#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h02 h GLU 6 N 0.00 0.89 0.00 -0.67 4.81 -2.05 0.92 114.58 118.48 3h02 h GLU 6 Ca 0.00 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.18 3h02 h GLU 6 Cb 0.00 -0.20 0.00 0.00 0.63 0.00 0.00 28.75 29.18 3h02 h GLU 6 CO 0.00 0.59 0.00 2.41 -0.73 0.00 0.00 179.01 181.28 3h02 n THR 7 N -4.43 0.00 0.00 0.32 -1.04 -1.26 0.19 114.28 108.06 3h02 n THR 7 Ca 0.07 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.08 3h02 n THR 7 Cb 0.04 -0.22 0.00 0.00 -1.82 0.00 0.00 70.33 68.33 3h02 n THR 7 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 3h02 n LEU 9 N 0.05 0.00 -1.68 -4.42 4.77 0.32 -1.87 117.00 114.17 3h02 n LEU 9 Ca 0.00 0.00 0.09 0.00 -0.03 0.00 0.00 56.01 56.07 3h02 n LEU 9 Cb 0.00 0.00 0.37 0.00 -2.33 0.00 0.00 43.42 41.46 3h02 n LEU 9 CO 0.00 0.00 0.84 -1.22 -1.33 0.00 0.00 177.39 175.68 3h02 n TYR 10 N 0.00 1.65 -1.38 -1.77 4.01 0.13 -4.23 117.16 115.57 3h02 n TYR 10 Ca 0.00 -0.64 -0.33 0.00 -0.16 0.00 0.00 57.90 56.76 3h02 n TYR 10 Cb 0.00 -0.31 0.09 0.00 -0.31 0.00 0.00 39.34 38.81 3h02 n TYR 10 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3h02 s ALA 11 N -2.08 2.10 0.54 -0.72 0.00 -0.78 -4.91 121.76 115.90 3h02 s ALA 11 Ca 0.53 0.75 -0.20 0.00 0.00 0.00 0.00 51.96 53.03 3h02 s ALA 11 Cb 0.35 -3.43 -0.07 0.00 0.00 0.00 0.00 23.12 19.97 3h02 s ALA 11 CO 0.23 -1.89 0.97 -2.30 0.00 0.00 0.00 175.76 172.77 3h02 n PRO 12 N -2.92 1.08 -4.17 0.00 -0.02 -1.26 -4.97 135.00 122.74 3h02 n PRO 12 Ca 0.12 0.40 -0.35 0.00 -2.02 0.00 0.00 63.50 61.66 3h02 n PRO 12 Cb 0.51 -2.12 -0.09 0.00 -0.02 0.00 0.00 33.50 31.78 3h02 n PRO 12 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3h02 s VAL 13 N -1.44 4.62 -0.24 -1.45 1.01 -1.26 -5.08 120.40 116.56 3h02 s VAL 13 Ca 0.71 -0.11 0.02 0.00 0.00 0.00 0.00 61.98 62.60 3h02 s VAL 13 Cb -0.46 -3.02 0.05 0.00 0.00 0.00 0.00 36.38 32.95 3h02 s VAL 13 CO 0.51 0.54 -0.12 -1.61 0.00 0.00 0.00 175.10 174.42 3h02 s GLU 14 N -0.29 2.27 -0.12 2.72 2.02 -1.26 -5.10 118.70 118.94 3h02 s GLU 14 Ca 0.08 -1.19 -0.15 0.00 0.02 0.00 0.00 54.97 53.72 3h02 s GLU 14 Cb -0.12 -2.77 -0.05 0.00 0.10 0.00 0.00 34.13 31.29 3h02 s GLU 14 CO 0.02 -0.51 0.37 -1.58 0.02 0.00 0.00 175.26 173.59 3h02 s TRP 15 N 1.18 3.53 -0.17 1.61 0.52 -1.26 -4.16 118.94 120.18 3h02 s TRP 15 Ca -0.06 0.77 -0.06 0.00 0.02 0.00 0.00 56.10 56.76 3h02 s TRP 15 Cb -0.18 -2.40 -0.04 0.00 -1.15 0.00 0.00 33.47 29.70 3h02 s TRP 15 CO -0.07 0.29 0.04 -1.01 0.02 0.00 0.00 176.95 176.23 3h02 s HIS 16 N 0.23 3.21 0.09 -1.98 3.76 0.74 -4.90 115.29 116.43 3h02 s HIS 16 Ca 0.21 0.01 -0.30 0.00 -0.15 0.00 0.00 55.06 54.83 3h02 s HIS 16 Cb -0.14 -2.04 -0.06 0.00 1.11 0.00 0.00 32.58 31.45 3h02 s HIS 16 CO 0.08 0.13 1.12 0.34 -0.85 0.00 0.00 174.74 175.56 3h02 s ASP 17 N 0.31 7.21 -0.18 1.40 2.15 -1.26 -1.05 116.67 125.25 3h02 s ASP 17 Ca 0.02 1.96 0.17 0.00 0.43 0.00 0.00 52.55 55.13 3h02 s ASP 17 Cb -0.13 -2.59 0.45 0.00 -0.30 0.00 0.00 42.92 40.36 3h02 s ASP 17 CO 0.01 -0.34 1.17 0.00 -0.17 0.00 0.00 175.17 175.84 3h02 n SER 19 N -0.45 1.25 -4.66 0.00 7.64 -1.07 -4.57 113.62 111.75 3h02 n SER 19 Ca 0.18 -1.31 -0.47 0.00 1.01 0.00 0.00 58.87 58.29 3h02 n SER 19 Cb 0.91 0.02 -0.04 0.00 -1.01 0.00 0.00 64.21 64.08 3h02 n SER 19 CO 0.00 0.00 0.00 1.21 -3.01 0.00 0.00 175.04 173.24 3h02 n GLU 20 N -0.12 2.06 0.00 1.43 2.13 -1.26 -1.14 120.64 123.74 3h02 n GLU 20 Ca 0.18 0.74 0.00 0.00 0.66 0.00 0.00 57.16 58.74 3h02 n GLU 20 Cb 0.33 -2.51 0.00 0.00 0.27 0.00 0.00 31.44 29.53 3h02 n GLU 20 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3h02 n GLY 21 N 3.43 1.87 3.86 8.31 0.00 -1.26 -5.04 105.19 116.36 3h02 n GLY 21 Ca 0.18 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.84 3h02 n GLY 21 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3h02 s TYR 22 N -2.40 3.63 -0.16 1.61 2.02 -0.29 -5.01 117.35 116.77 3h02 s TYR 22 Ca 0.00 0.81 0.01 0.00 -0.37 0.00 0.00 57.07 57.53 3h02 s TYR 22 Cb 0.00 -2.16 -0.10 0.00 -0.40 0.00 0.00 41.96 39.29 3h02 s TYR 22 CO 0.00 0.59 -0.14 2.41 -1.57 0.00 0.00 175.55 176.85 3h02 n THR 23 N 1.33 0.89 0.81 -0.71 -1.04 -1.26 -4.74 114.28 109.57 3h02 n THR 23 Ca -0.11 -0.34 0.08 0.00 -2.04 0.00 0.00 64.05 61.64 3h02 n THR 23 Cb 0.53 -1.05 -0.08 0.00 -1.82 0.00 0.00 70.33 67.91 3h02 n THR 23 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 3h02 n ASP 24 N -2.95 1.02 -4.28 8.00 9.92 -1.26 -4.97 116.55 122.02 3h02 n ASP 24 Ca -0.27 -1.01 -0.15 0.00 -0.53 0.00 0.00 54.79 52.82 3h02 n ASP 24 Cb 0.79 0.89 -0.10 0.00 -0.64 0.00 0.00 41.12 42.06 3h02 n ASP 24 CO 0.00 0.00 0.00 0.27 0.13 0.00 0.00 177.20 177.60 3h02 s ILE 25 N -2.52 0.76 0.13 0.53 -4.36 -1.26 -0.07 121.20 114.42 3h02 s ILE 25 Ca 0.08 -2.00 0.07 0.00 -0.26 0.00 0.00 60.65 58.54 3h02 s ILE 25 Cb 0.13 -2.30 -0.04 0.00 1.25 0.00 0.00 42.46 41.51 3h02 s ILE 25 CO 0.66 -0.33 -0.04 -0.13 0.24 0.00 0.00 174.94 175.34 3h02 s ARG 26 N -3.92 2.32 -0.08 0.37 0.52 0.17 -4.82 118.95 113.51 3h02 s ARG 26 Ca 0.28 -1.03 -0.03 0.00 -0.52 0.00 0.00 55.73 54.43 3h02 s ARG 26 Cb 0.06 -2.37 0.04 0.00 0.52 0.00 0.00 34.95 33.21 3h02 s ARG 26 CO 0.07 0.49 0.15 -0.47 0.02 0.00 0.00 175.30 175.56 3h02 s TYR 27 N -1.46 -0.15 0.05 -0.53 5.04 -1.26 -1.25 117.35 117.79 3h02 s TYR 27 Ca 0.25 0.57 0.01 0.00 -2.44 0.00 0.00 57.07 55.45 3h02 s TYR 27 Cb -0.10 -0.28 -0.03 0.00 0.35 0.00 0.00 41.96 41.90 3h02 s TYR 27 CO 0.17 -0.26 -0.05 -1.21 -1.34 0.00 0.00 175.55 172.86 3h02 s GLU 28 N 2.24 0.54 -0.00 4.97 2.02 -0.59 0.52 118.70 128.40 3h02 s GLU 28 Ca 0.03 -0.94 0.02 0.00 0.02 0.00 0.00 54.97 54.10 3h02 s GLU 28 Cb -0.12 -0.02 -0.01 0.00 0.10 0.00 0.00 34.13 34.08 3h02 s GLU 28 CO -0.05 -0.03 -0.07 0.15 0.02 0.00 0.00 175.26 175.27 3h02 s LYS 29 N -2.58 0.56 0.24 1.61 1.02 -0.21 -0.11 119.74 120.27 3h02 s LYS 29 Ca -0.03 -0.28 -0.02 0.00 0.02 0.00 0.00 55.97 55.66 3h02 s LYS 29 Cb -0.02 -0.53 -0.05 0.00 -0.52 0.00 0.00 37.83 36.71 3h02 s LYS 29 CO -0.04 0.14 0.46 -1.54 -0.92 0.00 0.00 175.35 173.46 3h02 s SER 30 N -0.24 6.40 0.00 2.83 1.04 0.67 -0.18 113.70 124.22 3h02 s SER 30 Ca 0.02 0.51 0.29 0.00 0.48 0.00 0.00 55.95 57.25 3h02 s SER 30 Cb -0.03 -2.06 1.52 0.00 0.10 0.00 0.00 66.02 65.55 3h02 s SER 30 CO -0.00 -0.11 2.01 0.35 0.98 0.00 0.00 173.24 176.47 3h02 n THR 31 N -0.83 0.06 -0.30 2.02 -2.24 -1.26 -2.81 114.28 108.92 3h02 n THR 31 Ca -0.04 0.01 0.09 0.00 -2.27 0.00 0.00 64.05 61.85 3h02 n THR 31 Cb 0.54 -0.55 0.32 0.00 -2.10 0.00 0.00 70.33 68.54 3h02 n THR 31 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 3h02 n ASP 32 N -1.21 4.08 0.00 3.42 5.75 -1.26 -4.95 116.55 122.38 3h02 n ASP 32 Ca 0.16 -2.25 0.00 0.00 -0.01 0.00 0.00 54.79 52.69 3h02 n ASP 32 Cb 0.19 -0.51 0.00 0.00 -1.03 0.00 0.00 41.12 39.77 3h02 n ASP 32 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3h02 n GLY 33 N 1.27 1.25 3.50 6.12 0.00 -1.12 -4.92 105.19 111.27 3h02 n GLY 33 Ca 0.23 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.92 3h02 n GLY 33 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3h02 s ILE 34 N -2.00 3.57 -0.08 -0.61 1.01 -1.25 -1.01 121.20 120.82 3h02 s ILE 34 Ca 0.00 -0.50 0.01 0.00 0.00 0.00 0.00 60.65 60.16 3h02 s ILE 34 Cb 0.00 -2.50 -0.03 0.00 0.01 0.00 0.00 42.46 39.94 3h02 s ILE 34 CO 0.00 0.54 -0.09 0.00 0.00 0.00 0.00 174.94 175.39 3h02 s ALA 35 N -0.13 2.87 -0.11 9.38 0.00 -0.55 -0.23 121.76 132.98 