#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 1.31 -0.04 2.89 0.04 -1.25 -4.78 135.00 133.16 2c5h s PRO 9 Ca 0.00 -0.43 -0.00 0.00 0.04 0.00 0.00 61.00 60.61 2c5h s PRO 9 Cb 0.00 -2.01 0.03 0.00 0.04 0.00 0.00 34.50 32.56 2c5h s PRO 9 CO 0.00 -1.91 0.01 0.42 0.04 0.00 0.00 177.00 175.56 2c5h s ILE 10 N -3.59 0.20 -0.27 0.56 1.01 -1.26 -0.65 121.20 117.19 2c5h s ILE 10 Ca 0.68 0.12 -0.08 0.00 0.00 0.00 0.00 60.65 61.38 2c5h s ILE 10 Cb -0.06 -0.32 -0.01 0.00 0.01 0.00 0.00 42.46 42.07 2c5h s ILE 10 CO 0.49 0.17 0.09 -0.63 0.00 0.00 0.00 174.94 175.07 2c5h s ILE 11 N 1.33 4.31 -0.26 2.92 1.01 -0.59 -0.85 121.20 129.07 2c5h s ILE 11 Ca -0.05 -0.35 -0.13 0.00 0.00 0.00 0.00 60.65 60.12 2c5h s ILE 11 Cb -0.13 -3.11 -0.04 0.00 0.01 0.00 0.00 42.46 39.19 2c5h s ILE 11 CO -0.02 0.21 0.27 0.00 0.00 0.00 0.00 174.94 175.40 2c5h s ALA 12 N 1.59 3.56 -0.14 9.38 0.00 0.73 -0.45 121.76 136.42 2c5h s ALA 12 Ca 0.05 -0.89 -0.01 0.00 0.00 0.00 0.00 51.96 51.12 2c5h s ALA 12 Cb -0.16 -2.55 -0.01 0.00 0.00 0.00 0.00 23.12 20.40 2c5h s ALA 12 CO 0.04 -0.49 -0.11 0.12 0.00 0.00 0.00 175.76 175.32 2c5h s PHE 13 N 1.67 2.85 -0.03 0.00 5.36 0.15 -0.24 117.98 127.73 2c5h s PHE 13 Ca 0.11 -0.69 0.01 0.00 -0.96 0.00 0.00 56.93 55.40 2c5h s PHE 13 Cb -0.15 -1.89 0.02 0.00 -0.34 0.00 0.00 43.02 40.66 2c5h s PHE 13 CO 0.09 -0.26 -0.02 1.41 -1.46 0.00 0.00 175.22 174.98 2c5h s MET 14 N 0.53 0.49 0.33 10.12 -2.45 0.96 0.53 119.30 129.80 2c5h s MET 14 Ca -0.08 0.01 -0.10 0.00 -1.25 0.00 0.00 55.69 54.27 2c5h s MET 14 Cb -0.15 -0.60 0.04 0.00 1.25 0.00 0.00 34.83 35.37 2c5h s MET 14 CO 0.04 -0.11 0.62 -1.13 1.05 0.00 0.00 175.02 175.48 2c5h n SER 15 N 4.08 -1.79 -0.70 1.11 3.41 -0.99 0.60 113.62 119.34 2c5h n SER 15 Ca -0.26 -2.41 0.08 0.00 -0.26 0.00 0.00 58.87 56.02 2c5h n SER 15 Cb 0.51 3.02 0.22 0.00 -0.26 0.00 0.00 64.21 67.70 2c5h n SER 15 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 2c5h n ASP 16 N -1.50 3.49 0.00 4.04 5.68 -1.13 -3.55 116.55 123.58 2c5h n ASP 16 Ca -0.06 -2.94 0.09 0.00 -0.50 0.00 0.00 54.79 51.38 2c5h n ASP 16 Cb 0.50 -0.49 0.40 0.00 -1.14 0.00 0.00 41.12 40.39 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 -0.61 0.00 0.00 -2.12 4.77 -1.21 -4.82 117.00 113.01 2c5h n LEU 17 Ca 0.19 0.44 0.01 0.00 -0.03 0.00 0.00 56.01 56.61 2c5h n LEU 17 Cb 0.80 -0.44 -0.00 0.00 -2.33 0.00 0.00 43.42 41.45 2c5h n LEU 17 CO 0.12 -0.17 -0.01 0.61 -1.33 0.00 0.00 177.39 176.60 2c5h n GLY 18 N 0.28 -2.24 0.52 -0.72 0.00 0.15 -4.64 105.19 98.55 2c5h n GLY 18 Ca 0.06 -1.51 0.06 0.00 0.00 0.00 0.00 46.02 44.62 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 -1.04 1.46 -0.05 2.61 -2.24 -1.26 -4.72 114.28 109.03 2c5h n THR 19 Ca 0.00 -2.10 -0.05 0.00 -2.27 0.00 0.00 64.05 59.63 2c5h n THR 19 Cb 0.02 0.04 -0.09 0.00 -2.10 0.00 0.00 70.33 68.21 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 0.76 -3.83 4.28 -2.24 -1.26 -5.04 114.28 106.10 2c5h n THR 20 Ca 0.13 -0.48 0.00 0.00 -2.27 0.00 0.00 64.05 61.43 2c5h n THR 20 Cb 0.74 -0.67 0.00 0.00 -2.10 0.00 0.00 70.33 68.30 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 -2.41 1.88 -0.46 3.42 5.68 -1.26 -5.03 116.55 118.36 2c5h n ASP 21 Ca -0.18 -0.83 0.07 0.00 -0.50 0.00 0.00 54.79 53.34 2c5h n ASP 21 Cb 0.86 0.00 0.24 0.00 -1.14 0.00 0.00 41.12 41.08 2c5h n ASP 21 CO 0.00 0.00 0.00 -0.90 -1.33 0.00 0.00 177.20 174.97 2c5h n ASP 22 N -0.93 1.36 -0.06 -1.12 5.75 -1.26 -4.40 116.55 115.88 2c5h n ASP 22 Ca 0.00 -1.85 -0.10 0.00 -0.01 0.00 0.00 54.79 52.83 2c5h n ASP 22 Cb 0.00 -0.14 -0.04 0.00 -1.03 0.00 0.00 41.12 39.92 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 1.60 -1.15 -0.13 -1.12 0.02 -1.93 0.10 113.55 110.94 2c5h h SER 23 Ca 0.00 0.18 0.01 0.00 -0.84 0.00 0.00 61.79 61.14 2c5h h SER 23 Cb 0.36 0.50 -0.01 0.00 0.14 0.00 0.00 62.40 63.39 2c5h h SER 23 CO 0.00 -0.36 0.04 0.58 -1.14 0.00 0.00 176.83 175.95 2c5h h VAL 24 N -0.36 0.96 -0.46 2.27 2.07 -1.85 -2.56 116.25 116.33 2c5h h VAL 24 Ca 0.12 -0.03 -0.03 0.00 0.82 0.00 0.00 66.70 67.58 2c5h h VAL 24 Cb 0.57 0.85 -0.02 0.00 -1.52 0.00 0.00 31.29 31.17 2c5h h VAL 24 CO -0.46 0.02 0.17 0.00 0.02 0.00 0.00 177.57 177.32 2c5h h ALA 25 N 1.08 1.44 -0.17 1.67 0.00 -1.73 0.13 119.26 121.68 2c5h h ALA 25 Ca 0.06 -0.14 0.04 0.00 0.00 0.00 0.00 54.91 54.87 2c5h h ALA 25 Cb 0.04 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.59 2c5h h ALA 25 CO -0.06 0.43 -0.10 1.96 0.00 0.00 0.00 179.25 181.47 2c5h h GLN 26 N 0.66 -0.09 -0.22 0.00 4.20 -0.41 0.87 115.11 120.12 2c5h h GLN 26 Ca 0.16 0.01 0.03 0.00 0.06 0.00 0.00 58.65 58.90 2c5h h GLN 26 Cb 0.16 0.02 -0.03 0.00 0.30 0.00 0.00 27.48 27.93 2c5h h GLN 26 CO -0.01 -0.06 0.06 0.00 -0.67 0.00 0.00 178.83 178.15 2c5h h LYS 28 N 0.16 0.24 -0.38 0.00 1.57 -0.20 0.17 116.57 118.13 2c5h h LYS 28 Ca 0.10 -0.01 0.08 0.00 -1.87 0.00 0.00 60.65 58.94 2c5h h LYS 28 Cb 0.08 -0.06 -0.07 0.00 0.08 0.00 0.00 32.23 32.26 2c5h h LYS 28 CO -0.11 0.16 -0.10 0.78 -0.57 0.00 0.00 179.45 179.61 2c5h h GLY 29 N 0.25 0.27 1.06 3.86 0.00 0.13 -0.89 103.07 107.74 2c5h h GLY 29 Ca 0.23 0.13 -0.01 0.00 0.00 0.00 0.00 47.33 47.68 2c5h h GLY 29 CO -0.29 -0.15 0.54 1.41 0.00 0.00 0.00 176.54 178.06 2c5h h LEU 30 N -0.00 1.10 -0.27 3.11 3.38 -0.46 -0.99 115.31 121.17 2c5h h LEU 30 Ca 0.18 -0.07 0.02 0.00 0.09 0.00 0.00 57.88 58.10 2c5h h LEU 30 Cb 0.28 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.72 2c5h h LEU 30 CO -0.39 0.85 0.11 0.24 0.09 0.00 0.00 178.44 179.34 2c5h h MET 31 N 1.26 0.24 -0.29 1.13 2.86 0.33 0.15 114.93 120.61 2c5h h MET 31 Ca 0.33 -0.01 -0.12 0.00 -2.06 0.00 0.00 59.70 57.83 2c5h h MET 31 Cb -0.04 -0.05 -0.01 0.00 0.06 0.00 0.00 31.60 31.56 2c5h h MET 31 CO -0.06 0.16 -0.31 1.88 1.06 0.00 0.00 176.91 179.64 2c5h h TYR 32 N 0.25 0.71 -0.52 -0.22 0.05 -1.01 0.26 116.97 116.48 2c5h h TYR 32 Ca 0.12 -0.18 -0.03 0.00 0.05 0.00 0.00 58.73 58.69 2c5h h TYR 32 Cb 0.07 -0.16 -0.03 0.00 1.01 0.00 0.00 36.73 37.62 2c5h h TYR 32 CO -0.12 0.85 0.22 0.77 -1.05 0.00 0.00 178.16 178.83 2c5h h SER 33 N 0.53 0.68 0.15 3.88 0.02 -0.53 -2.34 113.55 115.93 2c5h h SER 33 Ca 0.06 -0.08 -0.35 0.00 -0.84 0.00 0.00 61.79 60.59 2c5h h SER 33 Cb 0.79 -0.17 -0.00 0.00 0.14 0.00 0.00 62.40 63.15 2c5h h SER 33 CO 0.06 0.61 -1.82 0.40 -1.14 0.00 0.00 176.83 174.94 2c5h h ILE 34 N 0.74 0.80 -2.64 3.27 2.04 -0.30 -3.41 117.51 118.00 2c5h h ILE 34 Ca 0.18 -2.41 -0.60 0.00 1.00 0.00 0.00 64.86 63.02 2c5h h ILE 34 Cb 0.13 2.63 -0.41 0.00 -0.74 0.00 0.00 36.82 38.43 2c5h h ILE 34 CO -0.02 0.85 -0.69 0.00 0.00 0.00 0.00 178.15 178.29 2c5h n PRO 36 N 1.78 -0.07 -0.10 0.00 -0.02 -0.89 -0.32 135.00 135.38 2c5h n PRO 36 Ca 0.24 1.42 0.03 0.00 -2.02 0.00 0.00 63.50 63.17 2c5h n PRO 36 Cb 0.40 -2.38 0.08 0.00 -0.02 0.00 0.00 33.50 31.58 2c5h n PRO 36 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 2c5h n ASP 37 N -5.35 1.01 -4.77 2.55 8.00 -1.26 -4.90 116.55 111.82 2c5h n ASP 37 Ca 0.30 -2.00 -0.39 0.00 0.71 0.00 0.00 54.79 53.41 2c5h n ASP 37 Cb 0.99 -0.13 -0.01 0.00 -0.02 0.00 0.00 41.12 41.95 2c5h n ASP 37 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2c5h s VAL 38 N -1.75 2.92 -0.21 2.53 0.11 0.56 -3.93 120.40 120.64 2c5h s VAL 38 Ca 0.12 0.79 -0.05 0.00 -2.93 0.00 0.00 61.98 59.91 2c5h s VAL 38 Cb 0.06 -3.45 -0.02 0.00 -1.53 0.00 0.00 36.38 31.44 2c5h s VAL 38 CO 0.08 0.08 0.00 -0.89 -3.33 0.00 0.00 175.10 171.05 2c5h s THR 39 N -1.36 3.94 -0.23 5.04 2.01 0.17 -4.95 115.64 120.27 2c5h s THR 39 Ca 0.58 -0.31 -0.17 0.00 0.31 0.00 0.00 61.69 62.10 2c5h s THR 39 Cb -0.34 -2.79 -0.03 0.00 0.01 0.00 0.00 72.50 69.35 2c5h s THR 39 CO 0.42 0.42 0.45 -0.69 -0.69 0.00 0.00 174.62 174.53 2c5h s VAL 40 N 1.10 5.14 -0.26 3.82 1.01 -1.26 -1.54 120.40 128.41 2c5h s VAL 40 Ca 0.02 0.78 -0.08 0.00 0.00 0.00 0.00 61.98 62.71 2c5h s VAL 40 Cb -0.14 -3.77 -0.02 0.00 0.00 0.00 0.00 36.38 32.44 2c5h s VAL 40 CO 0.01 0.17 0.09 -0.69 0.00 0.00 0.00 175.10 174.68 2c5h s VAL 41 N 1.80 4.35 0.02 2.92 1.01 0.40 -4.97 120.40 125.93 2c5h s VAL 41 Ca 0.20 -0.23 -0.30 0.00 0.00 0.00 0.00 61.98 61.64 2c5h s VAL 41 Cb -0.15 -3.08 -0.06 0.00 0.00 0.00 0.00 36.38 33.08 2c5h s VAL 41 CO 0.09 0.28 1.50 -1.81 0.00 0.00 0.00 175.10 175.16 2c5h s ASP 42 N 1.61 6.76 -0.02 3.32 1.01 -1.26 0.32 116.67 128.41 2c5h s ASP 42 Ca 0.06 2.25 -0.01 0.00 0.71 0.00 0.00 52.55 55.56 2c5h s ASP 42 Cb -0.16 -2.56 -0.00 0.00 1.01 0.00 0.00 42.92 41.21 2c5h s ASP 42 CO 0.04 -0.78 -0.01 0.58 0.21 0.00 0.00 175.17 175.21 2c5h h VAL 43 N 4.89 0.00 -1.59 -1.27 2.07 -0.26 -3.45 116.25 116.64 2c5h h VAL 43 Ca -0.39 -0.16 0.22 0.00 0.82 0.00 0.00 66.70 67.19 2c5h h VAL 43 Cb 1.19 0.00 -0.19 0.00 -1.52 0.00 0.00 31.29 30.77 2c5h h VAL 43 CO 0.91 0.00 0.76 0.00 0.02 0.00 0.00 177.57 179.26 2c5h n HIS 45 N -0.04 0.00 -2.43 0.00 8.25 -1.25 -2.34 115.22 117.40 2c5h n HIS 45 Ca -0.02 -0.76 -0.11 0.00 -0.26 0.00 0.00 57.72 56.57 2c5h n HIS 45 Cb 0.59 -0.15 0.04 0.00 1.12 0.00 0.00 29.99 31.58 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 -0.57 3.16 -4.74 0.41 3.41 -1.23 0.30 113.62 114.36 2c5h n SER 46 Ca 0.11 -2.87 -0.32 0.00 -0.26 0.00 0.00 58.87 55.53 2c5h n SER 46 Cb 0.78 -0.41 0.10 0.00 -0.26 0.00 0.00 64.21 64.42 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 -3.66 2.11 0.03 4.33 0.23 -1.25 -4.94 119.30 116.15 2c5h s MET 47 Ca 0.39 1.43 -0.30 0.00 -1.03 0.00 0.00 55.69 56.18 2c5h s MET 47 Cb 0.36 -1.86 -0.08 0.00 -1.53 0.00 0.00 34.83 31.72 2c5h s MET 47 CO -0.00 -1.79 1.77 0.99 -2.03 0.00 0.00 175.02 173.95 2c5h s THR 48 N -2.51 3.12 0.17 3.16 2.01 -1.26 -4.82 115.64 115.51 2c5h s THR 48 Ca 0.67 0.36 -0.30 0.00 0.31 0.00 0.00 61.69 62.72 2c5h s THR 48 Cb -0.22 -3.23 -0.17 0.00 0.01 0.00 0.00 72.50 68.89 2c5h s THR 48 CO 0.50 -0.02 0.66 -2.65 -0.69 0.00 0.00 174.62 172.42 2c5h n PRO 49 N 6.59 0.08 -0.74 4.92 -0.02 -1.26 -2.14 135.00 142.42 2c5h n PRO 49 Ca 0.18 0.03 0.00 0.00 -2.02 0.00 0.00 63.50 61.68 2c5h n PRO 49 Cb 0.41 -1.15 0.00 0.00 -0.02 0.00 0.00 33.50 32.74 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 0.32 0.00 -2.89 6.00 8.01 -1.26 -4.89 117.44 122.73 2c5h n TRP 50 Ca 0.18 0.00 -0.44 0.00 -1.31 0.00 0.00 57.50 55.93 2c5h n TRP 50 Cb 0.22 -1.65 -0.01 0.00 -2.01 0.00 0.00 31.31 27.86 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 -2.02 6.86 0.37 -0.99 -1.08 -0.91 -4.85 116.67 114.04 2c5h s ASP 51 Ca 0.00 -2.51 0.06 0.00 -0.52 0.00 0.00 52.55 49.58 2c5h s ASP 51 Cb 0.00 -2.42 0.76 0.00 -1.46 0.00 0.00 42.92 39.80 2c5h s ASP 51 CO 0.00 -0.94 1.99 -0.37 0.52 0.00 0.00 175.17 176.37 2c5h h VAL 52 N 5.29 1.05 -0.64 1.11 -1.51 -1.90 -1.59 116.25 118.06 2c5h h VAL 52 Ca 0.26 -0.25 -0.08 0.00 -1.23 0.00 0.00 66.70 65.40 2c5h h VAL 52 Cb 0.94 0.27 -0.02 0.00 -2.13 0.00 0.00 31.29 30.35 2c5h h VAL 52 CO 1.21 0.13 0.07 -0.33 -1.23 0.00 0.00 177.57 177.43 2c5h h GLU 53 N 0.72 1.08 0.44 5.19 3.07 -1.91 -0.16 114.58 123.01 2c5h h GLU 53 Ca 0.27 -0.31 -0.02 0.00 -0.50 0.00 0.00 59.36 58.80 2c5h h GLU 53 Cb 0.16 -0.12 0.00 0.00 -0.84 0.00 0.00 28.75 27.96 2c5h h GLU 53 CO -0.08 1.01 -0.21 1.49 -1.40 0.00 0.00 179.01 179.82 2c5h h GLU 54 N 0.99 -0.57 -0.89 2.33 4.81 -1.74 -2.94 114.58 116.57 2c5h h GLU 54 Ca 0.19 0.04 0.23 0.00 -0.13 0.00 0.00 59.36 59.69 2c5h h GLU 54 Cb 0.48 0.13 -0.16 0.00 0.63 0.00 0.00 28.75 29.83 2c5h h GLU 54 CO 0.02 -0.26 0.06 0.78 -0.73 0.00 0.00 179.01 178.88 2c5h h GLY 55 N -0.93 1.13 0.40 1.92 0.00 -1.22 0.51 103.07 104.87 2c5h h GLY 55 Ca -0.06 0.10 0.11 0.00 0.00 0.00 0.00 47.33 47.48 2c5h h GLY 55 CO 0.10 -0.41 0.42 0.00 0.00 0.00 0.00 176.54 176.65 2c5h h ALA 56 N 1.85 1.15 -0.87 3.60 0.00 -0.89 0.18 119.26 124.28 2c5h h ALA 56 Ca 0.53 0.06 0.12 0.00 0.00 0.00 0.00 54.91 55.62 2c5h h ALA 56 Cb 1.03 -0.06 -0.07 0.00 0.00 0.00 0.00 17.79 18.70 2c5h h ALA 56 CO -0.78 -0.02 0.56 0.00 0.00 0.00 0.00 179.25 179.02 2c5h h ARG 57 N 0.67 0.73 0.00 0.00 3.08 -0.73 -1.73 114.38 116.40 2c5h h ARG 57 Ca 0.41 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.41 2c5h h ARG 57 Cb 0.47 -0.16 0.00 0.00 0.08 0.00 0.00 29.97 30.35 2c5h h ARG 57 CO -0.30 0.48 -0.13 0.66 -1.07 0.00 0.00 179.97 179.61 2c5h n TYR 58 N -4.54 0.36 0.04 3.04 4.01 0.59 -4.09 117.16 116.57 2c5h n TYR 58 Ca 0.16 0.11 0.04 0.00 -0.16 0.00 0.00 57.90 58.04 2c5h n TYR 58 Cb 0.40 -0.63 -0.06 0.00 -0.31 0.00 0.00 39.34 38.74 2c5h n TYR 58 CO 0.00 0.00 0.00 0.44 -0.46 0.00 0.00 176.86 176.84 2c5h n ILE 59 N -1.81 0.00 0.17 -0.72 -5.35 -0.72 -4.73 119.36 106.20 2c5h n ILE 59 Ca 0.06 -0.19 0.03 0.00 -0.27 0.00 0.00 62.75 62.38 2c5h n ILE 59 Cb 0.38 0.41 0.27 0.00 -1.74 0.00 0.00 39.64 38.96 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 1.09 -0.30 7.28 3.04 -1.53 -3.17 116.25 122.66 2c5h h VAL 60 Ca 0.00 -1.76 0.00 0.00 -1.01 0.00 0.00 66.70 63.93 2c5h h VAL 60 Cb 0.32 2.02 0.00 0.00 -2.01 0.00 0.00 31.29 31.62 2c5h h VAL 60 CO 0.00 0.46 0.00 0.47 -1.01 0.00 0.00 177.57 177.49 2c5h n ASP 61 N -3.63 3.20 0.04 3.17 8.00 -1.26 -4.54 116.55 121.53 2c5h n ASP 61 Ca -0.01 -1.96 -0.13 0.00 0.71 0.00 0.00 54.79 53.40 2c5h n ASP 61 Cb 0.55 -0.19 -0.02 0.00 -0.02 0.00 0.00 41.12 41.45 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 4.30 0.61 -0.95 0.64 3.38 -1.86 -3.37 115.31 118.07 2c5h h LEU 62 Ca 0.00 -0.42 0.23 0.00 0.09 0.00 0.00 57.88 57.78 2c5h h LEU 62 Cb 0.94 -0.18 -0.13 0.00 0.09 0.00 0.00 40.66 41.38 2c5h h LEU 62 CO 0.00 1.19 0.49 -0.65 0.09 0.00 0.00 178.44 179.56 2c5h h PRO 63 N 0.33 0.47 0.00 1.13 0.11 -1.81 0.14 132.00 132.36 2c5h h PRO 63 Ca -0.05 -0.03 -0.04 0.00 0.11 0.00 0.00 66.00 65.99 2c5h h PRO 63 Cb 1.41 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 32.41 2c5h h PRO 63 CO 0.15 0.31 -0.20 0.07 -0.21 0.00 0.00 178.00 178.11 2c5h h ARG 64 N 0.48 0.00 0.00 1.05 0.11 -1.74 -2.73 114.38 111.56 2c5h h ARG 64 Ca 0.60 0.00 -0.20 0.00 0.10 0.00 0.00 59.98 60.48 2c5h h ARG 64 Cb 1.16 0.00 -0.03 0.00 1.11 0.00 0.00 29.97 32.21 2c5h h ARG 64 CO -0.51 0.20 -0.95 0.74 0.10 0.00 0.00 179.97 179.56 2c5h h PHE 65 N 0.00 0.00 -2.83 4.08 0.04 -0.95 -3.42 116.94 113.87 2c5h h PHE 65 Ca -0.00 0.00 -0.53 0.00 2.80 0.00 0.00 57.97 60.24 2c5h h PHE 65 Cb 0.49 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.62 2c5h h PHE 65 CO 0.00 0.95 -0.33 -0.06 -0.60 0.00 0.00 178.31 178.26 2c5h s PHE 66 N -2.78 3.48 0.43 -0.55 0.08 -1.03 -5.06 117.98 112.56 2c5h s PHE 66 Ca 0.01 0.33 -0.24 0.00 0.12 0.00 0.00 56.93 57.15 2c5h s PHE 66 Cb 0.10 -1.85 -0.08 0.00 -0.57 0.00 0.00 43.02 40.63 2c5h s PHE 66 CO 0.81 0.38 1.18 -1.25 -0.10 0.00 0.00 175.22 176.23 2c5h s PRO 67 N -3.36 3.89 0.48 0.24 0.05 -1.26 -4.93 135.00 130.11 2c5h s PRO 67 Ca 0.38 1.82 -0.22 0.00 0.05 0.00 0.00 61.00 63.03 2c5h s PRO 67 Cb -0.11 -2.53 -0.09 0.00 0.05 0.00 0.00 34.50 31.82 2c5h s PRO 67 CO 0.29 -0.46 0.96 0.39 0.05 0.00 0.00 177.00 178.24 2c5h n GLU 68 N -0.23 1.18 -0.18 4.56 1.02 -1.26 -2.30 120.64 123.43 2c5h n GLU 68 Ca 0.06 0.43 0.00 0.00 -0.02 0.00 0.00 57.16 57.63 2c5h n GLU 68 Cb 0.47 -2.06 0.00 0.00 -0.02 0.00 0.00 31.44 29.84 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 1.25 0.86 3.77 0.62 0.00 0.25 -5.03 105.19 106.91 2c5h n GLY 69 Ca 0.11 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.73 2c5h n GLY 69 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2c5h s THR 70 N -2.53 2.26 -0.15 2.61 2.01 -0.97 -4.64 115.64 114.23 2c5h s THR 70 Ca 0.00 0.23 0.00 0.00 0.31 0.00 0.00 61.69 62.23 2c5h s THR 70 Cb 0.00 -3.14 -0.01 0.00 0.01 0.00 0.00 72.50 69.37 2c5h s THR 70 CO 0.00 0.03 -0.14 -0.69 -0.69 0.00 0.00 174.62 173.13 2c5h s VAL 71 N -1.23 2.78 -0.38 3.82 1.01 -0.03 -3.04 120.40 123.32 2c5h s VAL 71 Ca 0.60 -0.74 -0.11 0.00 0.00 0.00 0.00 61.98 61.73 2c5h s VAL 71 Cb -0.42 -2.17 0.03 0.00 0.00 0.00 0.00 36.38 33.82 2c5h s VAL 71 CO 0.53 0.51 0.21 -0.36 0.00 0.00 0.00 175.10 176.00 2c5h s PHE 72 N 0.70 3.24 -0.57 5.22 0.08 0.71 -0.19 117.98 127.17 2c5h s PHE 72 Ca -0.07 -0.94 -0.21 0.00 0.12 0.00 0.00 56.93 55.83 2c5h s PHE 72 Cb -0.16 -2.45 0.07 0.00 -0.57 0.00 0.00 43.02 39.91 2c5h s PHE 72 CO 0.02 -0.65 0.79 0.00 -0.10 0.00 0.00 175.22 175.28 2c5h s ALA 73 N 1.56 3.28 -0.18 5.36 0.00 0.66 -1.02 121.76 131.42 2c5h s ALA 73 Ca 0.02 -1.74 0.01 0.00 0.00 0.00 0.00 51.96 50.25 2c5h s ALA 73 Cb -0.19 -3.59 0.03 0.00 0.00 0.00 0.00 23.12 19.37 2c5h s ALA 73 CO 0.07 -2.33 -0.16 0.95 0.00 0.00 0.00 175.76 174.29 2c5h s THR 74 N 3.27 1.87 -0.16 0.00 -4.23 -0.73 -0.03 115.64 115.63 2c5h s THR 74 Ca 0.19 -0.93 -0.08 0.00 -1.18 0.00 0.00 61.69 59.69 2c5h s THR 74 Cb -0.18 -1.77 0.06 0.00 1.34 0.00 0.00 72.50 71.95 2c5h s THR 74 CO 0.12 0.41 0.37 0.28 -0.54 0.00 0.00 174.62 175.26 2c5h s THR 75 N 1.34 -0.08 -0.06 3.99 -1.32 0.20 -4.17 115.64 115.54 2c5h s THR 75 Ca 0.03 0.12 -0.00 0.00 -1.21 0.00 0.00 61.69 60.62 2c5h s THR 75 Cb -0.14 -0.56 0.02 0.00 -1.51 0.00 0.00 72.50 70.31 2c5h s THR 75 CO -0.11 0.05 -0.03 0.28 -2.21 0.00 0.00 174.62 172.60 2c5h s THR 76 N 1.49 0.54 -0.53 5.08 -1.32 -1.26 -2.82 115.64 116.81 2c5h s THR 76 Ca -0.09 -0.05 0.07 0.00 -1.21 0.00 0.00 61.69 60.41 2c5h s THR 76 Cb -0.09 -0.61 0.32 0.00 -1.51 0.00 0.00 72.50 70.61 2c5h s THR 76 CO -0.12 0.26 0.84 0.00 -2.21 0.00 0.00 174.62 173.39 2c5h n TYR 77 N 4.58 2.79 -0.09 9.09 -0.00 -1.26 -4.82 117.16 127.45 2c5h n TYR 77 Ca -0.16 -3.95 0.20 0.00 -0.00 0.00 0.00 57.90 53.99 2c5h n TYR 77 Cb 0.50 -0.48 0.64 0.00 -0.00 0.00 0.00 39.34 40.01 2c5h n TYR 77 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.86 175.86 2c5h h PRO 78 N 3.25 0.12 -0.75 2.98 0.13 -1.99 0.11 132.00 135.84 2c5h h PRO 78 Ca 0.13 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 2c5h h PRO 78 Cb 0.66 -0.03 0.00 0.00 0.13 0.00 0.00 31.00 31.76 2c5h h PRO 78 CO 0.72 0.08 0.00 0.00 -0.23 0.00 0.00 178.00 178.58 2c5h n ALA 79 N -2.62 2.39 -1.67 -0.56 0.00 -1.26 -4.90 120.51 111.89 2c5h n ALA 79 Ca 0.13 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 53.15 2c5h n ALA 79 Cb 0.65 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 19.11 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 -0.06 2.35 -0.38 0.00 5.66 0.02 -2.19 114.28 119.69 2c5h n THR 80 Ca 0.00 -0.50 0.00 0.00 -3.05 0.00 0.00 64.05 60.50 2c5h n THR 80 Cb 0.19 -1.44 0.00 0.00 -1.55 0.00 0.00 70.33 67.53 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 0.91 1.53 3.39 1.09 0.00 0.11 -4.77 105.19 107.45 2c5h n GLY 81 Ca 0.07 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.90 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 0.49 2.61 -2.24 -0.93 -4.95 114.28 107.26 2c5h n THR 82 Ca 0.00 -1.53 0.13 0.00 -2.27 0.00 0.00 64.05 60.38 2c5h n THR 82 Cb 0.00 -0.76 0.44 0.00 -2.10 0.00 0.00 70.33 67.91 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 -0.24 0.00 -2.86 4.28 1.35 -1.96 -3.45 112.91 110.03 2c5h h THR 83 Ca -0.26 -0.41 -0.59 0.00 -0.55 0.00 0.00 66.41 64.60 2c5h h THR 83 Cb 1.07 1.31 0.15 0.00 -1.73 0.00 0.00 68.15 68.95 2c5h h THR 83 CO 0.32 0.00 -0.15 1.07 -0.25 0.00 0.00 175.52 176.51 2c5h n THR 84 N -2.36 2.34 -4.30 6.82 5.66 -1.26 -5.00 114.28 116.17 2c5h n THR 84 Ca 0.04 -0.50 -0.21 0.00 -3.05 0.00 0.00 64.05 60.33 2c5h n THR 84 Cb 0.35 -0.85 -0.13 0.00 -1.55 0.00 0.00 70.33 68.16 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 -1.98 0.96 0.85 1.09 1.81 -1.26 -4.99 118.95 115.44 2c5h s ARG 85 Ca 0.66 -0.92 -0.10 0.00 -1.72 0.00 0.00 55.73 53.65 2c5h s ARG 85 Cb -0.53 -1.03 0.10 0.00 -0.45 0.00 0.00 34.95 33.04 2c5h s ARG 85 CO 0.55 0.24 1.11 -1.12 -0.68 0.00 0.00 175.30 175.41 2c5h s SER 86 N -1.50 3.71 0.01 0.23 0.01 -1.26 -3.86 113.70 111.05 2c5h s SER 86 Ca 0.02 1.92 0.03 0.00 1.31 0.00 0.00 55.95 59.22 2c5h s SER 86 Cb -0.09 -2.50 -0.04 0.00 0.21 0.00 0.00 66.02 63.60 2c5h s SER 86 CO 0.02 -2.55 -0.04 0.54 0.41 0.00 0.00 173.24 171.62 2c5h s VAL 87 N -2.80 3.83 -0.22 3.43 0.11 0.40 -0.55 120.40 124.60 2c5h s VAL 87 Ca 0.64 -0.76 0.01 0.00 -2.93 0.00 0.00 61.98 58.93 2c5h s VAL 87 Cb -0.20 -2.70 0.05 0.00 -1.53 0.00 0.00 36.38 32.01 2c5h s VAL 87 CO 0.57 0.35 -0.08 0.00 -3.33 0.00 0.00 175.10 172.62 2c5h s ALA 88 N -1.06 1.98 -0.01 1.54 0.00 0.69 -1.54 121.76 123.36 2c5h s ALA 88 Ca 0.19 -1.28 0.05 0.00 0.00 0.00 0.00 51.96 50.91 2c5h s ALA 88 Cb -0.11 -1.36 -0.03 0.00 0.00 0.00 0.00 23.12 21.62 2c5h s ALA 88 CO 0.10 -1.01 -0.14 0.14 0.00 0.00 0.00 175.76 174.84 2c5h s VAL 89 N 1.39 3.10 -0.27 0.00 -7.23 -0.16 -0.88 120.40 116.36 2c5h s VAL 89 Ca -0.04 -0.87 -0.15 0.00 -1.81 0.00 0.00 61.98 59.11 2c5h s VAL 89 Cb -0.18 -2.27 -0.04 0.00 0.56 0.00 0.00 36.38 34.46 2c5h s VAL 89 CO -0.07 0.47 0.39 -0.60 -0.31 0.00 0.00 175.10 174.99 2c5h s ARG 90 N -1.09 4.03 0.51 4.82 3.52 -0.61 -0.14 118.95 130.00 2c5h s ARG 90 Ca 0.14 0.09 -0.17 0.00 -0.13 0.00 0.00 55.73 55.65 2c5h s ARG 90 Cb -0.11 -3.65 -0.08 0.00 -1.56 0.00 0.00 34.95 29.56 2c5h s ARG 90 CO 0.03 -0.28 1.00 0.96 -0.81 0.00 0.00 175.30 176.20 2c5h s ILE 91 N 2.08 4.35 0.00 4.11 -4.36 -0.37 -1.25 121.20 125.76 2c5h s ILE 91 Ca 0.16 1.19 0.00 0.00 -0.26 0.00 0.00 60.65 61.74 2c5h s ILE 91 Cb -0.16 -3.63 0.00 0.00 1.25 0.00 0.00 42.46 39.92 2c5h s ILE 91 CO 0.10 -0.58 0.00 1.17 0.24 0.00 0.00 174.94 175.86 2c5h n LYS 92 N -1.49 0.00 -2.37 0.37 4.81 -0.60 -2.88 118.16 115.99 2c5h n LYS 92 Ca 0.07 0.00 -0.41 0.00 -0.87 0.00 0.00 58.31 57.10 2c5h n LYS 92 Cb 0.54 -0.07 -0.04 0.00 0.02 0.00 0.00 35.03 35.48 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 4.52 0.41 1.64 -1.52 -0.34 -1.11 119.66 123.26 2c5h s GLN 93 Ca 0.00 1.90 0.19 0.00 -1.95 0.00 0.00 55.36 55.50 2c5h s GLN 93 Cb 0.00 -3.21 0.90 0.00 -0.22 0.00 0.00 33.01 30.48 2c5h s GLN 93 CO 0.00 -0.01 1.85 0.00 -0.25 0.00 0.00 175.29 176.88 2c5h h ALA 94 N 4.62 1.19 -3.94 6.09 0.00 -1.81 -3.42 119.26 122.00 2c5h h ALA 94 Ca -0.46 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.18 2c5h h ALA 94 Cb 1.21 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.96 2c5h h ALA 94 CO 0.71 0.38 -0.72 0.00 0.00 0.00 0.00 179.25 179.62 2c5h n ALA 95 N -2.34 -2.28 -1.43 0.00 0.00 -1.26 -4.23 120.51 108.97 2c5h n ALA 95 Ca -0.01 0.36 -0.39 0.00 0.00 0.00 0.00 53.44 53.40 2c5h n ALA 95 Cb 0.40 -1.10 0.03 0.00 0.00 0.00 0.00 19.45 18.78 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 1.36 0.43 -4.10 0.00 5.02 -1.26 -4.76 118.16 114.84 2c5h n LYS 96 Ca 0.00 0.17 -0.15 0.00 -2.02 0.00 0.00 58.31 56.30 2c5h n LYS 96 Cb 0.00 -1.55 -0.04 0.00 -0.02 0.00 0.00 35.03 33.42 2c5h n LYS 96 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 2c5h s GLY 97 N -1.11 1.60 0.00 0.72 0.00 -0.97 -4.78 107.32 102.78 2c5h s GLY 97 Ca 0.66 -1.58 0.00 0.00 0.00 0.00 0.00 44.72 43.79 2c5h s GLY 97 CO 0.57 -1.04 0.00 0.61 0.00 0.00 0.00 173.10 173.24 2c5h n GLY 98 N -0.59 -2.42 0.29 0.20 0.00 -1.26 -1.36 105.19 100.06 2c5h n GLY 98 Ca 0.01 -2.17 0.20 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 -1.75 -3.09 119.26 120.03 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 -0.66 0.54 0.00 0.00 0.00 179.25 179.13 2c5h n ARG 100 N -2.86 2.37 -0.95 0.00 1.74 -1.26 -4.92 116.66 110.77 2c5h n ARG 100 Ca -0.02 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.06 2c5h n ARG 100 Cb 0.07 -0.83 0.00 0.00 -1.02 0.00 0.00 32.46 30.68 2c5h n ARG 100 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2c5h n GLY 101 N 1.91 -1.42 3.21 -0.13 0.00 -1.17 -5.06 105.19 102.53 2c5h n GLY 101 Ca 0.00 -0.40 -0.09 0.00 0.00 0.00 0.00 46.02 45.53 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 -0.27 0.90 0.49 1.61 -2.07 -0.46 -4.79 119.66 115.07 2c5h s GLN 102 Ca 0.00 -1.18 -0.21 0.00 -1.82 0.00 0.00 55.36 52.15 2c5h s GLN 102 Cb 0.00 0.30 -0.08 0.00 -1.09 0.00 0.00 33.01 32.14 2c5h s GLN 102 CO 0.00 -0.28 1.07 -1.58 -1.32 0.00 0.00 175.29 173.18 2c5h s TRP 103 N -3.95 2.95 0.49 9.60 0.52 -1.26 -2.30 118.94 124.99 2c5h s TRP 103 Ca 0.13 1.58 -0.05 0.00 0.02 0.00 0.00 56.10 57.77 2c5h s TRP 103 Cb 0.06 -3.14 -0.03 0.00 -1.15 0.00 0.00 33.47 29.20 2c5h s TRP 103 CO -0.05 -1.00 0.80 0.00 0.02 0.00 0.00 176.95 176.72 2c5h s ALA 104 N -1.88 3.39 0.00 0.98 0.00 -1.26 -4.48 121.76 118.51 2c5h s ALA 104 Ca 0.67 -0.50 0.00 0.00 0.00 0.00 0.00 51.96 52.13 2c5h s ALA 104 Cb -0.19 -2.60 0.00 0.00 0.00 0.00 0.00 23.12 20.33 2c5h s ALA 104 CO 0.23 -0.38 0.00 0.41 0.00 0.00 0.00 175.76 176.02 2c5h n GLY 105 N -2.29 0.72 3.78 0.00 0.00 -1.26 0.17 105.19 106.31 2c5h n GLY 105 Ca 0.01 -2.24 -0.29 0.00 0.00 0.00 0.00 46.02 43.50 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 3.75 1.40 1.61 1.04 -1.26 -3.97 113.70 116.27 2c5h s SER 106 Ca 0.00 1.12 0.00 0.00 0.48 0.00 0.00 55.95 57.55 2c5h s SER 106 Cb 0.00 -1.76 0.00 0.00 0.10 0.00 0.00 66.02 64.36 2c5h s SER 106 CO 0.00 -2.42 0.00 0.61 0.98 0.00 0.00 173.24 172.41 2c5h n GLY 107 N -2.02 3.22 0.25 7.32 0.00 -1.26 -0.76 105.19 111.95 2c5h n GLY 107 Ca 0.07 -0.14 0.07 0.00 0.00 0.00 0.00 46.02 46.01 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 10.31 2.53 0.00 4.61 0.00 -1.26 -5.01 120.51 131.69 2c5h n ALA 108 Ca 0.00 -0.28 0.00 0.00 0.00 0.00 0.00 53.44 53.16 2c5h n ALA 108 Cb 0.00 -1.12 0.00 0.00 0.00 0.00 0.00 19.45 18.33 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 0.86 -0.23 3.32 0.00 0.00 0.06 -4.47 105.19 104.73 2c5h n GLY 109 Ca 0.11 -1.76 -0.46 0.00 0.00 0.00 0.00 46.02 43.91 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 -1.97 3.25 0.26 1.61 0.08 0.44 -4.90 117.98 116.77 2c5h s PHE 110 Ca 0.00 -1.25 -0.30 0.00 0.12 0.00 0.00 56.93 55.50 2c5h s PHE 110 Cb 0.00 -3.69 -0.10 0.00 -0.57 0.00 0.00 43.02 38.66 2c5h s PHE 110 CO 0.00 -0.98 1.49 -2.00 -0.10 0.00 0.00 175.22 173.63 2c5h s GLU 111 N 1.60 4.22 -0.24 0.44 2.12 -1.26 -4.54 118.70 121.05 2c5h s GLU 111 Ca 0.03 2.39 -0.01 0.00 0.36 0.00 0.00 54.97 57.74 2c5h s GLU 111 Cb -0.29 -3.08 0.02 0.00 0.26 0.00 0.00 34.13 31.04 2c5h s GLU 111 CO 0.03 -0.49 -0.08 1.03 -0.54 0.00 0.00 175.26 175.22 2c5h s ARG 112 N -0.42 2.89 0.56 4.30 1.81 -1.26 -5.10 118.95 121.73 2c5h s ARG 112 Ca 0.61 -0.93 -0.18 0.00 -1.72 0.00 0.00 55.73 53.50 2c5h s ARG 112 Cb -0.44 -2.92 -0.11 0.00 -0.45 0.00 0.00 34.95 31.03 2c5h s ARG 112 CO 0.45 -0.36 0.23 0.00 -0.68 0.00 0.00 175.30 174.94 2c5h n ALA 113 N 4.67 -2.04 -1.22 2.13 0.00 -1.26 -4.46 120.51 118.33 2c5h n ALA 113 Ca -0.17 -0.06 -0.29 0.00 0.00 0.00 0.00 53.44 52.92 2c5h n ALA 113 Cb 0.48 -1.64 0.15 0.00 0.00 0.00 0.00 19.45 18.44 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 -1.67 0.88 -1.61 0.00 2.02 -1.26 -4.13 118.70 112.92 2c5h s GLU 114 Ca 0.63 0.64 0.00 0.00 0.02 0.00 0.00 54.97 56.27 2c5h s GLU 114 Cb -0.46 -1.78 0.00 0.00 0.10 0.00 0.00 34.13 31.99 2c5h s GLU 114 CO 0.60 -2.45 0.00 0.41 0.02 0.00 0.00 175.26 173.84 2c5h n GLY 115 N -1.19 0.67 0.55 -1.39 0.00 -0.27 -4.89 105.19 98.67 2c5h n GLY 115 Ca 0.06 -0.20 0.06 0.00 0.00 0.00 0.00 46.02 45.94 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 -0.97 2.34 -3.86 1.61 7.64 -1.26 -4.91 113.62 114.22 2c5h n SER 116 Ca -0.18 -1.67 -0.12 0.00 1.01 0.00 0.00 58.87 57.91 2c5h n SER 116 Cb 0.60 -0.09 -0.13 0.00 -1.01 0.00 0.00 64.21 63.59 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 -0.99 -0.04 -0.06 1.43 2.02 -1.26 0.86 117.35 119.31 2c5h s TYR 117 Ca 0.18 0.11 0.04 0.00 -0.37 0.00 0.00 57.07 57.03 2c5h s TYR 117 Cb 0.11 0.00 -0.02 0.00 -0.40 0.00 0.00 41.96 41.65 2c5h s TYR 117 CO 0.16 -0.08 -0.18 0.42 -1.57 0.00 0.00 175.55 174.30 2c5h s ILE 118 N -0.23 2.71 -0.05 2.71 1.01 -1.17 -1.24 121.20 124.95 2c5h s ILE 118 Ca -0.03 -0.84 0.01 0.00 0.00 0.00 0.00 60.65 59.79 2c5h s ILE 118 Cb -0.02 -2.04 -0.03 0.00 0.01 0.00 0.00 42.46 40.38 2c5h s ILE 118 CO 0.00 0.58 -0.05 -0.31 0.00 0.00 0.00 174.94 175.16 2c5h s TYR 119 N -0.46 2.97 -0.06 3.97 2.02 0.80 -0.21 117.35 126.38 2c5h s TYR 119 Ca 0.05 0.04 -0.00 0.00 -0.37 0.00 0.00 57.07 56.79 2c5h s TYR 119 Cb -0.12 -1.69 0.02 0.00 -0.40 0.00 0.00 41.96 39.77 2c5h s TYR 119 CO 0.01 0.37 -0.03 -1.50 -1.57 0.00 0.00 175.55 172.84 2c5h s ILE 120 N -0.89 0.54 0.20 2.71 2.07 -0.19 -0.99 121.20 124.65 2c5h s ILE 120 Ca 0.14 -0.05 -0.21 0.00 -1.41 0.00 0.00 60.65 59.12 2c5h s ILE 120 Cb -0.11 -0.61 0.04 0.00 0.13 