#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1et5 s THR 5 N 0.00 3.65 0.20 0.00 -4.23 -1.26 -4.90 115.64 109.11 1et5 s THR 5 Ca 0.00 -0.55 -0.11 0.00 -1.18 0.00 0.00 61.69 59.85 1et5 s THR 5 Cb 0.00 -3.35 0.16 0.00 1.34 0.00 0.00 72.50 70.65 1et5 s THR 5 CO 0.00 -0.24 1.70 0.00 -0.54 0.00 0.00 174.62 175.54 1et5 h ALA 6 N 0.33 0.65 -0.53 3.99 0.00 -2.05 -0.83 119.26 120.82 1et5 h ALA 6 Ca -0.45 0.14 -0.03 0.00 0.00 0.00 0.00 54.91 54.57 1et5 h ALA 6 Cb 1.26 0.20 -0.03 0.00 0.00 0.00 0.00 17.79 19.23 1et5 h ALA 6 CO 0.56 -0.33 0.22 0.00 0.00 0.00 0.00 179.25 179.70 1et5 h ALA 7 N 1.47 1.39 -0.27 0.00 0.00 -1.99 -2.03 119.26 117.83 1et5 h ALA 7 Ca 0.30 -0.14 -0.08 0.00 0.00 0.00 0.00 54.91 55.00 1et5 h ALA 7 Cb 0.45 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 1et5 h ALA 7 CO -0.41 0.46 -0.13 0.93 0.00 0.00 0.00 179.25 180.10 1et5 h GLU 8 N 0.75 0.57 -0.40 0.00 5.08 -1.56 -2.92 114.58 116.08 1et5 h GLU 8 Ca 0.18 -0.25 -0.04 0.00 -1.00 0.00 0.00 59.36 58.26 1et5 h GLU 8 Cb 0.14 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.35 1et5 h GLU 8 CO -0.02 0.81 0.11 0.82 -1.00 0.00 0.00 179.01 179.73 1et5 h ILE 9 N 0.30 1.23 0.00 3.13 2.04 -1.10 -2.74 117.51 120.37 1et5 h ILE 9 Ca 0.06 -0.76 0.00 0.00 1.00 0.00 0.00 64.86 65.16 1et5 h ILE 9 Cb 0.64 0.96 0.00 0.00 -0.74 0.00 0.00 36.82 37.68 1et5 h ILE 9 CO 0.04 0.27 0.00 0.00 0.00 0.00 0.00 178.15 178.46 1et5 h ALA 10 N 0.96 1.00 0.00 1.87 0.00 -1.41 -2.28 119.26 119.39 1et5 h ALA 10 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.04 1et5 h ALA 10 Cb 0.30 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.09 1et5 h ALA 10 CO -0.00 0.00 -0.50 0.00 0.00 0.00 0.00 179.25 178.75 1et5 n ALA 11 N -2.06 2.92 -1.65 0.00 0.00 -1.05 -4.94 120.51 113.73 1et5 n ALA 11 Ca -0.00 -0.23 -0.36 0.00 0.00 0.00 0.00 53.44 52.85 1et5 n ALA 11 Cb 0.23 -1.22 0.06 0.00 0.00 0.00 0.00 19.45 18.52 1et5 n ALA 11 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1et5 s LEU 12 N -3.99 3.55 0.54 0.00 1.43 -0.86 -4.96 118.68 114.40 1et5 s LEU 12 Ca 0.08 2.45 -0.21 0.00 -1.03 0.00 0.00 54.13 55.42 1et5 s LEU 12 Cb 0.14 -4.60 -0.05 0.00 0.03 0.00 0.00 46.19 41.71 1et5 s LEU 12 CO 0.69 -1.87 1.25 -2.84 0.23 0.00 0.00 176.35 173.82 1et5 s PRO 13 N -3.49 3.25 0.18 1.29 0.02 -1.26 -4.76 135.00 130.23 1et5 s PRO 13 Ca 0.78 1.97 0.11 0.00 0.02 0.00 0.00 61.00 63.88 1et5 s PRO 13 Cb -0.32 -2.19 -0.04 0.00 0.02 0.00 0.00 34.50 31.97 1et5 s PRO 13 CO 0.38 -1.02 -0.24 1.03 -0.33 0.00 0.00 177.00 176.82 1et5 s ARG 14 N -2.99 1.48 -0.09 5.54 0.52 -1.26 -1.68 118.95 120.47 1et5 s ARG 14 Ca 0.71 -1.49 -0.04 0.00 -0.52 0.00 0.00 55.73 54.39 1et5 s ARG 14 Cb -0.34 -1.81 0.04 0.00 0.52 0.00 0.00 34.95 33.37 1et5 s ARG 14 CO 0.39 0.40 0.20 -1.14 0.02 0.00 0.00 175.30 175.17 1et5 s GLN 15 N -2.58 0.16 -0.18 3.54 0.74 -0.91 -4.96 119.66 115.47 1et5 s GLN 15 Ca 0.19 0.46 -0.14 0.00 0.05 0.00 0.00 55.36 55.92 1et5 s GLN 15 Cb -0.08 -0.15 -0.04 0.00 1.10 0.00 0.00 33.01 33.84 1et5 s GLN 15 CO 0.09 -0.17 0.32 0.15 -0.55 0.00 0.00 175.29 175.13 1et5 s LYS 16 N 1.23 4.23 -0.10 1.67 1.02 -1.26 0.08 119.74 126.61 1et5 s LYS 16 Ca -0.09 0.11 0.01 0.00 0.02 0.00 0.00 55.97 56.02 1et5 s LYS 16 Cb -0.11 -3.47 -0.02 0.00 -0.52 0.00 0.00 37.83 33.72 1et5 s LYS 16 CO -0.07 0.14 -0.13 0.08 -0.92 0.00 0.00 175.35 174.44 1et5 s VAL 17 N 0.76 3.07 -0.34 3.17 1.01 -0.61 -4.96 120.40 122.50 1et5 s VAL 17 Ca 0.17 -0.68 -0.15 0.00 0.00 0.00 0.00 61.98 61.32 1et5 s VAL 17 Cb -0.14 -2.25 -0.01 0.00 0.00 0.00 0.00 36.38 33.98 1et5 s VAL 17 CO 0.05 0.55 0.34 -1.61 0.00 0.00 0.00 175.10 174.44 1et5 s GLU 18 N -0.07 3.56 0.53 2.72 2.02 -1.26 -4.61 118.70 121.60 1et5 s GLU 18 Ca -0.02 -0.44 -0.20 0.00 0.02 0.00 0.00 54.97 54.33 1et5 s GLU 18 Cb -0.14 -3.80 -0.06 0.00 0.10 0.00 0.00 34.13 30.22 1et5 s GLU 18 CO 0.04 -0.51 1.11 -0.51 0.02 0.00 0.00 175.26 175.41 1et5 s LEU 19 N 1.98 3.77 0.22 1.80 1.43 -1.26 -4.81 118.68 121.80 1et5 s LEU 19 Ca 0.11 2.12 0.11 0.00 -1.03 0.00 0.00 54.13 55.44 1et5 s LEU 19 Cb -0.17 -4.57 -0.05 0.00 0.03 0.00 0.00 46.19 41.43 1et5 s LEU 19 CO 0.11 -1.12 -0.21 0.68 0.23 0.00 0.00 176.35 176.05 1et5 s VAL 20 N -1.81 2.24 0.28 -1.59 -7.23 -1.26 -5.01 120.40 106.02 1et5 s VAL 20 Ca 0.71 -2.14 -0.29 0.00 -1.81 0.00 0.00 61.98 58.45 1et5 s VAL 20 Cb -0.22 -2.12 -0.10 0.00 0.56 0.00 0.00 36.38 34.51 1et5 s VAL 20 CO 0.25 -0.28 1.18 -1.81 -0.31 0.00 0.00 175.10 174.13 1et5 s ASP 21 N -2.98 7.09 0.83 4.85 1.01 -1.26 -4.65 116.67 121.56 1et5 s ASP 21 Ca 0.23 2.40 -0.12 0.00 0.71 0.00 0.00 52.55 55.76 1et5 s ASP 21 Cb -0.06 -2.63 0.10 0.00 1.01 0.00 0.00 42.92 41.34 1et5 s ASP 21 CO 0.11 -0.30 1.16 -2.84 0.21 0.00 0.00 175.17 173.51 1et5 s PRO 22 N -1.37 1.56 0.00 8.23 0.01 -1.26 -2.43 135.00 139.74 1et5 s PRO 22 Ca 0.47 1.59 0.23 0.00 0.01 0.00 0.00 61.00 63.31 1et5 s PRO 22 Cb -0.35 -1.78 1.25 0.00 0.01 0.00 0.00 34.50 33.64 1et5 s PRO 22 CO 0.44 -2.23 1.76 -0.35 0.01 0.00 0.00 177.00 176.63 1et5 n PRO 23 N -3.60 0.48 -1.72 5.54 -0.04 -1.26 -5.06 135.00 129.35 1et5 n PRO 23 Ca 0.12 0.04 -0.30 0.00 -0.04 0.00 0.00 63.50 63.32 1et5 n PRO 23 Cb 0.51 -1.50 0.06 0.00 -0.04 0.00 0.00 33.50 32.53 1et5 n PRO 23 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 1et5 s PHE 24 N -2.36 3.14 0.01 0.54 0.40 -1.02 -0.03 117.98 118.66 1et5 s PHE 24 Ca 0.27 1.15 0.04 0.00 -0.60 0.00 0.00 56.93 57.79 1et5 s PHE 24 Cb 0.16 -3.04 -0.02 0.00 0.51 0.00 0.00 43.02 40.64 1et5 s PHE 24 CO 0.32 -1.37 -0.13 0.08 0.70 0.00 0.00 175.22 174.83 1et5 s VAL 25 N -3.23 1.00 0.95 -0.44 1.01 -1.26 -4.64 120.40 113.79 1et5 s VAL 25 Ca 0.59 -0.75 -0.11 0.00 0.00 0.00 0.00 61.98 61.71 1et5 s VAL 25 Cb -0.13 -0.88 0.13 0.00 0.00 0.00 0.00 36.38 35.51 1et5 s VAL 25 CO 0.53 0.12 0.93 0.00 0.00 0.00 0.00 175.10 176.68 1et5 