3h02 s ALA 35 Ca 0.01 -0.90 0.01 0.00 0.00 0.00 0.00 51.96 51.08 3h02 s ALA 35 Cb -0.13 -1.20 0.02 0.00 0.00 0.00 0.00 23.12 21.80 3h02 s ALA 35 CO 0.03 0.49 -0.13 0.21 0.00 0.00 0.00 175.76 176.36 3h02 s LYS 36 N -0.52 2.06 -0.28 0.00 2.20 0.84 -0.32 119.74 123.71 3h02 s LYS 36 Ca 0.08 -0.49 -0.08 0.00 -0.36 0.00 0.00 55.97 55.12 3h02 s LYS 36 Cb -0.12 -1.83 -0.01 0.00 -1.51 0.00 0.00 37.83 34.36 3h02 s LYS 36 CO 0.02 -0.13 0.09 0.42 -0.36 0.00 0.00 175.35 175.39 3h02 s ILE 37 N 1.20 4.22 -0.17 5.43 1.01 -0.11 -1.54 121.20 131.23 3h02 s ILE 37 Ca -0.03 -0.46 -0.01 0.00 0.00 0.00 0.00 60.65 60.15 3h02 s ILE 37 Cb -0.14 -3.10 -0.00 0.00 0.01 0.00 0.00 42.46 39.22 3h02 s ILE 37 CO -0.04 0.16 -0.12 -0.89 0.00 0.00 0.00 174.94 174.05 3h02 s THR 38 N 1.56 2.90 -0.06 2.92 2.01 -0.38 -1.48 115.64 123.12 3h02 s THR 38 Ca 0.04 -0.68 -0.30 0.00 0.31 0.00 0.00 61.69 61.06 3h02 s THR 38 Cb -0.16 -2.25 -0.04 0.00 0.01 0.00 0.00 72.50 70.05 3h02 s THR 38 CO 0.04 0.49 1.31 -0.63 -0.69 0.00 0.00 174.62 175.14 3h02 s ILE 39 N 0.98 4.02 -0.78 1.82 1.01 -0.35 -0.65 121.20 127.24 3h02 s ILE 39 Ca -0.02 1.34 0.02 0.00 0.00 0.00 0.00 60.65 62.00 3h02 s ILE 39 Cb -0.15 -3.87 0.30 0.00 0.01 0.00 0.00 42.46 38.76 3h02 s ILE 39 CO -0.02 -0.03 1.16 -3.20 0.00 0.00 0.00 174.94 172.85 3h02 n ASN 40 N 5.63 5.19 -2.96 3.58 5.15 0.91 -0.29 115.26 132.47 3h02 n ASN 40 Ca 0.13 -3.56 -0.15 0.00 -0.60 0.00 0.00 54.58 50.40 3h02 n ASN 40 Cb 0.45 -0.85 -0.01 0.00 -0.53 0.00 0.00 39.78 38.84 3h02 n ASN 40 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 3h02 n ARG 41 N 0.46 1.18 0.31 1.20 1.74 -1.26 -4.71 116.66 115.57 3h02 n ARG 41 Ca 0.33 -3.41 0.18 0.00 -0.77 0.00 0.00 57.85 54.17 3h02 n ARG 41 Cb 0.36 -1.56 1.02 0.00 -1.02 0.00 0.00 32.46 31.26 3h02 n ARG 41 CO 0.00 0.00 0.00 -1.00 -1.52 0.00 0.00 177.63 175.11 3h02 h PRO 42 N 2.99 0.00 0.00 5.56 0.13 -1.86 -0.64 132.00 138.18 3h02 h PRO 42 Ca 0.03 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.16 3h02 h PRO 42 Cb 1.03 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.16 3h02 h PRO 42 CO 0.52 0.00 0.00 1.96 -0.23 0.00 0.00 178.00 180.25 3h02 h GLN 43 N 0.00 0.00 -0.53 0.86 4.20 -1.97 -2.37 115.11 115.30 3h02 h GLN 43 Ca 0.00 0.00 -0.37 0.00 0.06 0.00 0.00 58.65 58.34 3h02 h GLN 43 Cb 0.02 0.00 -0.38 0.00 0.30 0.00 0.00 27.48 27.41 3h02 h GLN 43 CO -0.00 0.00 -0.93 1.33 -0.67 0.00 0.00 178.83 178.56 3h02 n VAL 44 N -2.67 1.87 -4.01 -0.54 0.24 -0.61 -4.97 118.33 107.64 3h02 n VAL 44 Ca -0.00 -3.45 -0.33 0.00 -2.04 0.00 0.00 64.34 58.52 3h02 n VAL 44 Cb 0.18 0.01 -0.00 0.00 -1.47 0.00 0.00 33.84 32.55 3h02 n VAL 44 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 3h02 n ARG 45 N -0.63 -4.14 -2.83 7.34 1.74 -0.89 -2.06 116.66 115.20 3h02 n ARG 45 Ca 0.26 0.47 -0.21 0.00 -0.77 0.00 0.00 57.85 57.60 3h02 n ARG 45 Cb 0.89 -5.27 0.01 0.00 -1.02 0.00 0.00 32.46 27.07 3h02 n ARG 45 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 3h02 n ASN 46 N -2.68 -5.38 -4.78 0.55 3.02 -0.35 -1.55 115.26 104.09 3h02 n ASN 46 Ca 0.06 -0.16 -0.36 0.00 -0.03 0.00 0.00 54.58 54.09 3h02 n ASN 46 Cb 0.51 -4.42 -0.01 0.00 -0.61 0.00 0.00 39.78 35.24 3h02 n ASN 46 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3h02 s ALA 47 N -3.02 2.91 0.04 5.41 0.00 -0.87 -4.03 121.76 122.19 3h02 s ALA 47 Ca 0.19 0.84 -0.02 0.00 0.00 0.00 0.00 51.96 52.98 3h02 s ALA 47 Cb -0.09 -3.35 -0.04 0.00 0.00 0.00 0.00 23.12 19.64 3h02 s ALA 47 CO 0.24 -0.59 0.22 -0.59 0.00 0.00 0.00 175.76 175.04 3h02 s PHE 48 N -1.66 3.53 0.44 0.00 -0.12 0.73 -4.88 117.98 116.02 3h02 s PHE 48 Ca 0.65 0.35 0.05 0.00 -0.05 0.00 0.00 56.93 57.93 3h02 s PHE 48 Cb -0.25 -1.83 -0.05 0.00 -0.63 0.00 0.00 43.02 40.25 3h02 s PHE 48 CO 0.30 0.60 0.01 -0.98 -0.05 0.00 0.00 175.22 175.10 3h02 s ARG 49 N -2.26 2.04 0.27 1.99 1.70 -1.26 -1.14 118.95 120.29 3h02 s ARG 49 Ca 0.32 -2.21 -0.00 0.00 -0.47 0.00 0.00 55.73 53.36 3h02 s ARG 49 Cb -0.13 -1.54 0.57 0.00 -0.57 0.00 0.00 34.95 33.28 3h02 s ARG 49 CO 0.23 -0.18 1.75 -1.35 -1.08 0.00 0.00 175.30 174.67 3h02 h PRO 50 N 1.63 0.54 -0.64 3.89 0.11 -2.00 -0.56 132.00 134.97 3h02 h PRO 50 Ca -0.44 -0.03 0.02 0.00 0.11 0.00 0.00 66.00 65.66 3h02 h PRO 50 Cb 1.27 -0.12 -0.04 0.00 0.11 0.00 0.00 31.00 32.22 3h02 h PRO 50 CO 0.77 0.36 0.41 1.25 -0.21 0.00 0.00 178.00 180.58 3h02 h LEU 51 N 0.56 0.69 -0.80 2.35 5.85 -1.99 -1.50 115.31 120.47 3h02 h LEU 51 Ca 0.48 -0.01 0.08 0.00 0.84 0.00 0.00 57.88 59.27 3h02 h LEU 51 Cb 0.74 -0.16 -0.06 0.00 0.37 0.00 0.00 40.66 41.54 3h02 h LEU 51 CO -0.40 0.49 0.47 0.74 -0.34 0.00 0.00 178.44 179.40 3h02 h THR 52 N 0.82 0.97 -0.41 1.05 2.02 -1.51 -1.37 112.91 114.49 3h02 h THR 52 Ca 0.25 -0.28 -0.06 0.00 0.77 0.00 0.00 66.41 67.09 3h02 h THR 52 Cb -0.04 0.07 -0.02 0.00 -1.74 0.00 0.00 68.15 66.43 3h02 h THR 52 CO -0.08 0.15 0.04 0.58 0.37 0.00 0.00 175.52 176.58 3h02 h VAL 53 N 0.82 1.25 -0.82 3.16 2.07 -0.77 -2.88 116.25 119.08 3h02 h VAL 53 Ca 0.37 -0.94 0.01 0.00 0.82 0.00 0.00 66.70 66.96 3h02 h VAL 53 Cb 0.26 1.06 -0.04 0.00 -1.52 0.00 0.00 31.29 31.05 3h02 h VAL 53 CO -0.21 0.32 0.54 0.50 0.02 0.00 0.00 177.57 178.74 3h02 h LYS 54 N 0.54 1.06 -1.09 1.57 3.64 -0.79 -0.22 116.57 121.28 3h02 h LYS 54 Ca 0.12 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.44 3h02 h LYS 54 Cb 0.42 -0.24 0.00 0.00 -0.41 0.00 0.00 32.23 32.00 3h02 h LYS 54 CO 0.01 0.70 0.00 0.39 -2.27 0.00 0.00 179.45 178.28 3h02 n GLU 55 N -4.53 0.37 0.00 1.90 1.02 -0.56 -1.39 120.64 117.45 3h02 n GLU 55 Ca 0.09 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.23 3h02 n GLU 55 Cb 0.03 -1.26 0.00 0.00 -0.02 0.00 0.00 31.44 30.19 3h02 n GLU 55 CO 0.00 0.00 0.00 -0.89 1.18 0.00 0.00 177.13 177.42 3h02 n ILE 57 N 0.60 0.00 -0.15 -3.67 5.41 -0.09 -0.01 119.36 121.45 3h02 n ILE 57 Ca 0.00 0.00 -0.10 0.00 1.00 0.00 0.00 62.75 63.65 3h02 n ILE 57 Cb 0.15 0.00 -0.01 0.00 -0.71 0.00 0.00 39.64 39.07 3h02 n ILE 57 CO 0.00 0.00 0.00 -0.61 0.00 0.00 0.00 176.55 175.94 3h02 h GLN 58 N 0.00 0.73 -0.55 0.38 4.15 -1.48 -1.26 115.11 117.07 3h02 h GLN 58 Ca 0.00 -0.20 -0.11 0.00 0.77 0.00 0.00 58.65 59.11 3h02 h GLN 58 Cb 0.00 -0.08 -0.02 0.00 0.21 0.00 0.00 27.48 27.59 3h02 h GLN 58 CO 0.00 0.76 -0.10 0.00 -1.93 0.00 0.00 178.83 177.56 3h02 h ALA 59 N 0.94 0.78 -0.51 3.38 0.00 -0.70 -1.85 119.26 121.30 3h02 h ALA 59 Ca 0.13 -0.35 -0.08 0.00 0.00 0.00 0.00 54.91 54.62 3h02 h ALA 59 Cb 0.39 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 3h02 h ALA 59 CO 0.01 0.67 0.01 1.25 0.00 0.00 0.00 179.25 181.19 3h02 h LEU 60 N 0.92 0.83 -0.38 0.00 5.85 -1.77 -0.87 115.31 119.89 3h02 h LEU 60 Ca 0.15 -0.21 -0.03 0.00 0.84 0.00 0.00 57.88 58.63 3h02 h LEU 60 Cb 0.67 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 41.46 3h02 h LEU 60 CO 0.05 0.89 0.13 0.00 -0.34 0.00 0.00 178.44 179.16 3h02 h ALA 61 N 1.20 0.50 -0.28 1.25 0.00 -1.09 0.30 119.26 121.15 3h02 h ALA 61 Ca 0.15 -0.16 0.05 0.00 0.00 0.00 0.00 54.91 54.95 3h02 h ALA 61 Cb 0.47 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 18.07 3h02 h ALA 61 CO 0.02 0.13 0.01 0.22 0.00 0.00 0.00 179.25 179.64 3h02 h ASP 62 N 0.47 -0.09 -0.71 0.00 3.58 -1.00 -1.06 116.42 117.60 3h02 h ASP 62 Ca 0.12 0.06 0.03 0.00 0.42 0.00 0.00 57.03 57.66 3h02 h ASP 62 Cb 0.24 0.10 -0.04 0.00 1.72 0.00 0.00 39.33 41.35 3h02 h ASP 62 CO -0.01 -0.01 0.45 0.00 -2.88 0.00 0.00 179.24 176.79 3h02 h ALA 