -0.31 0.00 0.00 175.10 174.17 1iux s GLN 224 N -0.63 4.60 0.02 4.82 0.74 0.55 -0.53 119.66 129.22 1iux s GLN 224 Ca -0.05 1.78 -0.02 0.00 0.05 0.00 0.00 55.36 57.12 1iux s GLN 224 Cb -0.05 -3.23 -0.02 0.00 1.10 0.00 0.00 33.01 30.81 1iux s GLN 224 CO -0.00 0.11 0.01 0.14 -0.55 0.00 0.00 175.29 175.00 1iux s VAL 225 N -0.60 0.11 0.84 1.34 -7.23 -0.23 -4.74 120.40 109.90 1iux s VAL 225 Ca 0.48 -0.94 -0.11 0.00 -1.81 0.00 0.00 61.98 59.60 1iux s VAL 225 Cb -0.31 -0.43 0.10 0.00 0.56 0.00 0.00 36.38 36.30 1iux s VAL 225 CO 0.38 -0.52 1.10 -2.16 -0.31 0.00 0.00 175.10 173.59 1iux s PRO 226 N -1.71 1.69 0.53 4.82 0.04 -1.26 -0.30 135.00 138.81 1iux s PRO 226 Ca -0.13 1.15 0.35 0.00 0.04 0.00 0.00 61.00 62.41 1iux s PRO 226 Cb -0.08 -1.83 1.65 0.00 0.04 0.00 0.00 34.50 34.28 1iux s PRO 226 CO -0.01 -2.04 2.05 -0.07 0.04 0.00 0.00 177.00 176.97 1iux h LEU 227 N -1.42 0.00 -0.02 -3.56 4.07 -1.89 -2.73 115.31 109.77 1iux h LEU 227 Ca -0.45 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.51 1iux h LEU 227 Cb 1.25 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.99 1iux h LEU 227 CO 0.50 0.00 0.00 -1.54 -1.08 0.00 0.00 178.44 176.32 1iux n SER 228 N -2.91 0.02 -4.77 -0.43 3.41 -1.26 -4.86 113.62 102.83 1iux n SER 228 Ca -0.01 0.50 -0.39 0.00 -0.26 0.00 0.00 58.87 58.72 1iux n SER 228 Cb 0.20 -0.51 -0.04 0.00 -0.26 0.00 0.00 64.21 63.60 1iux n SER 228 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 1iux s GLU 229 N -3.01 4.39 -0.09 4.33 0.41 -1.03 -5.04 118.70 118.66 1iux s GLU 229 Ca 0.09 1.76 0.02 0.00 -0.41 0.00 0.00 54.97 56.43 1iux s GLU 229 Cb 0.13 -2.92 -0.02 0.00 -1.78 0.00 0.00 34.13 29.54 1iux s GLU 229 CO 0.36 -0.00 -0.13 0.15 -0.49 0.00 0.00 175.26 175.14 1iux s LYS 230 N -1.90 2.91 0.59 1.61 1.02 -1.26 -5.01 119.74 117.70 1iux s LYS 230 Ca 0.51 -0.68 0.30 0.00 0.02 0.00 0.00 55.97 56.12 1iux s LYS 230 Cb -0.30 -2.51 1.85 0.00 -0.52 0.00 0.00 37.83 36.36 1iux s LYS 230 CO 0.38 0.45 2.26 -0.24 -0.92 0.00 0.00 175.35 177.28 1iux h VAL 231 N 4.79 0.50 0.00 3.17 3.04 -1.96 -1.72 116.25 124.06 1iux h VAL 231 Ca -0.38 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.31 1iux h VAL 231 Cb 1.18 1.00 0.00 0.00 -2.01 0.00 0.00 31.29 31.46 1iux h VAL 231 CO 0.53 0.00 0.00 -1.84 -1.01 0.00 0.00 177.57 175.25 1iux n GLU 232 N -3.81 0.18 -0.01 4.17 0.00 -1.26 -1.91 120.64 118.00 1iux n GLU 232 Ca -0.03 0.42 0.14 0.00 0.00 0.00 0.00 57.16 57.70 1iux n GLU 232 Cb 0.08 -1.85 0.65 0.00 0.00 0.00 0.00 31.44 30.31 1iux n GLU 232 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 1iux n ASP 233 N -2.20 0.99 -4.00 -1.84 8.00 -0.65 -4.65 116.55 112.20 1iux n ASP 233 Ca 0.02 -1.36 -0.31 0.00 0.71 0.00 0.00 54.79 53.85 1iux n ASP 233 Cb 0.22 -0.01 -0.14 0.00 -0.02 0.00 0.00 41.12 41.17 1iux n ASP 233 CO 0.00 0.00 0.00 0.26 -0.39 0.00 0.00 177.20 177.07 1iux s TRP 234 N -1.98 3.40 0.80 1.24 0.52 -0.80 -5.05 118.94 117.07 1iux s TRP 234 Ca 0.40 -3.03 -0.11 0.00 0.02 0.00 0.00 56.10 53.39 1iux s TRP 234 Cb 0.21 -2.93 0.07 0.00 -1.15 0.00 0.00 33.47 29.67 1iux s TRP 234 CO 0.33 -0.83 1.09 -1.54 0.02 0.00 0.00 176.95 176.03 1iux s SER 235 N 0.29 4.27 0.22 2.95 1.04 -1.26 -4.83 113.70 116.39 1iux s SER 235 Ca 0.15 1.77 -0.08 0.00 0.48 0.00 0.00 55.95 58.28 1iux s SER 235 Cb -0.23 -2.46 0.30 0.00 0.10 0.00 0.00 66.02 63.73 1iux s SER 235 CO -0.03 -2.17 1.80 0.44 0.98 0.00 0.00 173.24 174.26 1iux h ASP 236 N -1.23 0.55 -0.59 7.02 3.32 -1.98 -1.75 116.42 121.76 1iux h ASP 236 Ca -0.45 0.04 -0.06 0.00 0.02 0.00 0.00 57.03 56.59 1iux h ASP 236 Cb 1.24 -0.06 -0.03 0.00 0.22 0.00 0.00 39.33 40.70 1iux h ASP 236 CO 0.52 0.33 0.15 1.05 -1.72 0.00 0.00 179.24 179.57 1iux h GLU 237 N 0.68 0.98 -0.75 3.56 4.11 -1.95 -1.79 114.58 119.43 1iux h GLU 237 Ca 0.33 -0.22 -0.04 0.00 0.07 0.00 0.00 59.36 59.51 1iux h GLU 237 Cb 0.27 -0.14 -0.03 0.00 0.50 0.00 0.00 28.75 29.35 1iux h GLU 237 CO -0.22 0.88 0.33 -0.09 0.07 0.00 0.00 179.01 179.97 1iux h ARG 238 N 0.94 1.10 -0.15 1.06 2.43 -1.73 -2.16 114.38 115.86 1iux h ARG 238 Ca 0.20 -0.18 -0.01 0.00 -0.81 0.00 0.00 59.98 59.18 1iux h ARG 238 Cb 0.34 -0.19 -0.01 0.00 -0.42 0.00 0.00 29.97 29.69 1iux h ARG 238 CO 0.00 0.88 0.07 0.35 -1.51 0.00 0.00 179.97 179.76 1iux h PHE 239 N 1.07 0.22 -0.86 2.20 3.04 -0.73 -1.51 116.94 120.37 1iux h PHE 239 Ca 0.25 -0.01 -0.02 0.00 3.98 0.00 0.00 57.97 62.17 1iux h PHE 239 Cb 0.17 -0.07 -0.04 0.00 2.56 0.00 0.00 35.95 38.57 1iux h PHE 239 CO 0.01 0.25 0.46 -1.49 -2.02 0.00 0.00 178.31 175.53 1iux h TRP 240 N 0.12 1.18 -0.53 0.41 -0.00 -1.21 0.25 115.95 116.17 1iux h TRP 240 Ca 0.05 -0.03 -0.04 0.00 -0.00 0.00 0.00 58.89 58.87 1iux h TRP 240 Cb 0.12 -0.38 -0.02 0.00 -0.00 0.00 0.00 29.16 28.88 1iux h TRP 240 CO -0.03 0.82 0.18 1.15 -0.00 0.00 0.00 178.44 180.56 1iux h THR 241 N 1.20 1.23 -0.25 1.49 2.02 -1.28 -0.56 112.91 116.75 1iux h THR 241 Ca 0.30 -0.76 -0.09 0.00 0.77 0.00 0.00 66.41 66.63 1iux h THR 241 Cb 0.04 0.73 -0.01 0.00 -1.74 0.00 0.00 68.15 67.17 1iux h THR 241 CO -0.05 0.28 -0.19 -0.08 0.37 0.00 0.00 175.52 175.86 1iux h GLU 242 N 0.73 0.57 -0.09 6.66 4.57 -0.73 -2.08 114.58 124.20 1iux h GLU 242 Ca 0.17 -0.28 0.03 0.00 -1.18 0.00 0.00 59.36 58.10 1iux h GLU 242 Cb 0.26 -0.00 -0.03 0.00 -0.16 0.00 0.00 28.75 28.82 1iux h GLU 242 CO -0.01 0.86 -0.08 1.25 -1.18 0.00 0.00 179.01 179.85 1iux h LEU 243 N 0.29 -0.26 -1.46 1.64 6.46 -0.36 -2.14 115.31 119.47 1iux h LEU 243 Ca 0.05 0.05 0.00 0.00 -0.12 0.00 0.00 57.88 57.87 1iux h LEU 243 Cb 0.72 0.13 -0.03 0.00 -0.73 0.00 0.00 40.66 40.76 1iux h LEU 243 CO 0.05 -0.12 0.35 0.11 -0.62 0.00 0.00 178.44 178.21 1iux h LYS 244 N -0.10 0.71 0.00 1.25 1.57 -1.06 -1.11 116.57 117.83 1iux h LYS 244 Ca 0.07 -0.05 -0.02 0.00 -1.87 0.00 0.00 60.65 58.78 1iux h LYS 244 Cb 0.20 -0.16 -0.00 0.00 0.08 0.00 0.00 32.23 32.35 1iux h LYS 244 