#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2h90 h ALA 3 N 0.00 1.35 0.00 7.33 0.00 -1.98 -2.63 119.26 123.33 2h90 h ALA 3 Ca 0.00 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.73 2h90 h ALA 3 Cb 0.00 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.59 2h90 h ALA 3 CO 0.00 0.47 -0.04 1.25 0.00 0.00 0.00 179.25 180.93 2h90 h LEU 4 N 0.69 0.00 -3.38 0.00 5.85 -1.90 -2.56 115.31 114.01 2h90 h LEU 4 Ca 0.16 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.88 2h90 h LEU 4 Cb 0.23 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.26 2h90 h LEU 4 CO -0.01 0.04 0.00 0.49 -0.34 0.00 0.00 178.44 178.62 2h90 n PHE 5 N -3.83 1.36 -3.31 1.25 3.72 -0.99 -0.89 117.46 114.78 2h90 n PHE 5 Ca -0.03 -0.83 -0.39 0.00 -0.05 0.00 0.00 57.45 56.16 2h90 n PHE 5 Cb 0.13 -0.39 -0.06 0.00 -0.94 0.00 0.00 39.48 38.22 2h90 n PHE 5 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 176.76 175.50 2h90 s GLU 6 N -2.82 4.16 0.97 -1.08 2.02 -0.97 -4.70 118.70 116.28 2h90 s GLU 6 Ca 0.47 0.68 -0.11 0.00 0.02 0.00 0.00 54.97 56.02 2h90 s GLU 6 Cb 0.37 -3.25 0.17 0.00 0.10 0.00 0.00 34.13 31.53 2h90 s GLU 6 CO 0.11 0.62 1.09 -1.25 0.02 0.00 0.00 175.26 175.86 2h90 s PRO 7 N -1.01 0.67 -0.03 0.39 0.04 -1.25 -3.24 135.00 130.56 2h90 s PRO 7 Ca 0.28 1.04 -0.00 0.00 0.04 0.00 0.00 61.00 62.35 2h90 s PRO 7 Cb -0.19 -1.72 0.03 0.00 0.04 0.00 0.00 34.50 32.66 2h90 s PRO 7 CO 0.18 -2.71 0.03 -0.47 0.04 0.00 0.00 177.00 174.07 2h90 s TYR 8 N -2.73 0.14 -0.14 0.56 5.04 -0.34 -4.89 117.35 114.98 2h90 s TYR 8 Ca 0.65 0.11 -0.01 0.00 -2.44 0.00 0.00 57.07 55.39 2h90 s TYR 8 Cb -0.21 -0.36 -0.01 0.00 0.35 0.00 0.00 41.96 41.72 2h90 s TYR 8 CO 0.59 -0.13 -0.12 0.99 -1.34 0.00 0.00 175.55 175.54 2h90 s THR 9 N 1.35 3.10 -0.08 4.34 2.01 -1.26 0.07 115.64 125.17 2h90 s THR 9 Ca -0.05 -0.64 -0.01 0.00 0.31 0.00 0.00 61.69 61.29 2h90 s THR 9 Cb -0.13 -2.31 0.03 0.00 0.01 0.00 0.00 72.50 70.10 2h90 s THR 9 CO -0.03 0.51 0.00 -0.22 -0.69 0.00 0.00 174.62 174.20 2h90 s LEU 10 N 0.47 0.62 0.00 4.42 2.96 -0.26 -5.01 118.68 121.88 2h90 s LEU 10 Ca -0.09 -0.13 0.00 0.00 -0.22 0.00 0.00 54.13 53.69 2h90 s LEU 10 Cb -0.16 -0.45 0.00 0.00 0.50 0.00 0.00 46.19 46.08 2h90 s LEU 10 CO 0.04 -0.20 0.00 0.29 -1.32 0.00 0.00 176.35 175.16 2h90 n LYS 11 N 5.14 0.00 -0.07 1.98 4.76 -1.26 -1.66 118.16 127.05 2h90 n LYS 11 Ca -0.07 0.00 0.12 0.00 -2.87 0.00 0.00 58.31 55.49 2h90 n LYS 11 Cb 0.50 0.00 0.34 0.00 -1.84 0.00 0.00 35.03 34.03 2h90 n LYS 11 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 2h90 n ASP 12 N 4.46 2.19 -4.83 4.39 9.92 -0.41 -4.91 116.55 127.35 2h90 n ASP 12 Ca 0.00 -1.76 -0.36 0.00 -0.53 0.00 0.00 54.79 52.14 2h90 n ASP 12 Cb 0.00 -0.09 -0.07 0.00 -0.64 0.00 0.00 41.12 40.33 2h90 n ASP 12 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 2h90 s VAL 13 N -1.82 5.46 -0.16 2.53 1.01 -0.66 -5.06 120.40 121.69 2h90 s VAL 13 Ca 0.34 0.19 0.01 0.00 0.00 0.00 0.00 61.98 62.52 2h90 s VAL 13 Cb 0.20 -3.41 0.02 0.00 0.00 0.00 0.00 36.38 33.19 2h90 s VAL 13 CO 0.30 0.57 -0.17 -0.89 0.00 0.00 0.00 175.10 174.91 2h90 s THR 14 N -0.64 1.77 -0.01 3.92 2.01 -1.26 -1.10 115.64 120.34 2h90 s THR 14 Ca 0.13 -0.76 -0.18 0.00 0.31 0.00 0.00 61.69 61.18 2h90 s THR 14 Cb -0.12 -1.63 -0.06 0.00 0.01 0.00 0.00 72.50 70.71 2h90 s THR 14 CO 0.02 0.49 0.52 -0.76 -0.69 0.00 0.00 174.62 174.21 2h90 s LEU 15 N 1.37 4.43 0.34 4.42 1.43 0.11 -4.92 118.68 125.86 2h90 s LEU 15 Ca 0.04 1.07 0.26 0.00 -1.03 0.00 0.00 54.13 54.48 2h90 s LEU 15 Cb -0.13 -2.79 1.16 0.00 0.03 0.00 0.00 46.19 44.45 2h90 s LEU 15 CO -0.11 0.18 1.78 0.08 0.23 0.00 0.00 176.35 178.51 2h90 h ARG 16 N 5.35 0.00 0.00 1.70 0.11 -1.86 -0.89 114.38 118.79 2h90 h ARG 16 Ca -0.47 0.00 -0.04 0.00 0.10 0.00 0.00 59.98 59.57 2h90 h ARG 16 Cb 1.20 0.00 0.01 0.00 1.11 0.00 0.00 29.97 32.29 2h90 h ARG 16 CO 0.67 0.00 0.25 0.27 0.10 0.00 0.00 179.97 181.26 2h90 n ASN 17 N -2.42 -2.22 -1.08 0.08 0.23 -1.26 -3.88 115.26 104.72 2h90 n ASN 17 Ca 0.01 -2.59 0.07 0.00 -0.53 0.00 0.00 54.58 51.54 2h90 n ASN 17 Cb 0.20 3.71 0.23 0.00 -2.08 0.00 0.00 39.78 41.83 2h90 n ASN 17 CO 0.00 0.00 0.00 0.54 -0.93 0.00 0.00 177.26 176.87 2h90 n ARG 18 N -0.53 2.64 -3.13 -3.83 5.12 -0.07 -4.49 116.66 112.37 2h90 n ARG 18 Ca -0.08 -1.85 -0.40 0.00 -1.93 0.00 0.00 57.85 53.59 2h90 n ARG 18 Cb 0.58 -1.60 -0.06 0.00 -1.16 0.00 0.00 32.46 30.22 2h90 n ARG 18 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 2h90 s ILE 19 N -1.64 5.03 -0.03 0.55 1.01 -1.26 -0.88 121.20 123.97 2h90 s ILE 19 Ca 0.33 1.16 0.07 0.00 0.00 0.00 0.00 60.65 62.22 2h90 s ILE 19 Cb 0.21 -3.93 -0.02 0.00 0.01 0.00 0.00 42.46 38.72 2h90 s ILE 19 CO 0.18 0.11 -0.25 0.00 0.00 0.00 0.00 174.94 174.98 2h90 s ALA 20 N 1.93 2.10 -0.37 9.38 0.00 -0.38 -1.78 121.76 132.65 2h90 s ALA 20 Ca 0.28 -1.07 -0.13 0.00 0.00 0.00 0.00 51.96 51.03 2h90 s ALA 20 Cb -0.16 -0.56 0.00 0.00 0.00 0.00 0.00 23.12 22.41 2h90 s ALA 20 CO 0.10 0.49 0.25 0.42 0.00 0.00 0.00 175.76 177.03 2h90 s ILE 21 N -0.51 5.13 0.82 0.00 1.09 0.23 -1.22 121.20 126.74 2h90 s ILE 21 Ca 0.07 -0.48 -0.11 0.00 -1.10 0.00 0.00 60.65 59.04 2h90 s ILE 21 Cb -0.10 -3.74 0.08 0.00 -1.06 0.00 0.00 42.46 37.64 2h90 s ILE 21 CO -0.00 -0.14 1.09 -2.16 -0.10 0.00 0.00 174.94 173.63 2h90 s PRO 22 N 1.68 1.91 0.25 2.79 0.04 -1.26 -1.18 135.00 139.22 2h90 s PRO 22 Ca 0.05 1.05 -0.31 0.00 0.04 0.00 0.00 61.00 61.83 2h90 s PRO 22 Cb -0.18 -1.87 -0.12 0.00 0.04 0.00 0.00 34.50 32.37 2h90 s PRO 22 CO 0.09 -1.85 1.62 -0.35 0.04 0.00 0.00 177.00 176.55 2h90 n PRO 23 N -3.65 2.64 -3.59 0.56 -0.04 -1.20 -4.70 135.00 125.03 2h90 n PRO 23 Ca 0.08 0.95 -0.28 0.00 -0.04 0.00 0.00 63.50 64.21 2h90 n PRO 23 Cb 0.54 -2.74 -0.16 0.00 -0.04 0.00 0.00 33.50 31.10 2h90 n PRO 23 CO 0.00 0.00 0.00 -1.64 -0.04 0.00 0.00 175.50 173.82 2h90 s MET 24 N 0.11 0.22 0.27 0.54 -1.94 -1.26 -4.84 119.30 112.39 2h90 s MET 24 Ca 0.69 -0.43 -0.30 0.00 -1.71 0.00 0.00 55.69 53.94 2h90 s MET 24 Cb -0.52 -1.49 -0.14 0.00 2.01 0.00 0.00 34.83 34.69 2h90 s MET 24 CO 0.43 -0.88 1.18 0.00 -0.01 0.00 0.00 175.02 175.73 2h90 n GLN 26 N 1.16 0.77 -2.87 0.00 1.13 -1.26 -5.00 117.38 111.31 2h90 n GLN 26 Ca 0.10 -0.10 -0.20 0.00 -1.94 0.00 0.00 57.00 54.85 2h90 n GLN 26 Cb 0.31 -1.29 0.01 0.00 0.11 0.00 0.00 30.24 29.38 2h90 n GLN 26 CO 0.00 0.00 0.00 0.66 -1.44 0.00 0.00 177.06 176.28 2h90 n TYR 27 N -1.87 -1.64 0.08 1.08 4.01 -1.25 -4.86 117.16 112.71 2h90 n TYR 27 Ca -0.02 0.31 0.03 0.00 -0.16 0.00 0.00 57.90 58.06 2h90 n TYR 27 Cb 0.33 -3.67 0.06 0.00 -0.31 0.00 0.00 39.34 35.75 2h90 n TYR 27 CO 0.00 0.00 0.00 -1.33 -0.46 0.00 0.00 176.86 175.07 2h90 n MET 28 N -3.53 1.41 -2.30 -0.72 2.81 -0.91 -4.61 117.12 109.28 2h90 n MET 28 Ca -0.12 -1.35 -0.29 0.00 -1.81 0.00 0.00 57.70 54.13 2h90 n MET 28 Cb 0.61 -1.14 0.01 0.00 -0.71 0.00 0.00 33.22 31.99 2h90 n MET 28 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2h90 s ALA 29 N -0.77 3.26 -0.13 3.04 0.00 0.04 -4.78 121.76 122.42 2h90 s ALA 29 Ca 0.10 -0.34 0.00 0.00 0.00 0.00 0.00 51.96 51.72 2h90 s ALA 29 Cb 0.06 -2.80 0.02 0.00 0.00 0.00 0.00 23.12 20.41 2h90 s ALA 29 CO 0.09 -0.53 -0.12 -1.21 0.00 0.00 0.00 175.76 173.99 2h90 s GLU 30 N -4.95 2.00 -1.49 0.00 2.02 -0.81 -4.27 118.70 111.19 2h90 s GLU 30 Ca 0.51 -0.44 -0.12 0.00 0.02 0.00 0.00 54.97 54.94 2h90 s GLU 30 Cb -0.11 -1.90 0.08 0.00 0.10 0.00 0.00 34.13 32.30 2h90 s GLU 30 CO 0.49 -0.25 0.84 -0.25 0.02 0.00 0.00 175.26 176.11 2h90 n ASP 31 N 4.84 -4.75 0.00 -0.19 8.00 -1.26 -0.88 116.55 122.30 2h90 n ASP 31 Ca -0.15 -0.65 0.00 0.00 0.71 0.00 0.00 54.79 54.70 2h90 n ASP 31 Cb 0.50 -3.82 0.00 0.00 -0.02 0.00 0.00 41.12 37.78 2h90 n ASP 31 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2h90 n GLY 32 N -1.57 2.96 3.68 0.44 0.00 -1.25 -4.91 105.19 104.54 2h90 n GLY 32 Ca 0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.62 2h90 n GLY 32 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2h90 s MET 33 N 0.00 4.35 0.81 1.61 -1.94 -0.06 -0.60 119.30 123.47 2h90 s MET 33 Ca 0.00 1.19 -0.12 0.00 -1.71 0.00 0.00 55.69 55.05 2h90 s MET 33 Cb 0.00 -3.56 0.08 0.00 2.01 0.00 0.00 34.83 33.35 2h90 s MET 33 CO 0.00 -0.33 1.15 0.96 -0.01 0.00 0.00 175.02 176.79 2h90 s ILE 34 N 2.12 2.36 0.00 2.53 -4.36 -1.26 -1.92 121.20 120.67 2h90 s ILE 34 Ca 0.43 0.12 0.00 0.00 -0.26 0.00 0.00 60.65 60.94 2h90 s ILE 34 Cb -0.17 -3.06 0.00 0.00 1.25 0.00 0.00 42.46 40.48 2h90 s ILE 34 CO 0.14 -0.15 0.00 -0.46 0.24 0.00 0.00 174.94 174.71 2h90 n ASN 35 N -3.34 0.00 0.19 4.36 0.23 -1.26 -4.94 115.26 110.50 2h90 n ASN 35 Ca 0.07 -0.13 0.13 0.00 -0.53 0.00 0.00 54.58 54.13 2h90 n ASN 35 Cb 0.60 0.00 0.65 0.00 -2.08 0.00 0.00 39.78 38.95 2h90 n ASN 35 CO 0.00 0.00 0.00 -0.78 -0.93 0.00 0.00 177.26 175.55 2h90 h ASP 36 N 0.00 0.00 0.05 0.53 3.58 -1.97 -1.71 116.42 116.90 2h90 h ASP 36 Ca 0.00 0.00 -0.00 0.00 0.42 0.00 0.00 57.03 57.45 2h90 h ASP 36 Cb 0.00 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.05 2h90 h ASP 36 CO 0.00 0.00 -0.02 -0.25 -2.88 0.00 0.00 179.24 176.09 2h90 h TRP 37 N 0.00 -0.06 -0.59 0.28 2.91 -1.95 -2.50 115.95 114.03 2h90 h TRP 37 Ca 0.00 -0.00 -0.10 0.00 1.13 0.00 0.00 58.89 59.92 2h90 h TRP 37 Cb 0.16 0.02 -0.02 0.00 -0.51 0.00 0.00 29.16 28.81 2h90 h TRP 37 CO 0.00 0.16 -0.03 0.45 -1.03 0.00 0.00 178.44 177.98 2h90 h HIS 38 N -0.28 1.17 0.20 2.65 -0.00 -1.72 -1.67 115.15 115.50 2h90 h HIS 38 Ca -0.01 -0.22 0.00 0.00 -0.00 0.00 0.00 60.37 60.15 2h90 h HIS 38 Cb 0.25 -0.30 -0.01 0.00 -0.00 0.00 0.00 27.41 27.34 2h90 h HIS 38 CO -0.00 1.04 -0.18 1.25 -0.00 0.00 0.00 177.93 180.04 2h90 h HIS 39 N 0.96 -0.46 -0.52 2.45 -0.00 -1.35 0.58 115.15 116.81 2h90 h HIS 39 Ca 0.16 0.00 -0.08 0.00 -0.00 0.00 0.00 60.37 60.45 2h90 h HIS 39 Cb 0.60 0.18 -0.02 0.00 -0.00 0.00 0.00 27.41 28.17 2h90 h HIS 39 CO 0.04 -0.27 -0.00 0.28 -0.00 0.00 0.00 177.93 177.98 2h90 h VAL 40 N -0.40 1.26 0.20 5.26 2.07 -1.46 -0.02 116.25 123.16 2h90 h VAL 40 Ca -0.00 -1.09 0.00 0.00 0.82 0.00 0.00 66.70 66.43 2h90 h VAL 40 Cb 0.37 0.94 -0.02 0.00 -1.52 0.00 0.00 31.29 31.06 2h90 h VAL 40 CO -0.03 0.39 -0.20 -0.74 0.02 0.00 0.00 177.57 177.00 2h90 h HIS 41 N 0.78 -0.53 -0.22 1.57 6.17 -1.15 0.01 115.15 121.79 2h90 h HIS 41 Ca 0.15 0.00 -0.12 0.00 0.71 0.00 0.00 60.37 61.11 2h90 h HIS 41 Cb 0.53 0.21 -0.00 0.00 2.52 0.00 0.00 27.41 30.66 2h90 h HIS 41 CO 0.04 -0.30 -0.32 -0.07 0.71 0.00 0.00 177.93 177.99 2h90 h LEU 42 N -0.43 0.66 -0.78 0.26 3.38 -0.86 -2.18 115.31 115.36 2h90 h LEU 42 Ca 0.00 -0.52 -0.04 0.00 0.09 0.00 0.00 57.88 57.41 2h90 h LEU 42 Cb 0.41 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 40.94 2h90 h LEU 42 CO -0.05 1.05 0.31 0.00 0.09 0.00 0.00 178.44 179.83 2h90 h ALA 43 N 0.63 1.01 -0.78 1.53 0.00 -1.00 -0.74 119.26 119.92 2h90 h ALA 43 Ca 0.02 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 54.71 2h90 h ALA 43 Cb 0.90 -0.30 -0.04 0.00 0.00 0.00 0.00 17.79 18.35 2h90 h ALA 43 CO 0.07 0.64 0.39 0.78 0.00 0.00 0.00 179.25 181.13 2h90 h GLY 44 N 1.13 1.19 1.05 0.00 0.00 -0.96 -1.96 103.07 103.51 2h90 h GLY 44 Ca 0.26 -0.58 -0.10 0.00 0.00 0.00 0.00 47.33 46.92 2h90 h GLY 44 CO -0.02 0.55 -0.04 1.41 0.00 0.00 0.00 176.54 178.43 2h90 h LEU 45 N 1.09 0.96 -0.94 3.11 3.38 -0.96 -2.67 115.31 119.28 2h90 h LEU 45 Ca 0.27 -0.33 0.02 0.00 0.09 0.00 0.00 57.88 57.94 2h90 h LEU 45 Cb 0.09 -0.26 -0.05 0.00 0.09 0.00 0.00 40.66 40.53 2h90 h LEU 45 CO -0.04 1.06 0.62 0.00 0.09 0.00 0.00 178.44 180.17 2h90 h ALA 46 N 0.94 1.22 0.00 1.53 0.00 -0.77 -0.37 119.26 121.81 2h90 h ALA 46 Ca 0.14 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.00 2h90 h ALA 46 Cb 0.59 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 18.03 2h90 h ALA 46 CO 0.04 0.53 0.00 0.00 0.00 0.00 0.00 179.25 179.81 2h90 h ARG 47 N 1.22 0.00 0.00 0.00 3.08 -1.20 -3.03 114.38 114.45 2h90 h ARG 47 Ca 0.36 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.41 2h90 h ARG 47 Cb -0.06 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 29.99 2h90 h ARG 47 CO -0.10 0.00 -0.02 0.78 -1.07 0.00 0.00 179.97 179.55 2h90 h GLY 48 N 1.95 0.00 0.00 0.04 0.00 -0.71 -3.39 103.07 100.96 