63 N 1.23 0.93 -0.89 -0.78 0.00 -0.85 -0.48 119.26 118.43 3h02 h ALA 63 Ca 0.13 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 3h02 h ALA 63 Cb 0.17 -0.24 -0.04 0.00 0.00 0.00 0.00 17.79 17.68 3h02 h ALA 63 CO -0.22 0.24 0.55 -0.09 0.00 0.00 0.00 179.25 179.74 3h02 h ARG 64 N 0.88 1.20 -0.00 0.00 2.43 -0.31 -2.77 114.38 115.81 3h02 h ARG 64 Ca 0.28 -0.10 0.00 0.00 -0.81 0.00 0.00 59.98 59.36 3h02 h ARG 64 Cb 0.00 -0.26 0.00 0.00 -0.42 0.00 0.00 29.97 29.30 3h02 h ARG 64 CO -0.10 0.82 -0.18 0.66 -1.51 0.00 0.00 179.97 179.66 3h02 n TYR 65 N -4.37 0.00 -2.88 2.20 4.01 -0.46 -4.70 117.16 110.95 3h02 n TYR 65 Ca 0.10 0.00 -0.43 0.00 -0.16 0.00 0.00 57.90 57.41 3h02 n TYR 65 Cb 0.05 -0.24 -0.04 0.00 -0.31 0.00 0.00 39.34 38.79 3h02 n TYR 65 CO 0.00 0.00 0.00 0.34 -0.46 0.00 0.00 176.86 176.74 3h02 s ASP 66 N -2.67 6.28 0.00 7.72 -1.08 -0.26 -4.90 116.67 121.76 3h02 s ASP 66 Ca 0.22 -0.59 0.10 0.00 -0.52 0.00 0.00 52.55 51.77 3h02 s ASP 66 Cb 0.19 -2.41 0.54 0.00 -1.46 0.00 0.00 42.92 39.78 3h02 s ASP 66 CO 0.53 -1.24 1.20 -0.90 0.52 0.00 0.00 175.17 175.28 3h02 n ASP 67 N 7.36 0.00 0.00 -0.34 5.68 -1.26 -1.00 116.55 126.99 3h02 n ASP 67 Ca -0.01 0.07 0.11 0.00 -0.50 0.00 0.00 54.79 54.47 3h02 n ASP 67 Cb 0.47 -0.25 0.12 0.00 -1.14 0.00 0.00 41.12 40.32 3h02 n ASP 67 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.20 176.46 3h02 n ASN 68 N -1.25 0.66 -4.67 -1.12 4.13 -1.26 -4.84 115.26 106.92 3h02 n ASN 68 Ca 0.05 -0.46 -0.38 0.00 1.68 0.00 0.00 54.58 55.47 3h02 n ASN 68 Cb 0.08 0.52 -0.07 0.00 -1.54 0.00 0.00 39.78 38.76 3h02 n ASN 68 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 3h02 s VAL 69 N -3.02 5.19 -0.13 2.41 1.01 -0.17 -4.06 120.40 121.63 3h02 s VAL 69 Ca 0.09 0.74 0.09 0.00 0.00 0.00 0.00 61.98 62.91 3h02 s VAL 69 Cb 0.17 -3.75 -0.13 0.00 0.00 0.00 0.00 36.38 32.67 3h02 s VAL 69 CO 0.76 0.24 0.25 0.61 0.00 0.00 0.00 175.10 176.97 3h02 n GLY 70 N 3.92 -0.27 3.27 4.51 0.00 -0.18 -4.90 105.19 111.54 3h02 n GLY 70 Ca -0.08 -0.23 -0.13 0.00 0.00 0.00 0.00 46.02 45.58 3h02 n GLY 70 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3h02 s VAL 71 N -2.43 0.00 -0.07 1.61 1.01 -1.03 -3.92 120.40 115.57 3h02 s VAL 71 Ca -0.02 -0.02 0.03 0.00 0.00 0.00 0.00 61.98 61.98 3h02 s VAL 71 Cb 0.06 -0.54 -0.02 0.00 0.00 0.00 0.00 36.38 35.88 3h02 s VAL 71 CO 0.38 -0.01 -0.17 -0.63 0.00 0.00 0.00 175.10 174.67 3h02 s ILE 72 N 0.13 2.75 -0.16 2.22 1.09 -0.21 -1.49 121.20 125.54 3h02 s ILE 72 Ca -0.01 -0.81 -0.05 0.00 -1.10 0.00 0.00 60.65 58.68 3h02 s ILE 72 Cb -0.03 -2.08 -0.03 0.00 -1.06 0.00 0.00 42.46 39.26 3h02 s ILE 72 CO 0.01 0.57 0.01 -0.63 -0.10 0.00 0.00 174.94 174.80 3h02 s ILE 73 N -0.27 4.34 -0.14 2.92 1.01 0.56 0.04 121.20 129.66 3h02 s ILE 73 Ca 0.01 -0.20 -0.02 0.00 0.00 0.00 0.00 60.65 60.44 3h02 s ILE 73 Cb -0.13 -2.92 -0.02 0.00 0.01 0.00 0.00 42.46 39.40 3h02 s ILE 73 CO 0.03 0.49 -0.09 -0.22 0.00 0.00 0.00 174.94 175.15 3h02 s LEU 74 N 0.22 2.97 0.33 2.97 2.96 0.29 -0.93 118.68 127.48 3h02 s LEU 74 Ca 0.01 -0.23 -0.10 0.00 -0.22 0.00 0.00 54.13 53.59 3h02 s LEU 74 Cb -0.13 -1.69 0.02 0.00 0.50 0.00 0.00 46.19 44.89 3h02 s LEU 74 CO 0.02 0.17 0.60 0.28 -1.32 0.00 0.00 176.35 176.10 3h02 s THR 75 N 0.31 0.00 0.12 3.68 -1.32 -0.55 -4.31 115.64 113.57 3h02 s THR 75 Ca -0.07 -1.32 0.08 0.00 -1.21 0.00 0.00 61.69 59.17 3h02 s THR 75 Cb -0.15 -2.58 -0.04 0.00 -1.51 0.00 0.00 72.50 68.22 3h02 s THR 75 CO 0.04 0.00 -0.15 -0.83 -2.21 0.00 0.00 174.62 171.48 3h02 s GLY 76 N -3.11 1.73 0.36 6.08 0.00 -1.24 -1.21 107.32 109.92 3h02 s GLY 76 Ca 0.22 -1.32 -0.28 0.00 0.00 0.00 0.00 44.72 43.34 3h02 s GLY 76 CO 0.14 -1.31 1.46 1.85 0.00 0.00 0.00 173.10 175.24 3h02 s GLU 77 N -2.21 4.16 0.80 2.90 2.56 0.60 -4.80 118.70 122.71 3h02 s GLU 77 Ca 0.20 2.49 0.00 0.00 0.00 0.00 0.00 54.97 57.66 3h02 s GLU 77 Cb -0.11 -3.00 0.00 0.00 2.00 0.00 0.00 34.13 33.03 3h02 s GLU 77 CO 0.12 -0.47 0.00 0.41 -0.56 0.00 0.00 175.26 174.76 3h02 n GLY 78 N 0.74 -2.13 0.43 -1.50 0.00 -1.26 -4.53 105.19 96.94 3h02 n GLY 78 Ca 0.02 -1.48 0.05 0.00 0.00 0.00 0.00 46.02 44.60 3h02 n GLY 78 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3h02 n ASP 79 N 0.65 1.99 -0.03 1.61 8.00 -1.26 -4.65 116.55 122.87 3h02 n ASP 79 Ca 0.00 -1.51 0.05 0.00 0.71 0.00 0.00 54.79 54.04 3h02 n ASP 79 Cb 0.00 -0.03 -0.16 0.00 -0.02 0.00 0.00 41.12 40.91 3h02 n ASP 79 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 3h02 n LYS 80 N 0.54 0.66 -3.68 -1.24 5.02 -1.26 -3.65 118.16 114.55 3h02 n LYS 80 Ca 0.07 -0.12 -0.11 0.00 -2.02 0.00 0.00 58.31 56.13 3h02 n LYS 80 Cb 0.27 -1.54 -0.09 0.00 -0.02 0.00 0.00 35.03 33.65 3h02 n LYS 80 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3h02 s ALA 81 N -3.23 -1.40 -0.12 7.82 0.00 -1.19 -1.82 121.76 121.82 3h02 s ALA 81 Ca -0.08 1.78 -0.12 0.00 0.00 0.00 0.00 51.96 53.53 3h02 s ALA 81 Cb 0.12 -1.05 -0.11 0.00 0.00 0.00 0.00 23.12 22.07 3h02 s ALA 81 CO 0.88 -0.29 0.30 0.35 0.00 0.00 0.00 175.76 177.00 3h02 h PHE 82 N 6.32 0.00 -0.59 0.00 3.57 0.14 -3.38 116.94 123.00 3h02 h PHE 82 Ca -0.31 0.00 0.21 0.00 3.53 0.00 0.00 57.97 61.39 3h02 h PHE 82 Cb 1.19 0.00 -0.23 0.00 2.79 0.00 0.00 35.95 39.71 3h02 h PHE 82 CO 0.26 0.44 0.17 0.00 -2.23 0.00 0.00 178.31 176.94 3h02 n ALA 84 N 5.23 2.55 0.00 0.00 0.00 -0.60 -1.50 120.51 126.19 3h02 n ALA 84 Ca -0.07 -0.27 0.00 0.00 0.00 0.00 0.00 53.44 53.10 3h02 n ALA 84 Cb 0.53 -1.16 0.00 0.00 0.00 0.00 0.00 19.45 18.82 3h02 n ALA 84 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3h02 n GLY 85 N 0.88 0.46 3.88 0.00 0.00 -1.06 -4.56 105.19 104.78 3h02 n GLY 85 Ca 0.12 -2.27 -0.34 0.00 0.00 0.00 0.00 46.02 43.54 3h02 n GLY 85 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3h02 s GLY 86 N 0.00 2.30 -0.03 -0.02 0.00 -1.26 -0.20 107.32 108.11 3h02 s GLY 86 Ca 0.00 -0.45 -0.23 0.00 0.00 0.00 0.00 44.72 44.04 3h02 s GLY 86 CO 0.00 -0.28 1.05 -0.55 0.00 0.00 0.00 173.10 173.33 3h02 h ASP 87 N 3.49 0.33 -2.19 1.64 5.19 -1.47 -3.46 116.42 119.95 3h02 h ASP 87 Ca -0.48 -0.77 0.00 0.00 -0.62 0.00 0.00 57.03 55.16 3h02 h ASP 87 Cb 1.19 -0.10 0.00 0.00 0.18 0.00 0.00 39.33 40.60 3h02 h ASP 87 CO 0.68 1.05 0.00 1.57 -3.12 0.00 0.00 179.24 179.42 3h02 n HIS 105 N -4.41 0.00 -1.99 4.55 -0.00 -1.26 -5.11 115.22 107.01 3h02 n HIS 105 Ca -0.10 0.00 -0.32 0.00 -0.00 0.00 0.00 57.72 57.30 3h02 n HIS 105 Cb 0.56 -0.46 0.03 0.00 -0.00 0.00 0.00 29.99 30.12 3h02 n HIS 105 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 176.34 177.62 3h02 n LEU 106 N -0.41 6.28 0.00 0.27 4.32 -1.26 -4.77 117.00 121.44 3h02 n LEU 106 Ca 0.00 -4.83 0.05 0.00 -0.02 0.00 0.00 56.01 51.22 3h02 n LEU 106 Cb 0.00 -0.74 0.25 0.00 -1.62 0.00 0.00 43.42 41.30 3h02 n LEU 106 CO 0.00 1.91 0.66 -0.46 -1.22 0.00 0.00 177.39 178.27 3h02 n ASN 107 N -0.63 0.00 0.25 -1.43 6.94 -1.26 -2.33 115.26 116.80 3h02 n ASN 107 Ca 0.50 0.39 0.11 0.00 -0.02 0.00 0.00 54.58 55.56 3h02 n ASN 107 Cb 0.57 -0.44 0.67 0.00 -2.36 0.00 0.00 39.78 38.23 3h02 n ASN 107 CO 0.00 0.00 0.00 1.62 -1.03 0.00 0.00 177.26 177.85 3h02 h VAL 108 N 0.00 0.68 -0.69 3.53 3.04 -1.96 -1.22 116.25 119.63 3h02 h VAL 108 Ca 0.00 -0.59 -0.03 0.00 -1.01 0.00 0.00 66.70 65.07 3h02 h VAL 108 Cb 0.16 1.37 -0.03 0.00 -2.01 0.00 0.00 31.29 30.78 3h02 h VAL 108 CO 0.00 0.14 0.30 -0.07 -1.01 0.00 0.00 177.57 176.93 3h02 h LEU 109 N 0.00 0.90 -0.40 3.16 3.38 -1.89 0.91 