CO -0.16 0.48 -0.11 0.00 -0.57 0.00 0.00 179.45 179.09 1iux h ALA 245 N 1.66 1.10 0.00 3.86 0.00 -0.72 -2.96 119.26 122.20 1iux h ALA 245 Ca 0.20 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1iux h ALA 245 Cb -0.07 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.70 1iux h ALA 245 CO -0.04 0.14 -0.79 0.54 0.00 0.00 0.00 179.25 179.10 1iux n ARG 246 N -3.36 0.02 -3.61 0.00 1.74 -0.44 -4.97 116.66 106.03 1iux n ARG 246 Ca -0.01 -0.00 -0.23 0.00 -0.77 0.00 0.00 57.85 56.84 1iux n ARG 246 Cb 0.30 -1.50 -0.02 0.00 -1.02 0.00 0.00 32.46 30.22 1iux n ARG 246 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1iux s LEU 247 N -3.05 4.14 0.50 0.55 1.43 -1.06 -4.75 118.68 116.44 1iux s LEU 247 Ca 0.09 0.31 -0.23 0.00 -1.03 0.00 0.00 54.13 53.27 1iux s LEU 247 Cb 0.17 -3.14 -0.06 0.00 0.03 0.00 0.00 46.19 43.18 1iux s LEU 247 CO 0.79 -0.20 1.34 -2.84 0.23 0.00 0.00 176.35 175.67 1iux s PRO 248 N -4.13 3.44 0.25 1.29 0.02 -1.26 -4.72 135.00 129.87 1iux s PRO 248 Ca 0.38 2.20 -0.05 0.00 0.02 0.00 0.00 61.00 63.54 1iux s PRO 248 Cb -0.09 -2.42 0.46 0.00 0.02 0.00 0.00 34.50 32.47 1iux s PRO 248 CO 0.33 -0.94 1.67 0.66 -0.33 0.00 0.00 177.00 178.39 1iux h SER 249 N 1.87 -0.07 0.39 2.53 4.64 -1.97 -0.00 113.55 120.94 1iux h SER 249 Ca -0.50 0.16 -0.01 0.00 -0.47 0.00 0.00 61.79 60.96 1iux h SER 249 Cb 1.28 0.23 -0.00 0.00 -0.31 0.00 0.00 62.40 63.60 1iux h SER 249 CO 0.59 -0.08 -0.05 1.05 -0.87 0.00 0.00 176.83 177.47 1iux h GLU 250 N 0.22 0.00 0.09 4.77 9.09 -2.00 -1.61 114.58 125.15 1iux h GLU 250 Ca 0.42 0.00 -0.25 0.00 0.05 0.00 0.00 59.36 59.58 1iux h GLU 250 Cb 0.73 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 27.82 1iux h GLU 250 CO -0.55 0.05 -1.30 0.28 0.05 0.00 0.00 179.01 177.54 1iux h VAL 251 N 0.00 1.07 0.00 -1.06 2.07 -1.40 -3.35 116.25 113.58 1iux h VAL 251 Ca -0.00 -2.37 -0.03 0.00 0.82 0.00 0.00 66.70 65.12 1iux h VAL 251 Cb 0.26 2.70 -0.00 0.00 -1.52 0.00 0.00 31.29 32.73 1iux h VAL 251 CO 0.01 0.65 -0.13 0.00 0.02 0.00 0.00 177.57 178.12 1iux h ALA 252 N -0.09 1.52 -0.32 1.67 0.00 -1.09 -2.85 119.26 118.10 1iux h ALA 252 Ca -0.29 -0.12 -0.08 0.00 0.00 0.00 0.00 54.91 54.42 1iux h ALA 252 Cb 1.66 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 19.41 1iux h ALA 252 CO 0.02 0.16 -0.14 1.49 0.00 0.00 0.00 179.25 180.79 1iux h GLU 253 N 0.00 0.55 -0.50 0.00 4.81 -1.43 -3.14 114.58 114.87 1iux h GLU 253 Ca -0.00 -0.17 0.00 0.00 -0.13 0.00 0.00 59.36 59.06 1iux h GLU 253 Cb 0.28 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 29.61 1iux h GLU 253 CO 0.02 0.68 0.00 0.36 -0.73 0.00 0.00 179.01 179.34 1iux n LYS 254 N -4.18 3.30 -2.42 1.92 2.85 -1.08 -4.98 118.16 113.56 1iux n LYS 254 Ca 0.01 -2.65 -0.42 0.00 -1.05 0.00 0.00 58.31 54.19 1iux n LYS 254 Cb 0.34 -1.70 -0.03 0.00 -0.65 0.00 0.00 35.03 33.00 1iux n LYS 254 CO 0.00 0.00 0.00 -1.17 -0.05 0.00 0.00 177.40 176.18 1iux s LEU 255 N -1.75 4.27 -0.30 -5.58 1.98 -1.17 -4.90 118.68 111.22 1iux s LEU 255 Ca 0.42 1.84 -0.16 0.00 -2.89 0.00 0.00 54.13 53.34 1iux s LEU 255 Cb 0.27 -3.56 -0.02 0.00 0.66 0.00 0.00 46.19 43.54 1iux s LEU 255 CO 0.20 -0.63 0.40 -0.69 -1.89 0.00 0.00 176.35 173.75 1iux s VAL 256 N 2.41 5.14 0.45 1.68 1.01 -1.26 -5.07 120.40 124.76 1iux s VAL 256 Ca 0.57 0.42 0.05 0.00 0.00 0.00 0.00 61.98 63.02 1iux s VAL 256 Cb -0.25 -3.78 0.01 0.00 0.00 0.00 0.00 36.38 32.36 1iux s VAL 256 CO 0.22 0.03 0.62 0.42 0.00 0.00 0.00 175.10 176.39 1iux s THR 257 N 2.12 3.08 -0.04 3.92 -4.23 -1.26 -4.75 115.64 114.48 1iux s THR 257 Ca 0.15 -0.87 -0.30 0.00 -1.18 0.00 0.00 61.69 59.49 1iux s THR 257 Cb -0.16 -3.07 0.12 0.00 1.34 0.00 0.00 72.50 70.72 1iux s THR 257 CO 0.11 -0.04 1.33 -0.83 -0.54 0.00 0.00 174.62 174.65 1iux s GLY 258 N -4.35 -0.31 0.54 3.99 0.00 -1.26 -4.97 107.32 100.96 1iux s GLY 258 Ca 0.54 0.46 -0.21 0.00 0.00 0.00 0.00 44.72 45.51 1iux s GLY 258 CO 0.35 2.85 1.26 -4.14 0.00 0.00 0.00 173.10 173.42 1iux s PRO 259 N -2.15 3.23 0.22 2.90 0.02 -1.26 -4.97 135.00 132.99 1iux s PRO 259 Ca 0.22 1.98 -0.29 0.00 0.02 0.00 0.00 61.00 62.93 1iux s PRO 259 Cb 0.03 -2.18 -0.09 0.00 0.02 0.00 0.00 34.50 32.28 1iux s PRO 259 CO -0.03 -1.04 0.92 -1.54 -0.33 0.00 0.00 177.00 174.98 1iux s SER 260 N -1.27 7.60 0.02 2.53 1.04 -1.26 -4.41 113.70 117.95 1iux s SER 260 Ca 0.72 1.89 0.17 0.00 0.48 0.00 0.00 55.95 59.21 1iux s SER 260 Cb -0.34 -2.59 -0.17 0.00 0.10 0.00 0.00 66.02 63.02 1iux s SER 260 CO 0.39 0.14 0.72 0.18 0.98 0.00 0.00 173.24 175.66 1iux n LEU 261 N 1.64 0.74 -3.62 2.42 4.77 0.16 -4.94 117.00 118.17 1iux n LEU 261 Ca -0.02 0.33 -0.13 0.00 -0.03 0.00 0.00 56.01 56.16 1iux n LEU 261 Cb 0.47 0.12 -0.07 0.00 -2.33 0.00 0.00 43.42 41.61 1iux n LEU 261 CO 0.50 0.19 0.49 -0.70 -1.33 0.00 0.00 177.39 176.54 1iux s GLU 262 N -2.88 0.78 -0.00 3.23 -6.30 -1.19 -4.98 118.70 107.35 1iux s GLU 262 Ca -0.04 0.85 0.00 0.00 -2.50 0.00 0.00 54.97 53.28 1iux s GLU 262 Cb 0.09 0.38 0.00 0.00 0.00 0.00 0.00 34.13 34.60 1iux s GLU 262 CO 0.82 -0.11 -0.00 0.15 0.02 0.00 0.00 175.26 176.14 1iux s LYS 263 N 0.20 0.05 -0.03 4.30 1.02 -1.26 -0.70 119.74 123.33 1iux s LYS 263 Ca -0.00 0.01 -0.29 0.00 0.02 0.00 0.00 55.97 55.71 1iux s LYS 263 Cb -0.05 -0.10 0.10 0.00 -0.52 0.00 0.00 37.83 37.27 1iux s LYS 263 CO 0.00 -0.02 0.87 -1.54 -0.92 0.00 0.00 175.35 173.75 1iux s SER 264 N 0.17 -0.41 -0.17 2.83 1.04 -0.95 -5.00 113.70 111.22 1iux s SER 264 Ca -0.01 0.16 -0.03 0.00 0.48 0.00 0.00 55.95 56.54 1iux s SER 264 Cb -0.03 0.39 -0.02 0.00 0.10 0.00 0.00 66.02 66.47 1iux s SER 264 CO -0.00 -0.58 -0.06 -0.63 0.98 0.00 0.00 173.24 172.95 1iux s ILE 265 N -2.53 3.54 -0.21 -1.02 1.01 -1.26 -0.69 121.20 120.04 1iux s ILE 265 Ca 0.02 -0.47 -0.03 0.00 0.00 0.00 0.00 60.65 60.17 1iux s ILE 265 Cb -0.01 -2.56 -0.00 0.00 0.01 0.00 0.00 42.46 39.90 1iux s ILE 265 CO -0.05 0.47 -0.06 