2h90 h GLY 48 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2h90 h GLY 48 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.15 2h90 n GLY 49 N -0.67 2.10 3.68 4.60 0.00 -1.15 -3.94 105.19 109.81 2h90 n GLY 49 Ca -0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.59 2h90 n GLY 49 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2h90 n ALA 50 N -0.02 0.99 0.10 4.61 0.00 -1.26 -4.87 120.51 120.07 2h90 n ALA 50 Ca 0.00 0.30 -0.05 0.00 0.00 0.00 0.00 53.44 53.69 2h90 n ALA 50 Cb 0.00 -2.21 0.08 0.00 0.00 0.00 0.00 19.45 17.32 2h90 n ALA 50 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 2h90 h GLY 51 N 2.15 0.13 -5.86 0.00 0.00 -1.57 -3.42 103.07 94.50 2h90 h GLY 51 Ca -0.46 -0.20 -0.36 0.00 0.00 0.00 0.00 47.33 46.32 2h90 h GLY 51 CO 0.60 0.17 -0.76 -2.27 0.00 0.00 0.00 176.54 174.29 2h90 s LEU 52 N -7.58 1.61 -0.25 3.11 2.96 -0.96 -1.38 118.68 116.20 2h90 s LEU 52 Ca -0.02 -0.09 0.02 0.00 -0.22 0.00 0.00 54.13 53.81 2h90 s LEU 52 Cb 0.12 -0.32 0.06 0.00 0.50 0.00 0.00 46.19 46.55 2h90 s LEU 52 CO 0.79 -0.01 -0.06 -0.22 -1.32 0.00 0.00 176.35 175.54 2h90 s LEU 53 N 0.45 2.94 -0.34 -0.68 2.96 -0.56 -0.60 118.68 122.86 2h90 s LEU 53 Ca -0.05 -1.32 -0.16 0.00 -0.22 0.00 0.00 54.13 52.38 2h90 s LEU 53 Cb -0.09 -1.30 -0.01 0.00 0.50 0.00 0.00 46.19 45.29 2h90 s LEU 53 CO -0.00 -0.24 0.39 -0.69 -1.32 0.00 0.00 176.35 174.49 2h90 s VAL 54 N 1.29 5.14 0.51 1.68 1.01 -0.33 -0.79 120.40 128.91 2h90 s VAL 54 Ca -0.05 0.14 -0.23 0.00 0.00 0.00 0.00 61.98 61.84 2h90 s VAL 54 Cb -0.19 -3.84 -0.06 0.00 0.00 0.00 0.00 36.38 32.29 2h90 s VAL 54 CO -0.07 -0.10 1.34 -0.69 0.00 0.00 0.00 175.10 175.59 2h90 s VAL 55 N 2.09 2.25 0.97 2.92 1.01 0.41 -3.22 120.40 126.84 2h90 s VAL 55 Ca 0.13 0.20 -0.14 0.00 0.00 0.00 0.00 61.98 62.17 2h90 s VAL 55 Cb -0.16 -3.10 -0.01 0.00 0.00 0.00 0.00 36.38 33.10 2h90 s VAL 55 CO 0.12 0.01 0.04 -1.84 0.00 0.00 0.00 175.10 173.43 2h90 n GLU 56 N -0.74 -0.28 -1.59 2.72 0.28 -1.26 -2.08 120.64 117.70 2h90 n GLU 56 Ca 0.09 -0.05 -0.54 0.00 -0.16 0.00 0.00 57.16 56.49 2h90 n GLU 56 Cb 0.45 -1.62 -0.07 0.00 1.43 0.00 0.00 31.44 31.63 2h90 n GLU 56 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2h90 n ALA 57 N -3.35 0.40 -3.62 -1.84 0.00 -1.26 -4.20 120.51 106.64 2h90 n ALA 57 Ca 0.04 0.21 -0.35 0.00 0.00 0.00 0.00 53.44 53.34 2h90 n ALA 57 Cb 0.55 -2.36 -0.14 0.00 0.00 0.00 0.00 19.45 17.50 2h90 n ALA 57 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2h90 s THR 58 N 5.09 3.09 0.30 0.00 2.01 0.45 -4.32 115.64 122.27 2h90 s THR 58 Ca 1.03 -0.75 -0.30 0.00 0.31 0.00 0.00 61.69 61.98 2h90 s THR 58 Cb -0.98 -2.47 -0.11 0.00 0.01 0.00 0.00 72.50 68.94 2h90 s THR 58 CO 0.59 0.33 1.58 0.00 -0.69 0.00 0.00 174.62 176.42 2h90 s ALA 59 N 1.40 3.73 -0.85 7.40 0.00 -0.19 -0.78 121.76 132.47 2h90 s ALA 59 Ca 0.03 1.57 0.26 0.00 0.00 0.00 0.00 51.96 53.82 2h90 s ALA 59 Cb -0.15 -3.64 0.74 0.00 0.00 0.00 0.00 23.12 20.07 2h90 s ALA 59 CO -0.04 -0.99 1.62 1.33 0.00 0.00 0.00 175.76 177.68 2h90 n VAL 60 N 1.99 0.22 -3.65 0.00 0.24 -0.32 -1.24 118.33 115.57 2h90 n VAL 60 Ca 0.07 -0.13 -0.14 0.00 -2.04 0.00 0.00 64.34 62.10 2h90 n VAL 60 Cb 0.38 -0.24 -0.07 0.00 -1.47 0.00 0.00 33.84 32.44 2h90 n VAL 60 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2h90 s ALA 61 N -3.06 -1.14 0.20 2.33 0.00 -1.26 -4.36 121.76 114.48 2h90 s ALA 61 Ca 0.11 0.53 -0.12 0.00 0.00 0.00 0.00 51.96 52.48 2h90 s ALA 61 Cb 0.16 0.23 0.25 0.00 0.00 0.00 0.00 23.12 23.75 2h90 s ALA 61 CO 0.63 -0.40 1.68 -1.35 0.00 0.00 0.00 175.76 176.32 2h90 h PRO 62 N 3.18 0.14 0.00 0.00 0.11 -1.96 0.76 132.00 134.23 2h90 h PRO 62 Ca -0.30 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.80 2h90 h PRO 62 Cb 1.19 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.27 2h90 h PRO 62 CO 0.41 0.09 0.00 -0.85 -0.21 0.00 0.00 178.00 177.45 2h90 n GLU 63 N -5.23 0.27 0.00 1.05 0.00 -1.26 -2.31 120.64 113.16 2h90 n GLU 63 Ca 0.07 0.11 0.13 0.00 0.00 0.00 0.00 57.16 57.47 2h90 n GLU 63 Cb 0.31 -1.50 0.46 0.00 0.00 0.00 0.00 31.44 30.71 2h90 n GLU 63 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2h90 n GLY 64 N 0.32 -0.46 3.78 -1.84 0.00 0.26 -4.69 105.19 102.56 2h90 n GLY 64 Ca 0.09 -0.40 -0.33 0.00 0.00 0.00 0.00 46.02 45.38 2h90 n GLY 64 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2h90 s ARG 65 N -2.33 3.14 -0.05 1.61 0.52 -0.98 -0.14 118.95 120.72 2h90 s ARG 65 Ca 0.30 1.38 -0.20 0.00 -0.52 0.00 0.00 55.73 56.68 2h90 s ARG 65 Cb 0.20 -2.00 -0.31 0.00 0.52 0.00 0.00 34.95 33.36 2h90 s ARG 65 CO 0.45 -0.98 0.83 0.82 0.02 0.00 0.00 175.30 176.45 2h90 h ILE 66 N 0.50 1.40 -4.16 1.52 2.04 -1.90 -3.29 117.51 113.63 2h90 h ILE 66 Ca -0.48 -2.52 -0.33 0.00 1.00 0.00 0.00 64.86 62.53 2h90 h ILE 66 Cb 1.24 3.09 -0.14 0.00 -0.74 0.00 0.00 36.82 40.27 2h90 h ILE 66 CO 0.56 0.72 -0.60 0.42 0.00 0.00 0.00 178.15 179.25 2h90 s THR 67 N -2.45 0.28 -1.03 -0.27 -4.23 -1.26 -0.56 115.64 106.12 2h90 s THR 67 Ca -0.15 -2.00 0.09 0.00 -1.18 0.00 0.00 61.69 58.45 2h90 s THR 67 Cb 0.02 -2.55 0.08 0.00 1.34 0.00 0.00 72.50 71.38 2h90 s THR 67 CO 0.82 0.00 1.27 -2.65 -0.54 0.00 0.00 174.62 173.52 2h90 n PRO 68 N -0.43 0.01 -0.20 3.99 -0.02 -1.26 -1.94 135.00 135.15 2h90 n PRO 68 Ca 0.01 0.34 0.09 0.00 -2.02 0.00 0.00 63.50 61.93 2h90 n PRO 68 Cb 0.66 -1.50 0.20 0.00 -0.02 0.00 0.00 33.50 32.84 2h90 n PRO 68 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2h90 n GLY 69 N -0.60 1.89 3.79 -1.23 0.00 -1.26 -4.31 105.19 103.47 2h90 n GLY 69 Ca 0.02 -0.61 -0.36 0.00 0.00 0.00 0.00 46.02 45.08 2h90 n GLY 69 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2h90 s ALA 71 N -1.81 2.72 0.10 0.00 0.00 -1.26 -3.75 121.76 117.76 2h90 s ALA 71 Ca 0.57 0.44 -0.02 0.00 0.00 0.00 0.00 51.96 52.96 2h90 s ALA 71 Cb -0.17 -3.25 -0.04 0.00 0.00 0.00 0.00 23.12 19.66 2h90 s ALA 71 CO 0.22 -0.83 0.04 0.20 0.00 0.00 0.00 175.76 175.39 2h90 s GLY 72 N -2.67 0.71 -0.17 0.00 0.00 0.24 -1.02 107.32 104.41 2h90 s GLY 72 Ca 0.65 -1.30 0.19 0.00 0.00 0.00 0.00 44.72 44.25 2h90 s GLY 72 CO 0.36 -1.30 1.19 4.51 0.00 0.00 0.00 173.10 177.86 2h90 n ILE 73 N -0.01 0.51 1.58 0.90 3.06 -0.37 -4.69 119.36 120.33 2h90 n ILE 73 Ca -0.09 -1.64 0.05 0.00 -2.50 0.00 0.00 62.75 58.56 2h90 n ILE 73 Cb 0.62 1.06 0.22 0.00 0.54 0.00 0.00 39.64 42.08 2h90 n ILE 73 CO 0.00 0.00 0.00 -2.67 -2.50 0.00 0.00 176.55 171.38 2h90 n TRP 74 N -0.39 0.16 -3.68 9.51 2.14 -1.25 -4.57 117.44 119.36 2h90 n TRP 74 Ca -0.02 -0.08 -0.10 0.00 2.07 0.00 0.00 57.50 59.36 2h90 n TRP 74 Cb 0.90 0.00 -0.05 0.00 -0.81 0.00 0.00 31.31 31.35 2h90 n TRP 74 CO 0.00 0.00 0.00 -1.54 2.07 0.00 0.00 177.69 178.22 2h90 s SER 75 N -1.21 -0.17 0.45 -0.67 1.04 -1.26 -4.99 113.70 106.89 2h90 s SER 75 Ca 0.17 -0.33 0.16 0.00 0.48 0.00 0.00 55.95 56.43 2h90 s SER 75 Cb 0.09 0.44 1.04 0.00 0.10 0.00 0.00 66.02 67.68 2h90 s SER 75 CO 0.13 -0.79 1.99 0.44 0.98 0.00 0.00 173.24 175.99 2h90 h ASP 76 N 2.56 0.00 -0.23 7.02 5.19 -1.99 -1.68 116.42 127.29 2h90 h ASP 76 Ca -0.34 0.00 -0.10 0.00 -0.62 0.00 0.00 57.03 55.98 2h90 h ASP 76 Cb 1.24 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 40.73 2h90 h ASP 76 CO 0.48 0.18 -0.17 0.00 -3.12 0.00 0.00 179.24 176.61 2h90 h ALA 77 N 1.82 1.02 -0.49 3.45 0.00 -1.97 0.01 119.26 123.10 2h90 h ALA 77 Ca -0.00 -0.33 -0.12 0.00 0.00 0.00 0.00 54.91 54.46 2h90 h ALA 77 Cb 0.33 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 2h90 h ALA 77 CO 0.02 0.58 -0.16 0.45 0.00 0.00 0.00 179.25 180.15 2h90 h HIS 78 N 0.60 1.08 -0.51 0.00 3.86 -1.65 -2.94 115.15 115.58 2h90 h HIS 78 Ca 0.10 -0.24 -0.11 0.00 -1.16 0.00 0.00 60.37 58.96 2h90 h HIS 78 Cb 0.63 -0.26 -0.02 0.00 1.06 0.00 0.00 27.41 28.82 2h90 h HIS 78 CO 0.03 1.04 -0.11 0.00 0.86 0.00 0.00 177.93 179.74 2h90 h ALA 79 N 0.97 0.82 -0.78 2.45 0.00 -0.96 -2.91 119.26 118.85 2h90 h ALA 79 Ca 0.12 -0.35 0.06 0.00 0.00 0.00 0.00 54.91 54.75 2h90 h ALA 79 Cb 0.71 -0.19 -0.05 0.00 0.00 0.00 0.00 17.79 18.27 2h90 h ALA 79 CO 0.05 0.66 0.51 0.37 0.00 0.00 0.00 179.25 180.84 2h90 h GLN 80 N 0.86 0.83 -0.10 0.00 4.15 -0.85 -1.17 115.11 118.83 2h90 h GLN 80 Ca 0.13 -0.05 0.03 0.00 0.77 0.00 0.00 58.65 59.53 2h90 h GLN 80 Cb 0.66 -0.19 -0.00 0.00 0.21 0.00 0.00 27.48 28.16 2h90 h GLN 80 CO 0.05 0.55 0.09 0.00 -1.93 0.00 0.00 178.83 177.58 2h90 h ALA 81 N 1.57 1.82 0.00 3.38 0.00 -1.34 -1.82 119.26 122.88 2h90 h ALA 81 Ca 0.33 -0.00 -0.03 0.00 0.00 0.00 0.00 54.91 55.21 2h90 h ALA 81 Cb 0.22 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.01 2h90 h ALA 81 CO -0.11 -0.14 -0.26 0.74 0.00 0.00 0.00 179.25 179.48 2h90 h PHE 82 N 0.00 0.00 -0.30 0.00 0.04 -1.30 -3.39 116.94 111.99 2h90 h PHE 82 Ca 0.05 0.00 0.07 0.00 2.80 0.00 0.00 57.97 60.88 2h90 h PHE 82 Cb 0.23 0.00 -0.07 0.00 2.20 0.00 0.00 35.95 38.31 2h90 h PHE 82 CO 0.00 0.14 -0.14 0.28 -0.60 0.00 0.00 178.31 178.00 2h90 h VAL 83 N 0.00 0.57 -0.22 -0.55 2.07 -1.33 0.38 116.25 117.17 2h90 h VAL 83 Ca -0.01 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.48 2h90 h VAL 83 Cb 1.12 0.57 -0.01 0.00 -1.52 0.00 0.00 31.29 31.44 2h90 h VAL 83 CO 0.02 0.00 -0.02 -0.65 0.02 0.00 0.00 177.57 176.94 2h90 h PRO 84 N -0.09 0.32 -0.14 1.57 0.11 -1.76 -1.31 132.00 130.71 2h90 h PRO 84 Ca 0.16 -0.06 -0.08 0.00 0.11 0.00 0.00 66.00 66.13 2h90 h PRO 84 Cb 0.32 -0.05 -0.00 0.00 0.11 0.00 0.00 31.00 31.38 2h90 h PRO 84 CO -0.36 0.37 -0.21 0.28 -0.21 0.00 0.00 178.00 177.86 2h90 h VAL 85 N 0.31 1.36 -0.61 3.15 2.07 -1.58 -1.64 116.25 119.32 2h90 h VAL 85 Ca 0.07 -1.44 0.02 0.00 0.82 0.00 0.00 66.70 66.17 2h90 h VAL 85 Cb 0.25 1.97 -0.04 0.00 -1.52 0.00 0.00 31.29 31.95 2h90 h VAL 85 CO 0.01 0.42 0.38 0.58 0.02 0.00 0.00 177.57 178.99 2h90 h VAL 86 N -0.00 1.10 -0.27 2.57 2.07 -0.70 -0.33 116.25 120.68 2h90 h VAL 86 Ca 0.01 -0.26 -0.06 0.00 0.82 0.00 0.00 66.70 67.21 2h90 h VAL 86 Cb 0.78 0.27 -0.02 0.00 -1.52 0.00 0.00 31.29 30.80 2h90 h VAL 86 CO 0.05 0.14 -0.08 1.56 0.02 0.00 0.00 177.57 179.26 2h90 h GLN 87 N 0.77 0.43 -0.20 1.57 4.20 -1.19 -1.61 115.11 119.09 2h90 h GLN 87 Ca 0.24 -0.10 -0.18 0.00 0.06 0.00 0.00 58.65 58.67 2h90 h GLN 87 Cb -0.02 -0.06 -0.00 0.00 0.30 0.00 0.00 27.48 27.71 2h90 h GLN 87 CO -0.08 0.52 -0.59 0.00 -0.67 0.00 0.00 178.83 178.00 2h90 h ALA 88 N 1.52 0.58 -0.39 3.87 0.00 -0.52 -1.44 119.26 122.89 2h90 h ALA 88 Ca 0.08 -0.53 -0.04 0.00 0.00 0.00 0.00 54.91 54.42 2h90 h ALA 88 Cb 0.40 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 2h90 h ALA 88 CO 0.02 0.69 0.10 0.82 0.00 0.00 0.00 179.25 180.88 2h90 h ILE 89 N 0.49 1.22 -0.65 0.00 2.04 -0.73 -2.52 117.51 117.36 2h90 h ILE 89 Ca -0.00 -0.76 -0.06 0.00 1.00 0.00 0.00 64.86 65.04 2h90 h ILE 89 Cb 1.17 0.99 -0.03 0.00 -0.74 0.00 0.00 36.82 38.21 2h90 h ILE 89 CO 0.12 0.26 0.17 0.11 0.00 0.00 0.00 178.15 178.81 2h90 h LYS 90 N 0.48 1.01 0.00 2.37 1.57 -1.24 -2.13 116.57 118.62 2h90 h LYS 90 Ca 0.12 -0.22 -0.01 0.00 -1.87 0.00 0.00 60.65 58.67 2h90 h LYS 90 Cb 0.30 -0.14 -0.00 0.00 0.08 0.00 0.00 32.23 32.46 2h90 h LYS 90 CO 0.00 0.89 -0.06 0.00 -0.57 0.00 0.00 179.45 179.72 2h90 h ALA 91 N 1.21 1.72 -0.00 3.86 0.00 -1.02 -0.81 119.26 124.22 2h90 h ALA 91 Ca 0.21 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.07 2h90 h ALA 91 Cb 0.33 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.11 2h90 h ALA 91 CO -0.00 0.07 -0.14 0.00 0.00 0.00 0.00 179.25 179.18 2h90 n ALA 92 N -2.44 2.80 -0.60 0.00 0.00 -0.82 -4.93 120.51 114.51 2h90 n ALA 92 Ca -0.03 -0.27 0.00 0.00 0.00 0.00 0.00 53.44 53.14 2h90 n ALA 92 Cb 0.14 -1.32 0.00 0.00 0.00 0.00 0.00 19.45 18.27 2h90 n ALA 92 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2h90 n GLY 93 N 1.32 0.75 3.93 0.00 0.00 -0.31 -4.70 105.19 106.18 2h90 n GLY 93 Ca 0.13 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.89 2h90 n GLY 93 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2h90 s SER 94 N -2.46 6.37 -0.16 1.61 0.15 -1.08 -4.77 113.70 113.36 2h90 s SER 94 Ca 0.00 0.33 -0.22 0.00 0.70 0.00 0.00 55.95 56.76 2h90 s SER 94 Cb 0.00 -1.98 -0.03 0.00 -1.71 0.00 0.00 66.02 62.30 2h90 s SER 94 CO 0.00 -0.04 0.66 -0.69 1.20 0.00 0.00 173.24 174.37 2h90 s VAL 95 N -1.87 5.02 -0.22 4.45 1.01 -0.48 -3.97 120.40 124.34 2h90 s VAL 95 Ca 0.37 1.28 -0.26 0.00 0.00 0.00 0.00 61.98 63.37 2h90 s VAL 95 Cb -0.11 -3.98 -0.00 0.00 0.00 0.00 0.00 36.38 32.29 2h90 s VAL 95 CO 0.29 0.15 0.91 -2.16 0.00 0.00 0.00 175.10 174.29 2h90 s PRO 96 N 1.57 4.23 0.32 2.72 0.04 -1.26 -1.49 135.00 141.13 2h90 s PRO 96 Ca 0.32 1.11 0.06 0.00 0.04 0.00 0.00 61.00 62.53 2h90 s PRO 96 Cb -0.16 -3.63 -0.06 0.00 0.04 0.00 0.00 34.50 30.69 2h90 s PRO 96 CO 0.12 -0.52 -0.02 0.20 0.04 0.00 0.00 177.00 176.82 2h90 s GLY 97 N 1.26 2.02 -0.12 0.56 0.00 0.03 -1.00 107.32 110.07 2h90 s GLY 97 Ca 0.39 -2.02 -0.13 0.00 0.00 0.00 0.00 44.72 42.96 2h90 s GLY 97 CO 0.08 -1.89 0.35 -1.50 0.00 0.00 0.00 173.10 170.15 2h90 s ILE 98 N -3.02 0.01 -0.31 0.90 2.07 -0.61 -0.44 121.20 119.81 2h90 s ILE 98 Ca 0.32 -0.06 -0.11 0.00 -1.41 0.00 0.00 60.65 59.39 2h90 s ILE 98 Cb 0.06 -0.52 -0.03 0.00 0.13 0.00 0.00 42.46 42.10 2h90 s ILE 98 CO 0.14 -0.03 0.20 -1.58 -1.91 0.00 0.00 174.94 171.76 2h90 s GLN 99 N -0.01 3.67 -0.06 3.50 0.74 -0.88 -1.05 119.66 125.57 2h90 s GLN 99 Ca -0.02 -0.51 -0.08 0.00 0.05 0.00 0.00 55.36 54.80 2h90 s GLN 99 Cb -0.03 -3.68 -0.04 0.00 1.10 0.00 0.00 33.01 30.36 2h90 s GLN 99 CO 0.01 -0.32 0.22 0.96 -0.55 0.00 0.00 175.29 175.62 2h90 s ILE 100 N 1.72 5.36 0.34 -2.34 -4.36 -0.54 -0.41 121.20 120.97 2h90 s ILE 100 Ca 0.06 0.31 -0.07 0.00 -0.26 0.00 0.00 60.65 60.70 2h90 s ILE 100 Cb -0.17 -3.51 0.01 0.00 1.25 0.00 0.00 42.46 40.05 2h90 s ILE 100 CO 0.10 0.54 0.55 0.00 0.24 0.00 0.00 174.94 176.37 2h90 s ALA 101 N -1.11 0.29 -0.22 2.27 0.00 0.04 -1.59 121.76 121.45 2h90 s ALA 101 Ca 0.20 -1.26 -0.05 0.00 0.00 0.00 0.00 51.96 50.86 2h90 s ALA 101 Cb -0.13 1.03 0.11 0.00 0.00 0.00 0.00 23.12 24.13 2h90 s ALA 101 CO 0.09 -0.85 0.39 -1.58 0.00 0.00 0.00 175.76 173.81 2h90 s HIS 102 N -3.00 -0.79 -0.52 0.00 2.46 -1.26 -1.17 115.29 111.01 2h90 s HIS 102 Ca 0.26 1.13 0.19 0.00 0.47 0.00 0.00 55.06 57.10 2h90 s HIS 102 Cb -0.02 0.13 0.88 0.00 -0.13 0.00 0.00 32.58 33.45 2h90 s HIS 102 CO 0.17 -0.60 1.58 0.00 -2.47 0.00 0.00 174.74 173.42 2h90 n ALA 103 N 5.37 1.39 -0.78 1.58 0.00 0.80 -1.44 120.51 127.43 2h90 n ALA 103 Ca -0.06 0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.48 2h90 n ALA 103 Cb 0.50 -1.30 0.00 0.00 0.00 0.00 0.00 19.45 18.65 2h90 n ALA 103 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2h90 n GLY 104 N -0.59 3.30 0.04 0.00 0.00 -1.26 -1.49 105.19 105.19 2h90 n GLY 104 Ca 0.01 -0.10 0.09 0.00 0.00 0.00 0.00 46.02 46.02 2h90 n GLY 104 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2h90 n ARG 105 N 14.00 0.06 -0.15 1.61 1.85 -1.18 -2.20 116.66 130.65 2h90 n ARG 105 Ca 0.00 0.27 0.10 0.00 -1.00 0.00 0.00 57.85 57.21 2h90 n ARG 105 Cb 0.00 -1.60 0.29 0.00 -1.05 0.00 0.00 32.46 30.09 2h90 n ARG 105 CO 0.00 0.00 0.00 1.63 -0.01 0.00 0.00 177.63 179.25 2h90 n LYS 106 N -1.71 1.95 -1.66 2.89 5.02 -0.56 -4.87 118.16 119.23 2h90 n LYS 106 Ca 0.04 -1.45 -0.29 0.00 -2.02 0.00 0.00 58.31 54.58 2h90 n LYS 106 Cb 0.21 -1.40 0.16 0.00 -0.02 0.00 0.00 35.03 33.99 2h90 n LYS 106 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2h90 s ALA 107 N -1.62 1.87 -1.30 7.82 0.00 -0.94 -4.36 121.76 123.24 2h90 s ALA 107 Ca 0.32 -0.86 -0.03 0.00 0.00 0.00 0.00 51.96 51.39 2h90 s ALA 107 Cb 0.18 -2.90 0.01 0.00 0.00 0.00 0.00 23.12 20.40 2h90 s ALA 107 CO 0.25 -2.48 0.91 0.45 0.00 0.00 0.00 175.76 174.89 2h90 n SER 108 N -3.87 -2.64 -4.63 0.00 2.88 -0.77 -4.89 113.62 99.69 2h90 n SER 108 Ca 0.11 -0.70 -0.23 0.00 -1.33 0.00 0.00 58.87 56.71 2h90 n SER 108 Cb 0.60 -4.57 -0.08 0.00 -0.75 0.00 0.00 64.21 59.41 2h90 n SER 108 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2h90 s ALA 109 N -3.46 3.15 0.64 -1.46 0.00 0.27 -1.38 121.76 119.52 2h90 s ALA 109 Ca 0.16 -1.77 -0.12 0.00 0.00 0.00 0.00 51.96 50.23 2h90 s ALA 109 Cb -0.08 -0.61 -0.02 0.00 0.00 0.00 0.00 23.12 22.41 2h90 s ALA 109 CO 0.77 0.20 1.04 -0.80 0.00 0.00 0.00 175.76 176.97 2h90 s ASN 110 N -3.68 5.82 0.75 0.00 -0.87 0.82 -4.13 114.94 113.65 2h90 s ASN 110 Ca 0.33 1.57 -0.15 0.00 -1.57 0.00 0.00 52.86 53.04 2h90 s ASN 110 Cb -0.04 -2.49 0.05 0.00 -0.02 0.00 0.00 41.25 38.74 2h90 s ASN 110 CO 0.19 -1.14 1.23 -0.13 -2.57 0.00 0.00 177.10 174.68 2h90 s ARG 111 N -4.89 1.99 0.35 -0.60 0.52 -1.26 -3.92 118.95 111.14 2h90 s ARG 111 Ca 0.58 1.84 0.08 0.00 -0.52 0.00 0.00 55.73 57.70 2h90 s ARG 111 Cb -0.13 -1.81 0.78 0.00 0.52 0.00 0.00 34.95 34.32 2h90 s ARG 111 CO 0.50 -1.97 1.88 -1.35 0.02 0.00 0.00 175.30 174.39 2h90 h PRO 112 N -0.38 0.71 -0.54 3.54 0.11 -1.94 -0.21 132.00 133.29 2h90 h PRO 112 Ca -0.48 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.59 2h90 h PRO 112 Cb 1.31 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 32.26 2h90 h PRO 112 CO 0.49 0.47 0.00 -2.67 -0.21 0.00 0.00 178.00 176.08 2h90 n TRP 113 N -4.55 0.79 -2.13 0.65 2.14 -1.26 -3.74 117.44 109.34 2h90 n TRP 113 Ca 0.16 -0.34 -0.02 0.00 2.07 0.00 0.00 57.50 59.38 2h90 n TRP 113 Cb 0.42 -0.11 0.09 0.00 -0.81 0.00 0.00 31.31 30.91 2h90 n TRP 113 CO 0.00 0.00 0.00 0.39 2.07 0.00 0.00 177.69 180.15 2h90 n GLU 114 N 0.67 1.58 0.00 -2.67 1.02 -0.20 -4.95 120.64 116.09 2h90 n GLU 114 Ca 0.15 -3.15 0.00 0.00 -0.02 0.00 0.00 57.16 54.14 2h90 n GLU 114 Cb 0.51 -1.30 0.00 0.00 -0.02 0.00 0.00 31.44 30.63 2h90 n GLU 114 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2h90 n GLY 115 N -0.50 2.60 3.08 0.62 0.00 -1.20 -4.53 105.19 105.25 2h90 n GLY 115 Ca 0.19 -0.88 0.00 0.00 0.00 0.00 0.00 46.02 45.32 2h90 n GLY 115 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2h90 n ASP 116 N 0.12 -5.50 -4.82 1.61 2.03 -0.57 -4.94 116.55 104.48 2h90 n ASP 116 Ca 0.00 0.00 -0.23 0.00 0.52 0.00 0.00 54.79 55.08 2h90 n ASP 116 Cb 0.00 -3.41 -0.05 0.00 -0.72 0.00 0.00 41.12 36.95 2h90 n ASP 116 CO 0.00 0.00 0.00 1.51 -1.92 0.00 0.00 177.20 176.79 2h90 s ASP 117 N -2.00 4.75 0.33 1.67 -4.77 -1.26 -4.68 116.67 110.71 2h90 s ASP 117 Ca 0.00 -0.93 -0.29 0.00 -3.30 0.00 0.00 52.55 48.03 2h90 s ASP 117 Cb 0.00 -0.44 -0.11 0.00 -1.09 0.00 0.00 42.92 41.28 2h90 s ASP 117 CO 0.00 -0.65 1.55 -1.00 0.70 0.00 0.00 175.17 175.76 2h90 s HIS 118 N -2.56 2.67 0.33 2.11 3.76 -0.69 -0.12 115.29 120.78 2h90 s HIS 118 Ca 0.44 0.95 -0.29 0.00 -0.15 0.00 0.00 55.06 56.01 2h90 s HIS 118 Cb -0.00 -4.05 -0.10 0.00 1.11 0.00 0.00 32.58 29.53 2h90 s HIS 118 CO 0.25 -3.34 1.32 0.42 -0.85 0.00 0.00 174.74 172.55 2h90 s ILE 119 N -0.52 2.68 0.57 0.60 1.01 -0.48 -4.79 121.20 120.28 2h90 s ILE 119 Ca 0.58 0.68 -0.20 0.00 0.00 0.00 0.00 60.65 61.71 2h90 s ILE 119 Cb -0.47 -3.43 -0.05 0.00 0.01 0.00 0.00 42.46 38.52 2h90 s ILE 119 CO 0.55 0.16 1.15 0.00 0.00 0.00 0.00 174.94 176.80 2h90 n ALA 120 N 0.88 0.79 0.12 9.38 0.00 -1.26 -4.89 120.51 125.53 2h90 n ALA 120 Ca 0.00 0.07 0.08 0.00 0.00 0.00 0.00 53.44 53.59 2h90 n ALA 120 Cb 0.42 -2.22 0.56 0.00 0.00 0.00 0.00 19.45 18.20 2h90 n ALA 120 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2h90 h ALA 121 N 0.93 1.93 -0.23 0.00 0.00 -2.01 -2.04 119.26 117.86 2h90 h ALA 121 Ca -0.49 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.41 2h90 h ALA 121 Cb 1.34 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.07 2h90 h ALA 121 CO 0.54 0.04 0.00 -0.40 0.00 0.00 0.00 179.25 179.43 2h90 n ASP 122 N -4.50 2.08 -4.68 0.00 5.68 -1.26 -4.86 116.55 109.01 2h90 n ASP 122 Ca 0.01 -1.79 -0.43 0.00 -0.50 0.00 0.00 54.79 52.08 2h90 n ASP 122 Cb 0.14 -0.14 -0.02 0.00 -1.14 0.00 0.00 41.12 39.95 2h90 n ASP 122 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 2h90 s ASP 123 N -1.52 7.18 0.14 -1.12 -1.08 -0.77 -4.91 116.67 114.60 2h90 s ASP 123 Ca 0.33 1.47 0.12 0.00 -0.52 0.00 0.00 52.55 53.96 2h90 s ASP 123 Cb 0.18 -2.55 0.61 0.00 -1.46 0.00 0.00 42.92 39.70 2h90 s ASP 123 CO 0.27 -0.55 1.38 0.35 0.52 0.00 0.00 175.17 177.14 2h90 n THR 124 N 4.88 1.39 0.26 1.71 -2.24 -1.26 -1.84 114.28 117.18 2h90 n THR 124 Ca 0.10 0.52 0.12 0.00 -2.27 0.00 0.00 64.05 62.52 2h90 n THR 124 Cb 0.47 -1.48 0.11 0.00 -2.10 0.00 0.00 70.33 67.34 2h90 n THR 124 CO 0.00 0.00 0.00 0.03 -0.57 0.00 0.00 175.07 174.53 2h90 h ARG 125 N 0.00 0.00 -7.53 -0.78 3.08 -1.93 -3.48 114.38 103.74 2h90 h ARG 125 Ca 0.00 0.00 -0.46 0.00 0.07 0.00 0.00 59.98 59.59 2h90 h ARG 125 Cb 0.08 0.00 0.13 0.00 0.08 0.00 0.00 29.97 30.26 2h90 h ARG 125 CO 0.00 0.00 0.32 0.20 -1.07 0.00 0.00 179.97 179.42 2h90 s GLY 126 N -4.14 1.59 0.18 0.04 0.00 -0.77 -4.90 107.32 99.33 2h90 s GLY 126 Ca 0.04 -0.62 -0.22 0.00 0.00 0.00 0.00 44.72 43.91 2h90 s GLY 126 CO 0.73 -0.04 0.60 0.66 0.00 0.00 0.00 173.10 175.05 2h90 s TRP 127 N -3.36 -0.42 0.22 1.90 -2.14 -1.26 -5.05 118.94 108.83 2h90 s TRP 127 Ca 0.65 0.14 -0.30 0.00 2.66 0.00 0.00 56.10 59.25 2h90 s TRP 127 Cb -0.13 0.55 -0.09 0.00 -3.10 0.00 0.00 33.47 30.71 2h90 s TRP 127 CO 0.53 -0.92 1.26 -2.00 -2.66 0.00 0.00 176.95 173.16 2h90 s GLU 128 N -3.80 4.44 0.20 3.25 2.12 -1.26 -4.76 118.70 118.89 2h90 s GLU 128 Ca 0.04 2.00 -0.05 0.00 0.36 0.00 0.00 54.97 57.32 2h90 s GLU 128 Cb -0.02 -3.19 -0.05 0.00 0.26 0.00 0.00 34.13 31.13 2h90 s GLU 128 CO -0.08 -0.15 0.45 0.95 -0.54 0.00 0.00 175.26 175.88 2h90 s THR 129 N -0.25 5.11 0.09 -1.70 -4.23 -1.26 -4.95 115.64 108.44 2h90 s THR 129 Ca 0.53 0.02 0.08 0.00 -1.18 0.00 0.00 61.69 61.14 2h90 s THR 129 Cb -0.35 -3.67 -0.03 0.00 1.34 0.00 0.00 72.50 69.78 2h90 s THR 129 CO 0.40 -0.11 -0.21 0.27 -0.54 0.00 0.00 174.62 174.43 2h90 s ILE 130 N -1.83 1.74 0.34 2.99 -4.36 -1.26 -0.63 121.20 118.21 2h90 s ILE 130 Ca 0.42 -1.47 -0.17 0.00 -0.26 0.00 0.00 60.65 59.17 2h90 s ILE 130 Cb -0.11 -1.56 0.04 0.00 1.25 0.00 0.00 42.46 42.07 2h90 s ILE 130 CO 0.26 0.02 0.74 0.00 0.24 0.00 0.00 174.94 176.21 2h90 s ALA 131 N -1.06 -0.82 0.28 2.27 0.00 -0.69 -3.13 121.76 118.60 2h90 s ALA 131 Ca 0.07 -0.64 -0.04 0.00 0.00 0.00 0.00 51.96 51.36 2h90 s ALA 131 Cb -0.10 0.76 0.36 0.00 0.00 0.00 0.00 23.12 24.15 2h90 s ALA 131 CO 0.04 -0.99 1.92 -1.35 0.00 0.00 0.00 175.76 175.38 2h90 h PRO 132 N 2.01 1.13 -4.08 0.00 0.11 -1.86 -0.65 132.00 128.67 2h90 h PRO 132 Ca -0.27 -0.10 -0.14 0.00 0.11 0.00 0.00 66.00 65.59 2h90 h PRO 132 Cb 1.25 -0.24 -0.18 0.00 0.11 0.00 0.00 31.00 31.94 2h90 h PRO 132 CO 0.35 0.79 -0.67 -1.12 -0.21 0.00 0.00 178.00 177.14 2h90 s SER 133 N -6.29 0.35 -1.37 -2.05 0.01 -1.25 -4.25 113.70 98.85 2h90 s SER 133 Ca -0.12 -0.73 -0.15 0.00 1.31 0.00 0.00 55.95 56.26 2h90 s SER 133 Cb 0.17 0.16 0.01 0.00 0.21 0.00 0.00 66.02 66.57 2h90 s SER 133 CO 0.81 -0.46 2.22 0.00 0.41 0.00 0.00 173.24 176.22 2h90 n ALA 134 N 0.82 5.33 -3.43 1.44 0.00 -1.26 -4.68 120.51 118.74 2h90 n ALA 134 Ca -0.19 -3.77 -0.18 0.00 0.00 0.00 0.00 53.44 49.30 2h90 n ALA 134 Cb 0.58 -3.54 -0.16 0.00 0.00 0.00 0.00 19.45 16.33 2h90 n ALA 134 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2h90 s ILE 135 N 3.40 0.37 0.42 0.00 1.09 -1.26 -4.84 121.20 120.38 2h90 s ILE 135 Ca 0.49 -0.08 -0.15 0.00 -1.10 0.00 0.00 60.65 59.82 2h90 s ILE 135 Cb 0.14 -0.40 -0.08 0.00 -1.06 0.00 0.00 42.46 41.06 2h90 s ILE 135 CO -0.06 0.17 0.85 0.00 -0.10 0.00 0.00 174.94 175.80 2h90 s ALA 136 N 0.66 3.21 0.12 9.38 0.00 -1.26 -4.47 121.76 129.40 2h90 s ALA 136 Ca -0.08 0.06 -0.16 0.00 0.00 0.00 0.00 51.96 51.78 2h90 s ALA 136 Cb -0.11 -2.91 -0.02 0.00 0.00 0.00 0.00 23.12 20.08 2h90 s ALA 136 CO -0.01 0.03 1.65 0.35 0.00 0.00 0.00 175.76 177.79 2h90 h PHE 137 N 1.51 0.58 0.00 0.00 3.57 -1.78 -3.50 116.94 117.33 2h90 h PHE 137 Ca -0.48 -0.05 0.00 0.00 3.53 0.00 0.00 57.97 60.97 2h90 h PHE 137 Cb 1.18 -0.17 0.00 0.00 2.79 0.00 0.00 35.95 39.75 2h90 h PHE 137 CO 0.62 0.55 0.00 0.41 -2.23 0.00 0.00 178.31 177.66 2h90 n GLY 138 N -0.68 -1.36 7.00 2.40 0.00 -0.68 -4.40 105.19 107.47 2h90 n GLY 138 Ca -0.01 -2.09 0.00 0.00 0.00 0.00 0.00 46.02 43.92 2h90 n GLY 138 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2h90 n ALA 139 N -0.20 0.00 1.48 4.61 0.00 -1.26 -0.40 120.51 124.74 2h90 n ALA 139 Ca 0.00 0.00 0.14 0.00 0.00 0.00 0.00 53.44 53.58 2h90 n ALA 139 Cb 0.00 0.00 0.75 0.00 0.00 0.00 0.00 19.45 20.20 2h90 n ALA 139 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.50 