0.00 0.00 42.46 41.91 2c5h s ILE 120 CO 0.04 0.26 0.60 0.00 -1.91 0.00 0.00 174.94 173.93 2c5h s ALA 121 N 1.41 -1.30 0.50 1.50 0.00 -0.59 -1.77 121.76 121.51 2c5h s ALA 121 Ca -0.03 0.07 -0.23 0.00 0.00 0.00 0.00 51.96 51.78 2c5h s ALA 121 Cb -0.13 0.86 -0.07 0.00 0.00 0.00 0.00 23.12 23.78 2c5h s ALA 121 CO -0.03 -0.84 1.26 -2.30 0.00 0.00 0.00 175.76 173.85 2c5h n PRO 122 N -0.38 1.66 -1.37 0.00 -0.02 -1.26 -0.45 135.00 133.17 2c5h n PRO 122 Ca -0.12 0.60 -0.33 0.00 -2.02 0.00 0.00 63.50 61.64 2c5h n PRO 122 Cb 0.63 -2.43 -0.06 0.00 -0.02 0.00 0.00 33.50 31.62 2c5h n PRO 122 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 2c5h n ASN 123 N -0.46 7.82 -0.12 2.55 2.85 -1.25 -4.29 115.26 122.37 2c5h n ASN 123 Ca 0.09 -2.68 0.03 0.00 -0.11 0.00 0.00 54.58 51.91 2c5h n ASN 123 Cb 0.43 -1.48 -0.00 0.00 1.24 0.00 0.00 39.78 39.96 2c5h n ASN 123 CO 0.00 0.00 0.00 -0.46 -2.11 0.00 0.00 177.26 174.69 2c5h n ASN 124 N 2.91 0.85 0.00 1.20 0.23 -1.26 -4.48 115.26 114.72 2c5h n ASN 124 Ca 0.67 -0.93 0.00 0.00 -0.53 0.00 0.00 54.58 53.80 2c5h n ASN 124 Cb 0.39 0.52 0.00 0.00 -2.08 0.00 0.00 39.78 38.61 2c5h n ASN 124 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2c5h n GLY 125 N 0.75 0.99 0.34 4.83 0.00 -1.25 -4.81 105.19 106.03 2c5h n GLY 125 Ca 0.02 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.16 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 0.27 -3.04 0.99 5.85 -1.84 -2.12 115.31 115.42 2c5h h LEU 126 Ca 0.00 0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.70 2c5h h LEU 126 Cb 0.00 -0.05 -0.02 0.00 0.37 0.00 0.00 40.66 40.96 2c5h h LEU 126 CO 0.00 0.17 0.03 0.18 -0.34 0.00 0.00 178.44 178.48 2c5h n LEU 127 N -4.47 4.80 0.23 2.25 4.77 -1.26 -4.24 117.00 119.08 2c5h n LEU 127 Ca 0.07 -2.44 -0.16 0.00 -0.03 0.00 0.00 56.01 53.45 2c5h n LEU 127 Cb 0.32 -0.65 -0.09 0.00 -2.33 0.00 0.00 43.42 40.67 2c5h n LEU 127 CO 0.35 0.57 0.52 0.74 -1.33 0.00 0.00 177.39 178.24 2c5h h THR 128 N 2.98 0.00 -0.74 -5.08 2.02 -1.68 -0.21 112.91 110.21 2c5h h THR 128 Ca 0.03 0.00 -0.05 0.00 0.77 0.00 0.00 66.41 67.16 2c5h h THR 128 Cb 1.72 0.00 -0.03 0.00 -1.74 0.00 0.00 68.15 68.09 2c5h h THR 128 CO 0.42 0.00 0.27 0.71 0.37 0.00 0.00 175.52 177.29 2c5h h THR 129 N -0.86 1.25 -0.06 3.16 1.35 -1.84 -1.79 112.91 114.12 2c5h h THR 129 Ca -0.05 -0.83 0.04 0.00 -0.55 0.00 0.00 66.41 65.02 2c5h h THR 129 Cb 0.76 0.40 -0.06 0.00 -1.73 0.00 0.00 68.15 67.52 2c5h h THR 129 CO -0.09 0.33 -0.40 0.58 -0.25 0.00 0.00 175.52 175.68 2c5h h VAL 130 N 1.08 0.17 -0.07 6.82 2.07 -1.79 0.22 116.25 124.75 2c5h h VAL 130 Ca 0.24 0.00 -0.07 0.00 0.82 0.00 0.00 66.70 67.69 2c5h h VAL 130 Cb 0.24 0.17 -0.01 0.00 -1.52 0.00 0.00 31.29 30.17 2c5h h VAL 130 CO -0.02 0.00 -0.29 -0.07 0.02 0.00 0.00 177.57 177.21 2c5h h LEU 131 N -0.52 0.12 0.00 2.57 3.38 -0.63 0.15 115.31 120.38 2c5h h LEU 131 Ca 0.06 -0.04 -0.24 0.00 0.09 0.00 0.00 57.88 57.76 2c5h h LEU 131 Cb 0.63 -0.03 -0.04 0.00 0.09 0.00 0.00 40.66 41.31 2c5h h LEU 131 CO -0.35 0.41 -1.26 1.05 0.09 0.00 0.00 178.44 178.39 2c5h h GLU 132 N 0.11 0.01 0.00 1.13 4.11 -0.78 0.53 114.58 119.69 2c5h h GLU 132 Ca 0.02 -0.02 -0.03 0.00 0.07 0.00 0.00 59.36 59.40 2c5h h GLU 132 Cb 0.58 0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.83 2c5h h GLU 132 CO 0.04 0.83 -1.19 0.39 0.07 0.00 0.00 179.01 179.16 2c5h n GLU 133 N -3.25 0.61 -0.00 1.06 1.02 0.72 -4.41 120.64 116.39 2c5h n GLU 133 Ca -0.06 0.10 0.03 0.00 -0.02 0.00 0.00 57.16 57.21 2c5h n GLU 133 Cb 0.98 -1.79 -0.05 0.00 -0.02 0.00 0.00 31.44 30.57 2c5h n GLU 133 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 2c5h n HIS 134 N -2.66 0.00 -1.04 -0.32 8.25 0.50 -4.84 115.22 115.11 2c5h n HIS 134 Ca -0.02 0.00 0.14 0.00 -0.26 0.00 0.00 57.72 57.58 2c5h n HIS 134 Cb 0.60 -0.12 -0.04 0.00 1.12 0.00 0.00 29.99 31.55 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 2.00 -1.97 3.13 -1.41 0.00 0.18 -1.20 105.19 105.93 2c5h n GLY 135 Ca -0.01 -1.25 -0.11 0.00 0.00 0.00 0.00 46.02 44.66 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 -2.23 0.06 -0.10 1.61 -0.85 -1.26 -1.56 117.35 113.02 2c5h s TYR 136 Ca 0.00 -0.21 0.03 0.00 -0.52 0.00 0.00 57.07 56.37 2c5h s TYR 136 Cb 0.00 -0.05 -0.24 0.00 0.38 0.00 0.00 41.96 42.04 2c5h s TYR 136 CO 0.00 -0.34 0.44 1.28 -1.52 0.00 0.00 175.55 175.42 2c5h n LEU 137 N 1.16 1.79 -3.63 -3.49 4.77 -0.38 -4.72 117.00 112.50 2c5h n LEU 137 Ca -0.21 0.27 -0.11 0.00 -0.03 0.00 0.00 56.01 55.92 2c5h n LEU 137 Cb 0.57 -0.49 -0.07 0.00 -2.33 0.00 0.00 43.42 41.10 2c5h n LEU 137 CO 0.22 0.65 0.62 -1.83 -1.33 0.00 0.00 177.39 175.72 2c5h s GLU 138 N -2.57 0.65 0.01 3.23 -1.05 -1.24 -5.03 118.70 112.70 2c5h s GLU 138 Ca -0.15 0.68 0.02 0.00 -0.15 0.00 0.00 54.97 55.37 2c5h s GLU 138 Cb 0.07 0.31 -0.01 0.00 -0.44 0.00 0.00 34.13 34.07 2c5h s GLU 138 CO 0.79 -0.10 -0.06 0.00 0.95 0.00 0.00 175.26 176.84 2c5h s ALA 139 N 0.11 0.49 -0.07 -0.84 0.00 -1.26 -1.57 121.76 118.62 2c5h s ALA 139 Ca 0.01 -0.42 -0.06 0.00 0.00 0.00 0.00 51.96 51.49 2c5h s ALA 139 Cb -0.04 -0.06 0.02 0.00 0.00 0.00 0.00 23.12 23.04 2c5h s ALA 139 CO -0.03 0.06 0.18 0.71 0.00 0.00 0.00 175.76 176.69 2c5h s TYR 140 N -0.58 -0.21 0.01 0.00 2.02 -0.06 -1.62 117.35 116.92 2c5h s TYR 140 Ca -0.02 0.51 -0.30 0.00 -0.37 0.00 0.00 57.07 56.88 2c5h s TYR 140 Cb -0.05 0.06 -0.05 0.00 -0.40 0.00 0.00 41.96 41.52 2c5h s TYR 140 CO 0.00 -0.11 1.26 -2.00 -1.57 0.00 0.00 175.55 173.13 2c5h s GLU 141 N 0.25 4.36 -1.03 -0.62 2.12 -0.72 -0.22 118.70 122.84 2c5h s GLU 141 Ca -0.01 1.81 -0.21 0.00 0.36 0.00 0.00 54.97 56.92 2c5h s GLU 141 Cb -0.03 -3.46 0.08 0.00 0.26 0.00 0.00 34.13 30.99 2c5h s GLU 141 CO -0.01 -0.40 1.37 0.08 -0.54 0.00 0.00 175.26 175.76 2c5h s VAL 142 N 1.74 4.26 -0.06 3.70 1.01 0.28 -1.91 120.40 129.43 2c5h s VAL 142 Ca 0.59 -1.24 0.01 0.00 0.00 0.00 0.00 61.98 61.34 2c5h s VAL 142 Cb -0.29 -4.98 -0.02 0.00 0.00 0.00 0.00 36.38 31.10 2c5h s VAL 142 CO 0.26 -1.79 0.05 0.35 0.00 0.00 0.00 175.10 173.98 2c5h n THR 143 N 6.26 0.00 -2.26 3.92 -2.24 0.16 -4.39 114.28 115.74 2c5h n THR 143 Ca 0.32 -0.42 -0.41 0.00 -2.27 0.00 0.00 64.05 61.27 2c5h n THR 143 Cb 0.49 0.94 -0.03 0.00 -2.10 0.00 0.00 70.33 69.63 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 -1.24 6.97 0.00 3.42 0.15 0.18 -4.87 113.70 118.30 2c5h s SER 144 Ca 0.00 2.50 0.13 0.00 0.70 0.00 0.00 55.95 59.29 2c5h s SER 144 Cb 0.01 -2.64 0.60 0.00 -1.71 0.00 0.00 66.02 62.28 2c5h s SER 144 CO 0.06 -0.39 1.41 -0.81 1.20 0.00 0.00 173.24 174.70 2c5h n PRO 145 N 1.16 0.05 0.11 5.44 -0.04 -1.26 -1.91 135.00 138.55 2c5h n PRO 145 Ca 0.00 0.24 0.13 0.00 -0.04 0.00 0.00 63.50 63.83 2c5h n PRO 145 Cb 0.43 -1.50 0.41 0.00 -0.04 0.00 0.00 33.50 32.80 2c5h n PRO 145 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2c5h n LYS 146 N -1.44 0.26 0.00 0.54 5.02 -1.26 -4.13 118.16 117.14 2c5h n LYS 146 Ca 0.04 0.24 0.00 0.00 -2.02 0.00 0.00 58.31 56.58 2c5h n LYS 146 Cb 0.14 -1.82 0.00 0.00 -0.02 0.00 0.00 35.03 33.33 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 -2.27 0.00 -4.41 -0.18 0.24 -0.95 -5.04 118.33 105.71 2c5h n VAL 147 Ca 0.05 -0.14 -0.21 0.00 -2.04 0.00 0.00 64.34 62.00 2c5h n VAL 147 Cb 0.41 0.80 -0.10 0.00 -1.47 0.00 0.00 33.84 33.47 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 -0.47 1.94 0.81 1.34 -4.36 -0.80 -2.52 121.20 117.14 2c5h s ILE 148 Ca 0.00 -2.24 -0.12 0.00 -0.26 0.00 0.00 60.65 58.03 2c5h s ILE 148 Cb 0.00 -2.26 0.08 0.00 1.25 0.00 0.00 42.46 41.54 2c5h s ILE 148 CO 0.00 -0.44 1.15 -2.84 0.24 0.00 0.00 174.94 173.04 2c5h s PRO 149 N -3.63 1.79 0.11 0.37 0.02 -1.26 -4.49 135.00 127.91 2c5h s PRO 149 Ca 0.27 1.50 0.03 0.00 0.02 0.00 0.00 61.00 62.81 2c5h s PRO 149 Cb -0.00 -1.82 -0.21 0.00 0.02 0.00 0.00 34.50 32.49 2c5h s PRO 149 CO 0.11 -2.04 1.25 0.93 -0.33 0.00 0.00 177.00 176.91 2c5h h GLU 150 N -1.09 0.11 -3.03 5.54 5.08 -1.96 -3.37 114.58 115.85 2c5h h GLU 150 Ca -0.45 -0.18 -0.62 0.00 -1.00 0.00 0.00 59.36 57.12 2c5h h GLU 150 Cb 1.26 0.06 -0.41 0.00 0.50 0.00 0.00 28.75 30.17 2c5h h GLU 150 CO 0.47 1.06 -0.64 1.14 -1.00 0.00 0.00 179.01 180.05 2c5h s GLN 151 N -2.75 2.15 0.43 2.33 0.00 -1.26 -5.10 119.66 115.46 2c5h s GLN 151 Ca -0.01 -3.03 -0.26 0.00 -0.00 0.00 0.00 55.36 52.06 2c5h s GLN 151 Cb 0.09 -3.11 -0.09 0.00 0.00 0.00 0.00 33.01 29.90 2c5h s GLN 151 CO 0.84 -1.27 1.41 -1.25 0.00 0.00 0.00 175.29 175.03 2c5h s PRO 152 N -1.02 3.78 -0.04 9.60 0.04 -1.26 -4.88 135.00 141.22 2c5h s PRO 152 Ca 0.24 2.39 -0.29 0.00 0.04 0.00 0.00 61.00 63.38 2c5h s PRO 152 Cb -0.08 -2.71 -0.08 0.00 0.04 0.00 0.00 34.50 31.68 2c5h s PRO 152 CO -0.14 -0.73 2.03 -2.00 0.04 0.00 0.00 177.00 176.21 2c5h s GLU 153 N -2.37 3.85 0.30 4.56 2.56 -1.26 -4.89 118.70 121.44 2c5h s GLU 153 Ca 0.59 2.43 0.02 0.00 0.00 0.00 0.00 54.97 58.02 2c5h s GLU 153 Cb -0.43 -4.22 0.74 0.00 2.00 0.00 0.00 34.13 32.22 2c5h s GLU 153 CO 0.56 -1.29 1.62 -1.35 -0.56 0.00 0.00 175.26 174.24 2c5h h PRO 154 N 11.88 0.12 -0.01 4.30 0.11 -1.92 -2.37 132.00 144.11 2c5h h PRO 154 Ca -0.47 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.63 2c5h h PRO 154 Cb 1.24 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.32 2c5h h PRO 154 CO 0.95 0.08 -0.36 0.25 -0.21 0.00 0.00 178.00 178.71 2c5h n THR 155 N -5.32 0.00 -2.41 -1.15 -2.24 -1.26 0.07 114.28 101.97 2c5h n THR 155 Ca 0.22 -0.13 -0.25 