#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1m68 n PRO 3 N 0.00 2.45 -4.24 -0.72 -0.04 -1.25 -4.80 135.00 126.40 1m68 n PRO 3 Ca 0.00 -1.26 -0.19 0.00 -0.04 0.00 0.00 63.50 62.00 1m68 n PRO 3 Cb 0.00 -1.77 -0.16 0.00 -0.04 0.00 0.00 33.50 31.53 1m68 n PRO 3 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1m68 s VAL 4 N -1.67 0.58 -0.06 0.52 1.01 -1.25 -1.94 120.40 117.60 1m68 s VAL 4 Ca 0.22 -0.22 0.02 0.00 0.00 0.00 0.00 61.98 62.01 1m68 s VAL 4 Cb 0.17 -0.56 0.01 0.00 0.00 0.00 0.00 36.38 36.01 1m68 s VAL 4 CO 0.06 0.21 -0.12 -0.62 0.00 0.00 0.00 175.10 174.63 1m68 s ASP 5 N 0.47 1.71 0.00 3.32 -1.08 -1.07 -4.85 116.67 115.16 1m68 s ASP 5 Ca -0.06 -0.28 0.10 0.00 -0.52 0.00 0.00 52.55 51.79 1m68 s ASP 5 Cb -0.10 -0.73 0.17 0.00 -1.46 0.00 0.00 42.92 40.79 1m68 s ASP 5 CO 0.00 0.04 1.01 0.18 0.52 0.00 0.00 175.17 176.92 1m68 n LEU 6 N 3.71 2.30 -3.34 -1.34 4.77 -1.24 -2.29 117.00 119.58 1m68 n LEU 6 Ca -0.22 -1.43 -0.10 0.00 -0.03 0.00 0.00 56.01 54.23 1m68 n LEU 6 Cb 0.52 -0.09 -0.07 0.00 -2.33 0.00 0.00 43.42 41.44 1m68 n LEU 6 CO 0.25 0.51 -0.07 -2.28 -1.33 0.00 0.00 177.39 174.48 1m68 s HIS 7 N -0.92 -0.85 0.19 -1.77 5.04 -1.26 -4.64 115.29 111.07 1m68 s HIS 7 Ca 0.16 0.61 -0.19 0.00 -1.54 0.00 0.00 55.06 54.10 1m68 s HIS 7 Cb 0.10 -0.07 0.04 0.00 0.04 0.00 0.00 32.58 32.69 1m68 s HIS 7 CO 0.14 -0.81 0.56 0.00 -2.34 0.00 0.00 174.74 172.28 1m68 s MET 8 N 2.53 1.38 0.06 2.88 0.23 -1.25 -0.81 119.30 124.31 1m68 s MET 8 Ca 0.12 -0.76 0.07 0.00 -1.03 0.00 0.00 55.69 54.09 1m68 s MET 8 Cb -0.14 0.55 -0.03 0.00 -1.53 0.00 0.00 34.83 33.68 1m68 s MET 8 CO -0.21 -0.59 -0.19 -1.01 -2.03 0.00 0.00 175.02 170.99 1m68 s HIS 9 N -3.84 1.61 0.38 3.16 3.76 -0.29 -0.47 115.29 119.61 1m68 s HIS 9 Ca 0.07 -0.38 0.02 0.00 -0.15 0.00 0.00 55.06 54.61 1m68 s HIS 9 Cb -0.01 -0.94 0.02 0.00 1.11 0.00 0.00 32.58 32.75 1m68 s HIS 9 CO -0.05 0.10 0.13 0.25 -0.85 0.00 0.00 174.74 174.32 1m68 n THR 10 N 1.66 0.00 0.19 1.30 -2.24 -1.26 -4.57 114.28 109.36 1m68 n THR 10 Ca -0.18 -1.65 0.05 0.00 -2.27 0.00 0.00 64.05 60.00 1m68 n THR 10 Cb 0.54 0.12 0.25 0.00 -2.10 0.00 0.00 70.33 69.14 1m68 n THR 10 CO 0.00 0.00 0.00 1.33 -0.57 0.00 0.00 175.07 175.83 1m68 n VAL 11 N -1.14 1.44 0.29 2.28 0.24 -0.85 -2.07 118.33 118.52 1m68 n VAL 11 Ca -0.09 0.46 0.14 0.00 -2.04 0.00 0.00 64.34 62.81 1m68 n VAL 11 Cb 0.46 -1.40 0.69 0.00 -1.47 0.00 0.00 33.84 32.12 1m68 n VAL 11 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1m68 h ALA 12 N 2.14 1.55 -3.81 2.33 0.00 -1.90 -3.30 119.26 116.28 1m68 h ALA 12 Ca 0.00 -0.00 -0.68 0.00 0.00 0.00 0.00 54.91 54.23 1m68 h ALA 12 Cb 0.10 0.01 -0.24 0.00 0.00 0.00 0.00 17.79 17.66 1m68 h ALA 12 CO 0.00 -0.49 -0.76 -1.12 0.00 0.00 0.00 179.25 176.88 1m68 s SER 13 N -4.33 4.12 0.02 0.00 0.01 -0.88 -3.06 113.70 109.58 1m68 s SER 13 Ca -0.03 -0.20 0.19 0.00 1.31 0.00 0.00 55.95 57.22 1m68 s SER 13 Cb 0.08 -1.08 0.80 0.00 0.21 0.00 0.00 66.02 66.03 1m68 s SER 13 CO 0.27 0.30 1.60 0.35 0.41 0.00 0.00 173.24 176.18 1m68 n THR 14 N 2.60 0.73 0.60 1.44 -2.24 -1.24 -1.89 114.28 114.28 1m68 n THR 14 Ca -0.17 0.18 0.06 0.00 -2.27 0.00 0.00 64.05 61.84 1m68 n THR 14 Cb 0.52 -0.87 0.18 0.00 -2.10 0.00 0.00 70.33 68.06 1m68 n THR 14 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1m68 n HIS 15 N -1.55 0.65 -4.44 4.78 -0.00 -1.26 -4.80 115.22 108.60 1m68 n HIS 15 Ca 0.04 -0.28 -0.21 0.00 -0.00 0.00 0.00 57.72 57.27 1m68 n HIS 15 Cb 0.22 -0.07 -0.11 0.00 -0.00 0.00 0.00 29.99 30.03 1m68 n HIS 15 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 1m68 s ALA 16 N -1.59 2.33 0.00 1.59 0.00 -0.79 -4.92 121.76 118.38 1m68 s ALA 16 Ca 0.26 -2.01 0.00 0.00 0.00 0.00 0.00 51.96 50.21 1m68 s ALA 16 Cb 0.15 0.52 0.00 0.00 0.00 0.00 0.00 23.12 23.79 1m68 s ALA 16 CO 0.15 -0.24 0.40 0.66 0.00 0.00 0.00 175.76 176.73 1m68 n TYR 17 N -0.65 0.00 -4.32 0.00 4.02 -0.19 -4.36 117.16 111.66 1m68 n TYR 17 Ca -0.03 0.00 -0.22 0.00 -0.01 0.00 0.00 57.90 57.63 1m68 n TYR 17 Cb 0.66 0.03 -0.11 0.00 -0.02 0.00 0.00 39.34 39.90 1m68 n TYR 17 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 176.86 174.73 1m68 s SER 18 N -0.02 2.66 0.51 7.72 0.01 -1.26 -4.88 113.70 118.44 1m68 s SER 18 Ca 0.00 -0.83 0.08 0.00 1.31 0.00 0.00 55.95 56.52 1m68 s SER 18 Cb 0.00 -0.15 0.04 0.00 0.21 0.00 0.00 66.02 66.12 1m68 s SER 18 CO 0.00 -0.01 0.61 0.42 0.41 0.00 0.00 173.24 174.67 1m68 s THR 19 N -1.86 2.36 0.23 1.44 -4.23 -1.26 -2.01 115.64 110.30 1m68 s THR 19 Ca 0.14 -1.13 -0.07 0.00 -1.18 0.00 0.00 61.69 59.45 1m68 s THR 19 Cb -0.07 -2.49 0.20 0.00 1.34 0.00 0.00 72.50 71.49 1m68 s THR 19 CO 0.06 0.00 1.70 0.25 -0.54 0.00 0.00 174.62 176.09 1m68 h LEU 20 N 0.52 0.04 -1.11 4.79 5.85 -2.00 -1.54 115.31 121.86 1m68 h LEU 20 Ca -0.35 0.13 -0.08 0.00 0.84 0.00 0.00 57.88 58.42 1m68 h LEU 20 Cb 1.29 0.16 -0.01 0.00 0.37 0.00 0.00 40.66 42.47 1m68 h LEU 20 CO 0.47 0.00 -0.20 0.77 -0.34 0.00 0.00 178.44 179.14 1m68 h SER 21 N 0.29 0.37 -0.60 1.25 4.64 -1.99 -1.94 113.55 115.57 1m68 h SER 21 Ca 0.37 -0.11 -0.03 0.00 -0.47 0.00 0.00 61.79 61.55 1m68 h SER 21 Cb 0.59 -0.10 -0.03 0.00 -0.31 0.00 0.00 62.40 62.55 1m68 h SER 21 CO -0.45 0.59 0.26 0.44 -0.87 0.00 0.00 176.83 176.80 1m68 h ASP 22 N 0.35 0.81 -0.48 4.97 3.32 -1.68 -1.49 116.42 122.21 1m68 h ASP 22 Ca 0.06 -0.16 -0.09 0.00 0.02 0.00 0.00 57.03 56.86 1m68 h ASP 22 Cb 0.55 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.88 1m68 h ASP 22 CO 0.04 0.74 -0.05 1.88 -1.72 0.00 0.00 179.24 180.13 1m68 h TYR 23 N 0.82 0.98 -0.63 4.55 0.05 -0.98 -0.06 116.97 121.70 1m68 h TYR 23 Ca 0.20 -0.19 0.01 0.00 0.05 0.00 0.00 58.73 58.80 1m68 h TYR 23 Cb 0.17 -0.25 -0.03 0.00 1.01 0.00 0.00 36.73 37.63 1m68 h TYR 23 CO 0.01 0.94 0.42 0.82 -1.05 0.00 0.00 178.16 179.29 1m68 h ILE 24 N 0.74 1.16 -0.37 -2.88 2.04 -1.28 -0.80 117.51 116.12 1m68 h ILE 24 Ca 0.13 -0.29 -0.09 0.00 1.00 0.00 0.00 64.86 65.61 1m68 h ILE 24 Cb 0.58 0.23 -0.01 0.00 -0.74 0.00 0.00 36.82 36.88 1m68 h ILE 24 CO 0.03 0.16 -0.10 0.00 0.00 0.00 0.00 178.15 178.24 1m68 h ALA 25 N 1.23 0.52 -0.63 1.87 0.00 -0.91 -2.61 119.26 118.72 1m68 h ALA 25 Ca 0.23 -0.31 -0.03 0.00 0.00 0.00 0.00 54.91 54.80 1m68 h ALA 25 Cb -0.10 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.53 1m68 h ALA 25 CO -0.05 0.38 0.26 1.96 0.00 0.00 0.00 179.25 181.80 1m68 h GLN 26 N 0.53 0.92 -0.64 0.00 1.08 -0.84 -2.54 115.11 113.61 1m68 h GLN 26 Ca 0.09 -0.14 -0.04 0.00 -1.45 0.00 0.00 58.65 57.11 1m68 h GLN 26 Cb 0.62 -0.16 -0.03 0.00 -0.05 0.00 0.00 27.48 27.86 1m68 h GLN 26 CO 0.04 0.75 0.26 0.00 -0.95 0.00 0.00 178.83 178.92 1m68 h ALA 27 N 1.38 0.83 -0.72 3.87 0.00 -0.95 -0.90 119.26 122.77 1m68 h ALA 27 Ca 0.22 -0.17 0.01 0.00 0.00 0.00 0.00 54.91 54.96 1m68 h ALA 27 Cb 0.16 -0.25 -0.04 0.00 0.00 0.00 0.00 17.79 17.67 1m68 h ALA 27 CO -0.02 0.45 0.47 -0.22 0.00 0.00 0.00 179.25 179.93 1m68 h LYS 28 N 0.90 0.93 0.00 0.00 3.64 -1.35 0.22 116.57 120.90 1m68 h LYS 28 Ca 0.21 -0.06 -0.07 0.00 -1.27 0.00 0.00 60.65 59.47 1m68 h LYS 28 Cb 0.21 -0.21 -0.01 0.00 -0.41 0.00 0.00 32.23 31.81 1m68 h LYS 28 CO -0.02 0.61 -0.33 1.96 -2.27 0.00 0.00 179.45 179.40 1m68 h GLN 29 N 0.96 0.00 -0.23 1.90 4.20 -0.96 -3.22 115.11 117.75 1m68 h GLN 29 Ca 0.27 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.98 1m68 h GLN 29 Cb -0.09 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.69 1m68 h GLN 29 CO -0.07 0.33 0.00 1.63 -0.67 0.00 0.00 178.83 180.06 1m68 n LYS 30 N -3.61 2.80 -2.05 1.46 5.02 -0.40 -4.97 118.16 116.41 1m68 n LYS 30 Ca -0.01 -2.12 -0.10 0.00 -2.02 0.00 0.00 58.31 54.06 1m68 n LYS 30 Cb 0.45 -1.34 -0.01 0.00 -0.02 0.00 0.00 35.03 34.12 1m68 n LYS 30 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1m68 n GLY 31 N -0.03 0.14 3.74 0.72 0.00 -0.30 -5.01 105.19 104.46 1m68 n GLY 31 Ca 0.11 -0.48 -0.38 0.00 0.00 0.00 0.00 46.02 45.27 