175.11 2h90 n HIS 140 N 14.00 0.00 -3.31 0.00 1.44 -1.26 -3.91 115.22 122.18 2h90 n HIS 140 Ca 0.00 0.00 -0.26 0.00 -2.01 0.00 0.00 57.72 55.45 2h90 n HIS 140 Cb 0.00 -0.18 -0.07 0.00 0.12 0.00 0.00 29.99 29.86 2h90 n HIS 140 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 2h90 n LEU 141 N -1.18 2.96 0.03 2.39 4.77 0.47 -1.71 117.00 124.72 2h90 n LEU 141 Ca 0.16 -5.29 0.12 0.00 -0.03 0.00 0.00 56.01 50.97 2h90 n LEU 141 Cb 0.17 -0.32 0.52 0.00 -2.33 0.00 0.00 43.42 41.46 2h90 n LEU 141 CO 0.19 2.10 0.90 -0.81 -1.33 0.00 0.00 177.39 178.44 2h90 n PRO 142 N 0.82 0.06 -1.72 3.23 -0.04 -1.23 -1.68 135.00 134.44 2h90 n PRO 142 Ca 0.28 0.11 -0.42 0.00 -0.04 0.00 0.00 63.50 63.43 2h90 n PRO 142 Cb 0.44 -1.57 -0.03 0.00 -0.04 0.00 0.00 33.50 32.30 2h90 n PRO 142 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 2h90 s LYS 143 N -3.04 4.12 -0.22 0.54 1.02 -1.26 -4.79 119.74 116.12 2h90 s LYS 143 Ca 0.12 2.62 -0.24 0.00 0.02 0.00 0.00 55.97 58.49 2h90 s LYS 143 Cb 0.15 -3.07 -0.01 0.00 -0.52 0.00 0.00 37.83 34.38 2h90 s LYS 143 CO 0.48 -0.76 0.78 0.08 -0.92 0.00 0.00 175.35 175.01 2h90 s VAL 144 N 1.18 4.89 0.73 3.17 1.01 -1.26 -4.46 120.40 125.66 2h90 s VAL 144 Ca 0.75 1.48 -0.11 0.00 0.00 0.00 0.00 61.98 64.09 2h90 s VAL 144 Cb -0.50 -4.08 0.03 0.00 0.00 0.00 0.00 36.38 31.83 2h90 s VAL 144 CO 0.32 -0.01 1.09 -2.16 0.00 0.00 0.00 175.10 174.34 2h90 s PRO 145 N 2.47 2.67 0.02 2.72 0.04 -1.26 -4.84 135.00 136.82 2h90 s PRO 145 Ca 0.34 0.59 -0.22 0.00 0.04 0.00 0.00 61.00 61.75 2h90 s PRO 145 Cb -0.16 -1.99 -0.06 0.00 0.04 0.00 0.00 34.50 32.34 2h90 s PRO 145 CO 0.09 -1.20 0.65 0.50 0.04 0.00 0.00 177.00 177.09 2h90 s ARG 146 N -5.25 4.37 -0.00 4.56 3.52 0.20 -4.21 118.95 122.14 2h90 s ARG 146 Ca 0.59 0.85 -0.30 0.00 -0.13 0.00 0.00 55.73 56.74 2h90 s ARG 146 Cb -0.12 -3.34 -0.06 0.00 -1.56 0.00 0.00 34.95 29.87 2h90 s ARG 146 CO 0.53 0.37 1.56 -2.00 -0.81 0.00 0.00 175.30 174.95 2h90 s GLU 147 N -0.26 4.22 0.36 5.12 2.12 -1.26 -1.70 118.70 127.30 2h90 s GLU 147 Ca 0.33 2.14 -0.28 0.00 0.36 0.00 0.00 54.97 57.53 2h90 s GLU 147 Cb -0.19 -3.72 -0.10 0.00 0.26 0.00 0.00 34.13 30.38 2h90 s GLU 147 CO 0.19 -0.72 1.32 -1.64 -0.54 0.00 0.00 175.26 173.87 2h90 s MET 148 N 3.06 4.22 0.67 4.30 -1.94 -0.25 -4.92 119.30 124.43 2h90 s MET 148 Ca 0.70 2.22 -0.04 0.00 -1.71 0.00 0.00 55.69 56.86 2h90 s MET 148 Cb -0.34 -2.96 0.07 0.00 2.01 0.00 0.00 34.83 33.60 2h90 s MET 148 CO 0.29 -0.30 0.95 0.95 -0.01 0.00 0.00 175.02 176.89 2h90 s THR 149 N -1.18 2.37 0.35 2.05 -4.23 -1.26 -4.91 115.64 108.83 2h90 s THR 149 Ca 0.52 -0.42 0.05 0.00 -1.18 0.00 0.00 61.69 60.66 2h90 s THR 149 Cb -0.40 -2.95 0.17 0.00 1.34 0.00 0.00 72.50 70.67 2h90 s THR 149 CO 0.52 0.00 1.90 -0.07 -0.54 0.00 0.00 174.62 176.43 2h90 h LEU 150 N -0.43 0.45 -0.90 4.79 3.38 -1.99 -1.63 115.31 118.98 2h90 h LEU 150 Ca -0.43 -0.08 -0.11 0.00 0.09 0.00 0.00 57.88 57.36 2h90 h LEU 150 Cb 1.30 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.92 2h90 h LEU 150 CO 0.54 0.51 -0.37 0.44 0.09 0.00 0.00 178.44 179.66 2h90 h ASP 151 N 0.47 0.37 -0.50 -0.43 5.19 -1.99 -0.78 116.42 118.76 2h90 h ASP 151 Ca 0.10 -0.15 -0.03 0.00 -0.62 0.00 0.00 57.03 56.34 2h90 h ASP 151 Cb 0.29 -0.10 -0.02 0.00 0.18 0.00 0.00 39.33 39.67 2h90 h ASP 151 CO 0.01 0.71 0.19 0.44 -3.12 0.00 0.00 179.24 177.47 2h90 h ASP 152 N 0.30 0.69 -0.46 6.45 3.32 -1.69 0.24 116.42 125.27 2h90 h ASP 152 Ca 0.03 -0.17 -0.01 0.00 0.02 0.00 0.00 57.03 56.90 2h90 h ASP 152 Cb 0.79 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 40.14 2h90 h ASP 152 CO 0.06 0.67 0.26 0.40 -1.72 0.00 0.00 179.24 178.91 2h90 h ILE 153 N 0.66 1.16 -0.77 0.35 2.04 -0.95 0.28 117.51 120.28 2h90 h ILE 153 Ca 0.17 -0.40 -0.02 0.00 1.00 0.00 0.00 64.86 65.60 2h90 h ILE 153 Cb 0.20 0.59 -0.04 0.00 -0.74 0.00 0.00 36.82 36.84 2h90 h ILE 153 CO -0.01 0.17 0.41 0.00 0.00 0.00 0.00 178.15 178.71 2h90 h ALA 154 N 1.10 0.99 -0.23 1.87 0.00 -0.87 -1.58 119.26 120.55 2h90 h ALA 154 Ca 0.16 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 2h90 h ALA 154 Cb 0.04 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.51 2h90 h ALA 154 CO -0.03 0.52 0.04 -0.09 0.00 0.00 0.00 179.25 179.69 2h90 h ARG 155 N 1.08 0.37 -0.74 0.00 1.12 -0.51 -1.98 114.38 113.72 2h90 h ARG 155 Ca 0.27 -0.10 -0.05 0.00 -1.11 0.00 0.00 59.98 58.99 2h90 h ARG 155 Cb 0.06 -0.04 -0.03 0.00 -0.01 0.00 0.00 29.97 29.95 2h90 h ARG 155 CO -0.04 0.51 0.25 0.28 -3.11 0.00 0.00 179.97 177.86 2h90 h VAL 156 N 0.18 1.26 -0.74 0.20 2.07 -0.80 0.22 116.25 118.63 2h90 h VAL 156 Ca 0.07 -0.87 -0.00 0.00 0.82 0.00 0.00 66.70 66.71 2h90 h VAL 156 Cb 0.32 0.43 -0.04 0.00 -1.52 0.00 0.00 31.29 30.48 2h90 h VAL 156 CO 0.00 0.35 0.46 0.11 0.02 0.00 0.00 177.57 178.51 2h90 h LYS 157 N 1.09 1.00 -0.19 1.57 1.57 -1.19 -0.92 116.57 119.50 2h90 h LYS 157 Ca 0.24 -0.08 -0.08 0.00 -1.87 0.00 0.00 60.65 58.86 2h90 h LYS 157 Cb 0.28 -0.21 -0.01 0.00 0.08 0.00 0.00 32.23 32.36 2h90 h LYS 157 CO -0.01 0.70 -0.24 0.37 -0.57 0.00 0.00 179.45 179.69 2h90 h GLN 158 N 1.01 0.34 -0.64 3.15 5.75 -0.79 -1.55 115.11 122.39 2h90 h GLN 158 Ca 0.27 -0.12 -0.06 0.00 -0.15 0.00 0.00 58.65 58.59 2h90 h GLN 158 Cb -0.06 -0.03 -0.03 0.00 1.07 0.00 0.00 27.48 28.44 2h90 h GLN 158 CO -0.05 0.57 0.17 -0.44 -2.65 0.00 0.00 178.83 176.43 2h90 h ASP 159 N 0.31 0.92 -0.56 -0.69 3.32 0.01 0.65 116.42 120.37 2h90 h ASP 159 Ca 0.05 -0.17 -0.10 0.00 0.02 0.00 0.00 57.03 56.83 2h90 h ASP 159 Cb 0.60 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.89 2h90 h ASP 159 CO 0.04 0.88 -0.03 -0.26 -1.72 0.00 0.00 179.24 178.16 2h90 h PHE 160 N 0.94 1.11 -0.19 4.55 -1.00 -0.57 -0.18 116.94 121.61 2h90 h PHE 160 Ca 0.21 -0.20 -0.01 0.00 2.81 0.00 0.00 57.97 60.78 2h90 h PHE 160 Cb 0.31 -0.29 -0.01 0.00 3.61 0.00 0.00 35.95 39.58 2h90 h PHE 160 CO 0.02 1.00 0.09 0.28 -1.61 0.00 0.00 178.31 178.10 2h90 h VAL 161 N 0.90 1.13 -0.79 -0.55 2.07 -0.74 -0.47 116.25 117.79 2h90 h VAL 161 Ca 0.16 -0.37 -0.02 0.00 0.82 0.00 0.00 66.70 67.29 2h90 h VAL 161 Cb 0.58 1.03 -0.04 0.00 -1.52 0.00 0.00 31.29 31.34 2h90 h VAL 161 CO 0.03 0.12 0.43 0.44 0.02 0.00 0.00 177.57 178.61 2h90 h ASP 162 N 0.18 0.98 -0.65 0.57 3.32 -0.75 0.15 116.42 120.22 2h90 h ASP 162 Ca 0.06 -0.08 -0.05 0.00 0.02 0.00 0.00 57.03 56.98 2h90 h ASP 162 Cb 0.11 -0.25 -0.03 0.00 0.22 0.00 0.00 39.33 39.39 2h90 h ASP 162 CO -0.01 0.79 0.19 0.00 -1.72 0.00 0.00 179.24 178.50 2h90 h ALA 163 N 1.36 0.85 -0.49 3.45 0.00 -0.71 -0.20 119.26 123.53 2h90 h ALA 163 Ca 0.28 -0.22 -0.12 0.00 0.00 0.00 0.00 54.91 54.85 2h90 h ALA 163 Cb 0.04 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 2h90 h ALA 163 CO -0.04 0.53 -0.17 0.00 0.00 0.00 0.00 179.25 179.56 2h90 h ALA 164 N 1.07 0.68 -0.61 0.00 0.00 -0.55 -0.29 119.26 119.56 2h90 h ALA 164 Ca 0.21 -0.37 -0.02 0.00 0.00 0.00 0.00 54.91 54.73 2h90 h ALA 164 Cb 0.31 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.90 2h90 h ALA 164 CO -0.00 0.63 0.31 -0.09 0.00 0.00 0.00 179.25 180.10 2h90 h ARG 165 N 0.83 0.87 -0.53 0.00 1.12 -0.73 -0.58 114.38 115.36 2h90 h ARG 165 Ca 0.12 -0.12 -0.09 0.00 -1.11 0.00 0.00 59.98 58.78 2h90 h ARG 165 Cb 0.75 -0.16 -0.02 0.00 -0.01 0.00 0.00 29.97 30.53 2h90 h ARG 165 CO 0.06 0.68 -0.03 0.00 -3.11 0.00 0.00 179.97 177.57 2h90 h ARG 166 N 0.84 0.95 -0.78 0.20 3.08 -0.83 -1.30 114.38 116.53 2h90 h ARG 166 Ca 0.21 -0.32 -0.01 0.00 0.07 0.00 0.00 59.98 59.94 2h90 h ARG 166 Cb 0.08 -0.08 -0.04 0.00 0.08 0.00 0.00 29.97 30.02 2h90 h ARG 166 CO -0.03 0.98 0.45 0.00 -1.07 0.00 0.00 179.97 180.30 2h90 h ALA 167 N 0.94 1.00 0.31 0.04 0.00 -0.75 0.65 119.26 121.44 2h90 h ALA 167 Ca 0.15 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 2h90 h ALA 167 Cb 0.57 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 18.05 2h90 h ALA 167 CO 0.03 0.48 -0.16 -0.09 0.00 0.00 0.00 179.25 179.51 2h90 h ARG 168 N 1.07 -0.42 0.00 0.00 2.43 -0.84 -1.92 114.38 114.71 2h90 h ARG 168 Ca 0.28 0.03 -0.00 0.00 -0.81 0.00 0.00 59.98 59.48 2h90 h ARG 168 Cb -0.01 0.09 -0.00 0.00 -0.42 0.00 0.00 29.97 29.64 2h90 h ARG 168 CO -0.05 -0.28 -0.00 -0.44 -1.51 0.00 0.00 179.97 177.69 2h90 h ASP 169 N -0.43 0.00 1.04 -3.80 3.32 -0.91 -1.73 116.42 113.90 2h90 h ASP 169 Ca -0.04 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.01 2h90 h ASP 169 Cb 0.34 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.89 2h90 h ASP 169 CO 0.06 0.00 -0.08 0.00 -1.72 0.00 0.00 179.24 177.50 2h90 n ALA 170 N -2.09 2.48 0.00 3.45 0.00 0.19 -4.92 120.51 119.61 2h90 n ALA 170 Ca -0.00 -0.12 0.00 0.00 0.00 0.00 0.00 53.44 53.32 2h90 n ALA 170 Cb 0.26 -1.42 0.00 0.00 0.00 0.00 0.00 19.45 18.29 2h90 n ALA 170 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2h90 n GLY 171 N 1.45 0.67 3.77 0.00 0.00 -0.65 -4.55 105.19 105.88 2h90 n GLY 171 Ca 0.06 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.69 2h90 n GLY 171 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2h90 s PHE 172 N -2.00 2.47 -0.57 1.61 0.08 -0.75 -4.92 117.98 113.90 2h90 s PHE 172 Ca 0.00 1.26 0.07 0.00 0.12 0.00 0.00 56.93 58.37 2h90 s PHE 172 Cb 0.00 -3.93 0.19 0.00 -0.57 0.00 0.00 43.02 38.71 2h90 s PHE 172 CO 0.00 -2.94 1.15 0.39 -0.10 0.00 0.00 175.22 173.72 2h90 n GLU 173 N -0.16 2.89 -3.66 0.44 1.02 -0.17 -4.66 120.64 116.33 2h90 n GLU 173 Ca 0.05 -1.83 -0.09 0.00 -0.02 0.00 0.00 57.16 55.27 2h90 n GLU 173 Cb 0.42 -1.17 -0.08 0.00 -0.02 0.00 0.00 31.44 30.59 2h90 n GLU 173 CO 0.00 0.00 0.00 -0.46 1.18 0.00 0.00 177.13 177.85 2h90 s TRP 174 N -0.99 -0.87 0.03 -0.32 -0.11 -1.14 -3.90 118.94 111.63 2h90 s TRP 174 Ca 0.14 1.80 0.06 0.00 1.22 0.00 0.00 56.10 59.32 2h90 s TRP 174 Cb 0.07 0.47 -0.02 0.00 -1.50 0.00 0.00 33.47 32.50 2h90 s TRP 174 CO 0.10 -0.45 -0.17 -1.50 -4.62 0.00 0.00 176.95 170.31 2h90 s ILE 175 N 1.45 1.38 -0.12 5.86 2.07 -1.06 -1.57 121.20 129.21 2h90 s ILE 175 Ca -0.09 -1.02 -0.01 0.00 -1.41 0.00 0.00 60.65 58.12 2h90 s ILE 175 Cb -0.06 -1.20 0.03 0.00 0.13 0.00 0.00 42.46 41.36 2h90 s ILE 175 CO -0.16 0.16 -0.04 -0.70 -1.91 0.00 0.00 174.94 172.29 2h90 s GLU 176 N -1.01 1.19 -0.06 3.50 2.12 -0.21 -1.06 118.70 123.17 2h90 s GLU 176 Ca 0.05 -0.23 -0.28 0.00 0.36 0.00 0.00 54.97 54.87 2h90 s GLU 176 Cb -0.08 -1.56 -0.03 0.00 0.26 0.00 0.00 34.13 32.72 2h90 s GLU 176 CO 0.01 -0.34 0.90 -0.51 -0.54 0.00 0.00 175.26 174.78 2h90 s LEU 177 N 1.77 4.30 -1.10 2.70 1.43 -0.20 -1.47 118.68 126.12 2h90 s LEU 177 Ca 0.04 1.46 -0.19 0.00 -1.03 0.00 0.00 54.13 54.40 2h90 s LEU 177 Cb -0.13 -3.41 0.10 0.00 0.03 0.00 0.00 46.19 42.77 2h90 s LEU 177 CO -0.07 -0.29 1.44 -2.28 0.23 0.00 0.00 176.35 175.38 2h90 s HIS 178 N 1.34 2.92 -0.37 0.29 2.46 -0.62 -0.73 115.29 120.58 2h90 s HIS 178 Ca 0.46 -1.41 0.07 0.00 0.47 0.00 0.00 55.06 54.65 2h90 s HIS 178 Cb -0.19 -4.54 0.63 0.00 -0.13 0.00 0.00 32.58 28.35 2h90 s HIS 178 CO 0.21 -1.70 1.75 1.19 -2.47 0.00 0.00 174.74 173.72 2h90 n PHE 179 N 7.60 2.30 -4.37 3.88 3.72 0.04 -4.45 117.46 126.18 2h90 n PHE 179 Ca 0.35 -1.62 -0.18 0.00 -0.05 0.00 0.00 57.45 55.96 2h90 n PHE 179 Cb 0.48 -0.74 -0.05 0.00 -0.94 0.00 0.00 39.48 38.23 2h90 n PHE 179 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2h90 n ALA 180 N -0.93 0.37 -2.28 4.37 0.00 -1.05 -3.37 120.51 117.62 2h90 n ALA 180 Ca 0.47 -1.41 -0.20 0.00 0.00 0.00 0.00 53.44 52.29 2h90 n ALA 180 Cb 1.41 0.92 -0.02 0.00 0.00 0.00 0.00 19.45 21.75 2h90 n ALA 180 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2h90 n HIS 181 N -0.66 -0.88 -0.98 0.00 8.25 -1.12 -2.94 115.22 116.90 2h90 n HIS 181 Ca -0.06 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.40 2h90 n HIS 181 Cb 0.41 -3.83 0.00 0.00 1.12 0.00 0.00 29.99 27.69 2h90 n HIS 181 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2h90 n GLY 182 N -0.91 0.58 0.00 -1.41 0.00 0.31 -4.72 105.19 99.04 2h90 n GLY 182 Ca -0.24 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.78 2h90 n GLY 182 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2h90 n TYR 183 N -2.58 -3.78 -0.14 1.61 4.01 -1.15 -4.44 117.16 110.68 2h90 n TYR 183 Ca 0.00 0.00 -0.13 0.00 -0.16 0.00 0.00 57.90 57.61 2h90 n TYR 183 Cb 0.04 0.00 -0.08 