0.00 0.00 0.00 0.00 174.94 175.30 1iux s ALA 266 N 0.73 2.75 0.38 9.38 0.00 0.56 -4.92 121.76 130.64 1iux s ALA 266 Ca -0.03 -1.17 -0.24 0.00 0.00 0.00 0.00 51.96 50.52 1iux s ALA 266 Cb -0.15 -1.63 -0.09 0.00 0.00 0.00 0.00 23.12 21.25 1iux s ALA 266 CO 0.02 -0.41 1.01 -1.25 0.00 0.00 0.00 175.76 175.13 1iux s PRO 267 N 1.44 4.28 -0.00 0.00 0.04 -1.26 0.23 135.00 139.72 1iux s PRO 267 Ca 0.05 1.42 -0.19 0.00 0.04 0.00 0.00 61.00 62.33 1iux s PRO 267 Cb -0.14 -2.56 -0.06 0.00 0.04 0.00 0.00 34.50 31.78 1iux s PRO 267 CO -0.04 -0.02 0.53 -0.51 0.04 0.00 0.00 177.00 176.99 1iux s LEU 268 N -2.56 4.43 0.01 -3.56 1.02 -1.08 -4.90 118.68 112.04 1iux s LEU 268 Ca 0.56 1.08 -0.22 0.00 0.02 0.00 0.00 54.13 55.57 1iux s LEU 268 Cb -0.20 -2.80 0.05 0.00 0.02 0.00 0.00 46.19 43.26 1iux s LEU 268 CO 0.25 0.18 0.50 -0.60 0.02 0.00 0.00 176.35 176.69 1iux s ARG 269 N -0.47 0.95 -0.03 1.70 3.52 -1.26 -2.09 118.95 121.26 1iux s ARG 269 Ca 0.28 -0.12 0.07 0.00 -0.13 0.00 0.00 55.73 55.82 1iux s ARG 269 Cb -0.18 0.43 -0.01 0.00 -1.56 0.00 0.00 34.95 33.63 1iux s ARG 269 CO 0.16 -0.31 -0.24 -1.12 -0.81 0.00 0.00 175.30 172.97 1iux s SER 270 N -1.65 2.89 -0.27 -2.12 0.01 0.56 -2.21 113.70 110.91 1iux s SER 270 Ca -0.08 -0.46 -0.19 0.00 1.31 0.00 0.00 55.95 56.53 1iux s SER 270 Cb -0.01 -0.51 0.07 0.00 0.21 0.00 0.00 66.02 65.77 1iux s SER 270 CO 0.02 0.27 0.68 0.12 0.41 0.00 0.00 173.24 174.74 1iux s PHE 271 N -0.39 -0.92 -0.05 2.43 2.19 -0.25 -1.23 117.98 119.76 1iux s PHE 271 Ca 0.04 1.98 -0.06 0.00 0.33 0.00 0.00 56.93 59.22 1iux s PHE 271 Cb -0.11 0.47 0.01 0.00 -1.31 0.00 0.00 43.02 42.08 1iux s PHE 271 CO 0.01 -0.45 0.17 0.08 1.83 0.00 0.00 175.22 176.85 1iux s VAL 272 N 1.11 0.02 0.02 3.12 1.01 -0.15 -0.72 120.40 124.80 1iux s VAL 272 Ca -0.06 -0.13 0.08 0.00 0.00 0.00 0.00 61.98 61.86 1iux s VAL 272 Cb -0.05 -0.28 -0.02 0.00 0.00 0.00 0.00 36.38 36.02 1iux s VAL 272 CO -0.11 -0.07 -0.23 0.68 0.00 0.00 0.00 175.10 175.37 1iux s VAL 273 N -0.20 1.82 -0.05 2.92 -7.23 -1.10 -1.00 120.40 115.57 1iux s VAL 273 Ca -0.03 -1.13 0.01 0.00 -1.81 0.00 0.00 61.98 59.02 1iux s VAL 273 Cb -0.02 -1.55 0.02 0.00 0.56 0.00 0.00 36.38 35.39 1iux s VAL 273 CO 0.01 0.38 -0.04 -1.61 -0.31 0.00 0.00 175.10 173.53 1iux s GLU 274 N -0.89 0.84 0.24 4.82 2.02 -0.26 -4.41 118.70 121.07 1iux s GLU 274 Ca 0.09 -0.08 -0.04 0.00 0.02 0.00 0.00 54.97 54.96 1iux s GLU 274 Cb -0.09 -0.91 0.06 0.00 0.10 0.00 0.00 34.13 33.28 1iux s GLU 274 CO 0.01 -0.13 0.32 -0.35 0.02 0.00 0.00 175.26 175.13 1iux n PRO 275 N 4.29 -0.40 -0.47 0.39 -0.04 -1.26 -0.77 135.00 136.74 1iux n PRO 275 Ca -0.21 -0.50 0.05 0.00 -0.04 0.00 0.00 63.50 62.80 1iux n PRO 275 Cb 0.51 -0.34 0.20 0.00 -0.04 0.00 0.00 33.50 33.83 1iux n PRO 275 CO 0.00 0.00 0.00 -1.33 -0.04 0.00 0.00 175.50 174.13 1iux n MET 276 N -1.73 1.92 -3.61 0.54 2.81 -1.26 -4.90 117.12 110.89 1iux n MET 276 Ca 0.04 -2.95 -0.12 0.00 -1.81 0.00 0.00 57.70 52.85 1iux n MET 276 Cb 0.14 -1.70 -0.05 0.00 -0.71 0.00 0.00 33.22 30.90 1iux n MET 276 CO 0.00 0.00 0.00 1.14 1.51 0.00 0.00 175.97 178.62 1iux s GLN 277 N -3.04 1.03 -0.24 0.03 -2.07 -1.26 -0.56 119.66 113.55 1iux s GLN 277 Ca 0.39 -0.44 -0.04 0.00 -1.82 0.00 0.00 55.36 53.45 1iux s GLN 277 Cb 0.35 0.46 0.13 0.00 -1.09 0.00 0.00 33.01 32.86 1iux s GLN 277 CO 0.02 -0.38 0.43 -1.58 -1.32 0.00 0.00 175.29 172.45 1iux s HIS 278 N -2.99 -0.95 0.00 9.60 2.46 0.05 -5.00 115.29 118.46 1iux s HIS 278 Ca -0.02 1.20 0.00 0.00 0.47 0.00 0.00 55.06 56.71 1iux s HIS 278 Cb 0.00 0.20 0.00 0.00 -0.13 0.00 0.00 32.58 32.66 1iux s HIS 278 CO -0.06 -0.68 0.00 0.41 -2.47 0.00 0.00 174.74 171.94 1iux n GLY 279 N 5.38 4.26 0.94 1.59 0.00 -1.26 -1.04 105.19 115.06 1iux n GLY 279 Ca -0.05 0.11 0.09 0.00 0.00 0.00 0.00 46.02 46.18 1iux n GLY 279 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1iux n ARG 280 N 13.91 2.19 -4.04 1.61 5.12 0.05 -4.87 116.66 130.63 1iux n ARG 280 Ca 0.00 -1.84 -0.35 0.00 -1.93 0.00 0.00 57.85 53.73 1iux n ARG 280 Cb 0.00 -1.43 -0.10 0.00 -1.16 0.00 0.00 32.46 29.78 1iux n ARG 280 CO 0.00 0.00 0.00 -1.17 -1.93 0.00 0.00 177.63 174.53 1iux s LEU 281 N -1.17 3.81 -0.09 0.55 2.96 -0.21 -0.97 118.68 123.56 1iux s LEU 281 Ca 0.36 0.10 0.02 0.00 -0.22 0.00 0.00 54.13 54.38 1iux s LEU 281 Cb 0.19 -1.95 0.01 0.00 0.50 0.00 0.00 46.19 44.94 1iux s LEU 281 CO 0.26 0.20 -0.13 -0.36 -1.32 0.00 0.00 176.35 174.99 1iux s PHE 282 N 0.20 1.72 0.13 5.38 0.40 -0.57 -0.77 117.98 124.47 1iux s PHE 282 Ca 0.04 -0.74 -0.12 0.00 -0.60 0.00 0.00 56.93 55.51 1iux s PHE 282 Cb -0.12 -1.26 -0.06 0.00 0.51 0.00 0.00 43.02 42.08 1iux s PHE 282 CO 0.01 -0.39 0.49 -0.51 0.70 0.00 0.00 175.22 175.52 1iux s LEU 283 N 0.89 4.33 0.01 -0.37 1.43 0.28 -0.19 118.68 125.05 1iux s LEU 283 Ca -0.10 0.95 -0.07 0.00 -1.03 0.00 0.00 54.13 53.88 1iux s LEU 283 Cb -0.15 -3.20 0.00 0.00 0.03 0.00 0.00 46.19 42.87 1iux s LEU 283 CO 0.01 0.11 0.14 0.00 0.23 0.00 0.00 176.35 176.84 1iux s ALA 284 N -1.48 -0.32 0.00 4.21 0.00 -0.71 -4.85 121.76 118.61 1iux s ALA 284 Ca 0.37 -0.16 0.00 0.00 0.00 0.00 0.00 51.96 52.17 1iux s ALA 284 Cb -0.14 0.13 0.00 0.00 0.00 0.00 0.00 23.12 23.10 1iux s ALA 284 CO 0.19 -0.22 0.00 0.41 0.00 0.00 0.00 175.76 176.14 1iux n GLY 285 N 1.38 0.88 0.14 0.00 0.00 -1.26 -3.18 105.19 103.15 1iux n GLY 285 Ca -0.22 -0.74 0.09 0.00 0.00 0.00 0.00 46.02 45.14 1iux n GLY 285 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1iux n ASP 286 N -0.60 0.45 0.17 1.61 9.92 -1.25 -1.06 116.55 125.79 1iux n ASP 286 Ca 0.00 0.69 0.03 0.00 -0.53 0.00 0.00 54.79 54.98 1iux n ASP 286 Cb 0.00 -0.74 0.29 0.00 -0.64 0.00 0.00 41.12 40.04 1iux n ASP 286 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1iux h ALA 287 N 1.87 1.04 0.00 2.24 0.00 -1.61 -2.93 119.26 119.87 1iux h ALA 287 Ca 0.00 -0.41 -0.10 0.00 0.00 0.00 0.00 54.91 