n HIS 26 N 2.33 0.09 -1.89 5.22 1.44 -1.26 -4.90 115.22 116.24 1et5 n HIS 26 Ca -0.16 0.31 -0.41 0.00 -2.01 0.00 0.00 57.72 55.46 1et5 n HIS 26 Cb 0.55 -1.92 -0.01 0.00 0.12 0.00 0.00 29.99 28.74 1et5 n HIS 26 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1et5 s ALA 27 N -2.55 3.54 0.11 1.59 0.00 -1.26 -5.00 121.76 118.18 1et5 s ALA 27 Ca 0.64 1.48 -0.25 0.00 0.00 0.00 0.00 51.96 53.83 1et5 s ALA 27 Cb -0.22 -3.57 0.08 0.00 0.00 0.00 0.00 23.12 19.40 1et5 s ALA 27 CO 0.61 -0.95 0.78 -3.38 0.00 0.00 0.00 175.76 172.82 1et5 s HIS 28 N -1.13 -0.36 -0.12 0.00 -3.43 -1.26 -5.06 115.29 103.93 1et5 s HIS 28 Ca 0.52 0.14 -0.03 0.00 -0.80 0.00 0.00 55.06 54.89 1et5 s HIS 28 Cb -0.44 0.58 -0.03 0.00 -1.43 0.00 0.00 32.58 31.25 1et5 s HIS 28 CO 0.60 -0.77 0.01 -1.54 -2.00 0.00 0.00 174.74 171.03 1et5 s SER 29 N -2.70 5.25 0.20 7.38 1.04 -1.26 -5.00 113.70 118.61 1et5 s SER 29 Ca 0.05 0.09 -0.04 0.00 0.48 0.00 0.00 55.95 56.54 1et5 s SER 29 Cb -0.02 -1.63 0.14 0.00 0.10 0.00 0.00 66.02 64.62 1et5 s SER 29 CO -0.07 0.31 1.55 1.56 0.98 0.00 0.00 173.24 177.57 1et5 h GLN 30 N 5.69 0.64 -5.06 4.02 4.20 -1.97 -3.41 115.11 119.21 1et5 h GLN 30 Ca -0.45 -0.34 -0.64 0.00 0.06 0.00 0.00 58.65 57.28 1et5 h GLN 30 Cb 1.19 0.01 -0.20 0.00 0.30 0.00 0.00 27.48 28.79 1et5 h GLN 30 CO 0.59 0.95 -0.59 0.08 -0.67 0.00 0.00 178.83 179.18 1et5 s VAL 31 N -4.23 4.57 0.30 -0.54 1.01 -1.26 -3.17 120.40 117.08 1et5 s VAL 31 Ca -0.08 -0.09 -0.30 0.00 0.00 0.00 0.00 61.98 61.51 1et5 s VAL 31 Cb 0.12 -3.11 -0.11 0.00 0.00 0.00 0.00 36.38 33.28 1et5 s VAL 31 CO 0.84 0.37 1.53 0.00 0.00 0.00 0.00 175.10 177.84 1et5 s ALA 32 N 1.19 3.68 -0.34 5.51 0.00 0.60 -4.96 121.76 127.45 1et5 s ALA 32 Ca 0.05 1.51 -0.07 0.00 0.00 0.00 0.00 51.96 53.45 1et5 s ALA 32 Cb -0.14 -3.62 0.04 0.00 0.00 0.00 0.00 23.12 19.40 1et5 s ALA 32 CO 0.04 -0.93 0.11 -1.21 0.00 0.00 0.00 175.76 173.76 1et5 s GLU 33 N -0.77 2.64 0.30 0.00 2.02 -1.26 -4.94 118.70 116.70 1et5 s GLU 33 Ca 0.60 -1.17 0.00 0.00 0.02 0.00 0.00 54.97 54.43 1et5 s GLU 33 Cb -0.46 -3.47 0.00 0.00 0.10 0.00 0.00 34.13 30.30 1et5 s GLU 33 CO 0.49 -0.66 0.00 0.41 0.02 0.00 0.00 175.26 175.52 1et5 n GLY 34 N 4.82 -1.79 2.84 -1.39 0.00 -1.26 -5.01 105.19 103.40 1et5 n GLY 34 Ca -0.12 -1.90 -0.19 0.00 0.00 0.00 0.00 46.02 43.81 1et5 n GLY 34 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1et5 n GLY 35 N 0.00 -0.30 3.57 -0.02 0.00 -1.26 -5.02 105.19 102.17 1et5 n GLY 35 Ca 0.00 -1.87 -0.37 0.00 0.00 0.00 0.00 46.02 43.79 1et5 n GLY 35 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1et5 n PRO 36 N -2.69 0.63 -4.26 1.61 -0.02 -1.26 -5.01 135.00 124.00 1et5 n PRO 36 Ca 0.12 0.26 -0.14 0.00 -2.02 0.00 0.00 63.50 61.72 1et5 n PRO 36 Cb 0.43 -2.08 -0.10 0.00 -0.02 0.00 0.00 33.50 31.73 1et5 n PRO 36 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 1et5 s LYS 37 N -2.86 1.16 -0.32 -0.52 1.02 -1.26 -4.41 119.74 112.54 1et5 s LYS 37 Ca 0.73 -1.56 -0.09 0.00 0.02 0.00 0.00 55.97 55.07 1et5 s LYS 37 Cb -0.39 -0.34 0.01 0.00 -0.52 0.00 0.00 37.83 36.59 1et5 s LYS 37 CO 0.50 -0.12 0.14 0.08 -0.92 0.00 0.00 175.35 175.03 1et5 s VAL 38 N -3.61 4.39 -0.26 3.17 1.01 -0.68 -0.91 120.40 123.51 1et5 s VAL 38 Ca 0.25 -0.62 -0.13 0.00 0.00 0.00 0.00 61.98 61.47 1et5 s VAL 38 Cb 0.06 -3.30 -0.04 0.00 0.00 0.00 0.00 36.38 33.09 1et5 s VAL 38 CO 0.05 -0.01 0.29 -0.69 0.00 0.00 0.00 175.10 174.74 1et5 s VAL 39 N 1.56 5.25 -0.20 2.92 1.01 0.11 -2.14 120.40 128.91 1et5 s VAL 39 Ca 0.03 0.41 -0.14 0.00 0.00 0.00 0.00 61.98 62.28 1et5 s VAL 39 Cb -0.18 -3.62 -0.04 0.00 0.00 0.00 0.00 36.38 32.54 1et5 s VAL 39 CO 0.05 0.23 0.30 -1.61 0.00 0.00 0.00 175.10 174.07 1et5 s GLU 40 N 1.70 4.18 0.06 2.72 2.02 0.11 0.12 118.70 129.61 1et5 s GLU 40 Ca 0.12 0.04 0.06 0.00 0.02 0.00 0.00 54.97 55.21 1et5 s GLU 40 Cb -0.15 -3.50 -0.03 0.00 0.10 0.00 0.00 34.13 30.55 1et5 s GLU 40 CO 0.09 0.09 -0.16 -0.06 0.02 0.00 0.00 175.26 175.24 1et5 s PHE 41 N 0.94 1.38 -0.03 1.61 0.40 -0.50 -1.57 117.98 120.21 1et5 s PHE 41 Ca 0.15 -0.40 0.04 0.00 -0.60 0.00 0.00 56.93 56.12 1et5 s PHE 41 Cb -0.14 -0.79 -0.00 0.00 0.51 0.00 0.00 43.02 42.59 1et5 s PHE 41 CO 0.05 0.08 -0.15 0.99 0.70 0.00 0.00 175.22 176.89 1et5 s THR 42 N -1.04 1.25 -0.01 0.64 2.01 -1.26 -1.14 115.64 116.09 1et5 s THR 42 Ca 0.02 -0.63 -0.00 0.00 0.31 0.00 0.00 61.69 61.39 1et5 s THR 42 Cb -0.09 -1.07 0.01 0.00 0.01 0.00 0.00 72.50 71.36 1et5 s THR 42 CO 0.02 0.36 0.02 -0.04 -0.69 0.00 0.00 174.62 174.29 1et5 s MET 43 N -0.01 0.00 0.07 4.92 -1.94 -0.70 -4.87 119.30 116.77 1et5 s MET 43 Ca -0.02 0.06 0.05 0.00 -1.71 0.00 0.00 55.69 54.08 1et5 s MET 43 Cb -0.10 -0.05 -0.04 0.00 2.01 0.00 0.00 34.83 36.65 1et5 s MET 43 CO 0.01 -0.04 -0.06 0.08 -0.01 0.00 0.00 175.02 175.00 1et5 s VAL 44 N 0.26 3.66 -0.19 -6.03 1.01 -1.26 -1.46 120.40 116.39 1et5 s VAL 44 Ca -0.02 -1.03 -0.12 0.00 0.00 0.00 0.00 61.98 60.81 1et5 s VAL 44 Cb -0.03 -2.68 -0.05 0.00 0.00 0.00 0.00 36.38 33.62 1et5 s VAL 44 CO -0.01 0.20 0.21 -0.63 0.00 0.00 0.00 175.10 174.87 1et5 s ILE 45 N -1.18 5.36 -0.16 2.22 1.01 -0.71 0.42 121.20 128.17 1et5 s ILE 45 Ca 0.21 0.35 0.00 0.00 0.00 0.00 0.00 60.65 61.22 1et5 s ILE 45 Cb -0.11 -3.55 0.03 0.00 0.01 0.00 0.00 42.46 38.84 1et5 s ILE 45 CO 0.13 0.41 -0.13 -1.61 0.00 0.00 0.00 174.94 173.74 1et5 s GLU 46 N 0.49 2.17 -0.32 2.79 2.02 -0.12 -4.43 118.70 121.30 1et5 s GLU 46 Ca 0.12 -0.61 -0.17 0.00 0.02 0.00 0.00 54.97 54.32 1et5 s GLU 46 Cb -0.12 -2.16 -0.01 0.00 0.10 0.00 0.00 34.13 31.94 1et5 s GLU 46 CO 0.01 -0.29 0.48 -1.21 0.02 0.00 0.00 175.26 174.27 1et5 s GLU 47 N 1.48 3.75 0.14 1.61 2.02 -1.26 -1.03 118.70 125.42 1et5 s GLU 47 Ca 0.03 -0.07 -0.19 0.00 0.02 0.00 0.00 54.97 54.76 1et5 s GLU 47 Cb -0.14 -3.76 0.05 0.00 0.10 0.00 0.00 34.13 30.38 1et5 s