0.00 -0.31 0.00 0.00 39.34 38.99 2h90 n TYR 183 CO 0.00 0.00 0.00 1.25 -0.46 0.00 0.00 176.86 177.65 2h90 h LEU 184 N 0.00 -1.74 -0.12 7.72 5.85 -1.34 0.69 115.31 126.36 2h90 h LEU 184 Ca 0.00 0.24 0.04 0.00 0.84 0.00 0.00 57.88 59.00 2h90 h LEU 184 Cb 0.00 0.73 -0.04 0.00 0.37 0.00 0.00 40.66 41.72 2h90 h LEU 184 CO 0.00 -0.39 -0.13 1.23 -0.34 0.00 0.00 178.44 178.81 2h90 h GLY 185 N -0.37 -0.05 0.96 3.75 0.00 -1.79 -1.99 103.07 103.58 2h90 h GLY 185 Ca 0.10 0.16 0.02 0.00 0.00 0.00 0.00 47.33 47.60 2h90 h GLY 185 CO -0.60 -0.14 0.63 -1.61 0.00 0.00 0.00 176.54 174.82 2h90 h GLN 186 N -0.16 1.22 0.00 4.80 5.75 -1.48 -2.36 115.11 122.89 2h90 h GLN 186 Ca 0.09 -0.07 -0.02 0.00 -0.15 0.00 0.00 58.65 58.49 2h90 h GLN 186 Cb 0.28 -0.28 -0.00 0.00 1.07 0.00 0.00 27.48 28.56 2h90 h GLN 186 CO -0.22 0.81 -0.09 0.66 -2.65 0.00 0.00 178.83 177.34 2h90 h SER 187 N 1.26 0.00 0.54 -0.69 4.64 -0.22 -1.70 113.55 117.38 2h90 h SER 187 Ca 0.36 0.00 -0.21 0.00 -0.47 0.00 0.00 61.79 61.46 2h90 h SER 187 Cb -0.10 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 61.99 2h90 h SER 187 CO -0.09 0.09 -0.95 -0.26 -0.87 0.00 0.00 176.83 174.75 2h90 h PHE 188 N 0.00 0.39 0.02 4.77 0.04 -0.84 -3.24 116.94 118.08 2h90 h PHE 188 Ca -0.00 -0.22 -0.24 0.00 2.80 0.00 0.00 57.97 60.31 2h90 h PHE 188 Cb 0.36 -0.04 0.00 0.00 2.20 0.00 0.00 35.95 38.47 2h90 h PHE 188 CO 0.00 1.06 -0.99 0.35 -0.60 0.00 0.00 178.31 178.13 2h90 h PHE 189 N 0.13 0.63 -3.34 -0.55 3.57 -1.24 -3.43 116.94 112.73 2h90 h PHE 189 Ca -0.06 -0.36 -0.54 0.00 3.53 0.00 0.00 57.97 60.54 2h90 h PHE 189 Cb 1.59 -0.07 -0.01 0.00 2.79 0.00 0.00 35.95 40.26 2h90 h PHE 189 CO 0.04 1.19 0.45 0.45 -2.23 0.00 0.00 178.31 178.21 2h90 s SER 190 N -7.11 7.26 0.34 0.41 0.15 -0.71 -4.88 113.70 109.15 2h90 s SER 190 Ca -0.06 1.82 0.26 0.00 0.70 0.00 0.00 55.95 58.67 2h90 s SER 190 Cb 0.08 -2.58 1.14 0.00 -1.71 0.00 0.00 66.02 62.96 2h90 s SER 190 CO 0.87 -0.33 1.78 -0.33 1.20 0.00 0.00 173.24 176.44 2h90 h GLU 191 N 6.69 0.00 -0.54 5.44 5.08 -1.88 0.12 114.58 129.48 2h90 h GLU 191 Ca -0.41 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 57.87 2h90 h GLU 191 Cb 1.22 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.45 2h90 h GLU 191 CO 0.77 0.00 0.03 0.45 -1.00 0.00 0.00 179.01 179.26 2h90 h HIS 192 N 0.00 1.02 0.00 4.33 3.86 -1.91 -3.33 115.15 119.12 2h90 h HIS 192 Ca 0.00 -0.17 0.00 0.00 -1.16 0.00 0.00 60.37 59.04 2h90 h HIS 192 Cb 0.32 -0.27 0.00 0.00 1.06 0.00 0.00 27.41 28.52 2h90 h HIS 192 CO 0.00 0.92 -1.78 -1.13 0.86 0.00 0.00 177.93 176.80 2h90 n SER 193 N -4.29 1.08 -4.35 2.45 3.41 -1.04 -4.89 113.62 105.98 2h90 n SER 193 Ca 0.02 -0.00 -0.41 0.00 -0.26 0.00 0.00 58.87 58.21 2h90 n SER 193 Cb 0.31 1.78 -0.10 0.00 -0.26 0.00 0.00 64.21 65.94 2h90 n SER 193 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 2h90 s ASN 194 N -3.97 5.80 -0.12 4.04 3.84 0.00 -3.75 114.94 120.79 2h90 s ASN 194 Ca -0.06 -1.20 0.15 0.00 0.21 0.00 0.00 52.86 51.96 2h90 s ASN 194 Cb 0.11 -2.05 0.34 0.00 -0.55 0.00 0.00 41.25 39.10 2h90 s ASN 194 CO 0.71 -0.48 1.24 0.29 -2.79 0.00 0.00 177.10 176.07 2h90 n LYS 195 N 5.02 2.22 -1.89 0.43 4.76 -1.26 -4.60 118.16 122.84 2h90 n LYS 195 Ca -0.11 -2.49 -0.36 0.00 -2.87 0.00 0.00 58.31 52.48 2h90 n LYS 195 Cb 0.45 -1.54 0.05 0.00 -1.84 0.00 0.00 35.03 32.14 2h90 n LYS 195 CO 0.00 0.00 0.00 1.03 -1.37 0.00 0.00 177.40 177.06 2h90 s ARG 196 N -2.45 2.81 0.00 1.97 0.52 -1.26 -4.91 118.95 115.62 2h90 s ARG 196 Ca 0.31 1.81 0.04 0.00 -0.52 0.00 0.00 55.73 57.37 2h90 s ARG 196 Cb 0.25 -1.91 0.09 0.00 0.52 0.00 0.00 34.95 33.90 2h90 s ARG 196 CO 0.06 -1.33 0.93 0.25 0.02 0.00 0.00 175.30 175.23 2h90 n THR 197 N -1.83 0.64 -1.45 0.02 -2.24 -1.26 -2.76 114.28 105.40 2h90 n THR 197 Ca 0.14 -0.82 0.00 0.00 -2.27 0.00 0.00 64.05 61.10 2h90 n THR 197 Cb 0.50 0.71 0.00 0.00 -2.10 0.00 0.00 70.33 69.44 2h90 n THR 197 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 2h90 n ASP 198 N 0.02 0.00 0.06 3.42 5.68 -1.26 -4.90 116.55 119.57 2h90 n ASP 198 Ca 0.04 0.00 0.06 0.00 -0.50 0.00 0.00 54.79 54.39 2h90 n ASP 198 Cb 0.24 0.00 0.29 0.00 -1.14 0.00 0.00 41.12 40.51 2h90 n ASP 198 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2h90 n ALA 199 N -3.00 1.30 -0.49 2.12 0.00 -1.26 -2.51 120.51 116.68 2h90 n ALA 199 Ca 0.00 0.04 0.07 0.00 0.00 0.00 0.00 53.44 53.56 2h90 n ALA 199 Cb 0.00 -1.19 0.23 0.00 0.00 0.00 0.00 19.45 18.49 2h90 n ALA 199 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2h90 n TYR 200 N -1.78 0.82 -3.81 0.00 4.01 -1.26 -4.45 117.16 110.70 2h90 n TYR 200 Ca 0.01 -0.62 -0.10 0.00 -0.16 0.00 0.00 57.90 57.04 2h90 n TYR 200 Cb 0.09 -0.14 -0.06 0.00 -0.31 0.00 0.00 39.34 38.92 2h90 n TYR 200 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 2h90 s GLY 201 N -1.22 0.09 0.00 2.72 0.00 -1.04 -4.18 107.32 103.68 2h90 s GLY 201 Ca 0.35 -0.48 0.00 0.00 0.00 0.00 0.00 44.72 44.59 2h90 s GLY 201 CO 0.17 -0.57 0.00 0.61 0.00 0.00 0.00 173.10 173.31 2h90 n GLY 202 N -0.22 0.88 3.69 0.20 0.00 -1.11 -4.44 105.19 104.19 2h90 n GLY 202 Ca -0.11 -0.74 -0.29 0.00 0.00 0.00 0.00 46.02 44.88 2h90 n GLY 202 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2h90 s SER 203 N -4.00 2.65 0.16 1.61 1.04 -1.26 -4.77 113.70 109.12 2h90 s SER 203 Ca 0.00 1.12 -0.13 0.00 0.48 0.00 0.00 55.95 57.42 2h90 s SER 203 Cb 0.00 -1.76 0.06 0.00 0.10 0.00 0.00 66.02 64.41 2h90 s SER 203 CO 0.00 -3.11 1.73 0.15 0.98 0.00 0.00 173.24 172.99 2h90 h PHE 204 N -1.88 0.82 -0.65 5.02 3.57 -1.98 -0.02 116.94 121.82 2h90 h PHE 204 Ca -0.54 -0.06 -0.03 0.00 3.53 0.00 0.00 57.97 60.87 2h90 h PHE 204 Cb 1.33 -0.25 -0.03 0.00 2.79 0.00 0.00 35.95 39.80 2h90 h PHE 204 CO 0.26 0.66 0.29 -0.44 -2.23 0.00 0.00 178.31 176.85 2h90 h ASP 205 N 0.75 0.87 -0.30 0.41 3.32 -1.98 -0.59 116.42 118.89 2h90 h ASP 205 Ca 0.18 -0.15 -0.13 0.00 0.02 0.00 0.00 57.03 56.96 2h90 h ASP 205 Cb 0.18 -0.23 -0.00 0.00 0.22 0.00 0.00 39.33 39.50 2h90 h ASP 205 CO -0.02 0.78 -0.30 0.78 -1.72 0.00 0.00 179.24 178.76 2h90 h ASN 206 N 0.91 0.79 0.50 6.45 4.21 -1.72 -1.49 115.58 125.23 2h90 h ASN 206 Ca 0.22 -0.47 -0.07 0.00 1.21 0.00 0.00 56.30 57.19 2h90 h ASN 206 Cb 0.16 -0.22 -0.01 0.00 -1.12 0.00 0.00 38.32 37.13 2h90 h ASN 206 CO -0.02 1.10 -0.31 0.03 -1.29 0.00 0.00 177.43 176.93 2h90 h ARG 207 N 0.50 0.00 0.00 0.81 3.08 -0.89 -2.62 114.38 115.26 2h90 h ARG 207 Ca 0.05 0.00 -0.06 0.00 0.07 0.00 0.00 59.98 60.04 2h90 h ARG 207 Cb 0.87 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.92 2h90 h ARG 207 CO 0.07 0.31 -0.43 0.77 -1.07 0.00 0.00 179.97 179.63 2h90 h SER 208 N 0.00 0.00 -0.50 7.04 0.02 -0.97 -3.28 113.55 115.86 2h90 h SER 208 Ca -0.00 0.00 0.10 0.00 -0.84 0.00 0.00 61.79 61.05 2h90 h SER 208 Cb 0.65 0.00 -0.10 0.00 0.14 0.00 0.00 62.40 63.09 2h90 h SER 208 CO 0.04 0.25 -0.19 -0.09 -1.14 0.00 0.00 176.83 175.70 2h90 h ARG 209 N 0.00 -0.07 -0.43 3.45 2.43 -0.87 -0.60 114.38 118.29 2h90 h ARG 209 Ca -0.02 0.01 0.04 0.00 -0.81 0.00 0.00 59.98 59.20 2h90 h ARG 209 Cb 1.21 0.02 -0.04 0.00 -0.42 0.00 0.00 29.97 30.73 2h90 h ARG 209 CO 0.03 -0.05 0.20 0.35 -1.51 0.00 0.00 179.97 178.99 2h90 h PHE 210 N -0.08 0.36 -0.38 2.20 3.57 -1.76 0.13 116.94 120.98 2h90 h PHE 210 Ca 0.24 0.02 -0.05 0.00 3.53 0.00 0.00 57.97 61.70 2h90 h PHE 210 Cb 0.45 -0.10 -0.01 0.00 2.79 0.00 0.00 35.95 39.07 2h90 h PHE 210 CO -0.48 0.17 0.03 -0.07 -2.23 0.00 0.00 178.31 175.73 2h90 h LEU 211 N 0.40 0.63 -0.50 0.59 4.07 -1.69 -1.29 115.31 117.52 2h90 h LEU 211 Ca 0.19 -0.28 -0.11 0.00 0.08 0.00 0.00 57.88 57.76 2h90 h LEU 211 Cb 0.13 -0.17 -0.02 0.00 1.08 0.00 0.00 40.66 41.69 2h90 h LEU 211 CO -0.16 0.76 -0.11 -0.07 -1.08 0.00 0.00 178.44 177.78 2h90 h LEU 212 N 0.48 0.96 -0.80 1.67 3.38 -0.84 -1.41 115.31 118.75 2h90 h LEU 212 Ca 0.11 -0.36 -0.11 0.00 0.09 0.00 0.00 57.88 57.61 2h90 h LEU 212 Cb 0.41 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 2h90 h LEU 212 CO 0.01 1.10 -0.28 -0.33 0.09 0.00 0.00 178.44 179.03 2h90 h GLU 213 N 0.81 0.58 -0.39 1.13 5.08 -0.70 -1.24 114.58 119.83 2h90 h GLU 213 Ca 0.13 -0.24 -0.11 0.00 -1.00 0.00 0.00 59.36 58.14 2h90 h GLU 213 Cb 0.67 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.89 2h90 h GLU 213 CO 0.05 0.80 -0.17 1.15 -1.00 0.00 0.00 179.01 179.84 2h90 h THR 214 N 0.50 1.28 -0.33 1.13 2.02 -1.09 -0.26 112.91 116.16 2h90 h THR 214 Ca 0.07 -1.29 -0.01 0.00 0.77 0.00 0.00 66.41 65.94 2h90 h THR 214 Cb 0.75 1.28 -0.02 0.00 -1.74 0.00 0.00 68.15 68.42 2h90 h THR 214 CO 0.06 0.43 0.16 0.25 0.37 0.00 0.00 175.52 176.79 2h90 h LEU 215 N 0.62 0.42 -0.82 2.58 5.85 -1.09 -1.00 115.31 121.87 2h90 h LEU 215 Ca 0.09 -0.12 -0.04 0.00 0.84 0.00 0.00 57.88 58.65 2h90 h LEU 215 Cb 0.72 -0.11 -0.04 0.00 0.37 0.00 0.00 40.66 41.60 2h90 h LEU 215 CO 0.05 0.42 0.34 0.00 -0.34 0.00 0.00 178.44 178.92 2h90 h ALA 216 N 1.02 1.06 -0.47 1.25 0.00 -1.11 -0.18 119.26 120.83 2h90 h ALA 216 Ca 0.11 -0.19 -0.08 0.00 0.00 0.00 0.00 54.91 54.75 2h90 h ALA 216 Cb 0.11 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 2h90 h ALA 216 CO -0.02 0.67 -0.02 0.00 0.00 0.00 0.00 179.25 179.89 2h90 h ALA 217 N 1.18 0.64 -0.55 0.00 0.00 -0.83 -2.85 119.26 116.85 2h90 h ALA 217 Ca 0.27 -0.29 -0.09 0.00 0.00 0.00 0.00 54.91 54.81 2h90 h ALA 217 Cb 0.20 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 2h90 h ALA 217 CO -0.03 0.46 -0.00 0.28 0.00 0.00 0.00 179.25 179.97 2h90 h VAL 218 N 0.71 1.26 -0.15 0.00 2.07 -0.94 -2.65 116.25 116.54 2h90 h VAL 218 Ca 0.13 -1.10 0.04 0.00 0.82 0.00 0.00 66.70 66.59 2h90 h VAL 218 Cb 0.54 0.84 -0.01 0.00 -1.52 0.00 0.00 31.29 31.14 2h90 h VAL 218 CO 0.03 0.39 0.13 -0.09 0.02 0.00 0.00 177.57 178.05 2h90 h ARG 219 N 0.87 0.00 0.00 1.57 2.43 -0.80 -0.14 114.38 118.31 2h90 h ARG 219 Ca 0.16 0.00 -0.04 0.00 -0.81 0.00 0.00 59.98 59.29 2h90 h ARG 219 Cb 0.52 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.06 2h90 h ARG 219 CO 0.03 0.00 -0.18 0.93 -1.51 0.00 0.00 179.97 179.23 2h90 h GLU 220 N 0.00 0.00 0.00 0.20 5.08 -1.32 -3.26 114.58 115.28 2h90 h GLU 220 Ca 0.07 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.43 2h90 h GLU 220 Cb 0.33 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.58 2h90 h GLU 220 CO -0.00 0.18 -1.09 1.33 -1.00 0.00 0.00 179.01 178.43 2h90 n VAL 221 N -3.50 0.00 -2.95 3.13 0.24 -0.53 -4.98 118.33 109.74 2h90 n VAL 221 Ca -0.01 -0.22 -0.41 0.00 -2.04 0.00 0.00 64.34 61.67 2h90 n VAL 221 Cb 0.35 0.50 -0.04 0.00 -1.47 0.00 0.00 33.84 33.17 2h90 n VAL 221 CO 0.00 0.00 0.00 0.86 -2.14 0.00 0.00 176.83 175.55 2h90 s TRP 222 N -2.32 3.49 0.13 6.34 -0.11 -0.18 -4.80 118.94 121.49 2h90 s TRP 222 Ca -0.01 1.26 -0.35 0.00 1.22 0.00 0.00 56.10 58.22 2h90 s TRP 222 Cb 0.05 -2.93 -0.16 0.00 -1.50 0.00 0.00 33.47 28.93 2h90 s TRP 222 CO 0.32 -0.10 1.29 -2.30 -4.62 0.00 0.00 176.95 171.53 2h90 n PRO 223 N 4.61 1.27 0.25 5.86 -0.02 -1.26 -4.85 135.00 140.87 2h90 n PRO 223 Ca 0.02 0.45 0.08 0.00 -2.02 0.00 0.00 63.50 62.03 2h90 n PRO 223 Cb 0.50 -2.05 0.62 0.00 -0.02 0.00 0.00 33.50 32.56 2h90 n PRO 223 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 2h90 h GLU 224 N 4.14 0.00 -0.14 -0.52 4.57 -1.94 -2.35 114.58 118.33 2h90 h GLU 224 Ca -0.45 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.73 2h90 h GLU 224 Cb 1.33 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.92 2h90 h GLU 224 CO 0.75 0.04 0.00 0.27 -1.18 0.00 0.00 179.01 178.89 2h90 n ASN 225 N -4.46 1.26 -4.32 1.04 6.94 -1.26 -4.81 115.26 109.65 2h90 n ASN 225 Ca -0.03 -1.69 -0.32 0.00 -0.02 0.00 0.00 54.58 52.52 2h90 n ASN 225 Cb 0.12 -0.09 -0.16 0.00 -2.36 0.00 0.00 39.78 37.30 2h90 n ASN 225 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 2h90 s LEU 226 N -1.49 2.30 -0.08 -4.53 1.43 -0.89 -1.29 118.68 114.13 2h90 s LEU 226 Ca 0.29 -0.43 -0.38 0.00 -1.03 0.00 0.00 54.13 52.59 2h90 s LEU 226 Cb 0.15 -1.45 -0.16 0.00 0.03 0.00 0.00 46.19 44.77 2h90 s LEU 226 CO 0.23 0.25 1.56 -2.65 0.23 0.00 0.00 176.35 175.97 2h90 n PRO 227 N 2.95 1.26 -3.76 1.29 -0.02 -1.25 -4.83 135.00 130.63 2h90 n PRO 227 Ca -0.18 0.46 -0.37 0.00 -2.02 0.00 0.00 63.50 61.39 2h90 n PRO 227 Cb 0.52 -2.14 -0.13 