#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bro s PHE 2 N 0.00 0.54 -0.12 6.00 0.08 -1.26 -0.70 117.98 122.52 1bro s PHE 2 Ca 0.00 -0.53 0.01 0.00 0.12 0.00 0.00 56.93 56.52 1bro s PHE 2 Cb 0.00 -0.34 0.02 0.00 -0.57 0.00 0.00 43.02 42.13 1bro s PHE 2 CO 0.00 -0.13 -0.12 0.42 -0.10 0.00 0.00 175.22 175.29 1bro s ILE 3 N -1.53 1.37 -0.05 0.64 1.01 -0.52 -4.91 121.20 117.21 1bro s ILE 3 Ca -0.11 -0.53 -0.30 0.00 0.00 0.00 0.00 60.65 59.72 1bro s ILE 3 Cb -0.09 -1.30 -0.02 0.00 0.01 0.00 0.00 42.46 41.05 1bro s ILE 3 CO -0.00 0.42 1.03 -0.89 0.00 0.00 0.00 174.94 175.50 1bro s THR 4 N 1.39 4.72 -0.58 2.92 2.01 -1.26 0.10 115.64 124.94 1bro s THR 4 Ca 0.01 1.97 0.07 0.00 0.31 0.00 0.00 61.69 64.05 1bro s THR 4 Cb -0.13 -4.27 -0.01 0.00 0.01 0.00 0.00 72.50 68.10 1bro s THR 4 CO -0.07 0.06 0.48 1.33 -0.69 0.00 0.00 174.62 175.73 1bro n VAL 5 N 4.29 0.00 -3.00 3.82 0.24 0.03 -4.96 118.33 118.75 1bro n VAL 5 Ca 0.08 -0.42 0.00 0.00 -2.04 0.00 0.00 64.34 61.96 1bro n VAL 5 Cb 0.49 1.07 0.00 0.00 -1.47 0.00 0.00 33.84 33.93 1bro n VAL 5 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1bro n GLY 6 N 0.82 -0.55 3.00 7.63 0.00 -1.11 -4.94 105.19 110.05 1bro n GLY 6 Ca 0.03 -0.79 -0.12 0.00 0.00 0.00 0.00 46.02 45.13 1bro n GLY 6 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1bro s GLN 7 N -0.92 0.40 -0.22 1.61 -1.52 -1.26 -0.79 119.66 116.96 1bro s GLN 7 Ca 0.00 -0.54 -0.04 0.00 -1.95 0.00 0.00 55.36 52.83 1bro s GLN 7 Cb 0.00 -0.19 0.08 0.00 -0.22 0.00 0.00 33.01 32.69 1bro s GLN 7 CO 0.00 0.03 0.14 -2.00 -0.25 0.00 0.00 175.29 173.21 1bro s GLU 8 N -1.13 0.15 5.83 2.91 2.12 0.35 -4.85 118.70 124.08 1bro s GLU 8 Ca -0.08 -0.18 0.00 0.00 0.36 0.00 0.00 54.97 55.06 1bro s GLU 8 Cb -0.08 -1.42 0.00 0.00 0.26 0.00 0.00 34.13 32.90 1bro s GLU 8 CO -0.00 -0.81 0.00 0.09 -0.54 0.00 0.00 175.26 174.00 1bro n ASN 9 N 5.28 0.00 0.00 -1.70 3.02 -1.26 -1.18 115.26 119.42 1bro n ASN 9 Ca -0.06 0.00 0.11 0.00 -0.03 0.00 0.00 54.58 54.60 1bro n ASN 9 Cb 0.47 0.00 0.53 0.00 -0.61 0.00 0.00 39.78 40.17 1bro n ASN 9 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 1bro n SER 10 N 4.37 0.00 -4.63 6.41 3.41 -1.26 -4.86 113.62 117.06 1bro n SER 10 Ca 0.00 0.32 -0.23 0.00 -0.26 0.00 0.00 58.87 58.70 1bro n SER 10 Cb 0.00 -0.43 -0.07 0.00 -0.26 0.00 0.00 64.21 63.44 1bro n SER 10 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 1bro s THR 11 N -2.86 3.39 0.22 6.66 -4.23 -0.32 -5.15 115.64 113.36 1bro s THR 11 Ca 0.15 -1.91 0.05 0.00 -1.18 0.00 0.00 61.69 58.80 1bro s THR 11 Cb 0.16 -2.80 -0.03 0.00 1.34 0.00 0.00 72.50 71.16 1bro s THR 11 CO 0.41 -0.35 0.30 -0.94 -0.54 0.00 0.00 174.62 173.50 1bro s SER 12 N -3.59 6.10 -0.36 3.99 1.04 -1.26 -0.49 113.70 119.12 1bro s SER 12 Ca 0.31 0.00 -0.12 0.00 0.48 0.00 0.00 55.95 56.62 1bro s SER 12 Cb -0.07 -1.74 0.01 0.00 0.10 0.00 0.00 66.02 64.32 1bro s SER 12 CO 0.19 -0.04 0.22 -0.63 0.98 0.00 0.00 173.24 173.97 1bro s ILE 13 N -1.96 4.82 0.05 -1.02 1.01 0.03 -4.76 121.20 119.36 1bro s ILE 13 Ca 0.34 -0.64 0.08 0.00 0.00 0.00 0.00 60.65 60.43 1bro s ILE 13 Cb -0.09 -3.61 -0.03 0.00 0.01 0.00 0.00 42.46 38.74 1bro s ILE 13 CO 0.28 -0.16 -0.23 -1.81 0.00 0.00 0.00 174.94 173.02 1bro s ASP 14 N 1.61 3.46 -0.15 3.58 1.01 -1.26 -0.79 116.67 124.13 1bro s ASP 14 Ca 0.04 -0.53 -0.05 0.00 0.71 0.00 0.00 52.55 52.71 1bro s ASP 14 Cb -0.18 -0.42 -0.04 0.00 1.01 0.00 0.00 42.92 43.29 1bro s ASP 14 CO 0.08 0.25 0.03 -0.76 0.21 0.00 0.00 175.17 174.98 1bro s LEU 15 N -1.39 3.68 0.29 1.23 1.43 0.12 -1.46 118.68 122.57 1bro s LEU 15 Ca 0.13 0.08 -0.29 0.00 -1.03 0.00 0.00 54.13 53.03 1bro s LEU 15 Cb -0.10 -1.90 -0.09 0.00 0.03 0.00 0.00 46.19 44.13 1bro s LEU 15 CO 0.04 0.24 1.04 -0.47 0.23 0.00 0.00 176.35 177.43 1bro s TYR 16 N -0.04 3.64 0.10 0.29 5.04 -1.26 -1.43 117.35 123.69 1bro s TYR 16 Ca 0.05 1.75 -0.09 0.00 -2.44 0.00 0.00 57.07 56.34 1bro s TYR 16 Cb -0.12 -3.17 -0.00 0.00 0.35 0.00 0.00 41.96 39.02 1bro s TYR 16 CO 0.01 -0.27 0.21 1.52 -1.34 0.00 0.00 175.55 175.69 1bro s TYR 17 N -1.27 0.18 0.07 4.97 1.13 0.13 -1.85 117.35 120.71 1bro s TYR 17 Ca 0.46 -0.60 0.08 0.00 -1.41 0.00 0.00 57.07 55.60 1bro s TYR 17 Cb -0.28 -0.05 -0.03 0.00 -1.10 0.00 0.00 41.96 40.50 1bro s TYR 17 CO 0.36 -0.58 -0.21 -1.21 -2.51 0.00 0.00 175.55 171.40 1bro s GLU 18 N -3.88 1.28 -0.26 -3.49 2.02 -0.50 -3.76 118.70 110.12 1bro s GLU 18 Ca 0.07 -1.04 -0.03 0.00 0.02 0.00 0.00 54.97 53.99 1bro s GLU 18 Cb 0.05 -1.47 0.11 0.00 0.10 0.00 0.00 34.13 32.92 1bro s GLU 18 CO -0.09 0.36 0.21 0.34 0.02 0.00 0.00 175.26 176.10 1bro s ASP 19 N -1.49 2.17 0.10 -0.19 -1.08 -1.26 -2.49 116.67 112.43 1bro s ASP 19 Ca 0.07 -0.75 0.07 0.00 -0.52 0.00 0.00 52.55 51.42 1bro s ASP 19 Cb -0.09 0.17 -0.03 0.00 -1.46 0.00 0.00 42.92 41.51 1bro s ASP 19 CO 0.03 -0.38 -0.17 -1.00 0.52 0.00 0.00 175.17 174.17 1bro s HIS 20 N 2.26 1.49 0.01 -5.34 3.76 -0.62 -5.00 115.29 111.86 1bro s HIS 20 Ca 0.08 -0.46 0.00 0.00 -0.15 0.00 0.00 55.06 54.53 1bro s HIS 20 Cb -0.15 -0.81 0.00 0.00 1.11 0.00 0.00 32.58 32.73 1bro s HIS 20 CO -0.27 0.14 0.00 0.41 -0.85 0.00 0.00 174.74 174.18 1bro n GLY 21 N 1.02 -2.08 3.02 -2.22 0.00 -1.26 0.21 105.19 103.88 1bro n GLY 21 Ca -0.19 -1.43 -0.11 0.00 0.00 0.00 0.00 46.02 44.29 1bro n GLY 21 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1bro s THR 22 N -0.44 0.33 -2.57 2.61 -4.23 -1.26 -4.69 115.64 105.40 1bro s THR 22 Ca 0.00 -1.00 0.00 0.00 -1.18 0.00 0.00 61.69 59.51 1bro s THR 22 Cb 0.00 -0.44 0.00 0.00 1.34 0.00 0.00 72.50 73.40 1bro s THR 22 CO 0.00 -0.44 0.00 0.61 -0.54 0.00 0.00 174.62 174.25 1bro n GLY 23 N 1.53 0.86 3.71 3.99 0.00 -1.26 -3.39 105.19 110.63 1bro n GLY 23 Ca -0.23 -2.13 -0.43 0.00 0.00 0.00 0.00 46.02 43.23 1bro n GLY 23 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1bro n GLN 24 N -1.09 2.32 -2.65 1.61 7.27 -1.26 -3.67 117.38 119.90 1bro n GLN 24 Ca 0.00 0.82 -0.42 0.00 0.07 0.00 0.00 57.00 57.47 1bro n GLN 24 Cb 0.00 -2.50 -0.03 0.00 2.41 0.00 0.00 30.24 30.12 1bro n GLN 24 CO 0.00 0.00 0.00 -1.25 0.07 0.00 0.00 177.06 175.88 1bro s PRO 25 N -1.06 4.48 -0.22 3.69 0.04 -1.26 -1.07 135.00 139.61 1bro s PRO 25 Ca 0.62 1.46 0.01 0.00 0.04 0.00 0.00 61.00 63.13 1bro s PRO 25 Cb -0.56 -3.49 0.03 0.00 0.04 0.00 0.00 34.50 30.52 1bro s PRO 25 CO 0.55 -0.19 -0.14 0.08 0.04 0.00 0.00 177.00 177.34 1bro s VAL 26 N 1.45 2.34 -0.24 -0.36 1.01 0.29 -1.43 120.40 123.46 1bro s VAL 26 Ca 0.52 -1.12 -0.11 0.00 0.00 0.00 0.00 61.98 61.27 1bro s VAL 26 Cb -0.21 -2.14 -0.05 0.00 0.00 0.00 0.00 36.38 33.98 1bro s VAL 26 CO 0.24 0.31 0.19 -0.69 0.00 0.00 0.00 175.10 175.15 1bro s VAL 27 N 1.26 5.34 -0.24 2.92 1.01 0.23 -1.63 120.40 129.28 1bro s VAL 27 Ca 0.00 0.23 -0.08 0.00 0.00 0.00 0.00 61.98 62.13 1bro s VAL 27 Cb -0.16 -3.53 -0.04 0.00 0.00 0.00 0.00 36.38 32.66 1bro s VAL 27 CO -0.09 0.33 0.10 -0.76 0.00 0.00 0.00 175.10 174.68 1bro s LEU 28 N 1.15 3.70 -0.37 3.92 1.43 0.07 0.08 118.68 128.66 1bro s LEU 28 Ca 0.09 -0.08 -0.03 0.00 -1.03 0.00 0.00 54.13 53.08 1bro s LEU 28 Cb -0.14 -1.99 0.08 0.00 0.03 0.00 0.00 46.19 44.18 1bro s LEU 28 CO 0.05 0.01 0.14 -0.63 0.23 0.00 0.00 176.35 176.15 1bro s ILE 29 N 1.33 3.29 1.08 -0.59 1.01 0.17 -3.98 121.20 123.51 1bro s ILE 29 Ca 0.06 -1.73 -0.12 0.00 0.00 0.00 0.00 60.65 58.85 1bro s ILE 29 Cb -0.15 -3.10 0.23 0.00 0.01 0.00 0.00 42.46 39.46 1bro s ILE 29 CO 0.05 -0.46 1.06 -1.38 0.00 0.00 0.00 174.94 174.21 1bro s HIS 30 N 1.21 1.72 0.53 3.97 -3.43 -1.26 -0.38 115.29 117.65 1bro s HIS 30 Ca 0.03 1.12 0.08 0.00 -0.80 0.00 0.00 55.06 55.48 1bro s HIS 30 Cb -0.22 -3.18 0.05 0.00 -1.43 0.00 0.00 32.58 27.81 1bro s HIS 30 CO -0.02 -3.38 0.58 0.20 -2.00 0.00 0.00 174.74 170.12 1bro s GLY 31 N -2.96 2.03 0.32 -1.38 0.00 -1.20 -2.93 107.32 101.20 1bro s GLY 31 Ca 0.67 -1.75 -0.22 0.00 0.00 0.00 0.00 44.72 43.42 1bro s GLY 31 CO 0.61 -1.77 0.86 -0.12 0.00 0.00 0.00 173.10 172.68 1bro s PHE 32 N -2.66 3.54 -0.64 1.90 2.19 -1.26 -1.79 117.98 119.27 1bro s PHE 32 Ca 0.49 1.56 0.01 0.00 0.33 0.00 0.00 56.93 59.32 1bro s PHE 32 Cb -0.04 -2.77 0.41 0.00 -1.31 0.00 0.00 43.02 39.30 1bro s PHE 32 CO 0.31 0.15 1.72 -0.35 1.83 0.00 0.00 175.22 178.88 1bro n PRO 33 N 0.19 3.00 0.00 10.12 -0.04 -1.26 -5.01 135.00 142.00 1bro n PRO 33 Ca 0.02 -3.76 0.00 0.00 -0.04 0.00 0.00 63.50 59.72 1bro n PRO 33 Cb 0.52 -2.27 0.00 0.00 -0.04 0.00 0.00 33.50 31.70 1bro n PRO 33 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1bro n LEU 34 N -0.65 0.00 -3.90 1.53 4.77 -0.74 -3.70 117.00 114.31 1bro n LEU 34 Ca 0.52 0.00 -0.10 0.00 -0.03 0.00 0.00 56.01 56.39 1bro n LEU 34 Cb 0.54 0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 41.63 1bro n LEU 34 CO 0.53 0.00 0.40 -0.94 -1.33 0.00 0.00 177.39 176.05 1bro s SER 35 N -1.00 0.27 0.40 -1.43 1.04 -1.26 -3.95 113.70 107.77 1bro s SER 35 Ca 0.00 -1.21 0.12 0.00 0.48 0.00 0.00 55.95 55.33 1bro s SER 35 Cb 0.00 0.78 0.94 0.00 0.10 0.00 0.00 66.02 67.84 1bro s SER 35 CO 0.00 -1.54 1.94 1.23 0.98 0.00 0.00 173.24 175.86 1bro h GLY 36 N 2.04 0.78 1.78 7.32 0.00 -1.94 -2.42 103.07 110.64 1bro h GLY 36 Ca -0.30 -0.22 0.03 0.00 0.00 0.00 0.00 47.33 46.84 1bro h GLY 36 CO 0.39 0.12 0.08 0.45 0.00 0.00 0.00 176.54 177.58 1bro h HIS 37 N 0.53 0.00 0.00 5.60 3.86 -1.96 -2.81 115.15 120.37 1bro h HIS 37 Ca 0.33 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.54 1bro h HIS 37 Cb 0.58 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.05 1bro h HIS 37 CO -0.00 0.00 0.12 0.66 0.86 0.00 0.00 177.93 179.57 1bro h SER 38 N 0.00 0.00 -0.10 2.45 4.64 -1.85 -1.41 113.55 117.28 1bro h SER 38 Ca 0.05 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.37 1bro h SER 38 Cb 0.