1m68 n GLY 31 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1m68 s ILE 32 N -2.48 5.08 -0.30 -0.61 1.01 0.61 -4.77 121.20 119.74 1m68 s ILE 32 Ca 0.00 1.07 0.18 0.00 0.00 0.00 0.00 60.65 61.90 1m68 s ILE 32 Cb 0.00 -3.86 -0.26 0.00 0.01 0.00 0.00 42.46 38.36 1m68 s ILE 32 CO 0.00 0.37 0.52 0.29 0.00 0.00 0.00 174.94 176.12 1m68 n LYS 33 N 3.24 0.74 -3.67 2.79 4.76 -0.82 -4.43 118.16 120.78 1m68 n LYS 33 Ca -0.07 -0.11 -0.08 0.00 -2.87 0.00 0.00 58.31 55.17 1m68 n LYS 33 Cb 0.51 -1.41 -0.09 0.00 -1.84 0.00 0.00 35.03 32.21 1m68 n LYS 33 CO 0.00 0.00 0.00 -1.17 -1.37 0.00 0.00 177.40 174.86 1m68 s LEU 34 N -3.80 -0.57 0.17 -0.35 2.96 -1.10 -1.06 118.68 114.94 1m68 s LEU 34 Ca -0.02 1.22 -0.07 0.00 -0.22 0.00 0.00 54.13 55.04 1m68 s LEU 34 Cb 0.12 1.88 -0.02 0.00 0.50 0.00 0.00 46.19 48.68 1m68 s LEU 34 CO 0.76 -0.22 0.24 0.72 -1.32 0.00 0.00 176.35 176.52 1m68 s PHE 35 N 1.63 0.57 -0.04 5.38 -0.12 -1.07 -2.59 117.98 121.74 1m68 s PHE 35 Ca -0.09 -0.92 0.04 0.00 -0.05 0.00 0.00 56.93 55.90 1m68 s PHE 35 Cb -0.07 -0.18 -0.00 0.00 -0.63 0.00 0.00 43.02 42.14 1m68 s PHE 35 CO -0.16 -0.69 -0.16 0.00 -0.05 0.00 0.00 175.22 174.15 1m68 s ALA 36 N -4.01 1.43 -0.23 1.99 0.00 -0.97 -0.04 121.76 119.93 1m68 s ALA 36 Ca 0.21 -0.64 -0.18 0.00 0.00 0.00 0.00 51.96 51.35 1m68 s ALA 36 Cb 0.04 -0.47 -0.03 0.00 0.00 0.00 0.00 23.12 22.66 1m68 s ALA 36 CO 0.02 0.26 0.51 0.42 0.00 0.00 0.00 175.76 176.97 1m68 s ILE 37 N 0.03 5.10 -0.61 0.00 -1.09 -1.01 -3.86 121.20 119.75 1m68 s ILE 37 Ca -0.03 0.90 0.06 0.00 -2.23 0.00 0.00 60.65 59.35 1m68 s ILE 37 Cb -0.11 -3.82 0.24 0.00 -1.58 0.00 0.00 42.46 37.19 1m68 s ILE 37 CO 0.02 0.14 0.69 0.35 -1.23 0.00 0.00 174.94 174.91 1m68 n THR 38 N 4.80 1.89 -1.72 2.92 -2.24 0.38 -1.85 114.28 118.46 1m68 n THR 38 Ca -0.05 -5.03 -0.38 0.00 -2.27 0.00 0.00 64.05 56.33 1m68 n THR 38 Cb 0.50 -2.09 0.05 0.00 -2.10 0.00 0.00 70.33 66.70 1m68 n THR 38 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1m68 n ASP 39 N 1.04 2.25 -4.62 3.42 8.00 -1.25 -3.17 116.55 122.22 1m68 n ASP 39 Ca 0.28 0.92 -0.43 0.00 0.71 0.00 0.00 54.79 56.27 1m68 n ASP 39 Cb 0.42 -1.54 -0.01 0.00 -0.02 0.00 0.00 41.12 39.97 1m68 n ASP 39 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 1m68 n HIS 40 N -1.32 1.49 -1.74 1.24 8.25 -1.26 -0.34 115.22 121.54 1m68 n HIS 40 Ca 0.12 0.64 -0.34 0.00 -0.26 0.00 0.00 57.72 57.88 1m68 n HIS 40 Cb 0.46 -2.28 0.06 0.00 1.12 0.00 0.00 29.99 29.34 1m68 n HIS 40 CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 1m68 s GLY 41 N -0.53 2.43 0.58 -1.41 0.00 -0.29 -4.37 107.32 103.73 1m68 s GLY 41 Ca 0.58 0.83 0.28 0.00 0.00 0.00 0.00 44.72 46.42 1m68 s GLY 41 CO 0.60 1.21 2.23 -2.55 0.00 0.00 0.00 173.10 174.60 1m68 h PRO 42 N 0.24 0.00 0.00 2.90 0.11 -1.77 -1.14 132.00 132.35 1m68 h PRO 42 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1m68 h PRO 42 Cb 1.28 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.39 1m68 h PRO 42 CO 0.53 0.01 0.00 -0.44 -0.21 0.00 0.00 178.00 177.89 1m68 h ASP 43 N 0.00 0.00 -4.23 -2.05 5.19 -1.89 -3.45 116.42 109.98 1m68 h ASP 43 Ca -0.00 0.00 -0.50 0.00 -0.62 0.00 0.00 57.03 55.91 1m68 h ASP 43 Cb 0.03 0.00 0.09 0.00 0.18 0.00 0.00 39.33 39.63 1m68 h ASP 43 CO 0.00 0.00 0.37 -0.04 -3.12 0.00 0.00 179.24 176.45 1m68 s MET 44 N -3.47 2.92 0.52 3.56 -1.94 -0.43 -4.77 119.30 115.67 1m68 s MET 44 Ca 0.03 1.25 -0.19 0.00 -1.71 0.00 0.00 55.69 55.08 1m68 s MET 44 Cb 0.09 -1.98 -0.07 0.00 2.01 0.00 0.00 34.83 34.88 1m68 s MET 44 CO 0.50 -1.14 1.03 -1.21 -0.01 0.00 0.00 175.02 174.19 1m68 s GLU 45 N -4.31 3.72 -1.46 2.03 2.02 -1.26 -3.59 118.70 115.85 1m68 s GLU 45 Ca 0.64 1.24 -0.08 0.00 0.02 0.00 0.00 54.97 56.79 1m68 s GLU 45 Cb -0.18 -2.09 0.04 0.00 0.10 0.00 0.00 34.13 32.00 1m68 s GLU 45 CO 0.43 -0.49 0.76 -3.47 0.02 0.00 0.00 175.26 172.52 1m68 n ASP 46 N -1.32 -5.40 -4.49 -0.19 2.03 -1.26 -5.00 116.55 100.91 1m68 n ASP 46 Ca 0.09 -0.45 -0.26 0.00 0.52 0.00 0.00 54.79 54.69 1m68 n ASP 46 Cb 0.53 -4.35 -0.10 0.00 -0.72 0.00 0.00 41.12 36.48 1m68 n ASP 46 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1m68 s ALA 47 N -3.17 2.74 1.11 -1.67 0.00 -1.24 -4.23 121.76 115.30 1m68 s ALA 47 Ca 0.45 -1.68 -0.16 0.00 0.00 0.00 0.00 51.96 50.56 1m68 s ALA 47 Cb -0.21 -0.43 0.24 0.00 0.00 0.00 0.00 23.12 22.72 1m68 s ALA 47 CO 0.56 0.38 1.11 -1.25 0.00 0.00 0.00 175.76 176.55 1m68 s PRO 48 N -3.05 -0.47 0.60 0.00 0.04 -1.17 -4.92 135.00 126.02 1m68 s PRO 48 Ca 0.25 0.14 -0.17 0.00 0.04 0.00 0.00 61.00 61.27 1m68 s PRO 48 Cb -0.07 -1.67 -0.03 0.00 0.04 0.00 0.00 34.50 32.78 1m68 s PRO 48 CO 0.13 -3.26 1.11 -1.58 0.04 0.00 0.00 177.00 173.45 1m68 s HIS 49 N -3.04 2.67 0.57 0.56 5.65 -1.26 -4.34 115.29 116.09 1m68 s HIS 49 Ca 0.69 1.55 0.35 0.00 0.25 0.00 0.00 55.06 57.89 1m68 s HIS 49 Cb -0.13 -3.21 1.96 0.00 -1.18 0.00 0.00 32.58 30.01 1m68 s HIS 49 CO 0.56 -1.60 2.26 1.12 -0.65 0.00 0.00 174.74 176.44 1m68 h HIS 50 N 0.59 0.00 0.00 3.88 2.07 -1.95 -0.38 115.15 119.36 1m68 h HIS 50 Ca -0.48 0.00 -0.02 0.00 -2.85 0.00 0.00 60.37 57.01 1m68 h HIS 50 Cb 1.25 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 31.23 1m68 h HIS 50 CO 0.53 0.02 -0.11 -1.49 -3.07 0.00 0.00 177.93 173.81 1m68 h TRP 51 N 0.00 0.00 -0.87 6.12 6.55 -1.99 -1.37 115.95 124.39 1m68 h TRP 51 Ca -0.00 0.00 0.14 0.00 0.95 0.00 0.00 58.89 59.98 1m68 h TRP 51 Cb 0.07 0.00 -0.07 0.00 -0.86 0.00 0.00 29.16 28.31 1m68 h TRP 51 CO 0.00 0.11 0.56 1.25 -1.05 0.00 0.00 178.44 179.31 1m68 h HIS 52 N 0.00 0.78 0.14 0.49 -0.00 -1.42 0.17 115.15 115.30 1m68 h HIS 52 Ca -0.00 0.02 -0.24 0.00 -0.00 0.00 0.00 60.37 60.15 1m68 h HIS 52 Cb 0.24 -0.25 0.01 0.00 -0.00 0.00 0.00 27.41 27.42 1m68 h HIS 52 CO 0.00 0.30 -1.16 0.74 -0.00 0.00 0.00 177.93 177.81 1m68 h PHE 53 N 0.67 0.52 -0.85 5.26 0.04 -1.43 -3.34 116.94 117.81 1m68 h PHE 53 Ca 0.43 -0.38 0.08 0.00 2.80 0.00 0.00 57.97 60.90 1m68 h PHE 53 Cb 0.71 -0.02 -0.06 0.00 2.20 0.00 0.00 35.95 38.78 1m68 h PHE 53 CO -0.00 1.45 0.55 0.82 -0.60 0.00 0.00 178.31 180.53 1m68 h ILE 54 N -0.31 1.00 -0.16 -0.55 2.04 -1.18 -2.55 117.51 115.80 1m68 h ILE 54 Ca -0.23 -0.30 0.00 0.00 1.00 0.00 0.00 64.86 65.33 1m68 h ILE 54 Cb 1.74 0.04 0.00 0.00 -0.74 0.00 0.00 36.82 37.86 1m68 h ILE 54 CO 0.11 0.16 0.00 -3.20 0.00 0.00 0.00 178.15 175.22 1m68 n ASN 55 N -4.51 1.16 0.03 1.72 5.15 0.02 -3.53 115.26 115.30 1m68 n ASN 55 Ca 0.14 -1.77 0.10 0.00 -0.60 0.00 0.00 54.58 52.44 1m68 n ASN 55 Cb 0.27 -0.11 0.43 0.00 -0.53 0.00 0.00 39.78 39.84 1m68 n ASN 55 CO 0.00 0.00 0.00 0.23 1.40 0.00 0.00 177.26 178.89 1m68 n MET 56 N 0.04 0.05 0.27 1.20 2.81 -0.96 -2.57 117.12 117.97 1m68 n MET 56 Ca 0.12 0.21 0.18 0.00 -1.81 0.00 0.00 57.70 56.41 1m68 n MET 56 Cb 0.22 -1.59 0.97 0.00 -0.71 0.00 0.00 33.22 32.11 1m68 n MET 56 CO 0.00 0.00 0.00 0.07 1.51 0.00 0.00 175.97 177.55 1m68 h ARG 57 N 0.00 0.00 0.00 0.03 0.11 -1.76 -1.85 114.38 110.91 1m68 h ARG 57 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 1m68 h ARG 57 Cb 0.37 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.45 1m68 h ARG 57 CO 0.00 0.00 -0.20 -0.84 0.10 0.00 0.00 179.97 179.03 1m68 h ILE 58 N 0.00 0.00 -3.81 0.08 3.07 -1.81 -3.47 117.51 111.57 1m68 h ILE 58 Ca 0.00 -0.69 -0.55 0.00 1.55 0.00 0.00 64.86 65.16 1m68 h ILE 58 Cb 0.02 1.57 0.13 0.00 -0.27 0.00 0.00 36.82 38.27 1m68 h ILE 58 CO 0.00 0.00 0.60 0.79 -1.05 0.00 0.00 178.15 178.49 1m68 n TRP 59 N -2.54 2.41 -1.52 0.16 7.02 -0.70 -4.96 117.44 117.32 1m68 n TRP 59 Ca 0.04 0.46 -0.33 0.00 -1.02 0.00 0.00 57.50 56.65 1m68 n TRP 59 Cb 0.47 -2.41 0.07 0.00 -2.42 0.00 0.00 31.31 27.02 1m68 n TRP 59 CO 0.00 0.00 0.00 -1.25 -2.02 0.00 0.00 177.69 174.42 1m68 s PRO 60 N -2.41 2.43 -0.03 -0.99 0.04 -1.26 -4.95 135.00 127.83 1m68 s PRO 60 Ca 0.62 1.44 -0.17 0.00 0.04 0.00 0.00 61.00 62.94 1m68 s PRO 60 Cb -0.47 -1.90 -0.32 0.00 0.04 0.00 