GLU 47 CO -0.10 -0.53 0.49 -1.59 0.02 0.00 0.00 175.26 173.55 1et5 s LYS 48 N 2.29 1.18 0.06 1.61 -2.85 -0.59 -4.99 119.74 116.45 1et5 s LYS 48 Ca 0.18 -0.63 -0.27 0.00 -1.00 0.00 0.00 55.97 54.25 1et5 s LYS 48 Cb -0.16 0.52 -0.05 0.00 -2.06 0.00 0.00 37.83 36.08 1et5 s LYS 48 CO 0.12 -0.49 0.85 0.15 0.10 0.00 0.00 175.35 176.08 1et5 s LYS 49 N -3.79 4.57 0.05 1.78 -0.14 -1.26 -0.18 119.74 120.77 1et5 s LYS 49 Ca 0.03 1.22 0.04 0.00 -1.36 0.00 0.00 55.97 55.90 1et5 s LYS 49 Cb 0.01 -3.38 -0.02 0.00 -1.68 0.00 0.00 37.83 32.75 1et5 s LYS 49 CO -0.12 0.22 -0.13 0.96 -0.76 0.00 0.00 175.35 175.53 1et5 s ILE 50 N 0.09 0.99 -0.18 2.17 -4.36 -0.47 -4.92 121.20 114.50 1et5 s ILE 50 Ca 0.42 -1.09 -0.14 0.00 -0.26 0.00 0.00 60.65 59.58 1et5 s ILE 50 Cb -0.21 -0.94 -0.05 0.00 1.25 0.00 0.00 42.46 42.51 1et5 s ILE 50 CO 0.25 -0.14 0.29 -0.69 0.24 0.00 0.00 174.94 174.89 1et5 s VAL 51 N -1.06 5.30 -1.56 8.37 1.01 -1.26 -1.63 120.40 129.57 1et5 s VAL 51 Ca -0.02 0.51 0.14 0.00 0.00 0.00 0.00 61.98 62.62 1et5 s VAL 51 Cb -0.09 -3.62 0.23 0.00 0.00 0.00 0.00 36.38 32.90 1et5 s VAL 51 CO 0.01 0.36 1.11 2.30 0.00 0.00 0.00 175.10 178.88 1et5 n ILE 52 N 3.79 0.40 -3.91 2.22 -5.35 -0.03 -4.84 119.36 111.65 1et5 n ILE 52 Ca -0.12 -0.70 -0.09 0.00 -0.27 0.00 0.00 62.75 61.57 1et5 n ILE 52 Cb 0.52 0.98 -0.01 0.00 -1.74 0.00 0.00 39.64 39.38 1et5 n ILE 52 CO 0.00 0.00 0.00 1.51 -1.76 0.00 0.00 176.55 176.30 1et5 s ASP 53 N -1.12 0.08 0.00 7.28 3.84 -1.26 -1.35 116.67 124.14 1et5 s ASP 53 Ca 0.22 -1.03 0.24 0.00 -0.00 0.00 0.00 52.55 51.98 1et5 s ASP 53 Cb 0.13 0.74 1.41 0.00 -1.38 0.00 0.00 42.92 43.82 1et5 s ASP 53 CO 0.19 -1.43 1.80 -0.90 -0.00 0.00 0.00 175.17 174.83 1et5 n ASP 54 N -0.97 0.00 -1.12 2.11 5.75 -1.26 -2.83 116.55 118.22 1et5 n ASP 54 Ca -0.04 -0.89 0.08 0.00 -0.01 0.00 0.00 54.79 53.93 1et5 n ASP 54 Cb 0.60 0.00 0.27 0.00 -1.03 0.00 0.00 41.12 40.96 1et5 n ASP 54 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1et5 n ALA 55 N -0.95 2.76 -1.30 2.12 0.00 -1.26 -4.96 120.51 116.92 1et5 n ALA 55 Ca 0.18 -1.62 -0.09 0.00 0.00 0.00 0.00 53.44 51.91 1et5 n ALA 55 Cb 0.08 -0.76 -0.04 0.00 0.00 0.00 0.00 19.45 18.74 1et5 n ALA 55 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1et5 n GLY 56 N 0.57 0.99 3.71 0.00 0.00 -1.13 -4.98 105.19 104.36 1et5 n GLY 56 Ca 0.20 -0.64 -0.42 0.00 0.00 0.00 0.00 46.02 45.16 1et5 n GLY 56 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1et5 s THR 57 N -2.33 2.85 0.19 2.61 2.01 -1.26 -4.89 115.64 114.82 1et5 s THR 57 Ca 0.00 0.57 0.07 0.00 0.31 0.00 0.00 61.69 62.65 1et5 s THR 57 Cb 0.00 -3.37 -0.04 0.00 0.01 0.00 0.00 72.50 69.10 1et5 s THR 57 CO 0.00 0.04 0.03 -1.61 -0.69 0.00 0.00 174.62 172.39 1et5 s GLU 58 N 1.34 2.50 -0.05 4.92 2.02 -1.26 -0.85 118.70 127.31 1et5 s GLU 58 Ca 0.69 -1.11 -0.11 0.00 0.02 0.00 0.00 54.97 54.46 1et5 s GLU 58 Cb -0.41 -2.39 0.02 0.00 0.10 0.00 0.00 34.13 31.45 1et5 s GLU 58 CO 0.31 0.44 0.27 0.08 0.02 0.00 0.00 175.26 176.38 1et5 s VAL 59 N -1.83 0.04 -0.76 2.63 1.01 -0.64 -4.93 120.40 115.90 1et5 s VAL 59 Ca 0.29 -0.30 -0.21 0.00 0.00 0.00 0.00 61.98 61.76 1et5 s VAL 59 Cb -0.09 -0.49 0.10 0.00 0.00 0.00 0.00 36.38 35.90 1et5 s VAL 59 CO 0.20 -0.17 1.01 -1.00 0.00 0.00 0.00 175.10 175.14 1et5 s HIS 60 N -0.68 2.87 0.47 5.22 3.76 -1.26 -1.37 115.29 124.30 1et5 s HIS 60 Ca -0.08 -0.92 -0.19 0.00 -0.15 0.00 0.00 55.06 53.72 1et5 s HIS 60 Cb -0.04 -4.27 -0.10 0.00 1.11 0.00 0.00 32.58 29.28 1et5 s HIS 60 CO 0.02 -1.56 0.97 0.00 -0.85 0.00 0.00 174.74 173.32 1et5 s ALA 61 N 3.42 3.04 -0.33 -1.40 0.00 0.75 -4.88 121.76 122.35 1et5 s ALA 61 Ca 0.26 0.32 0.02 0.00 0.00 0.00 0.00 51.96 52.56 1et5 s ALA 61 Cb -0.13 -3.14 0.10 0.00 0.00 0.00 0.00 23.12 19.95 1et5 s ALA 61 CO 0.02 -0.05 0.07 -1.64 0.00 0.00 0.00 175.76 174.16 1et5 s MET 62 N -3.57 1.22 -0.03 0.00 -1.94 -0.85 -1.54 119.30 112.60 1et5 s MET 62 Ca 0.61 -1.62 0.08 0.00 -1.71 0.00 0.00 55.69 53.05 1et5 s MET 62 Cb -0.10 -2.78 -0.02 0.00 2.01 0.00 0.00 34.83 33.95 1et5 s MET 62 CO 0.21 -0.96 -0.25 0.00 -0.01 0.00 0.00 175.02 174.00 1et5 s ALA 63 N 1.12 2.18 -0.15 3.03 0.00 -0.20 -2.35 121.76 125.39 1et5 s ALA 63 Ca 0.11 -1.10 -0.29 0.00 0.00 0.00 0.00 51.96 50.67 1et5 s ALA 63 Cb -0.19 -0.58 -0.02 0.00 0.00 0.00 0.00 23.12 22.33 1et5 s ALA 63 CO -0.14 0.51 1.28 -0.06 0.00 0.00 0.00 175.76 177.36 1et5 s PHE 64 N -0.54 2.81 -1.97 0.00 0.08 -1.25 -0.95 117.98 116.16 1et5 s PHE 64 Ca 0.08 0.96 0.00 0.00 0.12 0.00 0.00 56.93 58.09 1et5 s PHE 64 Cb -0.11 -3.53 0.00 0.00 -0.57 0.00 0.00 43.02 38.82 1et5 s PHE 64 CO -0.00 -1.82 0.00 0.09 -0.10 0.00 0.00 175.22 173.39 1et5 n ASN 65 N 6.58 -5.55 0.00 1.36 4.13 0.17 -2.75 115.26 119.20 1et5 n ASN 65 Ca 0.14 0.29 0.00 0.00 1.68 0.00 0.00 54.58 56.69 1et5 n ASN 65 Cb 0.45 -4.72 0.00 0.00 -1.54 0.00 0.00 39.78 33.96 1et5 n ASN 65 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1et5 n GLY 66 N -0.71 0.47 3.54 7.41 0.00 -1.13 -5.00 105.19 109.76 1et5 n GLY 66 Ca -0.22 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.56 1et5 n GLY 66 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1et5 s THR 67 N -2.22 2.59 -0.16 2.61 -4.23 -1.11 -4.95 115.64 108.17 1et5 s THR 67 Ca 0.00 -2.21 -0.02 0.00 -1.18 0.00 0.00 61.69 58.28 1et5 s THR 67 Cb 0.00 -2.56 0.05 0.00 1.34 0.00 0.00 72.50 71.33 1et5 s THR 67 CO 0.00 -0.31 0.02 -0.69 -0.54 0.00 0.00 174.62 173.10 1et5 s VAL 68 N -2.51 0.52 0.98 2.29 1.01 -1.26 -3.53 120.40 117.91 1et5 s VAL 68 Ca 0.32 -0.40 -0.14 0.00 0.00 0.00 0.00 61.98 61.75 1et5 s VAL 68 Cb -0.02 -0.93 0.18 0.00 0.00 0.00 0.00 36.38 35.61 1et5 s VAL 68 CO 0.17 -0.08 1.17 -2.16 0.00 0.00 0.00 175.10 174.20 1et5 s PRO 69 N 1.87 0.56 0.97 2.72 0.04 -1.26 -1.44 135.00 138.46 1et5 s PRO 69 Ca 0.01 0.07 -0.12 0.00 0.04 0.00 0.00 61.00 61.00 