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.30 1bro h SER 38 CO -0.00 0.00 0.00 0.79 -0.87 0.00 0.00 176.83 176.75 1bro n TRP 39 N -2.93 0.12 -0.36 4.77 7.02 -1.06 -4.61 117.44 120.39 1bro n TRP 39 Ca -0.02 -0.06 0.29 0.00 -1.02 0.00 0.00 57.50 56.69 1bro n TRP 39 Cb 0.18 0.00 0.59 0.00 -2.42 0.00 0.00 31.31 29.66 1bro n TRP 39 CO 0.00 0.00 0.00 1.05 -2.02 0.00 0.00 177.69 176.72 1bro h GLU 40 N 1.75 0.23 -0.31 -0.99 4.11 -1.48 0.21 114.58 118.10 1bro h GLU 40 Ca 0.00 -0.01 -0.10 0.00 0.07 0.00 0.00 59.36 59.31 1bro h GLU 40 Cb 0.38 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.56 1bro h GLU 40 CO 0.00 0.15 -0.23 0.00 0.07 0.00 0.00 179.01 179.00 1bro h ARG 41 N 0.24 0.61 0.08 1.06 3.08 -1.88 -1.94 114.38 115.63 1bro h ARG 41 Ca 0.65 -0.23 -0.19 0.00 0.07 0.00 0.00 59.98 60.27 1bro h ARG 41 Cb 1.94 -0.03 0.02 0.00 0.08 0.00 0.00 29.97 31.98 1bro h ARG 41 CO -0.26 0.79 -0.81 1.96 -1.07 0.00 0.00 179.97 180.58 1bro h GLN 42 N 0.54 0.41 -0.43 0.04 7.50 -1.00 -3.14 115.11 119.03 1bro h GLN 42 Ca 0.08 -0.55 0.02 0.00 0.50 0.00 0.00 58.65 58.70 1bro h GLN 42 Cb 0.69 0.18 -0.03 0.00 0.05 0.00 0.00 27.48 28.37 1bro h GLN 42 CO 0.05 1.21 0.25 0.77 -1.50 0.00 0.00 178.83 179.61 1bro h SER 43 N -0.13 0.39 -0.76 1.46 0.02 -0.95 0.12 113.55 113.70 1bro h SER 43 Ca -0.12 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.84 1bro h SER 43 Cb 1.56 -0.08 -0.04 0.00 0.14 0.00 0.00 62.40 63.99 1bro h SER 43 CO 0.16 0.28 0.49 0.00 -1.14 0.00 0.00 176.83 176.62 1bro h ALA 44 N 1.20 0.96 -0.48 3.77 0.00 -1.46 0.16 119.26 123.41 1bro h ALA 44 Ca 0.17 -0.06 -0.09 0.00 0.00 0.00 0.00 54.91 54.93 1bro h ALA 44 Cb 0.02 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.49 1bro h ALA 44 CO -0.09 0.39 -0.05 0.00 0.00 0.00 0.00 179.25 179.50 1bro h ALA 45 N 1.27 1.01 -0.20 0.00 0.00 -1.38 -0.86 119.26 119.10 1bro h ALA 45 Ca 0.28 -0.30 -0.13 0.00 0.00 0.00 0.00 54.91 54.75 1bro h ALA 45 Cb -0.09 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.51 1bro h ALA 45 CO -0.06 0.60 -0.40 -0.07 0.00 0.00 0.00 179.25 179.32 1bro h LEU 46 N 0.76 0.70 -0.54 0.00 3.38 -0.78 -2.40 115.31 116.43 1bro h LEU 46 Ca 0.14 -0.55 -0.09 0.00 0.09 0.00 0.00 57.88 57.47 1bro h LEU 46 Cb 0.54 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.07 1bro h LEU 46 CO 0.03 1.12 -0.01 -0.07 0.09 0.00 0.00 178.44 179.59 1bro h LEU 47 N 0.30 0.95 -2.05 1.67 3.38 -0.90 -2.29 115.31 116.37 1bro h LEU 47 Ca 0.01 -0.31 -0.00 0.00 0.09 0.00 0.00 57.88 57.66 1bro h LEU 47 Cb 1.00 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 41.50 1bro h LEU 47 CO 0.09 1.03 -0.00 0.44 0.09 0.00 0.00 178.44 180.09 1bro h ASP 48 N 0.84 0.00 -0.33 -0.43 3.32 -1.08 -2.54 116.42 116.21 1bro h ASP 48 Ca 0.15 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.20 1bro h ASP 48 Cb 0.55 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.10 1bro h ASP 48 CO 0.03 0.00 0.00 0.00 -1.72 0.00 0.00 179.24 177.55 1bro n ALA 49 N -2.52 2.45 -2.21 3.45 0.00 -0.91 -5.00 120.51 115.78 1bro n ALA 49 Ca -0.03 -0.82 0.00 0.00 0.00 0.00 0.00 53.44 52.59 1bro n ALA 49 Cb 0.09 -0.96 0.00 0.00 0.00 0.00 0.00 19.45 18.58 1bro n ALA 49 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1bro n GLY 50 N 1.35 0.74 3.89 0.00 0.00 -0.96 -5.06 105.19 105.16 1bro n GLY 50 Ca 0.18 -0.74 -0.23 0.00 0.00 0.00 0.00 46.02 45.23 1bro n GLY 50 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1bro s TYR 51 N -2.57 3.28 -0.17 1.61 2.02 -0.89 -4.23 117.35 116.41 1bro s TYR 51 Ca 0.00 -0.03 -0.17 0.00 -0.37 0.00 0.00 57.07 56.50 1bro s TYR 51 Cb 0.00 -1.51 -0.04 0.00 -0.40 0.00 0.00 41.96 40.01 1bro s TYR 51 CO 0.00 0.49 0.42 0.50 -1.57 0.00 0.00 175.55 175.40 1bro s ARG 52 N -3.68 4.24 -0.19 -0.62 3.52 -0.23 -4.02 118.95 117.97 1bro s ARG 52 Ca 0.33 0.29 -0.04 0.00 -0.13 0.00 0.00 55.73 56.18 1bro s ARG 52 Cb -0.09 -3.50 -0.02 0.00 -1.56 0.00 0.00 34.95 29.78 1bro s ARG 52 CO 0.27 0.04 -0.03 0.08 -0.81 0.00 0.00 175.30 174.85 1bro s VAL 53 N 1.04 3.72 -0.17 7.11 1.01 0.13 -0.55 120.40 132.70 1bro s VAL 53 Ca 0.21 -0.40 0.01 0.00 0.00 0.00 0.00 61.98 61.81 1bro s VAL 53 Cb -0.15 -2.66 0.01 0.00 0.00 0.00 0.00 36.38 33.58 1bro s VAL 53 CO 0.08 0.45 -0.19 -0.63 0.00 0.00 0.00 175.10 174.81 1bro s ILE 54 N 0.93 2.18 0.10 2.22 1.01 -0.65 -1.58 121.20 125.41 1bro s ILE 54 Ca 0.00 -0.92 0.09 0.00 0.00 0.00 0.00 60.65 59.82 1bro s ILE 54 Cb -0.14 -1.90 -0.03 0.00 0.01 0.00 0.00 42.46 40.39 1bro s ILE 54 CO 0.01 0.54 -0.22 0.42 0.00 0.00 0.00 174.94 175.69 1bro s THR 55 N 1.09 1.80 0.07 2.92 -4.23 -1.04 -0.75 115.64 115.51 1bro s THR 55 Ca -0.00 -1.55 -0.08 0.00 -1.18 0.00 0.00 61.69 58.88 1bro s THR 55 Cb -0.14 -1.62 -0.00 0.00 1.34 0.00 0.00 72.50 72.07 1bro s THR 55 CO -0.08 -0.01 0.17 -0.72 -0.54 0.00 0.00 174.62 173.45 1bro s TYR 56 N -1.11 0.15 -0.27 3.99 1.13 -1.26 -1.42 117.35 118.56 1bro s TYR 56 Ca 0.08 -0.52 -0.14 0.00 -1.41 0.00 0.00 57.07 55.08 1bro s TYR 56 Cb -0.10 -0.07 -0.04 0.00 -1.10 0.00 0.00 41.96 40.65 1bro s TYR 56 CO 0.04 -0.49 0.34 -0.51 -2.51 0.00 0.00 175.55 172.42 1bro s ASP 57 N -2.60 6.21 0.66 -0.18 1.01 -0.77 -3.95 116.67 117.04 1bro s ASP 57 Ca 0.02 0.21 -0.18 0.00 0.71 0.00 0.00 52.55 53.32 1bro s ASP 57 Cb 0.03 -2.20 -0.01 0.00 1.01 0.00 0.00 42.92 41.75 1bro s ASP 57 CO -0.09 -0.17 1.18 -1.14 0.21 0.00 0.00 175.17 175.16 1bro n ARG 58 N 5.29 0.94 -1.57 8.23 0.63 -1.26 -4.34 116.66 124.58 1bro n ARG 58 Ca -0.09 0.38 -0.50 0.00 -0.92 0.00 0.00 57.85 56.71 1bro n ARG 58 Cb 0.51 -2.41 -0.05 0.00 0.45 0.00 0.00 32.46 30.96 1bro n ARG 58 CO 0.00 0.00 0.00 2.89 -2.51 0.00 0.00 177.63 178.01 1bro n ARG 59 N -1.80 1.04 -0.56 -0.14 1.85 -1.26 -2.05 116.66 113.74 1bro n ARG 59 Ca 0.15 0.37 0.00 0.00 -1.00 0.00 0.00 57.85 57.37 1bro n ARG 59 Cb 0.48 -1.89 0.00 0.00 -1.05 0.00 0.00 32.46 30.00 1bro n ARG 59 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1bro n GLY 60 N 2.11 0.78 3.21 2.89 0.00 0.16 -4.99 105.19 109.34 1bro n GLY 60 Ca 0.16 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 46.00 1bro n GLY 60 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1bro s PHE 61 N -3.08 1.31 0.00 1.61 0.08 -0.87 -0.60 117.98 116.44 1bro s PHE 61 Ca 0.00 -0.51 0.00 0.00 0.12 0.00 0.00 56.93 56.54 1bro s PHE 61 Cb 0.00 -0.71 0.00 0.00 -0.57 0.00 0.00 43.02 41.74 1bro s PHE 61 CO 0.00 0.10 0.00 0.41 -0.10 0.00 0.00 175.22 175.63 1bro n GLY 62 N 0.89 3.58 0.79 4.36 0.00 -1.25 -1.00 105.19 112.56 1bro n GLY 62 Ca -0.18 0.09 0.11 0.00 0.00 0.00 0.00 46.02 46.04 1bro n GLY 62 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1bro n GLN 63 N 14.00 2.04 -1.69 1.61 6.02 -1.26 -4.59 117.38 133.51 1bro n GLN 63 Ca 0.00 -1.57 -0.29 0.00 -0.01 0.00 0.00 57.00 55.13 1bro n GLN 63 Cb 0.00 -1.44 0.10 0.00 1.02 0.00 0.00 30.24 29.92 1bro n GLN 63 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 177.06 174.93 1bro s SER 64 N -1.55 4.35 0.76 1.08 0.01 -0.17 -4.45 113.70 113.73 1bro s SER 64 Ca 0.34 1.03 -0.15 0.00 1.31 0.00 0.00 55.95 58.49 1bro s SER 64 Cb 0.19 -1.66 0.04 0.00 0.21 0.00 0.00 66.02 64.80 1bro s SER 64 CO 0.28 -2.03 1.07 -1.20 0.41 0.00 0.00 173.24 171.77 1bro n SER 65 N -3.44 0.73 -3.40 2.44 7.64 -0.53 -4.55 113.62 112.52 1bro n SER 65 Ca 0.07 0.63 -0.27 0.00 1.01 0.00 0.00 58.87 60.31 1bro n SER 65 Cb 0.59 -1.45 -0.08 0.00 -1.01 0.00 0.00 64.21 62.25 1bro n SER 65 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1bro n GLN 66 N -2.48 2.37 -1.43 1.43 6.02 -1.26 0.39 117.38 122.42 1bro n GLN 66 Ca 0.13 -4.54 -0.30 0.00 -0.01 0.00 0.00 57.00 52.29 1bro n GLN 66 Cb 0.50 -2.16 0.11 0.00 1.02 0.00 0.00 30.24 29.71 1bro n GLN 66 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 177.06 174.80 1bro s PRO 67 N -2.37 1.63 -0.33 -1.09 0.04 -1.26 -4.95 135.00 126.67 1bro s PRO 67 Ca 0.40 0.64 0.09 0.00 0.04 0.00 0.00 61.00 62.16 1bro s PRO 67 Cb 0.15 -1.87 0.59 0.00 0.04 0.00 0.00 34.50 33.42 1bro s PRO 67 CO -0.02 -1.94 1.64 0.25 0.04 0.00 0.00 177.00 176.97 1bro n THR 68 N -3.65 2.76 -3.94 1.26 -2.24 -1.26 -4.58 114.28 102.63 1bro n THR 68 Ca 0.07 -2.26 -0.09 0.00 -2.27 0.00 0.00 64.05 59.50 1bro n THR 68 Cb 0.56 -0.36 -0.09 0.00 -2.10 0.00 0.00 70.33 68.35 1bro n THR 68 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1bro s THR 69 N -3.18 0.15 -0.12 4.28 -4.23 -1.26 -4.96 115.64 106.33 1bro s THR 69 Ca 0.49 -1.26 -0.00 0.00 -1.18 0.00 0.00 61.69 59.75 1bro s THR 69 Cb 0.42 -1.14 0.00 0.00 1.34 0.00 0.00 72.50 73.13 1bro s THR 69 CO 0.06 -0.69 0.00 0.61 -0.54 0.00 0.00 174.62 174.06 1bro n GLY 70 N 0.41 0.34 3.46 3.99 0.00 -1.26 -5.00 105.19 107.13 1bro n GLY 70 Ca -0.17 -0.82 -0.44 0.00 0.00 0.00 0.00 46.02 44.59 1bro n GLY 70 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1bro s TYR 71 N -2.12 3.46 -0.06 1.61 2.02 -1.26 -4.37 117.35 116.63 1bro s TYR 71 Ca 0.00 -2.03 -0.29 0.00 -0.37 0.00 0.00 57.07 54.38 1bro s TYR 71 Cb -0.00 -4.29 0.10 0.00 -0.40 0.00 0.00 41.96 37.37 1bro s TYR 71 CO 0.00 -1.40 0.88 0.16 -1.57 0.00 0.00 175.55 173.62 1bro s ASP 72 N 2.92 -0.43 0.51 2.29 1.47 -1.26 -4.82 116.67 