0.00 -2.27 0.00 0.00 64.05 61.63 2c5h n THR 155 Cb 0.73 0.56 0.01 0.00 -2.10 0.00 0.00 70.33 69.52 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 -0.69 3.09 0.27 4.78 -0.00 -0.89 -4.76 117.46 119.26 2c5h n PHE 156 Ca 0.10 -2.90 0.13 0.00 -0.00 0.00 0.00 57.45 54.78 2c5h n PHE 156 Cb 0.37 -0.15 0.61 0.00 -0.00 0.00 0.00 39.48 40.30 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 2.53 0.00 -0.58 -5.13 -1.99 -1.78 -1.40 116.97 108.61 2c5h h TYR 157 Ca 0.28 0.00 -0.08 0.00 2.00 0.00 0.00 58.73 60.93 2c5h h TYR 157 Cb 1.07 0.00 -0.02 0.00 2.00 0.00 0.00 36.73 39.78 2c5h h TYR 157 CO 0.80 0.00 0.07 0.77 -0.00 0.00 0.00 178.16 179.80 2c5h h SER 158 N 0.00 0.95 -0.00 3.88 0.02 -1.92 0.89 113.55 117.37 2c5h h SER 158 Ca 0.00 -0.28 -0.01 0.00 -0.84 0.00 0.00 61.79 60.66 2c5h h SER 158 Cb 0.17 -0.25 0.00 0.00 0.14 0.00 0.00 62.40 62.46 2c5h h SER 158 CO 0.00 0.99 -0.05 -0.09 -1.14 0.00 0.00 176.83 176.54 2c5h h ARG 159 N 0.88 0.04 0.07 3.45 2.43 -1.70 -1.12 114.38 118.43 2c5h h ARG 159 Ca 0.17 -0.04 -0.26 0.00 -0.81 0.00 0.00 59.98 59.04 2c5h h ARG 159 Cb 0.46 0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 30.01 2c5h h ARG 159 CO 0.02 0.77 -1.27 0.93 -1.51 0.00 0.00 179.97 178.91 2c5h h GLU 160 N -0.68 0.15 -0.33 0.20 4.39 -1.28 -1.39 114.58 115.64 2c5h h GLU 160 Ca -0.01 -0.26 0.00 0.00 0.34 0.00 0.00 59.36 59.44 2c5h h GLU 160 Cb 0.79 0.10 0.00 0.00 -0.10 0.00 0.00 28.75 29.54 2c5h h GLU 160 CO 0.01 1.05 0.00 -1.33 -1.16 0.00 0.00 179.01 177.58 2c5h n MET 161 N -3.41 2.42 0.07 2.33 2.81 0.30 -4.30 117.12 117.35 2c5h n MET 161 Ca -0.08 -1.97 0.00 0.00 -1.81 0.00 0.00 57.70 53.83 2c5h n MET 161 Cb 1.00 -1.31 0.00 0.00 -0.71 0.00 0.00 33.22 32.21 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 0.72 0.09 0.31 2.03 0.31 -1.15 -4.67 118.33 115.97 2c5h n VAL 162 Ca 0.13 0.03 -0.17 0.00 -0.01 0.00 0.00 64.34 64.32 2c5h n VAL 162 Cb 0.43 -0.40 -0.08 0.00 -0.91 0.00 0.00 33.84 32.88 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 -0.82 -0.06 3.52 0.00 -0.99 0.27 119.26 121.17 2c5h h ALA 163 Ca 0.00 -0.16 0.02 0.00 0.00 0.00 0.00 54.91 54.77 2c5h h ALA 163 Cb 0.00 0.38 -0.05 0.00 0.00 0.00 0.00 17.79 18.13 2c5h h ALA 163 CO 0.00 -0.97 -0.43 0.82 0.00 0.00 0.00 179.25 178.67 2c5h h ILE 164 N -0.81 0.00 0.00 0.00 2.04 -1.50 -1.41 117.51 115.82 2c5h h ILE 164 Ca -0.07 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 65.76 2c5h h ILE 164 Cb 0.66 0.00 -0.00 0.00 -0.74 0.00 0.00 36.82 36.73 2c5h h ILE 164 CO 0.08 0.00 -0.15 1.55 0.00 0.00 0.00 178.15 179.63 2c5h h PRO 165 N -0.49 0.00 -0.08 2.37 0.13 -1.35 -1.67 132.00 130.91 2c5h h PRO 165 Ca 0.02 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.13 2c5h h PRO 165 Cb 0.55 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.67 2c5h h PRO 165 CO -0.32 0.15 -0.05 0.66 -0.23 0.00 0.00 178.00 178.21 2c5h h SER 166 N 0.00 0.11 -0.21 1.44 4.64 0.58 -1.09 113.55 119.01 2c5h h SER 166 Ca -0.00 -0.01 -0.21 0.00 -0.47 0.00 0.00 61.79 61.10 2c5h h SER 166 Cb 0.34 -0.03 0.01 0.00 -0.31 0.00 0.00 62.40 62.41 2c5h h SER 166 CO 0.02 0.18 -0.68 0.00 -0.87 0.00 0.00 176.83 175.48 2c5h h ALA 167 N 1.84 0.37 -0.49 5.18 0.00 -0.53 0.49 119.26 126.12 2c5h h ALA 167 Ca 0.03 -0.56 -0.08 0.00 0.00 0.00 0.00 54.91 54.30 2c5h h ALA 167 Cb 0.17 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 2c5h h ALA 167 CO 0.01 0.68 -0.00 0.45 0.00 0.00 0.00 179.25 180.38 2c5h h HIS 168 N 0.60 0.87 -0.05 0.00 3.86 -1.06 0.09 115.15 119.48 2c5h h HIS 168 Ca -0.02 -0.13 -0.21 0.00 -1.16 0.00 0.00 60.37 58.85 2c5h h HIS 168 Cb 1.30 -0.24 0.00 0.00 1.06 0.00 0.00 27.41 29.54 2c5h h HIS 168 CO 0.08 0.81 -0.85 -0.07 0.86 0.00 0.00 177.93 178.75 2c5h h LEU 169 N 0.76 0.59 -1.55 2.43 3.38 -1.03 0.12 115.31 120.02 2c5h h LEU 169 Ca 0.15 -0.43 -0.02 0.00 0.09 0.00 0.00 57.88 57.67 2c5h h LEU 169 Cb 0.47 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.02 2c5h h LEU 169 CO 0.02 1.21 0.10 0.00 0.09 0.00 0.00 178.44 179.86 2c5h h ALA 170 N 0.76 1.65 -0.07 1.53 0.00 -0.68 -2.41 119.26 120.04 2c5h h ALA 170 Ca -0.06 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.76 2c5h h ALA 170 Cb 1.47 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 19.14 2c5h h ALA 170 CO 0.15 0.28 0.00 0.00 0.00 0.00 0.00 179.25 179.68 2c5h n ALA 171 N -2.49 2.52 -0.33 0.00 0.00 0.00 -4.84 120.51 115.38 2c5h n ALA 171 Ca 0.01 -0.18 0.00 0.00 0.00 0.00 0.00 53.44 53.27 2c5h n ALA 171 Cb 0.14 -1.09 0.00 0.00 0.00 0.00 0.00 19.45 18.50 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 0.73 0.80 3.69 0.00 0.00 -0.91 -5.04 105.19 104.46 2c5h n GLY 172 Ca 0.07 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.67 2c5h n GLY 172 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2c5h s PHE 173 N -2.15 2.25 0.03 1.61 5.36 0.36 -4.87 117.98 120.57 2c5h s PHE 173 Ca 0.00 0.18 -0.32 0.00 -0.96 0.00 0.00 56.93 55.83 2c5h s PHE 173 Cb 0.00 -4.03 -0.11 0.00 -0.34 0.00 0.00 43.02 38.55 2c5h s PHE 173 CO 0.00 -4.19 1.88 -2.30 -1.46 0.00 0.00 175.22 169.14 2c5h n PRO 174 N 5.86 2.55 -0.24 10.12 -0.02 -1.26 -4.57 135.00 147.44 2c5h n PRO 174 Ca 0.17 0.93 0.05 0.00 -2.02 0.00 0.00 63.50 62.63 2c5h n PRO 174 Cb 0.40 -2.82 0.16 0.00 -0.02 0.00 0.00 33.50 31.22 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 9.22 -0.16 0.00 2.45 5.85 -1.95 -1.06 115.31 129.65 2c5h h LEU 175 Ca -0.48 0.17 0.00 0.00 0.84 0.00 0.00 57.88 58.40 2c5h h LEU 175 Cb 1.25 0.26 0.00 0.00 0.37 0.00 0.00 40.66 42.54 2c5h h LEU 175 CO 0.94 -0.10 0.00 -1.54 -0.34 0.00 0.00 178.44 177.40 2c5h n SER 176 N -5.25 0.00 -0.85 1.25 3.41 -1.26 -2.33 113.62 108.59 2c5h n SER 176 Ca 0.13 -0.77 0.08 0.00 -0.26 0.00 0.00 58.87 58.05 2c5h n SER 176 Cb 0.45 0.00 0.18 0.00 -0.26 0.00 0.00 64.21 64.58 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 -0.87 2.41 0.16 4.33 1.02 -0.40 -4.42 120.64 122.87 2c5h n GLU 177 Ca 0.11 -2.08 0.04 0.00 -0.02 0.00 0.00 57.16 55.21 2c5h n GLU 177 Cb 0.05 -1.37 0.18 0.00 -0.02 0.00 0.00 31.44 30.28 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 0.86 0.00 2.62 -1.51 -1.60 -3.44 116.25 116.15 2c5h h VAL 178 Ca 0.00 -1.89 0.00 0.00 -1.23 0.00 0.00 66.70 63.58 2c5h h VAL 178 Cb 0.79 2.19 0.00 0.00 -2.13 0.00 0.00 31.29 32.14 2c5h h VAL 178 CO 0.00 0.43 0.00 0.61 -1.23 0.00 0.00 177.57 177.38 2c5h n GLY 179 N 0.77 0.22 3.67 5.19 0.00 -0.80 0.48 105.19 114.71 2c5h n GLY 179 Ca 0.01 -1.12 -0.35 0.00 0.00 0.00 0.00 46.02 44.56 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 -0.68 0.51 -1.88 1.61 1.85 -1.26 -4.30 116.66 112.52 2c5h n ARG 180 Ca 0.00 0.24 -0.39 0.00 -1.00 0.00 0.00 57.85 56.70 2c5h n ARG 180 Cb 0.00 -2.37 0.02 0.00 -1.05 0.00 0.00 32.46 29.06 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 -3.64 3.47 -0.17 2.89 0.02 -1.26 -1.76 135.00 134.55 2c5h s PRO 181 Ca 0.75 2.22 -0.09 0.00 0.02 0.00 0.00 61.00 63.91 2c5h s PRO 181 Cb -0.33 -2.45 -0.05 0.00 0.02 0.00 0.00 34.50 31.69 2c5h s PRO 181 CO 0.48 -0.92 0.14 -0.51 -0.33 0.00 0.00 177.00 175.86 2c5h s LEU 182 N -3.10 4.28 0.72 -5.54 1.43 -0.64 -4.81 118.68 111.02 2c5h s LEU 182 Ca 0.66 0.34 -0.12 0.00 -1.03 0.00 0.00 54.13 53.97 2c5h s LEU 182 Cb -0.40 -2.09 0.03 0.00 0.03 0.00 0.00 46.19 43.76 2c5h s LEU 182 CO 0.49 0.27 1.10 -1.61 0.23 0.00 0.00 176.35 176.83 2c5h s GLU 183 N -0.21 2.54 0.12 1.70 2.02 -1.26 -4.69 118.70 118.92 2c5h s GLU 183 Ca 0.11 1.25 -0.23 0.00 0.02 0.00 0.00 54.97 56.12 2c5h s GLU 183 Cb -0.11 -1.93 -0.05 0.00 0.10 0.00 0.00 34.13 32.14 2c5h s GLU 183 CO 0.01 -1.43 1.67 0.22 0.02 0.00 0.00 175.26 175.74 2c5h h ASP 184 N -0.59 -0.48 0.00 -0.19 3.58 -1.99 -1.59 116.42 115.16 2c5h h ASP 184 Ca -0.45 0.08 0.00 0.00 0.42 0.00 0.00 57.03 57.08 2c5h h ASP 184 Cb 1.24 0.21 0.00 0.00 1.72 0.00 0.00 39.33 42.50 2c5h h ASP 184 CO 0.53 -0.21 0.08 0.00 -2.88 0.00 0.00 179.24 176.75 2c5h n HIS 185 N -5.30 0.62 0.84 0.28 1.44 -1.26 -0.43 115.22 111.42 2c5h n HIS 185 Ca -0.04 0.33 0.12 0.00 -2.01 0.00 0.00 57.72 56.12 2c5h n HIS 185 Cb 0.21 -0.97 0.30 0.00 0.12 0.00 0.00 29.99 29.65 2c5h n HIS 185 CO 0.00 0.00 0.00 0.39 -2.81 0.00 0.00 176.34 173.92 2c5h n GLU 186 N -2.16 0.11 -2.77 -1.40 1.02 -0.60 -4.65 120.64 110.19 2c5h n GLU 186 Ca -0.01 0.04 -0.43 0.00 -0.02 0.00 0.00 57.16 56.74 2c5h n GLU 186 Cb 0.11 -1.58 -0.04 0.00 -0.02 0.00 0.00 31.44 29.91 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 -3.06 4.31 0.27 -3.67 1.01 0.43 -5.00 121.20 115.50 2c5h s ILE 187 Ca 0.10 0.54 -0.30 0.00 0.00 0.00 0.00 60.65 60.98 2c5h s ILE 187 Cb 0.16 -4.57 -0.13 0.00 0.01 0.00 0.00 42.46 37.94 2c5h s ILE 187 CO 0.67 -1.12 1.46 0.52 0.00 0.00 0.00 174.94 176.47 2c5h n VAL 188 N 6.37 1.12 -4.87 2.92 0.31 -1.26 -5.00 118.33 117.92 2c5h n VAL 188 Ca 0.04 -0.28 -0.28 0.00 -0.01 0.00 0.00 64.34 63.81 2c5h n VAL 188 Cb 0.48 -1.66 -0.15 0.00 -0.91 0.00 0.00 33.84 31.60 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 -0.64 1.66 0.35 5.55 3.00 -1.26 -3.81 118.95 123.79 2c5h s ARG 189 Ca 0.65 -0.97 0.07 0.00 0.00 0.00 0.00 55.73 55.48 2c5h s ARG 189 Cb -0.58 -1.75 -0.01 0.00 0.00 0.00 0.00 34.95 32.60 2c5h s ARG 189 CO 0.51 0.46 0.43 -0.59 0.00 0.00 0.00 175.30 176.11 2c5h s PHE 190 N -0.73 3.01 -0.27 -0.53 -0.12 -1.26 -4.93 117.98 113.15 2c5h s PHE 190 Ca 0.09 -0.27 -0.14 0.00 -0.05 0.00 0.00 56.93 56.56 2c5h s PHE 190 Cb -0.09 -1.98 -0.04 0.00 -0.63 0.00 0.00 