1et5 s PRO 69 Cb -0.16 -1.79 0.17 0.00 0.04 0.00 0.00 34.50 32.76 1et5 s PRO 69 CO -0.07 -2.55 1.09 0.20 0.04 0.00 0.00 177.00 175.71 1et5 s GLY 70 N -4.18 1.59 0.69 0.56 0.00 -0.26 -4.72 107.32 101.00 1et5 s GLY 70 Ca 0.67 -0.21 -0.15 0.00 0.00 0.00 0.00 44.72 45.04 1et5 s GLY 70 CO 0.54 0.36 1.14 2.56 0.00 0.00 0.00 173.10 177.70 1et5 s PRO 71 N -4.91 2.53 -0.02 2.90 0.04 -1.26 -4.52 135.00 129.76 1et5 s PRO 71 Ca 0.65 1.51 -0.24 0.00 0.04 0.00 0.00 61.00 62.96 1et5 s PRO 71 Cb -0.19 -1.91 -0.04 0.00 0.04 0.00 0.00 34.50 32.40 1et5 s PRO 71 CO 0.58 -1.48 0.71 -1.17 0.04 0.00 0.00 177.00 175.67 1et5 s LEU 72 N -5.03 4.38 -0.09 -3.56 2.96 -1.26 -4.26 118.68 111.82 1et5 s LEU 72 Ca 0.69 1.27 -0.00 0.00 -0.22 0.00 0.00 54.13 55.87 1et5 s LEU 72 Cb -0.23 -3.11 -0.03 0.00 0.50 0.00 0.00 46.19 43.32 1et5 s LEU 72 CO 0.43 -0.04 -0.06 -0.04 -1.32 0.00 0.00 176.35 175.32 1et5 s MET 73 N 0.37 3.04 -0.08 1.98 -1.94 -1.11 -4.60 119.30 116.95 1et5 s MET 73 Ca 0.37 -0.54 0.04 0.00 -1.71 0.00 0.00 55.69 53.84 1et5 s MET 73 Cb -0.19 -2.68 0.00 0.00 2.01 0.00 0.00 34.83 33.97 1et5 s MET 73 CO 0.20 0.53 -0.20 0.08 -0.01 0.00 0.00 175.02 175.61 1et5 s VAL 74 N -0.44 1.77 0.27 -6.03 1.01 -1.26 -0.33 120.40 115.39 1et5 s VAL 74 Ca 0.07 -0.86 0.05 0.00 0.00 0.00 0.00 61.98 61.24 1et5 s VAL 74 Cb -0.12 -1.54 -0.02 0.00 0.00 0.00 0.00 36.38 34.70 1et5 s VAL 74 CO 0.02 0.50 0.25 1.33 0.00 0.00 0.00 175.10 177.20 1et5 n VAL 75 N 3.52 0.00 -4.29 2.92 0.24 -0.65 -4.99 118.33 115.08 1et5 n VAL 75 Ca -0.20 -1.91 -0.25 0.00 -2.04 0.00 0.00 64.34 59.94 1et5 n VAL 75 Cb 0.53 0.98 -0.08 0.00 -1.47 0.00 0.00 33.84 33.79 1et5 n VAL 75 CO 0.00 0.00 0.00 -1.00 -2.14 0.00 0.00 176.83 173.69 1et5 s HIS 76 N -3.12 2.66 0.24 6.34 0.09 -1.26 -1.59 115.29 118.65 1et5 s HIS 76 Ca 0.31 -0.22 -0.31 0.00 -0.00 0.00 0.00 55.06 54.84 1et5 s HIS 76 Cb 0.01 -1.24 -0.14 0.00 -0.00 0.00 0.00 32.58 31.21 1et5 s HIS 76 CO 0.22 0.57 1.36 0.94 -0.00 0.00 0.00 174.74 177.83 1et5 n GLN 77 N -0.36 1.93 -0.96 1.40 7.27 0.06 -1.22 117.38 125.50 1et5 n GLN 77 Ca -0.09 0.69 0.00 0.00 0.07 0.00 0.00 57.00 57.67 1et5 n GLN 77 Cb 0.57 -2.31 0.00 0.00 2.41 0.00 0.00 30.24 30.91 1et5 n GLN 77 CO 0.00 0.00 0.00 -0.25 0.07 0.00 0.00 177.06 176.88 1et5 n ASP 78 N 2.01 0.00 -4.81 1.69 10.43 0.98 -4.76 116.55 122.09 1et5 n ASP 78 Ca 0.11 0.00 -0.29 0.00 2.57 0.00 0.00 54.79 57.18 1et5 n ASP 78 Cb 0.31 0.00 0.11 0.00 1.84 0.00 0.00 41.12 43.38 1et5 n ASP 78 CO 0.00 0.00 0.00 -1.81 -1.07 0.00 0.00 177.20 174.32 1et5 s ASP 79 N -3.03 4.09 -0.13 -2.24 -0.00 -0.36 -4.69 116.67 110.32 1et5 s ASP 79 Ca 0.00 1.06 -0.01 0.00 -0.00 0.00 0.00 52.55 53.60 1et5 s ASP 79 Cb 0.00 -1.69 -0.02 0.00 -0.00 0.00 0.00 42.92 41.21 1et5 s ASP 79 CO 0.00 -2.19 -0.10 -0.31 -0.00 0.00 0.00 175.17 172.57 1et5 s TYR 80 N -3.29 2.89 -0.23 4.23 1.51 -0.09 -1.61 117.35 120.76 1et5 s TYR 80 Ca 0.62 -0.47 -0.13 0.00 -1.01 0.00 0.00 57.07 56.08 1et5 s TYR 80 Cb -0.14 -1.87 -0.04 0.00 -0.11 0.00 0.00 41.96 39.80 1et5 s TYR 80 CO 0.53 -0.11 0.27 -1.17 -1.11 0.00 0.00 175.55 173.96 1et5 s LEU 81 N 0.25 4.11 -0.27 -1.29 0.20 -0.42 0.03 118.68 121.29 1et5 s LEU 81 Ca -0.07 0.25 0.01 0.00 0.69 0.00 0.00 54.13 55.02 1et5 s LEU 81 Cb -0.15 -2.28 0.06 0.00 -0.43 0.00 0.00 46.19 43.39 1et5 s LEU 81 CO 0.04 -0.02 -0.07 -0.70 -0.29 0.00 0.00 176.35 175.31 1et5 s GLU 82 N 1.33 2.31 -0.13 1.98 2.12 0.12 -2.23 118.70 124.19 1et5 s GLU 82 Ca 0.12 -1.32 -0.04 0.00 0.36 0.00 0.00 54.97 54.09 1et5 s GLU 82 Cb -0.14 -3.00 -0.03 0.00 0.26 0.00 0.00 34.13 31.22 1et5 s GLU 82 CO 0.07 -0.59 0.01 -1.17 -0.54 0.00 0.00 175.26 173.04 1et5 s LEU 83 N 1.15 3.57 -0.26 2.70 2.96 -0.10 -1.41 118.68 127.29 1et5 s LEU 83 Ca -0.08 0.06 -0.07 0.00 -0.22 0.00 0.00 54.13 53.83 1et5 s LEU 83 Cb -0.20 -1.85 -0.02 0.00 0.50 0.00 0.00 46.19 44.62 1et5 s LEU 83 CO -0.04 0.27 0.07 -0.89 -1.32 0.00 0.00 176.35 174.45 1et5 s THR 84 N -0.26 4.22 -0.18 3.68 2.01 -0.29 -0.97 115.64 123.85 1et5 s THR 84 Ca 0.06 -0.28 -0.03 0.00 0.31 0.00 0.00 61.69 61.75 1et5 s THR 84 Cb -0.12 -3.01 -0.01 0.00 0.01 0.00 0.00 72.50 69.36 1et5 s THR 84 CO 0.02 0.29 -0.07 -0.22 -0.69 0.00 0.00 174.62 173.95 1et5 s LEU 85 N 1.59 2.90 -0.10 4.42 2.96 -0.04 -1.73 118.68 128.68 1et5 s LEU 85 Ca 0.06 -0.33 0.02 0.00 -0.22 0.00 0.00 54.13 53.66 1et5 s LEU 85 Cb -0.15 -1.71 -0.01 0.00 0.50 0.00 0.00 46.19 44.81 1et5 s LEU 85 CO 0.03 0.06 -0.18 -0.63 -1.32 0.00 0.00 176.35 174.32 1et5 s ILE 86 N 0.97 2.66 -0.49 6.68 1.01 -0.53 -1.68 121.20 129.83 1et5 s ILE 86 Ca -0.00 -0.82 -0.02 0.00 0.00 0.00 0.00 60.65 59.80 1et5 s ILE 86 Cb -0.15 -2.07 0.13 0.00 0.01 0.00 0.00 42.46 40.38 1et5 s ILE 86 CO 0.00 0.55 0.29 0.21 0.00 0.00 0.00 174.94 175.98 1et5 s ASN 87 N 0.16 5.21 0.27 3.58 3.84 -0.24 -1.73 114.94 126.03 1et5 s ASN 87 Ca -0.10 -2.36 -0.27 0.00 0.21 0.00 0.00 52.86 50.34 1et5 s ASN 87 Cb -0.16 -1.83 -0.15 0.00 -0.55 0.00 0.00 41.25 38.57 1et5 s ASN 87 CO 0.06 -0.47 0.78 -2.65 -2.79 0.00 0.00 177.10 172.03 1et5 n PRO 88 N 4.15 0.76 0.17 0.43 -0.02 -1.26 0.17 135.00 139.40 1et5 n PRO 88 Ca 0.02 0.27 0.12 0.00 -2.02 0.00 0.00 63.50 61.88 1et5 n PRO 88 Cb 0.40 -1.49 0.61 0.00 -0.02 0.00 0.00 33.50 33.00 1et5 n PRO 88 CO 0.00 0.00 0.00 1.05 1.98 0.00 0.00 175.50 178.53 1et5 h GLU 89 N 1.49 0.00 0.00 -0.52 4.11 -1.89 -0.34 114.58 117.44 1et5 h GLU 89 Ca -0.35 0.00 -0.04 0.00 0.07 0.00 0.00 59.36 59.04 1et5 h GLU 89 Cb 1.38 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.63 1et5 h GLU 89 CO 0.58 0.00 -0.18 1.15 0.07 0.00 0.00 179.01 180.64 1et5 h THR 90 N 0.00 0.39 -4.50 -1.06 2.02 -1.94 -3.43 112.91 104.40 1et5 h THR 90 Ca 0.00 -1.10 -0.47 0.00 0.77 0.00 0.00 66.41 65.61 1et5 h THR 90 Cb 0.03 1.82 0.11 0.00 -1.74 0.00 0.00 68.15 68.36 1et5 h THR 90 CO 0.00 0.17 0.38 0.20 0.37 