54.41 1iux h ALA 287 Cb 0.09 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 1iux h ALA 287 CO 0.00 0.56 -1.84 0.00 0.00 0.00 0.00 179.25 177.97 1iux n ALA 288 N -2.36 2.26 -3.54 0.00 0.00 -0.23 -4.73 120.51 111.91 1iux n ALA 288 Ca -0.01 -0.60 -0.16 0.00 0.00 0.00 0.00 53.44 52.67 1iux n ALA 288 Cb 0.53 -0.38 -0.06 0.00 0.00 0.00 0.00 19.45 19.53 1iux n ALA 288 CO 0.00 0.00 0.00 -3.38 0.00 0.00 0.00 177.50 174.12 1iux s HIS 289 N -2.86 -0.60 -0.02 0.00 0.00 -0.99 -2.71 115.29 108.11 1iux s HIS 289 Ca -0.06 1.07 0.05 0.00 -3.00 0.00 0.00 55.06 53.11 1iux s HIS 289 Cb 0.08 0.41 -0.01 0.00 -4.00 0.00 0.00 32.58 29.06 1iux s HIS 289 CO 0.65 -0.53 -0.16 0.42 -1.00 0.00 0.00 174.74 174.12 1iux s ILE 290 N -1.05 1.32 0.07 -5.38 -1.09 0.10 -3.96 121.20 111.21 1iux s ILE 290 Ca -0.08 -0.70 0.08 0.00 -2.23 0.00 0.00 60.65 57.72 1iux s ILE 290 Cb -0.00 -1.11 -0.03 0.00 -1.58 0.00 0.00 42.46 39.73 1iux s ILE 290 CO 0.07 0.38 -0.20 0.68 -1.23 0.00 0.00 174.94 174.64 1iux s VAL 291 N -0.25 1.66 0.65 2.92 -7.23 -1.25 -1.09 120.40 115.81 1iux s VAL 291 Ca 0.03 -1.37 -0.17 0.00 -1.81 0.00 0.00 61.98 58.67 1iux s VAL 291 Cb -0.08 -1.48 -0.00 0.00 0.56 0.00 0.00 36.38 35.38 1iux s VAL 291 CO 0.00 0.06 1.22 -2.16 -0.31 0.00 0.00 175.10 173.90 1iux s PRO 292 N -1.55 2.61 0.61 4.82 0.04 -0.94 -4.77 135.00 135.83 1iux s PRO 292 Ca 0.07 1.81 0.34 0.00 0.04 0.00 0.00 61.00 63.26 1iux s PRO 292 Cb -0.09 -1.88 2.00 0.00 0.04 0.00 0.00 34.50 34.56 1iux s PRO 292 CO 0.03 -1.48 2.29 -1.35 0.04 0.00 0.00 177.00 176.52 1iux h PRO 293 N 0.38 0.00 -1.23 0.56 0.11 -1.94 -3.31 132.00 126.57 1iux h PRO 293 Ca -0.49 0.00 0.36 0.00 0.11 0.00 0.00 66.00 65.98 1iux h PRO 293 Cb 1.30 0.00 -0.10 0.00 0.11 0.00 0.00 31.00 32.31 1iux h PRO 293 CO 0.53 0.00 0.81 1.15 -0.21 0.00 0.00 178.00 180.28 1iux h THR 294 N 0.00 0.31 -0.01 -1.15 2.02 -1.90 -0.11 112.91 112.07 1iux h THR 294 Ca -0.00 -0.06 0.00 0.00 0.77 0.00 0.00 66.41 67.12 1iux h THR 294 Cb 0.01 0.10 0.00 0.00 -1.74 0.00 0.00 68.15 66.53 1iux h THR 294 CO 0.00 0.03 -0.29 0.61 0.37 0.00 0.00 175.52 176.25 1iux n GLY 295 N -1.55 -0.49 3.66 2.16 0.00 -1.25 -4.91 105.19 102.81 1iux n GLY 295 Ca 0.31 -0.44 -0.24 0.00 0.00 0.00 0.00 46.02 45.65 1iux n GLY 295 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1iux n ALA 296 N -0.52 -1.55 0.13 4.61 0.00 -0.05 -4.92 120.51 118.20 1iux n ALA 296 Ca 0.12 0.17 0.05 0.00 0.00 0.00 0.00 53.44 53.78 1iux n ALA 296 Cb 0.37 -4.10 -0.07 0.00 0.00 0.00 0.00 19.45 15.65 1iux n ALA 296 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1iux n LYS 297 N -4.64 1.28 0.11 0.00 4.76 -1.26 -4.65 118.16 113.74 1iux n LYS 297 Ca -0.09 -0.07 -0.09 0.00 -2.87 0.00 0.00 58.31 55.20 1iux n LYS 297 Cb 0.59 -1.17 -0.05 0.00 -1.84 0.00 0.00 35.03 32.56 1iux n LYS 297 CO 0.00 0.00 0.00 0.78 -1.37 0.00 0.00 177.40 176.81 1iux h GLY 298 N 2.02 -1.08 1.81 0.72 0.00 -1.88 0.18 103.07 104.85 1iux h GLY 298 Ca 0.00 0.51 -0.04 0.00 0.00 0.00 0.00 47.33 47.80 1iux h GLY 298 CO 0.00 -0.34 -0.10 -2.00 0.00 0.00 0.00 176.54 174.10 1iux h LEU 299 N -0.45 0.22 -0.96 3.11 5.85 -1.94 -2.57 115.31 118.58 1iux h LEU 299 Ca -0.02 -0.04 -0.10 0.00 0.84 0.00 0.00 57.88 58.56 1iux h LEU 299 Cb 0.41 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.37 1iux h LEU 299 CO -0.08 0.35 -0.37 0.78 -0.34 0.00 0.00 178.44 178.78 1iux h ASN 300 N 0.23 0.30 0.62 1.25 2.35 -1.74 -1.89 115.58 116.70 1iux h ASN 300 Ca 0.05 -0.12 -0.17 0.00 -0.55 0.00 0.00 56.30 55.51 1iux h ASN 300 Cb 0.32 -0.08 -0.02 0.00 0.05 0.00 0.00 38.32 38.59 1iux h ASN 300 CO 0.02 0.65 -0.79 -0.07 -1.65 0.00 0.00 177.43 175.59 1iux h LEU 301 N 0.25 0.16 -0.74 1.61 3.38 -0.34 -2.96 115.31 116.67 1iux h LEU 301 Ca 0.03 -0.12 -0.02 0.00 0.09 0.00 0.00 57.88 57.86 1iux h LEU 301 Cb 0.77 -0.05 -0.03 0.00 0.09 0.00 0.00 40.66 41.44 1iux h LEU 301 CO 0.06 0.88 0.38 0.00 0.09 0.00 0.00 178.44 179.85 1iux h ALA 302 N 1.11 0.94 -0.58 1.53 0.00 -1.06 -1.78 119.26 119.43 1iux h ALA 302 Ca -0.02 -0.13 0.02 0.00 0.00 0.00 0.00 54.91 54.77 1iux h ALA 302 Cb 1.38 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 18.85 1iux h ALA 302 CO 0.11 0.48 0.36 0.00 0.00 0.00 0.00 179.25 180.21 1iux h ALA 303 N 1.19 0.74 -0.18 0.00 0.00 -1.24 -0.14 119.26 119.63 1iux h ALA 303 Ca 0.26 -0.02 -0.11 0.00 0.00 0.00 0.00 54.91 55.04 1iux h ALA 303 Cb 0.08 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 1iux h ALA 303 CO -0.04 0.11 -0.35 0.66 0.00 0.00 0.00 179.25 179.63 1iux h SER 304 N 0.73 0.39 -0.37 0.00 4.64 -1.30 0.28 113.55 117.91 1iux h SER 304 Ca 0.22 -0.15 -0.02 0.00 -0.47 0.00 0.00 61.79 61.37 1iux h SER 304 Cb -0.02 -0.11 -0.02 0.00 -0.31 0.00 0.00 62.40 61.95 1iux h SER 304 CO -0.08 0.72 0.17 0.44 -0.87 0.00 0.00 176.83 177.21 1iux h ASP 305 N 0.33 0.50 -0.28 4.97 3.32 -0.84 -0.20 116.42 124.21 1iux h ASP 305 Ca 0.04 -0.15 -0.01 0.00 0.02 0.00 0.00 57.03 56.93 1iux h ASP 305 Cb 0.78 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 40.18 1iux h ASP 305 CO 0.06 0.51 0.13 0.58 -1.72 0.00 0.00 179.24 178.80 1iux h VAL 306 N 0.46 1.16 -0.65 -1.35 2.07 -0.68 0.22 116.25 117.48 1iux h VAL 306 Ca 0.13 -0.47 0.03 0.00 0.82 0.00 0.00 66.70 67.20 1iux h VAL 306 Cb 0.15 0.95 -0.04 0.00 -1.52 0.00 0.00 31.29 30.83 1iux h VAL 306 CO -0.01 0.17 0.40 -1.28 0.02 0.00 0.00 177.57 176.86 1iux h SER 307 N 0.32 0.64 -0.34 0.57 0.87 -0.22 -0.36 113.55 115.04 1iux h SER 307 Ca 0.10 0.00 -0.06 0.00 -1.23 0.00 0.00 61.79 60.60 1iux h SER 307 Cb 0.14 -0.13 -0.01 0.00 -0.44 0.00 0.00 62.40 61.96 1iux h SER 307 CO -0.01 0.45 -0.01 0.74 -0.53 0.00 0.00 176.83 177.46 1iux h THR 308 N 0.78 1.26 -0.31 2.23 2.02 -0.67 -2.11 112.91 116.11 1iux h THR 308 Ca 0.26 -1.00 -0.03 0.00 0.77 0.00 0.00 66.41 66.41 1iux h THR 308 Cb 0.03 1.24 -0.01 0.00 -1.74 0.00 0.00 68.15 67.67 1iux h THR 308 CO -0.11 