0.00 -0.02 0.00 0.00 33.50 31.74 2h90 n PRO 227 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 2h90 s LEU 228 N 2.04 4.19 0.40 2.45 2.96 -1.26 -2.55 118.68 126.90 2h90 s LEU 228 Ca 0.91 -1.06 0.04 0.00 -0.22 0.00 0.00 54.13 53.79 2h90 s LEU 228 Cb -0.97 -1.86 -0.03 0.00 0.50 0.00 0.00 46.19 43.82 2h90 s LEU 228 CO 0.55 -0.30 0.11 0.42 -1.32 0.00 0.00 176.35 175.81 2h90 s THR 229 N 1.41 0.73 0.05 3.68 -4.23 -0.22 -0.29 115.64 116.76 2h90 s THR 229 Ca -0.01 -2.00 -0.20 0.00 -1.18 0.00 0.00 61.69 58.30 2h90 s THR 229 Cb -0.19 -2.43 0.04 0.00 1.34 0.00 0.00 72.50 71.27 2h90 s THR 229 CO 0.02 0.00 0.45 0.00 -0.54 0.00 0.00 174.62 174.56 2h90 s ALA 230 N -3.22 -1.13 -0.11 3.99 0.00 -1.19 -1.04 121.76 119.07 2h90 s ALA 230 Ca 0.25 0.41 -0.02 0.00 0.00 0.00 0.00 51.96 52.61 2h90 s ALA 230 Cb 0.04 0.37 -0.03 0.00 0.00 0.00 0.00 23.12 23.50 2h90 s ALA 230 CO 0.14 -0.48 -0.03 0.50 0.00 0.00 0.00 175.76 175.89 2h90 s ARG 231 N -2.49 3.17 -0.12 0.00 3.52 0.09 -0.36 118.95 122.76 2h90 s ARG 231 Ca -0.05 -0.48 -0.07 0.00 -0.13 0.00 0.00 55.73 54.99 2h90 s ARG 231 Cb -0.01 -2.79 0.04 0.00 -1.56 0.00 0.00 34.95 30.64 2h90 s ARG 231 CO -0.02 0.53 0.29 0.12 -0.81 0.00 0.00 175.30 175.41 2h90 s PHE 232 N -0.41 -0.39 -0.26 5.12 5.36 -0.56 -0.78 117.98 126.06 2h90 s PHE 232 Ca 0.07 0.90 -0.27 0.00 -0.96 0.00 0.00 56.93 56.67 2h90 s PHE 232 Cb -0.12 0.11 0.01 0.00 -0.34 0.00 0.00 43.02 42.68 2h90 s PHE 232 CO 0.02 -0.24 0.96 0.20 -1.46 0.00 0.00 175.22 174.70 2h90 s GLY 233 N 1.03 1.68 0.00 13.12 0.00 -1.25 -1.55 107.32 120.34 2h90 s GLY 233 Ca -0.07 -0.02 0.24 0.00 0.00 0.00 0.00 44.72 44.86 2h90 s GLY 233 CO -0.07 2.06 1.28 3.33 0.00 0.00 0.00 173.10 179.70 2h90 n VAL 234 N 5.45 0.00 -3.46 1.40 0.24 -0.36 -4.50 118.33 117.10 2h90 n VAL 234 Ca 0.09 -0.03 -0.13 0.00 -2.04 0.00 0.00 64.34 62.23 2h90 n VAL 234 Cb 0.47 0.51 -0.03 0.00 -1.47 0.00 0.00 33.84 33.32 2h90 n VAL 234 CO 0.00 0.00 0.00 -1.48 -2.14 0.00 0.00 176.83 173.21 2h90 s LEU 235 N -2.92 -0.50 -0.02 1.34 2.34 -1.26 -3.56 118.68 114.10 2h90 s LEU 235 Ca 0.12 0.15 0.11 0.00 0.06 0.00 0.00 54.13 54.57 2h90 s LEU 235 Cb 0.17 2.51 -0.18 0.00 -0.56 0.00 0.00 46.19 48.14 2h90 s LEU 235 CO 0.72 -0.87 0.24 -0.62 -1.06 0.00 0.00 176.35 174.76 2h90 n GLU 236 N -0.05 0.42 -3.08 1.48 -0.58 -1.26 -1.25 120.64 116.33 2h90 n GLU 236 Ca -0.17 -0.10 -0.13 0.00 -0.42 0.00 0.00 57.16 56.33 2h90 n GLU 236 Cb 0.63 -1.27 0.06 0.00 -0.57 0.00 0.00 31.44 30.28 2h90 n GLU 236 CO 0.00 0.00 0.00 0.66 -0.48 0.00 0.00 177.13 177.31 2h90 n TYR 237 N -1.92 -1.67 -0.88 -0.32 4.01 -1.26 -4.63 117.16 110.48 2h90 n TYR 237 Ca -0.03 0.65 0.08 0.00 -0.16 0.00 0.00 57.90 58.45 2h90 n TYR 237 Cb 0.32 -3.92 0.18 0.00 -0.31 0.00 0.00 39.34 35.61 2h90 n TYR 237 CO 0.00 0.00 0.00 -0.40 -0.46 0.00 0.00 176.86 176.00 2h90 n ASP 238 N -2.04 2.98 0.00 7.72 5.75 -1.26 -1.41 116.55 128.28 2h90 n ASP 238 Ca -0.11 -2.89 0.00 0.00 -0.01 0.00 0.00 54.79 51.78 2h90 n ASP 238 Cb 0.58 -0.42 0.00 0.00 -1.03 0.00 0.00 41.12 40.25 2h90 n ASP 238 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2h90 n GLY 239 N -0.85 0.71 0.82 6.12 0.00 -1.26 -4.85 105.19 105.88 2h90 n GLY 239 Ca 0.16 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.24 2h90 n GLY 239 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2h90 n ARG 240 N -2.54 0.95 -0.21 1.61 1.74 -1.26 -4.91 116.66 112.03 2h90 n ARG 240 Ca 0.00 -2.66 -0.04 0.00 -0.77 0.00 0.00 57.85 54.37 2h90 n ARG 240 Cb 0.00 -1.02 0.06 0.00 -1.02 0.00 0.00 32.46 30.48 2h90 n ARG 240 CO 0.00 0.00 0.00 -0.44 -1.52 0.00 0.00 177.63 175.67 2h90 h ASP 241 N 0.82 0.63 -0.38 0.55 3.32 -1.97 -1.10 116.42 118.29 2h90 h ASP 241 Ca -0.07 0.00 -0.08 0.00 0.02 0.00 0.00 57.03 56.90 2h90 h ASP 241 Cb 1.31 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 40.71 2h90 h ASP 241 CO 0.03 0.44 -0.07 -0.08 -1.72 0.00 0.00 179.24 177.84 2h90 h GLU 242 N 0.76 0.72 -0.52 3.56 4.57 -1.98 0.20 114.58 121.88 2h90 h GLU 242 Ca 0.25 -0.27 -0.10 0.00 -1.18 0.00 0.00 59.36 58.06 2h90 h GLU 242 Cb 0.01 -0.04 -0.02 0.00 -0.16 0.00 0.00 28.75 28.54 2h90 h GLU 242 CO -0.10 0.86 -0.06 1.96 -1.18 0.00 0.00 179.01 180.49 2h90 h GLN 243 N 0.52 0.95 -0.34 1.92 7.50 -1.95 -1.88 115.11 121.83 2h90 h GLN 243 Ca 0.10 -0.33 -0.08 0.00 0.50 0.00 0.00 58.65 58.83 2h90 h GLN 243 Cb 0.58 -0.07 -0.01 0.00 0.05 0.00 0.00 27.48 28.03 2h90 h GLN 243 CO 0.03 1.00 -0.10 1.15 -1.50 0.00 0.00 178.83 179.41 2h90 h THR 244 N 0.82 1.28 -0.51 -0.54 2.02 -1.10 -2.63 112.91 112.26 2h90 h THR 244 Ca 0.14 -1.18 -0.05 0.00 0.77 0.00 0.00 66.41 66.09 2h90 h THR 244 Cb 0.60 1.35 -0.02 0.00 -1.74 0.00 0.00 68.15 68.34 2h90 h THR 244 CO 0.04 0.38 0.11 0.25 0.37 0.00 0.00 175.52 176.68 2h90 h LEU 245 N 0.45 0.72 -0.39 2.58 5.85 -0.52 -0.05 115.31 123.95 2h90 h LEU 245 Ca 0.08 -0.13 -0.05 0.00 0.84 0.00 0.00 57.88 58.63 2h90 h LEU 245 Cb 0.61 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.44 2h90 h LEU 245 CO 0.04 0.72 0.05 -0.08 -0.34 0.00 0.00 178.44 178.83 2h90 h GLU 246 N 0.75 0.64 -0.64 1.25 4.81 -1.23 -0.66 114.58 119.51 2h90 h GLU 246 Ca 0.17 -0.18 -0.08 0.00 -0.13 0.00 0.00 59.36 59.14 2h90 h GLU 246 Cb 0.29 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.57 2h90 h GLU 246 CO -0.00 0.71 0.08 0.93 -0.73 0.00 0.00 179.01 179.99 2h90 h GLU 247 N 0.49 1.08 -0.64 1.92 5.08 -1.17 -1.78 114.58 119.56 2h90 h GLU 247 Ca 0.12 -0.30 -0.05 0.00 -1.00 0.00 0.00 59.36 58.12 2h90 h GLU 247 Cb 0.38 -0.12 -0.03 0.00 0.50 0.00 0.00 28.75 29.48 2h90 h GLU 247 CO 0.01 1.01 0.20 0.77 -1.00 0.00 0.00 179.01 179.99 2h90 h SER 248 N 0.99 0.94 -0.29 1.42 0.02 -0.83 -0.27 113.55 115.54 2h90 h SER 248 Ca 0.19 -0.21 -0.10 0.00 -0.84 0.00 0.00 61.79 60.83 2h90 h SER 248 Cb 0.47 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 62.75 2h90 h SER 248 CO 0.02 0.90 -0.16 0.40 -1.14 0.00 0.00 176.83 176.86 2h90 h ILE 249 N 0.93 1.26 -0.64 3.27 2.04 -1.00 0.19 117.51 123.56 2h90 h ILE 249 Ca 0.21 -1.22 -0.06 0.00 1.00 0.00 0.00 64.86 64.79 2h90 h ILE 249 Cb 0.30 1.13 -0.03 0.00 -0.74 0.00 0.00 36.82 37.48 2h90 h ILE 249 CO -0.01 0.41 0.15 -0.08 0.00 0.00 0.00 178.15 178.63 2h90 h GLU 250 N 0.65 1.03 -0.31 2.37 4.57 -0.85 -1.01 114.58 121.04 2h90 h GLU 250 Ca 0.10 -0.25 -0.09 0.00 -1.18 0.00 0.00 59.36 57.94 2h90 h GLU 250 Cb 0.63 -0.13 -0.02 0.00 -0.16 0.00 0.00 28.75 29.07 2h90 h GLU 250 CO 0.04 0.93 -0.19 1.25 -1.18 0.00 0.00 179.01 179.86 2h90 h LEU 251 N 0.95 0.57 -1.15 1.64 5.85 -0.62 -2.06 115.31 120.49 2h90 h LEU 251 Ca 0.20 -0.18 -0.01 0.00 0.84 0.00 0.00 57.88 58.73 2h90 h LEU 251 Cb 0.36 -0.16 -0.04 0.00 0.37 0.00 0.00 40.66 41.20 2h90 h LEU 251 CO 0.00 0.78 0.42 0.00 -0.34 0.00 0.00 178.44 179.30 2h90 h ALA 252 N 1.28 1.36 -0.74 1.25 0.00 -0.33 0.13 119.26 122.21 2h90 h ALA 252 Ca 0.08 -0.10 -0.06 0.00 0.00 0.00 0.00 54.91 54.83 2h90 h ALA 252 Cb 0.62 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 18.09 2h90 h ALA 252 CO 0.04 0.54 0.22 0.00 0.00 0.00 0.00 179.25 180.05 2h90 h ARG 253 N 1.02 1.15 -0.22 0.00 3.08 -0.55 -0.97 114.38 117.88 2h90 h ARG 253 Ca 0.26 -0.25 -0.13 0.00 0.07 0.00 0.00 59.98 59.93 2h90 h ARG 253 Cb -0.01 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 29.87 2h90 h ARG 253 CO -0.05 0.99 -0.39 0.00 -1.07 0.00 0.00 179.97 179.45 2h90 h ARG 254 N 1.10 0.51 -0.24 0.04 3.08 -0.66 -1.53 114.38 116.69 2h90 h ARG 254 Ca 0.24 -0.25 -0.01 0.00 0.07 0.00 0.00 59.98 60.02 2h90 h ARG 254 Cb 0.33 -0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.36 2h90 h ARG 254 CO -0.01 0.82 0.11 0.74 -1.07 0.00 0.00 179.97 180.57 2h90 h PHE 255 N 0.43 0.35 -0.33 3.04 0.04 -0.35 0.21 116.94 120.32 2h90 h PHE 255 Ca 0.04 -0.02 0.01 0.00 2.80 0.00 0.00 57.97 60.80 2h90 h PHE 255 Cb 0.87 -0.11 -0.02 0.00 2.20 0.00 0.00 35.95 38.89 2h90 h PHE 255 CO 0.03 0.34 0.19 -0.22 -0.60 0.00 0.00 178.31 178.06 2h90 h LYS 256 N 0.25 0.39 0.00 1.51 3.64 -1.00 -0.26 116.57 121.10 2h90 h LYS 256 Ca 0.08 -0.02 -0.02 0.00 -1.27 0.00 0.00 60.65 59.42 2h90 h LYS 256 Cb 0.13 -0.09 -0.00 0.00 -0.41 0.00 0.00 32.23 31.86 2h90 h LYS 256 CO -0.01 0.25 -0.07 0.00 -2.27 0.00 0.00 179.45 177.35 2h90 h ALA 257 N 1.15 1.62 -0.32 5.00 0.00 -1.05 -1.32 119.26 124.35 2h90 h ALA 257 Ca 0.13 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.97 2h90 h ALA 257 Cb 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.78 2h90 h ALA 257 CO -0.06 0.09 0.00 0.41 0.00 0.00 0.00 179.25 179.69 2h90 n GLY 258 N -1.16 1.23 0.48 0.00 0.00 0.04 -4.90 105.19 100.89 2h90 n GLY 258 Ca -0.03 -0.40 0.00 0.00 0.00 0.00 0.00 46.02 45.60 2h90 n GLY 258 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2h90 n GLY 259 N 0.76 0.74 3.71 -0.02 0.00 -0.50 -4.84 105.19 105.04 2h90 n GLY 259 Ca 0.12 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.72 2h90 n GLY 259 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2h90 s LEU 260 N 0.00 4.37 0.05 0.99 2.96 -0.26 -4.72 118.68 122.07 2h90 s LEU 260 Ca 0.00 2.19 0.17 0.00 -0.22 0.00 0.00 54.13 56.27 2h90 s LEU 260 Cb 0.00 -3.58 -0.14 0.00 0.50 0.00 0.00 46.19 42.97 2h90 s LEU 260 CO 0.00 -0.57 0.79 0.47 -1.32 0.00 0.00 176.35 175.72 2h90 n ASP 261 N 3.97 0.80 -3.57 3.68 8.00 0.60 -4.47 116.55 125.56 2h90 n ASP 261 Ca 0.10 0.35 -0.15 0.00 0.71 0.00 0.00 54.79 55.80 2h90 n ASP 261 Cb 0.44 0.26 -0.06 0.00 -0.02 0.00 0.00 41.12 41.74 2h90 n ASP 261 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 2h90 s LEU 262 N -5.71 -0.65 -0.12 0.64 0.20 -1.25 -4.27 118.68 107.52 2h90 s LEU 262 Ca -0.03 0.95 0.02 0.00 0.69 0.00 0.00 54.13 55.76 2h90 s LEU 262 Cb 0.09 2.42 -0.00 0.00 -0.43 0.00 0.00 46.19 48.26 2h90 s LEU 262 CO 0.81 -0.44 -0.20 -0.22 -0.29 0.00 0.00 176.35 176.02 2h90 s LEU 263 N -0.56 2.29 -0.46 -0.68 2.96 -0.29 -3.14 118.68 118.80 2h90 s LEU 263 Ca -0.06 -0.50 -0.22 0.00 -0.22 0.00 0.00 54.13 53.13 2h90 s LEU 263 Cb -0.02 -1.48 0.03 0.00 0.50 0.00 0.00 46.19 45.22 2h90 s LEU 263 CO 0.05 0.14 0.72 -0.55 -1.32 0.00 0.00 176.35 175.39 2h90 s SER 264 N 0.49 6.35 -0.09 3.68 0.15 0.51 -2.11 113.70 122.67 2h90 s SER 264 Ca -0.13 -0.30 -0.27 0.00 0.70 0.00 0.00 55.95 55.95 2h90 s SER 264 Cb -0.17 -2.35 -0.02 0.00 -1.71 0.00 0.00 66.02 61.77 2h90 s SER 264 CO 0.05 -0.87 0.87 -0.69 1.20 0.00 0.00 173.24 173.80 2h90 s VAL 265 N 3.06 4.90 0.00 4.45 1.01 -0.03 -1.49 120.40 132.30 2h90 s VAL 265 Ca 0.25 1.77 0.00 0.00 0.00 0.00 0.00 61.98 64.00 2h90 s VAL 265 Cb -0.14 -4.19 0.00 0.00 0.00 0.00 0.00 36.38 32.05 2h90 s VAL 265 CO 0.20 0.11 0.00 -0.24 0.00 0.00 0.00 175.10 175.17 2h90 n SER 266 N 4.48 0.00 -4.82 3.32 2.88 -0.60 -4.47 113.62 114.41 2h90 n SER 266 Ca 0.04 -0.68 -0.28 0.00 -1.33 0.00 0.00 58.87 56.62 2h90 n SER 266 Cb 0.50 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 63.91 2h90 n SER 266 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 2h90 s VAL 267 N -1.87 4.70 0.12 2.46 1.01 -1.26 -1.22 120.40 124.33 2h90 s VAL 267 Ca 0.00 -0.84 -0.14 0.00 0.00 0.00 0.00 61.98 60.99 2h90 s VAL 267 Cb 0.00 -3.34 -0.04 0.00 0.00 0.00 0.00 36.38 33.00 2h90 s VAL 267 CO 0.00 0.01 1.51 1.23 0.00 0.00 0.00 175.10 177.85 2h90 h GLY 268 N 2.78 0.79 -4.66 4.51 0.00 -1.40 -3.29 103.07 101.80 2h90 h GLY 268 Ca -0.47 -0.67 -0.34 0.00 0.00 0.00 0.00 47.33 45.86 2h90 h GLY 268 CO 0.66 0.61 -0.48 0.69 0.00 0.00 0.00 176.54 178.02 2h90 n PHE 269 N -4.36 -1.67 0.07 5.60 3.72 -1.26 0.12 117.46 119.67 2h90 n PHE 269 Ca -0.02 0.30 -0.11 0.00 -0.05 0.00 0.00 57.45 57.58 2h90 n PHE 269 Cb 0.36 -3.16 -0.01 0.00 -0.94 0.00 0.00 39.48 35.73 2h90 n PHE 269 CO 0.00 0.00 0.00 1.15 -0.05 0.00 0.00 176.76 177.86 2h90 h THR 270 N -0.68 1.41 -3.60 4.37 2.02 -1.89 -3.31 112.91 111.23 2h90 h THR 270 Ca -0.40 -2.37 -0.31 0.00 0.77 0.00 0.00 66.41 64.11 2h90 h THR 270 Cb 1.28 2.31 -0.16 0.00 -1.74 0.00 0.00 68.15 69.84 2h90 h THR 270 CO 0.47 0.70 -0.72 0.27 0.37 0.00 0.00 175.52 176.62 2h90 s ILE 271 N -3.39 1.00 0.08 3.11 -4.36 -1.26 -4.90 121.20 111.48 2h90 s ILE 271 Ca -0.05 -1.86 0.10 0.00 -0.26 0.00 0.00 60.65 58.58 2h90 s ILE 271 Cb 0.10 -1.61 -0.09 0.00 1.25 0.00 0.00 42.46 42.10 2h90 s ILE 271 CO 0.85 -0.68 1.40 1.55 0.24 0.00 0.00 174.94 178.29 2h90 h PRO 272 