0.00 34.50 31.85 1m68 s PRO 60 CO 0.57 -1.55 0.84 0.00 0.04 0.00 0.00 177.00 176.90 1m68 h ARG 61 N -0.39 0.41 -4.18 4.56 2.47 -1.93 -3.43 114.38 111.88 1m68 h ARG 61 Ca -0.46 -0.69 -0.45 0.00 -1.26 0.00 0.00 59.98 57.11 1m68 h ARG 61 Cb 1.26 0.26 -0.34 0.00 -1.65 0.00 0.00 29.97 29.49 1m68 h ARG 61 CO 0.52 1.33 -0.79 0.08 0.56 0.00 0.00 179.97 181.67 1m68 s VAL 62 N -2.53 0.75 -0.06 2.04 1.01 -1.26 0.07 120.40 120.42 1m68 s VAL 62 Ca -0.13 -0.23 0.00 0.00 0.00 0.00 0.00 61.98 61.62 1m68 s VAL 62 Cb 0.03 -0.74 0.02 0.00 0.00 0.00 0.00 36.38 35.69 1m68 s VAL 62 CO 0.87 0.28 -0.05 -0.69 0.00 0.00 0.00 175.10 175.51 1m68 s VAL 63 N 0.96 0.65 -1.51 2.92 1.01 -0.45 -4.80 120.40 119.18 1m68 s VAL 63 Ca -0.10 -0.14 -0.13 0.00 0.00 0.00 0.00 61.98 61.62 1m68 s VAL 63 Cb -0.15 -0.69 0.08 0.00 0.00 0.00 0.00 36.38 35.62 1m68 s VAL 63 CO 0.00 0.27 0.91 0.47 0.00 0.00 0.00 175.10 176.76 1m68 n ASP 64 N 4.42 -4.85 0.00 3.32 8.00 -1.26 -1.05 116.55 125.13 1m68 n ASP 64 Ca -0.18 -0.70 0.00 0.00 0.71 0.00 0.00 54.79 54.62 1m68 n ASP 64 Cb 0.51 -3.88 0.00 0.00 -0.02 0.00 0.00 41.12 37.73 1m68 n ASP 64 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1m68 n GLY 65 N -1.63 2.73 3.73 0.44 0.00 -1.26 -4.96 105.19 104.23 1m68 n GLY 65 Ca 0.03 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.67 1m68 n GLY 65 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1m68 s VAL 66 N -2.90 5.21 0.26 1.61 1.01 -0.22 -4.91 120.40 120.47 1m68 s VAL 66 Ca 0.00 0.84 -0.16 0.00 0.00 0.00 0.00 61.98 62.66 1m68 s VAL 66 Cb 0.00 -3.76 -0.08 0.00 0.00 0.00 0.00 36.38 32.53 1m68 s VAL 66 CO 0.00 0.35 0.69 -0.83 0.00 0.00 0.00 175.10 175.32 1m68 s GLY 67 N 0.51 2.43 -0.16 4.51 0.00 -0.22 -1.34 107.32 113.04 1m68 s GLY 67 Ca 0.23 0.03 0.00 0.00 0.00 0.00 0.00 44.72 44.99 1m68 s GLY 67 CO 0.09 0.29 -0.12 -0.42 0.00 0.00 0.00 173.10 172.93 1m68 s ILE 68 N -1.77 1.51 -0.05 0.90 1.01 0.11 -2.59 121.20 120.33 1m68 s ILE 68 Ca 0.48 -0.69 -0.11 0.00 0.00 0.00 0.00 60.65 60.33 1m68 s ILE 68 Cb -0.13 -1.48 -0.05 0.00 0.01 0.00 0.00 42.46 40.81 1m68 s ILE 68 CO 0.19 0.36 0.30 -0.76 0.00 0.00 0.00 174.94 175.03 1m68 s LEU 69 N 1.49 4.44 -0.26 2.97 1.43 0.95 -4.81 118.68 124.89 1m68 s LEU 69 Ca 0.03 0.76 -0.16 0.00 -1.03 0.00 0.00 54.13 53.74 1m68 s LEU 69 Cb -0.14 -2.39 -0.03 0.00 0.03 0.00 0.00 46.19 43.66 1m68 s LEU 69 CO -0.10 0.36 0.41 -0.13 0.23 0.00 0.00 176.35 177.12 1m68 s ARG 70 N -1.08 4.05 0.27 1.70 0.52 -1.26 -2.41 118.95 120.74 1m68 s ARG 70 Ca 0.20 0.14 0.04 0.00 -0.52 0.00 0.00 55.73 55.59 1m68 s ARG 70 Cb -0.15 -3.64 -0.02 0.00 0.52 0.00 0.00 34.95 31.67 1m68 s ARG 70 CO 0.10 -0.26 0.27 0.41 0.02 0.00 0.00 175.30 175.84 1m68 n GLY 71 N 4.49 2.92 3.26 -3.53 0.00 -0.77 -0.10 105.19 111.46 1m68 n GLY 71 Ca -0.07 -1.77 -0.13 0.00 0.00 0.00 0.00 46.02 44.04 1m68 n GLY 71 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1m68 s ILE 72 N -2.99 0.02 -0.76 -0.61 2.07 -1.09 -4.26 121.20 113.56 1m68 s ILE 72 Ca 0.30 -0.13 -0.13 0.00 -1.41 0.00 0.00 60.65 59.28 1m68 s ILE 72 Cb 0.01 -0.56 0.20 0.00 0.13 0.00 0.00 42.46 42.24 1m68 s ILE 72 CO 0.21 -0.07 0.70 -0.70 -1.91 0.00 0.00 174.94 173.17 1m68 s GLU 73 N -0.24 3.42 0.71 3.50 2.12 0.54 -1.77 118.70 126.97 1m68 s GLU 73 Ca -0.04 -2.35 -0.12 0.00 0.36 0.00 0.00 54.97 52.83 1m68 s GLU 73 Cb -0.03 -4.35 0.02 0.00 0.26 0.00 0.00 34.13 30.02 1m68 s GLU 73 CO 0.02 -1.29 1.07 0.00 -0.54 0.00 0.00 175.26 174.53 1m68 s ALA 74 N 0.38 2.52 -0.19 6.30 0.00 0.21 -1.14 121.76 129.84 1m68 s ALA 74 Ca 0.15 0.22 -0.09 0.00 0.00 0.00 0.00 51.96 52.24 1m68 s ALA 74 Cb -0.14 -3.23 -0.05 0.00 0.00 0.00 0.00 23.12 19.71 1m68 s ALA 74 CO -0.07 -1.37 0.11 -0.80 0.00 0.00 0.00 175.76 173.63 1m68 s ASN 75 N -3.44 6.00 -0.01 0.00 0.01 -1.26 -1.90 114.94 114.34 1m68 s ASN 75 Ca 0.60 0.18 -0.30 0.00 -0.71 0.00 0.00 52.86 52.63 1m68 s ASN 75 Cb -0.16 -2.04 -0.05 0.00 0.41 0.00 0.00 41.25 39.41 1m68 s ASN 75 CO 0.52 0.18 1.37 -0.63 -1.51 0.00 0.00 177.10 177.03 1m68 s ILE 76 N 0.37 3.79 -0.15 0.60 1.01 -0.85 -2.80 121.20 123.17 1m68 s ILE 76 Ca 0.06 1.16 0.13 0.00 0.00 0.00 0.00 60.65 62.00 1m68 s ILE 76 Cb -0.12 -3.75 -0.24 0.00 0.01 0.00 0.00 42.46 38.37 1m68 s ILE 76 CO -0.01 -0.00 0.27 0.29 0.00 0.00 0.00 174.94 175.48 1m68 n LYS 77 N 5.35 0.67 -3.83 2.79 5.02 0.53 -4.34 118.16 124.35 1m68 n LYS 77 Ca 0.13 0.13 -0.07 0.00 -2.02 0.00 0.00 58.31 56.48 1m68 n LYS 77 Cb 0.44 -1.63 0.01 0.00 -0.02 0.00 0.00 35.03 33.83 1m68 n LYS 77 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1m68 s ASN 78 N -5.91 -0.07 0.43 4.39 2.20 -1.26 -4.79 114.94 109.92 1m68 s ASN 78 Ca -0.12 -0.91 0.29 0.00 -0.94 0.00 0.00 52.86 51.18 1m68 s ASN 78 Cb 0.07 0.75 1.56 0.00 -2.00 0.00 0.00 41.25 41.63 1m68 s ASN 78 CO 0.80 -1.47 1.88 -0.37 -2.94 0.00 0.00 177.10 175.00 1m68 h VAL 79 N 2.00 0.00 -0.00 3.54 -1.51 -1.90 -1.13 116.25 117.25 1m68 h VAL 79 Ca -0.28 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.19 1m68 h VAL 79 Cb 1.24 0.63 0.00 0.00 -2.13 0.00 0.00 31.29 31.04 1m68 h VAL 79 CO 0.35 0.00 -0.02 0.47 -1.23 0.00 0.00 177.57 177.14 1m68 n ASP 80 N -2.50 0.22 -0.13 4.19 8.00 -1.26 -4.33 116.55 120.73 1m68 n ASP 80 Ca -0.02 -0.77 -0.02 0.00 0.71 0.00 0.00 54.79 54.69 1m68 n ASP 80 Cb 0.04 -0.08 -0.01 0.00 -0.02 0.00 0.00 41.12 41.06 1m68 n ASP 80 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1m68 n GLY 81 N 1.13 0.53 3.78 0.44 0.00 -0.43 -4.67 105.19 105.98 1m68 n GLY 81 Ca 0.20 -0.64 -0.36 0.00 0.00 0.00 0.00 46.02 45.22 1m68 n GLY 81 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1m68 s GLU 82 N -1.56 3.87 0.20 1.61 2.02 -1.26 -4.25 118.70 119.33 1m68 s GLU 82 Ca 0.00 1.57 0.07 0.00 0.02 0.00 0.00 54.97 56.62 1m68 s GLU 82 Cb 0.00 -2.34 -0.05 0.00 0.10 0.00 0.00 34.13 31.84 1m68 s GLU 82 CO 0.00 -0.41 -0.11 0.96 0.02 0.00 0.00 175.26 175.72 1m68 s ILE 83 N -1.71 1.56 -0.72 -1.63 -4.36 -1.26 -0.35 121.20 112.73 1m68 s ILE 83 Ca 0.63 -2.16 -0.07 0.00 -0.26 0.00 0.00 60.65 58.79 1m68 s ILE 83 Cb -0.23 -2.08 -0.14 0.00 1.25 0.00 0.00 42.46 41.26 1m68 s ILE 83 CO 0.28 -0.57 3.22 -0.90 0.24 0.00 0.00 174.94 177.21 1m68 n ASP 84 N -0.37 6.82 -3.85 4.36 5.75 -1.12 -4.79 116.55 123.36 1m68 n ASP 84 Ca -0.08 -2.63 -0.26 0.00 -0.01 0.00 0.00 54.79 51.81 1m68 n ASP 84 Cb 0.61 -1.45 -0.17 0.00 -1.03 0.00 0.00 41.12 39.08 1m68 n ASP 84 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1m68 s SER 86 N 1.81 5.15 0.16 0.00 1.04 -1.26 -4.86 113.70 115.73 1m68 s SER 86 Ca 0.04 0.75 -0.15 0.00 0.48 0.00 0.00 55.95 57.07 1m68 s SER 86 Cb -0.13 -1.51 0.04 0.00 0.10 0.00 0.00 66.02 64.51 1m68 s SER 86 CO -0.07 -1.43 1.79 1.23 0.98 0.00 0.00 173.24 175.74 1m68 h GLY 87 N -0.57 0.68 1.10 7.32 0.00 -2.00 0.32 103.07 109.93 1m68 h GLY 87 Ca -0.45 -0.29 0.00 0.00 0.00 0.00 0.00 47.33 46.59 1m68 h GLY 87 CO 0.62 0.28 0.57 0.50 0.00 0.00 0.00 176.54 178.51 1m68 h LYS 88 N 0.62 1.20 -0.23 4.80 1.57 -2.00 -1.22 116.57 121.32 1m68 h LYS 88 Ca 0.17 -0.09 -0.02 0.00 -1.87 0.00 0.00 60.65 58.83 1m68 h LYS 88 Cb -0.00 -0.26 -0.01 0.00 0.08 0.00 0.00 32.23 32.04 1m68 h LYS 88 CO -0.03 0.82 0.05 0.52 -0.57 0.00 0.00 179.45 180.24 1m68 h MET 89 N 1.23 0.37 -0.94 3.15 2.86 -1.69 -3.01 114.93 116.90 1m68 h MET 89 Ca 0.33 -0.09 0.13 0.00 -2.06 0.00 0.00 59.70 58.00 1m68 h MET 89 Cb -0.10 -0.05 -0.09 0.00 0.06 0.00 0.00 31.60 31.43 1m68 h MET 89 CO -0.07 0.49 0.56 0.74 1.06 0.00 0.00 176.91 179.70 1m68 h PHE 90 N 0.19 1.02 0.00 -0.22 0.04 0.19 -1.59 116.94 116.57 1m68 h PHE 90 Ca 0.07 0.03 0.00 0.00 2.80 0.00 0.00 57.97 60.87 1m68 h PHE 90 Cb 0.29 -0.31 0.00 0.00 2.20 0.00 0.00 35.95 38.12 1m68 h PHE 90 CO 0.01 0.36 0.00 -0.44 -0.60 0.00 0.00 178.31 177.65 1m68 h ASP 91 N 0.87 0.00 0.11 2.17 3.32 -1.10 -2.37 116.42 119.42 1m68 h ASP 91 Ca 0.48 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.53 1m68 h ASP 91 Cb 0.54 