117.35 1bro s ASP 72 Ca 0.41 0.28 0.17 0.00 1.18 0.00 0.00 52.55 54.59 1bro s ASP 72 Cb -0.03 0.39 1.26 0.00 -0.34 0.00 0.00 42.92 44.20 1bro s ASP 72 CO -0.02 -0.53 2.12 1.88 0.68 0.00 0.00 175.17 179.31 1bro h TYR 73 N 2.39 0.00 -0.27 2.11 0.05 -1.91 0.03 116.97 119.36 1bro h TYR 73 Ca -0.22 0.00 -0.09 0.00 0.05 0.00 0.00 58.73 58.47 1bro h TYR 73 Cb 1.20 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.93 1bro h TYR 73 CO 0.29 0.04 -0.16 -0.44 -1.05 0.00 0.00 178.16 176.84 1bro h ASP 74 N 0.00 0.62 -0.36 3.88 3.32 -1.97 -0.84 116.42 121.07 1bro h ASP 74 Ca -0.00 -0.42 -0.05 0.00 0.02 0.00 0.00 57.03 56.57 1bro h ASP 74 Cb 0.08 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 39.44 1bro h ASP 74 CO 0.01 0.91 0.02 0.74 -1.72 0.00 0.00 179.24 179.19 1bro h THR 75 N 0.33 1.25 -0.99 0.35 2.02 -1.65 -2.33 112.91 111.89 1bro h THR 75 Ca 0.06 -0.94 0.06 0.00 0.77 0.00 0.00 66.41 66.36 1bro h THR 75 Cb 0.69 1.16 -0.07 0.00 -1.74 0.00 0.00 68.15 68.20 1bro h THR 75 CO 0.05 0.31 0.64 -0.26 0.37 0.00 0.00 175.52 176.63 1bro h PHE 76 N 0.44 1.19 -0.40 3.16 0.04 -1.01 -0.30 116.94 120.07 1bro h PHE 76 Ca 0.10 0.03 -0.11 0.00 2.80 0.00 0.00 57.97 60.80 1bro h PHE 76 Cb 0.43 -0.39 -0.02 0.00 2.20 0.00 0.00 35.95 38.17 1bro h PHE 76 CO 0.03 0.63 -0.18 0.00 -0.60 0.00 0.00 178.31 178.19 1bro h ALA 77 N 1.44 0.92 -0.68 2.45 0.00 -1.07 -1.91 119.26 120.41 1bro h ALA 77 Ca 0.42 -0.35 -0.07 0.00 0.00 0.00 0.00 54.91 54.91 1bro h ALA 77 Cb 0.14 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 1bro h ALA 77 CO -0.17 0.62 0.13 0.00 0.00 0.00 0.00 179.25 179.83 1bro h ALA 78 N 1.11 0.95 -0.02 0.00 0.00 -0.80 0.34 119.26 120.85 1bro h ALA 78 Ca 0.10 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.75 1bro h ALA 78 Cb 0.68 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 18.21 1bro h ALA 78 CO 0.05 0.66 0.01 -0.44 0.00 0.00 0.00 179.25 179.54 1bro h ASP 79 N 1.04 0.02 -0.59 0.00 3.32 -0.96 -0.88 116.42 118.37 1bro h ASP 79 Ca 0.21 -0.02 -0.02 0.00 0.02 0.00 0.00 57.03 57.22 1bro h ASP 79 Cb 0.41 -0.01 -0.03 0.00 0.22 0.00 0.00 39.33 39.93 1bro h ASP 79 CO 0.01 0.04 0.30 0.25 -1.72 0.00 0.00 179.24 178.12 1bro h LEU 80 N 0.01 0.76 -0.54 1.55 5.85 -0.94 -2.23 115.31 119.77 1bro h LEU 80 Ca 0.01 -0.11 0.08 0.00 0.84 0.00 0.00 57.88 58.70 1bro h LEU 80 Cb 0.02 -0.19 -0.07 0.00 0.37 0.00 0.00 40.66 40.79 1bro h LEU 80 CO -0.00 0.66 0.16 -1.13 -0.34 0.00 0.00 178.44 177.79 1bro h ASN 81 N 0.81 0.12 -0.49 1.25 -0.73 -0.04 -1.80 115.58 114.69 1bro h ASN 81 Ca 0.21 0.08 0.05 0.00 1.87 0.00 0.00 56.30 58.50 1bro h ASN 81 Cb 0.08 0.08 -0.05 0.00 0.27 0.00 0.00 38.32 38.71 1bro h ASN 81 CO -0.03 0.09 0.24 0.74 -0.37 0.00 0.00 177.43 178.10 1bro h THR 82 N 0.32 0.94 -0.22 -3.57 2.02 -0.78 0.27 112.91 111.89 1bro h THR 82 Ca 0.27 -0.16 0.00 0.00 0.77 0.00 0.00 66.41 67.29 1bro h THR 82 Cb 0.33 0.43 -0.01 0.00 -1.74 0.00 0.00 68.15 67.16 1bro h THR 82 CO -0.30 0.09 0.14 0.58 0.37 0.00 0.00 175.52 176.40 1bro h VAL 83 N 0.47 1.07 -0.69 3.16 2.07 -0.79 -1.93 116.25 119.60 1bro h VAL 83 Ca 0.22 -0.13 -0.00 0.00 0.82 0.00 0.00 66.70 67.61 1bro h VAL 83 Cb 0.15 0.76 -0.03 0.00 -1.52 0.00 0.00 31.29 30.65 1bro h VAL 83 CO -0.17 0.06 0.43 -0.07 0.02 0.00 0.00 177.57 177.84 1bro h LEU 84 N 0.29 0.82 -0.38 2.57 3.38 -0.75 -0.70 115.31 120.54 1bro h LEU 84 Ca 0.08 -0.05 -0.17 0.00 0.09 0.00 0.00 57.88 57.83 1bro h LEU 84 Cb -0.02 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 40.52 1bro h LEU 84 CO -0.02 0.63 -0.46 -0.33 0.09 0.00 0.00 178.44 178.35 1bro h GLU 85 N 0.93 0.87 -0.18 1.13 4.39 -0.47 0.53 114.58 121.79 1bro h GLU 85 Ca 0.25 -0.50 -0.02 0.00 0.34 0.00 0.00 59.36 59.43 1bro h GLU 85 Cb -0.05 0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 28.63 1bro h GLU 85 CO -0.05 1.14 0.04 1.15 -1.16 0.00 0.00 179.01 180.14 1bro h THR 86 N 0.69 1.21 0.00 1.13 2.02 -1.15 -2.81 112.91 114.00 1bro h THR 86 Ca 0.04 -0.66 0.00 0.00 0.77 0.00 0.00 66.41 66.56 1bro h THR 86 Cb 1.06 1.30 0.00 0.00 -1.74 0.00 0.00 68.15 68.77 1bro h THR 86 CO 0.11 0.20 -0.13 0.18 0.37 0.00 0.00 175.52 176.24 1bro n LEU 87 N -4.79 0.23 -3.77 2.58 4.77 -0.29 -4.98 117.00 110.77 1bro n LEU 87 Ca -0.04 0.39 -0.26 0.00 -0.03 0.00 0.00 56.01 56.07 1bro n LEU 87 Cb 0.17 -0.41 0.02 0.00 -2.33 0.00 0.00 43.42 40.87 1bro n LEU 87 CO 0.36 0.00 -0.13 -0.67 -1.33 0.00 0.00 177.39 175.62 1bro n ASP 88 N -1.62 -2.46 -4.77 -1.43 2.03 0.14 -4.96 116.55 103.48 1bro n ASP 88 Ca 0.06 -0.95 -0.38 0.00 0.52 0.00 0.00 54.79 54.05 1bro n ASP 88 Cb 0.35 -3.51 -0.05 0.00 -0.72 0.00 0.00 41.12 37.19 1bro n ASP 88 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1bro s LEU 89 N -6.67 4.36 -0.01 -2.67 1.43 -0.98 -5.06 118.68 109.09 1bro s LEU 89 Ca 0.18 1.96 0.05 0.00 -1.03 0.00 0.00 54.13 55.29 1bro s LEU 89 Cb -0.06 -3.95 -0.01 0.00 0.03 0.00 0.00 46.19 42.20 1bro s LEU 89 CO 0.85 -0.15 -0.15 -1.10 0.23 0.00 0.00 176.35 176.03 1bro s GLN 90 N -1.96 1.22 -1.59 1.70 -1.52 -1.26 -4.72 119.66 111.53 1bro s GLN 90 Ca 0.50 -0.57 -0.16 0.00 -1.95 0.00 0.00 55.36 53.18 1bro s GLN 90 Cb -0.22 -1.19 0.11 0.00 -0.22 0.00 0.00 33.01 31.49 1bro s GLN 90 CO 0.28 0.32 0.92 -0.25 -0.25 0.00 0.00 175.29 176.32 1bro n ASP 91 N 2.62 -4.39 -4.87 5.90 8.00 -0.57 -4.73 116.55 118.51 1bro n ASP 91 Ca -0.15 -0.85 -0.30 0.00 0.71 0.00 0.00 54.79 54.20 1bro n ASP 91 Cb 0.55 -3.52 -0.02 0.00 -0.02 0.00 0.00 41.12 38.11 1bro n ASP 91 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1bro s ALA 92 N -3.28 3.27 -0.16 2.24 0.00 -0.30 -4.42 121.76 119.10 1bro s ALA 92 Ca 0.70 -0.17 -0.03 0.00 0.00 0.00 0.00 51.96 52.45 1bro s ALA 92 Cb -0.36 -2.82 -0.02 0.00 0.00 0.00 0.00 23.12 19.92 1bro s ALA 92 CO 0.86 -0.22 -0.05 0.08 0.00 0.00 0.00 175.76 176.43 1bro s VAL 93 N -2.61 3.69 -0.24 0.00 1.01 -0.52 0.04 120.40 121.77 1bro s VAL 93 Ca 0.52 -0.42 -0.11 0.00 0.00 0.00 0.00 61.98 61.97 1bro s VAL 93 Cb -0.10 -2.62 -0.05 0.00 0.00 0.00 0.00 36.38 33.61 1bro s VAL 93 CO 0.37 0.48 0.19 -0.76 0.00 0.00 0.00 175.10 175.39 1bro s LEU 94 N 0.55 4.11 -0.28 3.92 1.43 -0.71 -0.60 118.68 127.10 1bro s LEU 94 Ca -0.04 0.15 0.00 0.00 -1.03 0.00 0.00 54.13 53.21 1bro s LEU 94 Cb -0.15 -2.16 0.05 0.00 0.03 0.00 0.00 46.19 43.97 1bro s LEU 94 CO 0.03 0.04 -0.05 -0.69 0.23 0.00 0.00 176.35 175.90 1bro s VAL 95 N 1.14 2.66 0.13 -1.59 1.01 0.11 -1.37 120.40 122.49 1bro s VAL 95 Ca 0.09 -1.42 0.06 0.00 0.00 0.00 0.00 61.98 60.71 1bro s VAL 95 Cb -0.14 -2.51 -0.04 0.00 0.00 0.00 0.00 36.38 33.70 1bro s VAL 95 CO 0.05 -0.02 0.00 -0.83 0.00 0.00 0.00 175.10 174.30 1bro s GLY 96 N 1.21 1.82 -0.08 4.51 0.00 -0.58 -0.66 107.32 113.54 1bro s GLY 96 Ca -0.06 -1.23 0.03 0.00 0.00 0.00 0.00 44.72 43.46 1bro s GLY 96 CO -0.03 -1.22 -0.15 -0.12 0.00 0.00 0.00 173.10 171.58 1bro s PHE 97 N -1.49 1.74 0.00 1.90 5.36 0.49 -1.39 117.98 124.59 1bro s PHE 97 Ca 0.26 -0.69 0.00 0.00 -0.96 0.00 0.00 56.93 55.55 1bro s PHE 97 Cb -0.11 -1.24 0.00 0.00 -0.34 0.00 0.00 43.02 41.33 1bro s PHE 97 CO 0.18 -0.33 0.00 0.45 -1.46 0.00 0.00 175.22 174.06 1bro n SER 98 N 3.81 0.00 -0.32 6.13 2.88 -0.14 -0.03 113.62 125.95 1bro n SER 98 Ca -0.22 0.00 0.15 0.00 -1.33 0.00 0.00 58.87 57.48 1bro n SER 98 Cb 0.52 0.00 0.34 0.00 -0.75 0.00 0.00 64.21 64.32 1bro n SER 98 CO 0.00 0.00 0.00 -0.03 -1.23 0.00 0.00 175.04 173.78 1bro h MET 99 N 0.00 0.43 0.00 -1.46 4.05 -1.83 0.18 114.93 116.30 1bro h MET 99 Ca 0.00 -0.03 0.00 0.00 -0.28 0.00 0.00 59.70 59.39 1bro h MET 99 Cb 0.00 -0.10 0.00 0.00 -0.80 0.00 0.00 31.60 30.70 1bro h MET 99 CO 0.00 0.29 0.00 0.78 0.23 0.00 0.00 176.91 178.21 1bro h GLY 100 N 0.44 0.00 2.00 1.39 0.00 -0.33 -1.94 103.07 104.64 1bro h GLY 100 Ca 0.60 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.92 1bro h GLY 100 CO -0.52 0.00 -0.07 -0.91 0.00 0.00 0.00 176.54 175.04 1bro h THR 101 N 0.00 0.21 0.09 4.70 1.35 -0.77 -2.77 112.91 115.73 1bro h THR 101 Ca 0.00 -0.60 -0.00 0.00 -0.55 0.00 0.00 66.41 65.25 1bro h THR 101 Cb 0.07 1.49 0.00 0.00 -1.73 0.00 0.00 68.15 67.98 1bro h THR 101 CO 0.00 0.07 -0.05 1.23 -0.25 0.00 0.00 175.52 176.52 1bro h GLY 102 N 1.65 -0.13 1.04 5.82 0.00 -1.48 -2.63 103.07 107.33 1bro h GLY 102 Ca -0.00 0.05 -0.03 0.00 0.00 0.00 0.00 47.33 47.34 1bro h GLY 102 CO 0.01 -0.05 0.38 0.83 0.00 0.00 0.00 176.54 177.71 1bro h GLU 103 N -0.40 1.20 0.04 4.80 3.07 -1.62 -2.48 114.58 119.19 1bro h GLU 103 Ca -0.01 -0.19 -0.00 0.00 -0.50 0.00 0.00 59.36 58.66 1bro h GLU 103 Cb 0.34 -0.21 -0.00 0.00 -0.84 0.00 0.00 28.75 28.04 1bro h GLU 103 CO 0.02 0.94 -0.02 0.28 -1.40 0.00 0.00 179.01 178.82 1bro h VAL 104 N 1.18 0.95 -0.28 3.13 2.07 -1.43 0.51 116.25 122.38 1bro h VAL 104 Ca 0.28 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.81 1bro h VAL 104 Cb 0.14 0.95 -0.02 0.00 -1.52 0.00 0.00 31.29 30.84 1bro h VAL 104 CO -0.03 0.00 0.17 0.00 0.02 0.00 0.00 177.57 177.73 1bro h ALA 105 N 0.90 0.35 -0.41 1.67 0.00 -1.41 -2.81 119.26 117.56 1bro h ALA 105 Ca -0.00 -0.01 -0.11 0.00 0.00 0.00 0.00 54.91 54.79 1bro h ALA 105 Cb 0.05 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 1bro h ALA 105 CO 0.00 -0.20 -0.17 -0.09 0.00 0.00 0.00 179.25 178.78 1bro h ARG 106 N 0.35 0.83 0.26 0.00 9.65 -1.44 -1.83 114.38 122.21 1bro h ARG 106 Ca 0.11 -0.36 -0.01 0.00 -1.10 0.00 0.00 59.98 58.63 1bro h ARG 106 Cb -0.01 -0.03 -0.01 0.00 -1.39 0.00 0.00 29.97 28.53 1bro h ARG 