#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2c5h s PRO 9 N 0.00 4.31 -0.11 5.56 0.04 -1.26 -4.82 135.00 138.72 2c5h s PRO 9 Ca 0.00 2.28 0.03 0.00 0.04 0.00 0.00 61.00 63.35 2c5h s PRO 9 Cb 0.00 -3.06 0.01 0.00 0.04 0.00 0.00 34.50 31.48 2c5h s PRO 9 CO 0.00 -0.28 -0.20 0.42 0.04 0.00 0.00 177.00 176.98 2c5h s ILE 10 N -0.92 1.81 -0.24 0.56 1.01 -1.26 -1.30 121.20 120.86 2c5h s ILE 10 Ca 0.51 -0.85 -0.07 0.00 0.00 0.00 0.00 60.65 60.24 2c5h s ILE 10 Cb -0.41 -1.60 -0.03 0.00 0.01 0.00 0.00 42.46 40.43 2c5h s ILE 10 CO 0.52 0.50 0.07 -0.63 0.00 0.00 0.00 174.94 175.41 2c5h s ILE 11 N 0.65 4.41 -0.24 2.92 1.01 -0.66 -0.55 121.20 128.73 2c5h s ILE 11 Ca -0.13 -0.14 -0.09 0.00 0.00 0.00 0.00 60.65 60.30 2c5h s ILE 11 Cb -0.16 -3.05 -0.04 0.00 0.01 0.00 0.00 42.46 39.22 2c5h s ILE 11 CO 0.03 0.35 0.11 0.00 0.00 0.00 0.00 174.94 175.43 2c5h s ALA 12 N 1.43 3.35 -0.16 9.38 0.00 0.23 -0.48 121.76 135.51 2c5h s ALA 12 Ca 0.06 -1.02 -0.02 0.00 0.00 0.00 0.00 51.96 50.98 2c5h s ALA 12 Cb -0.15 -2.18 -0.02 0.00 0.00 0.00 0.00 23.12 20.78 2c5h s ALA 12 CO 0.04 -0.34 -0.09 0.12 0.00 0.00 0.00 175.76 175.49 2c5h s PHE 13 N 1.35 2.90 -0.03 0.00 5.36 0.13 -0.03 117.98 127.66 2c5h s PHE 13 Ca 0.06 -0.67 0.01 0.00 -0.96 0.00 0.00 56.93 55.37 2c5h s PHE 13 Cb -0.15 -1.95 0.02 0.00 -0.34 0.00 0.00 43.02 40.61 2c5h s PHE 13 CO 0.05 -0.28 -0.01 1.41 -1.46 0.00 0.00 175.22 174.93 2c5h s MET 14 N 0.69 0.37 0.39 10.12 -2.45 0.10 0.83 119.30 129.35 2c5h s MET 14 Ca -0.04 0.02 -0.13 0.00 -1.25 0.00 0.00 55.69 54.28 2c5h s MET 14 Cb -0.15 -0.49 0.05 0.00 1.25 0.00 0.00 34.83 35.49 2c5h s MET 14 CO 0.02 -0.09 0.74 -1.54 1.05 0.00 0.00 175.02 175.20 2c5h s SER 15 N 0.82 0.19 -0.18 1.11 1.04 -0.89 -0.11 113.70 115.67 2c5h s SER 15 Ca -0.09 -1.24 0.16 0.00 0.48 0.00 0.00 55.95 55.26 2c5h s SER 15 Cb -0.12 0.83 0.44 0.00 0.10 0.00 0.00 66.02 67.27 2c5h s SER 15 CO -0.01 -1.65 1.32 -0.90 0.98 0.00 0.00 173.24 172.98 2c5h n ASP 16 N -1.48 3.03 0.09 7.02 5.68 -1.09 -3.56 116.55 126.25 2c5h n ASP 16 Ca -0.07 -3.20 0.10 0.00 -0.50 0.00 0.00 54.79 51.11 2c5h n ASP 16 Cb 0.60 -0.52 0.42 0.00 -1.14 0.00 0.00 41.12 40.49 2c5h n ASP 16 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 2c5h n LEU 17 N -0.95 0.43 0.00 -2.12 4.77 -1.23 -4.83 117.00 113.07 2c5h n LEU 17 Ca 0.21 0.63 0.04 0.00 -0.03 0.00 0.00 56.01 56.85 2c5h n LEU 17 Cb 0.82 -0.60 -0.01 0.00 -2.33 0.00 0.00 43.42 41.30 2c5h n LEU 17 CO 0.10 -0.55 -0.05 0.61 -1.33 0.00 0.00 177.39 176.17 2c5h n GLY 18 N -0.35 -1.93 0.42 -0.72 0.00 0.24 -4.63 105.19 98.22 2c5h n GLY 18 Ca 0.02 -1.34 0.06 0.00 0.00 0.00 0.00 46.02 44.75 2c5h n GLY 18 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2c5h n THR 19 N -1.43 1.31 -0.03 2.61 -2.24 -1.26 -4.71 114.28 108.54 2c5h n THR 19 Ca 0.00 -1.78 0.03 0.00 -2.27 0.00 0.00 64.05 60.02 2c5h n THR 19 Cb 0.12 0.06 -0.11 0.00 -2.10 0.00 0.00 70.33 68.30 2c5h n THR 19 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 2c5h n THR 20 N -0.84 0.32 -3.45 4.28 -2.24 -1.26 -5.04 114.28 106.05 2c5h n THR 20 Ca 0.12 -0.42 0.00 0.00 -2.27 0.00 0.00 64.05 61.47 2c5h n THR 20 Cb 0.71 -0.11 0.00 0.00 -2.10 0.00 0.00 70.33 68.84 2c5h n THR 20 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 2c5h n ASP 21 N -2.18 1.51 -0.36 3.42 5.75 -1.26 -5.03 116.55 118.40 2c5h n ASP 21 Ca -0.09 -0.45 0.09 0.00 -0.01 0.00 0.00 54.79 54.33 2c5h n ASP 21 Cb 0.58 0.00 0.38 0.00 -1.03 0.00 0.00 41.12 41.05 2c5h n ASP 21 CO 0.00 0.00 0.00 -0.90 -0.11 0.00 0.00 177.20 176.19 2c5h n ASP 22 N -0.67 1.07 -0.12 -1.12 5.75 -1.26 -4.47 116.55 115.73 2c5h n ASP 22 Ca 0.00 -1.67 -0.10 0.00 -0.01 0.00 0.00 54.79 53.01 2c5h n ASP 22 Cb 0.00 -0.08 -0.07 0.00 -1.03 0.00 0.00 41.12 39.94 2c5h n ASP 22 CO 0.00 0.00 0.00 0.28 -0.11 0.00 0.00 177.20 177.37 2c5h h SER 23 N 1.37 -1.40 -0.36 -1.12 0.02 -1.93 -0.18 113.55 109.95 2c5h h SER 23 Ca 0.00 0.19 0.06 0.00 -0.84 0.00 0.00 61.79 61.20 2c5h h SER 23 Cb 0.30 0.58 -0.05 0.00 0.14 0.00 0.00 62.40 63.37 2c5h h SER 23 CO 0.00 -0.29 0.03 0.58 -1.14 0.00 0.00 176.83 176.00 2c5h h VAL 24 N -0.28 0.76 -0.37 2.27 2.07 -1.84 -1.87 116.25 116.99 2c5h h VAL 24 Ca 0.06 -0.05 0.02 0.00 0.82 0.00 0.00 66.70 67.55 2c5h h VAL 24 Cb 0.43 0.62 -0.02 0.00 -1.52 0.00 0.00 31.29 30.80 2c5h h VAL 24 CO -0.46 0.02 0.24 0.00 0.02 0.00 0.00 177.57 177.40 2c5h h ALA 25 N 1.30 1.80 0.11 1.67 0.00 -1.73 0.13 119.26 122.54 2c5h h ALA 25 Ca 0.17 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.06 2c5h h ALA 25 Cb 0.23 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.89 2c5h h ALA 25 CO -0.27 0.17 -0.08 1.96 0.00 0.00 0.00 179.25 181.03 2c5h h GLN 26 N 0.44 -0.18 -0.40 0.00 4.20 -0.20 0.74 115.11 119.70 2c5h h GLN 26 Ca 0.14 0.01 0.07 0.00 0.06 0.00 0.00 58.65 58.94 2c5h h GLN 26 Cb 0.03 0.04 -0.06 0.00 0.30 0.00 0.00 27.48 27.79 2c5h h GLN 26 CO -0.03 -0.12 0.01 0.00 -0.67 0.00 0.00 178.83 178.02 2c5h h LYS 28 N 0.12 0.97 -0.13 0.00 1.57 -0.03 0.22 116.57 119.28 2c5h h LYS 28 Ca 0.20 -0.19 0.02 0.00 -1.87 0.00 0.00 60.65 58.80 2c5h h LYS 28 Cb 0.28 -0.15 -0.02 0.00 0.08 0.00 0.00 32.23 32.42 2c5h h LYS 28 CO -0.32 0.84 0.02 0.78 -0.57 0.00 0.00 179.45 180.19 2c5h h GLY 29 N 1.04 0.14 1.11 3.86 0.00 0.81 -0.95 103.07 109.08 2c5h h GLY 29 Ca 0.21 -0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.51 2c5h h GLY 29 CO -0.01 -0.01 0.42 1.41 0.00 0.00 0.00 176.54 178.36 2c5h h LEU 30 N 0.07 1.04 0.19 3.11 3.38 -0.60 -0.48 115.31 122.01 2c5h h LEU 30 Ca 0.06 -0.10 -0.00 0.00 0.09 0.00 0.00 57.88 57.92 2c5h h LEU 30 Cb 0.06 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.54 2c5h h LEU 30 CO -0.09 0.85 -0.13 0.24 0.09 0.00 0.00 178.44 179.41 2c5h h MET 31 N 1.15 -0.30 -0.86 1.13 2.86 -0.34 0.16 114.93 118.73 2c5h h MET 31 Ca 0.29 0.02 -0.02 0.00 -2.06 0.00 0.00 59.70 57.93 2c5h h MET 31 Cb 0.07 0.07 -0.04 0.00 0.06 0.00 0.00 31.60 31.76 2c5h h MET 31 CO -0.04 -0.20 0.48 1.88 1.06 0.00 0.00 176.91 180.08 2c5h h TYR 32 N -0.32 1.18 -0.40 -0.22 0.05 -0.93 0.67 116.97 117.00 2c5h h TYR 32 Ca -0.01 -0.02 -0.03 0.00 0.05 0.00 0.00 58.73 58.71 2c5h h TYR 32 Cb 0.27 -0.38 -0.02 0.00 1.01 0.00 0.00 36.73 37.62 2c5h h TYR 32 CO -0.10 0.81 0.12 0.77 -1.05 0.00 0.00 178.16 178.71 2c5h h SER 33 N 1.20 0.53 0.39 3.88 0.02 -0.47 -2.40 113.55 116.71 2c5h h SER 33 Ca 0.30 -0.07 -0.32 0.00 -0.84 0.00 0.00 61.79 60.87 2c5h h SER 33 Cb 0.02 -0.14 -0.01 0.00 0.14 0.00 0.00 62.40 62.41 2c5h h SER 33 CO -0.05 0.52 -1.61 0.40 -1.14 0.00 0.00 176.83 174.95 2c5h h ILE 34 N 0.57 1.06 -2.60 3.27 2.04 -0.17 -3.42 117.51 118.26 2c5h h ILE 34 Ca 0.14 -2.71 -0.60 0.00 1.00 0.00 0.00 64.86 62.69 2c5h h ILE 34 Cb 0.19 2.72 -0.40 0.00 -0.74 0.00 0.00 36.82 38.58 2c5h h ILE 34 CO -0.01 0.81 -0.80 0.00 0.00 0.00 0.00 178.15 178.16 2c5h h PRO 36 N 5.27 0.25 -0.01 0.00 0.11 -1.65 0.82 132.00 136.78 2c5h h PRO 36 Ca 0.20 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.29 2c5h h PRO 36 Cb 0.82 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 31.88 2c5h h PRO 36 CO 0.56 0.17 0.00 -0.40 -0.21 0.00 0.00 178.00 178.11 2c5h n ASP 37 N -4.98 0.29 -4.77 -2.05 3.85 -1.26 -4.94 116.55 102.69 2c5h n ASP 37 Ca 0.33 -1.22 -0.37 0.00 -0.71 0.00 0.00 54.79 52.81 2c5h n ASP 37 Cb 1.08 -0.01 -0.01 0.00 -1.35 0.00 0.00 41.12 40.83 2c5h n ASP 37 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.20 176.73 2c5h s VAL 38 N -1.99 3.17 -0.20 2.12 0.11 0.28 -4.32 120.40 119.57 2c5h s VAL 38 Ca 0.40 0.90 -0.04 0.00 -2.93 0.00 0.00 61.98 60.31 2c5h s VAL 38 Cb 0.19 -3.47 -0.02 0.00 -1.53 0.00 0.00 36.38 31.56 2c5h s VAL 38 CO 0.32 0.01 -0.04 -0.89 -3.33 0.00 0.00 175.10 171.17 2c5h s THR 39 N -1.53 3.60 -0.31 5.04 2.01 -0.42 -4.99 115.64 119.05 2c5h s THR 39 Ca 0.62 -0.43 -0.13 0.00 0.31 0.00 0.00 61.69 62.06 2c5h s THR 39 Cb -0.28 -2.62 -0.03 0.00 0.01 0.00 0.00 72.50 69.58 2c5h s THR 39 CO 0.35 0.44 0.27 -0.69 -0.69 0.00 0.00 174.62 174.30 2c5h s VAL 40 N 1.09 5.25 -0.23 3.82 1.01 -1.26 -1.65 120.40 128.43 2c5h s VAL 40 Ca 0.01 0.10 -0.08 0.00 0.00 0.00 0.00 61.98 62.02 2c5h s VAL 40 Cb -0.15 -3.67 -0.03 0.00 0.00 0.00 0.00 36.38 32.53 2c5h s VAL 40 CO 0.00 0.09 0.08 -0.69 0.00 0.00 0.00 175.10 174.58 2c5h s VAL 41 N 1.85 4.54 0.10 2.92 1.01 0.37 -4.99 120.40 126.21 2c5h s VAL 41 Ca 0.09 -0.10 -0.31 0.00 0.00 0.00 0.00 61.98 61.66 2c5h s VAL 41 Cb -0.16 -3.10 -0.07 0.00 0.00 0.00 0.00 36.38 33.04 2c5h s VAL 41 CO 0.11 0.37 1.32 -1.81 0.00 0.00 0.00 175.10 175.09 2c5h s ASP 42 N 1.23 6.91 -0.03 3.32 1.01 -1.26 0.20 116.67 128.06 2c5h s ASP 42 Ca 0.05 2.23 -0.01 0.00 0.71 0.00 0.00 52.55 55.53 2c5h s ASP 42 Cb -0.14 -2.59 -0.00 0.00 1.01 0.00 0.00 42.92 41.20 2c5h s ASP 42 CO 0.04 -0.58 -0.02 0.58 0.21 0.00 0.00 175.17 175.39 2c5h h VAL 43 N 4.29 0.00 -2.00 -1.27 2.07 0.09 -3.45 116.25 115.98 2c5h h VAL 43 Ca -0.42 -0.23 0.15 0.00 0.82 0.00 0.00 66.70 67.01 2c5h h VAL 43 Cb 1.21 0.00 -0.17 0.00 -1.52 0.00 0.00 31.29 30.81 2c5h h VAL 43 CO 0.84 0.00 0.59 0.00 0.02 0.00 0.00 177.57 179.02 2c5h n HIS 45 N -0.14 0.00 -2.18 0.00 8.25 -1.25 -2.10 115.22 117.80 2c5h n HIS 45 Ca -0.06 -0.71 0.04 0.00 -0.26 0.00 0.00 57.72 56.73 2c5h n HIS 45 Cb 0.60 -0.16 0.09 0.00 1.12 0.00 0.00 29.99 31.64 2c5h n HIS 45 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 2c5h n SER 46 N -0.12 1.36 -4.74 0.41 3.41 -1.23 0.83 113.62 113.53 2c5h n SER 46 Ca 0.09 -2.72 -0.31 0.00 -0.26 0.00 0.00 58.87 55.67 2c5h n SER 46 Cb 0.93 -0.39 0.11 0.00 -0.26 0.00 0.00 64.21 64.60 2c5h n SER 46 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2c5h s MET 47 N -1.37 1.84 -0.09 4.33 0.23 -1.25 -4.91 119.30 118.08 2c5h s MET 47 Ca 0.36 1.13 -0.29 0.00 -1.03 0.00 0.00 55.69 55.86 2c5h s MET 47 Cb 0.38 -1.85 -0.07 0.00 -1.53 0.00 0.00 34.83 31.76 2c5h s MET 47 CO -0.13 -1.93 2.10 2.41 -2.03 0.00 0.00 175.02 175.45 2c5h n THR 48 N -3.71 0.56 -1.41 3.16 -1.04 -1.26 -4.82 114.28 105.76 2c5h n THR 48 Ca 0.09 -0.30 -0.52 0.00 -2.04 0.00 0.00 64.05 61.28 2c5h n THR 48 Cb 0.53 -2.45 -0.05 0.00 -1.82 0.00 0.00 70.33 66.55 2c5h n THR 48 CO 0.00 0.00 0.00 -2.65 -0.64 0.00 0.00 175.07 171.78 2c5h n PRO 49 N 8.15 0.00 -0.65 -2.82 -0.02 -1.26 -1.32 135.00 137.08 2c5h n PRO 49 Ca 0.25 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.73 2c5h n PRO 49 Cb 0.43 -1.20 0.00 0.00 -0.02 0.00 0.00 33.50 32.70 2c5h n PRO 49 CO 0.00 0.00 0.00 0.91 1.98 0.00 0.00 175.50 178.39 2c5h n TRP 50 N 0.69 0.00 -2.84 6.00 8.01 -1.26 -4.89 117.44 123.15 2c5h n TRP 50 Ca 0.18 0.00 -0.43 0.00 -1.31 0.00 0.00 57.50 55.94 2c5h n TRP 50 Cb 0.17 -1.24 -0.02 0.00 -2.01 0.00 0.00 31.31 28.20 2c5h n TRP 50 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.69 177.02 2c5h s ASP 51 N -2.18 6.67 0.28 -0.99 -1.08 -0.43 -4.86 116.67 114.07 2c5h s ASP 51 Ca 0.00 -2.07 -0.02 0.00 -0.52 0.00 0.00 52.55 49.94 2c5h s ASP 51 Cb 0.00 -2.44 0.42 0.00 -1.46 0.00 0.00 42.92 39.44 2c5h s ASP 51 CO 0.00 -1.11 1.91 -0.37 0.52 0.00 0.00 175.17 176.11 2c5h h VAL 52 N 5.86 1.12 -0.58 1.11 -1.51 -1.90 -1.55 116.25 118.81 2c5h h VAL 52 Ca 0.20 -0.40 -0.00 0.00 -1.23 0.00 0.00 66.70 65.27 2c5h h VAL 52 Cb 1.00 -0.14 -0.03 0.00 -2.13 0.00 0.00 31.29 29.98 2c5h h VAL 52 CO 1.20 0.21 0.36 -0.08 -1.23 0.00 0.00 177.57 178.03 2c5h h GLU 53 N 1.17 0.78 0.74 5.19 4.57 -1.92 -0.18 114.58 124.93 2c5h h GLU 53 Ca 0.40 -0.06 -0.04 0.00 -1.18 0.00 0.00 59.36 58.48 2c5h h GLU 53 Cb 0.09 -0.17 0.01 0.00 -0.16 0.00 0.00 28.75 28.52 2c5h h GLU 53 CO -0.14 0.55 -0.36 1.49 -1.18 0.00 0.00 179.01 179.37 2c5h h GLU 54 N 0.78 -0.96 -0.95 1.92 4.81 -1.69 -2.72 114.58 115.77 2c5h h GLU 54 Ca 0.21 0.07 0.29 0.00 -0.13 0.00 0.00 59.36 59.79 2c5h h GLU 54 Cb -0.04 0.22 -0.15 0.00 0.63 0.00 0.00 28.75 29.41 2c5h h GLU 54 CO -0.04 -0.62 0.39 0.78 -0.73 0.00 0.00 179.01 178.79 2c5h h GLY 55 N -1.20 1.72 0.38 1.92 0.00 -1.23 0.94 103.07 105.60 2c5h h GLY 55 Ca -0.10 -0.12 0.12 0.00 0.00 0.00 0.00 47.33 47.23 2c5h h GLY 55 CO 0.17 -0.46 0.46 0.00 0.00 0.00 0.00 176.54 176.71 2c5h h ALA 56 N 1.84 1.23 0.00 3.60 0.00 -0.72 -0.87 119.26 124.34 2c5h h ALA 56 Ca 0.65 0.06 -0.04 0.00 0.00 0.00 0.00 54.91 55.58 2c5h h ALA 56 Cb 1.43 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 19.14 2c5h h ALA 56 CO -0.66 0.01 -0.21 -0.09 0.00 0.00 0.00 179.25 178.31 2c5h h ARG 57 N 0.72 0.00 0.00 0.00 2.43 -0.62 -1.97 114.38 114.94 2c5h h ARG 57 Ca 0.43 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.60 2c5h h ARG 57 Cb 0.51 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.06 2c5h h ARG 57 CO -0.30 0.21 -0.44 1.88 -1.51 0.00 0.00 179.97 179.81 2c5h h TYR 58 N 0.00 0.00 0.00 2.20 0.05 -1.08 -3.38 116.97 114.76 2c5h h TYR 58 Ca -0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 2c5h h TYR 58 Cb 0.54 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.28 2c5h h TYR 58 CO 0.00 0.00 -0.90 0.44 -1.05 0.00 0.00 178.16 176.65 2c5h n ILE 59 N -2.33 0.00 0.09 -2.88 -5.35 -0.82 -4.69 119.36 103.39 2c5h n ILE 59 Ca 0.04 -0.25 -0.04 0.00 -0.27 0.00 0.00 62.75 62.23 2c5h n ILE 59 Cb 0.46 0.71 0.14 0.00 -1.74 0.00 0.00 39.64 39.21 2c5h n ILE 59 CO 0.00 0.00 0.00 1.62 -1.76 0.00 0.00 176.55 176.41 2c5h h VAL 60 N 0.00 1.38 -0.40 7.28 3.04 -1.56 -3.24 116.25 122.75 2c5h h VAL 60 Ca 0.00 -1.93 0.00 0.00 -1.01 0.00 0.00 66.70 63.76 2c5h h VAL 60 Cb 0.36 1.97 0.00 0.00 -2.01 0.00 0.00 31.29 31.61 2c5h h VAL 60 CO 0.00 0.57 0.00 0.47 -1.01 0.00 0.00 177.57 177.60 2c5h n ASP 61 N -3.89 3.41 -0.12 3.17 8.00 -1.26 -4.53 116.55 121.33 2c5h n ASP 61 Ca -0.02 -1.97 -0.11 0.00 0.71 0.00 0.00 54.79 53.40 2c5h n ASP 61 Cb 0.60 -0.26 -0.03 0.00 -0.02 0.00 0.00 41.12 41.41 2c5h n ASP 61 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 2c5h h LEU 62 N 4.19 0.70 -1.42 0.64 3.38 -1.85 -3.36 115.31 117.60 2c5h h LEU 62 Ca 0.00 -0.37 0.17 0.00 0.09 0.00 0.00 57.88 57.76 2c5h h LEU 62 Cb 0.95 -0.19 -0.07 0.00 0.09 0.00 0.00 40.66 41.44 2c5h h LEU 62 CO 0.00 0.92 0.57 -0.65 0.09 0.00 0.00 178.44 179.36 2c5h h PRO 63 N 0.49 0.52 0.00 1.13 0.11 -1.82 -0.33 132.00 132.09 2c5h h PRO 63 Ca 0.09 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 66.15 2c5h h PRO 63 Cb 0.62 -0.12 -0.00 0.00 0.11 0.00 0.00 31.00 31.61 2c5h h PRO 63 CO 0.04 0.34 -0.06 0.07 -0.21 0.00 0.00 178.00 178.18 2c5h h ARG 64 N 0.53 0.00 0.00 1.05 0.11 -1.72 -2.85 114.38 111.49 2c5h h ARG 64 Ca 0.44 0.00 -0.06 0.00 0.10 0.00 0.00 59.98 60.47 2c5h h ARG 64 Cb 0.92 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.99 2c5h h ARG 64 CO -0.18 0.06 -0.62 0.74 0.10 0.00 0.00 179.97 180.07 2c5h h PHE 65 N 0.00 0.00 -2.82 4.08 0.04 -1.29 -3.41 116.94 113.54 2c5h h PHE 65 Ca -0.00 0.00 -0.58 0.00 2.80 0.00 0.00 57.97 60.19 2c5h h PHE 65 Cb 0.60 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 38.71 2c5h h PHE 65 CO 0.00 0.23 -0.45 -0.06 -0.60 0.00 0.00 178.31 177.43 2c5h s PHE 66 N -3.13 3.50 0.52 -0.55 0.08 -1.08 -5.06 117.98 112.25 2c5h s PHE 66 Ca 0.03 0.25 -0.22 0.00 0.12 0.00 0.00 56.93 57.10 2c5h s PHE 66 Cb 0.07 -1.77 -0.06 0.00 -0.57 0.00 0.00 43.02 40.70 2c5h s PHE 66 CO 0.74 0.53 1.36 -2.14 -0.10 0.00 0.00 175.22 175.61 2c5h s PRO 67 N -2.83 3.28 0.32 0.24 0.02 -1.26 -4.91 135.00 129.86 2c5h s PRO 67 Ca 0.36 2.24 -0.27 0.00 0.02 0.00 0.00 61.00 63.35 2c5h s PRO 67 Cb -0.12 -2.34 -0.14 0.00 0.02 0.00 0.00 34.50 31.92 2c5h s PRO 67 CO 0.28 -1.08 0.92 0.39 -0.33 0.00 0.00 177.00 177.19 2c5h n GLU 68 N -0.84 1.17 -0.08 5.54 1.02 -1.26 -2.33 120.64 123.86 2c5h n GLU 68 Ca 0.09 0.41 0.00 0.00 -0.02 0.00 0.00 57.16 57.65 2c5h n GLU 68 Cb 0.45 -1.78 0.00 0.00 -0.02 0.00 0.00 31.44 30.09 2c5h n GLU 68 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2c5h n GLY 69 N 1.33 0.73 3.76 0.62 0.00 0.15 -5.02 105.19 106.76 2c5h n GLY 69 Ca 0.10 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.73 2c5h n GLY 69 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2c5h n THR 70 N -2.00 3.35 -4.76 2.61 -1.04 -0.99 -4.67 114.28 106.77 2c5h n THR 70 Ca 0.00 -0.50 -0.33 0.00 -2.04 0.00 0.00 64.05 61.18 2c5h n THR 70 Cb 0.00 -1.77 -0.14 0.00 -1.82 0.00 0.00 70.33 66.60 2c5h n THR 70 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 2c5h s VAL 71 N -1.24 3.03 -0.41 12.58 1.01 0.28 -3.20 120.40 132.46 2c5h s VAL 71 Ca 0.67 -0.67 -0.12 0.00 0.00 0.00 0.00 61.98 61.85 2c5h s VAL 71 Cb -0.43 -2.27 0.04 0.00 0.00 0.00 0.00 36.38 33.72 2c5h s VAL 71 CO 0.53 0.52 0.27 -0.36 0.00 0.00 0.00 175.10 176.07 2c5h s PHE 72 N 0.38 3.26 -0.55 5.22 0.08 0.09 0.74 117.98 127.20 2c5h s PHE 72 Ca -0.11 -0.98 -0.21 0.00 0.12 0.00 0.00 56.93 55.75 2c5h s PHE 72 Cb -0.16 -2.71 0.06 0.00 -0.57 0.00 0.00 43.02 39.64 2c5h s PHE 72 CO 0.05 -0.70 0.78 0.00 -0.10 0.00 0.00 175.22 175.25 2c5h s ALA 73 N 1.57 3.28 -0.12 5.36 0.00 0.95 -1.02 121.76 131.78 2c5h s ALA 73 Ca 0.03 -1.61 0.01 0.00 0.00 0.00 0.00 51.96 50.39 2c5h s ALA 73 Cb -0.21 -3.56 0.02 0.00 0.00 0.00 0.00 23.12 19.37 2c5h s ALA 73 CO 0.07 -2.26 -0.13 0.95 0.00 0.00 0.00 175.76 174.39 2c5h s THR 74 N 3.26 1.37 -0.23 0.00 -4.23 -0.86 0.01 115.64 114.97 2c5h s THR 74 Ca 0.21 -0.53 -0.10 0.00 -1.18 0.00 0.00 61.69 60.09 2c5h s THR 74 Cb -0.17 -1.29 0.09 0.00 1.34 0.00 0.00 72.50 72.47 2c5h s THR 74 CO 0.14 0.42 0.52 0.28 -0.54 0.00 0.00 174.62 175.43 2c5h s THR 75 N 1.30 -0.44 -0.05 3.99 -1.32 0.84 -4.17 115.64 115.80 2c5h s THR 75 Ca -0.01 0.08 0.02 0.00 -1.21 0.00 0.00 61.69 60.58 2c5h s THR 75 Cb -0.14 -0.78 0.01 0.00 -1.51 0.00 0.00 72.50 70.08 2c5h s THR 75 CO -0.06 0.03 -0.10 0.28 -2.21 0.00 0.00 174.62 172.57 2c5h s THR 76 N 2.17 0.89 -0.47 5.08 -1.32 -1.26 -2.67 115.64 118.07 2c5h s THR 76 Ca -0.06 -0.37 0.09 0.00 -1.21 0.00 0.00 61.69 60.14 2c5h s THR 76 Cb -0.10 -0.82 0.34 0.00 -1.51 0.00 0.00 72.50 70.41 2c5h s THR 76 CO -0.15 0.29 0.81 0.00 -2.21 0.00 0.00 174.62 173.36 2c5h n TYR 77 N 3.67 1.88 -0.37 9.09 9.36 -1.26 -4.78 117.16 134.76 2c5h n TYR 77 Ca -0.22 -3.90 0.28 0.00 3.32 0.00 0.00 57.90 57.38 2c5h n TYR 77 Cb 0.52 -0.45 0.56 0.00 -0.63 0.00 0.00 39.34 39.34 2c5h n TYR 77 CO 0.00 0.00 0.00 -1.35 0.22 0.00 0.00 176.86 175.73 2c5h h PRO 78 N 3.06 0.27 0.00 2.98 0.11 -1.99 0.23 132.00 136.66 2c5h h PRO 78 Ca 0.11 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.21 2c5h h PRO 78 Cb 0.76 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 31.81 2c5h h PRO 78 CO 0.64 0.18 0.00 0.00 -0.21 0.00 0.00 178.00 178.61 2c5h n ALA 79 N -2.49 2.27 -1.67 -0.75 0.00 -1.26 -4.92 120.51 111.69 2c5h n ALA 79 Ca 0.30 -0.00 -0.44 0.00 0.00 0.00 0.00 53.44 53.30 2c5h n ALA 79 Cb 1.08 -1.01 -0.01 0.00 0.00 0.00 0.00 19.45 19.51 2c5h n ALA 79 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 2c5h n THR 80 N -0.51 1.70 -0.21 0.00 5.66 0.80 -1.85 114.28 119.86 2c5h n THR 80 Ca 0.00 -0.42 0.00 0.00 -3.05 0.00 0.00 64.05 60.58 2c5h n THR 80 Cb 0.00 -1.44 0.00 0.00 -1.55 0.00 0.00 70.33 67.34 2c5h n THR 80 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2c5h n GLY 81 N 1.23 1.29 3.78 1.09 0.00 0.13 -4.74 105.19 107.98 2c5h n GLY 81 Ca 0.07 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.88 2c5h n GLY 81 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2c5h n THR 82 N -2.00 0.00 0.26 2.61 -2.24 -0.77 -4.95 114.28 107.19 2c5h n THR 82 Ca 0.00 -1.65 0.16 0.00 -2.27 0.00 0.00 64.05 60.29 2c5h n THR 82 Cb 0.00 -0.78 0.60 0.00 -2.10 0.00 0.00 70.33 68.05 2c5h n THR 82 CO 0.00 0.00 0.00 0.71 -0.57 0.00 0.00 175.07 175.21 2c5h h THR 83 N -0.37 0.10 -2.27 4.28 1.35 -1.96 -3.45 112.91 110.58 2c5h h THR 