0.33 0.07 0.25 0.37 0.00 0.00 175.52 176.43 1iux h LEU 309 N 0.41 0.48 0.09 2.58 5.85 -0.28 -2.21 115.31 122.24 1iux h LEU 309 Ca 0.09 -0.24 0.02 0.00 0.84 0.00 0.00 57.88 58.59 1iux h LEU 309 Cb 0.47 -0.13 -0.03 0.00 0.37 0.00 0.00 40.66 41.34 1iux h LEU 309 CO 0.02 0.60 -0.24 0.22 -0.34 0.00 0.00 178.44 178.70 1iux h TYR 310 N 0.35 -0.64 -0.64 1.25 3.20 -1.06 0.16 116.97 119.58 1iux h TYR 310 Ca 0.10 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 61.97 1iux h TYR 310 Cb 0.31 0.27 -0.03 0.00 1.54 0.00 0.00 36.73 38.82 1iux h TYR 310 CO 0.02 -0.34 0.37 0.00 -1.64 0.00 0.00 178.16 176.57 1iux h ARG 311 N -0.43 0.88 -0.40 1.82 3.08 -1.34 0.45 114.38 118.44 1iux h ARG 311 Ca 0.03 -0.08 -0.14 0.00 0.07 0.00 0.00 59.98 59.86 1iux h ARG 311 Cb 0.46 -0.18 -0.01 0.00 0.08 0.00 0.00 29.97 30.32 1iux h ARG 311 CO -0.15 0.63 -0.31 -0.07 -1.07 0.00 0.00 179.97 179.00 1iux h LEU 312 N 0.89 0.95 -0.90 3.04 3.38 -1.15 -2.32 115.31 119.20 1iux h LEU 312 Ca 0.23 -0.44 -0.08 0.00 0.09 0.00 0.00 57.88 57.68 1iux h LEU 312 Cb -0.00 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.46 1iux h LEU 312 CO -0.04 1.20 -0.04 -0.07 0.09 0.00 0.00 178.44 179.57 1iux h LEU 313 N 0.72 0.74 -0.18 1.67 3.38 -0.41 -1.50 115.31 119.73 1iux h LEU 313 Ca 0.07 -0.19 0.00 0.00 0.09 0.00 0.00 57.88 57.85 1iux h LEU 313 Cb 0.89 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.43 1iux h LEU 313 CO 0.08 0.83 0.12 0.25 0.09 0.00 0.00 178.44 179.81 1iux h LEU 314 N 0.71 0.21 -0.87 1.67 6.46 -0.80 0.03 115.31 122.72 1iux h LEU 314 Ca 0.13 -0.02 0.06 0.00 -0.12 0.00 0.00 57.88 57.93 1iux h LEU 314 Cb 0.49 -0.05 -0.06 0.00 -0.73 0.00 0.00 40.66 40.31 1iux h LEU 314 CO 0.03 0.16 0.55 0.11 -0.62 0.00 0.00 178.44 178.66 1iux h LYS 315 N 0.24 0.98 -0.43 1.25 1.79 -1.12 0.37 116.57 119.65 1iux h LYS 315 Ca 0.07 -0.06 -0.10 0.00 -2.18 0.00 0.00 60.65 58.38 1iux h LYS 315 Cb -0.02 -0.22 -0.01 0.00 -1.58 0.00 0.00 32.23 30.40 1iux h LYS 315 CO -0.01 0.65 -0.12 0.00 -1.08 0.00 0.00 179.45 178.89 1iux h ALA 316 N 1.40 0.59 0.04 3.86 0.00 -0.80 -1.35 119.26 122.99 1iux h ALA 316 Ca 0.37 -0.33 -0.09 0.00 0.00 0.00 0.00 54.91 54.85 1iux h ALA 316 Cb 0.13 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.77 1iux h ALA 316 CO -0.16 0.49 -0.46 1.88 0.00 0.00 0.00 179.25 181.00 1iux h TYR 317 N 0.67 0.14 0.01 0.00 0.05 -0.56 -2.59 116.97 114.69 1iux h TYR 317 Ca 0.11 -0.10 -0.26 0.00 0.05 0.00 0.00 58.73 58.52 1iux h TYR 317 Cb 0.66 -0.01 0.02 0.00 1.01 0.00 0.00 36.73 38.41 1iux h TYR 317 CO 0.05 1.18 -1.05 -0.09 -1.05 0.00 0.00 178.16 177.20 1iux h ARG 318 N -0.82 0.66 -0.11 4.88 2.43 -0.41 -3.36 114.38 117.65 1iux h ARG 318 Ca -0.10 -0.72 0.00 0.00 -0.81 0.00 0.00 59.98 58.34 1iux h ARG 318 Cb 1.23 0.21 0.00 0.00 -0.42 0.00 0.00 29.97 30.99 1iux h ARG 318 CO 0.00 1.30 0.00 0.39 -1.51 0.00 0.00 179.97 180.16 1iux n GLU 319 N -3.83 1.48 -2.30 0.20 1.02 -0.55 -4.99 120.64 111.66 1iux n GLU 319 Ca -0.11 -1.59 -0.19 0.00 -0.02 0.00 0.00 57.16 55.25 1iux n GLU 319 Cb 0.89 -1.31 -0.02 0.00 -0.02 0.00 0.00 31.44 30.98 1iux n GLU 319 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1iux n GLY 320 N 0.89 -0.25 2.77 0.62 0.00 -0.98 -4.91 105.19 103.34 1iux n GLY 320 Ca 0.10 -0.07 -0.37 0.00 0.00 0.00 0.00 46.02 45.69 1iux n GLY 320 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1iux n ARG 321 N -2.83 3.67 0.27 1.61 5.12 -0.95 -4.83 116.66 118.73 1iux n ARG 321 Ca -0.23 -4.16 0.18 0.00 -1.93 0.00 0.00 57.85 51.72 1iux n ARG 321 Cb 0.67 -2.32 0.98 0.00 -1.16 0.00 0.00 32.46 30.63 1iux n ARG 321 CO 0.00 0.00 0.00 0.78 -1.93 0.00 0.00 177.63 176.48 1iux h GLY 322 N 3.26 0.00 2.00 -0.13 0.00 -1.82 -2.27 103.07 104.11 1iux h GLY 322 Ca 0.47 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.76 1iux h GLY 322 CO 1.20 0.00 -0.17 1.05 0.00 0.00 0.00 176.54 178.61 1iux h GLU 323 N 0.00 0.00 0.00 4.80 9.09 -1.98 -2.84 114.58 123.65 1iux h GLU 323 Ca 0.00 0.00 -0.02 0.00 0.05 0.00 0.00 59.36 59.39 1iux h GLU 323 Cb 0.01 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 27.10 1iux h GLU 323 CO 0.00 0.17 -0.11 -0.07 0.05 0.00 0.00 179.01 179.06 1iux h LEU 324 N 0.00 0.00 -2.73 3.06 3.38 -1.78 -2.60 115.31 114.64 1iux h LEU 324 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1iux h LEU 324 Cb 0.53 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.28 1iux h LEU 324 CO 0.02 0.11 0.00 -0.07 0.09 0.00 0.00 178.44 178.59 1iux h LEU 325 N 0.00 0.00 -0.50 1.67 3.38 -1.71 -1.21 115.31 116.93 1iux h LEU 325 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1iux h LEU 325 Cb 0.30 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.05 1iux h LEU 325 CO 0.01 0.00 0.00 -0.62 0.09 0.00 0.00 178.44 177.92 1iux n GLU 326 N -3.03 0.13 0.00 1.13 1.02 -0.98 -2.29 120.64 116.62 1iux n GLU 326 Ca -0.02 0.38 0.13 0.00 -0.02 0.00 0.00 57.16 57.62 1iux n GLU 326 Cb 0.09 -1.76 0.31 0.00 -0.02 0.00 0.00 31.44 30.07 1iux n GLU 326 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1iux n ARG 327 N -2.00 0.58 -0.07 3.49 1.74 -0.46 -4.53 116.66 115.41 1iux n ARG 327 Ca 0.02 -0.35 -0.11 0.00 -0.77 0.00 0.00 57.85 56.64 1iux n ARG 327 Cb 0.20 -1.49 -0.05 0.00 -1.02 0.00 0.00 32.46 30.10 1iux n ARG 327 CO 0.00 0.00 0.00 -0.92 -1.52 0.00 0.00 177.63 175.19 1iux h TYR 328 N 0.86 -1.22 -0.46 -1.55 3.20 -1.61 -2.04 116.97 114.15 1iux h TYR 328 Ca 0.00 0.06 0.01 0.00 3.14 0.00 0.00 58.73 61.94 1iux h TYR 328 Cb 0.51 0.57 -0.03 0.00 1.54 0.00 0.00 36.73 39.33 1iux h TYR 328 CO 0.00 -0.45 0.29 0.77 -1.64 0.00 0.00 178.16 177.12 1iux h SER 329 N -0.40 0.48 -0.72 -2.11 0.02 -1.84 -1.18 113.55 107.80 1iux h SER 329 Ca 0.11 -0.01 0.02 0.00 -0.84 0.00 0.00 61.79 61.07 1iux h SER 329 Cb 0.60 -0.11 -0.04 0.00 0.14 0.00 0.00 62.40 62.99 1iux h SER 329 CO -0.49 0.35 0.47 0.00 -1.14 0.00 0.00 176.83 176.01 1iux h ALA 