115.31 121.37 3h02 h LEU 109 Ca -0.00 -0.11 -0.01 0.00 0.09 0.00 0.00 57.88 57.85 3h02 h LEU 109 Cb 0.36 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.86 3h02 h LEU 109 CO 0.02 0.79 0.23 0.44 0.09 0.00 0.00 178.44 180.00 3h02 h ASP 110 N 0.98 0.50 -0.74 -0.43 3.45 -1.43 -2.29 116.42 116.45 3h02 h ASP 110 Ca 0.24 -0.08 -0.05 0.00 0.43 0.00 0.00 57.03 57.57 3h02 h ASP 110 Cb 0.14 -0.13 -0.03 0.00 -0.56 0.00 0.00 39.33 38.75 3h02 h ASP 110 CO -0.03 0.44 0.29 0.15 -1.57 0.00 0.00 179.24 178.52 3h02 h PHE 111 N 0.52 1.14 -0.64 4.55 3.57 -1.16 -1.41 116.94 123.52 3h02 h PHE 111 Ca 0.14 -0.09 0.06 0.00 3.53 0.00 0.00 57.97 61.61 3h02 h PHE 111 Cb 0.04 -0.34 -0.05 0.00 2.79 0.00 0.00 35.95 38.39 3h02 h PHE 111 CO -0.03 0.88 0.36 1.96 -2.23 0.00 0.00 178.31 179.24 3h02 h GLN 112 N 1.07 0.64 -0.64 1.11 4.20 -0.69 -1.55 115.11 119.26 3h02 h GLN 112 Ca 0.25 -0.04 -0.04 0.00 0.06 0.00 0.00 58.65 58.88 3h02 h GLN 112 Cb 0.23 -0.14 -0.03 0.00 0.30 0.00 0.00 27.48 27.83 3h02 h GLN 112 CO -0.02 0.43 0.24 0.00 -0.67 0.00 0.00 178.83 178.81 3h02 h ARG 113 N 0.66 0.96 -0.65 1.46 3.08 -0.97 -2.19 114.38 116.73 3h02 h ARG 113 Ca 0.29 -0.18 -0.08 0.00 0.07 0.00 0.00 59.98 60.08 3h02 h ARG 113 Cb 0.17 -0.15 -0.03 0.00 0.08 0.00 0.00 29.97 30.04 3h02 h ARG 113 CO -0.18 0.81 0.11 0.37 -1.07 0.00 0.00 179.97 180.02 3h02 h GLN 114 N 0.89 1.08 -0.52 0.04 4.15 -0.91 0.55 115.11 120.40 3h02 h GLN 114 Ca 0.21 -0.29 -0.02 0.00 0.77 0.00 0.00 58.65 59.33 3h02 h GLN 114 Cb 0.22 -0.13 -0.02 0.00 0.21 0.00 0.00 27.48 27.76 3h02 h GLN 114 CO -0.02 0.99 0.26 0.82 -1.93 0.00 0.00 178.83 178.95 3h02 h ILE 115 N 1.00 1.19 -0.14 2.39 2.04 -1.21 -0.62 117.51 122.15 3h02 h ILE 115 Ca 0.20 -0.54 0.01 0.00 1.00 0.00 0.00 64.86 65.54 3h02 h ILE 115 Cb 0.43 0.59 -0.01 0.00 -0.74 0.00 0.00 36.82 37.08 3h02 h ILE 115 CO 0.01 0.21 0.04 -0.09 0.00 0.00 0.00 178.15 178.33 3h02 h ARG 116 N 0.70 0.11 -0.20 2.37 9.65 -0.99 -2.94 114.38 123.07 3h02 h ARG 116 Ca 0.18 -0.01 0.00 0.00 -1.10 0.00 0.00 59.98 59.05 3h02 h ARG 116 Cb 0.11 -0.02 0.00 0.00 -1.39 0.00 0.00 29.97 28.66 3h02 h ARG 116 CO -0.02 0.07 0.00 0.25 2.80 0.00 0.00 179.97 183.07 3h02 n THR 117 N -5.06 0.25 -2.06 0.20 -2.24 0.15 -4.89 114.28 100.63 3h02 n THR 117 Ca -0.04 -0.41 -0.42 0.00 -2.27 0.00 0.00 64.05 60.91 3h02 n THR 117 Cb 0.06 0.49 -0.03 0.00 -2.10 0.00 0.00 70.33 68.75 3h02 n THR 117 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3h02 n PRO 119 N 4.86 0.84 -4.43 0.00 -0.04 -1.26 -4.73 135.00 130.25 3h02 n PRO 119 Ca 0.14 0.00 -0.30 0.00 -0.04 0.00 0.00 63.50 63.30 3h02 n PRO 119 Cb 0.41 -1.28 -0.12 0.00 -0.04 0.00 0.00 33.50 32.47 3h02 n PRO 119 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 3h02 s LYS 120 N -2.00 1.76 0.41 0.54 1.02 -1.26 -4.23 119.74 115.98 3h02 s LYS 120 Ca 0.23 -1.17 -0.27 0.00 0.02 0.00 0.00 55.97 54.78 3h02 s LYS 120 Cb 0.10 -2.07 -0.10 0.00 -0.52 0.00 0.00 37.83 35.25 3h02 s LYS 120 CO 0.18 0.49 1.45 -2.14 -0.92 0.00 0.00 175.35 174.41 3h02 s PRO 121 N -1.94 3.89 -0.13 -1.68 0.02 -1.25 -4.83 135.00 129.08 3h02 s PRO 121 Ca 0.16 2.49 0.02 0.00 0.02 0.00 0.00 61.00 63.69 3h02 s PRO 121 Cb -0.10 -2.81 0.00 0.00 0.02 0.00 0.00 34.50 31.61 3h02 s PRO 121 CO 0.08 -0.68 -0.21 0.08 -0.33 0.00 0.00 177.00 175.94 3h02 s VAL 122 N -1.16 2.25 -0.15 3.83 1.01 -1.26 -1.05 120.40 123.87 3h02 s VAL 122 Ca 0.57 -0.93 0.00 0.00 0.00 0.00 0.00 61.98 61.62 3h02 s VAL 122 Cb -0.45 -1.90 -0.00 0.00 0.00 0.00 0.00 36.38 34.03 3h02 s VAL 122 CO 0.59 0.54 -0.15 -0.69 0.00 0.00 0.00 175.10 175.40 3h02 s VAL 123 N 0.61 2.68 0.00 2.92 1.01 0.11 -0.86 120.40 126.87 3h02 s VAL 123 Ca -0.11 -0.77 0.00 0.00 0.00 0.00 0.00 61.98 61.10 3h02 s VAL 123 Cb -0.16 -2.13 0.00 0.00 0.00 0.00 0.00 36.38 34.09 3h02 s VAL 123 CO 0.03 0.52 0.00 0.00 0.00 0.00 0.00 175.10 175.64 3h02 n ALA 124 N 4.01 0.00 0.00 5.51 0.00 0.64 -0.55 120.51 130.12 3h02 n ALA 124 Ca -0.19 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.25 3h02 n ALA 124 Cb 0.52 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.97 3h02 n ALA 124 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 3h02 n VAL 126 N -1.54 0.00 -4.67 0.00 0.31 0.62 -0.64 118.33 112.41 3h02 n VAL 126 Ca 0.00 0.00 -0.33 0.00 -0.01 0.00 0.00 64.34 64.00 3h02 n VAL 126 Cb 0.00 0.00 -0.13 0.00 -0.91 0.00 0.00 33.84 32.80 3h02 n VAL 126 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3h02 s ALA 127 N 0.00 2.76 0.00 3.52 0.00 -1.26 -0.41 121.76 126.38 3h02 s ALA 127 Ca 0.00 -0.88 0.00 0.00 0.00 0.00 0.00 51.96 51.08 3h02 s ALA 127 Cb 0.00 -1.29 0.00 0.00 0.00 0.00 0.00 23.12 21.83 3h02 s ALA 127 CO 0.00 0.30 0.00 0.41 0.00 0.00 0.00 175.76 176.47 3h02 n GLY 128 N 3.30 2.37 3.70 0.00 0.00 -1.24 -1.78 105.19 111.54 3h02 n GLY 128 Ca -0.18 -0.49 -0.42 0.00 0.00 0.00 0.00 46.02 44.93 3h02 n GLY 128 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3h02 s TYR 129 N 0.00 3.17 -0.43 1.61 1.51 -0.76 -1.12 117.35 121.33 3h02 s TYR 129 Ca 0.00 1.06 0.02 0.00 -1.01 0.00 0.00 57.07 57.14 3h02 s TYR 129 Cb 0.00 -3.55 0.14 0.00 -0.11 0.00 0.00 41.96 38.43 3h02 s TYR 129 CO 0.00 -1.89 0.24 0.45 -1.11 0.00 0.00 175.55 173.24 3h02 s SER 130 N 1.39 3.53 0.09 2.29 0.15 -0.32 -0.34 113.70 120.49 3h02 s SER 130 Ca 0.61 -2.59 0.06 0.00 0.70 0.00 0.00 55.95 54.73 3h02 s SER 130 Cb -0.31 -0.95 -0.03 0.00 -1.71 0.00 0.00 66.02 63.02 3h02 s SER 130 CO 0.27 -0.27 -0.17 -0.63 1.20 0.00 0.00 173.24 173.65 3h02 s ILE 131 N 0.42 1.38 0.00 6.45 -1.09 -0.56 -2.96 121.20 124.84 3h02 s ILE 131 Ca 0.18 -1.44 0.00 0.00 -2.23 0.00 0.00 60.65 57.16 3h02 s ILE 131 Cb -0.23 -1.31 0.00 0.00 -1.58 0.00 0.00 42.46 39.34 3h02 s ILE 131 CO -0.00 -0.17 0.00 0.61 -1.23 0.00 0.00 174.94 174.14 3h02 n GLY 132 N 1.13 3.53 0.34 6.18 0.00 -0.52 -0.57 105.19 115.28 3h02 n GLY 132 Ca -0.20 -0.06 0.17 0.00 0.00 0.00 0.00 46.02 45.92 3h02 n GLY 132 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3h02 h GLY 133 N 0.00 0.00 2.00 -0.02 0.00 -1.89 0.86 103.07 104.02 3h02 h GLY 133 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 47.33 47.23 3h02 h GLY 133 CO 0.00 0.00 -0.45 -1.33 0.00 0.00 0.00 176.54 174.76 3h02 h GLY 134 N 0.00 0.00 0.90 4.60 0.00 -1.00 -2.33 103.07 105.24 3h02 h GLY 134 Ca 0.11 0.00 -0.15 0.00 0.00 0.00 0.00 47.33 47.29 3h02 h GLY 134 CO -0.00 0.00 -0.54 0.84 0.00 0.00 0.00 176.54 176.84 3h02 h HIS 135 N 0.00 0.73 -0.90 5.60 6.17 -0.70 -3.04 115.15 123.00 3h02 h HIS 135 Ca -0.00 -0.33 0.01 0.00 0.71 0.00 0.00 60.37 60.76 3h02 h HIS 135 Cb 0.97 -0.11 -0.04 0.00 2.52 0.00 0.00 27.41 30.75 3h02 h HIS 135 CO 0.00 1.11 0.59 0.28 0.71 0.00 0.00 177.93 180.62 3h02 h VAL 136 N 0.14 1.23 -0.65 5.26 2.07 -1.39 -2.58 116.25 120.33 3h02 h VAL 136 Ca -0.04 -0.44 0.03 0.00 0.82 0.00 0.00 66.70 67.07 3h02 h VAL 136 Cb 1.19 -0.09 -0.04 0.00 -1.52 0.00 0.00 31.29 30.83 3h02 h VAL 136 CO 0.11 0.23 0.40 -0.07 0.02 0.00 0.00 177.57 178.26 3h02 h LEU 137 N 1.22 0.67 -8.10 2.57 3.38 -1.38 -3.43 115.31 110.24 3h02 h LEU 137 Ca 0.33 -0.00 -0.28 0.00 0.09 0.00 0.00 57.88 58.02 3h02 h LEU 137 Cb -0.13 -0.14 -0.04 0.00 0.09 0.00 0.00 40.66 40.44 3h02 h LEU 137 CO -0.07 0.47 0.82 -1.38 0.09 0.00 0.00 178.44 178.37 3h02 s HIS 138 N -6.13 1.81 0.00 1.13 -3.43 -0.97 -4.99 115.29 102.71 3h02 s HIS 138 Ca -0.13 0.73 0.00 0.00 -0.80 0.00 0.00 55.06 54.86 3h02 s HIS 138 Cb 0.14 -3.95 0.00 0.00 -1.43 0.00 0.00 32.58 27.35 3h02 s