N 3.15 0.00 -5.51 0.37 0.13 -1.89 -3.41 132.00 124.84 2h90 h PRO 272 Ca -0.37 0.00 -0.69 0.00 -0.87 0.00 0.00 66.00 64.07 2h90 h PRO 272 Cb 1.19 0.00 -0.09 0.00 0.13 0.00 0.00 31.00 32.23 2h90 h PRO 272 CO 0.59 0.78 2.24 -3.47 -0.23 0.00 0.00 178.00 177.91 2h90 n ASP 273 N -3.40 4.84 -3.88 1.44 2.03 -1.26 -4.89 116.55 111.44 2h90 n ASP 273 Ca 0.00 -2.92 -0.16 0.00 0.52 0.00 0.00 54.79 52.24 2h90 n ASP 273 Cb 0.81 -1.72 -0.09 0.00 -0.72 0.00 0.00 41.12 39.40 2h90 n ASP 273 CO 0.00 0.00 0.00 0.42 -1.92 0.00 0.00 177.20 175.70 2h90 s THR 274 N 3.81 0.07 -0.46 5.18 -4.23 -1.26 -4.82 115.64 113.93 2h90 s THR 274 Ca 0.52 -2.00 0.04 0.00 -1.18 0.00 0.00 61.69 59.07 2h90 s THR 274 Cb 0.05 -2.50 0.17 0.00 1.34 0.00 0.00 72.50 71.55 2h90 s THR 274 CO 0.05 0.00 0.37 -3.20 -0.54 0.00 0.00 174.62 171.30 2h90 n ASN 275 N -0.83 0.13 -4.67 3.99 5.15 -0.50 -5.03 115.26 113.50 2h90 n ASN 275 Ca 0.04 -2.52 -0.43 0.00 -0.60 0.00 0.00 54.58 51.07 2h90 n ASN 275 Cb 0.65 -0.59 -0.02 0.00 -0.53 0.00 0.00 39.78 39.29 2h90 n ASN 275 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 2h90 s ILE 276 N -0.22 4.70 -1.39 -1.44 1.01 -1.26 -4.89 121.20 117.71 2h90 s ILE 276 Ca 0.32 2.01 -0.13 0.00 0.00 0.00 0.00 60.65 62.84 2h90 s ILE 276 Cb 0.03 -4.30 -0.02 0.00 0.01 0.00 0.00 42.46 38.18 2h90 s ILE 276 CO -0.19 -0.10 2.38 -0.81 0.00 0.00 0.00 174.94 176.21 2h90 n PRO 277 N 5.81 2.86 -1.59 2.79 -0.04 -1.26 -4.97 135.00 138.60 2h90 n PRO 277 Ca 0.11 -2.33 -0.43 0.00 -0.04 0.00 0.00 63.50 60.80 2h90 n PRO 277 Cb 0.47 -3.07 -0.00 0.00 -0.04 0.00 0.00 33.50 30.86 2h90 n PRO 277 CO 0.00 0.00 0.00 0.91 -0.04 0.00 0.00 175.50 176.37 2h90 n TRP 278 N 5.50 1.16 0.00 0.54 7.02 -1.26 -4.90 117.44 125.49 2h90 n TRP 278 Ca 0.58 0.63 0.00 0.00 -1.02 0.00 0.00 57.50 57.70 2h90 n TRP 278 Cb 0.33 -2.23 0.00 0.00 -2.42 0.00 0.00 31.31 26.99 2h90 n TRP 278 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 2h90 n GLY 279 N 1.22 0.83 3.68 6.99 0.00 -1.26 -5.02 105.19 111.63 2h90 n GLY 279 Ca 0.09 -0.67 -0.42 0.00 0.00 0.00 0.00 46.02 45.02 2h90 n GLY 279 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2h90 s PRO 280 N -2.00 4.14 -1.60 1.61 0.04 -1.26 -1.78 135.00 134.15 2h90 s PRO 280 Ca 0.00 2.59 0.00 0.00 0.04 0.00 0.00 61.00 63.63 2h90 s PRO 280 Cb 0.00 -3.76 0.00 0.00 0.04 0.00 0.00 34.50 30.78 2h90 s PRO 280 CO 0.00 -0.87 0.00 0.00 0.04 0.00 0.00 177.00 176.17 2h90 n ALA 281 N 6.23 -0.62 0.31 8.56 0.00 -0.35 -4.85 120.51 129.79 2h90 n ALA 281 Ca 0.18 0.17 0.19 0.00 0.00 0.00 0.00 53.44 53.98 2h90 n ALA 281 Cb 0.39 -1.95 1.02 0.00 0.00 0.00 0.00 19.45 18.91 2h90 n ALA 281 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 2h90 h PHE 282 N 0.00 0.00 0.00 0.00 -5.15 -1.52 -1.54 116.94 108.73 2h90 h PHE 282 Ca -0.42 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.35 2h90 h PHE 282 Cb 1.30 0.00 0.00 0.00 0.22 0.00 0.00 35.95 37.47 2h90 h PHE 282 CO 0.59 0.02 0.00 -1.33 -2.00 0.00 0.00 178.31 175.59 2h90 n MET 283 N -3.40 0.25 -0.26 6.09 2.81 -1.26 -4.28 117.12 117.07 2h90 n MET 283 Ca -0.03 0.26 -0.07 0.00 -1.81 0.00 0.00 57.70 56.05 2h90 n MET 283 Cb 0.11 -1.82 -0.03 0.00 -0.71 0.00 0.00 33.22 30.77 2h90 n MET 283 CO 0.00 0.00 0.00 0.78 1.51 0.00 0.00 175.97 178.26 2h90 h GLY 284 N 3.99 -0.41 0.84 3.03 0.00 -1.64 -0.13 103.07 108.75 2h90 h GLY 284 Ca 0.00 0.58 0.03 0.00 0.00 0.00 0.00 47.33 47.95 2h90 h GLY 284 CO 0.00 -0.14 0.33 -2.55 0.00 0.00 0.00 176.54 174.18 2h90 h PRO 285 N -0.16 0.64 -0.42 4.80 0.11 -1.82 -0.94 132.00 134.21 2h90 h PRO 285 Ca 0.21 -0.04 -0.13 0.00 0.11 0.00 0.00 66.00 66.15 2h90 h PRO 285 Cb 0.55 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 31.51 2h90 h PRO 285 CO -0.77 0.42 -0.25 0.82 -0.21 0.00 0.00 178.00 178.02 2h90 h ILE 286 N 0.66 1.28 -0.89 4.15 1.08 -1.72 -1.77 117.51 120.29 2h90 h ILE 286 Ca 0.23 -1.41 -0.02 0.00 -0.39 0.00 0.00 64.86 63.28 2h90 h ILE 286 Cb 0.05 1.27 -0.04 0.00 -3.07 0.00 0.00 36.82 35.03 2h90 h ILE 286 CO -0.11 0.47 0.48 0.00 -0.69 0.00 0.00 178.15 178.30 2h90 h ALA 287 N 0.82 1.14 -0.69 1.87 0.00 -0.83 -1.66 119.26 119.91 2h90 h ALA 287 Ca 0.09 -0.13 -0.06 0.00 0.00 0.00 0.00 54.91 54.81 2h90 h ALA 287 Cb 0.82 -0.35 -0.03 0.00 0.00 0.00 0.00 17.79 18.23 2h90 h ALA 287 CO 0.07 0.65 0.21 1.49 0.00 0.00 0.00 179.25 181.67 2h90 h GLU 288 N 1.24 1.07 -0.65 0.00 4.22 -0.98 -0.29 114.58 119.19 2h90 h GLU 288 Ca 0.31 -0.23 -0.06 0.00 0.08 0.00 0.00 59.36 59.46 2h90 h GLU 288 Cb 0.04 -0.15 -0.03 0.00 0.50 0.00 0.00 28.75 29.11 2h90 h GLU 288 CO -0.05 0.93 0.17 -0.09 -2.18 0.00 0.00 179.01 177.79 2h90 h ARG 289 N 1.01 1.04 -0.36 1.92 2.43 -0.84 -0.00 114.38 119.57 2h90 h ARG 289 Ca 0.22 -0.25 -0.06 0.00 -0.81 0.00 0.00 59.98 59.09 2h90 h ARG 289 Cb 0.31 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 29.70 2h90 h ARG 289 CO -0.01 0.93 0.01 0.28 -1.51 0.00 0.00 179.97 179.67 2h90 h VAL 290 N 0.96 1.26 -0.66 0.20 2.07 -1.05 0.10 116.25 119.13 2h90 h VAL 290 Ca 0.21 -0.97 0.05 0.00 0.82 0.00 0.00 66.70 66.80 2h90 h VAL 290 Cb 0.35 1.18 -0.05 0.00 -1.52 0.00 0.00 31.29 31.25 2h90 h VAL 290 CO 0.00 0.32 0.39 -0.09 0.02 0.00 0.00 177.57 178.21 2h90 h ARG 291 N 0.45 0.71 -0.03 1.57 2.43 -0.77 -0.60 114.38 118.15 2h90 h ARG 291 Ca 0.10 -0.04 -0.06 0.00 -0.81 0.00 0.00 59.98 59.17 2h90 h ARG 291 Cb 0.45 -0.16 0.00 0.00 -0.42 0.00 0.00 29.97 29.84 2h90 h ARG 291 CO 0.02 0.47 -0.20 -0.09 -1.51 0.00 0.00 179.97 178.66 2h90 h ARG 292 N 0.74 0.19 0.00 0.20 2.43 -0.79 -0.71 114.38 116.43 2h90 h ARG 292 Ca 0.28 -0.16 -0.03 0.00 -0.81 0.00 0.00 59.98 59.25 2h90 h ARG 292 Cb 0.11 0.04 -0.00 0.00 -0.42 0.00 0.00 29.97 29.70 2h90 h ARG 292 CO -0.15 0.84 -0.16 0.93 -1.51 0.00 0.00 179.97 179.92 2h90 h GLU 293 N -0.41 0.00 -0.00 0.20 5.08 -0.77 -3.17 114.58 115.51 2h90 h GLU 293 Ca -0.02 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 2h90 h GLU 293 Cb 0.89 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.14 2h90 h GLU 293 CO 0.04 0.16 -0.56 0.00 -1.00 0.00 0.00 179.01 177.65 2h90 n ALA 294 N -2.16 3.65 -3.82 3.43 0.00 -0.24 -4.98 120.51 116.40 2h90 n ALA 294 Ca 0.02 -0.45 -0.25 0.00 0.00 0.00 0.00 53.44 52.76 2h90 n ALA 294 Cb 0.50 -0.54 0.01 0.00 0.00 0.00 0.00 19.45 19.43 2h90 n ALA 294 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2h90 n LYS 295 N -0.93 -3.41 -4.26 0.00 5.02 -0.31 -4.78 118.16 109.48 2h90 n LYS 295 Ca 0.04 0.49 -0.18 0.00 -2.02 0.00 0.00 58.31 56.64 2h90 n LYS 295 Cb 0.26 -4.67 -0.15 0.00 -0.02 0.00 0.00 35.03 30.45 2h90 n LYS 295 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 2h90 s LEU 296 N -6.77 1.94 0.59 -0.35 2.96 -1.01 -5.05 118.68 110.99 2h90 s LEU 296 Ca 0.09 -0.13 -0.20 0.00 -0.22 0.00 0.00 54.13 53.67 2h90 s LEU 296 Cb -0.03 -0.38 -0.03 0.00 0.50 0.00 0.00 46.19 46.24 2h90 s LEU 296 CO 0.86 0.07 1.29 -2.84 -1.32 0.00 0.00 176.35 174.41 2h90 s PRO 297 N -0.06 2.94 0.15 0.98 0.02 -1.26 -4.38 135.00 133.40 2h90 s PRO 297 Ca 0.01 2.05 -0.04 0.00 0.02 0.00 0.00 61.00 63.04 2h90 s PRO 297 Cb -0.04 -2.05 -0.03 0.00 0.02 0.00 0.00 34.50 32.40 2h90 s PRO 297 CO -0.00 -1.29 0.16 0.14 -0.33 0.00 0.00 177.00 175.67 2h90 s VAL 298 N -1.41 0.07 0.09 3.83 -7.23 -1.26 -1.14 120.40 113.35 2h90 s VAL 298 Ca 0.76 -1.73 -0.06 0.00 -1.81 0.00 0.00 61.98 59.14 2h90 s VAL 298 Cb -0.36 -2.04 -0.02 0.00 0.56 0.00 0.00 36.38 34.52 2h90 s VAL 298 CO 0.41 -0.33 0.13 0.28 -0.31 0.00 0.00 175.10 175.27 2h90 s THR 299 N -4.04 0.15 0.39 5.32 -1.32 -0.90 -1.13 115.64 114.11 2h90 s THR 299 Ca 0.24 -1.42 -0.12 0.00 -1.21 0.00 0.00 61.69 59.18 2h90 s THR 299 Cb 0.06 -1.48 0.05 0.00 -1.51 0.00 0.00 72.50 69.61 2h90 s THR 299 CO 0.03 -0.70 0.73 -0.55 -2.21 0.00 0.00 174.62 171.92 2h90 s SER 300 N -2.90 0.27 0.37 8.08 0.15 -1.26 -0.85 113.70 117.56 2h90 s SER 300 Ca 0.08 -1.28 -0.05 0.00 0.70 0.00 0.00 55.95 55.40 2h90 s SER 300 Cb 0.06 0.82 0.02 0.00 -1.71 0.00 0.00 66.02 65.21 2h90 s SER 300 CO -0.09 -1.64 0.56 0.00 1.20 0.00 0.00 173.24 173.27 2h90 s ALA 301 N -2.31 0.49 0.00 5.45 0.00 -1.26 -2.21 121.76 121.91 2h90 s ALA 301 Ca 0.19 -1.39 0.00 0.00 0.00 0.00 0.00 51.96 50.77 2h90 s ALA 301 Cb -0.04 1.04 0.00 0.00 0.00 0.00 0.00 23.12 24.12 2h90 s ALA 301 CO 0.14 -0.84 0.00 1.87 0.00 0.00 0.00 175.76 176.93 2h90 n TRP 302 N -0.58 0.00 -0.70 0.00 -0.00 -1.26 -4.62 117.44 110.28 2h90 n TRP 302 Ca -0.01 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 57.49 2h90 n TRP 302 Cb 0.61 0.00 0.00 0.00 -0.00 0.00 0.00 31.31 31.92 2h90 n TRP 302 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 2h90 n GLY 303 N 0.63 0.63 0.53 5.87 0.00 -1.26 -1.21 105.19 110.39 2h90 n GLY 303 Ca 0.00 -0.21 0.04 0.00 0.00 0.00 0.00 46.02 45.85 2h90 n GLY 303 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2h90 n PHE 304 N -2.70 0.39 0.40 1.61 3.72 -1.26 -3.86 117.46 115.76 2h90 n PHE 304 Ca 0.00 -0.18 0.08 0.00 -0.05 0.00 0.00 57.45 57.30 2h90 n PHE 304 Cb 0.00 -0.03 0.34 0.00 -0.94 0.00 0.00 39.48 38.85 2h90 n PHE 304 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2h90 n GLY 305 N 0.82 -1.02 3.50 1.37 0.00 -1.26 -4.27 105.19 104.33 2h90 n GLY 305 Ca 0.09 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.68 2h90 n GLY 305 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2h90 s THR 306 N -3.11 4.72 0.29 2.61 2.01 -1.25 -4.95 115.64 115.95 2h90 s THR 306 Ca 0.05 -0.00 -0.03 0.00 0.31 0.00 0.00 61.69 62.02 2h90 s THR 306 Cb 0.08 -4.33 0.41 0.00 0.01 0.00 0.00 72.50 68.68 2h90 s THR 306 CO 0.27 -0.80 1.58 -0.65 -0.69 0.00 0.00 174.62 174.33 2h90 h PRO 307 N 9.03 0.01 -0.33 4.92 0.11 -1.95 0.29 132.00 144.07 2h90 h PRO 307 Ca -0.26 -0.00 0.04 0.00 0.11 0.00 0.00 66.00 65.89 2h90 h PRO 307 Cb 1.09 -0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.18 2h90 h PRO 307 CO 0.97 0.01 0.22 1.96 -0.21 0.00 0.00 178.00 180.95 2h90 h GLN 308 N 0.02 0.27 -0.31 1.05 7.50 -1.92 -1.32 115.11 120.39 2h90 h GLN 308 Ca 0.53 -0.02 -0.18 0.00 0.50 0.00 0.00 58.65 59.49 2h90 h GLN 308 Cb 1.00 -0.06 -0.00 0.00 0.05 0.00 0.00 27.48 28.46 2h90 h GLN 308 CO -0.93 0.18 -0.51 -0.07 -1.50 0.00 0.00 178.83 176.00 2h90 h LEU 309 N 0.28 0.98 -0.26 1.46 3.38 -1.27 -0.89 115.31 119.00 2h90 h LEU 309 Ca 0.14 -0.51 -0.01 0.00 0.09 0.00 0.00 57.88 57.59 2h90 h LEU 309 Cb 0.22 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.67 2h90 h LEU 309 CO -0.03 1.31 0.11 0.00 0.09 0.00 0.00 178.44 179.93 2h90 h ALA 310 N 0.71 0.33 -0.25 1.53 0.00 -1.23 -1.32 119.26 119.04 2h90 h ALA 310 Ca 0.03 -0.10 0.01 0.00 0.00 0.00 0.00 54.91 54.84 2h90 h ALA 310 Cb 1.12 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.79 2h90 h ALA 310 CO 0.12 -0.09 0.16 1.49 0.00 0.00 0.00 179.25 180.92 2h90 h GLU 311 N 0.27 0.31 -0.61 0.00 4.57 -1.23 -2.42 114.58 115.47 2h90 h GLU 311 Ca 0.09 -0.02 0.00 0.00 -1.18 0.00 0.00 59.36 58.25 2h90 h GLU 311 Cb 0.15 -0.07 -0.03 0.00 -0.16 0.00 0.00 28.75 28.64 2h90 h GLU 311 CO -0.01 0.21 0.38 0.00 -1.18 0.00 0.00 179.01 178.41 2h90 h ALA 312 N 1.10 0.78 -0.94 2.92 0.00 -1.01 -0.93 119.26 121.18 2h90 h ALA 312 Ca 0.09 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 2h90 h ALA 312 Cb -0.02 -0.25 -0.05 0.00 0.00 0.00 0.00 17.79 17.48 2h90 h ALA 312 CO -0.03 0.24 0.57 0.00 0.00 0.00 0.00 179.25 180.03 2h90 h ALA 313 N 1.20 1.19 -0.14 0.00 0.00 -1.04 -1.42 119.26 119.05 2h90 h ALA 313 Ca 0.22 -0.10 -0.05 0.00 0.00 0.00 0.00 54.91 54.99 2h90 h ALA 313 Cb -0.05 -0.38 -0.00 0.00 0.00 0.00 0.00 17.79 17.36 2h90 h ALA 313 CO -0.04 0.64 -0.10 -0.07 0.00 0.00 0.00 179.25 179.67 2h90 h LEU 314 N 1.29 0.34 -1.83 0.00 3.38 -1.11 -1.10 115.31 116.27 2h90 h LEU 314 Ca 0.34 -0.45 -0.02 0.00 0.09 0.00 0.00 57.88 57.84 2h90 h LEU 314 Cb -0.07 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 40.59 2h90 h LEU 314 CO -0.06 0.71 -0.08 1.56 0.09 0.00 0.00 178.44 180.66 2h90 h GLN 315 N -0.04 0.01 -0.06 1.13 4.20 -0.97 -0.07 115.11 119.31 2h90 h GLN 315 Ca 0.03 -0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.74 2h90 h GLN 315 Cb 0.60 -0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.38 2h90 h GLN 315 CO 0.03 0.09 0.00 0.00 -0.67 0.00 0.00 178.83 178.27 2h90 n ALA 316 N -2.52 2.58 -3.52 3.87 0.00 -0.55 -4.92 120.51 115.44 2h90 n ALA 316 Ca -0.03 -0.40 -0.25 0.00 0.00 0.00 0.00 53.44 52.76 2h90 n ALA 316 Cb 0.16 -1.21 0.05 0.00 0.00 0.00 0.00 19.45 18.45 2h90 n ALA 316 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2h90 n ASN 317 N -0.06 -5.70 0.02 0.00 3.02 -0.04 -4.87 115.26 107.63 2h90 n ASN 317 Ca 0.18 -0.53 -0.05 0.00 -0.03 0.00 0.00 54.58 54.15 2h90 n ASN 317 Cb 0.28 -4.55 -0.11 0.00 -0.61 0.00 0.00 39.78 34.79 2h90 n ASN 317 CO 0.00 0.00 0.00 1.56 -2.62 0.00 0.00 177.26 176.20 2h90 h GLN 318 N -2.07 0.00 -4.24 3.52 4.20 -1.43 -3.47 115.11 111.62 2h90 h GLN 318 Ca -0.55 0.00 -0.13 0.00 0.06 0.00 0.00 58.65 58.03 2h90 h GLN 318 Cb 1.36 0.00 -0.15 0.00 0.30 0.00 0.00 27.48 28.99 2h90 h GLN 318 CO 0.59 0.56 -0.68 -0.51 -0.67 0.00 0.00 178.83 178.11 2h90 s LEU 319 N -6.19 2.47 -0.17 1.46 1.43 -1.22 -3.42 118.68 113.05 2h90 s LEU 319 Ca -0.02 -0.97 0.13 0.00 -1.03 0.00 0.00 54.13 52.24 2h90 s LEU 319 Cb 0.09 0.18 -0.20 0.00 0.03 0.00 0.00 46.19 46.29 2h90 s LEU 319 CO 0.81 -0.58 0.03 0.47 0.23 0.00 0.00 176.35 177.32 2h90 n ASP 320 N 0.21 1.08 -4.03 2.29 8.00 -0.29 -4.54 116.55 119.27 2h90 n ASP 320 Ca -0.15 -0.01 -0.16 0.00 0.71 0.00 0.00 54.79 55.18 2h90 n ASP 320 Cb 0.61 0.77 -0.13 0.00 -0.02 0.00 0.00 41.12 42.35 2h90 n ASP 320 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2h90 s LEU 321 N -5.32 2.11 -0.23 0.64 1.43 -1.17 -4.89 118.68 111.25 2h90 s LEU 321 Ca -0.10 -0.30 -0.06 0.00 -1.03 0.00 0.00 54.13 52.64 2h90 s LEU 321 Cb 0.05 -0.34 -0.02 0.00 0.03 0.00 0.00 46.19 45.91 2h90 s LEU 321 CO 0.66 -0.00 0.02 -0.69 0.23 0.00 0.00 176.35 176.57 2h90 s VAL 322 N -0.61 4.00 -0.19 -1.59 1.01 -0.06 -4.04 120.40 118.92 2h90 s VAL 322 Ca -0.01 -0.28 -0.18 0.00 0.00 0.00 0.00 61.98 61.50 2h90 s VAL 322 Cb -0.06 -2.84 -0.03 0.00 0.00 0.00 0.00 36.38 33.45 2h90 s VAL 322 CO 0.00 0.38 0.50 -0.44 0.00 0.00 0.00 175.10 175.55 2h90 s SER 323 N 1.41 6.56 -0.25 3.32 0.01 -0.94 -1.25 113.70 122.57 2h90 s SER 323 Ca 0.05 0.68 0.02 0.00 1.31 0.00 0.00 55.95 58.01 2h90 s SER 323 Cb -0.15 -2.29 0.06 0.00 0.21 0.00 0.00 66.02 63.86 2h90 s SER 323 CO 0.01 -0.15 -0.09 -0.69 0.41 0.00 0.00 173.24 172.74 2h90 s VAL 324 N 1.49 1.93 0.00 3.43 1.01 -0.35 -4.39 120.40 123.51 2h90 s VAL 324 Ca 0.24 -1.48 0.00 0.00 0.00 0.00 0.00 61.98 60.74 2h90 s VAL 324 Cb -0.15 -2.10 0.00 0.00 0.00 0.00 0.00 36.38 34.13 2h90 s VAL 324 CO 0.10 -0.05 0.00 0.61 0.00 0.00 0.00 175.10 175.75 2h90 n GLY 325 N 4.52 -0.01 0.41 4.51 0.00 -1.26 -4.31 105.19 109.05 2h90 n GLY 325 Ca -0.13 0.00 0.20 0.00 0.00 0.00 0.00 46.02 46.09 2h90 n GLY 325 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2h90 h ARG 326 N 0.00 0.27 0.00 1.61 3.08 -1.98 0.95 114.38 118.31 2h90 h ARG 326 Ca 0.00 -0.02 -0.01 0.00 0.07 0.00 0.00 59.98 60.02 2h90 h ARG 326 Cb 0.00 -0.06 -0.00 0.00 0.08 0.00 0.00 29.97 29.99 2h90 h ARG 326 CO 0.00 0.18 -0.04 0.00 -1.07 0.00 0.00 179.97 179.04 2h90 h ALA 327 N 1.62 1.48 0.00 0.04 0.00 -1.94 -0.22 119.26 120.24 2h90 h ALA 327 Ca 0.42 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.27 2h90 h ALA 327 Cb 1.21 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.99 2h90 h ALA 327 CO -0.11 0.05 -0.28 0.45 0.00 0.00 0.00 179.25 179.35 2h90 h HIS 328 N 0.00 0.00 0.06 0.00 3.86 -0.97 -0.71 115.15 117.39 2h90 h HIS 328 Ca -0.00 0.00 -0.26 0.00 -1.16 0.00 0.00 60.37 58.95 2h90 h HIS 328 Cb 0.11 0.00 0.01 0.00 1.06 0.00 0.00 27.41 28.59 2h90 h HIS 328 CO 0.00 0.09 -1.09 -0.07 0.86 0.00 0.00 177.93 177.72 2h90 h LEU 329 N 0.00 0.63 -0.19 2.43 3.38 -1.04 -2.98 115.31 117.54 2h90 h LEU 329 Ca -0.01 -0.55 -0.09 0.00 0.09 0.00 0.00 57.88 57.32 2h90 h LEU 329 Cb 1.07 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 41.62 2h90 h LEU 329 CO 0.01 1.37 -0.23 0.00 0.09 0.00 0.00 178.44 179.68 2h90 h ALA 330 N 0.57 0.29 -2.92 1.53 0.00 -1.29 -3.42 119.26 114.01 2h90 h ALA 330 Ca -0.12 -0.37 -0.50 0.00 0.00 0.00 0.00 54.91 53.92 2h90 h ALA 330 Cb 1.75 -0.06 -0.40 0.00 0.00 0.00 0.00 17.79 19.08 2h90 h ALA 330 CO 0.19 0.25 -0.77 0.34 0.00 0.00 0.00 179.25 179.27 2h90 s ASP 331 N -6.34 2.98 0.66 0.00 -1.08 -0.28 -5.00 116.67 107.61 2h90 s ASP 331 Ca -0.13 -0.97 0.42 0.00 -0.52 0.00 0.00 52.55 51.34 2h90 s ASP 331 Cb 0.06 -0.31 2.29 0.00 -1.46 0.00 0.00 42.92 43.50 2h90 s ASP 331 CO 0.79 -0.40 2.32 -0.65 0.52 0.00 0.00 175.17 177.75 2h90 h PRO 332 N 8.41 0.00 -0.93 4.34 0.11 -1.77 -1.60 132.00 140.56 2h90 h PRO 332 Ca -0.18 0.00 -0.49 0.00 0.11 0.00 0.00 66.00 65.45 2h90 h PRO 332 Cb 1.08 0.00 -0.29 0.00 0.11 0.00 0.00 31.00 31.90 2h90 h PRO 332 CO 0.37 0.00 0.58 0.72 -0.21 0.00 0.00 178.00 179.46 2h90 n HIS 333 N -3.15 2.86 -0.31 0.65 8.25 -1.26 -4.30 115.22 117.96 2h90 n HIS 333 Ca -0.03 -1.85 0.16 0.00 -0.26 0.00 0.00 57.72 55.74 2h90 n HIS 333 Cb 0.11 -0.91 0.41 0.00 1.12 0.00 0.00 29.99 30.72 2h90 n HIS 333 CO 0.00 0.00 0.00 2.35 0.64 0.00 0.00 176.34 179.33 2h90 h TRP 334 N 1.02 0.83 -0.85 4.41 7.01 -1.55 -0.16 115.95 126.65 2h90 h TRP 334 Ca 0.59 0.03 0.10 0.00 2.11 0.00 0.00 58.89 61.72 2h90 h TRP 334 Cb 2.70 -0.25 -0.06 0.00 -2.10 0.00 0.00 29.16 29.45 2h90 h TRP 334 CO 1.54 0.20 0.55 0.00 -2.79 0.00 0.00 178.44 177.94 2h90 h ALA 335 N 1.62 1.70 -0.32 2.65 0.00 -1.83 0.25 119.26 123.33 2h90 h ALA 335 Ca 0.53 -0.01 -0.10 0.00 0.00 0.00 0.00 54.91 55.34 2h90 h ALA 335 Cb 1.03 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.63 2h90 h ALA 335 CO -0.28 0.12 -0.18 -0.92 0.00 0.00 0.00 179.25 177.99 2h90 h TYR 336 N 0.80 0.80 -0.53 0.00 3.20 -1.15 -0.78 116.97 119.31 2h90 h TYR 336 Ca 0.39 -0.21 0.01 0.00 3.14 0.00 0.00 58.73 62.06 2h90 h TYR 336 Cb 0.44 -0.18 -0.03 0.00 1.54 0.00 0.00 36.73 38.50 2h90 h TYR 336 CO -0.00 0.91 0.35 0.35 -1.64 0.00 0.00 178.16 178.13 2h90 h PHE 337 N 0.45 0.66 -0.57 -3.82 3.57 -0.90 -2.07 116.94 114.27 2h90 h PHE 337 Ca 0.07 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.56 2h90 h PHE 337 Cb 0.72 -0.22 -0.03 0.00 2.79 0.00 0.00 35.95 39.21 2h90 h PHE 337 CO 0.06 0.42 0.27 0.00 -2.23 0.00 0.00 178.31 176.83 2h90 h ALA 338 N 1.20 0.74 -0.64 2.41 0.00 -0.44 -0.99 119.26 121.53 2h90 h ALA 338 Ca 0.19 -0.13 0.05 0.00 0.00 0.00 0.00 54.91 55.03 2h90 h ALA 338 Cb -0.08 -0.23 -0.05 0.00 0.00 0.00 0.00 17.79 17.43 2h90 h ALA 338 CO -0.04 0.30 0.36 0.00 0.00 0.00 0.00 179.25 179.87 2h90 h ALA 339 N 1.11 0.85 -0.15 0.00 0.00 -0.78 0.37 119.26 120.66 2h90 h ALA 339 Ca 0.20 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.10 2h90 h ALA 339 Cb 0.12 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 2h90 h ALA 339 CO -0.02 0.04 0.03 0.87 0.00 0.00 0.00 179.25 180.17 2h90 h LYS 340 N 0.67 0.24 -0.94 0.00 1.57 -1.10 0.62 116.57 117.63 2h90 h LYS 340 Ca 0.28 -0.06 0.07 0.00 -1.87 0.00 0.00 60.65 59.08 2h90 h LYS 340 Cb 0.16 -0.03 -0.06 0.00 0.08 0.00 0.00 32.23 32.37 2h90 h LYS 340 CO -0.17 0.41 0.61 0.93 -0.57 0.00 0.00 179.45 180.66 2h90 h GLU 341 N 0.04 1.02 -0.46 3.15 4.39 -0.61 -1.57 114.58 120.54 2h90 h GLU 341 Ca 0.05 -0.06 0.00 0.00 0.34 0.00 0.00 59.36 59.69 2h90 h GLU 341 Cb 0.28 -0.23 0.00 0.00 -0.10 0.00 0.00 28.75 28.69 2h90 h GLU 341 CO 0.00 0.68 0.00 1.28 -1.16 0.00 0.00 179.01 179.81 2h90 n LEU 342 N -4.51 2.44 -3.02 1.33 4.77 0.07 -4.94 117.00 113.14 2h90 n LEU 342 Ca 0.15 -1.22 -0.22 0.00 -0.03 0.00 0.00 56.01 54.69 2h90 n LEU 342 Cb 0.22 -0.31 0.05 0.00 -2.33 0.00 0.00 43.42 41.04 2h90 n LEU 342 CO 0.32 0.58 0.06 0.61 -1.33 0.00 0.00 177.39 177.63 2h90 n GLY 343 N 1.14 -0.46 3.77 -0.72 0.00 -0.59 -4.80 105.19 103.53 2h90 n GLY 343 Ca 0.15 0.12 -0.40 0.00 0.00 0.00 0.00 46.02 45.88 2h90 n GLY 343 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2h90 s VAL 344 N -3.19 2.97 0.21 1.61 1.01 0.16 -4.96 120.40 118.21 2h90 s VAL 344 Ca 0.36 0.97 -0.30 0.00 0.00 0.00 0.00 61.98 63.01 2h90 s VAL 344 Cb -0.16 -3.61 -0.09 0.00 0.00 0.00 0.00 36.38 32.52 2h90 s VAL 344 CO 0.45 0.22 1.32 -1.61 0.00 0.00 0.00 175.10 175.47 2h90 s GLU 345 N -1.74 4.38 -1.31 2.72 2.02 -1.26 -2.83 118.70 120.68 2h90 s GLU 345 Ca 0.48 2.08 -0.02 0.00 0.02 0.00 0.00 54.97 57.53 2h90 s GLU 345 Cb -0.37 -3.18 0.01 0.00 0.10 0.00 0.00 34.13 30.69 2h90 s GLU 345 CO 0.48 -0.26 0.82 1.63 0.02 0.00 0.00 175.26 177.96 2h90 n LYS 346 N 2.50 -5.53 -0.21 1.61 5.02 -1.26 -4.87 118.16 115.41 2h90 n LYS 346 Ca 0.06 0.68 0.12 0.00 -2.02 0.00 0.00 58.31 57.15 2h90 n LYS 346 Cb 0.42 -5.41 0.42 0.00 -0.02 0.00 0.00 35.03 30.45 2h90 n LYS 346 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2h90 h ALA 347 N 0.89 1.90 0.00 7.82 0.00 -1.86 -1.77 119.26 126.24 2h90 h ALA 347 Ca -0.60 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.29 2h90 h ALA 347 Cb 1.36 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 19.03 2h90 h ALA 347 CO 0.56 -0.10 -0.11 0.66 0.00 0.00 0.00 179.25 180.27 2h90 h SER 348 N 0.61 0.00 0.00 0.00 4.64 -1.89 -2.02 113.55 114.89 2h90 h SER 348 Ca 0.39 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.71 2h90 h SER 348 Cb 0.66 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.75 2h90 h SER 348 CO -0.15 0.11 0.00 0.79 -0.87 0.00 0.00 176.83 176.70 2h90 n TRP 349 N -3.89 0.00 0.22 4.77 7.02 -0.67 -1.46 117.44 123.43 2h90 n TRP 349 Ca -0.02 0.00 0.11 0.00 -1.02 0.00 0.00 57.50 56.57 2h90 n TRP 349 Cb 0.20 -0.04 0.34 0.00 -2.42 0.00 0.00 31.31 29.39 2h90 n TRP 349 CO 0.00 0.00 0.00 1.15 -2.02 0.00 0.00 177.69 176.82 2h90 h THR 350 N 0.00 0.29 -1.83 -0.99 2.02 -1.53 -3.44 112.91 107.43 2h90 h THR 350 Ca 0.00 -1.13 -0.47 0.00 0.77 0.00 0.00 66.41 65.58 2h90 h THR 350 Cb 0.21 1.90 -0.02 0.00 -1.74 0.00 0.00 68.15 68.50 2h90 h THR 350 CO 0.00 0.14 -0.40 -0.76 0.37 0.00 0.00 175.52 174.87 2h90 s LEU 351 N -6.39 3.77 0.75 2.58 1.43 -0.54 -4.10 118.68 116.19 2h90 s LEU 351 Ca 0.04 -0.36 -0.13 0.00 -1.03 0.00 0.00 54.13 52.64 2h90 s LEU 351 Cb 0.08 -2.45 0.05 0.00 0.03 0.00 0.00 46.19 43.89 2h90 s LEU 351 CO 0.64 -0.39 1.15 -2.84 0.23 0.00 0.00 176.35 175.15 2h90 s PRO 352 N -4.07 2.12 0.28 1.29 0.02 -1.26 -4.46 135.00 128.92 2h90 s PRO 352 Ca 0.43 1.52 0.01 0.00 0.02 0.00 0.00 61.00 62.98 2h90 s PRO 352 Cb -0.07 -1.86 0.64 0.00 0.02 0.00 0.00 34.50 33.23 2h90 s PRO 352 CO 0.29 -1.80 1.69 0.00 -0.33 0.00 0.00 177.00 176.85 2h90 h ALA 353 N -0.65 1.26 0.00 -1.55 0.00 -1.95 0.52 119.26 116.90 2h90 h ALA 353 Ca -0.46 0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.62 2h90 h ALA 353 Cb 1.27 0.19 0.00 0.00 0.00 0.00 0.00 17.79 19.25 2h90 h ALA 353 CO 0.50 -0.35 0.17 -1.35 0.00 0.00 0.00 179.25 178.21 2h90 h PRO 354 N 0.34 0.00 0.00 0.00 0.11 -2.01 -2.25 132.00 128.19 2h90 h PRO 354 Ca 0.51 0.00 -0.18 0.00 0.11 0.00 0.00 66.00 66.44 2h90 h PRO 354 Cb 0.95 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.03 2h90 h PRO 354 CO -0.54 0.00 -1.51 0.66 -0.21 0.00 0.00 178.00 176.40 2h90 n TYR 355 N -2.50 0.00 -0.32 0.65 4.01 -0.35 -4.76 117.16 113.89 2h90 n TYR 355 Ca -0.02 0.00 0.10 0.00 -0.16 0.00 0.00 57.90 57.82 2h90 n TYR 355 Cb 0.21 -0.44 0.27 0.00 -0.31 0.00 0.00 39.34 39.07 2h90 n TYR 355 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2h90 h ALA 356 N -0.48 1.44 -0.82 -0.72 0.00 -0.82 -2.15 119.26 115.70 2h90 h ALA 356 Ca -0.28 0.10 0.10 0.00 0.00 0.00 0.00 54.91 54.83 2h90 h ALA 356 Cb 1.14 -0.01 -0.06 0.00 0.00 0.00 0.00 17.79 18.86 2h90 h ALA 356 CO -0.17 -0.12 0.53 1.25 0.00 0.00 0.00 179.25 180.75 2h90 h HIS 357 N 0.63 0.81 -0.00 0.00 -0.00 -1.65 -2.50 115.15 112.45 2h90 h HIS 357 Ca 0.52 0.02 0.00 0.00 -0.00 0.00 0.00 60.37 60.91 2h90 h HIS 357 Cb 0.81 -0.26 0.00 0.00 -0.00 0.00 0.00 27.41 27.95 2h90 h HIS 357 CO -0.07 0.37 -0.51 0.91 -0.00 0.00 0.00 177.93 178.63 2h90 n TRP 358 N -4.51 0.00 0.60 5.26 7.02 -0.82 -4.11 117.44 120.87 2h90 n TRP 358 Ca 0.14 0.00 0.08 0.00 -1.02 0.00 0.00 57.50 56.70 2h90 n TRP 358 Cb 0.34 -0.18 -0.10 0.00 -2.42 0.00 0.00 31.31 28.95 2h90 n TRP 358 CO 0.00 0.00 0.00 1.28 -2.02 0.00 0.00 177.69 176.95 2h90 n LEU 359 N -1.26 0.60 0.00 -0.99 4.77 -0.98 -5.15 117.00 113.99 2h90 n LEU 359 Ca 0.07 -0.40 0.08 0.00 -0.03 0.00 0.00 56.01 55.73 2h90 n LEU 359 Cb 0.34 0.00 0.46 0.00 -2.33 0.00 0.00 43.42 41.89 2h90 n LEU 359 CO 0.34 0.15 0.67 -1.84 -1.33 0.00 0.00 177.39 175.38