0.00 0.00 175.52 176.64 1et5 s ASN 91 N -6.12 4.30 0.00 4.18 0.01 -0.14 -5.02 114.94 112.15 1et5 s ASN 91 Ca 0.02 0.87 0.04 0.00 -0.71 0.00 0.00 52.86 53.08 1et5 s ASN 91 Cb 0.09 -1.41 -0.04 0.00 0.41 0.00 0.00 41.25 40.30 1et5 s ASN 91 CO 0.63 -2.05 0.20 0.35 -1.51 0.00 0.00 177.10 174.73 1et5 n THR 92 N -3.42 0.00 -4.43 1.60 -2.24 -1.26 -4.74 114.28 99.78 1et5 n THR 92 Ca 0.07 -0.41 -0.22 0.00 -2.27 0.00 0.00 64.05 61.22 1et5 n THR 92 Cb 0.60 1.01 -0.10 0.00 -2.10 0.00 0.00 70.33 69.74 1et5 n THR 92 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1et5 s LEU 93 N -2.07 2.58 0.35 3.22 1.43 -1.26 -4.93 118.68 118.00 1et5 s LEU 93 Ca 0.02 -1.04 -0.23 0.00 -1.03 0.00 0.00 54.13 51.85 1et5 s LEU 93 Cb 0.03 -0.95 -0.10 0.00 0.03 0.00 0.00 46.19 45.20 1et5 s LEU 93 CO 0.16 -0.04 0.91 -0.32 0.23 0.00 0.00 176.35 177.28 1et5 s MET 94 N -3.56 4.38 0.13 1.70 -2.45 -1.26 -4.20 119.30 114.04 1et5 s MET 94 Ca 0.28 1.16 -0.03 0.00 -1.25 0.00 0.00 55.69 55.84 1et5 s MET 94 Cb -0.03 -2.57 -0.03 0.00 1.25 0.00 0.00 34.83 33.45 1et5 s MET 94 CO 0.12 0.18 0.11 -1.01 1.05 0.00 0.00 175.02 175.47 1et5 s HIS 95 N -1.83 0.68 0.04 4.11 0.09 -0.90 -4.93 115.29 112.55 1et5 s HIS 95 Ca 0.54 -1.07 -0.01 0.00 -0.00 0.00 0.00 55.06 54.52 1et5 s HIS 95 Cb -0.14 -0.34 0.00 0.00 -0.00 0.00 0.00 32.58 32.10 1et5 s HIS 95 CO 0.19 -0.56 0.08 0.27 -0.00 0.00 0.00 174.74 174.72 1et5 n ASN 96 N -0.10 -0.22 -3.84 1.40 6.94 -1.26 -1.44 115.26 116.73 1et5 n ASN 96 Ca -0.07 -1.21 -0.12 0.00 -0.02 0.00 0.00 54.58 53.16 1et5 n ASN 96 Cb 0.63 0.38 -0.14 0.00 -2.36 0.00 0.00 39.78 38.30 1et5 n ASN 96 CO 0.00 0.00 0.00 -0.51 -1.03 0.00 0.00 177.26 175.72 1et5 s ILE 97 N -2.70 -0.00 -0.22 1.53 2.07 -1.26 -4.21 121.20 116.41 1et5 s ILE 97 Ca 0.03 0.01 0.01 0.00 -1.41 0.00 0.00 60.65 59.29 1et5 s ILE 97 Cb -0.00 -0.09 0.05 0.00 0.13 0.00 0.00 42.46 42.54 1et5 s ILE 97 CO 0.02 0.01 -0.09 0.21 -1.91 0.00 0.00 174.94 173.17 1et5 s ASN 98 N 0.11 3.74 -0.22 4.50 3.84 0.67 -1.78 114.94 125.80 1et5 s ASN 98 Ca -0.01 -1.07 -0.14 0.00 0.21 0.00 0.00 52.86 51.85 1et5 s ASN 98 Cb -0.01 -1.29 -0.04 0.00 -0.55 0.00 0.00 41.25 39.36 1et5 s ASN 98 CO -0.00 -0.18 0.32 -0.36 -2.79 0.00 0.00 177.10 174.09 1et5 s PHE 99 N 1.33 3.34 -0.27 0.43 0.40 -0.05 -1.56 117.98 121.60 1et5 s PHE 99 Ca -0.04 0.47 0.28 0.00 -0.60 0.00 0.00 56.93 57.03 1et5 s PHE 99 Cb -0.18 -2.44 1.10 0.00 0.51 0.00 0.00 43.02 42.01 1et5 s PHE 99 CO -0.07 -0.00 1.82 0.45 0.70 0.00 0.00 175.22 178.12 1et5 h HIS 100 N 7.49 0.00 0.00 0.36 3.86 -1.45 -2.33 115.15 123.09 1et5 h HIS 100 Ca -0.36 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.85 1et5 h HIS 100 Cb 1.16 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.63 1et5 h HIS 100 CO 0.68 0.00 0.00 0.00 0.86 0.00 0.00 177.93 179.47 1et5 h ALA 101 N 2.17 1.00 -2.14 2.45 0.00 -1.90 -3.47 119.26 117.36 1et5 h ALA 101 Ca 0.00 0.00 -0.46 0.00 0.00 0.00 0.00 54.91 54.45 1et5 h ALA 101 Cb 0.47 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.26 1et5 h ALA 101 CO 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 179.25 178.96 1et5 s ALA 102 N -3.24 3.86 -0.22 0.00 0.00 -0.88 -4.61 121.76 116.67 1et5 s ALA 102 Ca 0.07 -1.12 0.01 0.00 0.00 0.00 0.00 51.96 50.92 1et5 s ALA 102 Cb 0.10 -1.92 0.03 0.00 0.00 0.00 0.00 23.12 21.34 1et5 s ALA 102 CO 0.54 0.03 -0.14 0.99 0.00 0.00 0.00 175.76 177.18 1et5 s THR 103 N -2.20 2.32 0.00 0.00 2.01 -1.26 -4.66 115.64 111.85 1et5 s THR 103 Ca 0.39 -1.12 0.00 0.00 0.31 0.00 0.00 61.69 61.27 1et5 s THR 103 Cb -0.09 -2.13 0.00 0.00 0.01 0.00 0.00 72.50 70.29 1et5 s THR 103 CO 0.33 0.31 0.00 0.61 -0.69 0.00 0.00 174.62 175.18 1et5 n GLY 104 N 4.59 2.48 4.35 4.40 0.00 -1.26 -4.93 105.19 114.82 1et5 n GLY 104 Ca -0.18 -1.98 -0.33 0.00 0.00 0.00 0.00 46.02 43.53 1et5 n GLY 104 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1et5 n ALA 105 N 0.52 -1.90 -3.75 4.61 0.00 -1.26 -0.21 120.51 118.52 1et5 n ALA 105 Ca 0.00 -0.39 -0.26 0.00 0.00 0.00 0.00 53.44 52.79 1et5 n ALA 105 Cb 0.00 -1.04 0.05 0.00 0.00 0.00 0.00 19.45 18.46 1et5 n ALA 105 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1et5 n LEU 106 N -4.52 -3.01 -0.16 0.00 4.77 -1.26 -1.13 117.00 111.69 1et5 n LEU 106 Ca -0.27 -0.71 -0.02 0.00 -0.03 0.00 0.00 56.01 54.98 1et5 n LEU 106 Cb 0.66 -2.75 -0.01 0.00 -2.33 0.00 0.00 43.42 39.00 1et5 n LEU 106 CO 0.87 0.50 -0.02 0.61 -1.33 0.00 0.00 177.39 178.01 1et5 n GLY 107 N -1.70 0.48 0.00 -0.72 0.00 0.70 -2.31 105.19 101.65 1et5 n GLY 107 Ca -0.07 -0.17 0.00 0.00 0.00 0.00 0.00 46.02 45.79 1et5 n GLY 107 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1et5 n GLY 108 N -1.54 0.49 0.27 -0.02 0.00 -0.28 -0.88 105.19 103.24 1et5 n GLY 108 Ca -0.02 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 45.99 1et5 n GLY 108 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1et5 h GLY 109 N 0.00 0.60 2.00 -0.02 0.00 -0.85 -2.67 103.07 102.13 1et5 h GLY 109 Ca 0.00 -0.36 0.00 0.00 0.00 0.00 0.00 47.33 46.97 1et5 h GLY 109 CO 0.00 0.33 0.00 0.61 0.00 0.00 0.00 176.54 177.48 1et5 n GLY 110 N -0.86 -1.34 0.39 4.60 0.00 -0.62 -3.10 105.19 104.26 1et5 n GLY 110 Ca 0.02 -0.01 0.05 0.00 0.00 0.00 0.00 46.02 46.07 1et5 n GLY 110 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1et5 n LEU 111 N -1.88 1.87 -0.21 0.99 4.77 -1.03 -4.67 117.00 116.82 1et5 n LEU 111 Ca 0.04 -1.07 0.08 0.00 -0.03 0.00 0.00 56.01 55.04 1et5 n LEU 111 Cb 0.28 -0.01 0.13 0.00 -2.33 0.00 0.00 43.42 41.49 1et5 n LEU 111 CO 0.22 0.37 0.50 0.35 -1.33 0.00 0.00 177.39 177.50 1et5 n THR 112 N 0.53 1.70 -2.11 -5.08 -2.24 -1.06 -4.95 114.28 101.06 1et5 n THR 112 Ca 0.06 -2.14 -0.43 0.00 -2.27 0.00 0.00 64.05 59.27 1et5 n THR 112 Cb 0.25 -0.14 -0.02 0.00 -2.10 0.00 0.00 70.33 68.32 1et5 n THR 112 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1et5 