83 Ca -0.30 -0.66 -0.61 0.00 -0.55 0.00 0.00 66.41 64.29 2c5h h THR 83 Cb 1.20 1.60 0.15 0.00 -1.73 0.00 0.00 68.15 69.37 2c5h h THR 83 CO 0.36 0.04 -0.53 1.07 -0.25 0.00 0.00 175.52 176.20 2c5h n THR 84 N -3.14 1.54 -4.20 6.82 5.66 -1.26 -5.00 114.28 114.69 2c5h n THR 84 Ca 0.01 -0.50 -0.18 0.00 -3.05 0.00 0.00 64.05 60.33 2c5h n THR 84 Cb 0.35 -0.43 -0.12 0.00 -1.55 0.00 0.00 70.33 68.57 2c5h n THR 84 CO 0.00 0.00 0.00 -0.13 -3.05 0.00 0.00 175.07 171.89 2c5h s ARG 85 N -1.50 0.82 0.73 1.09 1.81 -1.26 -4.99 118.95 115.65 2c5h s ARG 85 Ca 0.63 -0.90 -0.13 0.00 -1.72 0.00 0.00 55.73 53.61 2c5h s ARG 85 Cb -0.59 -0.81 0.04 0.00 -0.45 0.00 0.00 34.95 33.14 2c5h s ARG 85 CO 0.59 0.18 1.12 -1.12 -0.68 0.00 0.00 175.30 175.39 2c5h s SER 86 N -1.59 4.59 -0.05 0.23 0.01 -1.26 -3.84 113.70 111.79 2c5h s SER 86 Ca -0.02 2.00 -0.01 0.00 1.31 0.00 0.00 55.95 59.23 2c5h s SER 86 Cb -0.09 -2.55 -0.04 0.00 0.21 0.00 0.00 66.02 63.55 2c5h s SER 86 CO 0.02 -1.98 0.03 0.54 0.41 0.00 0.00 173.24 172.25 2c5h s VAL 87 N -2.52 4.43 -0.20 3.43 0.11 0.03 -0.04 120.40 125.64 2c5h s VAL 87 Ca 0.66 -0.35 0.01 0.00 -2.93 0.00 0.00 61.98 59.37 2c5h s VAL 87 Cb -0.21 -2.93 0.04 0.00 -1.53 0.00 0.00 36.38 31.75 2c5h s VAL 87 CO 0.49 0.49 -0.10 0.00 -3.33 0.00 0.00 175.10 172.64 2c5h s ALA 88 N -1.01 2.04 0.05 1.54 0.00 0.15 -1.58 121.76 122.95 2c5h s ALA 88 Ca 0.17 -1.23 0.07 0.00 0.00 0.00 0.00 51.96 50.96 2c5h s ALA 88 Cb -0.12 -1.29 -0.03 0.00 0.00 0.00 0.00 23.12 21.68 2c5h s ALA 88 CO 0.07 -0.83 -0.16 0.14 0.00 0.00 0.00 175.76 174.98 2c5h s VAL 89 N 1.38 2.95 -0.29 0.00 -7.23 -0.41 -0.58 120.40 116.23 2c5h s VAL 89 Ca -0.02 -1.19 -0.12 0.00 -1.81 0.00 0.00 61.98 58.84 2c5h s VAL 89 Cb -0.16 -2.28 -0.04 0.00 0.56 0.00 0.00 36.38 34.46 2c5h s VAL 89 CO -0.08 0.29 0.25 -0.60 -0.31 0.00 0.00 175.10 174.65 2c5h s ARG 90 N -1.60 3.90 0.58 4.82 3.52 -0.68 -0.01 118.95 129.48 2c5h s ARG 90 Ca 0.16 -0.27 -0.15 0.00 -0.13 0.00 0.00 55.73 55.34 2c5h s ARG 90 Cb -0.11 -3.68 -0.05 0.00 -1.56 0.00 0.00 34.95 29.56 2c5h s ARG 90 CO 0.07 -0.25 1.03 0.96 -0.81 0.00 0.00 175.30 176.30 2c5h s ILE 91 N 1.85 4.18 0.00 4.11 -4.36 -0.50 -1.09 121.20 125.39 2c5h s ILE 91 Ca 0.09 0.97 0.00 0.00 -0.26 0.00 0.00 60.65 61.45 2c5h s ILE 91 Cb -0.16 -3.55 0.00 0.00 1.25 0.00 0.00 42.46 40.00 2c5h s ILE 91 CO 0.11 -0.67 0.00 1.17 0.24 0.00 0.00 174.94 175.79 2c5h n LYS 92 N -2.06 0.00 -2.97 0.37 4.81 0.02 -3.06 118.16 115.27 2c5h n LYS 92 Ca 0.08 0.00 -0.36 0.00 -0.87 0.00 0.00 58.31 57.16 2c5h n LYS 92 Cb 0.53 -0.22 -0.06 0.00 0.02 0.00 0.00 35.03 35.31 2c5h n LYS 92 CO 0.00 0.00 0.00 -0.65 1.17 0.00 0.00 177.40 177.92 2c5h s GLN 93 N 0.00 4.35 0.32 1.64 -0.21 -0.34 -0.88 119.66 124.54 2c5h s GLN 93 Ca 0.00 1.03 0.12 0.00 0.02 0.00 0.00 55.36 56.53 2c5h s GLN 93 Cb 0.00 -2.78 0.52 0.00 1.00 0.00 0.00 33.01 31.75 2c5h s GLN 93 CO 0.00 0.31 1.71 0.00 -2.12 0.00 0.00 175.29 175.19 2c5h h ALA 94 N 3.17 1.15 -3.41 6.09 0.00 -1.83 -3.42 119.26 121.00 2c5h h ALA 94 Ca -0.48 -0.46 0.00 0.00 0.00 0.00 0.00 54.91 53.98 2c5h h ALA 94 Cb 1.19 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.89 2c5h h ALA 94 CO 0.65 0.63 -0.52 0.00 0.00 0.00 0.00 179.25 180.01 2c5h n ALA 95 N -2.44 -2.58 -1.48 0.00 0.00 -1.26 -4.17 120.51 108.59 2c5h n ALA 95 Ca -0.01 0.33 -0.38 0.00 0.00 0.00 0.00 53.44 53.37 2c5h n ALA 95 Cb 0.52 -0.88 0.04 0.00 0.00 0.00 0.00 19.45 19.13 2c5h n ALA 95 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2c5h n LYS 96 N 0.91 0.54 -3.75 0.00 5.02 -1.26 -4.76 118.16 114.86 2c5h n LYS 96 Ca -0.02 0.21 -0.14 0.00 -2.02 0.00 0.00 58.31 56.34 2c5h n LYS 96 Cb 0.03 -1.71 -0.04 0.00 -0.02 0.00 0.00 35.03 33.28 2c5h n LYS 96 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2c5h n GLY 97 N 1.75 2.55 0.00 0.72 0.00 -1.00 -4.79 105.19 104.42 2c5h n GLY 97 Ca 0.12 -1.69 0.00 0.00 0.00 0.00 0.00 46.02 44.45 2c5h n GLY 97 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2c5h n GLY 98 N -0.52 0.75 0.20 -0.02 0.00 -1.25 -1.37 105.19 103.00 2c5h n GLY 98 Ca 0.03 -2.13 0.14 0.00 0.00 0.00 0.00 46.02 44.06 2c5h n GLY 98 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2c5h h ALA 99 N 0.00 1.00 0.00 4.61 0.00 -1.71 -2.97 119.26 120.19 2c5h h ALA 99 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2c5h h ALA 99 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 2c5h h ALA 99 CO 0.00 0.00 -0.18 -2.13 0.00 0.00 0.00 179.25 176.94 2c5h n ARG 100 N -2.47 3.25 -0.91 0.00 0.00 -1.26 -4.91 116.66 110.36 2c5h n ARG 100 Ca -0.01 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.84 2c5h n ARG 100 Cb 0.07 -0.44 0.00 0.00 0.00 0.00 0.00 32.46 32.09 2c5h n ARG 100 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2c5h n GLY 101 N 0.60 -1.54 3.26 5.14 0.00 -1.12 -5.07 105.19 106.46 2c5h n GLY 101 Ca 0.00 -0.42 -0.10 0.00 0.00 0.00 0.00 46.02 45.50 2c5h n GLY 101 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2c5h s GLN 102 N -0.16 1.11 0.39 1.61 -2.07 -0.47 -4.81 119.66 115.26 2c5h s GLN 102 Ca 0.00 -1.37 -0.24 0.00 -1.82 0.00 0.00 55.36 51.93 2c5h s GLN 102 Cb 0.00 0.31 -0.09 0.00 -1.09 0.00 0.00 33.01 32.14 2c5h s GLN 102 CO 0.00 -0.37 1.05 -1.58 -1.32 0.00 0.00 175.29 173.07 2c5h s TRP 103 N -4.04 3.30 0.46 9.60 0.52 -1.26 -2.39 118.94 125.13 2c5h s TRP 103 Ca 0.24 1.65 -0.21 0.00 0.02 0.00 0.00 56.10 57.80 2c5h s TRP 103 Cb 0.05 -3.13 -0.08 0.00 -1.15 0.00 0.00 33.47 29.16 2c5h s TRP 103 CO 0.04 -0.60 1.05 0.00 0.02 0.00 0.00 176.95 177.46 2c5h s ALA 104 N -1.62 2.93 0.00 0.98 0.00 -1.26 -4.42 121.76 118.37 2c5h s ALA 104 Ca 0.57 0.66 0.00 0.00 0.00 0.00 0.00 51.96 53.18 2c5h s ALA 104 Cb -0.23 -3.27 0.00 0.00 0.00 0.00 0.00 23.12 19.63 2c5h s ALA 104 CO 0.28 -0.31 0.00 0.41 0.00 0.00 0.00 175.76 176.14 2c5h n GLY 105 N -0.03 1.50 3.68 0.00 0.00 -1.26 0.11 105.19 109.19 2c5h n GLY 105 Ca 0.08 -2.22 -0.29 0.00 0.00 0.00 0.00 46.02 43.59 2c5h n GLY 105 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2c5h s SER 106 N 0.00 2.76 0.80 1.61 1.04 -1.26 -3.86 113.70 114.79 2c5h s SER 106 Ca 0.00 1.30 0.00 0.00 0.48 0.00 0.00 55.95 57.73 2c5h s SER 106 Cb 0.00 -1.98 0.00 0.00 0.10 0.00 0.00 66.02 64.14 2c5h s SER 106 CO 0.00 -3.06 0.00 0.61 0.98 0.00 0.00 173.24 171.77 2c5h n GLY 107 N -0.97 2.89 0.00 7.32 0.00 -1.26 -0.04 105.19 113.12 2c5h n GLY 107 Ca 0.06 -0.07 0.09 0.00 0.00 0.00 0.00 46.02 46.10 2c5h n GLY 107 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2c5h n ALA 108 N 8.84 2.43 0.00 4.61 0.00 -1.26 -5.00 120.51 130.13 2c5h n ALA 108 Ca 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 53.44 53.33 2c5h n ALA 108 Cb 0.00 -1.30 0.00 0.00 0.00 0.00 0.00 19.45 18.15 2c5h n ALA 108 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2c5h n GLY 109 N 0.55 -0.34 3.29 0.00 0.00 0.94 -4.54 105.19 105.09 2c5h n GLY 109 Ca 0.14 -1.76 -0.38 0.00 0.00 0.00 0.00 46.02 44.02 2c5h n GLY 109 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2c5h s PHE 110 N -1.83 3.23 0.30 1.61 0.08 0.31 -4.87 117.98 116.82 2c5h s PHE 110 Ca 0.00 -1.31 -0.29 0.00 0.12 0.00 0.00 56.93 55.45 2c5h s PHE 110 Cb 0.00 -2.29 -0.10 0.00 -0.57 0.00 0.00 43.02 40.06 2c5h s PHE 110 CO 0.00 -0.70 1.40 -1.21 -0.10 0.00 0.00 175.22 174.62 2c5h s GLU 111 N 1.43 4.27 -0.16 0.44 2.02 -1.26 -4.47 118.70 120.97 2c5h s GLU 111 Ca -0.01 2.32 0.01 0.00 0.02 0.00 0.00 54.97 57.32 2c5h s GLU 111 Cb -0.19 -3.07 0.02 0.00 0.10 0.00 0.00 34.13 30.99 2c5h s GLU 111 CO 0.03 -0.36 -0.18 1.03 0.02 0.00 0.00 175.26 175.79 2c5h s ARG 112 N -1.16 2.74 0.55 1.61 1.81 -1.26 -5.10 118.95 118.14 2c5h s ARG 112 Ca 0.55 -0.74 -0.19 0.00 -1.72 0.00 0.00 55.73 53.63 2c5h s ARG 112 Cb -0.42 -2.35 -0.08 0.00 -0.45 0.00 0.00 34.95 31.65 2c5h s ARG 112 CO 0.50 -0.16 0.72 0.00 -0.68 0.00 0.00 175.30 175.68 2c5h n ALA 113 N 4.49 -0.60 -0.74 2.13 0.00 -1.26 -4.46 120.51 120.06 2c5h n ALA 113 Ca -0.20 0.03 -0.28 0.00 0.00 0.00 0.00 53.44 52.99 2c5h n ALA 113 Cb 0.50 -1.94 0.23 0.00 0.00 0.00 0.00 19.45 18.25 2c5h n ALA 113 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 2c5h s GLU 114 N -2.26 -0.65 -1.52 0.00 0.41 -1.26 -3.94 118.70 109.48 2c5h s GLU 114 Ca 0.70 0.68 0.00 0.00 -0.41 0.00 0.00 54.97 55.94 2c5h s GLU 114 Cb -0.46 -1.60 0.00 0.00 -1.78 0.00 0.00 34.13 30.29 2c5h s GLU 114 CO 0.52 -3.50 0.00 0.41 -0.49 0.00 0.00 175.26 172.20 2c5h n GLY 115 N 0.20 0.19 0.47 -1.39 0.00 -0.06 -4.86 105.19 99.75 2c5h n GLY 115 Ca 0.03 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.10 2c5h n GLY 115 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2c5h n SER 116 N -1.56 2.47 -3.94 1.61 7.64 -1.25 -4.92 113.62 113.66 2c5h n SER 116 Ca -0.18 -1.83 -0.10 0.00 1.01 0.00 0.00 58.87 57.77 2c5h n SER 116 Cb 0.61 -0.14 -0.12 0.00 -1.01 0.00 0.00 64.21 63.56 2c5h n SER 116 CO 0.00 0.00 0.00 -0.31 -3.01 0.00 0.00 175.04 171.72 2c5h s TYR 117 N -0.93 0.18 -0.04 1.43 2.02 -1.26 0.31 117.35 119.06 2c5h s TYR 117 Ca 0.16 -0.36 0.07 0.00 -0.37 0.00 0.00 57.07 56.57 2c5h s TYR 117 Cb 0.09 -0.13 -0.02 0.00 -0.40 0.00 0.00 41.96 41.50 2c5h s TYR 117 CO 0.12 -0.15 -0.25 0.42 -1.57 0.00 0.00 175.55 174.12 2c5h s ILE 118 N -1.09 2.10 -0.07 2.71 1.01 -1.19 -1.41 121.20 123.26 2c5h s ILE 118 Ca -0.12 -1.07 0.00 0.00 0.00 0.00 0.00 60.65 59.46 2c5h s ILE 118 Cb -0.07 -1.74 -0.03 0.00 0.01 0.00 0.00 42.46 40.62 2c5h s ILE 118 CO -0.01 0.58 -0.05 -0.31 0.00 0.00 0.00 174.94 175.15 2c5h s TYR 119 N -0.38 3.01 -0.08 3.97 2.02 0.98 -0.73 117.35 126.15 2c5h s TYR 119 Ca 0.03 0.08 0.02 0.00 -0.37 0.00 0.00 57.07 56.82 2c5h s TYR 119 Cb -0.12 -1.73 0.02 0.00 -0.40 0.00 0.00 41.96 39.72 2c5h s TYR 119 CO 0.01 0.38 -0.11 -1.50 -1.57 0.00 0.00 175.55 172.76 2c5h s ILE 120 N -0.84 1.11 0.12 2.71 2.07 -0.19 -1.28 121.20 124.89 2c5h s ILE 120 Ca 0.13 -0.44 -0.20 0.00 -1.41 0.00 0.00 60.65 58.73 2c5h s ILE 120 Cb -0.11 -1.04 0.05 0.00 0.13 0.00 0.00 42.46 41.49 2c5h s ILE 120 CO 0.02 0.36 0.50 0.00 -1.91 0.00 0.00 174.94 173.90 2c5h s ALA 121 N 0.89 -1.26 0.35 1.50 0.00 -0.61 -2.03 121.76 120.60 2c5h s ALA 121 Ca -0.10 0.29 -0.27 0.00 0.00 0.00 0.00 51.96 51.88 2c5h s ALA 121 Cb -0.15 0.69 -0.12 0.00 0.00 0.00 0.00 23.12 23.54 2c5h s ALA 121 CO 0.01 -0.66 1.14 -0.35 0.00 0.00 0.00 175.76 175.90 2c5h n PRO 122 N -0.13 1.70 -1.19 0.00 -0.04 -1.26 -0.79 135.00 133.30 2c5h n PRO 122 Ca -0.17 0.60 -0.28 0.00 -0.04 0.00 0.00 63.50 63.61 2c5h n PRO 122 Cb 0.63 -2.12 -0.09 0.00 -0.04 0.00 0.00 33.50 31.88 2c5h n PRO 122 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 2c5h n ASN 123 N 0.80 7.32 -0.16 3.54 5.15 -1.25 -4.20 115.26 126.46 2c5h n ASN 123 Ca 0.07 -2.54 0.02 0.00 -0.60 0.00 0.00 54.58 51.54 2c5h n ASN 123 Cb 0.36 -1.50 0.01 0.00 -0.53 0.00 0.00 39.78 38.12 2c5h n ASN 123 CO 0.00 0.00 0.00 -0.46 1.40 0.00 0.00 177.26 178.20 2c5h n ASN 124 N 3.12 1.26 0.00 1.20 6.94 -1.26 -4.48 115.26 122.04 2c5h n ASN 124 Ca 0.64 -1.13 0.00 0.00 -0.02 0.00 0.00 54.58 54.07 2c5h n ASN 124 Cb 0.51 0.08 0.00 0.00 -2.36 0.00 0.00 39.78 38.02 2c5h n ASN 124 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2c5h n GLY 125 N 0.31 0.85 0.34 4.83 0.00 -1.25 -4.83 105.19 105.44 2c5h n GLY 125 Ca 0.02 0.00 0.16 0.00 0.00 0.00 0.00 46.02 46.21 2c5h n GLY 125 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2c5h h LEU 126 N 0.00 0.00 -1.61 0.99 5.85 -1.86 -0.74 115.31 117.94 2c5h h LEU 126 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 2c5h h LEU 126 Cb 0.00 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.03 2c5h h LEU 126 CO 0.00 0.00 0.00 0.18 -0.34 0.00 0.00 178.44 178.28 2c5h n LEU 127 N -4.38 2.36 0.42 2.25 4.77 -1.26 -4.23 117.00 116.93 2c5h n LEU 127 Ca 0.05 -1.19 -0.19 0.00 -0.03 0.00 0.00 56.01 54.66 2c5h n LEU 127 Cb 0.44 -0.33 -0.10 0.00 -2.33 0.00 0.00 43.42 41.10 2c5h n LEU 127 CO 0.35 0.50 0.53 0.74 -1.33 0.00 0.00 177.39 178.19 2c5h h THR 128 N 2.22 0.00 0.00 -5.08 2.02 -1.42 -0.72 112.91 109.92 2c5h h THR 128 Ca 0.00 0.00 -0.10 0.00 0.77 0.00 0.00 66.41 67.08 2c5h h THR 128 Cb 0.68 0.00 -0.01 0.00 -1.74 0.00 0.00 68.15 67.07 2c5h h THR 128 CO 0.05 0.00 -0.49 0.71 0.37 0.00 0.00 175.52 176.16 2c5h h THR 129 N -1.18 1.34 -0.02 3.16 1.35 -1.84 -0.93 112.91 114.80 2c5h h THR 129 Ca -0.10 -1.70 0.03 0.00 -0.55 0.00 0.00 66.41 64.09 2c5h h THR 129 Cb 0.95 1.92 -0.05 0.00 -1.73 0.00 0.00 68.15 69.24 2c5h h THR 129 CO 0.09 0.48 -0.26 0.58 -0.25 0.00 0.00 175.52 176.16 2c5h h VAL 130 N 0.00 0.41 0.00 6.82 2.07 -1.79 0.23 116.25 123.98 2c5h h VAL 130 Ca -0.00 0.00 -0.07 0.00 0.82 0.00 0.00 66.70 67.45 2c5h h VAL 130 Cb 0.88 0.41 -0.01 0.00 -1.52 0.00 0.00 31.29 31.05 2c5h h VAL 130 CO 0.06 0.00 -0.32 -0.07 0.02 0.00 0.00 177.57 177.26 2c5h h LEU 131 N -0.39 0.00 -0.05 2.57 3.38 -0.31 0.19 115.31 120.70 2c5h h LEU 131 Ca 0.07 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.02 2c5h h LEU 131 Cb 0.48 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.23 2c5h h LEU 131 CO -0.24 0.32 -0.05 -0.08 0.09 0.00 0.00 178.44 178.48 2c5h h GLU 132 N 0.00 0.13 0.00 1.13 4.81 -0.62 0.31 114.58 120.34 2c5h h GLU 132 Ca -0.00 -0.06 -0.19 0.00 -0.13 0.00 0.00 59.36 58.98 2c5h h GLU 132 Cb 0.59 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.94 2c5h h GLU 132 CO 0.04 0.57 -1.02 0.93 -0.73 0.00 0.00 179.01 178.80 2c5h h GLU 133 N -0.31 0.00 0.00 1.92 5.08 -0.29 -3.37 114.58 117.61 2c5h h GLU 133 Ca 0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 2c5h h GLU 133 Cb 0.54 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.79 2c5h h GLU 133 CO 0.01 0.68 -1.29 0.72 -1.00 0.00 0.00 179.01 178.13 2c5h n HIS 134 N -3.20 0.00 -1.26 4.33 8.25 0.63 -4.85 115.22 119.12 2c5h n HIS 134 Ca -0.03 0.00 0.17 0.00 -0.26 0.00 0.00 57.72 57.59 2c5h n HIS 134 Cb 0.88 -0.17 -0.05 0.00 1.12 0.00 0.00 29.99 31.77 2c5h n HIS 134 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2c5h n GLY 135 N 1.97 -2.20 3.13 -1.41 0.00 0.10 -1.20 105.19 105.59 2c5h n GLY 135 Ca -0.01 -1.18 -0.12 0.00 0.00 0.00 0.00 46.02 44.71 2c5h n GLY 135 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2c5h s TYR 136 N -2.60 -0.11 -0.04 1.61 -0.85 -1.26 -0.80 117.35 113.30 2c5h s TYR 136 Ca 0.00 0.21 -0.03 0.00 -0.52 0.00 0.00 57.07 56.73 2c5h s TYR 136 Cb 0.00 0.03 -0.27 0.00 0.38 0.00 0.00 41.96 42.10 2c5h s TYR 136 CO 0.00 -0.25 0.67 -0.07 -1.52 0.00 0.00 175.55 174.38 2c5h h LEU 137 N 4.72 0.39 -7.01 -3.49 3.38 -1.35 -3.44 115.31 108.51 2c5h h LEU 137 Ca -0.29 -0.65 -0.06 0.00 0.09 0.00 0.00 57.88 56.98 2c5h h LEU 137 Cb 1.19 -0.13 -0.20 0.00 0.09 0.00 0.00 40.66 41.62 2c5h h LEU 137 CO 0.39 1.56 0.16 -1.83 0.09 0.00 0.00 178.44 178.81 2c5h s GLU 138 N -2.59 0.99 -0.00 1.13 -1.05 -1.24 -5.03 118.70 110.91 2c5h s GLU 138 Ca -0.13 0.46 0.00 0.00 -0.15 0.00 0.00 54.97 55.15 2c5h s GLU 138 Cb 0.07 0.47 0.00 0.00 -0.44 0.00 0.00 34.13 34.23 2c5h s GLU 138 CO 0.83 -0.26 -0.00 0.00 0.95 0.00 0.00 175.26 176.78 2c5h s ALA 139 N -0.75 0.04 -0.01 -0.84 0.00 -1.26 -1.69 121.76 117.25 2c5h s ALA 139 Ca -0.08 0.02 -0.01 0.00 0.00 0.00 0.00 51.96 51.89 2c5h s ALA 139 Cb -0.01 -0.03 0.00 0.00 0.00 0.00 0.00 23.12 23.08 2c5h s ALA 139 CO 0.07 -0.00 0.03 0.71 0.00 0.00 0.00 175.76 176.57 2c5h s TYR 140 N 0.10 -0.03 -0.04 0.00 2.02 0.26 -1.48 117.35 118.17 2c5h s TYR 140 Ca -0.01 0.08 -0.30 0.00 -0.37 0.00 0.00 57.07 56.48 2c5h s TYR 140 Cb -0.01 0.00 -0.05 0.00 -0.40 0.00 0.00 41.96 41.50 2c5h s TYR 140 CO -0.00 -0.02 1.46 -2.00 -1.57 0.00 0.00 175.55 173.42 2c5h s GLU 141 N 0.07 4.24 -1.10 -0.62 2.12 -0.80 0.29 118.70 122.90 2c5h s GLU 141 Ca -0.00 2.00 -0.20 0.00 0.36 0.00 0.00 54.97 57.12 2c5h s GLU 141 Cb -0.01 -3.73 0.08 0.00 0.26 0.00 0.00 34.13 30.73 2c5h s GLU 141 CO -0.00 -0.69 1.47 0.08 -0.54 0.00 0.00 175.26 175.58 2c5h s VAL 142 N 3.11 4.26 -0.02 3.70 1.01 0.94 -2.27 120.40 131.12 2c5h s VAL 142 Ca 0.65 -1.46 0.04 0.00 0.00 0.00 0.00 61.98 61.22 2c5h s VAL 142 Cb -0.31 -5.03 -0.07 0.00 0.00 0.00 0.00 36.38 30.98 2c5h s VAL 142 CO 0.25 -1.85 0.10 0.35 0.00 0.00 0.00 175.10 173.96 2c5h n THR 143 N 6.23 0.00 -1.85 3.92 -2.24 0.21 -4.36 114.28 116.19 2c5h n THR 143 Ca 0.36 -0.12 -0.41 0.00 -2.27 0.00 0.00 64.05 61.61 2c5h n THR 143 Cb 0.48 0.43 -0.01 0.00 -2.10 0.00 0.00 70.33 69.13 2c5h n THR 143 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 2c5h s SER 144 N -2.45 6.43 0.21 3.42 0.15 0.16 -4.87 113.70 116.75 2c5h s SER 144 Ca -0.01 2.93 0.19 0.00 0.70 0.00 0.00 55.95 59.75 2c5h s SER 144 Cb 0.03 -2.65 0.87 0.00 -1.71 0.00 0.00 66.02 62.56 2c5h s SER 144 CO 0.18 -0.84 1.58 -2.65 1.20 0.00 0.00 173.24 172.71 2c5h n PRO 145 N 1.43 0.13 0.09 5.44 -0.02 -1.26 -1.92 135.00 138.90 2c5h n PRO 145 Ca 0.05 0.47 0.12 0.00 -2.02 0.00 0.00 63.50 62.12 2c5h n PRO 145 Cb 0.39 -1.80 0.45 0.00 -0.02 0.00 0.00 33.50 32.52 2c5h n PRO 145 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 2c5h n LYS 146 N -2.05 0.19 0.00 -0.52 5.02 -1.26 -4.09 118.16 115.45 2c5h n LYS 146 Ca 0.01 0.27 0.00 0.00 -2.02 0.00 0.00 58.31 56.57 2c5h n LYS 146 Cb 0.13 -1.77 0.00 0.00 -0.02 0.00 0.00 35.03 33.37 2c5h n LYS 146 CO 0.00 0.00 0.00 1.33 -0.52 0.00 0.00 177.40 178.21 2c5h n VAL 147 N -2.12 0.00 -4.33 -0.18 0.24 -0.92 -5.04 118.33 105.98 2c5h n VAL 147 Ca 0.04 -0.07 -0.19 0.00 -2.04 0.00 0.00 64.34 62.09 2c5h n VAL 147 Cb 0.33 1.32 -0.10 0.00 -1.47 0.00 0.00 33.84 33.92 2c5h n VAL 147 CO 0.00 0.00 0.00 0.27 -2.14 0.00 0.00 176.83 174.96 2c5h s ILE 148 N -0.09 1.70 0.64 1.34 -4.36 -0.81 -2.53 121.20 117.09 2c5h s ILE 148 Ca 0.00 -2.15 -0.18 0.00 -0.26 0.00 0.00 60.65 58.06 2c5h s ILE 148 Cb 0.00 -1.99 -0.02 0.00 1.25 0.00 0.00 42.46 41.70 2c5h s ILE 148 CO 0.00 -0.57 1.17 -2.65 0.24 0.00 0.00 174.94 173.14 2c5h n PRO 149 N -0.25 1.01 0.15 0.37 -0.02 -1.26 -4.46 135.00 130.54 2c5h n PRO 149 Ca -0.09 0.40 0.01 0.00 -2.02 0.00 0.00 63.50 61.80 2c5h n PRO 149 Cb 0.60 -2.40 0.21 0.00 -0.02 0.00 0.00 33.50 31.88 2c5h n PRO 149 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 2c5h h GLU 150 N 0.46 0.00 -2.63 -0.52 5.08 -1.97 -3.36 114.58 111.65 2c5h h GLU 150 Ca -0.50 0.00 -0.61 0.00 -1.00 0.00 0.00 59.36 57.25 2c5h h GLU 150 Cb 1.35 0.00 -0.41 0.00 0.50 0.00 0.00 28.75 30.19 2c5h h GLU 150 CO 0.52 0.54 -0.67 1.04 -1.00 0.00 0.00 179.01 179.44 2c5h n GLN 151 N -3.61 1.79 -1.99 2.33 3.00 -1.26 -5.09 117.38 112.55 2c5h n GLN 151 Ca -0.00 -4.31 -0.41 0.00 -0.01 0.00 0.00 57.00 52.27 2c5h n GLN 151 Cb 0.60 -2.13 -0.01 0.00 0.00 0.00 0.00 30.24 28.71 2c5h n GLN 151 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.06 175.81 2c5h s PRO 152 N -1.61 4.24 -0.05 -1.09 0.04 -1.26 -4.88 135.00 130.39 2c5h s PRO 152 Ca 0.32 2.36 -0.29 0.00 0.04 0.00 0.00 61.00 63.42 2c5h s PRO 152 Cb 0.05 -3.02 -0.07 0.00 0.04 0.00 0.00 34.50 31.50 2c5h s PRO 152 CO -0.12 -0.34 1.98 -2.00 0.04 0.00 0.00 177.00 176.56 2c5h s GLU 153 N -1.94 3.89 0.30 4.56 2.56 -1.26 -4.87 118.70 121.94 2c5h s GLU 153 Ca 0.51 2.38 0.04 0.00 0.00 0.00 0.00 54.97 57.89 2c5h s GLU 153 Cb -0.42 -4.19 0.78 0.00 2.00 0.00 0.00 34.13 32.30 2c5h s GLU 153 CO 0.57 -1.24 1.62 -1.35 -0.56 0.00 0.00 175.26 174.30 2c5h h PRO 154 N 11.56 0.13 0.00 4.30 0.11 -1.92 -2.12 132.00 144.06 2c5h h PRO 154 Ca -0.46 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.65 2c5h h PRO 154 Cb 1.23 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.31 2c5h h PRO 154 CO 0.95 0.09 -1.05 0.25 -0.21 0.00 0.00 178.00 178.02 2c5h n THR 155 N -5.30 0.21 -2.40 -1.15 -2.24 -1.26 0.20 114.28 102.34 2c5h n THR 155 Ca 0.23 -0.29 -0.30 0.00 -2.27 0.00 0.00 64.05 61.43 2c5h n THR 155 Cb 0.76 0.12 0.01 0.00 -2.10 0.00 0.00 70.33 69.12 2c5h n THR 155 CO 0.00 0.00 0.00 0.33 -0.57 0.00 0.00 175.07 174.83 2c5h n PHE 156 N -2.05 3.36 0.32 4.78 -0.00 -0.80 -4.76 117.46 118.31 2c5h n PHE 156 Ca 0.01 -3.00 0.19 0.00 -0.00 0.00 0.00 57.45 54.65 2c5h n PHE 156 Cb 0.45 -0.36 1.05 0.00 -0.00 0.00 0.00 39.48 40.63 2c5h n PHE 156 CO 0.00 0.00 0.00 1.88 -0.00 0.00 0.00 176.76 178.64 2c5h h TYR 157 N 2.72 0.00 -0.81 -5.13 -1.99 -1.78 -0.80 116.97 109.19 2c5h h TYR 157 Ca 0.35 0.00 0.00 0.00 2.00 0.00 0.00 58.73 61.08 2c5h h TYR 157 Cb 0.70 0.00 -0.04 0.00 2.00 0.00 0.00 36.73 39.39 2c5h h TYR 157 CO 0.91 0.00 0.51 0.77 -0.00 0.00 0.00 178.16 180.35 2c5h h SER 158 N 0.00 0.96 -0.04 3.88 0.02 -1.91 0.23 113.55 116.68 2c5h h SER 158 Ca -0.00 -0.05 -0.10 0.00 -0.84 0.00 0.00 61.79 60.80 2c5h h SER 158 Cb 0.02 -0.24 0.01 0.00 0.14 0.00 0.00 62.40 62.32 2c5h h SER 158 CO 0.00 0.72 -0.37 -0.09 -1.14 0.00 0.00 176.83 175.95 2c5h h ARG 159 N 1.11 0.33 0.22 3.45 2.43 -1.70 0.43 114.38 120.64 2c5h h ARG 159 Ca 0.29 -0.30 -0.29 0.00 -0.81 0.00 0.00 59.98 58.88 2c5h h ARG 159 Cb -0.07 0.07 0.03 0.00 -0.42 0.00 0.00 29.97 29.58 2c5h h ARG 159 CO -0.06 0.96 -1.27 0.93 -1.51 0.00 0.00 179.97 179.02 2c5h h GLU 160 N -0.19 0.47 -0.36 0.20 4.39 -1.06 -1.56 114.58 116.46 2c5h h GLU 160 Ca -0.03 -0.80 0.00 0.00 0.34 0.00 0.00 59.36 58.87 2c5h h GLU 160 Cb 1.06 0.30 0.00 0.00 -0.10 0.00 0.00 28.75 30.00 2c5h h GLU 160 CO 0.08 1.38 0.00 -1.33 -1.16 0.00 0.00 179.01 177.98 2c5h n MET 161 N -3.85 3.02 0.00 2.33 2.81 0.79 -4.30 117.12 117.92 2c5h n MET 161 Ca -0.16 -2.46 0.00 0.00 -1.81 0.00 0.00 57.70 53.27 2c5h n MET 161 Cb 1.02 -1.57 0.00 0.00 -0.71 0.00 0.00 33.22 31.96 2c5h n MET 161 CO 0.00 0.00 0.00 0.28 1.51 0.00 0.00 175.97 177.76 2c5h n VAL 162 N 0.24 0.00 0.10 2.03 0.31 -1.19 -4.67 118.33 115.15 2c5h n VAL 162 Ca 0.17 0.00 -0.14 0.00 -0.01 0.00 0.00 64.34 64.36 2c5h n VAL 162 Cb 0.66 -0.01 -0.09 0.00 -0.91 0.00 0.00 33.84 33.50 2c5h n VAL 162 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2c5h h ALA 163 N 0.00 -0.94 0.07 3.52 0.00 -0.78 0.19 119.26 121.33 2c5h h ALA 163 Ca 0.00 -0.10 0.02 0.00 0.00 0.00 0.00 54.91 54.83 2c5h h ALA 163 Cb 0.00 0.84 -0.05 0.00 0.00 0.00 0.00 17.79 18.58 2c5h h ALA 163 CO 0.00 -1.05 -0.47 0.82 0.00 0.00 0.00 179.25 178.55 2c5h h ILE 164 N -0.65 0.09 0.00 0.00 2.04 -1.52 -1.93 117.51 115.53 2c5h h ILE 164 Ca -0.01 0.00 -0.05 0.00 1.00 0.00 0.00 64.86 65.81 2c5h h ILE 164 Cb 0.66 0.09 -0.01 0.00 -0.74 0.00 0.00 36.82 36.82 2c5h h ILE 164 CO -0.25 0.00 -0.22 1.55 0.00 0.00 0.00 178.15 179.23 2c5h h PRO 165 N -0.67 0.00 -0.33 2.37 0.13 -1.35 -1.21 132.00 130.94 2c5h h PRO 165 Ca 0.02 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.15 2c5h h PRO 165 Cb 0.71 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.82 2c5h h PRO 165 CO -0.29 0.22 0.19 0.66 -0.23 0.00 0.00 178.00 178.54 2c5h h SER 166 N 0.00 0.39 -0.14 1.44 4.64 0.12 -1.36 113.55 118.65 2c5h h SER 166 Ca -0.00 -0.02 -0.18 0.00 -0.47 0.00 0.00 61.79 61.12 2c5h h SER 166 Cb 0.47 -0.10 -0.00 0.00 -0.31 0.00 0.00 62.40 62.45 2c5h h SER 166 CO 0.03 0.32 -0.56 0.00 -0.87 0.00 0.00 176.83 175.74 2c5h h ALA 167 N 1.75 0.56 -0.94 5.18 0.00 -0.57 0.15 119.26 125.39 2c5h h ALA 167 Ca 0.12 -0.52 -0.01 0.00 0.00 0.00 0.00 54.91 54.50 2c5h h ALA 167 Cb 0.01 -0.08 -0.05 0.00 0.00 0.00 0.00 17.79 17.67 2c5h h ALA 167 CO -0.02 0.69 0.57 0.45 0.00 0.00 0.00 179.25 180.93 2c5h h HIS 168 N 0.56 1.23 -0.23 0.00 3.86 -1.05 -0.20 115.15 119.32 2c5h h HIS 168 Ca 0.01 -0.00 -0.11 0.00 -1.16 0.00 0.00 60.37 59.10 2c5h h HIS 168 Cb 1.15 -0.41 -0.00 0.00 1.06 0.00 0.00 27.41 29.21 2c5h h HIS 168 CO 0.06 0.82 -0.30 -0.07 0.86 0.00 0.00 177.93 179.30 2c5h h LEU 169 N 1.29 0.67 -1.70 2.43 3.38 -0.89 0.38 115.31 120.87 2c5h h LEU 169 Ca 0.34 -0.50 0.07 0.00 0.09 0.00 0.00 57.88 57.87 2c5h h LEU 169 Cb -0.06 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 40.48 2c5h h LEU 169 CO -0.06 1.04 0.32 0.00 0.09 0.00 0.00 178.44 179.82 2c5h h ALA 170 N 0.65 1.97 -0.06 1.53 0.00 -0.50 -1.92 119.26 120.94 2c5h h ALA 170 Ca 0.03 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.92 2c5h h ALA 170 Cb 0.88 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.58 2c5h h ALA 170 CO 0.07 -0.06 0.00 0.00 0.00 0.00 0.00 179.25 179.26 2c5h n ALA 171 N -2.52 2.50 -0.67 0.00 0.00 -0.10 -4.79 120.51 114.92 2c5h n ALA 171 Ca 0.07 -0.11 0.00 0.00 0.00 0.00 0.00 53.44 53.39 2c5h n ALA 171 Cb 0.28 -1.01 0.00 0.00 0.00 0.00 0.00 19.45 18.71 2c5h n ALA 171 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2c5h n GLY 172 N 0.61 0.76 3.66 0.00 0.00 -0.72 -5.02 105.19 104.47 2c5h n GLY 172 Ca 0.03 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.63 2c5h n GLY 172 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 2c5h n PHE 173 N -2.30 2.50 -1.67 1.61 7.35 0.05 -4.86 117.46 120.14 2c5h n PHE 173 Ca 0.00 -0.37 -0.51 0.00 -0.76 0.00 0.00 57.45 55.81 2c5h n PHE 173 Cb 0.00 -2.80 -0.05 0.00 0.35 0.00 0.00 39.48 36.97 2c5h n PHE 173 CO 0.00 0.00 0.00 -2.30 -0.76 0.00 0.00 176.76 173.70 2c5h n PRO 174 N 7.60 1.85 -0.28 -7.13 -0.02 -1.26 -4.52 135.00 131.23 2c5h n PRO 174 Ca 0.20 0.67 -0.00 0.00 -2.02 0.00 0.00 63.50 62.35 2c5h n PRO 174 Cb 0.41 -2.52 0.06 0.00 -0.02 0.00 0.00 33.50 31.44 2c5h n PRO 174 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 2c5h h LEU 175 N 9.11 -1.00 0.00 2.45 5.85 -1.95 -1.31 115.31 128.45 2c5h h LEU 175 Ca -0.46 0.25 0.00 0.00 0.84 0.00 0.00 57.88 58.51 2c5h h LEU 175 Cb 1.29 0.58 0.00 0.00 0.37 0.00 0.00 40.66 42.89 2c5h h LEU 175 CO 0.96 -0.28 0.00 -1.54 -0.34 0.00 0.00 178.44 177.23 2c5h n SER 176 N -5.49 0.00 -0.74 1.25 3.41 -1.26 -2.14 113.62 108.64 2c5h n SER 176 Ca 0.09 -0.57 0.08 0.00 -0.26 0.00 0.00 58.87 58.21 2c5h n SER 176 Cb 0.40 0.00 0.13 0.00 -0.26 0.00 0.00 64.21 64.47 2c5h n SER 176 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2c5h n GLU 177 N -0.84 1.87 0.22 4.33 1.02 -0.49 -4.39 120.64 122.34 2c5h n GLU 177 Ca 0.07 -1.79 0.11 0.00 -0.02 0.00 0.00 57.16 55.54 2c5h n GLU 177 Cb 0.03 -1.33 0.27 0.00 -0.02 0.00 0.00 31.44 30.39 2c5h n GLU 177 CO 0.00 0.00 0.00 -0.39 1.18 0.00 0.00 177.13 177.92 2c5h h VAL 178 N 2.96 0.23 0.00 2.62 -1.51 -1.57 -3.43 116.25 115.54 2c5h h VAL 178 Ca 0.00 -1.15 0.00 0.00 -1.23 0.00 0.00 66.70 64.32 2c5h h VAL 178 Cb 0.72 1.96 0.00 0.00 -2.13 0.00 0.00 31.29 31.85 2c5h h VAL 178 CO 0.00 0.12 0.00 0.61 -1.23 0.00 0.00 177.57 177.07 2c5h n GLY 179 N 0.82 -0.10 3.64 5.19 0.00 -0.96 0.64 105.19 114.42 2c5h n GLY 179 Ca 0.03 -1.26 -0.35 0.00 0.00 0.00 0.00 46.02 44.44 2c5h n GLY 179 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2c5h n ARG 180 N -0.97 0.44 -2.05 1.61 1.85 -1.26 -4.37 116.66 111.91 2c5h n ARG 180 Ca 0.00 0.21 -0.38 0.00 -1.00 0.00 0.00 57.85 56.68 2c5h n ARG 180 Cb 0.00 -2.30 0.01 0.00 -1.05 0.00 0.00 32.46 29.12 2c5h n ARG 180 CO 0.00 0.00 0.00 -2.14 -0.01 0.00 0.00 177.63 175.48 2c5h s PRO 181 N -3.56 3.60 -0.17 2.89 0.02 -1.26 -1.90 135.00 134.62 2c5h s PRO 181 Ca 0.74 2.02 -0.06 0.00 0.02 0.00 0.00 61.00 63.71 2c5h s PRO 181 Cb -0.33 -2.44 -0.04 0.00 0.02 0.00 0.00 34.50 31.71 2c5h s PRO 181 CO 0.50 -0.75 0.03 -0.51 -0.33 0.00 0.00 177.00 175.94 2c5h s LEU 182 N -3.05 3.65 0.85 -5.54 1.43 -0.55 -4.84 118.68 110.64 2c5h s LEU 182 Ca 0.65 0.03 -0.11 0.00 -1.03 0.00 0.00 54.13 53.67 2c5h s LEU 182 Cb -0.35 -1.90 0.10 0.00 0.03 0.00 0.00 46.19 44.07 2c5h s LEU 182 CO 0.42 0.19 1.09 -1.61 0.23 0.00 0.00 176.35 176.68 2c5h s GLU 183 N 0.25 1.61 0.08 1.70 2.02 -1.26 -4.69 118.70 118.41 2c5h s GLU 183 Ca 0.02 0.90 -0.25 0.00 0.02 0.00 0.00 54.97 55.66 2c5h s GLU 183 Cb -0.13 -1.84 -0.16 0.00 0.10 0.00 0.00 34.13 32.10 2c5h s GLU 183 CO 0.01 -2.02 1.70 0.22 0.02 0.00 0.00 175.26 175.19 2c5h h ASP 184 N -1.39 -0.16 0.00 -0.19 3.58 -1.99 -2.44 116.42 113.83 2c5h h ASP 184 Ca -0.48 -0.01 0.00 0.00 0.42 0.00 0.00 57.03 56.97 2c5h h ASP 184 Cb 1.27 0.04 0.00 0.00 1.72 0.00 0.00 39.33 42.36 2c5h h ASP 184 CO 0.54 -0.10 0.15 1.12 -2.88 0.00 0.00 179.24 178.07 2c5h h HIS 185 N -0.20 0.00 0.00 0.28 2.07 -2.03 0.34 115.15 115.61 2c5h h HIS 185 Ca -0.02 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.50 2c5h h HIS 185 Cb 0.16 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.14 2c5h h HIS 185 CO -0.06 0.00 -0.60 0.39 -3.07 0.00 0.00 177.93 174.59 2c5h n GLU 186 N -2.45 0.27 -2.76 5.12 1.02 -0.92 -4.68 120.64 116.24 2c5h n GLU 186 Ca -0.02 0.08 -0.43 0.00 -0.02 0.00 0.00 57.16 56.78 2c5h n GLU 186 Cb 0.19 -1.67 -0.04 0.00 -0.02 0.00 0.00 31.44 29.90 2c5h n GLU 186 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 2c5h s ILE 187 N -3.15 4.24 0.29 -3.67 1.01 0.12 -4.99 121.20 115.04 2c5h s ILE 187 Ca 0.07 0.36 -0.30 0.00 0.00 0.00 0.00 60.65 60.78 2c5h s ILE 187 Cb 0.14 -4.63 -0.12 0.00 0.01 0.00 0.00 42.46 37.85 2c5h s ILE 187 CO 0.71 -1.26 1.46 0.52 0.00 0.00 0.00 174.94 176.37 2c5h n VAL 188 N 6.29 1.23 -4.38 2.92 0.31 -1.26 -5.01 118.33 118.43 2c5h n VAL 188 Ca 0.03 -0.31 -0.26 0.00 -0.01 0.00 0.00 64.34 63.79 2c5h n VAL 188 Cb 0.48 -1.70 -0.13 0.00 -0.91 0.00 0.00 33.84 31.58 2c5h n VAL 188 CO 0.00 0.00 0.00 -0.13 -1.32 0.00 0.00 176.83 175.38 2c5h s ARG 189 N -0.81 1.28 0.32 5.55 3.00 -1.26 -3.93 118.95 123.10 2c5h s ARG 189 Ca 0.63 -1.22 0.07 0.00 0.00 0.00 0.00 55.73 55.21 2c5h s ARG 189 Cb -0.57 -1.63 -0.02 0.00 0.00 0.00 0.00 34.95 32.73 2c5h s ARG 189 CO 0.52 0.39 0.36 -0.59 0.00 0.00 0.00 175.30 175.98 2c5h s PHE 190 N -1.08 3.08 -0.16 -0.53 -0.12 -1.26 -4.92 117.98 112.98 2c5h s PHE 190 Ca 0.10 -0.21 -0.14 0.00 -0.05 0.00 0.00 56.93 56.62 2c5h s PHE 190 Cb -0.10 -1.81 -0.05 