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.09 1m68 h ASP 91 CO -0.29 0.00 -0.82 -1.20 -1.72 0.00 0.00 179.24 175.21 1m68 n SER 92 N -2.84 1.00 -4.74 6.45 7.64 -0.61 -4.98 113.62 115.54 1m68 n SER 92 Ca -0.01 -0.89 -0.26 0.00 1.01 0.00 0.00 58.87 58.72 1m68 n SER 92 Cb 0.15 0.76 -0.06 0.00 -1.01 0.00 0.00 64.21 64.05 1m68 n SER 92 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1m68 s LEU 93 N -2.93 3.59 -0.15 -3.43 1.43 -0.89 -4.38 118.68 111.91 1m68 s LEU 93 Ca 0.10 -0.26 0.06 0.00 -1.03 0.00 0.00 54.13 53.01 1m68 s LEU 93 Cb 0.17 -2.21 -0.14 0.00 0.03 0.00 0.00 46.19 44.04 1m68 s LEU 93 CO 0.79 0.07 -0.06 0.47 0.23 0.00 0.00 176.35 177.85 1m68 n ASP 94 N -0.33 2.22 -4.04 2.29 8.00 0.85 -4.98 116.55 120.56 1m68 n ASP 94 Ca -0.09 -0.05 -0.30 0.00 0.71 0.00 0.00 54.79 55.07 1m68 n ASP 94 Cb 0.55 0.23 -0.17 0.00 -0.02 0.00 0.00 41.12 41.72 1m68 n ASP 94 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1m68 s LEU 95 N -5.54 1.72 -0.33 0.64 2.96 -0.77 -5.01 118.68 112.35 1m68 s LEU 95 Ca -0.16 -0.47 -0.05 0.00 -0.22 0.00 0.00 54.13 53.23 1m68 s LEU 95 Cb 0.05 -1.17 0.05 0.00 0.50 0.00 0.00 46.19 45.62 1m68 s LEU 95 CO 0.47 -0.02 0.08 -0.63 -1.32 0.00 0.00 176.35 174.93 1m68 s ILE 96 N 1.27 3.52 0.07 6.68 -1.09 -1.26 -2.68 121.20 127.70 1m68 s ILE 96 Ca 0.00 -1.27 0.02 0.00 -2.23 0.00 0.00 60.65 57.17 1m68 s ILE 96 Cb -0.14 -3.03 -0.04 0.00 -1.58 0.00 0.00 42.46 37.67 1m68 s ILE 96 CO -0.07 -0.20 0.11 -0.63 -1.23 0.00 0.00 174.94 172.92 1m68 s ILE 97 N 1.34 4.73 -0.02 2.92 1.01 -0.73 -0.95 121.20 129.50 1m68 s ILE 97 Ca -0.02 -0.65 -0.09 0.00 0.00 0.00 0.00 60.65 59.89 1m68 s ILE 97 Cb -0.20 -3.28 0.01 0.00 0.01 0.00 0.00 42.46 39.01 1m68 s ILE 97 CO 0.01 0.15 0.20 0.00 0.00 0.00 0.00 174.94 175.30 1m68 s ALA 98 N -1.39 -0.49 0.10 9.38 0.00 -0.54 0.68 121.76 129.49 1m68 s ALA 98 Ca 0.30 0.18 -0.26 0.00 0.00 0.00 0.00 51.96 52.18 1m68 s ALA 98 Cb -0.12 -0.03 0.09 0.00 0.00 0.00 0.00 23.12 23.05 1m68 s ALA 98 CO 0.22 -0.19 1.11 0.20 0.00 0.00 0.00 175.76 177.11 1m68 s GLY 99 N -0.96 -0.17 -0.19 0.00 0.00 -0.80 -1.77 107.32 103.44 1m68 s GLY 99 Ca -0.10 0.13 -0.23 0.00 0.00 0.00 0.00 44.72 44.51 1m68 s GLY 99 CO 0.02 1.45 0.74 -1.36 0.00 0.00 0.00 173.10 173.95 1m68 s PHE 100 N -2.56 3.39 -0.07 1.90 0.08 -1.26 -2.01 117.98 117.44 1m68 s PHE 100 Ca 0.18 1.10 0.01 0.00 0.12 0.00 0.00 56.93 58.34 1m68 s PHE 100 Cb 0.00 -2.93 0.02 0.00 -0.57 0.00 0.00 43.02 39.55 1m68 s PHE 100 CO 0.01 -0.23 -0.07 -1.01 -0.10 0.00 0.00 175.22 173.82 1m68 s HIS 101 N 2.13 1.10 0.08 0.36 3.76 -1.26 -5.02 115.29 116.44 1m68 s HIS 101 Ca 0.34 -0.41 -0.15 0.00 -0.15 0.00 0.00 55.06 54.68 1m68 s HIS 101 Cb -0.16 -0.92 -0.03 0.00 1.11 0.00 0.00 32.58 32.57 1m68 s HIS 101 CO 0.11 -0.30 1.02 -1.91 -0.85 0.00 0.00 174.74 172.81 1m68 n GLU 102 N 4.30 -0.22 0.27 1.40 2.13 -1.24 -1.18 120.64 126.11 1m68 n GLU 102 Ca -0.19 1.01 0.17 0.00 0.66 0.00 0.00 57.16 58.80 1m68 n GLU 102 Cb 0.51 -1.49 0.80 0.00 0.27 0.00 0.00 31.44 31.53 1m68 n GLU 102 CO 0.00 0.00 0.00 -1.35 -0.41 0.00 0.00 177.13 175.37 1m68 h PRO 103 N 0.00 0.00 0.00 5.31 0.11 -1.98 -2.56 132.00 132.88 1m68 h PRO 103 Ca 0.08 0.00 -0.43 0.00 0.11 0.00 0.00 66.00 65.76 1m68 h PRO 103 Cb 0.20 0.00 -0.07 0.00 0.11 0.00 0.00 31.00 31.24 1m68 h PRO 103 CO -0.46 0.00 -2.50 0.28 -0.21 0.00 0.00 178.00 175.11 1m68 n VAL 104 N -3.12 1.49 -3.72 3.15 0.31 -0.33 -4.92 118.33 111.19 1m68 n VAL 104 Ca 0.00 -0.46 -0.28 0.00 -0.01 0.00 0.00 64.34 63.60 1m68 n VAL 104 Cb 0.44 -1.66 -0.16 0.00 -0.91 0.00 0.00 33.84 31.54 1m68 n VAL 104 CO 0.00 0.00 0.00 0.12 -1.32 0.00 0.00 176.83 175.63 1m68 s PHE 105 N -2.51 0.96 0.27 3.52 2.19 -0.46 -4.88 117.98 117.08 1m68 s PHE 105 Ca -0.37 -0.83 -0.24 0.00 0.33 0.00 0.00 56.93 55.82 1m68 s PHE 105 Cb 0.12 -1.01 -0.09 0.00 -1.31 0.00 0.00 43.02 40.73 1m68 s PHE 105 CO 0.53 -0.61 0.86 0.00 1.83 0.00 0.00 175.22 177.83 1m68 s ALA 106 N 1.88 3.30 0.18 11.12 0.00 -1.17 -3.63 121.76 133.45 1m68 s ALA 106 Ca -0.00 0.40 -0.33 0.00 0.00 0.00 0.00 51.96 52.02 1m68 s ALA 106 Cb -0.17 -3.05 -0.13 0.00 0.00 0.00 0.00 23.12 19.77 1m68 s ALA 106 CO -0.09 0.24 1.59 -2.30 0.00 0.00 0.00 175.76 175.20 1m68 n PRO 107 N 0.74 2.28 -0.29 0.00 -0.02 -1.26 -4.97 135.00 131.48 1m68 n PRO 107 Ca -0.00 0.82 0.00 0.00 -2.02 0.00 0.00 63.50 62.30 1m68 n PRO 107 Cb 0.50 -2.60 0.00 0.00 -0.02 0.00 0.00 33.50 31.38 1m68 n PRO 107 CO 0.00 0.00 0.00 1.58 1.98 0.00 0.00 175.50 179.06 1m68 n HIS 108 N 3.33 -0.11 -1.29 6.00 -0.00 -1.26 -5.11 115.22 116.79 1m68 n HIS 108 Ca 0.16 0.00 -0.35 0.00 0.46 0.00 0.00 57.72 57.99 1m68 n HIS 108 Cb 0.30 0.00 0.10 0.00 -0.12 0.00 0.00 29.99 30.27 1m68 n HIS 108 CO 0.00 0.00 0.00 -3.47 0.46 0.00 0.00 176.34 173.33 1m68 n ASP 109 N -0.24 0.57 -0.22 0.26 -0.08 -1.26 -4.73 116.55 110.85 1m68 n ASP 109 Ca 0.00 0.64 0.01 0.00 -1.51 0.00 0.00 54.79 53.92 1m68 n ASP 109 Cb 0.00 -1.43 0.09 0.00 2.34 0.00 0.00 41.12 42.12 1m68 n ASP 109 CO 0.00 0.00 0.00 0.50 0.12 0.00 0.00 177.20 177.82 1m68 h LYS 110 N -0.44 0.04 -0.37 -0.67 3.64 -2.00 -0.86 116.57 115.92 1m68 h LYS 110 Ca -0.47 -0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 58.89 1m68 h LYS 110 Cb 1.32 -0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 33.12 1m68 h LYS 110 CO 0.46 0.03 0.17 0.00 -2.27 0.00 0.00 179.45 177.84 1m68 h ALA 111 N 1.62 1.61 0.00 5.00 0.00 -1.90 0.13 119.26 125.73 1m68 h ALA 111 Ca 0.32 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 55.15 1m68 h ALA 111 Cb 0.52 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.15 1m68 h ALA 111 CO -0.62 0.32 -0.00 1.15 0.00 0.00 0.00 179.25 180.09 1m68 h THR 112 N 0.51 1.41 -0.30 0.00 2.02 -1.54 -1.33 112.91 113.69 1m68 h THR 112 Ca 0.13 -1.21 0.04 0.00 0.77 0.00 0.00 66.41 66.14 1m68 h THR 112 Cb 0.07 2.23 -0.03 0.00 -1.74 0.00 0.00 68.15 68.68 1m68 h THR 112 CO -0.02 0.31 0.09 0.78 0.37 0.00 0.00 175.52 177.06 1m68 h ASN 113 N -0.51 0.08 -0.20 4.18 2.35 -0.92 0.04 115.58 120.60 1m68 h ASN 113 Ca -0.00 0.04 0.04 0.00 -0.55 0.00 0.00 56.30 55.83 1m68 h ASN 113 Cb 0.51 0.03 -0.04 0.00 0.05 0.00 0.00 38.32 38.88 1m68 h ASN 113 CO 0.00 0.08 -0.05 0.74 -1.65 0.00 0.00 177.43 176.55 1m68 h THR 114 N 0.22 0.80 -0.16 2.81 2.02 -0.79 -0.72 112.91 117.08 1m68 h THR 114 Ca 0.14 0.00 -0.09 0.00 0.77 0.00 0.00 66.41 67.22 1m68 h THR 114 Cb 0.12 0.80 -0.01 0.00 -1.74 0.00 0.00 68.15 67.32 1m68 h THR 114 CO -0.15 0.00 -0.32 -0.61 0.37 0.00 0.00 175.52 174.81 1m68 h GLN 115 N -0.00 0.32 -0.24 6.66 4.15 -0.71 -0.77 115.11 124.51 1m68 h GLN 115 Ca 0.09 -0.13 -0.17 0.00 0.77 0.00 0.00 58.65 59.22 1m68 h GLN 115 Cb 0.15 -0.02 -0.00 0.00 0.21 0.00 0.00 27.48 27.82 1m68 h GLN 115 CO -0.20 0.61 -0.52 0.00 -1.93 0.00 0.00 178.83 176.78 1m68 h ALA 116 N 1.39 0.63 -0.12 3.38 0.00 -0.53 0.07 119.26 124.08 1m68 h ALA 116 Ca 0.04 -0.50 -0.03 0.00 0.00 0.00 0.00 54.91 54.41 1m68 h ALA 116 Cb 0.70 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.40 1m68 h ALA 116 CO 0.05 0.68 -0.05 1.98 0.00 0.00 0.00 179.25 181.92 1m68 h MET 117 N 0.54 0.25 -0.42 0.00 1.85 -0.83 -1.59 114.93 114.73 1m68 h MET 117 Ca 0.02 -0.10 0.00 0.00 -0.61 0.00 0.00 59.70 59.01 1m68 h MET 117 Cb 1.09 -0.01 -0.02 0.00 0.43 0.00 0.00 31.60 33.09 1m68 h MET 117 CO 0.11 0.57 0.27 0.82 -0.40 0.00 0.00 176.91 178.28 1m68 h ILE 118 N -0.09 1.12 -0.74 1.77 2.04 -1.13 0.02 117.51 120.50 1m68 h ILE 118 Ca 0.03 -0.22 -0.01 0.00 1.00 0.00 0.00 64.86 65.66 1m68 h ILE 118 Cb 0.49 0.51 -0.04 0.00 -0.74 0.00 0.00 36.82 37.05 1m68 h ILE 118 CO 0.02 0.11 0.43 0.00 0.00 0.00 0.00 178.15 178.71 1m68 h ALA 119 N 1.14 1.36 -0.13 1.87 0.00 -0.92 0.18 119.26 122.78 1m68 h ALA 119 Ca 0.15 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 1m68 h ALA 119 Cb -0.05 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.43 1m68 h ALA 119 CO -0.03 0.54 0.05 1.15 0.00 0.00 0.00 179.25 180.96 1m68 h THR 