s GLU 113 N -2.57 3.54 -0.07 -0.78 2.02 -1.25 -4.22 118.70 115.37 1et5 s GLU 113 Ca 0.29 1.40 0.03 0.00 0.02 0.00 0.00 54.97 56.72 1et5 s GLU 113 Cb 0.26 -4.10 0.00 0.00 0.10 0.00 0.00 34.13 30.39 1et5 s GLU 113 CO 0.01 -1.60 -0.18 0.96 0.02 0.00 0.00 175.26 174.47 1et5 s ILE 114 N 6.00 1.55 0.62 -1.63 -4.36 -0.52 -4.99 121.20 117.87 1et5 s ILE 114 Ca 0.73 -0.74 -0.05 0.00 -0.26 0.00 0.00 60.65 60.34 1et5 s ILE 114 Cb -0.21 -1.36 0.03 0.00 1.25 0.00 0.00 42.46 42.17 1et5 s ILE 114 CO 0.32 0.45 0.91 0.20 0.24 0.00 0.00 174.94 177.05 1et5 s ASN 115 N 0.38 5.26 0.23 4.36 0.02 -1.26 -2.12 114.94 121.81 1et5 s ASN 115 Ca -0.13 0.46 -0.31 0.00 -1.02 0.00 0.00 52.86 51.86 1et5 s ASN 115 Cb -0.16 -1.33 -0.14 0.00 0.02 0.00 0.00 41.25 39.65 1et5 s ASN 115 CO 0.05 -1.25 1.34 -2.65 0.02 0.00 0.00 177.10 174.61 1et5 n PRO 116 N -2.63 1.83 -0.44 -0.60 -0.02 -1.26 -1.59 135.00 130.29 1et5 n PRO 116 Ca 0.06 0.65 0.00 0.00 -2.02 0.00 0.00 63.50 62.19 1et5 n PRO 116 Cb 0.59 -2.26 0.00 0.00 -0.02 0.00 0.00 33.50 31.81 1et5 n PRO 116 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1et5 n GLY 117 N 2.06 0.74 3.59 -1.23 0.00 0.44 -4.69 105.19 106.10 1et5 n GLY 117 Ca 0.12 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.89 1et5 n GLY 117 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1et5 s GLU 118 N -0.56 1.98 0.16 1.61 2.02 -0.62 -4.85 118.70 118.44 1et5 s GLU 118 Ca 0.00 -1.76 -0.01 0.00 0.02 0.00 0.00 54.97 53.22 1et5 s GLU 118 Cb 0.00 -1.88 -0.04 0.00 0.10 0.00 0.00 34.13 32.31 1et5 s GLU 118 CO 0.00 0.19 0.08 -1.59 0.02 0.00 0.00 175.26 173.96 1et5 s LYS 119 N -3.66 1.05 0.05 1.61 -2.85 -1.26 -1.08 119.74 113.60 1et5 s LYS 119 Ca 0.33 -1.52 -0.20 0.00 -1.00 0.00 0.00 55.97 53.58 1et5 s LYS 119 Cb -0.01 0.21 0.04 0.00 -2.06 0.00 0.00 37.83 36.02 1et5 s LYS 119 CO 0.18 -0.30 0.46 -0.08 0.10 0.00 0.00 175.35 175.71 1et5 s THR 120 N -4.06 0.04 -0.13 3.79 -1.32 -0.67 -5.00 115.64 108.29 1et5 s THR 120 Ca 0.30 -0.36 -0.00 0.00 -1.21 0.00 0.00 61.69 60.41 1et5 s THR 120 Cb 0.07 -0.98 0.02 0.00 -1.51 0.00 0.00 72.50 70.11 1et5 s THR 120 CO 0.06 -0.20 -0.10 -0.63 -2.21 0.00 0.00 174.62 171.53 1et5 s ILE 121 N -2.60 1.25 -0.02 5.08 1.01 -1.26 -0.86 121.20 123.80 1et5 s ILE 121 Ca -0.04 -0.43 0.05 0.00 0.00 0.00 0.00 60.65 60.23 1et5 s ILE 121 Cb -0.01 -1.22 -0.03 0.00 0.01 0.00 0.00 42.46 41.22 1et5 s ILE 121 CO -0.03 0.41 -0.18 -0.22 0.00 0.00 0.00 174.94 174.92 1et5 s LEU 122 N 1.62 2.55 -0.03 2.97 2.96 -0.15 -4.97 118.68 123.63 1et5 s LEU 122 Ca 0.05 -0.31 0.02 0.00 -0.22 0.00 0.00 54.13 53.67 1et5 s LEU 122 Cb -0.13 -1.50 0.00 0.00 0.50 0.00 0.00 46.19 45.07 1et5 s LEU 122 CO -0.09 0.32 -0.08 -0.60 -1.32 0.00 0.00 176.35 174.58 1et5 s ARG 123 N -0.86 0.89 0.04 1.98 3.52 -1.26 -0.92 118.95 122.33 1et5 s ARG 123 Ca 0.12 -0.27 -0.07 0.00 -0.13 0.00 0.00 55.73 55.38 1et5 s ARG 123 Cb -0.10 -0.84 -0.00 0.00 -1.56 0.00 0.00 34.95 32.44 1et5 s ARG 123 CO 0.01 0.09 0.14 -0.59 -0.81 0.00 0.00 175.30 174.14 1et5 s PHE 124 N 0.23 0.13 -0.13 5.12 -0.12 -0.95 -4.99 117.98 117.29 1et5 s PHE 124 Ca -0.03 -0.39 -0.20 0.00 -0.05 0.00 0.00 56.93 56.25 1et5 s PHE 124 Cb -0.08 -0.09 -0.04 0.00 -0.63 0.00 0.00 43.02 42.18 1et5 s PHE 124 CO 0.00 -0.39 0.58 0.21 -0.05 0.00 0.00 175.22 175.57 1et5 s LYS 125 N -2.52 4.33 -1.27 1.99 2.20 -1.26 -1.29 119.74 121.92 1et5 s LYS 125 Ca -0.06 0.60 -0.16 0.00 -0.36 0.00 0.00 55.97 55.99 1et5 s LYS 125 Cb -0.02 -3.48 0.11 0.00 -1.51 0.00 0.00 37.83 32.93 1et5 s LYS 125 CO -0.04 0.02 1.63 0.00 -0.36 0.00 0.00 175.35 176.60 1et5 s ALA 126 N 1.03 3.57 -0.08 3.13 0.00 -0.63 -4.80 121.76 123.96 1et5 s ALA 126 Ca 0.30 -3.08 0.20 0.00 0.00 0.00 0.00 51.96 49.38 1et5 s ALA 126 Cb -0.16 -4.46 0.47 0.00 0.00 0.00 0.00 23.12 18.97 1et5 s ALA 126 CO 0.12 -3.11 1.63 1.79 0.00 0.00 0.00 175.76 176.20 1et5 h THR 127 N 5.24 0.59 -3.31 0.00 1.35 -1.87 0.28 112.91 115.19 1et5 h THR 127 Ca 0.40 -1.56 -0.66 0.00 -0.55 0.00 0.00 66.41 64.04 1et5 h THR 127 Cb 0.87 2.08 -0.29 0.00 -1.73 0.00 0.00 68.15 69.08 1et5 h THR 127 CO 1.38 0.30 -0.80 -0.54 -0.25 0.00 0.00 175.52 175.61 1et5 s LYS 128 N -3.28 3.27 0.24 4.72 1.02 -1.26 -4.78 119.74 119.67 1et5 s LYS 128 Ca 0.03 -0.74 -0.25 0.00 0.02 0.00 0.00 55.97 55.03 1et5 s LYS 128 Cb 0.08 -2.57 -0.09 0.00 -0.52 0.00 0.00 37.83 34.73 1et5 s LYS 128 CO 0.69 0.14 0.84 -1.25 -0.92 0.00 0.00 175.35 174.85 1et5 s PRO 129 N 0.52 4.54 0.00 -1.68 0.04 -1.26 -4.79 135.00 132.36 1et5 s PRO 129 Ca -0.10 1.19 0.00 0.00 0.04 0.00 0.00 61.00 62.13 1et5 s PRO 129 Cb -0.16 -3.02 0.00 0.00 0.04 0.00 0.00 34.50 31.36 1et5 s PRO 129 CO 0.04 0.42 0.00 0.41 0.04 0.00 0.00 177.00 177.92 1et5 n GLY 130 N 1.02 -0.02 3.80 0.56 0.00 0.50 -2.44 105.19 108.61 1et5 n GLY 130 Ca -0.02 -1.76 -0.36 0.00 0.00 0.00 0.00 46.02 43.88 1et5 n GLY 130 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1et5 s VAL 131 N -1.48 5.33 0.03 1.61 -7.23 0.15 -0.64 120.40 118.18 1et5 s VAL 131 Ca 0.00 0.15 0.03 0.00 -1.81 0.00 0.00 61.98 60.35 1et5 s VAL 131 Cb 0.00 -3.35 -0.02 0.00 0.56 0.00 0.00 36.38 33.57 1et5 s VAL 131 CO 0.00 0.56 -0.10 -0.36 -0.31 0.00 0.00 175.10 174.89 1et5 s PHE 132 N -0.53 0.87 0.50 2.82 0.08 -0.20 -4.42 117.98 117.10 1et5 s PHE 132 Ca 0.12 -0.36 -0.18 0.00 0.12 0.00 0.00 56.93 56.64 1et5 s PHE 132 Cb -0.12 -0.52 -0.08 0.00 -0.57 0.00 0.00 43.02 41.73 1et5 s PHE 132 CO 0.02 -0.02 0.99 0.08 -0.10 0.00 0.00 175.22 176.19 1et5 s VAL 133 N -0.91 4.39 0.02 -0.44 1.01 -1.26 -0.73 120.40 122.48 1et5 s VAL 133 Ca -0.03 1.23 0.01 0.00 0.00 0.00 0.00 61.98 63.19 1et5 s VAL 133 Cb -0.07 -3.65 -0.02 0.00 0.00 0.00 0.00 36.38 32.64 1et5 s VAL 133 CO 0.01 -0.57 -0.04 -0.72 0.00 0.00 0.00 175.10 173.77 1et5 s TYR 134 N -2.49 0.35 0.12 5.22 -0.85 -0.80 -1.16 117.35 117.74 1et5 s TYR 