330 N 1.18 0.94 0.02 3.77 0.00 -1.79 -0.69 119.26 122.70 1iux h ALA 330 Ca 0.17 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.05 1iux h ALA 330 Cb -0.03 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.50 1iux h ALA 330 CO -0.06 0.28 -0.01 0.82 0.00 0.00 0.00 179.25 180.28 1iux h ILE 331 N 0.93 1.24 -0.17 0.00 2.04 -1.01 -3.18 117.51 117.35 1iux h ILE 331 Ca 0.28 -0.82 -0.00 0.00 1.00 0.00 0.00 64.86 65.32 1iux h ILE 331 Cb -0.04 1.79 -0.01 0.00 -0.74 0.00 0.00 36.82 37.83 1iux h ILE 331 CO -0.09 0.21 0.10 0.00 0.00 0.00 0.00 178.15 178.37 1iux h LEU 333 N 0.19 0.06 -0.38 0.00 3.38 -1.20 -1.17 115.31 116.19 1iux h LEU 333 Ca 0.06 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.02 1iux h LEU 333 Cb 0.03 -0.01 -0.02 0.00 0.09 0.00 0.00 40.66 40.75 1iux h LEU 333 CO -0.01 0.04 0.21 0.03 0.09 0.00 0.00 178.44 178.79 1iux h ARG 334 N 0.07 0.54 -0.09 1.13 3.08 -1.52 -1.78 114.38 115.82 1iux h ARG 334 Ca 0.20 -0.07 -0.22 0.00 0.07 0.00 0.00 59.98 59.96 1iux h ARG 334 Cb 0.70 -0.10 0.01 0.00 0.08 0.00 0.00 29.97 30.65 1iux h ARG 334 CO -0.02 0.45 -0.84 -0.09 -1.07 0.00 0.00 179.97 178.40 1iux h ARG 335 N 0.49 0.64 -0.12 0.04 2.43 -1.49 -3.14 114.38 113.23 1iux h ARG 335 Ca 0.13 -0.57 0.03 0.00 -0.81 0.00 0.00 59.98 58.76 1iux h ARG 335 Cb 0.07 0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 29.73 1iux h ARG 335 CO -0.02 1.18 -0.03 0.82 -1.51 0.00 0.00 179.97 180.41 1iux h ILE 336 N 0.41 0.87 -0.81 1.20 2.04 -1.12 -1.72 117.51 118.39 1iux h ILE 336 Ca -0.06 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 65.76 1iux h ILE 336 Cb 1.46 0.87 -0.04 0.00 -0.74 0.00 0.00 36.82 38.37 1iux h ILE 336 CO 0.16 0.00 0.38 -0.50 0.00 0.00 0.00 178.15 178.19 1iux h TRP 337 N -0.00 1.16 -0.32 1.37 4.06 -1.38 0.88 115.95 121.72 1iux h TRP 337 Ca 0.06 -0.06 -0.11 0.00 2.06 0.00 0.00 58.89 60.84 1iux h TRP 337 Cb 0.09 -0.36 -0.01 0.00 -1.00 0.00 0.00 29.16 27.88 1iux h TRP 337 CO -0.17 0.84 -0.27 0.87 -3.56 0.00 0.00 178.44 176.15 1iux h LYS 338 N 1.15 0.65 -0.16 0.49 1.57 -1.46 -0.68 116.57 118.12 1iux h LYS 338 Ca 0.28 -0.27 -0.17 0.00 -1.87 0.00 0.00 60.65 58.62 1iux h LYS 338 Cb 0.12 -0.02 -0.00 0.00 0.08 0.00 0.00 32.23 32.40 1iux h LYS 338 CO -0.03 0.85 -0.61 0.00 -0.57 0.00 0.00 179.45 179.09 1iux h ALA 339 N 1.14 0.64 -0.52 3.86 0.00 -0.96 -1.92 119.26 121.51 1iux h ALA 339 Ca 0.07 -0.54 -0.02 0.00 0.00 0.00 0.00 54.91 54.42 1iux h ALA 339 Cb 0.76 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.45 1iux h ALA 339 CO 0.06 0.71 0.25 0.93 0.00 0.00 0.00 179.25 181.19 1iux h GLU 340 N 0.40 0.75 -0.61 0.00 4.39 -0.54 -0.68 114.58 118.29 1iux h GLU 340 Ca -0.01 -0.11 0.01 0.00 0.34 0.00 0.00 59.36 59.59 1iux h GLU 340 Cb 1.17 -0.13 -0.03 0.00 -0.10 0.00 0.00 28.75 29.65 1iux h GLU 340 CO 0.11 0.62 0.40 -0.09 -1.16 0.00 0.00 179.01 178.90 1iux h ARG 341 N 0.69 0.79 -0.13 2.33 2.43 -0.98 -0.29 114.38 119.23 1iux h ARG 341 Ca 0.18 -0.05 -0.01 0.00 -0.81 0.00 0.00 59.98 59.29 1iux h ARG 341 Cb 0.12 -0.18 -0.01 0.00 -0.42 0.00 0.00 29.97 29.48 1iux h ARG 341 CO -0.02 0.53 0.05 0.35 -1.51 0.00 0.00 179.97 179.36 1iux h PHE 342 N 0.82 0.21 -0.66 2.20 3.57 -1.01 -0.20 116.94 121.87 1iux h PHE 342 Ca 0.23 -0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.68 1iux h PHE 342 Cb -0.08 -0.06 -0.03 0.00 2.79 0.00 0.00 35.95 38.56 1iux h PHE 342 CO -0.03 0.31 0.29 0.77 -2.23 0.00 0.00 178.31 177.41 1iux h SER 343 N 0.05 0.86 -0.24 0.41 0.02 -0.93 -0.69 113.55 113.03 1iux h SER 343 Ca 0.04 -0.10 -0.02 0.00 -0.84 0.00 0.00 61.79 60.87 1iux h SER 343 Cb 0.19 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 62.50 1iux h SER 343 CO -0.00 0.75 0.06 -0.25 -1.14 0.00 0.00 176.83 176.25 1iux h TRP 344 N 0.94 0.40 -0.17 3.45 7.01 -0.88 -1.39 115.95 125.30 1iux h TRP 344 Ca 0.23 -0.05 -0.00 0.00 2.11 0.00 0.00 58.89 61.18 1iux h TRP 344 Cb 0.14 -0.11 -0.01 0.00 -2.10 0.00 0.00 29.16 27.08 1iux h TRP 344 CO 0.01 0.47 0.09 2.35 -2.79 0.00 0.00 178.44 178.58 1iux h TRP 345 N 0.21 0.24 -0.33 2.65 7.01 -0.59 -0.40 115.95 124.74 1iux h TRP 345 Ca 0.08 -0.01 0.03 0.00 2.11 0.00 0.00 58.89 61.10 1iux h TRP 345 Cb 0.27 -0.08 -0.03 0.00 -2.10 0.00 0.00 29.16 27.22 1iux h TRP 345 CO 0.01 0.22 0.13 0.52 -2.79 0.00 0.00 178.44 176.54 1iux h MET 346 N 0.18 0.28 -0.58 2.65 2.86 -1.10 -1.49 114.93 117.73 1iux h MET 346 Ca 0.06 -0.02 0.02 0.00 -2.06 0.00 0.00 59.70 57.71 1iux h MET 346 Cb 0.07 -0.06 -0.04 0.00 0.06 0.00 0.00 31.60 31.63 1iux h MET 346 CO -0.01 0.18 0.36 1.15 1.06 0.00 0.00 176.91 179.65 1iux h THR 347 N 0.28 1.08 0.00 2.22 2.02 -1.05 -1.63 112.91 115.84 1iux h THR 347 Ca 0.15 -0.25 -0.09 0.00 0.77 0.00 0.00 66.41 66.99 1iux h THR 347 Cb 0.10 0.30 -0.01 0.00 -1.74 0.00 0.00 68.15 66.80 1iux h THR 347 CO -0.14 0.13 -0.43 0.77 0.37 0.00 0.00 175.52 176.22 1iux h SER 348 N 0.72 0.00 1.09 4.18 4.64 -0.56 -2.61 113.55 121.00 1iux h SER 348 Ca 0.23 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.52 1iux h SER 348 Cb -0.00 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.08 1iux h SER 348 CO -0.09 0.43 -0.93 -0.37 -0.87 0.00 0.00 176.83 175.00 1iux h VAL 349 N 0.00 0.10 0.00 0.95 -1.51 -1.02 -3.39 116.25 111.37 1iux h VAL 349 Ca -0.00 -1.18 -0.07 0.00 -1.23 0.00 0.00 66.70 64.22 1iux h VAL 349 Cb 0.83 1.66 -0.01 0.00 -2.13 0.00 0.00 31.29 31.64 1iux h VAL 349 CO 0.06 0.05 -1.76 0.18 -1.23 0.00 0.00 177.57 174.87 1iux n LEU 350 N -2.77 0.29 -4.98 4.19 4.77 -0.64 -4.92 117.00 112.94 1iux n LEU 350 Ca -0.01 0.12 -0.20 0.00 -0.03 0.00 0.00 56.01 55.88 1iux n LEU 350 Cb 0.60 0.06 -0.01 0.00 -2.33 0.00 0.00 43.42 41.73 1iux n LEU 350 CO 0.40 0.04 0.03 -1.00 -1.33 0.00 0.00 177.39 175.53 1iux s HIS 351 N -3.28 3.31 -0.26 -1.77 3.76 -0.99 -4.29 115.29 111.77 1iux s HIS 351 Ca -0.06 -0.06 -0.09 0.00 -0.15 0.00 0.00 55.06 54.70 1iux s HIS 351 Cb 0.11 -1.80 -0.04 0.00 1.11 0.00 0.00 32.58 31.96 1iux s HIS 351 CO 0.86 0.20 0.13 1.03 -0.85 0.00 0.00 174.74 176.10 1iux s ARG 352 N -4.11 3.83 0.07 1.40 1.81 -1.26 -4.95 118.95 115.73 1iux s ARG 352 Ca 0.40 -0.39 -0.16 0.00 -1.72 0.00 0.00 55.73 53.86 1iux s ARG 352 Cb -0.09 -3.47 -0.06 0.00 -0.45 0.00 0.00 34.95 30.87 1iux s ARG 352 CO 0.31 -0.14 0.49 -0.06 -0.68 0.00 0.00 175.30 175.22 1iux s PHE 353 N 1.55 3.71 0.11 -0.53 0.40 -1.26 -4.97 117.98 116.99 1iux s PHE 353 Ca 0.06 1.08 -0.29 0.00 -0.60 0.00 0.00 56.93 57.18 1iux s PHE 353 Cb -0.15 -2.36 -0.09 0.00 0.51 0.00 0.00 43.02 40.93 1iux s PHE 353 CO 0.07 0.56 1.61 -1.00 0.70 0.00 0.00 175.22 177.16 1iux h PRO 354 N 4.28 -0.56 -2.77 0.24 0.13 -1.98 -3.33 132.00 128.02 1iux h PRO 354 Ca -0.50 0.04 -0.73 0.00 -0.87 0.00 0.00 66.00 63.93 1iux h PRO 354 Cb 1.21 0.13 -0.33 0.00 0.13 0.00 0.00 31.00 32.13 1iux h PRO 354 CO 0.64 -0.37 0.25 -0.40 -0.23 0.00 0.00 178.00 177.88 1iux n ASP 355 N -5.43 5.33 -4.52 1.44 5.68 -1.26 -5.01 116.55 112.77 1iux n ASP 355 Ca -0.07 -3.38 -0.37 0.00 -0.50 0.00 0.00 54.79 50.48 1iux n ASP 355 Cb 0.35 -1.07 -0.12 0.00 -1.14 0.00 0.00 41.12 39.14 1iux n ASP 355 CO 0.00 0.00 0.00 -0.89 -1.33 0.00 0.00 177.20 174.98 1iux s THR 356 N -2.48 4.67 0.76 2.12 2.01 -1.25 -5.10 115.64 116.36 1iux s THR 356 Ca 0.33 -0.05 -0.12 0.00 0.31 0.00 0.00 61.69 62.16 1iux s THR 356 Cb 0.06 -3.18 0.05 0.00 0.01 0.00 0.00 72.50 69.44 1iux s THR 356 CO 0.04 0.34 1.12 1.51 -0.69 0.00 0.00 174.62 176.93 1iux s ASP 357 N 1.42 4.91 0.25 3.53 1.47 -1.26 -4.89 116.67 122.10 1iux s ASP 357 Ca 0.06 1.09 -0.03 0.00 1.18 0.00 0.00 52.55 54.85 1iux s ASP 357 Cb -0.15 -1.80 0.45 0.00 -0.34 0.00 0.00 42.92 41.08 1iux s ASP 357 CO 0.05 -1.68 1.81 0.00 0.68 0.00 0.00 175.17 176.03 1iux h ALA 358 N -0.89 1.26 -0.00 2.11 0.00 -2.00 -2.73 119.26 117.00 1iux h ALA 358 Ca -0.46 0.04 0.02 0.00 0.00 0.00 0.00 54.91 54.51 1iux h ALA 358 Cb 1.28 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.91 1iux h ALA 358 CO 0.63 0.10 -0.12 0.35 0.00 0.00 0.00 179.25 180.21 1iux h PHE 359 N 0.81 -0.29 -0.95 0.00 3.57 -2.00 -2.57 116.94 115.51 1iux h PHE 359 Ca 0.43 0.01 0.07 0.00 3.53 0.00 0.00 57.97 62.00 1iux h PHE 359 Cb 0.42 0.13 -0.07 0.00 2.79 0.00 0.00 35.95 39.23 1iux h PHE 359 CO -0.05 -0.17 0.60 0.77 -2.23 0.00 0.00 178.31 177.22 1iux h SER 360 N -0.20 0.95 -0.66 0.41 0.02 -1.87 -0.69 113.55 111.52 1iux h SER 360 Ca 0.04 0.02 -0.02 0.00 -0.84 0.00 0.00 61.79 60.98 1iux h SER 360 Cb 0.25 -0.19 -0.03 0.00 0.14 0.00 0.00 62.40 62.57 1iux h SER 360 CO -0.12 0.60 0.32 1.56 -1.14 0.00 0.00 176.83 178.05 1iux h GLN 361 N 1.08 0.95 -0.38 3.45 4.20 -1.39 -0.32 115.11 122.69 1iux h GLN 361 Ca 0.41 -0.14 -0.12 0.00 0.06 0.00 0.00 58.65 58.86 1iux h GLN 361 Cb 0.19 -0.17 -0.01 0.00 0.30 0.00 0.00 27.48 27.79 1iux h GLN 361 CO -0.18 0.75 -0.24 0.00 -0.67 0.00 0.00 178.83 178.49 1iux h ARG 362 N 0.91 0.78 -0.39 1.46 2.47 -1.01 -1.69 114.38 116.91 1iux h ARG 362 Ca 0.23 -0.33 -0.10 0.00 -1.26 0.00 0.00 59.98 58.52 1iux h ARG 362 Cb 0.12 -0.03 -0.02 0.00 -1.65 0.00 0.00 29.97 28.39 1iux h ARG 362 CO -0.03 0.94 -0.16 0.82 0.56 0.00 0.00 179.97 182.11 1iux h ILE 363 N 0.68 1.26 -0.26 2.04 1.08 -0.87 -0.81 117.51 120.63 1iux h ILE 363 Ca 0.09 -1.21 -0.01 0.00 -0.39 0.00 0.00 64.86 63.33 1iux h ILE 363 Cb 0.76 1.14 -0.01 0.00 -3.07 0.00 0.00 36.82 35.64 1iux h ILE 363 CO 0.06 0.41 0.11 -0.61 -0.69 0.00 0.00 178.15 177.43 1iux h GLN 364 N 0.64 0.37 -0.17 2.37 4.15 -0.85 0.17 115.11 121.78 1iux h GLN 364 Ca 0.10 -0.06 -0.00 0.00 0.77 0.00 0.00 58.65 59.46 1iux h GLN 364 Cb 0.63 -0.06 -0.01 0.00 0.21 0.00 0.00 27.48 28.25 1iux h GLN 364 CO 0.04 0.39 0.11 0.37 -1.93 0.00 0.00 178.83 177.81 1iux h GLN 365 N 0.27 0.24 -0.36 1.69 4.15 -1.18 -2.71 115.11 117.22 1iux h GLN 365 Ca 0.09 -0.02 -0.02 0.00 0.77 0.00 0.00 58.65 59.46 1iux h GLN 365 Cb 0.15 -0.05 -0.02 0.00 0.21 0.00 0.00 27.48 27.77 1iux h GLN 365 CO -0.01 0.20 0.12 1.15 -1.93 0.00 0.00 178.83 178.36 1iux h THR 366 N 0.21 1.15 -0.32 2.39 2.02 -0.86 -0.11 112.91 117.39 1iux h THR 366 Ca 0.06 -0.49 0.01 0.00 0.77 0.00 0.00 66.41 66.76 1iux h THR 366 Cb 0.02 0.75 -0.02 0.00 -1.74 0.00 0.00 68.15 67.17 1iux h THR 366 CO -0.01 0.18 0.20 -0.33 0.37 0.00 0.00 175.52 175.93 1iux h GLU 367 N 0.50 0.40 0.14 6.66 4.39 -0.46 0.97 114.58 127.18 1iux h GLU 367 Ca 0.12 -0.02 -0.01 0.00 0.34 0.00 0.00 59.36 59.79 1iux h GLU 367 Cb 0.14 -0.09 0.00 0.00 -0.10 0.00 0.00 28.75 28.70 1iux h GLU 367 CO -0.01 0.27 -0.07 -0.07 -1.16 0.00 0.00 179.01 177.97 1iux h LEU 368 N 0.41 -0.16 -1.10 1.33 3.38 -0.98 -1.31 115.31 116.89 1iux h LEU 368 Ca 0.12 -0.13 0.12 0.00 0.09 0.00 0.00 57.88 58.08 1iux h LEU 368 Cb -0.03 0.04 -0.08 0.00 0.09 0.00 0.00 40.66 40.69 1iux h LEU 368 CO -0.04 0.03 0.61 -0.33 0.09 0.00 0.00 178.44 178.80 1iux h GLU 369 N -0.34 0.91 0.29 1.13 5.08 -0.86 -1.06 114.58 119.73 1iux h GLU 369 Ca -0.02 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.27 1iux h GLU 369 Cb 0.27 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 29.32 1iux h GLU 369 CO 0.03 0.60 -0.14 -0.92 -1.00 0.00 0.00 179.01 177.58 1iux h TYR 370 N 0.93 -0.37 -0.02 4.33 3.20 -0.58 -2.79 116.97 121.68 1iux h TYR 370 Ca 0.47 -0.01 -0.02 0.00 3.14 0.00 0.00 58.73 62.31 1iux h TYR 370 Cb 0.49 0.12 -0.00 0.00 1.54 0.00 0.00 36.73 38.88 1iux h TYR 370 CO -0.00 -0.07 -0.09 1.88 -1.64 0.00 0.00 178.16 178.24 1iux h TYR 371 N -1.01 0.03 -0.00 -3.82 -1.99 -1.13 -1.83 116.97 107.22 1iux h TYR 371 Ca -0.04 -0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.69 1iux h TYR 371 Cb 0.46 -0.01 0.00 0.00 2.00 0.00 0.00 36.73 39.18 1iux h TYR 371 CO 0.04 0.12 -0.27 1.28 -0.00 0.00 0.00 178.16 179.33 1iux n LEU 372 N -4.41 0.46 -0.14 3.88 4.32 -0.41 -1.45 117.00 119.25 1iux n LEU 372 Ca -0.02 0.07 0.03 0.00 -0.02 0.00 0.00 