120 N 1.02 1.15 -0.65 0.00 2.02 -0.68 -1.58 112.91 114.20 1m68 h THR 120 Ca 0.26 -0.44 0.09 0.00 0.77 0.00 0.00 66.41 67.09 1m68 h THR 120 Cb -0.02 1.21 -0.07 0.00 -1.74 0.00 0.00 68.15 67.53 1m68 h THR 120 CO -0.05 0.13 0.29 0.40 0.37 0.00 0.00 175.52 176.67 1m68 h ILE 121 N 0.05 0.83 0.00 3.11 2.04 -0.30 -2.65 117.51 120.60 1m68 h ILE 121 Ca 0.04 -0.18 0.00 0.00 1.00 0.00 0.00 64.86 65.73 1m68 h ILE 121 Cb 0.17 0.27 0.00 0.00 -0.74 0.00 0.00 36.82 36.52 1m68 h ILE 121 CO -0.00 0.09 0.00 0.00 0.00 0.00 0.00 178.15 178.24 1m68 h ALA 122 N 1.41 1.00 0.00 1.87 0.00 -0.41 -3.25 119.26 119.87 1m68 h ALA 122 Ca 0.32 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.22 1m68 h ALA 122 Cb 0.34 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.13 1m68 h ALA 122 CO -0.27 0.00 -0.03 0.66 0.00 0.00 0.00 179.25 179.61 1m68 h SER 123 N 0.00 0.00 0.00 0.00 4.64 -0.91 -3.46 113.55 113.83 1m68 h SER 123 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1m68 h SER 123 Cb 0.61 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.70 1m68 h SER 123 CO 0.00 0.03 0.00 0.61 -0.87 0.00 0.00 176.83 176.60 1m68 n GLY 124 N -1.02 2.46 0.66 -0.77 0.00 -1.23 -4.91 105.19 100.38 1m68 n GLY 124 Ca -0.03 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.07 1m68 n GLY 124 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1m68 n ASN 125 N 0.00 1.95 -4.04 1.61 3.02 -1.26 -4.92 115.26 111.62 1m68 n ASN 125 Ca 0.00 -1.89 -0.19 0.00 -0.03 0.00 0.00 54.58 52.47 1m68 n ASN 125 Cb 0.00 -0.20 -0.14 0.00 -0.61 0.00 0.00 39.78 38.82 1m68 n ASN 125 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1m68 s VAL 126 N -1.60 0.74 -0.13 2.41 1.01 -1.26 -4.86 120.40 116.72 1m68 s VAL 126 Ca 0.28 -0.46 0.16 0.00 0.00 0.00 0.00 61.98 61.96 1m68 s VAL 126 Cb 0.15 -0.64 -0.24 0.00 0.00 0.00 0.00 36.38 35.66 1m68 s VAL 126 CO 0.21 0.17 0.38 1.41 0.00 0.00 0.00 175.10 177.27 1m68 n HIS 127 N 2.73 0.47 -3.73 5.22 8.25 -0.12 -4.79 115.22 123.24 1m68 n HIS 127 Ca -0.14 0.17 -0.12 0.00 -0.26 0.00 0.00 57.72 57.37 1m68 n HIS 127 Cb 0.57 -1.05 -0.11 0.00 1.12 0.00 0.00 29.99 30.51 1m68 n HIS 127 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 1m68 s ILE 128 N -2.62 -0.02 -0.30 1.59 1.01 -1.16 -1.13 121.20 118.57 1m68 s ILE 128 Ca -0.07 0.06 -0.14 0.00 0.00 0.00 0.00 60.65 60.50 1m68 s ILE 128 Cb 0.07 -0.51 -0.03 0.00 0.01 0.00 0.00 42.46 42.01 1m68 s ILE 128 CO 0.83 0.02 0.32 -0.63 0.00 0.00 0.00 174.94 175.49 1m68 s ILE 129 N 0.79 5.21 0.49 2.92 -1.09 -0.68 -1.47 121.20 127.37 1m68 s ILE 129 Ca -0.05 0.30 -0.19 0.00 -2.23 0.00 0.00 60.65 58.48 1m68 s ILE 129 Cb -0.06 -3.70 -0.09 0.00 -1.58 0.00 0.00 42.46 37.04 1m68 s ILE 129 CO -0.06 0.10 1.00 -0.94 -1.23 0.00 0.00 174.94 173.81 1m68 s SER 130 N 1.70 6.56 -0.08 3.58 1.04 -0.73 -1.02 113.70 124.75 1m68 s SER 130 Ca 0.12 1.74 -0.02 0.00 0.48 0.00 0.00 55.95 58.27 1m68 s SER 130 Cb -0.16 -2.54 0.00 0.00 0.10 0.00 0.00 66.02 63.43 1m68 s SER 130 CO 0.11 -0.63 0.05 0.00 0.98 0.00 0.00 173.24 173.75 1m68 n HIS 131 N -1.14 -0.11 0.37 5.02 -0.00 -1.26 -4.69 115.22 113.42 1m68 n HIS 131 Ca 0.08 0.02 0.10 0.00 -0.00 0.00 0.00 57.72 57.91 1m68 n HIS 131 Cb 0.53 -0.20 0.43 0.00 -0.00 0.00 0.00 29.99 30.76 1m68 n HIS 131 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 176.34 175.99 1m68 n PRO 132 N -1.10 0.13 -0.06 -1.40 -0.04 -1.26 -2.72 135.00 128.54 1m68 n PRO 132 Ca -0.01 0.42 0.06 0.00 -0.04 0.00 0.00 63.50 63.93 1m68 n PRO 132 Cb 0.04 -1.77 0.27 0.00 -0.04 0.00 0.00 33.50 32.00 1m68 n PRO 132 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1m68 n GLY 133 N -0.26 -0.30 3.63 0.55 0.00 -1.26 -4.87 105.19 102.67 1m68 n GLY 133 Ca 0.02 -0.22 -0.43 0.00 0.00 0.00 0.00 46.02 45.39 1m68 n GLY 133 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1m68 s ASN 134 N -1.28 6.29 0.52 1.61 2.47 -1.10 -3.08 114.94 120.37 1m68 s ASN 134 Ca 0.20 1.88 0.21 0.00 0.42 0.00 0.00 52.86 55.58 1m68 s ASN 134 Cb 0.10 -2.53 1.33 0.00 -1.45 0.00 0.00 41.25 38.70 1m68 s ASN 134 CO 0.16 -1.29 2.05 -0.65 -3.72 0.00 0.00 177.10 173.65 1m68 h PRO 135 N 11.17 0.02 -0.26 0.43 0.11 -1.93 -0.42 132.00 141.12 1m68 h PRO 135 Ca -0.38 -0.00 0.07 0.00 0.11 0.00 0.00 66.00 65.80 1m68 h PRO 135 Cb 1.18 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.27 1m68 h PRO 135 CO 0.98 0.02 0.19 -0.22 -0.21 0.00 0.00 178.00 178.75 1m68 h LYS 136 N 0.02 0.04 -3.56 1.05 3.64 -1.99 -3.31 116.57 112.46 1m68 h LYS 136 Ca 0.16 -0.00 -0.66 0.00 -1.27 0.00 0.00 60.65 58.87 1m68 h LYS 136 Cb 0.60 -0.01 -0.39 0.00 -0.41 0.00 0.00 32.23 32.02 1m68 h LYS 136 CO -0.01 0.03 -0.53 0.71 -2.27 0.00 0.00 179.45 177.38 1m68 s TYR 137 N -5.08 3.31 0.26 1.91 1.51 -0.17 -4.77 117.35 114.31 1m68 s TYR 137 Ca -0.05 -2.98 -0.30 0.00 -1.01 0.00 0.00 57.07 52.73 1m68 s TYR 137 Cb 0.18 -2.98 -0.10 0.00 -0.11 0.00 0.00 41.96 38.96 1m68 s TYR 137 CO 0.70 -0.80 1.34 -2.00 -1.11 0.00 0.00 175.55 173.68 1m68 s GLU 138 N -0.11 4.35 0.09 -0.62 2.12 -1.25 -4.75 118.70 118.54 1m68 s GLU 138 Ca 0.16 2.16 -0.07 0.00 0.36 0.00 0.00 54.97 57.59 1m68 s GLU 138 Cb -0.23 -3.13 -0.01 0.00 0.26 0.00 0.00 34.13 31.01 1m68 s GLU 138 CO -0.02 -0.26 0.15 0.96 -0.54 0.00 0.00 175.26 175.55 1m68 s ILE 139 N -0.34 0.15 -0.79 -3.70 -4.36 -1.26 -4.37 121.20 106.52 1m68 s ILE 139 Ca 0.55 -1.35 -0.26 0.00 -0.26 0.00 0.00 60.65 59.32 1m68 s ILE 139 Cb -0.39 -1.46 0.03 0.00 1.25 0.00 0.00 42.46 41.89 1m68 s ILE 139 CO 0.44 -0.67 1.37 -0.62 0.24 0.00 0.00 174.94 175.70 1m68 s ASP 140 N -2.89 6.15 0.09 4.36 -1.08 -1.26 -4.92 116.67 117.11 1m68 s ASP 140 Ca 0.08 -0.60 -0.32 0.00 -0.52 0.00 0.00 52.55 51.19 1m68 s ASP 140 Cb 0.05 -2.56 -0.15 0.00 -1.46 0.00 0.00 42.92 38.80 1m68 s ASP 140 CO -0.09 -1.83 1.61 0.58 0.52 0.00 0.00 175.17 175.96 1m68 h VAL 141 N 6.26 0.26 -0.75 1.11 2.07 -1.98 -1.26 116.25 121.96 1m68 h VAL 141 Ca -0.18 0.00 0.12 0.00 0.82 0.00 0.00 66.70 67.46 1m68 h VAL 141 Cb 1.05 0.26 -0.08 0.00 -1.52 0.00 0.00 31.29 30.99 1m68 h VAL 141 CO 1.30 0.00 0.35 0.50 0.02 0.00 0.00 177.57 179.74 1m68 h LYS 142 N -0.81 0.53 -0.71 1.57 3.64 -1.92 0.10 116.57 118.96 1m68 h LYS 142 Ca -0.04 -0.03 -0.03 0.00 -1.27 0.00 0.00 60.65 59.27 1m68 h LYS 142 Cb 0.70 -0.12 -0.03 0.00 -0.41 0.00 0.00 32.23 32.37 1m68 h LYS 142 CO -0.01 0.35 0.32 0.00 -2.27 0.00 0.00 179.45 177.84 1m68 h ALA 143 N 1.50 0.93 -0.25 5.00 0.00 -1.91 -0.77 119.26 123.76 1m68 h ALA 143 Ca 0.39 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 55.12 1m68 h ALA 143 Cb 0.52 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 1m68 h ALA 143 CO -0.34 0.52 0.06 0.28 0.00 0.00 0.00 179.25 179.77 1m68 h VAL 144 N 1.01 1.21 -0.46 0.00 2.07 -0.02 -1.29 116.25 118.77 1m68 h VAL 144 Ca 0.24 -0.68 0.01 0.00 0.82 0.00 0.00 66.70 67.09 1m68 h VAL 144 Cb 0.16 1.19 -0.02 0.00 -1.52 0.00 0.00 31.29 31.10 1m68 h VAL 144 CO -0.03 0.22 0.30 0.00 0.02 0.00 0.00 177.57 178.08 1m68 h ALA 145 N 0.88 0.58 -0.49 1.67 0.00 -0.62 0.17 119.26 121.46 1m68 h ALA 145 Ca 0.08 -0.03 0.01 0.00 0.00 0.00 0.00 54.91 54.97 1m68 h ALA 145 Cb 0.27 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 1m68 h ALA 145 CO 0.00 0.02 0.31 0.93 0.00 0.00 0.00 179.25 180.52 1m68 h GLU 146 N 0.61 0.62 -0.78 0.00 5.08 -1.05 0.23 114.58 119.28 1m68 h GLU 146 Ca 0.17 -0.04 -0.03 0.00 -1.00 0.00 0.00 59.36 58.46 1m68 h GLU 146 Cb -0.06 -0.14 -0.04 0.00 0.50 0.00 0.00 28.75 29.01 1m68 h GLU 146 CO -0.04 0.41 0.39 0.00 -1.00 0.00 0.00 179.01 178.76 1m68 h ALA 147 N 1.19 1.01 -0.70 3.43 0.00 -0.58 -0.97 119.26 122.64 1m68 h ALA 147 Ca 0.18 -0.15 -0.04 0.00 0.00 0.00 0.00 54.91 54.90 1m68 h ALA 147 Cb -0.05 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 17.40 1m68 h ALA 147 CO -0.05 0.57 0.27 0.00 0.00 0.00 0.00 179.25 180.03 1m68 h ALA 148 N 1.20 1.15 -0.37 0.00 0.00 0.43 0.10 119.26 121.77 1m68 h ALA 148 Ca 0.27 -0.19 -0.08 0.00 0.00 0.00 0.00 