106 CO -0.04 0.99 -0.19 -0.92 2.80 0.00 0.00 179.97 182.61 1bro h TYR 107 N 0.65 -0.48 -0.69 2.20 3.20 -0.88 -0.19 116.97 120.77 1bro h TYR 107 Ca 0.09 -0.00 0.07 0.00 3.14 0.00 0.00 58.73 62.03 1bro h TYR 107 Cb 0.73 0.18 -0.06 0.00 1.54 0.00 0.00 36.73 39.11 1bro h TYR 107 CO 0.06 -0.29 0.37 0.28 -1.64 0.00 0.00 178.16 176.94 1bro h VAL 108 N -0.45 0.92 -0.38 1.81 2.07 -1.52 1.23 116.25 119.93 1bro h VAL 108 Ca -0.02 -0.23 -0.16 0.00 0.82 0.00 0.00 66.70 67.11 1bro h VAL 108 Cb 0.39 0.20 -0.01 0.00 -1.52 0.00 0.00 31.29 30.35 1bro h VAL 108 CO 0.01 0.12 -0.39 -1.28 0.02 0.00 0.00 177.57 176.05 1bro h SER 109 N 0.67 1.00 0.15 0.57 0.87 -1.21 0.17 113.55 115.77 1bro h SER 109 Ca 0.32 -0.47 -0.36 0.00 -1.23 0.00 0.00 61.79 60.05 1bro h SER 109 Cb 0.26 -0.28 -0.01 0.00 -0.44 0.00 0.00 62.40 61.93 1bro h SER 109 CO -0.22 1.26 -1.92 0.28 -0.53 0.00 0.00 176.83 175.71 1bro h SER 110 N 0.76 0.48 -0.01 6.23 0.02 -0.78 -3.40 113.55 116.85 1bro h SER 110 Ca 0.06 -0.95 0.00 0.00 -0.84 0.00 0.00 61.79 60.06 1bro h SER 110 Cb 0.98 -0.16 0.00 0.00 0.14 0.00 0.00 62.40 63.37 1bro h SER 110 CO 0.10 1.84 -0.13 -1.22 -1.14 0.00 0.00 176.83 176.27 1bro n TYR 111 N -3.52 0.00 0.00 3.45 4.02 0.42 -5.07 117.16 116.47 1bro n TYR 111 Ca -0.30 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.59 1bro n TYR 111 Cb 1.06 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 40.38 1bro n TYR 111 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1bro n GLY 112 N 0.74 -1.15 1.31 2.72 0.00 0.60 -4.74 105.19 104.67 1bro n GLY 112 Ca 0.04 -1.62 -0.01 0.00 0.00 0.00 0.00 46.02 44.42 1bro n GLY 112 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1bro n THR 113 N -1.37 2.59 -0.11 2.61 -2.24 -1.26 -4.57 114.28 109.92 1bro n THR 113 Ca 0.00 -2.15 0.07 0.00 -2.27 0.00 0.00 64.05 59.70 1bro n THR 113 Cb 0.00 -0.32 0.41 0.00 -2.10 0.00 0.00 70.33 68.32 1bro n THR 113 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1bro h ALA 114 N 1.63 1.78 -0.02 6.98 0.00 -1.98 -2.32 119.26 125.32 1bro h ALA 114 Ca 0.18 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.07 1bro h ALA 114 Cb 1.81 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 19.44 1bro h ALA 114 CO 0.46 0.13 -0.24 0.54 0.00 0.00 0.00 179.25 180.14 1bro n ARG 115 N -4.47 1.47 -4.28 0.00 1.74 -1.26 -4.77 116.66 105.09 1bro n ARG 115 Ca 0.08 -1.10 -0.34 0.00 -0.77 0.00 0.00 57.85 55.72 1bro n ARG 115 Cb 0.21 -1.48 -0.10 0.00 -1.02 0.00 0.00 32.46 30.07 1bro n ARG 115 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1bro s ILE 116 N -2.29 4.31 -0.16 0.55 -1.09 -0.88 -1.15 121.20 120.49 1bro s ILE 116 Ca 0.25 -0.22 0.12 0.00 -2.23 0.00 0.00 60.65 58.56 1bro s ILE 116 Cb 0.19 -2.88 -0.23 0.00 -1.58 0.00 0.00 42.46 37.96 1bro s ILE 116 CO 0.46 0.53 0.21 0.00 -1.23 0.00 0.00 174.94 174.90 1bro n ALA 117 N 3.01 1.43 -3.18 9.38 0.00 0.11 -4.81 120.51 126.45 1bro n ALA 117 Ca -0.18 -1.08 -0.10 0.00 0.00 0.00 0.00 53.44 52.08 1bro n ALA 117 Cb 0.53 -0.39 -0.04 0.00 0.00 0.00 0.00 19.45 19.55 1bro n ALA 117 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1bro s LYS 118 N -2.53 1.22 0.04 0.00 1.02 -1.24 -3.99 119.74 114.26 1bro s LYS 118 Ca -0.14 -0.73 0.04 0.00 0.02 0.00 0.00 55.97 55.16 1bro s LYS 118 Cb 0.07 0.51 -0.02 0.00 -0.52 0.00 0.00 37.83 37.87 1bro s LYS 118 CO 0.79 -0.50 -0.12 0.14 -0.92 0.00 0.00 175.35 174.73 1bro s VAL 119 N -3.82 0.90 -0.03 3.17 -7.23 -0.62 -1.74 120.40 111.03 1bro s VAL 119 Ca 0.05 -0.93 0.01 0.00 -1.81 0.00 0.00 61.98 59.30 1bro s VAL 119 Cb 0.00 -0.84 0.01 0.00 0.56 0.00 0.00 36.38 36.12 1bro s VAL 119 CO -0.09 -0.07 -0.04 0.00 -0.31 0.00 0.00 175.10 174.59 1bro s ALA 120 N -0.89 0.56 -0.28 1.32 0.00 -0.47 -2.29 121.76 119.72 1bro s ALA 120 Ca -0.01 -0.08 -0.00 0.00 0.00 0.00 0.00 51.96 51.87 1bro s ALA 120 Cb -0.08 -0.31 0.05 0.00 0.00 0.00 0.00 23.12 22.79 1bro s ALA 120 CO 0.01 0.03 -0.05 -0.06 0.00 0.00 0.00 175.76 175.69 1bro s PHE 121 N 0.57 3.22 -0.19 0.00 0.08 0.64 -1.53 117.98 120.78 1bro s PHE 121 Ca -0.07 -1.95 -0.03 0.00 0.12 0.00 0.00 56.93 55.00 1bro s PHE 121 Cb -0.11 -2.04 -0.01 0.00 -0.57 0.00 0.00 43.02 40.29 1bro s PHE 121 CO -0.00 -0.81 -0.06 -0.51 -0.10 0.00 0.00 175.22 173.73 1bro s LEU 122 N 1.22 2.93 -1.24 -0.37 1.43 -0.49 -1.05 118.68 121.12 1bro s LEU 122 Ca -0.05 -0.32 -0.05 0.00 -1.03 0.00 0.00 54.13 52.67 1bro s LEU 122 Cb -0.19 -1.72 -0.01 0.00 0.03 0.00 0.00 46.19 44.30 1bro s LEU 122 CO -0.03 0.06 0.74 0.00 0.23 0.00 0.00 176.35 177.36 1bro n ALA 123 N 4.24 -2.19 -1.76 4.21 0.00 -0.80 -0.97 120.51 123.24 1bro n ALA 123 Ca -0.18 -0.14 -0.38 0.00 0.00 0.00 0.00 53.44 52.74 1bro n ALA 123 Cb 0.52 -2.90 0.01 0.00 0.00 0.00 0.00 19.45 17.08 1bro n ALA 123 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1bro s SER 124 N -4.05 5.76 0.06 0.00 0.01 -1.26 -2.50 113.70 111.71 1bro s SER 124 Ca 0.16 2.52 -0.02 0.00 1.31 0.00 0.00 55.95 59.91 1bro s SER 124 Cb -0.04 -2.62 -0.27 0.00 0.21 0.00 0.00 66.02 63.30 1bro s SER 124 CO 0.81 -1.22 1.09 -0.07 0.41 0.00 0.00 173.24 174.26 1bro h LEU 125 N 1.77 0.35-10.08 2.44 3.38 -1.92 -3.42 115.31 107.84 1bro h LEU 125 Ca -0.50 -0.40 -0.56 0.00 0.09 0.00 0.00 57.88 56.51 1bro h LEU 125 Cb 1.27 -0.11 0.16 0.00 0.09 0.00 0.00 40.66 42.07 1bro h LEU 125 CO 0.59 1.32 0.47 -0.62 0.09 0.00 0.00 178.44 180.29 1bro n GLU 126 N -3.48 1.06 0.05 1.13 4.71 -1.26 -4.05 120.64 118.80 1bro n GLU 126 Ca -0.09 0.42 -0.02 0.00 -0.01 0.00 0.00 57.16 57.46 1bro n GLU 126 Cb 1.02 -2.49 -0.07 0.00 -1.01 0.00 0.00 31.44 28.88 1bro n GLU 126 CO 0.00 0.00 0.00 -1.35 0.09 0.00 0.00 177.13 175.87 1bro h PRO 127 N 0.47 0.00 -0.52 3.49 0.11 -1.79 -3.36 132.00 130.40 1bro h PRO 127 Ca -0.51 0.00 0.17 0.00 0.11 0.00 0.00 66.00 65.78 1bro h PRO 127 Cb 1.34 0.00 -0.20 0.00 0.11 0.00 0.00 31.00 32.25 1bro h PRO 127 CO 0.52 0.45 -0.07 0.12 -0.21 0.00 0.00 178.00 178.81 1bro s PHE 128 N -2.86 -0.91 0.25 0.65 5.36 -1.26 0.76 117.98 119.98 1bro s PHE 128 Ca -0.01 0.73 0.21 0.00 -0.96 0.00 0.00 56.93 56.90 1bro s PHE 128 Cb 0.08 0.23 0.92 0.00 -0.34 0.00 0.00 43.02 43.92 1bro s PHE 128 CO 0.80 -0.52 1.85 -0.07 -1.46 0.00 0.00 175.22 175.82 1bro h LEU 129 N 7.75 0.00 -9.28 6.12 3.38 -1.76 -3.38 115.31 118.14 1bro h LEU 129 Ca -0.11 0.00 -0.55 0.00 0.09 0.00 0.00 57.88 57.30 1bro h LEU 129 Cb 1.18 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.90 1bro h LEU 129 CO -0.00 0.28 0.76 -0.22 0.09 0.00 0.00 178.44 179.35 1bro s LEU 130 N -7.24 4.26 -0.49 1.67 2.96 -1.26 0.33 118.68 118.91 1bro s LEU 130 Ca -0.01 1.81 -0.29 0.00 -0.22 0.00 0.00 54.13 55.42 1bro s LEU 130 Cb 0.12 -3.55 0.03 0.00 0.50 0.00 0.00 46.19 43.28 1bro s LEU 130 CO 0.66 -0.64 1.21 -0.75 -1.32 0.00 0.00 176.35 175.51 1bro s LYS 131 N 2.55 3.64 0.30 1.98 2.20 0.07 -4.27 119.74 126.21 1bro s LYS 131 Ca 0.56 0.58 0.03 0.00 -0.36 0.00 0.00 55.97 56.78 1bro s LYS 131 Cb -0.25 -3.96 -0.01 0.00 -1.51 0.00 0.00 37.83 32.10 1bro s LYS 131 CO 0.21 -1.50 0.12 0.25 -0.36 0.00 0.00 175.35 174.06 1bro n THR 132 N 6.88 0.00 0.05 3.43 -2.24 -0.49 -4.49 114.28 117.41 1bro n THR 132 Ca 0.12 -1.77 -0.12 0.00 -2.27 0.00 0.00 64.05 60.02 1bro n THR 132 Cb 0.49 0.65 -0.07 0.00 -2.10 0.00 0.00 70.33 69.30 1bro n THR 132 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 1bro h ASP 133 N 1.23 -0.05 -0.22 3.42 3.32 -2.01 -2.50 116.42 119.61 1bro h ASP 133 Ca -0.23 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.82 1bro h ASP 133 Cb 0.90 0.02 0.00 0.00 0.22 0.00 0.00 39.33 40.47 1bro h ASP 133 CO 0.36 -0.03 0.00 -0.90 -1.72 0.00 0.00 179.24 176.95 1bro n ASP 134 N -5.12 2.15 -3.09 6.45 5.75 -1.26 -4.50 116.55 116.94 1bro n ASP 134 Ca -0.07 -1.79 -0.19 0.00 -0.01 0.00 0.00 54.79 52.72 1bro n ASP 134 Cb 0.05 -0.14 -0.03 0.00 -1.03 0.00 0.00 41.12 39.97 1bro n ASP 134 CO 0.00 0.00 0.00 -3.20 -0.11 0.00 0.00 177.20 173.89 1bro n ASN 135 N 0.64 -0.40 0.13 -1.12 5.15 -0.97 -4.96 115.26 113.73 1bro n ASN 135 Ca 0.17 -2.91 0.12 0.00 -0.60 0.00 0.00 54.58 51.36 1bro n ASN 135 Cb 0.40 -0.06 0.50 0.00 -0.53 0.00 0.00 39.78 40.10 1bro n ASN 135 CO 0.00 0.00 0.00 -0.81 1.40 0.00 0.00 177.26 177.85 1bro n PRO 136 N 1.21 0.18 0.00 1.20 -0.04 -1.04 -1.40 135.00 135.12 1bro n PRO 136 Ca 0.19 0.45 0.14 0.00 -0.04 0.00 0.00 63.50 64.24 1bro n PRO 136 Cb 0.58 -1.88 0.54 0.00 -0.04 0.00 0.00 33.50 32.70 1bro n PRO 136 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1bro n ASP 137 N -2.23 0.15 -4.76 3.54 8.00 -1.26 -4.88 116.55 115.11 1bro n ASP 137 Ca 0.02 0.21 -0.39 0.00 0.71 0.00 0.00 54.79 55.34 1bro n ASP 137 Cb 0.20 -0.28 0.03 0.00 -0.02 0.00 0.00 41.12 41.05 1bro n ASP 137 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 1bro s GLY 138 N -2.94 2.89 0.02 0.44 0.00 -0.66 -4.52 107.32 102.54 1bro s GLY 138 Ca 0.15 1.35 -0.22 0.00 0.00 0.00 0.00 44.72 46.00 1bro s GLY 138 CO 0.56 1.89 1.28 0.00 0.00 0.00 0.00 173.10 176.83 1bro h ALA 139 N 1.73 0.15 -2.77 3.20 0.00 -0.37 -3.40 119.26 117.81 1bro h ALA 139 Ca -0.51 -0.34 -0.05 0.00 0.00 0.00 0.00 54.91 54.01 1bro h ALA 139 Cb 1.29 -0.03 -0.12 0.00 0.00 0.00 0.00 17.79 18.93 1bro h ALA 139 CO 0.58 0.05 -0.08 0.00 0.00 0.00 0.00 179.25 179.81 1bro s ALA 140 N -4.09 -0.80 0.79 0.00 0.00 -1.09 -4.88 121.76 111.69 1bro s ALA 140 Ca -0.15 -0.21 -0.11 0.00 0.00 0.00 0.00 51.96 51.49 1bro s ALA 140 Cb 0.04 0.75 0.06 0.00 0.00 0.00 0.00 23.12 23.97 1bro s ALA 140 CO 0.74 -0.69 