56.01 56.06 1iux n LEU 372 Cb 0.18 -0.27 -0.00 0.00 -1.62 0.00 0.00 43.42 41.71 1iux n LEU 372 CO 0.35 0.10 0.18 0.61 -1.22 0.00 0.00 177.39 177.41 1iux n GLY 373 N 1.42 -0.21 3.54 -0.72 0.00 -0.79 -4.93 105.19 103.50 1iux n GLY 373 Ca 0.09 -0.18 -0.34 0.00 0.00 0.00 0.00 46.02 45.60 1iux n GLY 373 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1iux s SER 374 N -1.02 4.54 0.32 1.61 0.15 -0.76 -5.01 113.70 113.52 1iux s SER 374 Ca 0.05 -0.09 0.02 0.00 0.70 0.00 0.00 55.95 56.63 1iux s SER 374 Cb 0.05 -1.27 0.53 0.00 -1.71 0.00 0.00 66.02 63.62 1iux s SER 374 CO 0.16 0.31 1.87 -0.33 1.20 0.00 0.00 173.24 176.44 1iux h GLU 375 N 5.62 0.67 -0.12 5.44 4.39 -1.91 0.22 114.58 128.90 1iux h GLU 375 Ca -0.43 -0.13 -0.19 0.00 0.34 0.00 0.00 59.36 58.94 1iux h GLU 375 Cb 1.18 -0.10 -0.00 0.00 -0.10 0.00 0.00 28.75 29.72 1iux h GLU 375 CO 0.54 0.63 -0.72 0.00 -1.16 0.00 0.00 179.01 178.30 1iux h ALA 376 N 1.45 0.53 -0.19 3.43 0.00 -1.95 -2.47 119.26 120.05 1iux h ALA 376 Ca 0.14 -0.59 -0.03 0.00 0.00 0.00 0.00 54.91 54.43 1iux h ALA 376 Cb 0.28 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 1iux h ALA 376 CO 0.00 0.73 0.00 0.78 0.00 0.00 0.00 179.25 180.76 1iux h GLY 377 N 1.04 0.37 1.18 0.00 0.00 -1.58 -2.38 103.07 101.69 1iux h GLY 377 Ca -0.03 -0.27 0.02 0.00 0.00 0.00 0.00 47.33 47.05 1iux h GLY 377 CO 0.13 0.25 0.50 1.41 0.00 0.00 0.00 176.54 178.83 1iux h LEU 378 N 0.10 0.83 -1.14 3.11 3.38 0.58 -1.82 115.31 120.35 1iux h LEU 378 Ca 0.06 -0.01 -0.08 0.00 0.09 0.00 0.00 57.88 57.93 1iux h LEU 378 Cb 0.38 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.92 1iux h LEU 378 CO 0.01 0.58 -0.23 0.00 0.09 0.00 0.00 178.44 178.90 1iux h ALA 379 N 1.54 1.28 -0.27 1.53 0.00 -1.22 -0.84 119.26 121.28 1iux h ALA 379 Ca 0.29 -0.30 -0.15 0.00 0.00 0.00 0.00 54.91 54.75 1iux h ALA 379 Cb -0.01 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 1iux h ALA 379 CO -0.08 0.48 -0.45 1.79 0.00 0.00 0.00 179.25 180.99 1iux h THR 380 N 0.30 1.29 0.22 0.00 1.35 -0.81 -1.35 112.91 113.91 1iux h THR 380 Ca 0.05 -1.65 -0.01 0.00 -0.55 0.00 0.00 66.41 64.25 1iux h THR 380 Cb 0.57 1.57 0.00 0.00 -1.73 0.00 0.00 68.15 68.56 1iux h THR 380 CO 0.04 0.53 -0.11 0.40 -0.25 0.00 0.00 175.52 176.13 1iux h ILE 381 N 0.57 0.86 -0.24 6.82 2.04 -1.30 -2.92 117.51 123.33 1iux h ILE 381 Ca 0.03 -0.64 0.05 0.00 1.00 0.00 0.00 64.86 65.31 1iux h ILE 381 Cb 1.01 1.22 -0.05 0.00 -0.74 0.00 0.00 36.82 38.25 1iux h ILE 381 CO 0.10 0.14 -0.09 0.00 0.00 0.00 0.00 178.15 178.30 1iux h ALA 382 N 0.04 0.13 0.00 1.87 0.00 -1.14 0.36 119.26 120.52 1iux h ALA 382 Ca -0.03 0.09 -0.05 0.00 0.00 0.00 0.00 54.91 54.92 1iux h ALA 382 Cb 0.45 0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 1iux h ALA 382 CO 0.05 -0.50 -0.24 1.05 0.00 0.00 0.00 179.25 179.61 1iux h GLU 383 N -0.04 0.00 0.07 0.00 4.11 -1.34 -2.04 114.58 115.34 1iux h GLU 383 Ca 0.12 0.00 -0.27 0.00 0.07 0.00 0.00 59.36 59.28 1iux h GLU 383 Cb 0.23 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.49 1iux h GLU 383 CO -0.27 0.24 -1.13 -0.91 0.07 0.00 0.00 179.01 177.01 1iux h ASN 384 N 0.00 0.73 -0.47 3.06 2.35 -1.17 -3.10 115.58 116.97 1iux h ASN 384 Ca -0.00 -0.64 -0.11 0.00 -0.55 0.00 0.00 56.30 54.99 1iux h ASN 384 Cb 0.44 -0.23 -0.01 0.00 0.05 0.00 0.00 38.32 38.57 1iux h ASN 384 CO 0.03 1.46 -0.14 0.22 -1.65 0.00 0.00 177.43 177.35 1iux h TYR 385 N 0.25 1.05 0.00 1.19 5.03 0.04 -2.61 116.97 121.92 1iux h TYR 385 Ca -0.14 -0.23 0.00 0.00 2.58 0.00 0.00 58.73 60.93 1iux h TYR 385 Cb 1.80 -0.25 0.00 0.00 1.55 0.00 0.00 36.73 39.83 1iux h TYR 385 CO 0.09 1.02 0.00 -0.39 -1.32 0.00 0.00 178.16 177.56 1iux h VAL 386 N 0.77 0.00 0.00 1.81 -1.51 -1.49 -3.48 116.25 112.34 1iux h VAL 386 Ca 0.12 -0.59 0.00 0.00 -1.23 0.00 0.00 66.70 65.00 1iux h VAL 386 Cb 0.70 1.56 0.00 0.00 -2.13 0.00 0.00 31.29 31.41 1iux h VAL 386 CO 0.05 0.00 0.00 0.61 -1.23 0.00 0.00 177.57 177.00 1iux n GLY 387 N 0.35 2.16 3.75 5.19 0.00 -0.98 -4.17 105.19 111.49 1iux n GLY 387 Ca 0.02 -1.28 -0.34 0.00 0.00 0.00 0.00 46.02 44.42 1iux n GLY 387 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1iux s LEU 388 N 0.00 3.39 0.78 0.99 1.02 -1.25 -4.88 118.68 118.72 1iux s LEU 388 Ca 0.00 2.13 -0.14 0.00 0.02 0.00 0.00 54.13 56.14 1iux s LEU 388 Cb 0.00 -4.57 0.07 0.00 0.02 0.00 0.00 46.19 41.71 1iux s LEU 388 CO 0.00 -1.82 1.22 -2.16 0.02 0.00 0.00 176.35 173.61 1iux s PRO 389 N -3.98 1.78 0.31 1.29 0.04 -1.26 -5.00 135.00 128.18 1iux s PRO 389 Ca 0.70 1.81 -0.20 0.00 0.04 0.00 0.00 61.00 63.34 1iux s PRO 389 Cb -0.24 -1.79 -0.09 0.00 0.04 0.00 0.00 34.50 32.43 1iux s PRO 389 CO 0.42 -2.12 0.83 0.71 0.04 0.00 0.00 177.00 176.87 1iux s TYR 390 N -2.02 3.52 0.21 0.56 1.51 -1.26 -5.03 117.35 114.83 1iux s TYR 390 Ca 0.75 1.49 -0.30 0.00 -1.01 0.00 0.00 57.07 58.00 1iux s TYR 390 Cb -0.30 -2.72 -0.08 0.00 -0.11 0.00 0.00 41.96 38.75 1iux s TYR 390 CO 0.49 0.15 1.11 -2.00 -1.11 0.00 0.00 175.55 174.19 1iux s GLU 391 N -2.50 4.60 0.17 -0.62 -6.30 -1.26 -4.98 118.70 107.82 1iux s GLU 391 Ca 0.51 1.75 -0.14 0.00 -2.50 0.00 0.00 54.97 54.60 1iux s GLU 391 Cb -0.14 -3.25 0.06 0.00 0.00 0.00 0.00 34.13 30.80 1iux s GLU 391 CO 0.19 0.10 1.81 1.05 0.02 0.00 0.00 175.26 178.44 1iux h GLU 392 N 4.76 0.71 0.00 4.30 4.11 -2.01 -3.50 114.58 122.95 1iux h GLU 392 Ca -0.45 -0.06 0.00 0.00 0.07 0.00 0.00 59.36 58.92 1iux h GLU 392 Cb 1.21 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 30.31 1iux h GLU 392 CO 0.71 0.50 0.00 -0.89 0.07 0.00 0.00 179.01 179.40 1iux n ILE 393 N -4.69 0.00 -0.93 -1.06 5.41 -1.26 -5.16 119.36 111.68 1iux n ILE 393 Ca 0.03 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.78 1iux n ILE 393 Cb 0.04 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 38.97 1iux n ILE 393 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93