HIS 138 CO 0.76 -1.39 0.00 0.00 -2.00 0.00 0.00 174.74 172.11 3h02 h ASP 142 N 0.00 0.73 -4.03 0.00 3.32 -1.38 -3.45 116.42 111.63 3h02 h ASP 142 Ca 0.00 -0.08 -0.33 0.00 0.02 0.00 0.00 57.03 56.65 3h02 h ASP 142 Cb 0.00 -0.19 -0.15 0.00 0.22 0.00 0.00 39.33 39.21 3h02 h ASP 142 CO 0.00 0.60 -0.72 -0.76 -1.72 0.00 0.00 179.24 176.64 3h02 s LEU 143 N -10.00 2.51 -0.09 1.55 1.43 -1.08 -5.05 118.68 107.95 3h02 s LEU 143 Ca -0.13 -0.98 -0.01 0.00 -1.03 0.00 0.00 54.13 51.97 3h02 s LEU 143 Cb 0.13 -0.35 0.03 0.00 0.03 0.00 0.00 46.19 46.03 3h02 s LEU 143 CO 0.77 -0.32 -0.01 -0.89 0.23 0.00 0.00 176.35 176.13 3h02 s THR 144 N -3.19 0.50 -0.26 5.49 2.01 -1.26 -0.26 115.64 118.68 3h02 s THR 144 Ca 0.15 0.00 -0.08 0.00 0.31 0.00 0.00 61.69 62.07 3h02 s THR 144 Cb 0.02 -0.66 -0.03 0.00 0.01 0.00 0.00 72.50 71.83 3h02 s THR 144 CO 0.00 0.25 0.10 -0.63 -0.69 0.00 0.00 174.62 173.66 3h02 s ILE 145 N 1.92 4.61 -0.02 1.82 1.01 0.18 -0.57 121.20 130.15 3h02 s ILE 145 Ca 0.05 -0.07 0.04 0.00 0.00 0.00 0.00 60.65 60.67 3h02 s ILE 145 Cb -0.13 -3.17 -0.03 0.00 0.01 0.00 0.00 42.46 39.15 3h02 s ILE 145 CO -0.06 0.32 -0.13 0.00 0.00 0.00 0.00 174.94 175.07 3h02 s ALA 146 N 1.62 2.75 0.70 9.38 0.00 -0.67 -0.27 121.76 135.27 3h02 s ALA 146 Ca 0.06 -1.03 -0.10 0.00 0.00 0.00 0.00 51.96 50.89 3h02 s ALA 146 Cb -0.15 -0.97 0.03 0.00 0.00 0.00 0.00 23.12 22.03 3h02 s ALA 146 CO 0.06 0.57 1.07 0.00 0.00 0.00 0.00 175.76 177.46 3h02 s ALA 147 N -0.84 2.94 0.25 0.00 0.00 0.46 -0.75 121.76 123.82 3h02 s ALA 147 Ca 0.14 -0.51 0.36 0.00 0.00 0.00 0.00 51.96 51.95 3h02 s ALA 147 Cb -0.11 -2.90 1.76 0.00 0.00 0.00 0.00 23.12 21.87 3h02 s ALA 147 CO 0.03 -1.19 2.09 0.93 0.00 0.00 0.00 175.76 177.62 3h02 h GLU 148 N -0.64 0.00 -0.61 0.00 5.08 -1.30 -2.15 114.58 114.96 3h02 h GLU 148 Ca -0.45 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.91 3h02 h GLU 148 Cb 1.27 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.52 3h02 h GLU 148 CO 0.63 0.00 0.00 0.27 -1.00 0.00 0.00 179.01 178.91 3h02 n ASN 149 N -2.91 3.45 -4.77 1.42 6.94 -1.26 -4.59 115.26 113.54 3h02 n ASN 149 Ca -0.01 -1.99 -0.41 0.00 -0.02 0.00 0.00 54.58 52.15 3h02 n ASN 149 Cb 0.17 -0.41 -0.02 0.00 -2.36 0.00 0.00 39.78 37.16 3h02 n ASN 149 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 3h02 s ALA 150 N -1.19 3.51 -0.05 -2.53 0.00 -0.81 -3.61 121.76 117.08 3h02 s ALA 150 Ca 0.43 1.25 0.02 0.00 0.00 0.00 0.00 51.96 53.67 3h02 s ALA 150 Cb 0.23 -3.48 0.01 0.00 0.00 0.00 0.00 23.12 19.88 3h02 s ALA 150 CO 0.30 -0.64 -0.10 0.42 0.00 0.00 0.00 175.76 175.74 3h02 s ILE 151 N -0.96 0.98 0.14 0.00 -1.09 -0.28 -2.41 121.20 117.58 3h02 s ILE 151 Ca 0.50 -0.40 0.08 0.00 -2.23 0.00 0.00 60.65 58.60 3h02 s ILE 151 Cb -0.40 -0.91 -0.04 0.00 -1.58 0.00 0.00 42.46 39.54 3h02 s ILE 151 CO 0.51 0.32 -0.19 -0.36 -1.23 0.00 0.00 174.94 173.99 3h02 s PHE 152 N 0.62 1.75 0.00 3.97 0.08 0.54 -1.18 117.98 123.77 3h02 s PHE 152 Ca -0.12 -0.46 0.00 0.00 0.12 0.00 0.00 56.93 56.47 3h02 s PHE 152 Cb -0.14 -0.91 0.00 0.00 -0.57 0.00 0.00 43.02 41.40 3h02 s PHE 152 CO 0.03 0.27 0.00 0.41 -0.10 0.00 0.00 175.22 175.82 3h02 n GLY 153 N 0.59 2.69 3.92 4.36 0.00 -1.16 0.42 105.19 116.02 3h02 n GLY 153 Ca -0.16 -1.09 -0.20 0.00 0.00 0.00 0.00 46.02 44.57 3h02 n GLY 153 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3h02 s GLN 154 N -2.06 2.95 0.00 1.61 -1.52 -1.26 -1.44 119.66 117.95 3h02 s GLN 154 Ca 0.00 -1.13 0.00 0.00 -1.95 0.00 0.00 55.36 52.28 3h02 s GLN 154 Cb 0.00 -2.66 0.00 0.00 -0.22 0.00 0.00 33.01 30.13 3h02 s GLN 154 CO 0.00 0.10 0.00 0.25 -0.25 0.00 0.00 175.29 175.39 3h02 n THR 155 N -1.50 0.00 -0.23 -0.19 -2.24 -1.26 -4.56 114.28 104.30 3h02 n THR 155 Ca -0.02 -0.03 -0.06 0.00 -2.27 0.00 0.00 64.05 61.67 3h02 n THR 155 Cb 0.59 0.65 -0.06 0.00 -2.10 0.00 0.00 70.33 69.42 3h02 n THR 155 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3h02 n GLY 156 N 0.17 -2.31 0.34 3.38 0.00 -1.26 -0.06 105.19 105.44 3h02 n GLY 156 Ca 0.00 0.83 0.16 0.00 0.00 0.00 0.00 46.02 47.00 3h02 n GLY 156 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3h02 h PRO 157 N 0.00 0.00 -0.43 1.61 0.11 -1.67 1.06 132.00 132.68 3h02 h PRO 157 Ca 0.09 0.00 -0.14 0.00 0.11 0.00 0.00 66.00 66.06 3h02 h PRO 157 Cb 0.23 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.33 3h02 h PRO 157 CO -0.53 0.00 -0.29 0.87 -0.21 0.00 0.00 178.00 177.84 3h02 h LYS 158 N 0.00 0.96 -0.20 1.05 1.57 -0.79 -3.14 116.57 116.01 3h02 h LYS 158 Ca 0.14 -0.45 0.00 0.00 -1.87 0.00 0.00 60.65 58.47 3h02 h LYS 158 Cb 0.60 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.90 3h02 h LYS 158 CO -0.00 1.12 0.00 1.33 -0.57 0.00 0.00 179.45 181.33 3h02 n VAL 159 N -4.10 0.25 -2.25 0.50 0.24 -0.43 -4.98 118.33 107.56 3h02 n VAL 159 Ca -0.01 -0.56 -0.01 0.00 -2.04 0.00 0.00 64.34 61.72 3h02 n VAL 159 Cb 0.50 1.03 0.00 0.00 -1.47 0.00 0.00 33.84 33.90 3h02 n VAL 159 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3h02 n GLY 160 N 1.37 0.59 2.20 7.63 0.00 0.33 -5.04 105.19 112.27 3h02 n GLY 160 Ca 0.17 -0.52 -0.08 0.00 0.00 0.00 0.00 46.02 45.59 3h02 n GLY 160 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3h02 n SER 161 N -0.19 -1.08 -3.60 1.61 3.41 0.93 -4.97 113.62 109.71 3h02 n SER 161 Ca -0.01 -2.11 -0.03 0.00 -0.26 0.00 0.00 58.87 56.47 3h02 n SER 161 Cb 0.51 1.91 -0.02 0.00 -0.26 0.00 0.00 64.21 66.35 3h02 n SER 161 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 3h02 s PHE 162 N -4.15 -0.10 -0.36 7.33 -0.12 -1.26 -1.95 117.98 117.37 3h02 s PHE 162 Ca 0.15 0.04 0.03 0.00 -0.05 0.00 0.00 56.93 57.10 3h02 s PHE 162 Cb -0.02 0.52 0.10 0.00 -0.63 0.00 0.00 43.02 43.00 3h02 s PHE 162 CO 0.11 -0.20 0.09 0.34 -0.05 0.00 0.00 175.22 175.50 3h02 s ASP 163 N -2.34 4.53 -0.02 1.98 -1.08 -1.26 -4.96 116.67 113.52 3h02 s ASP 163 Ca 0.11 -2.16 0.16 0.00 -0.52 0.00 0.00 52.55 50.14 3h02 s ASP 163 Cb 0.00 -1.45 0.50 0.00 -1.46 0.00 0.00 42.92 40.51 3h02 s ASP 163 CO -0.04 -0.37 1.41 0.61 0.52 0.00 0.00 175.17 177.30 3h02 n GLY 164 N 4.23 1.69 0.00 2.66 0.00 -1.26 -3.16 105.19 109.34 3h02 n GLY 164 Ca 0.03 -0.61 0.00 0.00 0.00 0.00 0.00 46.02 45.45 3h02 n GLY 164 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3h02 n GLY 165 N 1.28 0.66 0.25 -0.02 0.00 -1.26 -4.57 105.19 101.53 3h02 n GLY 165 Ca 0.19 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.33 3h02 n GLY 165 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 173.32 174.81 3h02 h TRP 166 N 0.00 0.00 -0.24 1.61 6.55 -1.97 -1.84 115.95 120.06 3h02 h TRP 166 Ca 0.00 0.00 0.07 0.00 0.95 0.00 0.00 58.89 59.91 3h02 h TRP 166 Cb 0.00 0.00 -0.01 0.00 -0.86 0.00 0.00 29.16 28.29 3h02 h TRP 166 CO 0.00 0.16 0.18 0.78 -1.05 0.00 0.00 178.44 178.51 3h02 h GLY 167 N 1.49 0.00 0.00 1.49 0.00 -1.89 -1.98 103.07 102.18 3h02 h GLY 167 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3h02 h GLY 167 CO 0.02 0.00 -0.36 0.00 0.00 0.00 0.00 176.54 176.20 3h02 n ALA 168 N -2.56 0.64 -0.13 3.60 0.00 -0.94 -4.74 120.51 116.38 3h02 n ALA 168 Ca 0.03 -0.43 -0.05 0.00 0.00 0.00 0.00 53.44 52.99 3h02 n ALA 168 Cb 0.33 0.02 0.03 0.00 0.00 0.00 0.00 19.45 19.83 3h02 n ALA 168 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3h02 h SER 169 N -0.36 0.19 0.00 0.00 4.64 -1.47 -1.57 113.55 114.98 3h02 h SER 169 Ca 0.00 0.04 0.00 0.00 -0.47 0.00 0.00 61.79 61.36 3h02 h SER 169 Cb 0.36 0.02 0.00 0.00 -0.31 0.00 0.00 