43.02 40.27 2c5h s PHE 190 CO 0.01 0.00 0.33 -0.80 -0.05 0.00 0.00 175.22 174.71 2c5h s ASN 191 N -4.14 6.21 0.10 1.98 0.01 -1.26 -5.02 114.94 112.82 2c5h s ASN 191 Ca 0.45 0.23 -0.31 0.00 -0.71 0.00 0.00 52.86 52.53 2c5h s ASN 191 Cb -0.08 -2.19 -0.07 0.00 0.41 0.00 0.00 41.25 39.32 2c5h s ASN 191 CO 0.30 -0.14 1.29 -0.13 -1.51 0.00 0.00 177.10 176.91 2c5h s ARG 192 N 1.90 4.38 0.14 -0.60 0.52 -1.26 -4.95 118.95 119.08 2c5h s ARG 192 Ca 0.13 1.92 -0.31 0.00 -0.52 0.00 0.00 55.73 56.95 2c5h s ARG 192 Cb -0.16 -3.29 -0.11 0.00 0.52 0.00 0.00 34.95 31.92 2c5h s ARG 192 CO 0.10 -0.32 1.84 -0.35 0.02 0.00 0.00 175.30 176.58 2c5h n PRO 193 N 3.79 2.84 -3.27 3.54 -0.04 -1.26 -4.96 135.00 135.64 2c5h n PRO 193 Ca 0.10 1.03 -0.33 0.00 -0.04 0.00 0.00 63.50 64.26 2c5h n PRO 193 Cb 0.44 -2.93 -0.06 0.00 -0.04 0.00 0.00 33.50 30.92 2c5h n PRO 193 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2c5h s ALA 194 N 2.60 3.45 -0.22 0.55 0.00 -1.26 -5.06 121.76 121.81 2c5h s ALA 194 Ca 0.81 -0.09 -0.20 0.00 0.00 0.00 0.00 51.96 52.47 2c5h s ALA 194 Cb -0.47 -2.61 -0.02 0.00 0.00 0.00 0.00 23.12 20.01 2c5h s ALA 194 CO 0.36 0.42 0.62 0.08 0.00 0.00 0.00 175.76 177.24 2c5h s VAL 195 N -1.82 5.01 -0.21 0.00 1.01 -1.26 -4.84 120.40 118.28 2c5h s VAL 195 Ca 0.49 1.15 -0.05 0.00 0.00 0.00 0.00 61.98 63.57 2c5h s VAL 195 Cb -0.12 -3.93 -0.02 0.00 0.00 0.00 0.00 36.38 32.31 2c5h s VAL 195 CO 0.19 0.07 0.00 -1.61 0.00 0.00 0.00 175.10 173.76 2c5h s GLU 196 N 2.18 3.57 -1.12 2.72 0.41 -0.76 -4.94 118.70 120.75 2c5h s GLU 196 Ca 0.27 -0.54 -0.15 0.00 -0.41 0.00 0.00 54.97 54.14 2c5h s GLU 196 Cb -0.16 -3.10 -0.07 0.00 -1.78 0.00 0.00 34.13 29.03 2c5h s GLU 196 CO 0.09 -0.06 2.18 1.04 -0.49 0.00 0.00 175.26 178.03 2c5h n GLN 197 N 4.46 2.30 -2.72 1.61 6.02 -1.26 -1.90 117.38 125.89 2c5h n GLN 197 Ca -0.17 -2.06 -0.42 0.00 -0.01 0.00 0.00 57.00 54.34 2c5h n GLN 197 Cb 0.52 -2.94 -0.03 0.00 1.02 0.00 0.00 30.24 28.80 2c5h n GLN 197 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 2c5h s ASP 198 N 3.80 6.29 0.12 1.08 2.15 -1.24 -4.85 116.67 124.02 2c5h s ASP 198 Ca 0.52 -0.40 0.00 0.00 0.43 0.00 0.00 52.55 53.10 2c5h s ASP 198 Cb 0.14 -2.49 0.00 0.00 -0.30 0.00 0.00 42.92 40.27 2c5h s ASP 198 CO 0.00 -1.46 0.00 0.61 -0.17 0.00 0.00 175.17 174.15 2c5h n GLY 199 N 5.21 -0.20 0.23 2.66 0.00 -1.26 -3.13 105.19 108.70 2c5h n GLY 199 Ca 0.02 -1.05 0.12 0.00 0.00 0.00 0.00 46.02 45.12 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 -7.29 1.61 4.39 -1.95 -3.47 114.58 107.87 2c5h h GLU 200 Ca 0.00 0.00 -0.46 0.00 0.34 0.00 0.00 59.36 59.24 2c5h h GLU 200 Cb 0.00 0.00 0.17 0.00 -0.10 0.00 0.00 28.75 28.82 2c5h h GLU 200 CO 0.00 0.11 0.17 0.00 -1.16 0.00 0.00 179.01 178.13 2c5h s ALA 201 N -3.47 0.86 -0.16 3.43 0.00 -1.19 -4.67 121.76 116.57 2c5h s ALA 201 Ca 0.03 -0.14 -0.03 0.00 0.00 0.00 0.00 51.96 51.83 2c5h s ALA 201 Cb 0.08 -3.20 0.05 0.00 0.00 0.00 0.00 23.12 20.06 2c5h s ALA 201 CO 0.62 -2.90 0.04 -0.51 0.00 0.00 0.00 175.76 173.01 2c5h s LEU 202 N -6.56 0.90 -0.13 0.00 1.43 0.12 -3.70 118.68 110.74 2c5h s LEU 202 Ca 0.65 -0.60 -0.22 0.00 -1.03 0.00 0.00 54.13 52.94 2c5h s LEU 202 Cb -0.20 -0.50 -0.03 0.00 0.03 0.00 0.00 46.19 45.49 2c5h s LEU 202 CO 0.59 -0.28 0.64 -0.69 0.23 0.00 0.00 176.35 176.83 2c5h s VAL 203 N 1.93 5.05 0.00 -1.59 1.01 -0.80 -1.96 120.40 124.04 2c5h s VAL 203 Ca 0.01 1.26 0.00 0.00 0.00 0.00 0.00 61.98 63.25 2c5h s VAL 203 Cb -0.16 -3.97 0.00 0.00 0.00 0.00 0.00 36.38 32.26 2c5h s VAL 203 CO -0.07 0.20 0.00 0.61 0.00 0.00 0.00 175.10 175.83 2c5h n GLY 204 N 3.43 4.95 3.24 4.51 0.00 0.86 -1.83 105.19 120.35 2c5h n GLY 204 Ca -0.02 -0.73 -0.13 0.00 0.00 0.00 0.00 46.02 45.14 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 1.01 0.06 -0.40 1.61 0.11 -1.26 -1.24 120.40 120.29 2c5h s VAL 205 Ca 0.00 -0.47 -0.28 0.00 -2.93 0.00 0.00 61.98 58.30 2c5h s VAL 205 Cb 0.00 -0.62 -0.01 0.00 -1.53 0.00 0.00 36.38 34.22 2c5h s VAL 205 CO 0.00 -0.26 1.64 -0.69 -3.33 0.00 0.00 175.10 172.46 2c5h s VAL 206 N -1.34 3.64 -0.04 2.04 1.01 0.90 -2.07 120.40 124.54 2c5h s VAL 206 Ca -0.13 0.62 0.13 0.00 0.00 0.00 0.00 61.98 62.60 2c5h s VAL 206 Cb -0.05 -3.92 0.00 0.00 0.00 0.00 0.00 36.38 32.41 2c5h s VAL 206 CO 0.04 -0.63 1.45 0.77 0.00 0.00 0.00 175.10 176.73 2c5h h SER 207 N 12.17 0.00 -4.69 3.32 4.64 -0.49 0.98 113.55 129.48 2c5h h SER 207 Ca -0.30 0.00 0.09 0.00 -0.47 0.00 0.00 61.79 61.11 2c5h h SER 207 Cb 1.14 0.00 -0.15 0.00 -0.31 0.00 0.00 62.40 63.08 2c5h h SER 207 CO 1.08 0.61 0.46 0.00 -0.87 0.00 0.00 176.83 178.10 2c5h s ALA 208 N -3.00 -1.79 -0.19 5.18 0.00 -1.01 -4.86 121.76 116.09 2c5h s ALA 208 Ca 0.03 0.94 -0.12 0.00 0.00 0.00 0.00 51.96 52.81 2c5h s ALA 208 Cb 0.09 0.48 -0.05 0.00 0.00 0.00 0.00 23.12 23.64 2c5h s ALA 208 CO 0.76 -0.70 0.20 0.42 0.00 0.00 0.00 175.76 176.44 2c5h s ILE 209 N -3.21 5.36 -0.83 0.00 -1.09 -1.26 -1.22 121.20 118.95 2c5h s ILE 209 Ca 0.04 0.34 -0.23 0.00 -2.23 0.00 0.00 60.65 58.57 2c5h s ILE 209 Cb -0.01 -3.54 0.07 0.00 -1.58 0.00 0.00 42.46 37.39 2c5h s ILE 209 CO -0.09 0.40 1.21 -0.62 -1.23 0.00 0.00 174.94 174.60 2c5h s ASP 210 N 0.52 6.35 0.32 3.58 2.15 0.57 -4.95 116.67 125.22 2c5h s ASP 210 Ca 0.11 -1.19 -0.20 0.00 0.43 0.00 0.00 52.55 51.70 2c5h s ASP 210 Cb -0.12 -2.49 -0.09 0.00 -0.30 0.00 0.00 42.92 39.91 2c5h s ASP 210 CO 0.01 -1.49 0.83 -1.00 -0.17 0.00 0.00 175.17 173.36 2c5h s HIS 211 N 4.46 3.50 -0.51 -5.34 3.76 -1.26 -1.03 115.29 118.87 2c5h s HIS 211 Ca 0.34 1.48 0.14 0.00 -0.15 0.00 0.00 55.06 56.87 2c5h s HIS 211 Cb -0.08 -2.72 0.75 0.00 1.11 0.00 0.00 32.58 31.64 2c5h s HIS 211 CO 0.02 0.13 1.64 -0.35 -0.85 0.00 0.00 174.74 175.34 2c5h n PRO 212 N 0.06 4.39 -0.01 8.40 -0.04 -1.26 -4.91 135.00 141.62 2c5h n PRO 212 Ca 0.02 -2.88 -0.07 0.00 -0.04 0.00 0.00 63.50 60.53 2c5h n PRO 212 Cb 0.52 -2.13 -0.13 0.00 -0.04 0.00 0.00 33.50 31.72 2c5h n PRO 212 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 2c5h n PHE 213 N 0.70 0.99 -0.54 0.54 3.72 -0.80 -4.97 117.46 117.10 2c5h n PHE 213 Ca 0.26 0.35 0.00 0.00 -0.05 0.00 0.00 57.45 58.01 2c5h n PHE 213 Cb 1.07 -1.17 0.00 0.00 -0.94 0.00 0.00 39.48 38.44 2c5h n PHE 213 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2c5h n GLY 214 N 1.53 0.69 3.74 1.37 0.00 -0.19 -4.00 105.19 108.34 2c5h n GLY 214 Ca -0.16 -0.35 -0.33 0.00 0.00 0.00 0.00 46.02 45.19 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 -2.31 4.44 -0.18 1.61 0.01 -1.21 -0.62 114.94 116.67 2c5h s ASN 215 Ca 0.00 2.09 -0.03 0.00 -0.71 0.00 0.00 52.86 54.21 2c5h s ASN 215 Cb 0.00 -2.56 -0.01 0.00 0.41 0.00 0.00 41.25 39.09 2c5h s ASN 215 CO 0.00 -2.09 -0.06 -0.69 -1.51 0.00 0.00 177.10 172.75 2c5h s VAL 216 N -2.40 3.43 -0.14 1.60 1.01 0.21 -0.31 120.40 123.81 2c5h s VAL 216 Ca 0.68 -0.50 -0.02 0.00 0.00 0.00 0.00 61.98 62.14 2c5h s VAL 216 Cb -0.22 -2.52 -0.02 0.00 0.00 0.00 0.00 36.38 33.61 2c5h s VAL 216 CO 0.48 0.46 -0.07 0.26 0.00 0.00 0.00 175.10 176.23 2c5h s TRP 217 N 0.95 2.95 0.22 5.22 0.51 -0.35 -0.63 118.94 127.81 2c5h s TRP 217 Ca -0.01 -0.36 0.06 0.00 -2.12 0.00 0.00 56.10 53.68 2c5h s TRP 217 Cb -0.15 -1.90 -0.04 0.00 -0.81 0.00 0.00 33.47 30.58 2c5h s TRP 217 CO 0.00 -0.04 0.19 0.95 -0.51 0.00 0.00 176.95 177.54 2c5h s THR 218 N 0.22 4.54 -1.38 2.01 -4.23 -0.21 0.24 115.64 116.83 2c5h s THR 218 Ca -0.04 -1.26 0.00 0.00 -1.18 0.00 0.00 61.69 59.21 2c5h s THR 218 Cb -0.14 -3.41 0.00 0.00 1.34 0.00 0.00 72.50 70.29 2c5h s THR 218 CO 0.04 -0.27 0.63 -0.46 -0.54 0.00 0.00 174.62 174.02 2c5h n ASN 219 N -0.93 0.57 -4.46 3.99 6.94 -0.88 -4.32 115.26 116.16 2c5h n ASN 219 Ca -0.08 -1.83 -0.43 0.00 -0.02 0.00 0.00 54.58 52.22 2c5h n ASN 219 Cb 0.57 -0.28 -0.03 0.00 -2.36 0.00 0.00 39.78 37.67 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 -1.38 4.37 0.66 1.53 1.01 -1.26 -4.84 121.20 121.29 2c5h s ILE 220 Ca 0.00 -0.63 -0.14 0.00 0.00 0.00 0.00 60.65 59.88 2c5h s ILE 220 Cb 0.00 -4.74 -0.00 0.00 0.01 0.00 0.00 42.46 37.73 2c5h s ILE 220 CO 0.00 -1.51 1.09 -2.28 0.00 0.00 0.00 174.94 172.24 2c5h s HIS 221 N 3.87 2.74 0.18 3.97 2.46 -1.26 0.56 115.29 127.81 2c5h s HIS 221 Ca 0.26 1.53 -0.19 0.00 0.47 0.00 0.00 55.06 57.13 2c5h s HIS 221 Cb -0.13 -3.09 0.13 0.00 -0.13 0.00 0.00 32.58 29.36 2c5h s HIS 221 CO 0.05 -1.53 1.61 0.07 -2.47 0.00 0.00 174.74 172.46 2c5h h ARG 222 N -0.09 -0.14 -0.80 2.88 0.11 -1.49 -1.49 114.38 113.36 2c5h h ARG 222 Ca -0.46 0.01 0.18 0.00 0.10 0.00 0.00 59.98 59.81 2c5h h ARG 222 Cb 1.24 0.03 -0.11 0.00 1.11 0.00 0.00 29.97 32.23 2c5h h ARG 222 CO 0.55 -0.09 0.28 1.79 0.10 0.00 0.00 179.97 182.60 2c5h h THR 223 N -0.14 0.53 -0.39 0.08 1.35 -1.93 1.86 112.91 114.26 2c5h h THR 223 Ca 0.23 -0.12 0.06 0.00 -0.55 0.00 0.00 66.41 66.03 2c5h h THR 223 Cb 0.51 0.14 -0.02 0.00 -1.73 0.00 0.00 68.15 67.05 2c5h h THR 223 CO -0.60 0.07 0.27 0.44 -0.25 0.00 0.00 175.52 175.44 2c5h h ASP 224 N 0.36 0.23 0.01 5.36 5.19 -1.66 -2.99 116.42 122.91 2c5h h ASP 224 Ca 0.47 0.00 -0.02 0.00 -0.62 0.00 0.00 57.03 56.86 2c5h h ASP 224 Cb 0.81 -0.05 0.00 0.00 0.18 0.00 0.00 39.33 40.27 2c5h h ASP 224 CO -0.49 0.15 -0.09 -0.07 -3.12 0.00 0.00 179.24 175.61 2c5h h LEU 225 N 0.26 0.06 0.00 1.55 3.38 0.33 -3.26 115.31 117.63 2c5h h LEU 225 Ca 0.18 -0.90 0.00 0.00 0.09 0.00 0.00 57.88 57.24 2c5h h LEU 225 Cb 0.36 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.09 