134 Ca 0.60 -0.40 -0.25 0.00 -0.52 0.00 0.00 57.07 56.50 1et5 s TYR 134 Cb -0.11 -0.23 0.07 0.00 0.38 0.00 0.00 41.96 42.08 1et5 s TYR 134 CO 0.28 -0.12 0.80 -3.38 -1.52 0.00 0.00 175.55 171.61 1et5 s HIS 135 N -1.10 -0.32 0.48 -3.49 -3.43 -0.60 -0.59 115.29 106.25 1et5 s HIS 135 Ca -0.10 0.08 -0.20 0.00 -0.80 0.00 0.00 55.06 54.03 1et5 s HIS 135 Cb -0.08 0.59 -0.09 0.00 -1.43 0.00 0.00 32.58 31.58 1et5 s HIS 135 CO -0.00 -0.80 1.02 0.00 -2.00 0.00 0.00 174.74 172.96 1et5 n ALA 137 N -0.99 -1.51 -2.27 0.00 0.00 -1.26 -4.52 120.51 109.96 1et5 n ALA 137 Ca 0.09 -1.34 -0.41 0.00 0.00 0.00 0.00 53.44 51.78 1et5 n ALA 137 Cb 0.53 -1.38 -0.04 0.00 0.00 0.00 0.00 19.45 18.56 1et5 n ALA 137 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 1et5 s PRO 138 N 0.72 4.67 0.10 0.00 0.02 -1.26 -4.86 135.00 134.38 1et5 s PRO 138 Ca 0.32 1.49 -0.36 0.00 0.02 0.00 0.00 61.00 62.47 1et5 s PRO 138 Cb 0.20 -3.37 -0.17 0.00 0.02 0.00 0.00 34.50 31.17 1et5 s PRO 138 CO -0.22 0.17 1.19 -2.30 -0.33 0.00 0.00 177.00 175.51 1et5 n PRO 139 N 2.83 0.83 0.00 5.54 -0.02 -1.26 -1.19 135.00 141.73 1et5 n PRO 139 Ca 0.03 0.30 0.00 0.00 -2.02 0.00 0.00 63.50 61.81 1et5 n PRO 139 Cb 0.49 -1.84 0.00 0.00 -0.02 0.00 0.00 33.50 32.13 1et5 n PRO 139 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1et5 n GLY 140 N 2.12 2.88 1.35 -1.23 0.00 -1.26 -4.78 105.19 104.27 1et5 n GLY 140 Ca 0.18 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.24 1et5 n GLY 140 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1et5 n MET 141 N -2.00 0.20 0.39 1.61 2.81 -0.33 -4.98 117.12 114.82 1et5 n MET 141 Ca 0.00 -2.13 -0.19 0.00 -1.81 0.00 0.00 57.70 53.57 1et5 n MET 141 Cb 0.00 -0.22 -0.10 0.00 -0.71 0.00 0.00 33.22 32.19 1et5 n MET 141 CO 0.00 0.00 0.00 0.28 1.51 0.00 0.00 175.97 177.76 1et5 h VAL 142 N 6.24 0.08 -0.97 2.03 2.07 -1.82 -2.89 116.25 120.98 1et5 h VAL 142 Ca -0.19 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.39 1et5 h VAL 142 Cb 1.77 0.08 -0.07 0.00 -1.52 0.00 0.00 31.29 31.55 1et5 h VAL 142 CO 0.08 0.00 0.62 -0.65 0.02 0.00 0.00 177.57 177.65 1et5 h PRO 143 N -1.10 1.10 -0.72 1.57 0.11 -1.92 -2.53 132.00 128.50 1et5 h PRO 143 Ca -0.09 -0.07 0.01 0.00 0.11 0.00 0.00 66.00 65.96 1et5 h PRO 143 Cb 0.90 -0.25 -0.04 0.00 0.11 0.00 0.00 31.00 31.72 1et5 h PRO 143 CO 0.08 0.73 0.47 2.35 -0.21 0.00 0.00 178.00 181.42 1et5 h TRP 144 N 1.13 0.91 -0.11 0.65 7.01 -1.95 -0.35 115.95 123.25 1et5 h TRP 144 Ca 0.42 0.02 -0.17 0.00 2.11 0.00 0.00 58.89 61.27 1et5 h TRP 144 Cb 0.17 -0.31 -0.01 0.00 -2.10 0.00 0.00 29.16 26.91 1et5 h TRP 144 CO -0.01 0.58 -0.66 0.45 -2.79 0.00 0.00 178.44 176.00 1et5 h HIS 145 N 0.98 0.56 -0.07 2.65 3.86 -1.29 -2.87 115.15 118.96 1et5 h HIS 145 Ca 0.26 -0.23 -0.02 0.00 -1.16 0.00 0.00 60.37 59.23 1et5 h HIS 145 Cb -0.11 -0.09 -0.00 0.00 1.06 0.00 0.00 27.41 28.27 1et5 h HIS 145 CO -0.02 0.96 -0.02 0.28 0.86 0.00 0.00 177.93 179.99 1et5 h VAL 146 N 0.30 1.30 0.00 2.45 2.07 -1.03 -2.12 116.25 119.22 1et5 h VAL 146 Ca -0.02 -0.97 0.00 0.00 0.82 0.00 0.00 66.70 66.54 1et5 h VAL 146 Cb 1.22 1.81 0.00 0.00 -1.52 0.00 0.00 31.29 32.79 1et5 h VAL 146 CO 0.12 0.27 0.00 1.33 0.02 0.00 0.00 177.57 179.30 1et5 n VAL 147 N -4.80 0.00 0.14 2.57 0.24 -0.18 -1.39 118.33 114.92 1et5 n VAL 147 Ca -0.07 0.00 0.11 0.00 -2.04 0.00 0.00 64.34 62.35 1et5 n VAL 147 Cb 0.24 -0.22 0.23 0.00 -1.47 0.00 0.00 33.84 32.62 1et5 n VAL 147 CO 0.00 0.00 0.00 -1.20 -2.14 0.00 0.00 176.83 173.49 1et5 n SER 148 N -0.67 3.53 0.00 -1.34 7.64 -1.08 -4.62 113.62 117.07 1et5 n SER 148 Ca 0.07 -1.98 0.00 0.00 1.01 0.00 0.00 58.87 57.97 1et5 n SER 148 Cb 0.03 -0.29 0.00 0.00 -1.01 0.00 0.00 64.21 62.94 1et5 n SER 148 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1et5 n GLY 149 N 1.48 0.82 2.92 0.23 0.00 -0.49 -2.01 105.19 108.14 1et5 n GLY 149 Ca 0.20 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.79 1et5 n GLY 149 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 1et5 n MET 150 N -2.12 3.53 -3.51 1.61 0.00 -0.82 -4.59 117.12 111.23 1et5 n MET 150 Ca 0.00 -3.48 -0.11 0.00 0.00 0.00 0.00 57.70 54.11 1et5 n MET 150 Cb 0.00 -2.97 -0.02 0.00 0.00 0.00 0.00 33.22 30.23 1et5 n MET 150 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 175.97 176.51 1et5 s ASN 151 N 1.26 -0.48 0.00 6.12 2.20 -1.26 -1.71 114.94 121.07 1et5 s ASN 151 Ca 0.41 -0.13 0.00 0.00 -0.94 0.00 0.00 52.86 52.19 1et5 s ASN 151 Cb 0.09 0.60 0.00 0.00 -2.00 0.00 0.00 41.25 39.94 1et5 s ASN 151 CO -0.00 -1.01 0.00 0.61 -2.94 0.00 0.00 177.10 173.75 1et5 n GLY 152 N -0.37 2.60 3.38 0.45 0.00 0.25 -1.10 105.19 110.40 1et5 n GLY 152 Ca -0.15 -0.43 -0.11 0.00 0.00 0.00 0.00 46.02 45.33 1et5 n GLY 152 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1et5 s ALA 153 N -1.00 -1.11 0.20 4.61 0.00 -1.26 -1.91 121.76 121.30 1et5 s ALA 153 Ca 0.00 0.06 0.05 0.00 0.00 0.00 0.00 51.96 52.08 1et5 s ALA 153 Cb 0.00 0.77 -0.05 0.00 0.00 0.00 0.00 23.12 23.84 1et5 s ALA 153 CO 0.00 -0.70 -0.08 0.96 0.00 0.00 0.00 175.76 175.94 1et5 s ILE 154 N -3.80 1.35 -0.08 0.00 -4.36 0.09 -2.75 121.20 111.65 1et5 s ILE 154 Ca 0.03 -2.10 0.01 0.00 -0.26 0.00 0.00 60.65 58.33 1et5 s ILE 154 Cb 0.01 -2.12 0.02 0.00 1.25 0.00 0.00 42.46 41.62 1et5 s ILE 154 CO -0.11 -0.53 -0.09 -0.32 0.24 0.00 0.00 174.94 174.13 1et5 s MET 155 N -3.75 1.51 -0.45 0.37 -2.45 0.55 -1.03 119.30 114.04 1et5 s MET 155 Ca 0.23 -0.30 -0.07 0.00 -1.25 0.00 0.00 55.69 54.30 1et5 s MET 155 Cb 0.03 -1.41 0.12 0.00 1.25 0.00 0.00 34.83 34.81 1et5 s MET 155 CO 0.06 -0.12 0.30 0.08 1.05 0.00 0.00 175.02 176.39 1et5 s VAL 156 N 1.16 3.93 0.38 10.11 1.01 0.19 -1.64 120.40 135.55 1et5 s VAL 156 Ca -0.06 -1.85 -0.24 0.00 0.00 0.00 0.00 61.98 59.84 1et5 s VAL 156 Cb -0.14 -3.61 -0.10 0.00 0.00 0.00 0.00 36.38 32.52 1et5 s VAL 156 