0.00 -0.63 0.00 0.00 43.02 40.44 2c5h s PHE 190 CO 0.05 0.17 0.32 -0.80 -0.05 0.00 0.00 175.22 174.90 2c5h s ASN 191 N -4.05 6.45 0.14 1.98 0.01 -1.26 -5.02 114.94 113.18 2c5h s ASN 191 Ca 0.41 0.52 -0.30 0.00 -0.71 0.00 0.00 52.86 52.78 2c5h s ASN 191 Cb -0.08 -2.19 -0.08 0.00 0.41 0.00 0.00 41.25 39.31 2c5h s ASN 191 CO 0.29 0.07 1.27 -0.13 -1.51 0.00 0.00 177.10 177.09 2c5h s ARG 192 N 0.59 4.41 0.01 -0.60 0.52 -1.26 -4.96 118.95 117.65 2c5h s ARG 192 Ca 0.17 1.95 -0.30 0.00 -0.52 0.00 0.00 55.73 57.03 2c5h s ARG 192 Cb -0.13 -3.25 -0.05 0.00 0.52 0.00 0.00 34.95 32.03 2c5h s ARG 192 CO 0.05 -0.26 1.27 -1.25 0.02 0.00 0.00 175.30 175.13 2c5h s PRO 193 N 0.43 4.35 0.37 3.54 0.05 -1.26 -4.97 135.00 137.52 2c5h s PRO 193 Ca 0.58 1.81 -0.12 0.00 0.05 0.00 0.00 61.00 63.33 2c5h s PRO 193 Cb -0.34 -3.48 -0.07 0.00 0.05 0.00 0.00 34.50 30.66 2c5h s PRO 193 CO 0.34 -0.43 0.75 0.00 0.05 0.00 0.00 177.00 177.71 2c5h s ALA 194 N 1.84 3.36 -0.19 8.56 0.00 -1.26 -5.05 121.76 129.03 2c5h s ALA 194 Ca 0.60 -0.15 -0.14 0.00 0.00 0.00 0.00 51.96 52.26 2c5h s ALA 194 Cb -0.29 -2.70 -0.04 0.00 0.00 0.00 0.00 23.12 20.09 2c5h s ALA 194 CO 0.26 0.11 0.33 0.08 0.00 0.00 0.00 175.76 176.54 2c5h s VAL 195 N -2.24 5.26 -0.32 0.00 1.01 -1.26 -4.84 120.40 118.01 2c5h s VAL 195 Ca 0.52 0.59 -0.09 0.00 0.00 0.00 0.00 61.98 62.99 2c5h s VAL 195 Cb -0.10 -3.67 0.00 0.00 0.00 0.00 0.00 36.38 32.61 2c5h s VAL 195 CO 0.27 0.32 0.15 -1.61 0.00 0.00 0.00 175.10 174.23 2c5h s GLU 196 N 0.91 3.18 -1.27 2.72 0.41 -0.71 -4.96 118.70 118.98 2c5h s GLU 196 Ca 0.17 -0.82 -0.17 0.00 -0.41 0.00 0.00 54.97 53.73 2c5h s GLU 196 Cb -0.14 -3.56 0.00 0.00 -1.78 0.00 0.00 34.13 28.65 2c5h s GLU 196 CO 0.06 -0.48 2.02 0.94 -0.49 0.00 0.00 175.26 177.31 2c5h n GLN 197 N 4.96 2.59 -2.56 1.61 7.27 -1.26 -2.40 117.38 127.58 2c5h n GLN 197 Ca -0.14 -2.64 -0.43 0.00 0.07 0.00 0.00 57.00 53.87 2c5h n GLN 197 Cb 0.48 -3.32 -0.02 0.00 2.41 0.00 0.00 30.24 29.79 2c5h n GLN 197 CO 0.00 0.00 0.00 0.34 0.07 0.00 0.00 177.06 177.47 2c5h s ASP 198 N 4.09 6.50 0.18 1.69 3.68 -1.25 -4.87 116.67 126.69 2c5h s ASP 198 Ca 0.53 0.31 0.00 0.00 2.13 0.00 0.00 52.55 55.52 2c5h s ASP 198 Cb 0.10 -2.55 0.00 0.00 -1.45 0.00 0.00 42.92 39.02 2c5h s ASP 198 CO 0.01 -1.40 0.00 0.61 0.13 0.00 0.00 175.17 174.52 2c5h n GLY 199 N 4.99 -0.26 0.24 2.66 0.00 -1.26 -3.08 105.19 108.49 2c5h n GLY 199 Ca 0.11 -1.05 0.14 0.00 0.00 0.00 0.00 46.02 45.22 2c5h n GLY 199 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2c5h h GLU 200 N 0.00 0.00 -7.24 1.61 4.39 -1.97 -3.47 114.58 107.90 2c5h h GLU 200 Ca 0.00 0.00 -0.48 0.00 0.34 0.00 0.00 59.36 59.22 2c5h h GLU 200 Cb 0.00 0.00 0.19 0.00 -0.10 0.00 0.00 28.75 28.84 2c5h h GLU 200 CO 0.00 0.00 0.16 0.00 -1.16 0.00 0.00 179.01 178.01 2c5h s ALA 201 N -3.40 0.81 -0.19 3.43 0.00 -1.18 -4.90 121.76 116.33 2c5h s ALA 201 Ca 0.05 0.20 -0.03 0.00 0.00 0.00 0.00 51.96 52.18 2c5h s ALA 201 Cb 0.07 -3.32 0.06 0.00 0.00 0.00 0.00 23.12 19.92 2c5h s ALA 201 CO 0.61 -3.04 0.03 -0.51 0.00 0.00 0.00 175.76 172.85 2c5h s LEU 202 N -6.73 1.17 -0.09 0.00 1.43 -0.69 -3.81 118.68 109.96 2c5h s LEU 202 Ca 0.66 -0.77 -0.18 0.00 -1.03 0.00 0.00 54.13 52.81 2c5h s LEU 202 Cb -0.22 -0.60 -0.04 0.00 0.03 0.00 0.00 46.19 45.35 2c5h s LEU 202 CO 0.60 -0.29 0.50 -0.69 0.23 0.00 0.00 176.35 176.70 2c5h s VAL 203 N 1.85 5.13 0.00 -1.59 1.01 -1.01 -2.30 120.40 123.49 2c5h s VAL 203 Ca -0.01 1.01 0.00 0.00 0.00 0.00 0.00 61.98 62.98 2c5h s VAL 203 Cb -0.17 -3.84 0.00 0.00 0.00 0.00 0.00 36.38 32.38 2c5h s VAL 203 CO -0.08 0.36 0.00 0.61 0.00 0.00 0.00 175.10 175.99 2c5h n GLY 204 N 3.03 5.34 3.34 4.51 0.00 -0.31 -1.74 105.19 119.36 2c5h n GLY 204 Ca -0.07 -0.77 -0.14 0.00 0.00 0.00 0.00 46.02 45.04 2c5h n GLY 204 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2c5h s VAL 205 N 1.60 0.02 -0.31 1.61 0.11 -1.26 -1.80 120.40 120.37 2c5h s VAL 205 Ca 0.00 -0.20 -0.28 0.00 -2.93 0.00 0.00 61.98 58.56 2c5h s VAL 205 Cb 0.00 -0.70 -0.02 0.00 -1.53 0.00 0.00 36.38 34.13 2c5h s VAL 205 CO 0.00 -0.11 1.80 -0.69 -3.33 0.00 0.00 175.10 172.77 2c5h s VAL 206 N -0.71 3.47 -0.47 2.04 1.01 -0.97 -1.71 120.40 123.06 2c5h s VAL 206 Ca -0.08 0.48 0.24 0.00 0.00 0.00 0.00 61.98 62.62 2c5h s VAL 206 Cb -0.03 -3.62 0.17 0.00 0.00 0.00 0.00 36.38 32.89 2c5h s VAL 206 CO 0.04 -0.39 1.42 0.77 0.00 0.00 0.00 175.10 176.94 2c5h h SER 207 N 12.76 0.00 -4.60 3.32 4.64 -0.63 -2.09 113.55 126.95 2c5h h SER 207 Ca -0.34 -0.05 0.07 0.00 -0.47 0.00 0.00 61.79 61.00 2c5h h SER 207 Cb 1.17 0.00 -0.17 0.00 -0.31 0.00 0.00 62.40 63.09 2c5h h SER 207 CO 1.02 0.02 0.44 0.00 -0.87 0.00 0.00 176.83 177.45 2c5h s ALA 208 N -3.23 -1.82 -0.15 5.18 0.00 -0.89 -4.80 121.76 116.05 2c5h s ALA 208 Ca 0.05 1.13 -0.12 0.00 0.00 0.00 0.00 51.96 53.02 2c5h s ALA 208 Cb 0.09 0.16 -0.05 0.00 0.00 0.00 0.00 23.12 23.32 2c5h s ALA 208 CO 0.70 -0.57 0.25 0.42 0.00 0.00 0.00 175.76 176.56 2c5h s ILE 209 N -2.51 5.33 -0.97 0.00 -1.09 -1.26 -0.86 121.20 119.85 2c5h s ILE 209 Ca 0.01 0.45 -0.20 0.00 -2.23 0.00 0.00 60.65 58.68 2c5h s ILE 209 Cb -0.01 -3.58 0.10 0.00 -1.58 0.00 0.00 42.46 37.40 2c5h s ILE 209 CO -0.05 0.44 1.25 -0.62 -1.23 0.00 0.00 174.94 174.73 2c5h s ASP 210 N 0.17 6.58 0.35 3.58 2.15 0.16 -4.94 116.67 124.73 2c5h s ASP 210 Ca 0.15 -1.83 -0.26 0.00 0.43 0.00 0.00 52.55 51.03 2c5h s ASP 210 Cb -0.13 -2.46 -0.09 0.00 -0.30 0.00 0.00 42.92 39.94 2c5h s ASP 210 CO 0.03 -1.23 1.07 -1.00 -0.17 0.00 0.00 175.17 173.87 2c5h s HIS 211 N 3.53 3.39 -2.00 -5.34 3.76 -1.26 -1.81 115.29 115.55 2c5h s HIS 211 Ca 0.38 1.67 0.21 0.00 -0.15 0.00 0.00 55.06 57.17 2c5h s HIS 211 Cb -0.03 -3.19 0.60 0.00 1.11 0.00 0.00 32.58 31.07 2c5h s HIS 211 CO -0.10 -0.59 1.50 -0.35 -0.85 0.00 0.00 174.74 174.35 2c5h n PRO 212 N 0.42 2.57 0.09 8.40 -0.04 -1.26 -4.91 135.00 140.27 2c5h n PRO 212 Ca 0.03 -2.44 0.01 0.00 -0.04 0.00 0.00 63.50 61.06 2c5h n PRO 212 Cb 0.48 -1.53 -0.03 0.00 -0.04 0.00 0.00 33.50 32.38 2c5h n PRO 212 CO 0.00 0.00 0.00 0.74 -0.04 0.00 0.00 175.50 176.20 2c5h h PHE 213 N 3.96 0.00 0.00 0.54 0.04 -1.79 -3.48 116.94 116.22 2c5h h PHE 213 Ca 0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 2c5h h PHE 213 Cb 0.91 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.06 2c5h h PHE 213 CO 0.45 0.53 0.00 0.41 -0.60 0.00 0.00 178.31 179.10 2c5h n GLY 214 N 1.30 0.41 3.79 -1.45 0.00 -0.75 -3.86 105.19 104.63 2c5h n GLY 214 Ca -0.03 -1.03 -0.34 0.00 0.00 0.00 0.00 46.02 44.62 2c5h n GLY 214 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2c5h s ASN 215 N -2.93 5.76 -0.20 1.61 0.01 -1.22 -0.45 114.94 117.52 2c5h s ASN 215 Ca 0.00 1.98 -0.03 0.00 -0.71 0.00 0.00 52.86 54.10 2c5h s ASN 215 Cb 0.00 -2.56 -0.01 0.00 0.41 0.00 0.00 41.25 39.10 2c5h s ASN 215 CO 0.00 -1.18 -0.06 -0.69 -1.51 0.00 0.00 177.10 173.65 2c5h s VAL 216 N -2.13 3.29 -0.17 1.60 1.01 0.21 0.40 120.40 124.60 2c5h s VAL 216 Ca 0.68 -0.53 -0.06 0.00 0.00 0.00 0.00 61.98 62.07 2c5h s VAL 216 Cb -0.19 -2.47 -0.03 0.00 0.00 0.00 0.00 36.38 33.68 2c5h s VAL 216 CO 0.31 0.45 0.01 0.26 0.00 0.00 0.00 175.10 176.13 2c5h s TRP 217 N 1.23 3.14 0.28 5.22 0.51 -0.04 -0.63 118.94 128.65 2c5h s TRP 217 Ca 0.03 -0.12 0.07 0.00 -2.12 0.00 0.00 56.10 53.96 2c5h s TRP 217 Cb -0.14 -2.02 -0.03 0.00 -0.81 0.00 0.00 33.47 30.46 2c5h s TRP 217 CO -0.02 0.05 0.21 0.95 -0.51 0.00 0.00 176.95 177.63 2c5h s THR 218 N 0.39 4.14 -1.13 2.01 -4.23 -0.32 0.07 115.64 116.57 2c5h s THR 218 Ca -0.00 -1.43 0.04 0.00 -1.18 0.00 0.00 61.69 59.11 2c5h s THR 218 Cb -0.13 -3.31 0.17 0.00 1.34 0.00 0.00 72.50 70.57 2c5h s THR 218 CO 0.02 -0.30 0.87 -0.46 -0.54 0.00 0.00 174.62 174.20 2c5h n ASN 219 N -1.21 1.76 -4.43 3.99 6.94 -0.69 -4.27 115.26 117.35 2c5h n ASN 219 Ca -0.06 -2.16 -0.44 0.00 -0.02 0.00 0.00 54.58 51.90 2c5h n ASN 219 Cb 0.58 -0.43 -0.03 0.00 -2.36 0.00 0.00 39.78 37.54 2c5h n ASN 219 CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 2c5h s ILE 220 N -1.49 4.68 0.68 1.53 1.01 -1.26 -4.83 121.20 121.52 2c5h s ILE 220 Ca 0.12 -1.20 -0.13 0.00 0.00 0.00 0.00 60.65 59.44 2c5h s ILE 220 Cb 0.08 -4.69 0.00 0.00 0.01 0.00 0.00 42.46 37.87 2c5h s ILE 220 CO 0.05 -1.40 1.07 -2.28 0.00 0.00 0.00 174.94 172.38 2c5h s HIS 221 N 2.92 2.87 0.17 3.97 5.65 -1.26 0.95 115.29 130.57 2c5h s HIS 221 Ca 0.25 1.50 -0.24 0.00 0.25 0.00 0.00 55.06 56.82 2c5h s HIS 221 Cb -0.12 -3.00 0.06 0.00 -1.18 0.00 0.00 32.58 28.34 2c5h s HIS 221 CO -0.01 -1.40 1.57 -0.09 -0.65 0.00 0.00 174.74 174.16 2c5h h ARG 222 N -0.33 -0.21 -0.91 2.88 2.43 -1.27 -1.68 114.38 115.29 2c5h h ARG 222 Ca -0.45 0.01 0.08 0.00 -0.81 0.00 0.00 59.98 58.81 2c5h h ARG 222 Cb 1.22 0.05 -0.06 0.00 -0.42 0.00 0.00 29.97 30.76 2c5h h ARG 222 CO 0.55 -0.14 0.59 1.79 -1.51 0.00 0.00 179.97 181.25 2c5h h THR 223 N -0.22 1.03 -0.79 0.20 1.35 -1.93 1.81 112.91 114.36 2c5h h THR 223 Ca 0.19 -0.34 0.16 0.00 -0.55 0.00 0.00 66.41 65.87 2c5h h THR 223 Cb 0.56 -0.04 -0.05 0.00 -1.73 0.00 0.00 68.15 66.88 2c5h h THR 223 CO -0.68 0.18 0.53 0.44 -0.25 0.00 0.00 175.52 175.74 2c5h h ASP 224 N 0.99 0.42 0.13 5.36 3.45 -1.70 -2.80 116.42 122.26 2c5h h ASP 224 Ca 0.40 0.03 -0.24 0.00 0.43 0.00 0.00 57.03 57.65 2c5h h ASP 224 Cb 0.27 -0.06 0.01 0.00 -0.56 0.00 0.00 39.33 38.99 2c5h h ASP 224 CO -0.16 0.21 -1.15 -0.07 -1.57 0.00 0.00 179.24 176.50 2c5h h LEU 225 N 0.44 0.43 -0.06 1.55 3.38 0.33 -3.29 115.31 118.09 2c5h h LEU 225 Ca 0.40 -0.90 0.00 0.00 0.09 0.00 0.00 57.88 57.47 2c5h h LEU 225 Cb 0.89 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.50 2c5h h LEU 225 CO -0.14 1.52 0.00 -1.84 0.09 0.00 0.00 178.44 178.07 2c5h n GLU 226 N -4.01 0.85 0.00 1.13 0.28 0.12 -1.17 120.64 117.84 2c5h n GLU 226 Ca -0.20 0.00 0.03 