54.91 54.91 1m68 h ALA 148 Cb 0.11 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 1m68 h ALA 148 CO -0.04 0.61 -0.09 0.00 0.00 0.00 0.00 179.25 179.73 1m68 h ALA 149 N 1.27 0.51 -0.44 0.00 0.00 -0.16 0.85 119.26 121.28 1m68 h ALA 149 Ca 0.24 -0.31 -0.09 0.00 0.00 0.00 0.00 54.91 54.75 1m68 h ALA 149 Cb 0.21 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 1m68 h ALA 149 CO -0.02 0.36 -0.07 -0.22 0.00 0.00 0.00 179.25 179.30 1m68 h LYS 150 N 0.51 0.83 -0.31 0.00 3.64 -0.79 -2.96 116.57 117.49 1m68 h LYS 150 Ca 0.09 -0.30 0.00 0.00 -1.27 0.00 0.00 60.65 59.17 1m68 h LYS 150 Cb 0.61 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.37 1m68 h LYS 150 CO 0.04 0.93 0.00 0.72 -2.27 0.00 0.00 179.45 178.87 1m68 n HIS 151 N -4.31 0.40 -3.66 1.91 8.25 0.32 -4.93 115.22 113.20 1m68 n HIS 151 Ca -0.00 -0.20 -0.25 0.00 -0.26 0.00 0.00 57.72 57.00 1m68 n HIS 151 Cb 0.35 0.00 0.07 0.00 1.12 0.00 0.00 29.99 31.53 1m68 n HIS 151 CO 0.00 0.00 0.00 1.04 0.64 0.00 0.00 176.34 178.02 1m68 n GLN 152 N 0.59 -7.43 -4.24 -0.41 6.02 -0.34 -5.01 117.38 106.56 1m68 n GLN 152 Ca 0.15 0.78 -0.35 0.00 -0.01 0.00 0.00 57.00 57.57 1m68 n GLN 152 Cb 0.36 -5.80 -0.09 0.00 1.02 0.00 0.00 30.24 25.73 1m68 n GLN 152 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 1m68 s VAL 153 N -3.32 4.61 0.30 5.09 1.01 0.15 -4.96 120.40 123.28 1m68 s VAL 153 Ca 0.59 -0.13 -0.17 0.00 0.00 0.00 0.00 61.98 62.27 1m68 s VAL 153 Cb -0.27 -2.97 -0.09 0.00 0.00 0.00 0.00 36.38 33.05 1m68 s VAL 153 CO 0.75 0.60 0.75 0.00 0.00 0.00 0.00 175.10 177.20 1m68 s ALA 154 N -0.81 3.33 -0.18 5.51 0.00 -0.28 -4.42 121.76 124.90 1m68 s ALA 154 Ca 0.13 0.11 -0.08 0.00 0.00 0.00 0.00 51.96 52.11 1m68 s ALA 154 Cb -0.12 -2.81 -0.04 0.00 0.00 0.00 0.00 23.12 20.15 1m68 s ALA 154 CO 0.03 0.32 0.09 -0.51 0.00 0.00 0.00 175.76 175.69 1m68 s LEU 155 N -2.68 4.01 0.27 0.00 1.43 -0.79 -1.69 118.68 119.23 1m68 s LEU 155 Ca 0.51 0.17 -0.29 0.00 -1.03 0.00 0.00 54.13 53.49 1m68 s LEU 155 Cb -0.12 -2.02 -0.09 0.00 0.03 0.00 0.00 46.19 43.98 1m68 s LEU 155 CO 0.18 0.19 1.23 -0.70 0.23 0.00 0.00 176.35 177.48 1m68 s GLU 156 N 0.26 4.47 -0.30 1.70 2.12 -0.19 -2.40 118.70 124.37 1m68 s GLU 156 Ca 0.06 2.01 -0.07 0.00 0.36 0.00 0.00 54.97 57.32 1m68 s GLU 156 Cb -0.12 -3.16 0.01 0.00 0.26 0.00 0.00 34.13 31.13 1m68 s GLU 156 CO -0.01 -0.06 0.10 0.42 -0.54 0.00 0.00 175.26 175.17 1m68 s ILE 157 N -0.73 4.07 -0.25 -3.70 -1.09 -0.37 -4.47 121.20 114.66 1m68 s ILE 157 Ca 0.50 -0.69 -0.08 0.00 -2.23 0.00 0.00 60.65 58.14 1m68 s ILE 157 Cb -0.36 -3.12 -0.04 0.00 -1.58 0.00 0.00 42.46 37.37 1m68 s ILE 157 CO 0.44 0.05 0.10 0.21 -1.23 0.00 0.00 174.94 174.51 1m68 s ASN 158 N 1.51 5.43 0.01 3.58 3.84 -1.26 -3.08 114.94 124.97 1m68 s ASN 158 Ca 0.03 -0.12 -0.25 0.00 0.21 0.00 0.00 52.86 52.72 1m68 s ASN 158 Cb -0.17 -1.98 -0.19 0.00 -0.55 0.00 0.00 41.25 38.36 1m68 s ASN 158 CO 0.03 -0.02 1.38 -1.13 -2.79 0.00 0.00 177.10 174.57 1m68 h ASN 159 N 8.13 0.02 -1.41 -4.21 -1.24 -1.42 -2.82 115.58 112.62 1m68 h ASN 159 Ca -0.37 -0.38 0.41 0.00 0.71 0.00 0.00 56.30 56.67 1m68 h ASN 159 Cb 1.18 -0.00 -0.06 0.00 0.73 0.00 0.00 38.32 40.17 1m68 h ASN 159 CO 0.58 0.39 1.08 -1.28 -1.29 0.00 0.00 177.43 176.92 1m68 h SER 160 N -0.36 0.00 0.00 1.15 0.87 -1.62 -3.47 113.55 110.12 1m68 h SER 160 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 1m68 h SER 160 Cb 0.38 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.34 1m68 h SER 160 CO 0.00 0.00 0.00 -1.20 -0.53 0.00 0.00 176.83 175.10 1m68 n SER 161 N -3.94 0.00 -0.02 6.23 7.64 -1.07 -5.12 113.62 117.34 1m68 n SER 161 Ca 0.31 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.19 1m68 n SER 161 Cb 1.53 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 64.73 1m68 n SER 161 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1m68 n ASN 172 N 0.00 0.00 0.10 6.43 3.02 -1.18 -5.13 115.26 118.51 1m68 n ASN 172 Ca 0.00 0.00 -0.01 0.00 -0.03 0.00 0.00 54.58 54.54 1m68 n ASN 172 Cb 0.00 -0.11 0.26 0.00 -0.61 0.00 0.00 39.78 39.32 1m68 n ASN 172 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1m68 h ARG 174 N 0.20 0.93 -0.65 0.00 3.08 -1.98 -1.13 114.38 114.83 1m68 h ARG 174 Ca 0.02 -0.25 -0.01 0.00 0.07 0.00 0.00 59.98 59.81 1m68 h ARG 174 Cb 0.72 -0.11 -0.03 0.00 0.08 0.00 0.00 29.97 30.63 1m68 h ARG 174 CO 0.05 0.90 0.36 1.49 -1.07 0.00 0.00 179.97 181.69 1m68 h GLU 175 N 0.82 0.91 -0.36 0.04 4.81 -1.92 -0.64 114.58 118.24 1m68 h GLU 175 Ca 0.17 -0.11 -0.01 0.00 -0.13 0.00 0.00 59.36 59.28 1m68 h GLU 175 Cb 0.42 -0.18 -0.02 0.00 0.63 0.00 0.00 28.75 29.61 1m68 h GLU 175 CO 0.01 0.69 0.18 0.28 -0.73 0.00 0.00 179.01 179.44 1m68 h VAL 176 N 0.89 1.16 -0.23 0.32 2.07 -1.26 0.10 116.25 119.30 1m68 h VAL 176 Ca 0.23 -0.46 -0.05 0.00 0.82 0.00 0.00 66.70 67.24 1m68 h VAL 176 Cb 0.04 0.80 -0.01 0.00 -1.52 0.00 0.00 31.29 30.61 1m68 h VAL 176 CO -0.04 0.17 -0.06 0.00 0.02 0.00 0.00 177.57 177.66 1m68 h ALA 177 N 1.03 0.32 -0.59 1.67 0.00 -0.90 0.13 119.26 120.92 1m68 h ALA 177 Ca 0.12 -0.27 -0.08 0.00 0.00 0.00 0.00 54.91 54.68 1m68 h ALA 177 Cb 0.11 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 1m68 h ALA 177 CO -0.02 0.12 0.03 0.00 0.00 0.00 0.00 179.25 179.39 1m68 h ALA 178 N 0.75 0.95 -0.44 0.00 0.00 -1.07 -0.55 119.26 118.90 1m68 h ALA 178 Ca 0.06 -0.29 0.02 0.00 0.00 0.00 0.00 54.91 54.70 1m68 h ALA 178 Cb 0.53 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.07 1m68 h ALA 178 CO 0.02 0.64 0.27 0.00 0.00 0.00 0.00 179.25 180.18 1m68 h ALA 179 N 1.10 0.55 -0.27 0.00 0.00 -0.31 -1.99 119.26 118.34 1m68 h ALA 179 Ca 0.17 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.99 1m68 h ALA 179 Cb 0.49 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 1m68 h ALA 179 CO 0.02 -0.05 -0.17 0.28 0.00 0.00 0.00 179.25 179.33 1m68 h VAL 180 N 0.54 1.24 -0.54 0.00 2.07 -0.47 -1.03 116.25 118.06 1m68 h VAL 180 Ca 0.17 -1.10 0.08 0.00 0.82 0.00 0.00 66.70 66.67 1m68 h VAL 180 Cb -0.01 1.23 -0.07 0.00 -1.52 0.00 0.00 31.29 30.93 1m68 h VAL 180 CO -0.07 0.36 0.18 -0.09 0.02 0.00 0.00 177.57 177.97 1m68 h ARG 181 N 0.43 0.34 0.09 1.57 2.43 -0.53 -1.76 114.38 116.95 1m68 h ARG 181 Ca 0.07 -0.02 -0.28 0.00 -0.81 0.00 0.00 59.98 58.95 1m68 h ARG 181 Cb 0.55 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 30.02 1m68 h ARG 181 CO 0.04 0.22 -1.35 -0.44 -1.51 0.00 0.00 179.97 176.93 1m68 h ASP 182 N 0.35 0.30 0.84 -3.80 3.32 -0.94 -3.27 116.42 113.22 1m68 h ASP 182 Ca 0.27 -0.37 -0.06 0.00 0.02 0.00 0.00 57.03 56.90 1m68 h ASP 182 Cb 0.32 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 39.77 1m68 h ASP 182 CO -0.29 1.30 -0.26 0.00 -1.72 0.00 0.00 179.24 178.27 1m68 h ALA 183 N 0.66 1.04 0.00 3.45 0.00 -1.18 -3.47 119.26 119.76 1m68 h ALA 183 Ca -0.17 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.50 1m68 h ALA 183 Cb 1.96 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.70 1m68 h ALA 183 CO 0.16 0.33 0.00 0.41 0.00 0.00 0.00 179.25 180.15 1m68 n GLY 184 N 0.09 0.81 2.07 0.00 0.00 -0.68 -4.87 105.19 102.61 1m68 n GLY 184 Ca -0.00 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.86 1m68 n GLY 184 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1m68 n GLY 185 N -2.27 -1.23 3.85 -0.02 0.00 -1.10 -4.97 105.19 99.44 1m68 n GLY 185 Ca 0.00 -1.71 -0.36 0.00 0.00 0.00 0.00 46.02 43.96 1m68 n GLY 185 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1m68 s TRP 186 N -2.50 3.63 -0.07 1.61 0.52 -1.26 -4.84 118.94 116.03 1m68 s TRP 186 Ca 0.40 0.96 0.00 0.00 0.02 0.00 0.00 56.10 57.49 1m68 s TRP 186 Cb -0.01 -2.29 -0.03 0.00 -1.15 0.00 0.00 33.47 29.99 1m68 s TRP 186 CO 0.28 0.51 -0.04 0.14 0.02 0.00 0.00 176.95 177.86 1m68 s VAL 187 N -1.35 3.91 -0.05 4.03 -7.23 -0.40 -1.88 120.40 117.43 1m68 s VAL 187 Ca 0.33 -0.43 0.04 0.00 -1.81 0.00 0.00 61.98 60.11 1m68 s VAL 187 Cb -0.15 -2.63 -0.03 0.00 0.56 0.00 0.00 