1.09 -1.25 0.00 0.00 0.00 175.76 175.66 1bro s PRO 141 N -3.84 2.18 0.24 0.00 0.04 -1.26 -0.75 135.00 131.60 1bro s PRO 141 Ca 0.06 0.68 -0.14 0.00 0.04 0.00 0.00 61.00 61.65 1bro s PRO 141 Cb 0.01 -1.93 0.30 0.00 0.04 0.00 0.00 34.50 32.92 1bro s PRO 141 CO -0.08 -1.56 1.58 0.37 0.04 0.00 0.00 177.00 177.35 1bro h GLN 142 N -1.05 -0.03 -0.23 4.56 5.75 -1.98 0.17 115.11 122.30 1bro h GLN 142 Ca -0.47 0.00 0.07 0.00 -0.15 0.00 0.00 58.65 58.10 1bro h GLN 142 Cb 1.26 0.01 -0.01 0.00 1.07 0.00 0.00 27.48 29.81 1bro h GLN 142 CO 0.59 -0.02 0.32 1.05 -2.65 0.00 0.00 178.83 178.12 1bro h GLU 143 N -0.03 0.00 0.01 1.69 9.09 -1.99 -0.09 114.58 123.26 1bro h GLU 143 Ca 0.36 0.00 -0.00 0.00 0.05 0.00 0.00 59.36 59.77 1bro h GLU 143 Cb 0.60 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.70 1bro h GLU 143 CO -0.86 0.00 -0.00 0.35 0.05 0.00 0.00 179.01 178.54 1bro h PHE 144 N 0.00 -0.01 -0.53 2.06 3.57 -1.31 -2.10 116.94 118.62 1bro h PHE 144 Ca 0.11 -0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.60 1bro h PHE 144 Cb 0.75 0.00 -0.03 0.00 2.79 0.00 0.00 35.95 39.46 1bro h PHE 144 CO 0.00 0.47 0.31 0.74 -2.23 0.00 0.00 178.31 177.60 1bro h PHE 145 N -0.49 0.70 -0.77 0.41 0.04 -1.14 -2.58 116.94 113.10 1bro h PHE 145 Ca -0.00 0.00 0.08 0.00 2.80 0.00 0.00 57.97 60.85 1bro h PHE 145 Cb 0.48 -0.23 -0.07 0.00 2.20 0.00 0.00 35.95 38.33 1bro h PHE 145 CO 0.09 0.48 0.44 -0.44 -0.60 0.00 0.00 178.31 178.27 1bro h ASP 146 N 0.74 0.63 0.26 2.17 3.32 -1.28 -1.91 116.42 120.34 1bro h ASP 146 Ca 0.19 0.04 -0.12 0.00 0.02 0.00 0.00 57.03 57.17 1bro h ASP 146 Cb -0.01 -0.08 -0.01 0.00 0.22 0.00 0.00 39.33 39.45 1bro h ASP 146 CO -0.03 0.37 -0.46 1.23 -1.72 0.00 0.00 179.24 178.63 1bro h GLY 147 N 0.75 0.26 0.61 2.75 0.00 -0.96 -1.71 103.07 104.77 1bro h GLY 147 Ca 0.37 -0.27 -0.00 0.00 0.00 0.00 0.00 47.33 47.42 1bro h GLY 147 CO -0.23 0.24 -0.04 -2.22 0.00 0.00 0.00 176.54 174.30 1bro h ILE 148 N 0.20 1.15 -0.73 2.60 2.04 -1.30 -1.86 117.51 119.60 1bro h ILE 148 Ca 0.01 -0.85 0.10 0.00 1.00 0.00 0.00 64.86 65.12 1bro h ILE 148 Cb 0.89 1.69 -0.07 0.00 -0.74 0.00 0.00 36.82 38.59 1bro h ILE 148 CO 0.07 0.21 0.37 0.58 0.00 0.00 0.00 178.15 179.37 1bro h VAL 149 N -0.50 0.84 -0.62 1.67 2.07 -1.30 -1.08 116.25 117.34 1bro h VAL 149 Ca -0.01 -0.21 -0.10 0.00 0.82 0.00 0.00 66.70 67.20 1bro h VAL 149 Cb 0.42 0.17 -0.02 0.00 -1.52 0.00 0.00 31.29 30.34 1bro h VAL 149 CO 0.02 0.11 0.01 0.00 0.02 0.00 0.00 177.57 177.73 1bro h ALA 150 N 1.44 0.83 -0.60 1.67 0.00 -1.28 -0.35 119.26 120.97 1bro h ALA 150 Ca 0.36 -0.31 -0.04 0.00 0.00 0.00 0.00 54.91 54.92 1bro h ALA 150 Cb 0.39 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.93 1bro h ALA 150 CO -0.28 0.66 0.19 0.00 0.00 0.00 0.00 179.25 179.83 1bro h ALA 151 N 0.99 1.21 -0.02 0.00 0.00 -0.89 0.19 119.26 120.75 1bro h ALA 151 Ca 0.18 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 1bro h ALA 151 Cb 0.55 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 18.10 1bro h ALA 151 CO 0.03 0.56 0.01 0.28 0.00 0.00 0.00 179.25 180.12 1bro h VAL 152 N 0.88 1.15 0.00 0.00 2.07 -0.81 -2.68 116.25 116.86 1bro h VAL 152 Ca 0.20 -0.45 -0.05 0.00 0.82 0.00 0.00 66.70 67.22 1bro h VAL 152 Cb 0.24 1.41 -0.01 0.00 -1.52 0.00 0.00 31.29 31.42 1bro h VAL 152 CO -0.01 0.12 -0.21 0.11 0.02 0.00 0.00 177.57 177.60 1bro h LYS 153 N -0.15 0.00 -0.46 1.57 1.57 -0.72 -1.81 116.57 116.58 1bro h LYS 153 Ca 0.01 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.76 1bro h LYS 153 Cb 0.19 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.48 1bro h LYS 153 CO -0.00 0.21 0.18 0.00 -0.57 0.00 0.00 179.45 179.28 1bro h ALA 154 N 1.79 0.60 -0.41 3.86 0.00 -0.28 -3.43 119.26 121.38 1bro h ALA 154 Ca -0.00 -0.15 0.14 0.00 0.00 0.00 0.00 54.91 54.90 1bro h ALA 154 Cb 0.39 -0.18 -0.19 0.00 0.00 0.00 0.00 17.79 17.82 1bro h ALA 154 CO 0.03 0.20 -0.13 0.34 0.00 0.00 0.00 179.25 179.69 1bro s ASP 155 N -5.93 -0.67 0.38 0.00 -1.08 -1.15 -5.05 116.67 103.18 1bro s ASP 155 Ca -0.13 -0.07 0.10 0.00 -0.52 0.00 0.00 52.55 51.94 1bro s ASP 155 Cb 0.11 1.21 0.77 0.00 -1.46 0.00 0.00 42.92 43.55 1bro s ASP 155 CO 0.77 -0.11 1.89 0.08 0.52 0.00 0.00 175.17 178.32 1bro h ARG 156 N 6.85 0.17 -0.10 4.34 0.11 -1.55 -0.52 114.38 123.68 1bro h ARG 156 Ca -0.05 -0.05 -0.00 0.00 0.10 0.00 0.00 59.98 59.98 1bro h ARG 156 Cb 1.19 -0.02 -0.00 0.00 1.11 0.00 0.00 29.97 32.25 1bro h ARG 156 CO -0.04 0.37 0.06 1.88 0.10 0.00 0.00 179.97 182.35 1bro h TYR 157 N 0.16 0.14 -0.36 4.08 0.05 -1.95 -0.76 116.97 118.33 1bro h TYR 157 Ca 0.03 -0.00 -0.15 0.00 0.05 0.00 0.00 58.73 58.66 1bro h TYR 157 Cb 0.45 -0.04 -0.01 0.00 1.01 0.00 0.00 36.73 38.14 1bro h TYR 157 CO 0.01 0.14 -0.38 0.00 -1.05 0.00 0.00 178.16 176.88 1bro h ALA 158 N 0.98 0.65 -0.60 3.88 0.00 -1.95 -2.89 119.26 119.33 1bro h ALA 158 Ca 0.04 -0.45 0.11 0.00 0.00 0.00 0.00 54.91 54.61 1bro h ALA 158 Cb 0.05 -0.12 -0.09 0.00 0.00 0.00 0.00 17.79 17.63 1bro h ALA 158 CO -0.01 0.67 0.12 0.35 0.00 0.00 0.00 179.25 180.39 1bro h PHE 159 N 0.70 0.19 -0.80 0.00 3.57 -0.46 -2.60 116.94 117.54 1bro h PHE 159 Ca 0.06 0.04 0.14 0.00 3.53 0.00 0.00 57.97 61.73 1bro h PHE 159 Cb 0.95 0.01 -0.09 0.00 2.79 0.00 0.00 35.95 39.61 1bro h PHE 159 CO 0.06 -0.04 0.39 1.88 -2.23 0.00 0.00 178.31 178.36 1bro h TYR 160 N 0.25 0.68 -0.13 0.41 0.05 -0.93 0.12 116.97 117.42 1bro h TYR 160 Ca 0.32 0.03 0.05 0.00 0.05 0.00 0.00 58.73 59.18 1bro h TYR 160 Cb 0.48 -0.18 -0.06 0.00 1.01 0.00 0.00 36.73 37.98 1bro h TYR 160 CO -0.25 0.16 -0.22 1.15 -1.05 0.00 0.00 178.16 177.95 1bro h THR 161 N 0.58 0.45 -0.26 -2.88 2.02 -1.52 -0.29 112.91 111.01 1bro h THR 161 Ca 0.43 0.00 -0.13 0.00 0.77 0.00 0.00 66.41 67.48 1bro h THR 161 Cb 0.59 0.45 -0.01 0.00 -1.74 0.00 0.00 68.15 67.44 1bro h THR 161 CO -0.35 0.00 -0.37 1.23 0.37 0.00 0.00 175.52 176.39 1bro h GLY 162 N -0.28 0.64 0.70 2.16 0.00 -1.38 -2.75 103.07 102.15 1bro h GLY 162 Ca 0.10 -0.62 0.01 0.00 0.00 0.00 0.00 47.33 46.82 1bro h GLY 162 CO -0.29 0.56 -0.24 -2.75 0.00 0.00 0.00 176.54 173.82 1bro h PHE 163 N 0.49 -0.62 -0.40 5.60 3.57 -0.37 -2.49 116.94 122.71 1bro h PHE 163 Ca 0.05 0.01 0.12 0.00 3.53 0.00 0.00 57.97 61.67 1bro h PHE 163 Cb 0.87 0.25 -0.02 0.00 2.79 0.00 0.00 35.95 39.84 1bro h PHE 163 CO 0.04 -0.34 0.30 0.74 -2.23 0.00 0.00 178.31 176.81 1bro h PHE 164 N -0.49 0.00 -0.06 0.41 0.04 -0.97 -1.28 116.94 114.59 1bro h PHE 164 Ca 0.00 0.00 0.02 0.00 2.80 0.00 0.00 57.97 60.79 1bro h PHE 164 Cb 0.47 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.60 1bro h PHE 164 CO -0.17 0.00 -0.03 -0.97 -0.60 0.00 0.00 178.31 176.53 1bro h ASN 165 N 0.00 -0.11 1.31 2.17 -0.73 -1.14 -1.96 115.58 115.11 1bro h ASN 165 Ca 0.19 0.03 0.00 0.00 1.87 0.00 0.00 56.30 58.39 1bro h ASN 165 Cb 0.79 0.06 0.00 0.00 0.27 0.00 0.00 38.32 39.44 1bro h ASN 165 CO -0.00 -0.05 -0.67 0.44 -0.37 0.00 0.00 177.43 176.78 1bro h ASP 166 N -0.04 0.00 -0.07 1.15 3.32 -1.43 -0.31 116.42 119.05 1bro h ASP 166 Ca 0.04 -0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.07 1bro h ASP 166 Cb 0.09 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.64 1bro h ASP 166 CO -0.08 0.00 -0.01 0.15 -1.72 0.00 0.00 179.24 177.59 1bro h PHE 167 N 0.00 0.14 -0.09 4.55 3.04 -1.20 -3.33 116.94 120.05 1bro h PHE 167 Ca 0.00 -0.03 0.00 0.00 3.98 0.00 0.00 57.97 61.92 1bro h PHE 167 Cb 0.99 -0.03 0.00 0.00 2.56 0.00 0.00 35.95 39.46 1bro h PHE 167 CO 0.00 0.43 0.00 0.66 -2.02 0.00 0.00 178.31 177.38 1bro n TYR 168 N -4.83 0.09 -3.75 0.41 4.01 -0.74 0.10 117.16 112.44 1bro n TYR 168 Ca -0.07 -0.04 -0.27 0.00 -0.16 0.00 0.00 57.90 57.36 1bro n TYR 168 Cb 0.21 0.00 0.02 0.00 -0.31 0.00 0.00 39.34 39.26 1bro n TYR 168 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 1bro n ASN 169 N 1.35 -2.93 0.04 7.72 4.13 -0.66 -4.62 115.26 120.29 1bro n ASN 169 Ca 0.15 -0.96 0.11 0.00 1.68 0.00 0.00 54.58 55.56 1bro n ASN 169 Cb 0.60 -3.50 0.56 0.00 -1.54 0.00 0.00 39.78 35.89 1bro n ASN 169 CO 0.00 0.00 0.00 -0.07 0.28 0.00 0.00 177.26 177.47 1bro h LEU 170 N -1.84 0.22 -1.05 3.41 3.38 -1.34 0.11 115.31 118.20 1bro h LEU 170 Ca -0.64 0.00 0.10 0.00 0.09 0.00 0.00 57.88 57.43 1bro h LEU 170 Cb 1.36 -0.05 -0.08 0.00 0.09 0.00 0.00 40.66 41.99 1bro h LEU 170 CO 0.54 0.14 0.63 -2.24 0.09 0.00 0.00 178.44 177.60 1bro h ASP 171 N 0.25 0.95 0.21 -0.43 2.03 -1.89 -1.00 116.42 116.53 1bro h ASP 171 Ca 0.18 0.03 -0.34 0.00 -0.73 0.00 0.00 57.03 56.17 1bro h ASP 171 Cb 0.38 -0.17 -0.06 0.00 -0.83 0.00 0.00 39.33 38.66 1bro h ASP 171 CO -0.03 0.55 -2.10 -1.84 -1.03 0.00 0.00 179.24 174.78 1bro n GLU 172 N -4.56 0.67 -0.02 4.15 0.28 0.17 -4.76 120.64 116.57 1bro n GLU 172 Ca 0.17 0.12 0.06 0.00 -0.16 0.00 0.00 57.16 57.35 1bro n GLU 172 Cb 0.29 -1.64 -0.15 0.00 1.43 0.00 0.00 31.44 31.37 1bro n GLU 172 CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06 1bro n ASN 173 N -2.88 0.09 -4.71 -1.84 3.02 -0.04 -4.88 115.26 104.02 1bro n ASN 173 Ca -0.26 0.03 -0.42 0.00 -0.03 0.00 0.00 54.58 53.90 1bro n ASN 173 Cb 1.11 1.63 -0.03 0.00 -0.61 0.00 0.00 39.78 41.88 1bro n ASN 173 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 1bro s LEU 174 N -4.82 4.37 0.00 3.41 2.96 -0.39 -1.38 118.68 122.82 1bro s LEU 174 Ca -0.08 2.56 0.00 0.00 -0.22 0.00 0.00 54.13 56.39 1bro s LEU 174 Cb 0.12 -3.58 0.00 0.00 0.50 0.00 0.00 46.19 43.23 1bro s LEU 174 CO 0.88 -0.84 0.00 