0.00 -0.16 0.00 0.00 57.16 56.83 2c5h n GLU 226 Cb 0.87 -1.03 0.01 0.00 1.43 0.00 0.00 31.44 32.73 2c5h n GLU 226 CO 0.00 0.00 0.00 0.36 -0.16 0.00 0.00 177.13 177.33 2c5h n LYS 227 N -0.46 0.82 0.00 3.44 2.85 -1.07 -4.19 118.16 119.55 2c5h n LYS 227 Ca 0.00 -0.70 0.12 0.00 -1.05 0.00 0.00 58.31 56.68 2c5h n LYS 227 Cb 0.01 -1.05 0.12 0.00 -0.65 0.00 0.00 35.03 33.47 2c5h n LYS 227 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2c5h n ALA 228 N 0.07 2.56 0.00 0.58 0.00 -0.32 -4.98 120.51 118.42 2c5h n ALA 228 Ca 0.03 -0.67 0.00 0.00 0.00 0.00 0.00 53.44 52.80 2c5h n ALA 228 Cb 0.14 -0.83 0.00 0.00 0.00 0.00 0.00 19.45 18.75 2c5h n ALA 228 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2c5h n GLY 229 N 1.35 2.90 2.39 0.00 0.00 -1.01 -5.05 105.19 105.76 2c5h n GLY 229 Ca 0.14 -0.77 -0.43 0.00 0.00 0.00 0.00 46.02 44.96 2c5h n GLY 229 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2c5h n ILE 230 N 0.00 0.00 -4.28 -0.61 5.41 -1.10 -4.63 119.36 114.15 2c5h n ILE 230 Ca 0.00 0.00 -0.19 0.00 1.00 0.00 0.00 62.75 63.56 2c5h n ILE 230 Cb 0.00 -0.32 -0.08 0.00 -0.71 0.00 0.00 39.64 38.53 2c5h n ILE 230 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2c5h n GLY 231 N 2.89 2.93 3.51 7.39 0.00 -1.26 -3.39 105.19 117.26 2c5h n GLY 231 Ca 0.22 -1.90 -0.38 0.00 0.00 0.00 0.00 46.02 43.96 2c5h n GLY 231 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2c5h n TYR 232 N -0.63 -0.19 0.00 1.61 4.01 -1.26 -2.34 117.16 118.35 2c5h n TYR 232 Ca 0.07 0.45 0.00 0.00 -0.16 0.00 0.00 57.90 58.26 2c5h n TYR 232 Cb 0.60 -2.02 0.00 0.00 -0.31 0.00 0.00 39.34 37.61 2c5h n TYR 232 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2c5h n GLY 233 N 1.62 2.99 3.74 2.72 0.00 0.10 -4.95 105.19 111.41 2c5h n GLY 233 Ca 0.12 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.73 2c5h n GLY 233 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2c5h s ALA 234 N -2.04 3.48 -0.40 4.61 0.00 -0.99 -4.55 121.76 121.88 2c5h s ALA 234 Ca 0.00 1.05 -0.29 0.00 0.00 0.00 0.00 51.96 52.72 2c5h s ALA 234 Cb 0.00 -3.45 0.02 0.00 0.00 0.00 0.00 23.12 19.70 2c5h s ALA 234 CO 0.00 -0.46 1.14 0.50 0.00 0.00 0.00 175.76 176.94 2c5h s ARG 235 N -0.42 3.86 -0.05 0.00 3.52 -1.26 -0.11 118.95 124.49 2c5h s ARG 235 Ca 0.54 0.82 0.01 0.00 -0.13 0.00 0.00 55.73 56.97 2c5h s ARG 235 Cb -0.35 -3.85 -0.03 0.00 -1.56 0.00 0.00 34.95 29.16 2c5h s ARG 235 CO 0.39 -1.19 -0.05 -0.51 -0.81 0.00 0.00 175.30 173.12 2c5h s LEU 236 N 4.20 3.25 -0.26 -0.88 1.43 0.31 -4.60 118.68 122.13 2c5h s LEU 236 Ca 0.48 -0.03 -0.09 0.00 -1.03 0.00 0.00 54.13 53.46 2c5h s LEU 236 Cb -0.10 -1.77 -0.04 0.00 0.03 0.00 0.00 46.19 44.32 2c5h s LEU 236 CO 0.25 0.34 0.11 -0.60 0.23 0.00 0.00 176.35 176.68 2c5h s ARG 237 N -1.04 3.78 -0.07 1.70 3.52 0.51 -1.93 118.95 125.42 2c5h s ARG 237 Ca 0.14 -0.41 0.05 0.00 -0.13 0.00 0.00 55.73 55.38 2c5h s ARG 237 Cb -0.11 -3.44 -0.01 0.00 -1.56 0.00 0.00 34.95 29.83 2c5h s ARG 237 CO 0.04 -0.15 -0.22 -1.17 -0.81 0.00 0.00 175.30 172.98 2c5h s LEU 238 N 1.58 2.23 -0.31 -0.88 2.96 0.12 0.15 118.68 124.54 2c5h s LEU 238 Ca 0.06 -0.45 0.00 0.00 -0.22 0.00 0.00 54.13 53.52 2c5h s LEU 238 Cb -0.15 -1.43 0.10 0.00 0.50 0.00 0.00 46.19 45.21 2c5h s LEU 238 CO 0.06 0.24 0.08 -0.89 -1.32 0.00 0.00 176.35 174.52 2c5h s THR 239 N -0.12 1.25 0.19 3.68 2.01 1.04 0.93 115.64 124.62 2c5h s THR 239 Ca -0.04 -1.61 -0.27 0.00 0.31 0.00 0.00 61.69 60.08 2c5h s THR 239 Cb -0.14 -1.91 -0.08 0.00 0.01 0.00 0.00 72.50 70.37 2c5h s THR 239 CO 0.04 -0.62 0.84 -0.76 -0.69 0.00 0.00 174.62 173.43 2c5h s LEU 240 N 1.43 4.61 0.00 4.42 1.43 -0.37 -0.97 118.68 129.23 2c5h s LEU 240 Ca 0.09 1.76 0.00 0.00 -1.03 0.00 0.00 54.13 54.95 2c5h s LEU 240 Cb -0.18 -3.42 0.00 0.00 0.03 0.00 0.00 46.19 42.63 2c5h s LEU 240 CO -0.20 0.19 0.00 -0.67 0.23 0.00 0.00 176.35 175.90 2c5h n ASP 241 N 1.54 -5.08 0.00 2.29 2.03 0.30 -2.05 116.55 115.58 2c5h n ASP 241 Ca -0.04 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.27 2c5h n ASP 241 Cb 0.48 -2.99 0.00 0.00 -0.72 0.00 0.00 41.12 37.89 2c5h n ASP 241 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2c5h n GLY 242 N 0.22 2.51 0.25 0.27 0.00 -1.26 -4.79 105.19 102.39 2c5h n GLY 242 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.97 2c5h n GLY 242 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 2c5h n VAL 243 N -2.00 0.32 -2.87 1.61 3.14 -1.04 -4.97 118.33 112.52 2c5h n VAL 243 Ca 0.00 -0.11 -0.43 0.00 -2.96 0.00 0.00 64.34 60.84 2c5h n VAL 243 Cb 0.00 -0.95 -0.04 0.00 -1.06 0.00 0.00 33.84 31.79 2c5h n VAL 243 CO 0.00 0.00 0.00 -0.76 -6.46 0.00 0.00 176.83 169.61 2c5h s LEU 244 N -5.61 4.25 0.76 6.55 1.43 -0.87 -4.95 118.68 120.24 2c5h s LEU 244 Ca -0.08 -0.55 -0.11 0.00 -1.03 0.00 0.00 54.13 52.36 2c5h s LEU 244 Cb 0.02 -2.70 0.05 0.00 0.03 0.00 0.00 46.19 43.60 2c5h s LEU 244 CO 0.12 -1.24 1.10 -2.84 0.23 0.00 0.00 176.35 173.72 2c5h s PRO 245 N 3.85 2.37 -0.19 1.29 0.02 -1.26 -1.24 135.00 139.84 2c5h s PRO 245 Ca 0.27 0.57 -0.20 0.00 0.02 0.00 0.00 61.00 61.65 2c5h s PRO 245 Cb -0.14 -1.96 0.05 0.00 0.02 0.00 0.00 34.50 32.48 2c5h s PRO 245 CO 0.16 -1.40 0.56 -0.06 -0.33 0.00 0.00 177.00 175.93 2c5h s PHE 246 N -3.24 -0.60 -0.04 6.54 0.08 0.26 -4.89 117.98 116.09 2c5h s PHE 246 Ca 0.60 1.43 0.04 0.00 0.12 0.00 0.00 56.93 59.13 2c5h s PHE 246 Cb -0.13 0.22 -0.00 0.00 -0.57 0.00 0.00 43.02 42.53 2c5h s PHE 246 CO 0.53 -0.32 -0.18 -1.21 -0.10 0.00 0.00 175.22 173.94 2c5h s GLU 247 N 0.13 1.80 -0.25 0.44 2.02 -1.26 0.14 118.70 121.72 2c5h s GLU 247 Ca -0.01 -0.63 -0.29 0.00 0.02 0.00 0.00 54.97 54.06 2c5h s GLU 247 Cb -0.04 -1.57 0.17 0.00 0.10 0.00 0.00 34.13 32.79 2c5h s GLU 247 CO 0.02 0.26 1.26 0.00 0.02 0.00 0.00 175.26 176.82 2c5h s ALA 248 N -0.01 -2.07 0.61 5.21 0.00 -0.81 -4.91 121.76 119.77 2c5h s ALA 248 Ca -0.03 1.80 -0.18 0.00 0.00 0.00 0.00 51.96 53.55 2c5h s ALA 248 Cb -0.11 -1.31 -0.03 0.00 0.00 0.00 0.00 23.12 21.67 2c5h s ALA 248 CO 0.02 -0.25 1.20 -2.14 0.00 0.00 0.00 175.76 174.59 2c5h s PRO 249 N -0.98 2.88 -0.03 0.00 0.02 -1.26 -0.53 135.00 135.11 2c5h s PRO 249 Ca 0.06 1.79 -0.30 0.00 0.02 0.00 0.00 61.00 62.57 2c5h s PRO 249 Cb -0.01 -1.92 -0.05 0.00 0.02 0.00 0.00 34.50 32.54 2c5h s PRO 249 CO -0.06 -1.27 1.41 -1.17 -0.33 0.00 0.00 177.00 175.59 2c5h s LEU 250 N -4.22 4.30 0.15 -5.54 2.96 0.84 -3.76 118.68 113.42 2c5h s LEU 250 Ca 0.76 2.07 0.02 0.00 -0.22 0.00 0.00 54.13 56.77 2c5h s LEU 250 Cb -0.30 -3.55 -0.04 0.00 0.50 0.00 0.00 46.19 42.79 2c5h s LEU 250 CO 0.35 -0.74 -0.03 0.42 -1.32 0.00 0.00 176.35 175.02 2c5h s THR 251 N 2.70 0.76 0.31 3.68 -4.23 0.05 0.01 115.64 118.91 2c5h s THR 251 Ca 0.64 -1.98 0.03 0.00 -1.18 0.00 0.00 61.69 59.20 2c5h s THR 251 Cb -0.30 -1.96 0.11 0.00 1.34 0.00 0.00 72.50 71.69 2c5h s THR 251 CO 0.25 -0.63 1.79 -0.65 -0.54 0.00 0.00 174.62 174.85 2c5h h PRO 252 N 2.78 0.51 0.00 3.99 0.11 -1.96 -3.35 132.00 134.09 2c5h h PRO 252 Ca -0.36 -0.15 -0.20 0.00 0.11 0.00 0.00 66.00 65.40 2c5h h PRO 252 Cb 1.19 -0.05 -0.05 0.00 0.11 0.00 0.00 31.00 32.20 2c5h h PRO 252 CO 0.63 0.63 -0.10 -2.37 -0.21 0.00 0.00 178.00 176.58 2c5h n THR 253 N -4.20 0.00 -0.05 -1.15 5.66 -1.26 -4.60 114.28 108.69 2c5h n THR 253 Ca 0.01 -1.25 -0.14 0.00 -3.05 0.00 0.00 64.05 59.61 2c5h n THR 253 Cb 0.33 0.77 -0.12 0.00 -1.55 0.00 0.00 70.33 69.75 2c5h n THR 253 CO 0.00 0.00 0.00 -0.26 -3.05 0.00 0.00 175.07 171.76 2c5h h PHE 254 N 1.71 0.07 0.00 1.09 0.04 -1.96 -3.27 116.94 114.61 2c5h h PHE 254 Ca -0.19 -0.04 0.00 0.00 2.80 0.00 0.00 57.97 60.54 2c5h h PHE 254 Cb 0.83 -0.01 0.00 0.00 2.20 0.00 0.00 35.95 38.98 2c5h h PHE 254 CO 0.00 0.91 0.23 0.00 -0.60 0.00 0.00 178.31 178.85 2c5h h ALA 255 N 0.14 1.22 0.00 2.45 0.00 -1.96 0.22 119.26 121.32 2c5h h ALA 255 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2c5h h ALA 255 Cb 0.94 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.73 2c5h h ALA 255 CO 0.02 -0.22 0.00 -0.44 0.00 0.00 0.00 179.25 178.61 2c5h h ASP 256 N 0.00 0.00 1.16 0.00 3.32 -1.99 -1.92 116.42 116.98 2c5h h ASP 256 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2c5h h ASP 256 Cb 0.46 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.01 2c5h h ASP 256 CO 0.00 0.00 0.00 0.00 -1.72 0.00 0.00 179.24 177.52 2c5h h ALA 257 N 2.08 1.00 0.00 3.45 0.00 -0.77 -3.49 119.26 121.54 2c5h h ALA 257 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2c5h h ALA 257 Cb 0.16 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.95 2c5h h ALA 257 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.66 2c5h n GLY 258 N 0.51 1.03 3.75 0.00 0.00 -0.72 -4.75 105.19 105.02 2c5h n GLY 258 Ca 0.03 -0.92 -0.36 0.00 0.00 0.00 0.00 46.02 44.78 2c5h n GLY 258 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2c5h s GLU 259 N 0.00 2.92 0.01 1.61 2.02 -1.26 -4.92 118.70 119.08 2c5h s GLU 259 Ca 0.00 1.80 -0.37 0.00 0.02 0.00 0.00 54.97 56.42 2c5h s GLU 259 Cb 0.00 -1.93 -0.16 0.00 0.10 0.00 0.00 34.13 32.15 2c5h s GLU 259 CO 0.00 -1.24 1.48 -0.89 0.02 0.00 0.00 175.26 174.63 2c5h n ILE 260 N -1.68 0.09 0.00 -1.63 5.41 -1.26 -2.33 119.36 117.96 2c5h n ILE 260 Ca 0.13 -0.02 0.00 0.00 1.00 0.00 0.00 62.75 63.87 2c5h n ILE 260 Cb 0.50 -1.03 0.00 0.00 -0.71 0.00 0.00 39.64 38.39 2c5h n ILE 260 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2c5h n GLY 261 N 3.06 3.03 3.52 7.39 0.00 0.27 -4.98 105.19 117.48 2c5h n GLY 261 Ca 0.20 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.86 2c5h n GLY 261 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2c5h n ASN 262 N 0.00 -0.62 -4.70 1.61 4.13 -0.99 -4.45 115.26 110.25 2c5h n ASN 262 Ca 0.00 0.62 -0.42 0.00 1.68 0.00 0.00 54.58 56.46 2c5h n ASN 262 Cb 0.00 -1.28 -0.03 0.00 -1.54 0.00 0.00 39.78 