62.40 62.47 3h02 h SER 169 CO 0.00 0.15 0.00 0.00 -0.87 0.00 0.00 176.83 176.11 3h02 n TYR 170 N -4.99 0.00 0.00 4.77 9.36 -0.74 -2.55 117.16 123.01 3h02 n TYR 170 Ca 0.03 -0.31 0.00 0.00 3.32 0.00 0.00 57.90 60.94 3h02 n TYR 170 Cb 0.15 -0.26 0.00 0.00 -0.63 0.00 0.00 39.34 38.59 3h02 n TYR 170 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 3h02 n ALA 172 N 1.32 0.00 0.64 2.98 0.00 -0.59 -2.49 120.51 122.37 3h02 n ALA 172 Ca 0.00 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.55 3h02 n ALA 172 Cb 0.20 0.00 0.45 0.00 0.00 0.00 0.00 19.45 20.10 3h02 n ALA 172 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3h02 n ARG 173 N 0.00 0.07 -0.11 0.00 5.12 -1.06 -0.79 116.66 119.90 3h02 n ARG 173 Ca 0.00 0.21 -0.19 0.00 -1.93 0.00 0.00 57.85 55.94 3h02 n ARG 173 Cb 0.00 -1.61 -0.07 0.00 -1.16 0.00 0.00 32.46 29.62 3h02 n ARG 173 CO 0.00 0.00 0.00 -0.89 -1.93 0.00 0.00 177.63 174.81 3h02 n ILE 174 N -1.75 1.51 0.61 0.55 5.41 -1.04 -4.77 119.36 119.89 3h02 n ILE 174 Ca 0.05 -0.09 0.06 0.00 1.00 0.00 0.00 62.75 63.76 3h02 n ILE 174 Cb 0.27 -2.11 -0.04 0.00 -0.71 0.00 0.00 39.64 37.04 3h02 n ILE 174 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 176.55 177.88 3h02 n VAL 175 N -4.39 0.00 0.00 1.39 0.24 -1.25 -4.80 118.33 109.52 3h02 n VAL 175 Ca -0.33 -0.26 0.00 0.00 -2.04 0.00 0.00 64.34 61.71 3h02 n VAL 175 Cb 0.67 1.06 0.00 0.00 -1.47 0.00 0.00 33.84 34.10 3h02 n VAL 175 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3h02 n GLY 176 N 1.20 1.05 0.28 7.63 0.00 0.03 -4.50 105.19 110.88 3h02 n GLY 176 Ca 0.04 -1.81 -0.09 0.00 0.00 0.00 0.00 46.02 44.16 3h02 n GLY 176 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 3h02 h GLN 177 N 0.00 0.89 -0.16 1.61 1.08 -2.00 -1.69 115.11 114.84 3h02 h GLN 177 Ca 0.00 -0.34 -0.01 0.00 -1.45 0.00 0.00 58.65 56.85 3h02 h GLN 177 Cb 0.00 -0.05 -0.01 0.00 -0.05 0.00 0.00 27.48 27.37 3h02 h GLN 177 CO 0.00 0.99 0.06 0.87 -0.95 0.00 0.00 178.83 179.80 3h02 h LYS 178 N 0.78 0.25 -0.35 1.46 1.79 -1.96 -2.20 116.57 116.33 3h02 h LYS 178 Ca 0.12 -0.05 -0.11 0.00 -2.18 0.00 0.00 60.65 58.43 3h02 h LYS 178 Cb 0.70 -0.04 -0.01 0.00 -1.58 0.00 0.00 32.23 31.30 3h02 h LYS 178 CO 0.05 0.34 -0.25 0.87 -1.08 0.00 0.00 179.45 179.39 3h02 h LYS 179 N 0.10 0.71 -0.64 3.15 1.79 -1.78 -2.35 116.57 117.54 3h02 h LYS 179 Ca 0.05 -0.29 -0.06 0.00 -2.18 0.00 0.00 60.65 58.18 3h02 h LYS 179 Cb 0.19 -0.03 -0.03 0.00 -1.58 0.00 0.00 32.23 30.78 3h02 h LYS 179 CO -0.00 0.88 0.18 0.00 -1.08 0.00 0.00 179.45 179.43 3h02 h ALA 180 N 1.11 1.11 -0.28 3.86 0.00 -1.25 0.53 119.26 124.33 3h02 h ALA 180 Ca 0.08 -0.22 -0.13 0.00 0.00 0.00 0.00 54.91 54.64 3h02 h ALA 180 Cb 0.74 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 3h02 h ALA 180 CO 0.06 0.61 -0.37 0.00 0.00 0.00 0.00 179.25 179.54 3h02 h ARG 181 N 0.95 0.65 -0.15 0.00 3.08 -1.25 -2.20 114.38 115.47 3h02 h ARG 181 Ca 0.21 -0.32 -0.02 0.00 0.07 0.00 0.00 59.98 59.92 3h02 h ARG 181 Cb 0.30 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.35 3h02 h ARG 181 CO -0.00 0.92 0.02 1.49 -1.07 0.00 0.00 179.97 181.32 3h02 h GLU 182 N 0.54 0.24 -0.51 0.04 4.81 -0.87 0.58 114.58 119.41 3h02 h GLU 182 Ca 0.05 -0.07 0.04 0.00 -0.13 0.00 0.00 59.36 59.25 3h02 h GLU 182 Cb 0.89 -0.03 -0.04 0.00 0.63 0.00 0.00 28.75 30.20 3h02 h GLU 182 CO 0.08 0.43 0.27 0.82 -0.73 0.00 0.00 179.01 179.88 3h02 h ILE 183 N 0.02 0.98 0.13 2.32 2.04 -0.83 -2.34 117.51 119.82 3h02 h ILE 183 Ca 0.04 -0.18 -0.27 0.00 1.00 0.00 0.00 64.86 65.46 3h02 h ILE 183 Cb 0.31 0.41 0.03 0.00 -0.74 0.00 0.00 36.82 36.82 3h02 h ILE 183 CO 0.00 0.10 -1.12 -0.50 0.00 0.00 0.00 178.15 176.63 3h02 h TRP 184 N 0.52 0.89 -0.07 1.37 4.06 -1.39 -2.65 115.95 118.68 3h02 h TRP 184 Ca 0.22 -0.57 -0.19 0.00 2.06 0.00 0.00 58.89 60.41 3h02 h TRP 184 Cb 0.11 -0.07 -0.00 0.00 -1.00 0.00 0.00 29.16 28.20 3h02 h TRP 184 CO -0.09 1.42 -0.74 0.74 -3.56 0.00 0.00 178.44 176.21 3h02 h PHE 185 N 0.11 0.54 0.00 0.49 -1.00 -0.83 -3.33 116.94 112.91 3h02 h PHE 185 Ca -0.18 -0.24 -0.02 0.00 2.81 0.00 0.00 57.97 60.34 3h02 h PHE 185 Cb 1.83 -0.08 -0.00 0.00 3.61 0.00 0.00 35.95 41.30 3h02 h PHE 185 CO 0.14 1.00 -2.01 1.28 -1.61 0.00 0.00 178.31 177.10 3h02 n LEU 186 N -3.83 0.01 -3.51 1.54 4.32 -0.89 -5.00 117.00 109.64 3h02 n LEU 186 Ca -0.04 0.00 -0.26 0.00 -0.02 0.00 0.00 56.01 55.69 3h02 n LEU 186 Cb 0.71 0.03 0.03 0.00 -1.62 0.00 0.00 43.42 42.58 3h02 n LEU 186 CO 0.48 0.03 0.07 0.00 -1.22 0.00 0.00 177.39 176.75 3h02 s ARG 188 N -6.21 0.77 -0.04 0.00 0.52 -1.26 -4.77 118.95 107.96 3h02 s ARG 188 Ca 0.51 0.12 -0.02 0.00 -0.52 0.00 0.00 55.73 55.82 3h02 s ARG 188 Cb -0.24 -1.81 -0.04 0.00 0.52 0.00 0.00 34.95 33.38 3h02 s ARG 188 CO 0.62 -2.42 0.08 -0.65 0.02 0.00 0.00 175.30 172.96 3h02 s GLN 189 N -5.41 3.14 -0.01 3.54 -0.21 -1.26 -4.29 119.66 115.16 3h02 s GLN 189 Ca 0.66 -0.39 0.08 0.00 0.02 0.00 0.00 55.36 55.73 3h02 s GLN 189 Cb -0.12 -2.92 -0.02 0.00 1.00 0.00 0.00 33.01 30.95 3h02 s GLN 189 CO 0.53 0.68 -0.24 0.71 -2.12 0.00 0.00 175.29 174.86 3h02 s TYR 190 N -1.11 2.15 0.74 0.91 2.02 0.17 -4.93 117.35 117.30 3h02 s TYR 190 Ca 0.20 -0.41 -0.06 0.00 -0.37 0.00 0.00 57.07 56.43 3h02 s TYR 190 Cb -0.12 -1.37 0.10 0.00 -0.40 0.00 0.00 41.96 40.17 3h02 s TYR 190 CO 0.10 -0.01 1.04 0.16 -1.57 0.00 0.00 175.55 175.27 3h02 s ASP 191 N -0.69 4.44 0.29 2.29 1.47 -1.26 -0.34 116.67 122.87 3h02 s ASP 191 Ca 0.09 0.17 -0.03 0.00 1.18 0.00 0.00 52.55 53.97 3h02 s ASP 191 Cb -0.09 -0.67 0.41 0.00 -0.34 0.00 0.00 42.92 42.23 3h02 s ASP 191 CO -0.00 -1.82 1.95 0.00 0.68 0.00 0.00 175.17 175.98 3h02 h ALA 192 N -0.70 1.40 -0.61 2.11 0.00 -1.73 -0.34 119.26 119.40 3h02 h ALA 192 Ca -0.42 -0.05 -0.07 0.00 0.00 0.00 0.00 54.91 54.36 3h02 h ALA 192 Cb 1.29 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 18.71 3h02 h ALA 192 CO 0.51 0.54 0.10 0.37 0.00 0.00 0.00 179.25 180.77 3h02 h GLN 193 N 1.17 1.01 -0.24 0.00 5.75 -1.90 -0.99 115.11 119.90 3h02 h GLN 193 Ca 0.33 -0.27 -0.02 0.00 -0.15 0.00 0.00 58.65 58.55 3h02 h GLN 193 Cb -0.08 -0.12 -0.01 0.00 1.07 0.00 0.00 27.48 28.34 3h02 h GLN 193 CO -0.08 0.95 0.09 1.96 -2.65 0.00 0.00 178.83 179.09 3h02 h GLN 194 N 0.91 0.37 -0.64 1.69 4.20 -1.78 -1.06 115.11 118.80 3h02 h GLN 194 Ca 0.18 -0.07 0.08 0.00 0.06 0.00 0.00 58.65 58.90 3h02 h GLN 194 Cb 0.43 -0.06 -0.06 0.00 0.30 0.00 0.00 27.48 28.09 3h02 h GLN 194 CO 0.01 0.43 0.31 0.00 -0.67 0.00 0.00 178.83 178.91 3h02 h ALA 195 N 0.92 0.85 -0.42 3.87 0.00 -0.91 -2.55 119.26 121.02 3h02 h ALA 195 Ca 0.08 0.05 -0.07 0.00 0.00 0.00 0.00 54.91 54.97 3h02 h ALA 195 Cb 0.21 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 3h02 h ALA 195 CO -0.00 -0.07 0.00 1.25 0.00 0.00 0.00 179.25 180.43 3h02 h LEU 196 N 0.56 0.73 -1.79 0.00 5.85 -0.98 0.45 115.31 120.13 3h02 h LEU 196 Ca 0.30 -0.31 0.00 0.00 0.84 0.00 0.00 57.88 58.72 3h02 h LEU 196 Cb 0.28 -0.20 0.00 0.00 0.37 0.00 0.00 40.66 41.12 3h02 h LEU 196 CO -0.24 0.86 0.00 0.47 -0.34 0.00 0.00 178.44 179.19 3h02 n ASP 197 N -4.42 0.40 -0.30 1.25 8.00 -0.42 -4.51 116.55 116.56 3h02 n ASP 197 Ca -0.00 -0.31 0.00 0.00 0.71 0.00 0.00 54.79 55.18 3h02 n ASP 197 Cb 0.29 -0.08 0.00 0.00 -0.02 0.00 0.00 41.12 41.31 3h02 n ASP 197 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3h02 n GLY 199 N 0.82 -0.21 0.11 0.44 0.00 -1.06 -5.10 105.19 100.19 3h02 n GLY 199 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.00 