0.61 -1.32 0.00 0.00 176.35 175.69 1bro n GLY 175 N 3.82 1.41 1.04 7.98 0.00 0.87 -4.85 105.19 115.46 1bro n GLY 175 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.16 1bro n GLY 175 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1bro n THR 176 N -2.00 0.75 0.45 2.61 -2.24 -1.00 -4.88 114.28 107.97 1bro n THR 176 Ca 0.00 0.25 0.11 0.00 -2.27 0.00 0.00 64.05 62.13 1bro n THR 176 Cb 0.00 -1.35 -0.12 0.00 -2.10 0.00 0.00 70.33 66.76 1bro n THR 176 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1bro n ARG 177 N -3.11 0.36 -3.77 -0.78 1.74 -0.48 -4.94 116.66 105.68 1bro n ARG 177 Ca 0.00 -0.09 -0.13 0.00 -0.77 0.00 0.00 57.85 56.86 1bro n ARG 177 Cb 0.00 -1.53 -0.12 0.00 -1.02 0.00 0.00 32.46 29.79 1bro n ARG 177 CO 0.00 0.00 0.00 -1.50 -1.52 0.00 0.00 177.63 174.61 1bro s ILE 178 N -3.28 -0.01 0.36 0.55 2.07 -0.83 -4.30 121.20 115.76 1bro s ILE 178 Ca -0.00 0.05 -0.03 0.00 -1.41 0.00 0.00 60.65 59.25 1bro s ILE 178 Cb 0.15 -0.35 -0.04 0.00 0.13 0.00 0.00 42.46 42.35 1bro s ILE 178 CO 0.88 0.02 0.61 -0.94 -1.91 0.00 0.00 174.94 173.60 1bro s SER 179 N 0.50 6.35 0.38 4.50 1.04 -1.26 -0.09 113.70 125.12 1bro s SER 179 Ca -0.03 0.68 0.05 0.00 0.48 0.00 0.00 55.95 57.12 1bro s SER 179 Cb -0.05 -2.13 0.75 0.00 0.10 0.00 0.00 66.02 64.69 1bro s SER 179 CO -0.03 -0.33 2.03 -0.08 0.98 0.00 0.00 173.24 175.82 1bro h GLU 180 N 0.99 0.67 -0.48 4.02 4.81 -1.98 -1.49 114.58 121.13 1bro h GLU 180 Ca -0.48 -0.04 -0.10 0.00 -0.13 0.00 0.00 59.36 58.60 1bro h GLU 180 Cb 1.20 -0.15 -0.02 0.00 0.63 0.00 0.00 28.75 30.42 1bro h GLU 180 CO 0.63 0.45 -0.10 0.93 -0.73 0.00 0.00 179.01 180.19 1bro h GLU 181 N 0.69 0.88 -0.44 1.92 3.07 -1.99 -2.24 114.58 116.47 1bro h GLU 181 Ca 0.19 -0.30 -0.11 0.00 -0.50 0.00 0.00 59.36 58.63 1bro h GLU 181 Cb -0.07 -0.07 -0.02 0.00 -0.84 0.00 0.00 28.75 27.76 1bro h GLU 181 CO -0.04 0.94 -0.17 0.00 -1.40 0.00 0.00 179.01 178.34 1bro h ALA 182 N 1.09 0.88 -0.57 3.43 0.00 -1.74 -1.62 119.26 120.73 1bro h ALA 182 Ca 0.13 -0.35 -0.05 0.00 0.00 0.00 0.00 54.91 54.64 1bro h ALA 182 Cb 0.62 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.22 1bro h ALA 182 CO 0.04 0.63 0.17 0.28 0.00 0.00 0.00 179.25 180.37 1bro h VAL 183 N 0.74 1.24 -0.38 0.00 2.07 -1.10 -2.58 116.25 116.24 1bro h VAL 183 Ca 0.11 -0.83 0.06 0.00 0.82 0.00 0.00 66.70 66.86 1bro h VAL 183 Cb 0.69 0.70 -0.06 0.00 -1.52 0.00 0.00 31.29 31.10 1bro h VAL 183 CO 0.05 0.31 0.04 -0.09 0.02 0.00 0.00 177.57 177.90 1bro h ARG 184 N 0.80 0.15 -0.20 1.57 9.65 -1.19 0.20 114.38 125.36 1bro h ARG 184 Ca 0.18 -0.01 0.04 0.00 -1.10 0.00 0.00 59.98 59.09 1bro h ARG 184 Cb 0.30 -0.03 -0.04 0.00 -1.39 0.00 0.00 29.97 28.81 1bro h ARG 184 CO -0.00 0.10 -0.04 -0.97 2.80 0.00 0.00 179.97 181.85 1bro h ASN 185 N 0.15 -0.17 -0.73 -3.80 -0.73 -1.19 0.18 115.58 109.29 1bro h ASN 185 Ca 0.18 0.06 -0.06 0.00 1.87 0.00 0.00 56.30 58.35 1bro h ASN 185 Cb 0.24 0.12 -0.03 0.00 0.27 0.00 0.00 38.32 38.91 1bro h ASN 185 CO -0.27 -0.06 0.22 0.28 -0.37 0.00 0.00 177.43 177.23 1bro h SER 186 N 0.01 1.08 -0.06 1.15 0.02 -0.96 -1.56 113.55 113.23 1bro h SER 186 Ca 0.10 -0.21 0.01 0.00 -0.84 0.00 0.00 61.79 60.85 1bro h SER 186 Cb 0.14 -0.28 -0.01 0.00 0.14 0.00 0.00 62.40 62.39 1bro h SER 186 CO -0.20 1.00 -0.01 -0.25 -1.14 0.00 0.00 176.83 176.24 1bro h TRP 187 N 1.10 -0.02 -0.84 3.45 7.01 0.14 -0.88 115.95 125.91 1bro h TRP 187 Ca 0.24 0.01 0.07 0.00 2.11 0.00 0.00 58.89 61.32 1bro h TRP 187 Cb 0.32 0.02 -0.07 0.00 -2.10 0.00 0.00 29.16 27.33 1bro h TRP 187 CO 0.03 -0.02 0.50 -0.91 -2.79 0.00 0.00 178.44 175.25 1bro h ASN 188 N 0.01 0.77 -0.67 2.65 -0.26 -0.42 0.12 115.58 117.78 1bro h ASN 188 Ca 0.03 0.03 -0.06 0.00 -0.56 0.00 0.00 56.30 55.74 1bro h ASN 188 Cb 0.04 -0.13 -0.03 0.00 -1.06 0.00 0.00 38.32 37.14 1bro h ASN 188 CO -0.06 0.47 0.18 0.74 -1.06 0.00 0.00 177.43 177.70 1bro h THR 189 N 0.89 1.26 -0.12 2.81 2.02 -1.03 -2.27 112.91 116.48 1bro h THR 189 Ca 0.38 -0.92 -0.01 0.00 0.77 0.00 0.00 66.41 66.62 1bro h THR 189 Cb 0.25 0.57 -0.00 0.00 -1.74 0.00 0.00 68.15 67.22 1bro h THR 189 CO -0.20 0.35 0.02 0.00 0.37 0.00 0.00 175.52 176.06 1bro h ALA 190 N 1.08 0.16 0.00 6.16 0.00 -0.22 -2.74 119.26 123.69 1bro h ALA 190 Ca 0.21 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 1bro h ALA 190 Cb 0.34 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.09 1bro h ALA 190 CO -0.00 -0.19 -0.03 0.00 0.00 0.00 0.00 179.25 179.03 1bro h ALA 191 N 0.80 1.33 0.00 0.00 0.00 -0.73 -2.17 119.26 118.50 1bro h ALA 191 Ca 0.04 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1bro h ALA 191 Cb 0.28 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.07 1bro h ALA 191 CO 0.00 0.03 -0.10 -1.13 0.00 0.00 0.00 179.25 178.06 1bro n SER 192 N -3.60 0.61 -4.73 0.00 3.41 -0.86 -4.86 113.62 103.59 1bro n SER 192 Ca -0.03 0.47 -0.30 0.00 -0.26 0.00 0.00 58.87 58.76 1bro n SER 192 Cb 0.12 -0.57 0.13 0.00 -0.26 0.00 0.00 64.21 63.63 1bro n SER 192 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 1bro s GLY 193 N -3.43 1.62 0.47 5.00 0.00 -0.82 -4.67 107.32 105.48 1bro s GLY 193 Ca 0.11 -0.08 -0.23 0.00 0.00 0.00 0.00 44.72 44.52 1bro s GLY 193 CO 0.60 0.40 1.17 -0.32 0.00 0.00 0.00 173.10 174.95 1bro s GLY 194 N -3.48 2.77 0.21 0.20 0.00 0.23 -4.93 107.32 102.32 1bro s GLY 194 Ca 0.63 0.93 -0.10 0.00 0.00 0.00 0.00 44.72 46.18 1bro s GLY 194 CO 0.57 1.38 1.84 0.27 0.00 0.00 0.00 173.10 177.16 1bro h PHE 195 N 1.97 0.99 0.58 1.90 -0.00 -1.94 -2.24 116.94 118.21 1bro h PHE 195 Ca -0.49 -0.01 -0.03 0.00 -0.00 0.00 0.00 57.97 57.44 1bro h PHE 195 Cb 1.25 -0.33 0.01 0.00 -0.00 0.00 0.00 35.95 36.88 1bro h PHE 195 CO 0.53 0.67 -0.28 0.35 -0.00 0.00 0.00 178.31 179.58 1bro h PHE 196 N 1.03 -0.72 -0.39 6.09 3.04 -1.91 -2.83 116.94 121.24 1bro h PHE 196 Ca 0.27 -0.02 0.02 0.00 3.98 0.00 0.00 57.97 62.22 1bro h PHE 196 Cb -0.02 0.24 -0.02 0.00 2.56 0.00 0.00 35.95 38.70 1bro h PHE 196 CO -0.01 -0.40 0.26 0.00 -2.02 0.00 0.00 178.31 176.14 1bro h ALA 197 N -0.59 1.80 -0.27 2.41 0.00 -1.80 0.06 119.26 120.87 1bro h ALA 197 Ca -0.08 -0.02 0.02 0.00 0.00 0.00 0.00 54.91 54.83 1bro h ALA 197 Cb 0.65 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.29 1bro h ALA 197 CO 0.13 0.16 0.13 0.00 0.00 0.00 0.00 179.25 179.68 1bro h ALA 198 N 1.77 0.32 0.00 0.00 0.00 -1.28 0.22 119.26 120.30 1bro h ALA 198 Ca 0.15 0.01 -0.12 0.00 0.00 0.00 0.00 54.91 54.94 1bro h ALA 198 Cb 0.05 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 1bro h ALA 198 CO -0.03 -0.26 -0.75 0.00 0.00 0.00 0.00 179.25 178.21 1bro h ALA 199 N 1.14 0.65 0.06 0.00 0.00 -1.20 -3.34 119.26 116.56 1bro h ALA 199 Ca 0.11 -0.56 -0.25 0.00 0.00 0.00 0.00 54.91 54.21 1bro h ALA 199 Cb 0.03 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 1bro h ALA 199 CO -0.07 0.72 -1.22 0.00 0.00 0.00 0.00 179.25 178.67 1bro h ALA 200 N 1.46 0.30 -0.43 0.00 0.00 -0.77 -3.37 119.26 116.45 1bro h ALA 200 Ca -0.04 -0.98 0.02 0.00 0.00 0.00 0.00 54.91 53.91 1bro h ALA 200 Cb 1.45 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 19.22 1bro h ALA 200 CO 0.06 1.18 0.24 0.00 0.00 0.00 0.00 179.25 180.73 1bro h ALA 201 N 0.79 0.54 -0.87 0.00 0.00 -0.68 -2.93 119.26 116.11 1bro h ALA 201 Ca -0.11 -0.00 0.22 0.00 0.00 0.00 0.00 54.91 55.02 1bro h ALA 201 Cb 1.89 -0.10 -0.05 0.00 0.00 0.00 0.00 17.79 19.53 1bro h ALA 201 CO 0.15 -0.09 0.60 -1.35 0.00 0.00 0.00 179.25 178.56 1bro h PRO 202 N 0.49 0.21 0.00 0.00 0.11 -1.76 -1.55 132.00 129.50 1bro h PRO 202 Ca 0.18 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.27 1bro h PRO 202 Cb 0.04 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 31.10 1bro h PRO 202 CO -0.09 0.14 0.00 1.79 -0.21 0.00 0.00 178.00 179.63 1bro h THR 203 N 0.22 0.00 0.00 -1.15 1.35 -1.75 -2.96 112.91 108.62 1bro h THR 203 Ca 0.44 -0.37 0.00 0.00 -0.55 0.00 0.00 66.41 65.93 1bro h THR 203 Cb 1.37 1.28 0.00 0.00 -1.73 0.00 0.00 68.15 69.07 1bro h THR 203 CO -0.10 0.00 -0.56 0.71 -0.25 0.00 0.00 175.52 175.32 1bro h THR 204 N 0.00 0.00 -0.88 6.82 1.35 -1.42 -3.36 112.91 115.42 1bro h THR 204 Ca 0.00 -0.54 0.03 0.00 -0.55 0.00 0.00 66.41 65.35 1bro h THR 204 Cb 0.41 1.18 -0.05 0.00 -1.73 0.00 0.00 68.15 67.96 1bro h THR 204 CO 0.00 0.00 0.58 -0.50 -0.25 0.00 0.00 175.52 175.35 1bro h TRP 205 N 0.00 1.08 -0.82 4.73 6.55 -1.61 -2.91 115.95 122.97 1bro h TRP 205 Ca 0.00 0.03 -0.54 0.00 0.95 0.00 0.00 58.89 59.33 1bro h TRP 205 Cb 0.77 -0.36 -0.24 0.00 -0.86 0.00 0.00 29.16 28.47 1bro h TRP 205 CO 0.00 0.64 0.69 2.48 -1.05 0.00 0.00 178.44 181.20 1bro n TYR 206 N -4.43 2.64 -2.28 0.49 0.18 -1.26 -4.62 117.16 107.87 1bro n TYR 206 Ca 0.11 -2.51 -0.41 0.00 1.88 0.00 0.00 57.90 56.98 1bro n TYR 206 Cb 0.08 -1.22 -0.03 0.00 -0.38 0.00 0.00 39.34 37.80 1bro n TYR 206 CO 0.00 0.00 0.00 0.99 -2.08 0.00 0.00 176.86 175.77 1bro s THR 207 N -3.77 3.14 -0.34 -3.48 2.01 -1.10 -4.65 115.64 107.46 1bro s THR 207 Ca 0.52 1.09 -0.22 0.00 0.31 0.00 0.00 61.69 63.39 1bro s THR 207 Cb 0.41 -3.69 0.00 0.00 0.01 0.00 0.00 72.50 69.23 1bro s THR 207 CO 0.01 0.23 0.71 -0.62 -0.69 0.00 0.00 174.62 174.26 1bro s ASP 208 N -0.41 6.53 -0.10 3.53 -1.08 -1.26 -4.34 116.67 119.54 1bro s ASP 208 Ca 0.49 0.38 0.17 0.00 -0.52 0.00 0.00 52.55 53.07 1bro s ASP 208 Cb -0.36 -2.37 0.62 0.00 -1.46 0.00 0.00 42.92 39.36 1bro s ASP 208 CO 0.45 -0.62 1.54 0.49 0.52 0.00 0.00 175.17 177.55 1bro n