36.93 2c5h n ASN 262 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 2c5h s ILE 263 N -1.88 4.85 -0.17 2.41 -1.09 -1.26 -0.37 121.20 123.69 2c5h s ILE 263 Ca 0.68 2.04 -0.03 0.00 -2.23 0.00 0.00 60.65 61.11 2c5h s ILE 263 Cb -0.35 -4.31 -0.02 0.00 -1.58 0.00 0.00 42.46 36.20 2c5h s ILE 263 CO 0.55 0.11 -0.05 0.00 -1.23 0.00 0.00 174.94 174.32 2c5h s ALA 264 N 1.32 2.88 -0.21 9.38 0.00 -0.09 -4.69 121.76 130.35 2c5h s ALA 264 Ca 0.50 -0.93 -0.12 0.00 0.00 0.00 0.00 51.96 51.41 2c5h s ALA 264 Cb -0.20 -1.54 -0.05 0.00 0.00 0.00 0.00 23.12 21.33 2c5h s ALA 264 CO 0.25 0.03 0.22 0.42 0.00 0.00 0.00 175.76 176.68 2c5h s ILE 265 N 0.69 5.33 0.38 0.00 1.01 -1.25 -1.86 121.20 125.50 2c5h s ILE 265 Ca -0.03 0.35 -0.07 0.00 0.00 0.00 0.00 60.65 60.90 2c5h s ILE 265 Cb -0.15 -3.56 0.03 0.00 0.01 0.00 0.00 42.46 38.79 2c5h s ILE 265 CO 0.02 0.36 0.63 0.00 0.00 0.00 0.00 174.94 175.95 2c5h n TYR 266 N 4.01 -1.86 -3.92 3.97 0.18 -0.77 -0.77 117.16 117.99 2c5h n TYR 266 Ca -0.13 -2.19 -0.35 0.00 1.88 0.00 0.00 57.90 57.10 2c5h n TYR 266 Cb 0.52 0.72 -0.14 0.00 -0.38 0.00 0.00 39.34 40.06 2c5h n TYR 266 CO 0.00 0.00 0.00 -0.51 -2.08 0.00 0.00 176.86 174.27 2c5h s LEU 267 N 0.00 3.00 1.26 -3.48 1.43 -1.25 -0.45 118.68 119.18 2c5h s LEU 267 Ca 0.24 -0.55 -0.16 0.00 -1.03 0.00 0.00 54.13 52.63 2c5h s LEU 267 Cb -0.03 -1.72 0.32 0.00 0.03 0.00 0.00 46.19 44.80 2c5h s LEU 267 CO 0.17 -0.06 0.99 0.54 0.23 0.00 0.00 176.35 178.23 2c5h s ASN 268 N 1.43 0.21 0.00 2.29 2.20 0.56 -4.81 114.94 116.83 2c5h s ASN 268 Ca 0.04 1.30 0.20 0.00 -0.94 0.00 0.00 52.86 53.46 2c5h s ASN 268 Cb -0.15 -1.98 1.13 0.00 -2.00 0.00 0.00 41.25 38.26 2c5h s ASN 268 CO -0.04 -4.65 1.61 -1.54 -2.94 0.00 0.00 177.10 169.55 2c5h n SER 269 N -5.19 0.00 -0.77 3.54 3.41 -1.26 -1.15 113.62 112.19 2c5h n SER 269 Ca 0.05 -0.38 0.09 0.00 -0.26 0.00 0.00 58.87 58.37 2c5h n SER 269 Cb 0.56 -0.11 0.11 0.00 -0.26 0.00 0.00 64.21 64.51 2c5h n SER 269 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2c5h n ARG 270 N -1.11 1.76 -0.09 4.33 5.12 -1.26 -3.74 116.66 121.66 2c5h n ARG 270 Ca 0.13 -1.74 0.00 0.00 -1.93 0.00 0.00 57.85 54.31 2c5h n ARG 270 Cb 0.10 -1.36 0.00 0.00 -1.16 0.00 0.00 32.46 30.05 2c5h n ARG 270 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2c5h n GLY 271 N 1.01 0.62 3.91 -0.13 0.00 -0.30 -4.36 105.19 105.94 2c5h n GLY 271 Ca 0.12 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.89 2c5h n GLY 271 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2c5h s TYR 272 N -2.15 3.39 0.04 1.61 2.02 -1.26 -0.73 117.35 120.28 2c5h s TYR 272 Ca 0.00 0.06 -0.30 0.00 -0.37 0.00 0.00 57.07 56.45 2c5h s TYR 272 Cb 0.00 -1.61 -0.07 0.00 -0.40 0.00 0.00 41.96 39.89 2c5h s TYR 272 CO 0.00 0.51 1.45 -1.17 -1.57 0.00 0.00 175.55 174.76 2c5h s LEU 273 N -3.34 4.34 0.21 -1.29 2.96 0.27 -0.32 118.68 121.51 2c5h s LEU 273 Ca 0.34 2.23 0.00 0.00 -0.22 0.00 0.00 54.13 56.48 2c5h s LEU 273 Cb -0.10 -3.57 -0.05 0.00 0.50 0.00 0.00 46.19 42.97 2c5h s LEU 273 CO 0.27 -0.74 0.10 -0.44 -1.32 0.00 0.00 176.35 174.22 2c5h s SER 274 N 1.82 0.69 -0.02 3.68 0.01 0.40 -1.18 113.70 119.11 2c5h s SER 274 Ca 0.66 -1.35 -0.06 0.00 1.31 0.00 0.00 55.95 56.51 2c5h s SER 274 Cb -0.34 0.26 0.01 0.00 0.21 0.00 0.00 66.02 66.15 2c5h s SER 274 CO 0.28 -0.76 0.14 -0.51 0.41 0.00 0.00 173.24 172.80 2c5h s ILE 275 N -3.93 0.05 0.31 1.44 2.07 0.20 -1.85 121.20 119.49 2c5h s ILE 275 Ca 0.36 -0.40 -0.15 0.00 -1.41 0.00 0.00 60.65 59.05 2c5h s ILE 275 Cb 0.07 -0.33 0.06 0.00 0.13 0.00 0.00 42.46 42.39 2c5h s ILE 275 CO 0.11 -0.22 0.76 0.00 -1.91 0.00 0.00 174.94 173.68 2c5h n ALA 276 N 2.14 -1.78 -2.56 1.50 0.00 -0.78 0.64 120.51 119.67 2c5h n ALA 276 Ca -0.18 -1.09 -0.33 0.00 0.00 0.00 0.00 53.44 51.84 2c5h n ALA 276 Cb 0.57 0.82 -0.11 0.00 0.00 0.00 0.00 19.45 20.73 2c5h n ALA 276 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2c5h s ARG 277 N -2.07 2.61 -0.14 0.00 0.52 -1.24 -0.91 118.95 117.71 2c5h s ARG 277 Ca 0.16 -0.65 -0.29 0.00 -0.52 0.00 0.00 55.73 54.43 2c5h s ARG 277 Cb -0.04 -2.51 -0.06 0.00 0.52 0.00 0.00 34.95 32.86 2c5h s ARG 277 CO 0.09 0.63 2.05 1.21 0.02 0.00 0.00 175.30 179.31 2c5h s ASN 278 N -1.03 5.90 -1.53 0.23 2.47 0.50 -3.24 114.94 118.24 2c5h s ASN 278 Ca 0.14 2.09 -0.07 0.00 0.42 0.00 0.00 52.86 55.44 2c5h s ASN 278 Cb -0.11 -2.52 0.06 0.00 -1.45 0.00 0.00 41.25 37.23 2c5h s ASN 278 CO 0.03 -1.58 0.54 0.00 -3.72 0.00 0.00 177.10 172.37 2c5h n ALA 279 N 9.93 -1.71 -3.47 1.71 0.00 -1.26 -0.57 120.51 125.14 2c5h n ALA 279 Ca 0.25 -0.17 -0.12 0.00 0.00 0.00 0.00 53.44 53.40 2c5h n ALA 279 Cb 0.44 -2.26 -0.03 0.00 0.00 0.00 0.00 19.45 17.59 2c5h n ALA 279 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2c5h s ALA 280 N -3.72 -1.72 -0.03 0.00 0.00 -1.20 -4.63 121.76 110.45 2c5h s ALA 280 Ca 0.30 0.88 -0.25 0.00 0.00 0.00 0.00 51.96 52.89 2c5h s ALA 280 Cb -0.16 0.46 -0.04 0.00 0.00 0.00 0.00 23.12 23.38 2c5h s ALA 280 CO 0.91 -0.63 0.77 -1.12 0.00 0.00 0.00 175.76 175.69 2c5h s SER 281 N -2.21 7.11 -0.13 0.00 0.01 -1.25 -3.72 113.70 113.50 2c5h s SER 281 Ca -0.01 1.33 -0.18 0.00 1.31 0.00 0.00 55.95 58.40 2c5h s SER 281 Cb -0.01 -2.45 -0.25 0.00 0.21 0.00 0.00 66.02 63.51 2c5h s SER 281 CO -0.06 -0.12 0.51 0.25 0.41 0.00 0.00 173.24 174.23 2c5h h LEU 282 N 6.57 0.26 -0.54 2.44 5.85 -1.73 -3.41 115.31 124.76 2c5h h LEU 282 Ca -0.42 -0.80 -0.14 0.00 0.84 0.00 0.00 57.88 57.36 2c5h h LEU 282 Cb 1.20 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 42.14 2c5h h LEU 282 CO 0.74 1.52 -0.32 0.00 -0.34 0.00 0.00 178.44 180.04 2c5h h ALA 283 N -0.13 0.73 0.08 1.25 0.00 -1.06 -3.33 119.26 116.80 2c5h h ALA 283 Ca -0.28 -0.42 -0.00 0.00 0.00 0.00 0.00 54.91 54.21 2c5h h ALA 283 Cb 1.58 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 19.24 2c5h h ALA 283 CO -0.00 0.66 -0.04 1.88 0.00 0.00 0.00 179.25 181.75 2c5h h TYR 284 N 0.70 -0.09 -0.61 0.00 0.05 -1.80 0.48 116.97 115.69 2c5h h TYR 284 Ca 0.07 -0.00 0.10 0.00 0.05 0.00 0.00 58.73 58.95 2c5h h TYR 284 Cb 0.88 0.03 -0.04 0.00 1.01 0.00 0.00 36.73 38.61 2c5h h TYR 284 CO 0.05 0.45 0.41 -1.35 -1.05 0.00 0.00 178.16 176.67 2c5h h PRO 285 N -0.89 0.40 -0.37 4.88 0.11 -1.79 -2.12 132.00 132.23 2c5h h PRO 285 Ca -0.01 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.08 2c5h h PRO 285 Cb 0.59 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 31.61 2c5h h PRO 285 CO 0.02 0.27 0.00 0.66 -0.21 0.00 0.00 178.00 178.73 2c5h n TYR 286 N -4.47 0.48 -3.69 0.65 4.01 -1.20 -4.96 117.16 107.98 2c5h n TYR 286 Ca 0.10 -0.24 -0.28 0.00 -0.16 0.00 0.00 57.90 57.32 2c5h n TYR 286 Cb 0.38 0.00 0.03 0.00 -0.31 0.00 0.00 39.34 39.43 2c5h n TYR 286 CO 0.00 0.00 0.00 0.72 -0.46 0.00 0.00 176.86 177.12 2c5h n HIS 287 N 1.14 -2.21 -2.58 -0.72 8.25 -0.01 -4.92 115.22 114.17 2c5h n HIS 287 Ca 0.19 0.79 -0.41 0.00 -0.26 0.00 0.00 57.72 58.03 2c5h n HIS 287 Cb 0.51 -3.92 -0.04 0.00 1.12 0.00 0.00 29.99 27.66 2c5h n HIS 287 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2c5h s LEU 288 N -7.07 4.52 0.17 2.41 1.43 -0.22 -5.04 118.68 114.88 2c5h s LEU 288 Ca 0.57 2.04 0.09 0.00 -1.03 0.00 0.00 54.13 55.81 2c5h s LEU 288 Cb -0.28 -3.61 -0.04 0.00 0.03 0.00 0.00 46.19 42.29 2c5h s LEU 288 CO 0.71 -0.12 -0.20 -0.54 0.23 0.00 0.00 176.35 176.42 2c5h s LYS 289 N -0.58 1.35 -0.23 1.70 1.02 -1.26 -4.82 119.74 116.92 2c5h s LYS 289 Ca 0.47 -1.45 -0.30 0.00 0.02 0.00 0.00 55.97 54.71 2c5h s LYS 289 Cb -0.28 -1.50 -0.07 0.00 -0.52 0.00 0.00 37.83 35.46 2c5h s LYS 289 CO 0.34 0.31 2.19 -1.91 -0.92 0.00 0.00 175.35 175.37 2c5h n GLU 290 N 0.28 1.80 0.00 1.68 2.13 -1.26 -2.78 120.64 122.49 2c5h n GLU 290 Ca -0.13 0.51 0.00 0.00 0.66 0.00 0.00 57.16 58.20 2c5h n GLU 290 Cb 0.57 -3.02 0.00 0.00 0.27 0.00 0.00 31.44 29.26 2c5h n GLU 290 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2c5h n GLY 291 N 5.84 1.33 3.52 8.31 0.00 -0.79 -4.99 105.19 118.41 2c5h n GLY 291 Ca 0.32 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 46.05 2c5h n GLY 291 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2c5h s MET 292 N 0.00 -0.98 0.20 1.61 -1.94 -1.12 -4.79 119.30 112.28 2c5h s MET 292 Ca 0.00 0.51 -0.20 0.00 -1.71 0.00 0.00 55.69 54.29 2c5h s MET 292 Cb 0.00 -1.57 -0.08 0.00 2.01 0.00 0.00 34.83 35.19 2c5h s MET 292 CO 0.00 -3.68 0.71 -1.54 -0.01 0.00 0.00 175.02 170.50 2c5h s SER 293 N -3.03 7.08 -0.04 3.03 1.04 -1.26 -2.30 113.70 118.21 2c5h s SER 293 Ca 0.68 1.41 0.06 0.00 0.48 0.00 0.00 55.95 58.59 2c5h s SER 293 Cb -0.20 -2.42 -0.01 0.00 0.10 0.00 0.00 66.02 63.49 2c5h s SER 293 CO 0.61 0.07 -0.24 0.00 0.98 0.00 0.00 173.24 174.66 2c5h s ALA 294 N -1.46 2.01 -0.05 5.32 0.00 -0.74 0.11 121.76 126.95 2c5h s ALA 294 Ca 0.41 -0.99 -0.03 0.00 0.00 0.00 0.00 51.96 51.35 2c5h s ALA 294 Cb -0.17 -0.59 0.03 0.00 0.00 0.00 0.00 23.12 22.38 2c5h s ALA 294 CO 0.21 0.42 0.12 0.50 0.00 0.00 0.00 175.76 177.01 2c5h s ARG 295 N -0.27 0.09 0.03 0.00 3.52 -0.15 -1.17 118.95 121.01 2c5h s ARG 295 Ca 0.01 0.26 0.05 0.00 -0.13 0.00 0.00 55.73 55.92 2c5h s ARG 295 Cb -0.12 -0.08 -0.02 0.00 -1.56 0.00 0.00 34.95 33.17 2c5h s ARG 295 CO 0.02 -0.10 -0.16 0.54 -0.81 0.00 0.00 175.30 174.79 2c5h s VAL 296 N 0.68 1.26 0.27 7.11 0.11 -0.97 0.34 120.40 129.19 2c5h s VAL 296 Ca -0.05 -0.96 -0.05 0.00 -2.93 0.00 0.00 61.98 57.98 2c5h s VAL 296 Cb -0.07 -1.11 -0.01 0.00 -1.53 0.00 0.00 36.38 33.66 2c5h s VAL 296 CO -0.03 0.13 0.37 -1.83 -3.33 0.00 0.00 175.10 170.40 2c5h s GLU 297 N -0.97 1.57 0.00 1.54 -1.05 0.40 -1.70 118.70 118.48 2c5h s GLU 297 Ca 0.04 -1.55 0.25 0.00 -0.15 0.00 0.00 54.97 53.55 2c5h s GLU 297 Cb -0.08 0.40 0.31 0.00 -0.44 0.00 0.00 34.13 34.32 2c5h s GLU 297 CO 0.01 -0.62 1.33 0.00 0.95 0.00 0.00 175.26 176.93