36.38 34.13 1m68 s VAL 187 CO 0.18 0.58 -0.15 0.00 -0.31 0.00 0.00 175.10 175.39 1m68 s ALA 188 N -0.86 2.63 -0.15 1.32 0.00 -1.01 -0.89 121.76 122.80 1m68 s ALA 188 Ca 0.13 -0.99 -0.08 0.00 0.00 0.00 0.00 51.96 51.03 1m68 s ALA 188 Cb -0.11 -0.94 -0.04 0.00 0.00 0.00 0.00 23.12 22.02 1m68 s ALA 188 CO 0.03 0.55 0.12 -0.51 0.00 0.00 0.00 175.76 175.95 1m68 s LEU 189 N -0.70 4.25 -0.03 0.00 1.43 -1.26 -1.23 118.68 121.13 1m68 s LEU 189 Ca 0.11 0.34 -0.01 0.00 -1.03 0.00 0.00 54.13 53.54 1m68 s LEU 189 Cb -0.11 -2.06 0.03 0.00 0.03 0.00 0.00 46.19 44.08 1m68 s LEU 189 CO 0.00 0.31 0.06 -0.83 0.23 0.00 0.00 176.35 176.12 1m68 s GLY 190 N -0.41 0.05 0.37 -3.19 0.00 -1.18 -3.59 107.32 99.38 1m68 s GLY 190 Ca 0.11 0.36 0.20 0.00 0.00 0.00 0.00 44.72 45.39 1m68 s GLY 190 CO 0.01 0.67 1.64 1.48 0.00 0.00 0.00 173.10 176.90 1m68 h SER 191 N 7.10 0.00 -6.32 1.64 4.64 -1.85 -1.24 113.55 117.52 1m68 h SER 191 Ca -0.42 0.00 -0.48 0.00 -0.47 0.00 0.00 61.79 60.42 1m68 h SER 191 Cb 1.14 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 63.19 1m68 h SER 191 CO 0.47 0.32 -0.77 -0.67 -0.87 0.00 0.00 176.83 175.31 1m68 n ASP 192 N -3.28 -4.48 -4.73 4.97 2.03 0.01 -2.09 116.55 108.96 1m68 n ASP 192 Ca 0.01 -0.80 -0.42 0.00 0.52 0.00 0.00 54.79 54.11 1m68 n ASP 192 Cb 0.57 -3.82 -0.02 0.00 -0.72 0.00 0.00 41.12 37.13 1m68 n ASP 192 CO 0.00 0.00 0.00 -1.20 -1.92 0.00 0.00 177.20 174.08 1m68 n SER 193 N -2.84 3.66 -0.15 1.67 7.64 -1.17 -4.80 113.62 117.63 1m68 n SER 193 Ca 0.02 1.15 0.06 0.00 1.01 0.00 0.00 58.87 61.11 1m68 n SER 193 Cb 0.53 -1.57 -0.04 0.00 -1.01 0.00 0.00 64.21 62.13 1m68 n SER 193 CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 1m68 n HIS 194 N 2.01 0.00 -4.27 1.43 8.25 -1.26 -1.13 115.22 120.25 1m68 n HIS 194 Ca 0.09 0.00 -0.15 0.00 -0.26 0.00 0.00 57.72 57.40 1m68 n HIS 194 Cb 0.36 0.00 -0.10 0.00 1.12 0.00 0.00 29.99 31.37 1m68 n HIS 194 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 1m68 s THR 195 N -1.96 1.30 -0.78 1.59 -4.23 -1.26 -1.02 115.64 109.27 1m68 s THR 195 Ca 0.08 -2.09 0.20 0.00 -1.18 0.00 0.00 61.69 58.70 1m68 s THR 195 Cb 0.10 -1.88 0.19 0.00 1.34 0.00 0.00 72.50 72.25 1m68 s THR 195 CO 0.44 -0.71 1.62 0.00 -0.54 0.00 0.00 174.62 175.43 1m68 n ALA 196 N -0.22 1.76 0.23 3.99 0.00 -1.26 -3.33 120.51 121.68 1m68 n ALA 196 Ca -0.10 -0.00 0.09 0.00 0.00 0.00 0.00 53.44 53.43 1m68 n ALA 196 Cb 0.60 -1.33 0.58 0.00 0.00 0.00 0.00 19.45 19.30 1m68 n ALA 196 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.50 178.24 1m68 h PHE 197 N 0.00 0.00 -0.50 0.00 0.04 -1.96 -2.24 116.94 112.29 1m68 h PHE 197 Ca 0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 1m68 h PHE 197 Cb 0.35 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.50 1m68 h PHE 197 CO 0.00 0.20 0.00 0.25 -0.60 0.00 0.00 178.31 178.16 1m68 n THR 198 N -3.84 0.66 -1.65 -1.55 -2.24 -1.21 -4.97 114.28 99.47 1m68 n THR 198 Ca -0.02 -0.76 -0.45 0.00 -2.27 0.00 0.00 64.05 60.54 1m68 n THR 198 Cb 0.30 0.63 -0.03 0.00 -2.10 0.00 0.00 70.33 69.13 1m68 n THR 198 CO 0.00 0.00 0.00 0.80 -0.57 0.00 0.00 175.07 175.30 1m68 n MET 199 N 1.32 1.82 -0.96 -0.78 0.00 -0.84 -1.40 117.12 116.28 1m68 n MET 199 Ca 0.20 0.65 0.00 0.00 0.00 0.00 0.00 57.70 58.55 1m68 n MET 199 Cb 0.55 -2.25 0.00 0.00 0.00 0.00 0.00 33.22 31.51 1m68 n MET 199 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1m68 n GLY 200 N 1.98 0.39 3.43 -5.12 0.00 -1.26 -4.95 105.19 99.65 1m68 n GLY 200 Ca 0.12 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.70 1m68 n GLY 200 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1m68 s GLU 201 N -0.66 3.11 -0.01 1.61 2.02 -0.49 -4.85 118.70 119.42 1m68 s GLU 201 Ca 0.00 -0.98 0.05 0.00 0.02 0.00 0.00 54.97 54.06 1m68 s GLU 201 Cb 0.00 -4.20 0.13 0.00 0.10 0.00 0.00 34.13 30.16 1m68 s GLU 201 CO 0.00 -1.56 1.10 1.19 0.02 0.00 0.00 175.26 176.01 1m68 n PHE 202 N 6.84 0.18 -0.25 1.61 3.72 -1.26 -4.74 117.46 123.56 1m68 n PHE 202 Ca -0.06 -0.54 0.01 0.00 -0.05 0.00 0.00 57.45 56.81 1m68 n PHE 202 Cb 0.44 -0.06 0.08 0.00 -0.94 0.00 0.00 39.48 39.01 1m68 n PHE 202 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 176.76 177.64 1m68 h GLU 203 N 0.71 -0.00 -0.44 -1.08 5.08 -1.99 0.10 114.58 116.95 1m68 h GLU 203 Ca 0.00 0.00 -0.12 0.00 -1.00 0.00 0.00 59.36 58.25 1m68 h GLU 203 Cb 0.63 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.87 1m68 h GLU 203 CO 0.01 -0.00 -0.17 0.93 -1.00 0.00 0.00 179.01 178.77 1m68 h GLU 204 N -0.00 0.90 -0.35 2.33 5.08 -1.94 -2.43 114.58 118.17 1m68 h GLU 204 Ca 0.34 -0.38 0.06 0.00 -1.00 0.00 0.00 59.36 58.39 1m68 h GLU 204 Cb 0.53 -0.03 -0.06 0.00 0.50 0.00 0.00 28.75 29.69 1m68 h GLU 204 CO -0.74 1.03 0.00 0.00 -1.00 0.00 0.00 179.01 178.30 1m68 h LEU 206 N 0.10 0.67 -0.18 0.00 3.38 -0.50 -1.34 115.31 117.44 1m68 h LEU 206 Ca 0.17 0.01 -0.03 0.00 0.09 0.00 0.00 57.88 58.12 1m68 h LEU 206 Cb 0.23 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 1m68 h LEU 206 CO -0.28 0.41 -0.01 0.11 0.09 0.00 0.00 178.44 178.76 1m68 h LYS 207 N 0.75 0.32 -0.54 1.13 1.57 -0.91 -1.32 116.57 117.57 1m68 h LYS 207 Ca 0.35 -0.11 0.11 0.00 -1.87 0.00 0.00 60.65 59.12 1m68 h LYS 207 Cb 0.37 -0.03 -0.09 0.00 0.08 0.00 0.00 32.23 32.56 1m68 h LYS 207 CO -0.13 0.55 0.01 0.82 -0.57 0.00 0.00 179.45 180.13 1m68 h ILE 208 N 0.06 0.57 -0.48 1.86 2.04 -0.91 0.43 117.51 121.08 1m68 h ILE 208 Ca 0.05 -0.04 -0.06 0.00 1.00 0.00 0.00 64.86 65.81 1m68 h ILE 208 Cb 0.41 0.44 -0.02 0.00 -0.74 0.00 0.00 36.82 36.91 1m68 h ILE 208 CO 0.01 0.02 0.06 -0.07 0.00 0.00 0.00 178.15 178.17 1m68 h LEU 209 N 0.12 0.72 -0.34 1.44 3.38 -1.05 -2.65 115.31 116.92 1m68 h LEU 209 Ca 0.28 -0.15 -0.08 0.00 0.09 0.00 0.00 57.88 58.02 1m68 h LEU 209 Cb 0.42 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.98 1m68 h LEU 209 CO -0.45 0.75 -0.12 -0.78 0.09 0.00 0.00 178.44 177.93 1m68 h ASP 210 N 0.72 0.70 0.00 -0.43 3.58 -0.20 -0.81 116.42 119.98 1m68 h ASP 210 Ca 0.15 -0.38 0.00 0.00 0.42 0.00 0.00 57.03 57.22 1m68 h ASP 210 Cb 0.36 -0.19 0.00 0.00 1.72 0.00 0.00 39.33 41.22 1m68 h ASP 210 CO 0.01 0.92 0.14 0.00 -2.88 0.00 0.00 179.24 177.43 1m68 h ALA 211 N 0.80 1.10 -0.03 -0.78 0.00 -0.59 -1.25 119.26 118.50 1m68 h ALA 211 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1m68 h ALA 211 Cb 0.63 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.42 1m68 h ALA 211 CO 0.04 -0.10 0.00 1.33 0.00 0.00 0.00 179.25 180.52 1m68 n VAL 212 N -2.30 0.41 -3.71 0.00 0.24 -1.01 -5.00 118.33 106.95 1m68 n VAL 212 Ca -0.01 -0.70 -0.25 0.00 -2.04 0.00 0.00 64.34 61.33 1m68 n VAL 212 Cb 0.17 0.83 0.03 0.00 -1.47 0.00 0.00 33.84 33.40 1m68 n VAL 212 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 1m68 n ASP 213 N -0.03 -2.72 -4.77 -1.34 8.00 -0.47 -4.94 116.55 110.28 1m68 n ASP 213 Ca 0.02 -0.92 -0.41 0.00 0.71 0.00 0.00 54.79 54.20 1m68 n ASP 213 Cb 0.15 -3.71 -0.02 0.00 -0.02 0.00 0.00 41.12 37.52 1m68 n ASP 213 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 1m68 s PHE 214 N -3.65 3.04 -0.01 1.24 2.19 -0.36 -4.95 117.98 115.48 1m68 s PHE 214 Ca 0.19 1.35 -0.30 0.00 0.33 0.00 0.00 56.93 58.50 1m68 s PHE 214 Cb -0.06 -3.70 -0.06 0.00 -1.31 0.00 0.00 43.02 37.89 1m68 s PHE 214 CO 0.84 -1.98 1.52 -2.14 1.83 0.00 0.00 175.22 175.29 1m68 s PRO 215 N -1.55 4.23 0.45 10.12 0.02 -1.26 -4.89 135.00 142.12 1m68 s PRO 215 Ca 0.51 2.09 0.13 0.00 0.02 0.00 0.00 61.00 63.74 1m68 s PRO 215 Cb -0.40 -3.71 1.04 0.00 0.02 0.00 0.00 34.50 31.45 1m68 s PRO 215 CO 0.51 -0.70 2.04 -1.35 -0.33 0.00 0.00 177.00 177.18 1m68 h PRO 216 N 8.46 0.35 0.00 5.54 0.11 -1.98 -1.33 132.00 143.15 1m68 h PRO 216 Ca -0.38 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.70 1m68 h PRO 216 Cb 1.18 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.21 1m68 h PRO 216 CO 0.93 0.23 0.16 1.05 -0.21 0.00 0.00 178.00 180.16 1m68 h GLU 217 N 0.36 