3h02 n GLY 199 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3h02 h LEU 200 N 0.00 0.00 -8.69 0.99 5.85 -1.14 -3.45 115.31 108.87 3h02 h LEU 200 Ca 0.00 0.00 -0.35 0.00 0.84 0.00 0.00 57.88 58.37 3h02 h LEU 200 Cb 1.15 0.00 -0.15 0.00 0.37 0.00 0.00 40.66 42.03 3h02 h LEU 200 CO 0.00 0.72 -0.72 0.68 -0.34 0.00 0.00 178.44 178.78 3h02 s VAL 201 N -3.22 1.28 0.04 1.05 -7.23 -1.21 -4.86 120.40 106.25 3h02 s VAL 201 Ca 0.00 -2.07 0.05 0.00 -1.81 0.00 0.00 61.98 58.15 3h02 s VAL 201 Cb 0.11 -1.86 -0.24 0.00 0.56 0.00 0.00 36.38 34.95 3h02 s VAL 201 CO 0.77 -0.70 1.00 0.78 -0.31 0.00 0.00 175.10 176.64 3h02 h ASN 202 N 2.78 0.13 -4.99 4.85 4.21 -1.16 -3.42 115.58 117.99 3h02 h ASN 202 Ca -0.37 -0.18 -0.01 0.00 1.21 0.00 0.00 56.30 56.95 3h02 h ASN 202 Cb 1.20 -0.04 -0.12 0.00 -1.12 0.00 0.00 38.32 38.24 3h02 h ASN 202 CO 0.62 1.15 0.22 0.28 -1.29 0.00 0.00 177.43 178.42 3h02 s THR 203 N -2.65 0.00 -0.10 2.81 -1.32 -1.23 -5.06 115.64 108.09 3h02 s THR 203 Ca -0.04 -0.08 0.02 0.00 -1.21 0.00 0.00 61.69 60.38 3h02 s THR 203 Cb 0.08 -1.08 0.01 0.00 -1.51 0.00 0.00 72.50 70.00 3h02 s THR 203 CO 0.83 0.00 -0.14 -0.69 -2.21 0.00 0.00 174.62 172.41 3h02 s VAL 204 N -3.74 1.39 0.15 5.08 1.01 -1.26 -1.66 120.40 121.38 3h02 s VAL 204 Ca 0.02 -0.59 0.04 0.00 0.00 0.00 0.00 61.98 61.45 3h02 s VAL 204 Cb -0.01 -1.28 -0.04 0.00 0.00 0.00 0.00 36.38 35.04 3h02 s VAL 204 CO -0.11 0.42 -0.08 0.68 0.00 0.00 0.00 175.10 176.00 3h02 s VAL 205 N 0.94 1.08 0.32 2.92 -7.23 0.07 -4.94 120.40 113.55 3h02 s VAL 205 Ca -0.08 -2.04 -0.29 0.00 -1.81 0.00 0.00 61.98 57.76 3h02 s VAL 205 Cb -0.15 -1.89 -0.12 0.00 0.56 0.00 0.00 36.38 34.78 3h02 s VAL 205 CO -0.00 -0.71 1.36 -2.65 -0.31 0.00 0.00 175.10 172.79 3h02 n PRO 206 N -0.20 2.23 -0.32 4.82 -0.02 -1.26 -0.86 135.00 139.39 3h02 n PRO 206 Ca -0.10 0.79 0.16 0.00 -2.02 0.00 0.00 63.50 62.33 3h02 n PRO 206 Cb 0.61 -2.42 0.36 0.00 -0.02 0.00 0.00 33.50 32.03 3h02 n PRO 206 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 3h02 h LEU 207 N 3.11 0.44 -1.57 2.45 5.85 -1.94 0.30 115.31 123.95 3h02 h LEU 207 Ca -0.47 0.16 -0.02 0.00 0.84 0.00 0.00 57.88 58.39 3h02 h LEU 207 Cb 1.27 0.11 -0.00 0.00 0.37 0.00 0.00 40.66 42.41 3h02 h LEU 207 CO 0.67 -0.00 -0.09 0.00 -0.34 0.00 0.00 178.44 178.68 3h02 h ALA 208 N 1.74 1.05 -0.52 1.25 0.00 -2.04 -2.56 119.26 118.20 3h02 h ALA 208 Ca 0.61 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.44 3h02 h ALA 208 Cb 1.21 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.98 3h02 h ALA 208 CO -0.53 0.11 0.00 -0.25 0.00 0.00 0.00 179.25 178.58 3h02 n ASP 209 N -3.27 3.66 0.02 0.00 8.00 0.07 -4.67 116.55 120.36 3h02 n ASP 209 Ca -0.00 -2.00 -0.11 0.00 0.71 0.00 0.00 54.79 53.39 3h02 n ASP 209 Cb 0.31 -0.34 -0.04 0.00 -0.02 0.00 0.00 41.12 41.03 3h02 n ASP 209 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 3h02 h LEU 210 N 4.47 -0.98 -0.50 0.64 5.85 -1.18 -0.44 115.31 123.15 3h02 h LEU 210 Ca 0.00 0.14 -0.15 0.00 0.84 0.00 0.00 57.88 58.71 3h02 h LEU 210 Cb 1.00 0.41 -0.01 0.00 0.37 0.00 0.00 40.66 42.43 3h02 h LEU 210 CO 0.00 -0.36 -0.42 -0.08 -0.34 0.00 0.00 178.44 177.24 3h02 h GLU 211 N -0.41 0.76 -0.36 1.25 4.81 -1.83 -1.81 114.58 116.99 3h02 h GLU 211 Ca 0.09 -0.41 0.04 0.00 -0.13 0.00 0.00 59.36 58.94 3h02 h GLU 211 Cb 0.55 0.02 -0.04 0.00 0.63 0.00 0.00 28.75 29.91 3h02 h GLU 211 CO -0.33 1.03 0.14 -0.22 -0.73 0.00 0.00 179.01 178.91 3h02 h LYS 212 N 0.62 0.30 -0.24 1.92 3.64 -1.80 0.21 116.57 121.22 3h02 h LYS 212 Ca 0.05 -0.02 -0.18 0.00 -1.27 0.00 0.00 60.65 59.23 3h02 h LYS 212 Cb 0.97 -0.07 -0.00 0.00 -0.41 0.00 0.00 32.23 32.72 3h02 h LYS 212 CO 0.09 0.20 -0.56 0.93 -2.27 0.00 0.00 179.45 177.84 3h02 h GLU 213 N 0.31 0.73 -0.07 1.90 4.39 -1.06 -1.93 114.58 118.84 3h02 h GLU 213 Ca 0.16 -0.47 -0.00 0.00 0.34 0.00 0.00 59.36 59.39 3h02 h GLU 213 Cb 0.11 0.06 -0.00 0.00 -0.10 0.00 0.00 28.75 28.81 3h02 h GLU 213 CO -0.14 1.09 0.04 1.15 -1.16 0.00 0.00 179.01 179.99 3h02 h THR 214 N 0.55 1.06 -0.45 1.13 2.02 -0.97 -1.53 112.91 114.72 3h02 h THR 214 Ca 0.01 -0.15 -0.02 0.00 0.77 0.00 0.00 66.41 67.02 3h02 h THR 214 Cb 1.14 1.04 -0.02 0.00 -1.74 0.00 0.00 68.15 68.57 3h02 h THR 214 CO 0.12 0.05 0.21 0.58 0.37 0.00 0.00 175.52 176.84 3h02 h VAL 215 N 0.04 1.16 -0.20 3.16 2.07 -0.58 -0.44 116.25 121.46 3h02 h VAL 215 Ca 0.02 -0.44 -0.00 0.00 0.82 0.00 0.00 66.70 67.10 3h02 h VAL 215 Cb 0.05 0.59 -0.01 0.00 -1.52 0.00 0.00 31.29 30.40 3h02 h VAL 215 CO -0.00 0.18 0.11 -0.09 0.02 0.00 0.00 177.57 177.79 3h02 h ARG 216 N 0.62 0.28 -0.50 1.57 2.43 -0.72 0.73 114.38 118.79 3h02 h ARG 216 Ca 0.16 -0.03 0.01 0.00 -0.81 0.00 0.00 59.98 59.31 3h02 h ARG 216 Cb 0.08 -0.06 -0.03 0.00 -0.42 0.00 0.00 29.97 29.54 3h02 h ARG 216 CO -0.02 0.26 0.32 -1.49 -1.51 0.00 0.00 179.97 177.52 3h02 h TRP 217 N 0.22 0.59 -0.32 2.20 4.06 -0.59 -1.32 115.95 120.80 3h02 h TRP 217 Ca 0.07 0.02 0.03 0.00 2.06 0.00 0.00 58.89 61.07 3h02 h TRP 217 Cb 0.06 -0.20 -0.03 0.00 -1.00 0.00 0.00 29.16 27.99 3h02 h TRP 217 CO -0.04 0.36 0.12 0.00 -3.56 0.00 0.00 178.44 175.32 3h02 h ARG 219 N 0.27 0.68 -1.02 0.00 3.08 -0.55 0.11 114.38 116.95 3h02 h ARG 219 Ca 0.14 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 60.13 3h02 h ARG 219 Cb 0.11 -0.14 0.00 0.00 0.08 0.00 0.00 29.97 30.01 3h02 h ARG 219 CO -0.14 0.50 0.00 0.39 -1.07 0.00 0.00 179.97 179.65 3h02 n GLU 220 N -4.41 0.27 0.00 0.04 1.02 -0.52 -1.81 120.64 115.21 3h02 n GLU 220 Ca 0.04 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.18 3h02 n GLU 220 Cb 0.09 -1.25 0.00 0.00 -0.02 0.00 0.00 31.44 30.26 3h02 n GLU 220 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 3h02 n LEU 222 N 0.62 0.00 0.12 -4.62 4.77 0.36 -3.60 117.00 114.65 3h02 n LEU 222 Ca 0.00 0.00 0.13 0.00 -0.03 0.00 0.00 56.01 56.11 3h02 n LEU 222 Cb 0.10 0.00 0.44 0.00 -2.33 0.00 0.00 43.42 41.63 3h02 n LEU 222 CO 0.00 0.00 0.88 0.00 -1.33 0.00 0.00 177.39 176.94 3h02 n GLN 223 N 0.00 0.24 -2.61 3.23 1.13 -0.75 -4.87 117.38 113.75 3h02 n GLN 223 Ca 0.00 0.30 -0.22 0.00 -1.94 0.00 0.00 57.00 55.15 3h02 n GLN 223 Cb 0.00 -1.84 0.04 0.00 0.11 0.00 0.00 30.24 28.55 3h02 n GLN 223 CO 0.00 0.00 0.00 -0.80 -1.44 0.00 0.00 177.06 174.82 3h02 s ASN 224 N -4.45 5.26 -0.08 1.08 0.01 -1.24 -5.02 114.94 110.49 3h02 s ASN 224 Ca 0.08 0.04 -0.29 0.00 -0.71 0.00 0.00 52.86 51.98 3h02 s ASN 224 Cb 0.11 -0.92 -0.06 0.00 0.41 0.00 0.00 41.25 40.79 3h02 s ASN 224 CO 0.52 -1.17 1.77 -0.55 -1.51 0.00 0.00 177.10 176.16 3h02 s SER 225 N -4.43 6.46 0.00 -1.22 0.15 -1.26 -4.99 113.70 108.41 3h02 s SER 225 Ca 0.57 2.18 0.00 0.00 0.70 0.00 0.00 55.95 59.40 3h02 s SER 225 Cb -0.10 -2.53 0.00 0.00 -1.71 0.00 0.00 66.02 61.68 3h02 s SER 225 CO 0.39 -1.11 0.14 -0.81 1.20 0.00 0.00 173.24 173.05 3h02 n PRO 226 N 7.47 0.11 0.00 5.44 -0.04 -1.26 -1.49 135.00 145.23 3h02 n PRO 226 Ca 0.19 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.65 3h02 n PRO 226 Cb 0.43 -1.45 0.00 0.00 -0.04 0.00 0.00 33.50 32.44 3h02 n PRO 226 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3h02 n ALA 228 N 1.27 0.00 -0.24 0.55 0.00 -1.26 -1.86 120.51 118.97 3h02 n ALA 228 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.41 3h02 n ALA 228 Cb 0.05 0.00 0.08 0.00 0.00 0.00 0.00 19.45 19.59 3h02 n ALA 228 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 3h02 h LEU 229 N 0.00 0.65 -0.26 0.00 3.38 -1.65 -0.15 115.31 117.29 3h02 h LEU 229 Ca 0.00 0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.96 3h02 h LEU 229 Cb 0.00 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.61 3h02 h LEU 229 CO 0.00 0.44 0.08 -0.09 0.09 0.00 0.00 178.44 178.96 3h02 h ARG 230 N 0.79 0.41 -0.65 1.13 2.43 -1.54 -0.39 114.38 116.55 3h02 h ARG 230 Ca 0.28 -0.09 -0.04 0.00 -0.81 0.00 0.00 59.98 59.32 3h02 h ARG 230 Cb 0.07 -0.06 -0.03 0.00 -0.42 0.00 0.00 29.97 29.54 3h02 h ARG 230 CO -0.13 0.48 0.23 0.00 -1.51 0.00 0.00 179.97 179.04 3h02 h LEU 232 N 0.95 0.68 -0.65 0.00 3.38 -0.81 -0.44 115.31 118.43 3h02 h LEU 232 Ca 0.22 -0.52 0.05 0.00 0.09 0.00 0.00 57.88 57.71 3h02 h LEU 232 Cb 0.23 -0.20 -0.05 0.00 0.09 0.00 0.00 40.66 40.74 3h02 h LEU 232 CO -0.01 1.07 0.37 0.50 0.09 0.00 0.00 178.44 180.46 3h02 h LYS 233 N 0.32 0.68 -0.63 1.13 3.64 -0.97 0.58 116.57 121.32 3h02 h LYS 233 Ca 0.02 -0.04 -0.04 0.00 -1.27 0.00 0.00 60.65 59.31 3h02 h LYS 233 Cb 0.93 -0.15 -0.03 0.00 -0.41 0.00 0.00 32.23 32.57 3h02 h LYS 233 CO 0.08 0.45 0.22 0.00 -2.27 0.00 0.00 179.45 177.93 3h02 h ALA 234 N 1.32 0.82 -0.87 5.00 0.00 -1.32 -0.10 119.26 124.11 3h02 h ALA 234 Ca 0.28 -0.19 0.01 0.00 0.00 0.00 0.00 54.91 55.01 3h02 h ALA 234 Cb 0.14 -0.24 -0.04 0.00 0.00 0.00 0.00 17.79 17.64 3h02 h ALA 234 CO -0.16 0.47 0.58 0.00 0.00 0.00 0.00 179.25 180.14 3h02 h ALA 235 N 1.08 1.11 -0.09 0.00 0.00 -0.13 0.90 119.26 122.14 3h02 h ALA 235 Ca 0.21 -0.06 -0.18 0.00 0.00 0.00 0.00 54.91 54.87 3h02 h ALA 235 Cb 0.26 -0.35 -0.00 0.00 0.00 0.00 0.00 17.79 17.70 3h02 h ALA 235 CO -0.01 0.50 -0.72 -0.07 0.00 0.00 0.00 179.25 178.95 3h02 h LEU 236 N 1.17 0.51 -1.00 0.00 3.38 -0.58 -2.73 115.31 116.06 3h02 h LEU 236 Ca 0.32 -0.33 -0.07 0.00 0.09 0.00 0.00 57.88 57.89 3h02 h LEU 236 Cb -0.12 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.46 3h02 h LEU 236 CO -0.08 1.07 -0.06 0.78 0.09 0.00 0.00 178.44 180.24 3h02 h ASN 237 N 0.29 0.63 0.44 -0.43 2.35 -0.73 -2.99 115.58 115.15 3h02 h ASN 237 Ca -0.03 -0.16 -0.00 0.00 -0.55 0.00 0.00 56.30 55.56 3h02 h ASN 237 Cb 1.29 -0.17 -0.00 0.00 0.05 0.00 0.00 38.32 39.50 3h02 h ASN 237 CO 0.13 0.74 -0.02 0.00 -1.65 0.00 0.00 177.43 176.63 3h02 h ALA 238 N 1.33 1.05 0.00 -0.83 0.00 -0.51 -0.02 119.26 120.28 3h02 h ALA 238 Ca 0.12 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.01 3h02 h ALA 238 Cb 0.48 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.26 3h02 h ALA 238 CO 0.02 0.02 0.00 -3.47 0.00 0.00 0.00 179.25 175.83 3h02 n ASP 239 N -3.17 0.00 0.00 0.00 2.03 -1.13 -4.00 116.55 110.28 3h02 n ASP 239 Ca -0.01 0.43 0.00 0.00 0.52 0.00 0.00 54.79 55.72 3h02 n ASP 239 Cb 0.18 -0.47 0.00 0.00 -0.72 0.00 0.00 41.12 40.11 3h02 n ASP 239 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3h02 n ASP 241 N -2.05 4.04 0.00 0.00 8.00 -0.35 -5.04 116.55 121.15 3h02 n ASP 241 Ca 0.00 -3.43 0.00 0.00 0.71 0.00 0.00 54.79 52.07 3h02 n ASP 241 Cb 0.47 -0.75 0.00 0.00 -0.02 0.00 0.00 41.12 40.83 3h02 n ASP 241 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3h02 n GLY 242 N -0.67 2.32 0.26 0.44 0.00 -1.26 -1.02 105.19 105.26 3h02 n GLY 242 Ca 0.45 0.01 0.07 0.00 0.00 0.00 0.00 46.02 46.55 3h02 n GLY 242 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 3h02 h GLN 243 N 0.00 0.08 -0.06 1.61 4.20 -1.96 0.71 115.11 119.69 3h02 h GLN 243 Ca 0.00 -0.01 -0.07 0.00 0.06 0.00 0.00 58.65 58.63 3h02 h GLN 243 Cb 0.00 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 27.75 3h02 h GLN 243 CO 0.00 0.09 -0.31 0.00 -0.67 0.00 0.00 178.83 177.94 3h02 h ALA 244 N 1.92 1.38 -0.01 3.87 0.00 -1.51 0.97 119.26 125.87 3h02 h ALA 244 Ca 0.02 -0.31 -0.25 0.00 0.00 0.00 0.00 54.91 54.37 3h02 h ALA 244 Cb 0.06 -0.07 0.01 0.00 0.00 0.00 0.00 17.79 17.79 3h02 h ALA 244 CO 0.00 0.45 -0.99 0.78 0.00 0.00 0.00 179.25 179.49 3h02 h GLY 245 N 1.01 0.67 1.19 0.00 0.00 -0.08 -2.81 103.07 103.06 3h02 h GLY 245 Ca 0.01 -1.16 0.01 0.00 0.00 0.00 0.00 47.33 46.19 3h02 h GLY 245 CO 0.04 1.02 0.53 1.41 0.00 0.00 0.00 176.54 179.55 3h02 h LEU 246 N 0.35 0.95 -0.51 3.11 3.38 -0.56 -1.36 115.31 120.67 3h02 h LEU 246 Ca -0.11 -0.03 -0.02 0.00 0.09 0.00 0.00 57.88 57.81 3h02 h LEU 246 Cb 1.63 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 42.12 3h02 h LEU 246 CO 0.19 0.69 0.23 -0.61 0.09 0.00 0.00 178.44 179.03 3h02 h GLN 247 N 1.11 0.73 -0.20 1.13 4.15 -0.72 0.54 115.11 121.85 3h02 h GLN 247 Ca 0.30 -0.11 -0.01 0.00 0.77 0.00 0.00 58.65 59.59 3h02 h GLN 247 Cb -0.11 -0.13 -0.01 0.00 0.21 0.00 0.00 27.48 27.44 3h02 h GLN 247 CO -0.06 0.62 0.08 0.93 -1.93 0.00 0.00 178.83 178.47 3h02 h GLU 248 N 0.67 0.31 0.14 1.69 5.08 -1.16 -0.74 114.58 120.56 3h02 h GLU 248 Ca 0.17 -0.06 0.01 0.00 -1.00 0.00 0.00 59.36 58.49 3h02 h GLU 248 Cb 0.14 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.31 3h02 h GLU 248 CO -0.02 0.37 -0.22 -0.07 -1.00 0.00 0.00 179.01 178.07 3h02 h LEU 249 N 0.18 -0.61 -1.24 1.33 3.38 -1.10 -1.57 115.31 115.68 3h02 h LEU 249 Ca 0.07 0.07 -0.02 0.00 0.09 0.00 0.00 57.88 58.08 3h02 h LEU 249 Cb 0.18 0.23 -0.03 0.00 0.09 0.00 0.00 40.66 41.13 3h02 h LEU 249 CO -0.01 -0.31 0.23 0.00 0.09 0.00 0.00 178.44 178.45 3h02 h ALA 250 N 0.34 1.41 -0.61 1.53 0.00 -0.87 0.04 119.26 121.11 3h02 h ALA 250 Ca 0.02 -0.13 0.01 0.00 0.00 0.00 0.00 54.91 54.82 3h02 h ALA 250 Cb 0.44 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.98 3h02 h ALA 250 CO -0.11 0.46 0.40 0.78 0.00 0.00 0.00 179.25 180.79 3h02 h GLY 251 N 0.88 0.85 0.97 0.00 0.00 -0.66 0.02 103.07 105.13 3h02 h GLY 251 Ca 0.19 -0.31 -0.14 0.00 0.00 0.00 0.00 47.33 47.06 3h02 h GLY 251 CO -0.02 0.30 -0.41 3.43 0.00 0.00 0.00 176.54 179.84 3h02 h ASN 252 N 0.80 0.73 -0.98 0.19 2.35 -0.05 -3.01 115.58 115.62 3h02 h ASN 252 Ca 0.23 -0.54 0.05 0.00 -0.55 0.00 0.00 56.30 55.48 3h02 h ASN 252 Cb -0.05 -0.21 -0.06 0.00 0.05 0.00 0.00 38.32 38.04 3h02 h ASN 252 CO -0.05 1.14 0.64 0.00 -1.65 0.00 0.00 177.43 177.50 3h02 h ALA 253 N 0.62 1.40 0.00 -0.83 0.00 -0.60 0.12 119.26 119.96 3h02 h ALA 253 Ca 0.01 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.88 3h02 h ALA 253 Cb 1.01 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 18.47 3h02 h ALA 253 CO 0.09 0.49 0.00 2.41 0.00 0.00 0.00 179.25 182.24 3h02 n THR 254 N -4.46 0.09 0.00 0.00 -1.04 -0.06 -0.38 114.28 108.43 3h02 n THR 254 Ca 0.14 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.15 3h02 n THR 254 Cb 0.13 -0.32 0.00 0.00 -1.82 0.00 0.00 70.33 68.33 3h02 n THR 254 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 3h02 n LEU 256 N 0.59 0.00 -0.15 -4.42 4.77 0.41 -2.04 117.00 116.15 3h02 n LEU 256 Ca 0.00 0.00 -0.07 0.00 -0.03 0.00 0.00 56.01 55.91 3h02 n LEU 256 Cb 0.08 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.19 3h02 n LEU 256 CO 0.00 0.00 1.06 0.15 -1.33 0.00 0.00 177.39 177.27 3h02 h PHE 257 N 0.00 0.57 0.00 -1.77 3.04 -0.96 -3.31 116.94 114.52 3h02 h PHE 257 Ca 0.00 0.01 -0.06 0.00 3.98 0.00 0.00 57.97 61.90 3h02 h PHE 257 Cb 0.00 -0.19 -0.00 0.00 2.56 0.00 0.00 35.95 38.31 3h02 h PHE 257 CO 0.00 0.35 0.83 0.66 -2.02 0.00 0.00 178.31 178.13 3h02 n TYR 258 N -4.78 0.16 -0.56 0.41 4.01 -0.86 -5.23 117.16 110.31 3h02 n TYR 258 Ca 0.02 -0.52 0.00 0.00 -0.16 0.00 0.00 57.90 57.24 3h02 n TYR 258 Cb 0.03 -0.72 0.00 0.00 -0.31 0.00 0.00 39.34 38.34 3h02 n TYR 258 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65