2c5h h LEU 225 CO -0.03 0.96 0.00 -1.84 0.09 0.00 0.00 178.44 177.62 2c5h n GLU 226 N -4.59 0.47 0.00 1.13 0.28 0.13 -1.21 120.64 116.85 2c5h n GLU 226 Ca -0.10 0.00 0.03 0.00 -0.16 0.00 0.00 57.16 56.93 2c5h n GLU 226 Cb 0.48 -1.43 0.01 0.00 1.43 0.00 0.00 31.44 31.93 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 -0.93 1.45 -0.02 3.44 2.85 -1.15 -4.10 118.16 119.71 2c5h n LYS 227 Ca 0.10 -0.61 0.12 0.00 -1.05 0.00 0.00 58.31 56.87 2c5h n LYS 227 Cb 0.04 -1.01 0.11 0.00 -0.65 0.00 0.00 35.03 33.52 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 -0.09 2.46 0.00 0.58 0.00 -0.35 -4.98 120.51 118.12 2c5h n ALA 228 Ca 0.03 -0.71 0.00 0.00 0.00 0.00 0.00 53.44 52.75 2c5h n ALA 228 Cb 0.13 -0.81 0.00 0.00 0.00 0.00 0.00 19.45 18.77 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 2.97 1.43 0.00 0.00 -0.97 -4.92 105.19 105.05 2c5h n GLY 229 Ca 0.14 -0.79 -0.26 0.00 0.00 0.00 0.00 46.02 45.11 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 -4.21 -0.61 5.41 -1.05 -4.65 119.36 114.24 2c5h n ILE 230 Ca 0.00 0.00 -0.18 0.00 1.00 0.00 0.00 62.75 63.57 2c5h n ILE 230 Cb 0.00 -0.20 -0.06 0.00 -0.71 0.00 0.00 39.64 38.67 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 2.04 2.59 3.46 7.39 0.00 -1.26 -3.46 105.19 115.95 2c5h n GLY 231 Ca 0.15 -1.80 -0.44 0.00 0.00 0.00 0.00 46.02 43.93 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 -0.20 0.00 1.61 4.01 -1.26 -2.40 117.16 118.29 2c5h n TYR 232 Ca 0.05 0.73 0.00 0.00 -0.16 0.00 0.00 57.90 58.52 2c5h n TYR 232 Cb 0.62 -2.03 0.00 0.00 -0.31 0.00 0.00 39.34 37.62 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 1.75 2.98 3.75 2.72 0.00 0.30 -4.96 105.19 111.73 2c5h n GLY 233 Ca 0.13 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 -2.52 3.59 -0.21 4.61 0.00 -1.01 -4.55 121.76 121.67 2c5h s ALA 234 Ca 0.00 1.30 -0.27 0.00 0.00 0.00 0.00 51.96 52.99 2c5h s ALA 234 Cb 0.00 -3.54 -0.00 0.00 0.00 0.00 0.00 23.12 19.58 2c5h s ALA 234 CO 0.00 -0.71 0.94 1.03 0.00 0.00 0.00 175.76 177.02 2c5h s ARG 235 N -0.67 4.26 0.00 0.00 0.52 -1.26 0.02 118.95 121.82 2c5h s ARG 235 Ca 0.57 1.19 0.07 0.00 -0.52 0.00 0.00 55.73 57.03 2c5h s ARG 235 Cb -0.41 -3.62 -0.03 0.00 0.52 0.00 0.00 34.95 31.41 2c5h s ARG 235 CO 0.45 -0.51 -0.20 -0.51 0.02 0.00 0.00 175.30 174.55 2c5h s LEU 236 N 2.78 2.44 -0.26 2.53 1.43 0.01 -4.47 118.68 123.13 2c5h s LEU 236 Ca 0.41 -0.40 -0.10 0.00 -1.03 0.00 0.00 54.13 53.00 2c5h s LEU 236 Cb -0.16 -1.45 -0.05 0.00 0.03 0.00 0.00 46.19 44.57 2c5h s LEU 236 CO 0.09 0.29 0.16 -0.60 0.23 0.00 0.00 176.35 176.52 2c5h s ARG 237 N -1.03 3.92 -0.08 1.70 3.52 -1.16 -2.20 118.95 123.62 2c5h s ARG 237 Ca 0.12 -0.34 0.05 0.00 -0.13 0.00 0.00 55.73 55.43 2c5h s ARG 237 Cb -0.10 -3.57 -0.01 0.00 -1.56 0.00 0.00 34.95 29.71 2c5h s ARG 237 CO 0.02 -0.12 -0.24 -1.17 -0.81 0.00 0.00 175.30 172.98 2c5h s LEU 238 N 1.56 2.12 -0.27 -0.88 2.96 0.71 -3.30 118.68 121.58 2c5h s LEU 238 Ca 0.07 -0.52 -0.01 0.00 -0.22 0.00 0.00 54.13 53.46 2c5h s LEU 238 Cb -0.15 -1.40 0.08 0.00 0.50 0.00 0.00 46.19 45.22 2c5h s LEU 238 CO 0.08 0.21 0.05 -0.89 -1.32 0.00 0.00 176.35 174.48 2c5h s THR 239 N 0.05 1.04 0.22 3.68 2.01 -1.12 0.01 115.64 121.53 2c5h s THR 239 Ca -0.10 -1.23 -0.11 0.00 0.31 0.00 0.00 61.69 60.57 2c5h s THR 239 Cb -0.15 -1.62 -0.07 0.00 0.01 0.00 0.00 72.50 70.66 2c5h s THR 239 CO 0.06 -0.43 0.56 -0.76 -0.69 0.00 0.00 174.62 173.36 2c5h s LEU 240 N 1.57 4.18 0.00 4.42 1.43 -0.74 -3.58 118.68 125.97 2c5h s LEU 240 Ca 0.04 0.97 0.00 0.00 -1.03 0.00 0.00 54.13 54.10 2c5h s LEU 240 Cb -0.18 -3.65 0.00 0.00 0.03 0.00 0.00 46.19 42.39 2c5h s LEU 240 CO -0.16 -0.06 0.00 -0.67 0.23 0.00 0.00 176.35 175.70 2c5h n ASP 241 N -0.02 -0.21 0.00 2.29 2.03 -0.90 -1.87 116.55 117.87 2c5h n ASP 241 Ca -0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 2c5h n ASP 241 Cb 0.52 -1.80 0.00 0.00 -0.72 0.00 0.00 41.12 39.13 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 -1.93 3.15 0.00 0.27 0.00 -1.26 -4.79 105.19 100.63 2c5h n GLY 242 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2c5h n GLY 242 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2c5h n VAL 243 N -1.78 0.00 -2.54 1.61 0.24 -0.92 -4.91 118.33 110.03 2c5h n VAL 243 Ca 0.00 0.00 -0.41 0.00 -2.04 0.00 0.00 64.34 61.89 2c5h n VAL 243 Cb 0.00 -0.36 -0.03 0.00 -1.47 0.00 0.00 33.84 31.98 2c5h n VAL 243 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 2c5h s LEU 244 N -3.50 3.37 0.98 1.34 1.43 -0.78 -4.97 118.68 116.55 2c5h s LEU 244 Ca 0.00 -1.06 -0.16 0.00 -1.03 0.00 0.00 54.13 51.88 2c5h s LEU 244 Cb 0.00 -2.57 0.20 0.00 0.03 0.00 0.00 46.19 43.85 2c5h s LEU 244 CO 0.00 -1.66 1.27 -2.84 0.23 0.00 0.00 176.35 173.35 2c5h s PRO 245 N 5.31 0.53 -0.28 1.29 0.02 -1.26 -1.80 135.00 138.81 2c5h s PRO 245 Ca 0.43 -0.28 -0.18 0.00 0.02 0.00 0.00 61.00 60.99 2c5h s PRO 245 Cb -0.03 -1.82 0.10 0.00 0.02 0.00 0.00 34.50 32.76 2c5h s PRO 245 CO -0.01 -2.51 0.78 -0.06 -0.33 0.00 0.00 177.00 174.88 2c5h s PHE 246 N -3.71 -0.87 -0.06 6.54 0.08 0.10 -4.89 117.98 115.18 2c5h s PHE 246 Ca 0.72 1.81 0.03 0.00 0.12 0.00 0.00 56.93 59.60 2c5h s PHE 246 Cb -0.06 0.50 0.01 0.00 -0.57 0.00 0.00 43.02 42.90 2c5h s PHE 246 CO 0.53 -0.43 -0.13 -1.21 -0.10 0.00 0.00 175.22 173.88 2c5h s GLU 247 N 1.29 1.62 -0.15 0.44 2.02 -1.26 -0.21 118.70 122.46 2c5h s GLU 247 Ca -0.07 -0.43 -0.30 0.00 0.02 0.00 0.00 54.97 54.18 2c5h s GLU 247 Cb -0.05 -1.37 0.13 0.00 0.10 0.00 0.00 34.13 32.95 2c5h s GLU 247 CO -0.15 0.07 1.03 0.00 0.02 0.00 0.00 175.26 176.24 2c5h s ALA 248 N 0.50 -1.95 0.42 5.21 0.00 -0.94 -4.95 121.76 120.06 2c5h s ALA 248 Ca -0.11 1.52 -0.20 0.00 0.00 0.00 0.00 51.96 53.17 2c5h s ALA 248 Cb -0.14 -0.55 -0.11 0.00 0.00 0.00 0.00 23.12 22.32 2c5h s ALA 248 CO 0.03 -0.39 0.93 -1.25 0.00 0.00 0.00 175.76 175.08 2c5h s PRO 249 N -1.56 4.20 -0.08 0.00 0.04 -1.26 -0.81 135.00 135.54 2c5h s PRO 249 Ca 0.01 1.07 -0.30 0.00 0.04 0.00 0.00 61.00 61.83 2c5h s PRO 249 Cb -0.01 -2.21 -0.04 0.00 0.04 0.00 0.00 34.50 32.28 2c5h s PRO 249 CO -0.02 -0.01 1.48 -1.17 0.04 0.00 0.00 177.00 177.32 2c5h s LEU 250 N -3.17 4.28 0.18 -3.56 2.96 0.10 -3.96 118.68 115.50 2c5h s LEU 250 Ca 0.61 2.05 0.04 0.00 -0.22 0.00 0.00 54.13 56.61 2c5h s LEU 250 Cb -0.09 -3.54 -0.05 0.00 0.50 0.00 0.00 46.19 43.01 2c5h s LEU 250 CO 0.14 -0.83 -0.07 0.42 -1.32 0.00 0.00 176.35 174.68 2c5h s THR 251 N 3.54 1.17 0.30 3.68 -4.23 0.13 -0.54 115.64 119.69 2c5h s THR 251 Ca 0.66 -2.06 -0.02 0.00 -1.18 0.00 0.00 61.69 59.09 2c5h s THR 251 Cb -0.29 -2.04 0.26 0.00 1.34 0.00 0.00 72.50 71.77 2c5h s THR 251 CO 0.24 -0.59 1.97 -0.65 -0.54 0.00 0.00 174.62 175.06 2c5h h PRO 252 N 2.65 1.07 0.00 3.99 0.11 -1.95 -3.36 132.00 134.52 2c5h h PRO 252 Ca -0.37 -0.06 -0.10 0.00 0.11 0.00 0.00 66.00 65.58 2c5h h PRO 252 Cb 1.20 -0.24 -0.02 0.00 0.11 0.00 0.00 31.00 32.05 2c5h h PRO 252 CO 0.64 0.71 -0.08 -2.37 -0.21 0.00 0.00 178.00 176.69 2c5h n THR 253 N -4.41 0.00 -0.01 -1.15 5.66 -1.26 -4.63 114.28 108.48 2c5h n THR 253 Ca 0.09 -0.53 -0.09 0.00 -3.05 0.00 0.00 64.05 60.47 2c5h n THR 253 Cb 0.03 0.29 -0.07 0.00 -1.55 0.00 0.00 70.33 69.03 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 1.26 -0.10 0.00 1.09 0.04 -1.97 -3.29 116.94 113.98 2c5h h PHE 254 Ca -0.06 -0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.70 2c5h h PHE 254 Cb 0.30 0.03 0.00 0.00 2.20 0.00 0.00 35.95 38.48 2c5h h PHE 254 CO 0.00 0.37 0.29 0.00 -0.60 0.00 0.00 178.31 178.37 2c5h h ALA 255 N -0.45 1.26 0.00 2.45 0.00 -1.96 0.18 119.26 120.75 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 0.51 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.30 2c5h h ALA 255 CO 0.02 -0.26 0.00 -0.44 0.00 0.00 0.00 179.25 178.57 2c5h h ASP 256 N 0.00 0.00 1.11 0.00 3.32 -1.99 -1.93 116.42 116.93 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 0.59 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.14 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 2.14 1.00 0.00 3.45 0.00 -0.85 -3.49 119.26 121.51 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 0.22 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.01 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 0.33 0.86 3.79 0.00 0.00 -0.73 -4.77 105.19 104.67 2c5h n GLY 258 Ca 0.02 -1.09 -0.31 0.00 0.00 0.00 0.00 46.02 44.64 2c5h n GLY 258 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2c5h s GLU 259 N 0.00 2.67 0.29 1.61 -1.05 -1.26 -4.91 118.70 116.06 2c5h s GLU 259 Ca 0.00 1.10 -0.30 0.00 -0.15 0.00 0.00 54.97 55.63 2c5h s GLU 259 Cb 0.00 -1.95 -0.12 0.00 -0.44 0.00 0.00 34.13 31.62 2c5h s GLU 259 CO 0.00 -1.32 1.47 -0.89 0.95 0.00 0.00 175.26 175.48 2c5h n ILE 260 N -3.14 1.27 0.00 1.83 5.41 -1.26 -2.30 119.36 121.18 2c5h n ILE 260 Ca 0.09 -0.32 0.00 0.00 1.00 0.00 0.00 62.75 63.52 2c5h n ILE 260 Cb 0.53 -1.74 0.00 0.00 -0.71 0.00 0.00 39.64 37.72 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 1.74 2.98 3.48 7.39 0.00 0.88 -4.96 105.19 116.70 2c5h n GLY 261 Ca 0.08 -0.46 -0.41 0.00 0.00 0.00 0.00 46.02 45.23 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 0.48 -0.65 -4.72 1.61 4.13 -0.97 -4.30 115.26 110.83 2c5h n ASN 262 Ca 0.00 0.88 -0.41 0.00 1.68 0.00 0.00 54.58 56.72 2c5h n ASN 262 Cb 0.00 -1.16 -0.04 0.00 -1.54 0.00 0.00 39.78 37.04 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 -1.52 4.16 -0.17 2.41 -1.09 -1.26 0.23 121.20 123.96 2c5h s ILE 263 Ca 0.65 1.68 -0.01 0.00 -2.23 0.00 0.00 60.65 60.75 2c5h s ILE 263 Cb -0.55 -4.08 -0.00 0.00 -1.58 0.00 0.00 42.46 36.25 2c5h s ILE 263 CO 0.57 0.21 -0.13 0.00 -1.23 0.00 0.00 174.94 174.35 2c5h s ALA 264 N 0.43 2.56 -0.21 9.38 0.00 -0.07 -4.67 121.76 129.19 2c5h s ALA 264 Ca 0.53 -1.06 -0.13 0.00 0.00 0.00 0.00 51.96 51.29 2c5h s ALA 264 Cb -0.27 -1.31 -0.05 0.00 0.00 0.00 0.00 23.12 21.49 2c5h s ALA 264 CO 0.31 -0.10 0.26 0.42 0.00 0.00 0.00 175.76 176.65 2c5h s ILE 265 N 0.93 5.30 0.25 0.00 1.01 -1.25 -2.18 121.20 125.25 2c5h s ILE 265 Ca -0.03 0.43 -0.14 0.00 0.00 0.00 0.00 60.65 60.91 2c5h s ILE 265 Cb -0.15 -3.60 0.00 0.00 0.01 0.00 0.00 42.46 38.72 2c5h s ILE 265 CO -0.01 0.33 0.51 -0.72 0.00 0.00 0.00 174.94 175.06 2c5h s TYR 266 N 0.93 0.26 -0.23 3.97 -0.85 -0.65 0.22 117.35 121.00 2c5h s TYR 266 Ca 0.13 -0.63 -0.15 0.00 -0.52 0.00 0.00 57.07 55.89 2c5h s TYR 266 Cb -0.13 0.28 -0.04 0.00 0.38 0.00 0.00 41.96 42.44 2c5h s TYR 266 CO 0.05 -1.02 0.39 -0.51 -1.52 0.00 0.00 175.55 172.93 2c5h s LEU 267 N -3.00 4.11 1.23 -3.49 1.43 -1.26 0.04 118.68 117.75 2c5h s LEU 267 Ca 0.20 0.42 -0.18 0.00 -1.03 0.00 0.00 54.13 53.55 2c5h s LEU 267 Cb -0.01 -2.48 0.30 0.00 0.03 0.00 0.00 46.19 44.03 2c5h s LEU 267 CO 0.08 -0.12 1.03 0.54 0.23 0.00 0.00 176.35 178.11 2c5h s ASN 268 N 1.27 0.53 0.00 2.29 2.20 0.22 -4.82 114.94 116.63 2c5h s ASN 268 Ca 0.17 1.01 0.11 0.00 -0.94 0.00 0.00 52.86 53.22 2c5h s ASN 268 Cb -0.15 -1.51 0.68 0.00 -2.00 0.00 0.00 41.25 38.27 2c5h s ASN 268 CO 0.08 -4.41 1.13 -1.54 -2.94 0.00 0.00 177.10 169.43 2c5h n SER 269 N -5.00 0.00 -0.35 3.54 3.41 -1.26 -1.47 113.62 112.49 2c5h n SER 269 Ca 0.09 -0.71 0.05 0.00 -0.26 0.00 0.00 58.87 58.04 2c5h n SER 269 Cb 0.58 0.00 0.03 0.00 -0.26 0.00 0.00 64.21 64.56 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 -0.84 1.06 0.00 4.33 5.12 -1.26 -4.04 116.66 121.03 2c5h n ARG 270 Ca 0.09 -0.93 0.00 0.00 -1.93 0.00 0.00 57.85 55.08 2c5h n ARG 270 Cb 0.04 -1.15 0.00 0.00 -1.16 0.00 0.00 32.46 30.19 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 0.70 0.57 3.89 -0.13 0.00 -0.54 -4.31 105.19 105.37 2c5h n GLY 271 Ca 0.05 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.75 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 -2.00 3.52 0.17 1.61 2.02 -1.25 -1.16 117.35 120.26 2c5h s TYR 272 Ca 0.00 0.55 -0.32 0.00 -0.37 0.00 0.00 57.07 56.94 2c5h s TYR 272 Cb 0.00 -1.99 -0.10 0.00 -0.40 0.00 0.00 41.96 39.47 2c5h s TYR 272 CO 0.00 0.52 1.59 -1.17 -1.57 0.00 0.00 175.55 174.91 2c5h s LEU 273 N -2.28 4.37 0.13 -1.29 2.96 0.19 0.72 118.68 123.48 2c5h s LEU 273 Ca 0.35 2.64 -0.03 0.00 -0.22 0.00 0.00 54.13 56.87 2c5h s LEU 273 Cb -0.13 -3.59 -0.03 0.00 0.50 0.00 0.00 46.19 42.94 2c5h s LEU 273 CO 0.22 -0.84 0.10 -0.44 -1.32 0.00 0.00 176.35 174.07 2c5h s SER 274 N 1.19 0.26 0.00 3.68 0.01 0.11 -1.04 113.70 117.91 2c5h s SER 274 Ca 0.71 -1.08 -0.07 0.00 1.31 0.00 0.00 55.95 56.81 2c5h s SER 274 Cb -0.44 0.32 0.00 0.00 0.21 0.00 0.00 66.02 66.11 2c5h s SER 274 CO 0.31 -0.75 0.14 -0.51 0.41 0.00 0.00 173.24 172.84 2c5h s ILE 275 N -4.01 0.08 0.15 1.44 2.07 0.20 -1.63 121.20 119.50 2c5h s ILE 275 Ca 0.20 -0.67 -0.21 0.00 -1.41 0.00 0.00 60.65 58.56 2c5h s ILE 275 Cb 0.06 -0.43 0.07 0.00 0.13 0.00 0.00 42.46 42.30 2c5h s ILE 275 CO -0.01 -0.37 0.98 0.00 -1.91 0.00 0.00 174.94 173.63 2c5h n ALA 276 N 1.50 -2.58 -2.48 1.50 0.00 -0.93 0.68 120.51 118.20 2c5h n ALA 276 Ca -0.22 -0.92 -0.31 0.00 0.00 0.00 0.00 53.44 51.98 2c5h n ALA 276 Cb 0.56 0.48 -0.12 0.00 0.00 0.00 0.00 19.45 20.37 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 -2.04 2.27 -0.23 0.00 0.52 -1.24 -0.89 118.95 117.34 2c5h s ARG 277 Ca 0.22 -0.86 -0.29 0.00 -0.52 0.00 0.00 55.73 54.28 2c5h s ARG 277 Cb -0.02 -2.29 -0.04 0.00 0.52 0.00 0.00 34.95 33.12 2c5h s ARG 277 CO 0.04 0.57 1.92 1.21 0.02 0.00 0.00 175.30 179.07 2c5h s ASN 278 N -1.23 5.91 -1.44 0.23 2.47 0.14 -2.97 114.94 118.04 2c5h s ASN 278 Ca 0.14 1.72 -0.05 0.00 0.42 0.00 0.00 52.86 55.09 2c5h s ASN 278 Cb -0.11 -2.52 0.04 0.00 -1.45 0.00 0.00 41.25 37.21 2c5h s ASN 278 CO 0.04 -1.62 0.63 0.00 -3.72 0.00 0.00 177.10 172.43 2c5h n ALA 279 N 10.06 -1.79 -3.50 1.71 0.00 -1.26 -0.08 120.51 125.65 2c5h n ALA 279 Ca 0.24 -0.13 -0.11 0.00 0.00 0.00 0.00 53.44 53.44 2c5h n ALA 279 Cb 0.45 -2.36 -0.03 0.00 0.00 0.00 0.00 19.45 17.51 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 -3.69 -1.79 -0.06 0.00 0.00 -1.16 -4.53 121.76 110.53 2c5h s ALA 280 Ca 0.21 1.06 -0.23 0.00 0.00 0.00 0.00 51.96 53.01 2c5h s ALA 280 Cb -0.11 0.24 -0.04 0.00 0.00 0.00 0.00 23.12 23.21 2c5h s ALA 280 CO 0.87 -0.59 0.68 0.45 0.00 0.00 0.00 175.76 177.17 2c5h s SER 281 N -2.10 6.98 -0.15 0.00 0.15 -1.26 -3.68 113.70 113.65 2c5h s SER 281 Ca 0.01 1.18 -0.16 0.00 0.70 0.00 0.00 55.95 57.68 2c5h s SER 281 Cb -0.01 -2.40 -0.23 0.00 -1.71 0.00 0.00 66.02 61.67 2c5h s SER 281 CO -0.05 -0.08 0.35 0.25 1.20 0.00 0.00 173.24 174.91 2c5h h LEU 282 N 6.59 0.22 -0.29 3.45 5.85 -1.73 -3.41 115.31 125.99 2c5h h LEU 282 Ca -0.42 -0.74 -0.20 0.00 0.84 0.00 0.00 57.88 57.36 2c5h h LEU 282 Cb 1.20 -0.07 -0.00 0.00 0.37 0.00 0.00 40.66 42.15 2c5h h LEU 282 CO 0.75 1.64 -0.83 0.00 -0.34 0.00 0.00 178.44 179.65 2c5h h ALA 283 N -0.20 0.48 0.15 1.25 0.00 -1.17 -3.36 119.26 116.40 2c5h h ALA 283 Ca -0.36 -0.65 -0.01 0.00 0.00 0.00 0.00 54.91 53.89 2c5h h ALA 283 Cb 1.64 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.39 2c5h h ALA 283 CO -0.05 0.79 -0.07 1.88 0.00 0.00 0.00 179.25 181.80 2c5h h TYR 284 N 0.27 -0.18 -0.77 0.00 0.05 -1.79 0.16 116.97 114.71 2c5h h TYR 284 Ca -0.05 -0.00 0.11 0.00 0.05 0.00 0.00 58.73 58.84 2c5h h TYR 284 Cb 1.43 0.06 -0.05 0.00 1.01 0.00 0.00 36.73 39.18 2c5h h TYR 284 CO 0.05 0.27 0.50 -1.35 -1.05 0.00 0.00 178.16 176.59 2c5h h PRO 285 N -0.84 0.59 -0.70 4.88 0.11 -1.80 -2.25 132.00 131.99 2c5h h PRO 285 Ca -0.02 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.05 2c5h h PRO 285 Cb 0.54 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 31.51 2c5h h PRO 285 CO 0.03 0.39 0.00 0.66 -0.21 0.00 0.00 178.00 178.87 2c5h n TYR 286 N -4.50 1.04 -3.92 0.65 4.01 -1.20 -4.97 117.16 108.28 2c5h n TYR 286 Ca 0.13 -0.52 -0.28 0.00 -0.16 0.00 0.00 57.90 57.08 2c5h n TYR 286 Cb 0.39 -0.04 0.01 0.00 -0.31 0.00 0.00 39.34 39.39 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 1.51 -1.96 -2.72 -0.72 8.25 0.35 -4.91 115.22 115.01 2c5h n HIS 287 Ca 0.24 0.84 -0.40 0.00 -0.26 0.00 0.00 57.72 58.14 2c5h n HIS 287 Cb 0.66 -3.87 -0.06 0.00 1.12 0.00 0.00 29.99 27.84 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 -7.05 4.61 0.02 2.41 1.43 0.03 -5.03 118.68 115.09 2c5h s LEU 288 Ca 0.35 1.95 0.01 0.00 -1.03 0.00 0.00 54.13 55.41 2c5h s LEU 288 Cb -0.18 -3.61 -0.01 0.00 0.03 0.00 0.00 46.19 42.42 2c5h s LEU 288 CO 0.85 0.09 -0.05 -0.54 0.23 0.00 0.00 176.35 176.93 2c5h s LYS 289 N -0.96 0.38 0.20 1.70 -0.14 -1.26 -4.78 119.74 114.88 2c5h s LYS 289 Ca 0.43 -0.45 -0.31 0.00 -1.36 0.00 0.00 55.97 54.27 2c5h s LYS 289 Cb -0.26 -0.22 -0.16 0.00 -1.68 0.00 0.00 37.83 35.51 2c5h s LYS 289 CO 0.32 0.05 1.01 -0.85 -0.76 0.00 0.00 175.35 175.12 2c5h n GLU 290 N 2.17 0.95 0.00 1.68 0.28 -1.26 -3.26 120.64 121.20 2c5h n GLU 290 Ca -0.18 0.34 0.00 0.00 -0.16 0.00 0.00 57.16 57.15 2c5h n GLU 290 Cb 0.57 -1.72 0.00 0.00 1.43 0.00 0.00 31.44 31.72 2c5h n GLU 290 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2c5h n GLY 291 N 1.77 2.18 3.76 -1.84 0.00 0.34 -4.96 105.19 106.44 2c5h n GLY 291 Ca 0.14 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.79 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 -0.37 3.48 0.72 1.61 -1.94 -1.20 -4.68 119.30 116.92 2c5h s MET 292 Ca 0.00 1.94 -0.16 0.00 -1.71 0.00 0.00 55.69 55.76 2c5h s MET 292 Cb 0.00 -2.32 0.01 0.00 2.01 0.00 0.00 34.83 34.53 2c5h s MET 292 CO 0.00 -0.83 0.98 -1.13 -0.01 0.00 0.00 175.02 174.03 2c5h n SER 293 N -0.77 0.51 -3.76 3.03 3.41 -1.26 -0.07 113.62 114.72 2c5h n SER 293 Ca 0.09 0.66 -0.12 0.00 -0.26 0.00 0.00 58.87 59.24 2c5h n SER 293 Cb 0.47 -1.41 -0.12 0.00 -0.26 0.00 0.00 64.21 62.89 2c5h n SER 293 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2c5h s ALA 294 N -1.82 -0.67 -0.03 7.33 0.00 -0.37 -2.12 121.76 124.08 2c5h s ALA 294 Ca 0.73 0.89 -0.05 0.00 0.00 0.00 0.00 51.96 53.54 2c5h s ALA 294 Cb -0.34 -0.54 0.01 0.00 0.00 0.00 0.00 23.12 22.25 2c5h s ALA 294 CO 0.50 -0.16 0.12 0.50 0.00 0.00 0.00 175.76 176.72 2c5h s ARG 295 N 0.58 0.25 0.02 0.00 3.52 -1.23 0.30 118.95 122.38 2c5h s ARG 295 Ca -0.04 -0.01 -0.02 0.00 -0.13 0.00 0.00 55.73 55.53 2c5h s ARG 295 Cb -0.05 0.11 -0.02 0.00 -1.56 0.00 0.00 34.95 33.43 2c5h s ARG 295 CO -0.03 -0.04 0.01 0.54 -0.81 0.00 0.00 175.30 174.96 2c5h s VAL 296 N -0.39 0.12 0.07 7.11 0.11 -0.83 -2.79 120.40 123.80 2c5h s VAL 296 Ca -0.05 -1.00 -0.27 0.00 -2.93 0.00 0.00 61.98 57.73 2c5h s VAL 296 Cb -0.03 -0.50 0.09 0.00 -1.53 0.00 0.00 36.38 34.40 2c5h s VAL 296 CO 0.00 -0.55 0.92 -1.83 -3.33 0.00 0.00 175.10 170.31 2c5h s GLU 297 N -1.86 0.98 0.00 1.54 -1.05 -1.21 0.16 118.70 117.27 2c5h s GLU 297 Ca -0.12 -0.46 0.31 0.00 -0.15 0.00 0.00 54.97 54.55 2c5h s GLU 297 Cb -0.07 0.39 1.63 0.00 -0.44 0.00 0.00 34.13 35.64 2c5h s GLU 297 CO -0.02 -0.44 2.07 0.00 0.95 0.00 0.00 175.26 177.82