PHE 209 N 6.16 1.23 -0.22 -5.34 3.72 0.23 -4.65 117.46 118.59 1bro n PHE 209 Ca 0.01 -0.63 0.05 0.00 -0.05 0.00 0.00 57.45 56.83 1bro n PHE 209 Cb 0.48 -0.22 0.30 0.00 -0.94 0.00 0.00 39.48 39.11 1bro n PHE 209 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1bro h ARG 210 N 3.39 0.85 0.00 -1.08 3.08 -1.91 -1.21 114.38 117.50 1bro h ARG 210 Ca 0.00 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 60.00 1bro h ARG 210 Cb 1.33 -0.19 0.00 0.00 0.08 0.00 0.00 29.97 31.19 1bro h ARG 210 CO 0.19 0.56 -0.04 0.00 -1.07 0.00 0.00 179.97 179.61 1bro h ALA 211 N 1.57 0.98 0.15 0.04 0.00 -1.93 -3.34 119.26 116.72 1bro h ALA 211 Ca 0.33 0.00 -0.30 0.00 0.00 0.00 0.00 54.91 54.95 1bro h ALA 211 Cb 0.19 0.00 0.01 0.00 0.00 0.00 0.00 17.79 17.99 1bro h ALA 211 CO -0.11 0.00 -1.38 -0.44 0.00 0.00 0.00 179.25 177.32 1bro h ASP 212 N 0.00 0.48 -0.54 0.00 3.32 -1.55 -3.39 116.42 114.74 1bro h ASP 212 Ca 0.00 -0.56 0.11 0.00 0.02 0.00 0.00 57.03 56.60 1bro h ASP 212 Cb 0.84 -0.16 -0.11 0.00 0.22 0.00 0.00 39.33 40.13 1bro h ASP 212 CO 0.00 1.45 -0.18 0.40 -1.72 0.00 0.00 179.24 179.19 1bro h ILE 213 N 0.08 0.38 0.00 0.35 2.04 -1.63 -1.24 117.51 117.50 1bro h ILE 213 Ca -0.19 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.67 1bro h ILE 213 Cb 2.02 0.38 0.00 0.00 -0.74 0.00 0.00 36.82 38.48 1bro h ILE 213 CO 0.20 0.00 0.17 -0.65 0.00 0.00 0.00 178.15 177.87 1bro h PRO 214 N -0.05 0.00 -0.00 2.37 0.11 -1.78 -0.75 132.00 131.90 1bro h PRO 214 Ca 0.26 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.37 1bro h PRO 214 Cb 0.45 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.56 1bro h PRO 214 CO -0.58 0.00 -0.15 0.54 -0.21 0.00 0.00 178.00 177.60 1bro n ARG 215 N -2.97 0.28 -2.45 1.05 5.12 -0.47 -4.77 116.66 112.45 1bro n ARG 215 Ca -0.02 -0.08 -0.43 0.00 -1.93 0.00 0.00 57.85 55.38 1bro n ARG 215 Cb 0.23 -1.50 -0.02 0.00 -1.16 0.00 0.00 32.46 30.01 1bro n ARG 215 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 1bro s ILE 216 N -2.78 4.02 -2.11 0.55 1.01 -0.29 -4.75 121.20 116.86 1bro s ILE 216 Ca 0.20 1.03 0.23 0.00 0.00 0.00 0.00 60.65 62.11 1bro s ILE 216 Cb 0.19 -4.38 0.00 0.00 0.01 0.00 0.00 42.46 38.29 1bro s ILE 216 CO 0.54 -0.88 1.10 0.47 0.00 0.00 0.00 174.94 176.17 1bro n ASP 217 N 8.46 2.11 -4.41 3.58 8.00 -1.26 -5.04 116.55 127.99 1bro n ASP 217 Ca 0.15 -1.55 -0.21 0.00 0.71 0.00 0.00 54.79 53.88 1bro n ASP 217 Cb 0.48 0.44 -0.10 0.00 -0.02 0.00 0.00 41.12 41.93 1bro n ASP 217 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 1bro s VAL 218 N -2.44 1.81 0.23 2.53 -7.23 -1.26 -5.10 120.40 108.94 1bro s VAL 218 Ca 0.19 -2.19 -0.31 0.00 -1.81 0.00 0.00 61.98 57.86 1bro s VAL 218 Cb 0.18 -2.31 -0.14 0.00 0.56 0.00 0.00 36.38 34.67 1bro s VAL 218 CO 0.55 -0.40 1.22 -2.65 -0.31 0.00 0.00 175.10 173.52 1bro n PRO 219 N -0.53 1.59 -4.16 4.82 -0.02 -1.26 -4.77 135.00 130.66 1bro n PRO 219 Ca -0.06 0.56 -0.18 0.00 -2.02 0.00 0.00 63.50 61.80 1bro n PRO 219 Cb 0.62 -2.09 -0.12 0.00 -0.02 0.00 0.00 33.50 31.89 1bro n PRO 219 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1bro s ALA 220 N -0.41 1.13 -0.05 3.55 0.00 -1.26 -1.58 121.76 123.14 1bro s ALA 220 Ca 0.67 -0.99 0.05 0.00 0.00 0.00 0.00 51.96 51.69 1bro s ALA 220 Cb -0.73 -0.08 -0.01 0.00 0.00 0.00 0.00 23.12 22.31 1bro s ALA 220 CO 0.54 0.14 -0.21 -1.17 0.00 0.00 0.00 175.76 175.06 1bro s LEU 221 N -1.76 1.99 -0.16 0.00 2.96 -0.97 -0.62 118.68 120.11 1bro s LEU 221 Ca -0.02 -0.42 0.01 0.00 -0.22 0.00 0.00 54.13 53.47 1bro s LEU 221 Cb -0.10 -1.15 0.02 0.00 0.50 0.00 0.00 46.19 45.47 1bro s LEU 221 CO 0.02 0.20 -0.16 -0.63 -1.32 0.00 0.00 176.35 174.46 1bro s ILE 222 N -0.08 1.73 -0.04 6.68 1.01 0.36 -0.26 121.20 130.60 1bro s ILE 222 Ca -0.03 -0.76 0.04 0.00 0.00 0.00 0.00 60.65 59.90 1bro s ILE 222 Cb -0.12 -1.62 -0.00 0.00 0.01 0.00 0.00 42.46 40.73 1bro s ILE 222 CO 0.03 0.46 -0.15 -0.22 0.00 0.00 0.00 174.94 175.06 1bro s LEU 223 N 1.42 1.87 0.05 2.97 0.20 -0.21 0.19 118.68 125.17 1bro s LEU 223 Ca 0.04 -0.30 -0.16 0.00 0.69 0.00 0.00 54.13 54.40 1bro s LEU 223 Cb -0.13 -0.84 0.03 0.00 -0.43 0.00 0.00 46.19 44.82 1bro s LEU 223 CO -0.11 0.13 0.37 -2.28 -0.29 0.00 0.00 176.35 174.17 1bro s HIS 224 N 0.08 -0.21 -0.03 5.38 2.46 0.03 -1.90 115.29 121.10 1bro s HIS 224 Ca -0.03 0.12 -0.16 0.00 0.47 0.00 0.00 55.06 55.46 1bro s HIS 224 Cb -0.10 0.18 -0.05 0.00 -0.13 0.00 0.00 32.58 32.47 1bro s HIS 224 CO 0.02 -0.56 0.42 0.20 -2.47 0.00 0.00 174.74 172.35 1bro s GLY 225 N -2.07 2.46 0.48 1.59 0.00 -1.26 -0.32 107.32 108.19 1bro s GLY 225 Ca -0.05 -0.21 0.27 0.00 0.00 0.00 0.00 44.72 44.73 1bro s GLY 225 CO -0.03 0.29 1.83 -0.91 0.00 0.00 0.00 173.10 174.28 1bro h THR 226 N 3.94 0.26 -0.49 0.90 1.35 -1.34 -3.06 112.91 114.46 1bro h THR 226 Ca -0.49 -0.92 0.00 0.00 -0.55 0.00 0.00 66.41 64.45 1bro h THR 226 Cb 1.21 1.74 0.00 0.00 -1.73 0.00 0.00 68.15 69.37 1bro h THR 226 CO 0.65 0.11 0.00 0.61 -0.25 0.00 0.00 175.52 176.64 1bro n GLY 227 N 0.32 2.62 3.63 5.82 0.00 0.35 -4.80 105.19 113.13 1bro n GLY 227 Ca 0.01 -0.75 -0.43 0.00 0.00 0.00 0.00 46.02 44.86 1bro n GLY 227 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1bro s ASP 228 N -0.68 6.29 0.12 1.61 -1.08 -0.87 -4.26 116.67 117.79 1bro s ASP 228 Ca 0.44 1.85 0.20 0.00 -0.52 0.00 0.00 52.55 54.53 1bro s ASP 228 Cb 0.33 -2.53 -0.09 0.00 -1.46 0.00 0.00 42.92 39.17 1bro s ASP 228 CO 0.15 -1.30 0.88 0.54 0.52 0.00 0.00 175.17 175.96 1bro n ARG 229 N 7.75 0.62 -0.04 4.34 1.74 -1.26 -4.21 116.66 125.60 1bro n ARG 229 Ca 0.20 0.12 -0.11 0.00 -0.77 0.00 0.00 57.85 57.30 1bro n ARG 229 Cb 0.44 -1.78 -0.09 0.00 -1.02 0.00 0.00 32.46 30.01 1bro n ARG 229 CO 0.00 0.00 0.00 1.15 -1.52 0.00 0.00 177.63 177.26 1bro h THR 230 N 0.00 1.26 -3.48 0.55 2.02 -1.90 -3.42 112.91 107.94 1bro h THR 230 Ca -0.07 -1.79 -0.65 0.00 0.77 0.00 0.00 66.41 64.67 1bro h THR 230 Cb 1.23 2.31 -0.40 0.00 -1.74 0.00 0.00 68.15 69.55 1bro h THR 230 CO 0.02 0.40 -0.62 -0.76 0.37 0.00 0.00 175.52 174.93 1bro s LEU 231 N -8.49 4.56 0.18 2.58 1.43 -1.26 -5.09 118.68 112.58 1bro s LEU 231 Ca -0.14 -2.76 -0.32 0.00 -1.03 0.00 0.00 54.13 49.88 1bro s LEU 231 Cb -0.01 -1.67 -0.11 0.00 0.03 0.00 0.00 46.19 44.42 1bro s LEU 231 CO 0.52 -0.29 1.77 -2.65 0.23 0.00 0.00 176.35 175.93 1bro n PRO 232 N 3.47 2.81 0.06 1.29 -0.02 -1.26 -4.77 135.00 136.58 1bro n PRO 232 Ca 0.05 1.02 0.19 0.00 -2.02 0.00 0.00 63.50 62.73 1bro n PRO 232 Cb 0.35 -2.88 0.71 0.00 -0.02 0.00 0.00 33.50 31.66 1bro n PRO 232 CO 0.00 0.00 0.00 0.97 1.98 0.00 0.00 175.50 178.45 1bro h ILE 233 N 4.14 0.70 0.00 4.25 2.10 -1.82 -1.39 117.51 125.49 1bro h ILE 233 Ca -0.44 0.00 -0.07 0.00 1.08 0.00 0.00 64.86 65.43 1bro h ILE 233 Cb 1.21 0.77 -0.01 0.00 -1.09 0.00 0.00 36.82 37.70 1bro h ILE 233 CO 0.96 0.00 -0.32 -0.33 -1.08 0.00 0.00 178.15 177.38 1bro h GLU 234 N 0.00 0.00 -0.02 2.19 3.07 -1.96 -1.82 114.58 116.03 1bro h GLU 234 Ca 0.20 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.06 1bro h GLU 234 Cb 0.85 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.76 1bro h GLU 234 CO -0.00 0.32 -0.16 0.09 -1.40 0.00 0.00 179.01 177.86 1bro n ASN 235 N -3.82 2.24 0.00 1.42 4.13 -0.55 -4.38 115.26 114.30 1bro n ASN 235 Ca -0.01 -1.62 0.00 0.00 1.68 0.00 0.00 54.58 54.62 1bro n ASN 235 Cb 0.40 0.20 0.00 0.00 -1.54 0.00 0.00 39.78 38.84 1bro n ASN 235 CO 0.00 0.00 0.00 0.35 0.28 0.00 0.00 177.26 177.89 1bro n THR 236 N 0.59 0.00 -0.28 3.41 -2.24 -1.03 -4.51 114.28 110.21 1bro n THR 236 Ca 0.10 0.00 -0.01 0.00 -2.27 0.00 0.00 64.05 61.87 1bro n THR 236 Cb 0.44 0.00 0.06 0.00 -2.10 0.00 0.00 70.33 68.73 1bro n THR 236 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1bro h ALA 237 N 1.00 0.27 -0.42 6.98 0.00 -1.68 0.65 119.26 126.06 1bro h ALA 237 Ca 0.00 0.26 -0.05 0.00 0.00 0.00 0.00 54.91 55.12 1bro h ALA 237 Cb 0.00 0.76 -0.02 0.00 0.00 0.00 0.00 17.79 18.53 1bro h ALA 237 CO 0.00 -0.54 0.06 0.00 0.00 0.00 0.00 179.25 178.77 1bro h ARG 238 N -0.05 0.64 0.00 0.00 3.08 -1.60 -1.29 114.38 115.16 1bro h ARG 238 Ca 0.33 -0.13 -0.19 0.00 0.07 0.00 0.00 59.98 60.07 1bro h ARG 238 Cb 0.59 -0.10 -0.03 0.00 0.08 0.00 0.00 29.97 30.51 1bro h ARG 238 CO -0.83 0.62 -1.15 -0.39 -1.07 0.00 0.00 179.97 177.15 1bro h VAL 239 N 0.62 0.94 -0.38 2.04 -1.51 -1.64 -3.25 116.25 113.07 1bro h VAL 239 Ca 0.14 -2.53 -0.00 0.00 -1.23 0.00 0.00 66.70 63.08 1bro h VAL 239 Cb 0.30 2.40 -0.02 0.00 -2.13 0.00 0.00 31.29 31.83 1bro h VAL 239 CO 0.00 0.54 0.24 0.15 -1.23 0.00 0.00 177.57 177.27 1bro h PHE 240 N 0.00 0.50 -0.70 5.19 3.57 -0.59 -1.87 116.94 123.03 1bro h PHE 240 Ca -0.11 0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.36 1bro h PHE 240 Cb 1.67 -0.17 -0.03 0.00 2.79 0.00 0.00 35.95 40.21 1bro h PHE 240 CO 0.00 0.35 0.34 1.25 -2.23 0.00 0.00 178.31 178.02 1bro h HIS 241 N 0.51 0.98 -0.91 0.41 2.76 -1.34 -0.31 115.15 117.26 1bro h HIS 241 Ca 0.14 -0.04 -0.01 0.00 -2.20 0.00 0.00 60.37 58.27 1bro h HIS 241 Cb -0.01 -0.31 -0.04 0.00 1.55 0.00 0.00 27.41 28.59 1bro h HIS 241 CO -0.04 0.72 0.55 -0.22 -1.30 0.00 0.00 177.93 177.63 1bro h LYS 242 N 0.99 1.24 0.00 5.26 3.64 -1.47 -1.94 116.57 124.29 1bro h LYS 242 Ca 0.24 -0.11 -0.09 0.00 -1.27 0.00 0.00 60.65 59.42 1bro h LYS 242 Cb 0.09 -0.26 -0.01 0.00 -0.41 0.00 0.00 32.23 31.64 1bro h LYS 242 CO -0.03 0.87 -0.43 0.00 -2.27 0.00 0.00 179.45 177.59 1bro h ALA 243 N 1.30 0.87 -2.08 5.00 0.00 -0.38 -3.36 119.26 120.61 1bro h ALA 243 Ca 0.33 -0.39 -0.58 0.00 0.00 0.00 0.00 54.91 54.27 1bro h ALA 243 Cb -0.05 -0.07 -0.40 0.00 0.00 0.00 0.00 17.79 17.27 1bro h ALA 243 CO -0.06 0.53 -0.90 -0.11 0.00 0.00 0.00 179.25 178.71 1bro n LEU 244 N -3.41 1.65 0.28 0.00 7.94 -0.27 -4.82 117.00 118.38 1bro n LEU 244 Ca 0.01 -5.00 0.17 0.00 -1.11 0.00 0.00 56.01 50.07 1bro n LEU 244 Cb 0.59 0.11 0.77 0.00 0.53 0.00 0.00 43.42 45.42 1bro n LEU 244 CO 0.38 2.07 1.01 1.55 -1.11 0.00 0.00 177.39 181.28 1bro h PRO 245 N 4.06 0.00 0.00 1.96 0.13 -1.52 -1.63 132.00 135.00 1bro h PRO 245 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 1bro h PRO 245 Cb 0.79 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.92 1bro h PRO 245 CO 0.62 0.05 0.00 -1.13 -0.23 0.00 0.00 178.00 177.30 1bro n SER 246 N -3.20 0.00 -4.80 1.44 3.41 -1.26 -4.85 113.62 104.36 1bro n SER 246 Ca -0.00 0.38 -0.34 0.00 -0.26 0.00 0.00 58.87 58.65 1bro n SER 246 Cb 0.27 -0.45 -0.03 0.00 -0.26 0.00 0.00 64.21 63.74 1bro n SER 246 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1bro s ALA 247 N -2.90 2.86 0.07 7.33 0.00 -0.61 -4.80 121.76 123.70 1bro s ALA 247 Ca 0.13 0.57 -0.29 0.00 0.00 0.00 0.00 51.96 52.36 1bro s ALA 247 Cb 0.14 -3.24 -0.05 0.00 0.00 0.00 0.00 23.12 19.97 1bro s ALA 247 CO 0.39 -0.36 0.95 -2.00 0.00 0.00 0.00 175.76 174.73 1bro s GLU 248 N -3.36 4.63 -0.07 0.00 2.12 0.21 -4.91 118.70 117.32 1bro s GLU 248 Ca 0.66 1.40 0.04 0.00 0.36 0.00 0.00 54.97 57.43 1bro s GLU 248 Cb -0.16 -3.40 0.00 0.00 0.26 0.00 0.00 34.13 30.83 1bro s GLU 248 CO 0.22 0.13 -0.19 -0.47 -0.54 0.00 0.00 175.26 174.41 1bro s TYR 249 N 0.33 2.05 -0.01 5.30 5.04 -1.26 0.13 117.35 128.94 1bro s TYR 249 Ca 0.48 -0.75 0.00 0.00 -2.44 0.00 0.00 57.07 54.35 1bro s TYR 249 Cb -0.22 -1.40 0.02 0.00 0.35 0.00 0.00 41.96 40.71 1bro s TYR 249 CO 0.29 -0.31 0.02 0.08 -1.34 0.00 0.00 175.55 174.28 1bro s VAL 250 N 0.34 -0.03 -0.21 3.14 1.01 0.50 -4.95 120.40 120.20 1bro s VAL 250 Ca -0.13 0.12 -0.07 0.00 0.00 0.00 0.00 61.98 61.90 1bro s VAL 250 Cb -0.16 -0.05 -0.04 0.00 0.00 0.00 0.00 36.38 36.13 1bro s VAL 250 CO 0.06 0.05 0.06 -1.61 0.00 0.00 0.00 175.10 173.66 1bro s GLU 251 N 0.61 3.83 -0.47 2.72 2.02 -1.26 -0.79 118.70 125.35 1bro s GLU 251 Ca -0.05 -0.41 -0.15 0.00 0.02 0.00 0.00 54.97 54.38 1bro s GLU 251 Cb -0.07 -3.24 0.08 0.00 0.10 0.00 0.00 34.13 30.99 1bro s GLU 251 CO -0.02 0.09 0.39 0.08 0.02 0.00 0.00 175.26 175.82 1bro s VAL 252 N 0.88 5.15 -0.10 2.63 1.01 0.56 -4.93 120.40 125.60 1bro s VAL 252 Ca 0.03 -1.12 -0.36 0.00 0.00 0.00 0.00 61.98 60.53 1bro s VAL 252 Cb -0.14 -4.10 -0.13 0.00 0.00 0.00 0.00 36.38 32.01 1bro s VAL 252 CO 0.02 -0.59 1.79 1.21 0.00 0.00 0.00 175.10 177.53 1bro n GLU 253 N 5.18 1.87 -0.79 2.72 4.07 -1.26 -1.61 120.64 130.82 1bro n GLU 253 Ca -0.12 0.68 0.00 0.00 -0.06 0.00 0.00 57.16 57.66 1bro n GLU 253 Cb 0.43 -2.47 0.00 0.00 -0.06 0.00 0.00 31.44 29.34 1bro n GLU 253 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1bro n GLY 254 N 4.15 0.78 3.77 8.31 0.00 -1.26 -4.84 105.19 116.09 1bro n GLY 254 Ca 0.23 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.85 1bro n GLY 254 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bro s ALA 255 N -3.01 3.32 0.84 4.61 0.00 -0.98 -4.20 121.76 122.35 1bro s ALA 255 Ca 0.00 1.12 -0.02 0.00 0.00 0.00 0.00 51.96 53.06 1bro s ALA 255 Cb 0.00 -3.43 0.04 0.00 0.00 0.00 0.00 23.12 19.73 1bro s ALA 255 CO 0.00 -0.60 0.24 -0.35 0.00 0.00 0.00 175.76 175.05 1bro n PRO 256 N 0.46 -0.04 -0.20 0.00 -0.04 -1.26 -0.49 135.00 133.43 1bro n PRO 256 Ca 0.02 -0.43 -0.10 0.00 -0.04 0.00 0.00 63.50 62.95 1bro n PRO 256 Cb 0.44 -0.22 0.02 0.00 -0.04 0.00 0.00 33.50 33.69 1bro n PRO 256 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 1bro h HIS 257 N -0.94 1.17 -0.42 0.54 -0.00 -1.74 -3.25 115.15 110.50 1bro h HIS 257 Ca -0.08 -0.23 -0.31 0.00 -0.00 0.00 0.00 60.37 59.75 1bro h HIS 257 Cb 0.23 -0.29 -0.11 0.00 -0.00 0.00 0.00 27.41 27.23 1bro h HIS 257 CO 0.00 1.07 -0.07 0.41 -0.00 0.00 0.00 177.93 179.33 1bro n GLY 258 N -0.31 3.53 0.23 5.26 0.00 0.29 -4.65 105.19 109.54 1bro n GLY 258 Ca 0.02 -1.46 0.16 0.00 0.00 0.00 0.00 46.02 44.74 1bro n GLY 258 CO 0.00 0.00 0.00 0.17 0.00 0.00 0.00 173.32 173.49 1bro h LEU 259 N 4.53 0.00 -1.08 0.99 -0.00 -1.84 -3.10 115.31 114.82 1bro h LEU 259 Ca 0.27 0.00 0.08 0.00 -0.00 0.00 0.00 57.88 58.23 1bro h LEU 259 Cb 1.19 0.00 -0.07 0.00 -0.00 0.00 0.00 40.66 41.79 1bro h LEU 259 CO 0.48 0.00 0.62 -0.07 -0.00 0.00 0.00 178.44 179.47 1bro h LEU 260 N 0.00 0.95 0.00 0.17 3.38 -1.88 0.16 115.31 118.09 1bro h LEU 260 Ca 0.00 0.02 -0.02 0.00 0.09 0.00 0.00 57.88 57.97 1bro h LEU 260 Cb 0.39 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 40.95 1bro h LEU 260 CO 0.00 0.58 -0.56 -0.25 0.09 0.00 0.00 178.44 178.30 1bro h TRP 261 N 1.06 0.00 -0.82 1.13 2.91 -1.86 -3.26 115.95 115.11 1bro h TRP 261 Ca 0.43 0.00 0.06 0.00 1.13 0.00 0.00 58.89 60.51 1bro h TRP 261 Cb 0.28 0.00 -0.05 0.00 -0.51 0.00 0.00 29.16 28.88 1bro h TRP 261 CO -0.00 0.12 0.54 1.79 -1.03 0.00 0.00 178.44 179.85 1bro h THR 262 N -1.00 1.06 -0.71 2.65 1.35 -1.54 -2.66 112.91 112.06 1bro h THR 262 Ca -0.03 -0.32 -0.52 0.00 -0.55 0.00 0.00 66.41 65.00 1bro h THR 262 Cb 0.56 0.06 -0.41 0.00 -1.73 0.00 0.00 68.15 66.63 1bro h THR 262 CO -0.02 0.17 -0.82 1.41 -0.25 0.00 0.00 175.52 176.01 1bro n HIS 263 N -4.48 2.58 -0.29 4.73 8.25 0.56 -4.84 115.22 121.73 1bro n HIS 263 Ca 0.12 -2.19 0.11 0.00 -0.26 0.00 0.00 57.72 55.50 1bro n HIS 263 Cb 0.19 -0.33 0.27 0.00 1.12 0.00 0.00 29.99 31.24 1bro n HIS 263 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1bro h ALA 264 N 2.15 1.30 -0.51 -1.41 0.00 -1.42 -0.53 119.26 118.84 1bro h ALA 264 Ca 0.33 0.16 0.05 0.00 0.00 0.00 0.00 54.91 55.46 1bro h ALA 264 Cb 1.51 0.17 -0.05 0.00 0.00 0.00 0.00 17.79 19.42 1bro h ALA 264 CO 0.71 -0.33 0.24 0.93 0.00 0.00 0.00 179.25 180.80 1bro h GLU 265 N 0.37 0.46 -0.49 0.00 4.39 -1.88 0.49 114.58 117.92 1bro h GLU 265 Ca 0.52 -0.03 -0.08 0.00 0.34 0.00 0.00 59.36 60.11 1bro h GLU 265 Cb 0.96 -0.10 -0.02 0.00 -0.10 0.00 0.00 28.75 29.49 1bro h GLU 265 CO -0.52 0.30 -0.01 0.93 -1.16 0.00 0.00 179.01 178.55 1bro h GLU 266 N 0.47 0.87 -0.19 2.33 3.07 -1.79 -0.47 114.58 118.89 1bro h GLU 266 Ca 0.23 -0.28 -0.03 0.00 -0.50 0.00 0.00 59.36 58.78 1bro h GLU 266 Cb 0.17 -0.08 -0.01 0.00 -0.84 0.00 0.00 28.75 28.00 1bro h GLU 266 CO -0.18 0.91 0.01 0.28 -1.40 0.00 0.00 179.01 178.63 1bro h VAL 267 N 0.73 1.25 -0.56 3.13 2.07 -0.75 -2.82 116.25 119.29 1bro h VAL 267 Ca 0.14 -0.83 0.02 0.00 0.82 0.00 0.00 66.70 66.85 1bro h VAL 267 Cb 0.53 1.43 -0.03 0.00 -1.52 0.00 0.00 31.29 31.69 1bro h VAL 267 CO 0.03 0.25 0.35 0.78 0.02 0.00 0.00 177.57 179.00 1bro h ASN 268 N 0.09 0.58 0.26 0.57 2.35 0.12 -0.25 115.58 119.30 1bro h ASN 268 Ca 0.05 -0.00 0.01 0.00 -0.55 0.00 0.00 56.30 55.81 1bro h ASN 268 Cb 0.37 -0.13 -0.03 0.00 0.05 0.00 0.00 38.32 38.58 1bro h ASN 268 CO 0.01 0.41 -0.41 0.74 -1.65 0.00 0.00 177.43 176.53 1bro h THR 269 N 0.70 0.17 -0.61 2.81 2.02 -1.11 -1.85 112.91 115.04 1bro h THR 269 Ca 0.22 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.42 1bro h THR 269 Cb -0.01 0.17 -0.04 0.00 -1.74 0.00 0.00 68.15 66.54 1bro h THR 269 CO -0.08 0.00 0.38 0.00 0.37 0.00 0.00 175.52 176.19 1bro h ALA 270 N -0.32 0.78 -0.40 6.16 0.00 -1.35 -1.32 119.26 122.82 1bro h ALA 270 Ca -0.01 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 1bro h ALA 270 Cb 0.71 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.28 1bro h ALA 270 CO -0.16 0.13 0.15 1.25 0.00 0.00 0.00 179.25 180.63 1bro h LEU 271 N 0.76 0.56 -0.60 0.00 5.85 -0.95 -1.58 115.31 119.36 1bro h LEU 271 Ca 0.24 -0.18 -0.14 0.00 0.84 0.00 0.00 57.88 58.65 1bro h LEU 271 Cb -0.01 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 40.87 1bro h LEU 271 CO -0.09 0.59 -0.34 -0.07 -0.34 0.00 0.00 178.44 178.19 1bro h LEU 272 N 0.51 0.78 -0.63 2.25 3.38 -1.33 0.38 115.31 120.63 1bro h LEU 272 Ca 0.13 -0.33 -0.06 0.00 0.09 0.00 0.00 57.88 57.72 1bro h LEU 272 Cb 0.21 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.72 1bro h LEU 272 CO -0.01 1.05 0.17 0.00 0.09 0.00 0.00 178.44 179.73 1bro h ALA 273 N 0.99 0.83 -0.46 1.53 0.00 -1.13 -0.60 119.26 120.44 1bro h ALA 273 Ca 0.06 -0.23 -0.06 0.00 0.00 0.00 0.00 54.91 54.69 1bro h ALA 273 Cb 0.87 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.40 1bro h ALA 273 CO 0.08 0.54 0.06 0.35 0.00 0.00 0.00 179.25 180.27 1bro h PHE 274 N 0.93 0.82 0.00 0.00 3.57 -0.81 -2.80 116.94 118.66 1bro h PHE 274 Ca 0.20 -0.12 -0.06 0.00 3.53 0.00 0.00 57.97 61.52 1bro h PHE 274 Cb 0.34 -0.22 -0.01 0.00 2.79 0.00 0.00 35.95 38.85 1bro h PHE 274 CO 0.03 0.78 -0.27 -0.07 -2.23 0.00 0.00 178.31 176.54 1bro h LEU 275 N 0.63 0.00 -2.02 0.59 3.38 -0.07 -2.43 115.31 115.39 1bro h LEU 275 Ca 0.14 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.11 1bro h LEU 275 Cb 0.41 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.16 1bro h LEU 275 CO 0.01 0.27 0.00 0.00 0.09 0.00 0.00 178.44 178.81 1bro h ALA 276 N 1.73 1.00 -0.00 1.53 0.00 -0.83 -3.51 119.26 119.19 1bro h ALA 276 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1bro h ALA 276 Cb 0.61 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.40 1bro h ALA 276 CO 0.03 0.00 0.00 1.63 0.00 0.00 0.00 179.25 180.91