0.00 -0.34 1.05 9.09 -2.03 -1.90 114.58 120.81 1m68 h GLU 217 Ca 0.18 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.59 1m68 h GLU 217 Cb 0.25 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.35 1m68 h GLU 217 CO -0.04 0.00 0.00 0.54 0.05 0.00 0.00 179.01 179.56 1m68 n ARG 218 N -2.74 3.29 -3.37 1.06 1.74 -0.50 -4.89 116.66 111.25 1m68 n ARG 218 Ca -0.02 -2.84 -0.41 0.00 -0.77 0.00 0.00 57.85 53.80 1m68 n ARG 218 Cb 0.21 -1.88 -0.09 0.00 -1.02 0.00 0.00 32.46 29.68 1m68 n ARG 218 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1m68 s ILE 219 N -2.65 5.13 0.37 0.55 1.01 -0.72 -1.28 121.20 123.63 1m68 s ILE 219 Ca 0.43 -0.02 0.10 0.00 0.00 0.00 0.00 60.65 61.16 1m68 s ILE 219 Cb 0.34 -3.89 0.32 0.00 0.01 0.00 0.00 42.46 39.24 1m68 s ILE 219 CO 0.11 -0.19 1.90 -0.07 0.00 0.00 0.00 174.94 176.70 1m68 h LEU 220 N 8.86 0.59 0.00 2.97 3.38 -1.34 -3.00 115.31 126.77 1m68 h LEU 220 Ca -0.29 0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.71 1m68 h LEU 220 Cb 1.13 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.79 1m68 h LEU 220 CO 0.73 0.32 0.00 0.59 0.09 0.00 0.00 178.44 180.17 1m68 n ASN 221 N -4.52 0.00 -0.27 -0.43 4.13 -1.26 -3.63 115.26 109.27 1m68 n ASN 221 Ca 0.15 -0.41 0.11 0.00 1.68 0.00 0.00 54.58 56.10 1m68 n ASN 221 Cb 0.43 -0.12 0.35 0.00 -1.54 0.00 0.00 39.78 38.90 1m68 n ASN 221 CO 0.00 0.00 0.00 0.58 0.28 0.00 0.00 177.26 178.12 1m68 h VAL 222 N 0.00 0.87 -2.79 2.41 2.07 -1.88 -3.31 116.25 113.61 1m68 h VAL 222 Ca 0.00 -0.26 -0.06 0.00 0.82 0.00 0.00 66.70 67.20 1m68 h VAL 222 Cb 0.08 0.06 -0.16 0.00 -1.52 0.00 0.00 31.29 29.75 1m68 h VAL 222 CO 0.00 0.14 0.03 -0.94 0.02 0.00 0.00 177.57 176.81 1m68 s SER 223 N -5.82 -0.43 0.23 0.57 1.04 -1.25 -4.54 113.70 103.50 1m68 s SER 223 Ca -0.10 0.16 -0.06 0.00 0.48 0.00 0.00 55.95 56.43 1m68 s SER 223 Cb 0.22 0.49 0.34 0.00 0.10 0.00 0.00 66.02 67.16 1m68 s SER 223 CO 0.79 -0.72 1.79 -0.65 0.98 0.00 0.00 173.24 175.43 1m68 h PRO 224 N 2.80 0.63 -0.72 4.02 0.11 -1.88 -2.52 132.00 134.45 1m68 h PRO 224 Ca -0.31 -0.04 -0.06 0.00 0.11 0.00 0.00 66.00 65.71 1m68 h PRO 224 Cb 1.21 -0.14 -0.03 0.00 0.11 0.00 0.00 31.00 32.15 1m68 h PRO 224 CO 0.41 0.42 0.22 -0.09 -0.21 0.00 0.00 178.00 178.75 1m68 h ARG 225 N 0.65 1.12 -0.56 1.05 9.65 -1.95 0.23 114.38 124.57 1m68 h ARG 225 Ca 0.36 -0.24 -0.02 0.00 -1.10 0.00 0.00 59.98 58.98 1m68 h ARG 225 Cb 0.35 -0.16 -0.03 0.00 -1.39 0.00 0.00 29.97 28.74 1m68 h ARG 225 CO -0.26 0.96 0.28 -0.09 2.80 0.00 0.00 179.97 183.67 1m68 h ARG 226 N 1.06 0.80 -0.28 0.20 2.43 -1.80 0.47 114.38 117.27 1m68 h ARG 226 Ca 0.23 -0.11 -0.04 0.00 -0.81 0.00 0.00 59.98 59.25 1m68 h ARG 226 Cb 0.31 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 29.70 1m68 h ARG 226 CO -0.01 0.65 0.01 1.25 -1.51 0.00 0.00 179.97 180.36 1m68 h LEU 227 N 0.76 0.48 -1.05 3.80 7.12 -0.97 -2.29 115.31 123.16 1m68 h LEU 227 Ca 0.19 -0.30 -0.09 0.00 0.13 0.00 0.00 57.88 57.81 1m68 h LEU 227 Cb 0.10 -0.13 -0.01 0.00 -0.53 0.00 0.00 40.66 40.09 1m68 h LEU 227 CO -0.03 0.66 -0.34 -0.07 -0.13 0.00 0.00 178.44 178.53 1m68 h LEU 228 N 0.28 0.25 -0.97 2.25 3.38 -0.27 -2.16 115.31 118.08 1m68 h LEU 228 Ca 0.08 -0.09 0.01 0.00 0.09 0.00 0.00 57.88 57.97 1m68 h LEU 228 Cb 0.41 -0.07 -0.05 0.00 0.09 0.00 0.00 40.66 41.04 1m68 h LEU 228 CO 0.01 0.58 0.63 0.78 0.09 0.00 0.00 178.44 180.53 1m68 h ASN 229 N 0.21 1.12 -0.29 -0.43 2.35 0.11 -1.25 115.58 117.41 1m68 h ASN 229 Ca 0.03 -0.04 -0.01 0.00 -0.55 0.00 0.00 56.30 55.73 1m68 h ASN 229 Cb 0.71 -0.28 -0.01 0.00 0.05 0.00 0.00 38.32 38.78 1m68 h ASN 229 CO 0.05 0.82 0.14 0.15 -1.65 0.00 0.00 177.43 176.94 1m68 h PHE 230 N 1.32 0.41 -0.86 1.19 3.57 -0.89 0.24 116.94 121.92 1m68 h PHE 230 Ca 0.35 -0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.84 1m68 h PHE 230 Cb -0.14 -0.13 -0.04 0.00 2.79 0.00 0.00 35.95 38.43 1m68 h PHE 230 CO -0.00 0.37 0.54 -0.07 -2.23 0.00 0.00 178.31 176.92 1m68 h LEU 231 N 0.33 1.01 -0.38 0.59 3.38 -1.11 -0.98 115.31 118.16 1m68 h LEU 231 Ca 0.10 -0.05 -0.01 0.00 0.09 0.00 0.00 57.88 58.01 1m68 h LEU 231 Cb 0.11 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.59 1m68 h LEU 231 CO -0.01 0.76 0.19 -0.33 0.09 0.00 0.00 178.44 179.14 1m68 h GLU 232 N 1.17 0.53 -0.71 1.13 5.08 -0.88 -0.59 114.58 120.31 1m68 h GLU 232 Ca 0.31 -0.07 0.15 0.00 -1.00 0.00 0.00 59.36 58.75 1m68 h GLU 232 Cb -0.09 -0.10 -0.04 0.00 0.50 0.00 0.00 28.75 29.02 1m68 h GLU 232 CO -0.06 0.46 0.48 0.66 -1.00 0.00 0.00 179.01 179.55 1m68 h SER 233 N 0.47 0.32 0.20 1.42 4.64 -0.03 0.50 113.55 121.07 1m68 h SER 233 Ca 0.13 0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.47 1m68 h SER 233 Cb 0.09 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 62.13 1m68 h SER 233 CO -0.02 0.17 -0.03 0.54 -0.87 0.00 0.00 176.83 176.62 1m68 n ARG 234 N -4.46 0.90 0.00 4.77 5.12 -0.30 -4.88 116.66 117.82 1m68 n ARG 234 Ca 0.13 -0.20 0.00 0.00 -1.93 0.00 0.00 57.85 55.85 1m68 n ARG 234 Cb 0.54 -1.50 0.00 0.00 -1.16 0.00 0.00 32.46 30.35 1m68 n ARG 234 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1m68 n GLY 235 N 1.16 1.28 3.69 -0.13 0.00 0.16 -5.09 105.19 106.26 1m68 n GLY 235 Ca 0.19 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.79 1m68 n GLY 235 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1m68 s MET 236 N -0.14 4.43 0.39 1.61 0.00 -0.80 -5.00 119.30 119.79 1m68 s MET 236 Ca 0.00 1.31 -0.28 0.00 0.00 0.00 0.00 55.69 56.72 1m68 s MET 236 Cb 0.00 -3.53 -0.11 0.00 0.00 0.00 0.00 34.83 31.20 1m68 s MET 236 CO 0.00 -0.25 1.49 0.00 0.00 0.00 0.00 175.02 176.26 1m68 s ALA 237 N 1.79 3.54 0.59 4.11 0.00 -1.26 -4.22 121.76 126.31 1m68 s ALA 237 Ca 0.47 1.58 -0.20 0.00 0.00 0.00 0.00 51.96 53.81 1m68 s ALA 237 Cb -0.18 -3.61 -0.04 0.00 0.00 0.00 0.00 23.12 19.28 1m68 s ALA 237 CO 0.19 -1.09 1.23 -2.30 0.00 0.00 0.00 175.76 173.79 1m68 n PRO 238 N 0.37 1.30 -3.76 0.00 -0.02 -1.26 -4.98 135.00 126.65 1m68 n PRO 238 Ca 0.01 0.49 -0.37 0.00 -2.02 0.00 0.00 63.50 61.62 1m68 n PRO 238 Cb 0.39 -2.45 -0.12 0.00 -0.02 0.00 0.00 33.50 31.31 1m68 n PRO 238 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1m68 s ILE 239 N -1.37 3.42 0.27 4.25 1.01 -1.26 -4.97 121.20 122.55 1m68 s ILE 239 Ca 0.76 -1.83 -0.01 0.00 0.00 0.00 0.00 60.65 59.57 1m68 s ILE 239 Cb -0.41 -3.24 0.25 0.00 0.01 0.00 0.00 42.46 39.08 1m68 s ILE 239 CO 0.46 -0.57 1.83 0.00 0.00 0.00 0.00 174.94 176.66 1m68 h ALA 240 N 8.11 1.37 0.00 9.38 0.00 -2.03 0.03 119.26 136.12 1m68 h ALA 240 Ca -0.16 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.77 1m68 h ALA 240 Cb 1.06 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.66 1m68 h ALA 240 CO 0.69 0.19 0.00 0.93 0.00 0.00 0.00 179.25 181.06 1m68 h GLU 241 N 0.93 0.00 -0.01 0.00 3.07 -2.00 -2.50 114.58 114.07 1m68 h GLU 241 Ca 0.45 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.31 1m68 h GLU 241 Cb 0.41 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.32 1m68 h GLU 241 CO -0.25 0.00 -0.32 1.19 -1.40 0.00 0.00 179.01 178.22 1m68 n PHE 242 N -2.40 0.00 -0.44 4.33 3.72 -0.00 -4.65 117.46 118.02 1m68 n PHE 242 Ca -0.01 0.00 0.37 0.00 -0.05 0.00 0.00 57.45 57.76 1m68 n PHE 242 Cb 0.08 -0.10 0.65 0.00 -0.94 0.00 0.00 39.48 39.16 1m68 n PHE 242 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1m68 h ALA 243 N 3.68 2.68 -0.01 4.37 0.00 -1.55 -0.53 119.26 127.89 1m68 h ALA 243 Ca 0.00 0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.05 1m68 h ALA 243 Cb 0.55 0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.57 1m68 h ALA 243 CO 0.00 -1.34 -0.35 -3.47 0.00 0.00 0.00 179.25 174.09 1m68 n ASP 244 N -4.77 1.47 0.00 0.00 2.03 -1.26 -5.12 116.55 108.89 1m68 n ASP 244 Ca 0.38 -1.17 0.13 0.00 0.52 0.00 0.00 54.79 54.65 1m68 n ASP 244 Cb 1.44 0.28 0.78 0.00 -0.72 0.00 0.00 41.12 42.90 1m68 n ASP 244 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46