CO -0.02 -0.74 0.97 -0.76 0.00 0.00 0.00 175.10 174.55 1et5 s LEU 157 N 1.30 4.13 0.71 3.92 1.43 -0.62 -0.37 118.68 129.19 1et5 s LEU 157 Ca 0.06 1.83 -0.15 0.00 -1.03 0.00 0.00 54.13 54.85 1et5 s LEU 157 Cb -0.25 -4.26 0.03 0.00 0.03 0.00 0.00 46.19 41.74 1et5 s LEU 157 CO -0.02 -0.30 1.16 -2.84 0.23 0.00 0.00 176.35 174.59 1et5 s PRO 158 N -2.60 2.33 0.35 1.29 0.02 -1.26 -0.76 135.00 134.38 1et5 s PRO 158 Ca 0.57 1.58 0.07 0.00 0.02 0.00 0.00 61.00 63.24 1et5 s PRO 158 Cb -0.16 -1.87 0.77 0.00 0.02 0.00 0.00 34.50 33.25 1et5 s PRO 158 CO 0.21 -1.65 1.91 0.00 -0.33 0.00 0.00 177.00 177.14 1et5 h ARG 159 N -0.29 0.72 -0.80 5.54 2.47 -1.90 -1.87 114.38 118.26 1et5 h ARG 159 Ca -0.47 -0.04 -0.15 0.00 -1.26 0.00 0.00 59.98 58.06 1et5 h ARG 159 Cb 1.27 -0.16 -0.09 0.00 -1.65 0.00 0.00 29.97 29.34 1et5 h ARG 159 CO 0.51 0.48 0.19 -0.85 0.56 0.00 0.00 179.97 180.86 1et5 n GLU 160 N -4.52 3.27 -0.15 0.04 0.00 -1.26 -0.29 120.64 117.73 1et5 n GLU 160 Ca 0.14 -2.42 0.02 0.00 0.00 0.00 0.00 57.16 54.91 1et5 n GLU 160 Cb 0.35 -2.03 -0.01 0.00 0.00 0.00 0.00 31.44 29.75 1et5 n GLU 160 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1et5 n GLY 161 N 0.01 -2.07 3.84 -1.84 0.00 -0.70 -4.83 105.19 99.60 1et5 n GLY 161 Ca 0.31 -1.42 -0.32 0.00 0.00 0.00 0.00 46.02 44.59 1et5 n GLY 161 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1et5 s LEU 162 N 0.00 4.00 0.04 0.99 1.43 -1.26 -4.40 118.68 119.48 1et5 s LEU 162 Ca 0.00 1.41 -0.03 0.00 -1.03 0.00 0.00 54.13 54.48 1et5 s LEU 162 Cb 0.00 -4.24 -0.02 0.00 0.03 0.00 0.00 46.19 41.96 1et5 s LEU 162 CO 0.00 -0.28 0.04 -1.00 0.23 0.00 0.00 176.35 175.34 1et5 s HIS 163 N -2.09 0.31 0.79 0.29 3.76 -1.26 -0.46 115.29 116.62 1et5 s HIS 163 Ca 0.57 -0.69 -0.13 0.00 -0.15 0.00 0.00 55.06 54.66 1et5 s HIS 163 Cb -0.10 -0.22 0.18 0.00 1.11 0.00 0.00 32.58 33.55 1et5 s HIS 163 CO 0.17 -0.34 1.07 -0.40 -0.85 0.00 0.00 174.74 174.39 1et5 n ASP 164 N 0.69 0.16 -0.31 1.40 3.85 0.57 -4.87 116.55 118.04 1et5 n ASP 164 Ca -0.18 -1.43 -0.02 0.00 -0.71 0.00 0.00 54.79 52.44 1et5 n ASP 164 Cb 0.59 -0.81 0.13 0.00 -1.35 0.00 0.00 41.12 39.68 1et5 n ASP 164 CO 0.00 0.00 0.00 1.23 -1.01 0.00 0.00 177.20 177.42 1et5 h GLY 165 N -1.36 1.29 1.96 6.12 0.00 -1.90 -1.09 103.07 108.09 1et5 h GLY 165 Ca -0.35 -0.55 0.00 0.00 0.00 0.00 0.00 47.33 46.44 1et5 h GLY 165 CO 0.25 0.53 0.02 0.50 0.00 0.00 0.00 176.54 177.83 1et5 h LYS 166 N 1.22 0.00 0.00 4.80 6.56 -1.99 -3.45 116.57 123.70 1et5 h LYS 166 Ca 0.31 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.90 1et5 h LYS 166 Cb -0.03 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 31.63 1et5 h LYS 166 CO -0.06 0.00 0.00 0.41 -2.06 0.00 0.00 179.45 177.74 1et5 n GLY 167 N -1.19 1.00 3.88 3.86 0.00 -0.41 -5.09 105.19 107.24 1et5 n GLY 167 Ca -0.03 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.65 1et5 n GLY 167 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1et5 s LYS 168 N -0.39 3.61 0.36 1.61 -0.14 -1.26 -4.80 119.74 118.73 1et5 s LYS 168 Ca 0.00 -0.03 -0.28 0.00 -1.36 0.00 0.00 55.97 54.30 1et5 s LYS 168 Cb 0.00 -3.06 -0.11 0.00 -1.68 0.00 0.00 37.83 32.98 1et5 s LYS 168 CO 0.00 0.63 1.48 0.00 -0.76 0.00 0.00 175.35 176.70 1et5 s ALA 169 N -1.32 3.59 -0.30 5.17 0.00 -1.26 -0.31 121.76 127.32 1et5 s ALA 169 Ca 0.29 1.54 0.02 0.00 0.00 0.00 0.00 51.96 53.81 1et5 s ALA 169 Cb -0.13 -3.60 0.09 0.00 0.00 0.00 0.00 23.12 19.47 1et5 s ALA 169 CO 0.17 -1.01 0.03 -0.51 0.00 0.00 0.00 175.76 174.44 1et5 s LEU 170 N -1.86 3.49 -0.23 0.00 1.43 0.39 -4.81 118.68 117.09 1et5 s LEU 170 Ca 0.54 -1.76 -0.07 0.00 -1.03 0.00 0.00 54.13 51.81 1et5 s LEU 170 Cb -0.46 -1.30 -0.03 0.00 0.03 0.00 0.00 46.19 44.42 1et5 s LEU 170 CO 0.60 -0.35 0.07 -0.89 0.23 0.00 0.00 176.35 176.01 1et5 s THR 171 N 1.23 4.48 0.04 5.49 2.01 -1.26 -4.21 115.64 123.42 1et5 s THR 171 Ca 0.06 -0.12 -0.08 0.00 0.31 0.00 0.00 61.69 61.86 1et5 s THR 171 Cb -0.18 -3.07 -0.05 0.00 0.01 0.00 0.00 72.50 69.20 1et5 s THR 171 CO -0.12 0.37 0.33 -0.72 -0.69 0.00 0.00 174.62 173.78 1et5 s TYR 172 N 1.24 3.58 -0.01 4.92 -0.85 -1.26 -4.82 117.35 120.15 1et5 s TYR 172 Ca 0.05 0.67 -0.05 0.00 -0.52 0.00 0.00 57.07 57.21 1et5 s TYR 172 Cb -0.14 -2.06 -0.29 0.00 0.38 0.00 0.00 41.96 39.85 1et5 s TYR 172 CO 0.04 0.57 0.82 -0.44 -1.52 0.00 0.00 175.55 175.02 1et5 h ASP 173 N 3.87 0.45 -5.01 -0.18 3.32 -0.68 -3.48 116.42 114.72 1et5 h ASP 173 Ca -0.50 -0.63 -0.17 0.00 0.02 0.00 0.00 57.03 55.75 1et5 h ASP 173 Cb 1.20 -0.15 -0.17 0.00 0.22 0.00 0.00 39.33 40.43 1et5 h ASP 173 CO 0.66 1.53 -0.69 -0.54 -1.72 0.00 0.00 179.24 178.48 1et5 s LYS 174 N -2.61 0.58 -0.02 3.56 1.02 -1.01 -5.02 119.74 116.24 1et5 s LYS 174 Ca -0.10 -1.06 -0.01 0.00 0.02 0.00 0.00 55.97 54.82 1et5 s LYS 174 Cb 0.06 0.05 0.02 0.00 -0.52 0.00 0.00 37.83 37.45 1et5 s LYS 174 CO 0.86 -0.06 0.04 -1.50 -0.92 0.00 0.00 175.35 173.77 1et5 s ILE 175 N -3.06 -0.03 0.08 2.17 2.07 -1.26 -1.20 121.20 119.97 1et5 s ILE 175 Ca 0.01 0.12 0.08 0.00 -1.41 0.00 0.00 60.65 59.45 1et5 s ILE 175 Cb 0.02 -0.09 -0.03 0.00 0.13 0.00 0.00 42.46 42.49 1et5 s ILE 175 CO -0.06 0.05 -0.21 -0.31 -1.91 0.00 0.00 174.94 172.50 1et5 s TYR 176 N 0.65 1.80 -0.23 3.50 2.02 -0.72 -4.52 117.35 119.84 1et5 s TYR 176 Ca -0.05 -0.40 0.00 0.00 -0.37 0.00 0.00 57.07 56.25 1et5 s TYR 176 Cb -0.08 -1.02 0.03 0.00 -0.40 0.00 0.00 41.96 40.50 1et5 s TYR 176 CO -0.02 0.16 -0.11 -0.47 -1.57 0.00 0.00 175.55 173.54 1et5 s TYR 177 N -1.02 3.02 -0.32 2.71 5.04 0.96 -1.30 117.35 126.43 1et5 s TYR 177 Ca 0.07 -1.74 -0.08 0.00 -2.44 0.00 0.00 57.07 52.88 1et5 s TYR 177 Cb -0.10 -1.99 0.02 0.00 0.35 0.00 0.00 41.96 40.25 1et5 s TYR 177 CO 0.03 -0.78 0.12 0.08 -1.34 0.00 0.00 175.55 173.66 1et5 s VAL 178 N 1.27 4.09 -0.27 3.14 1.01 0.33 -4.17 120.40 125.79 1et5 s VAL 178 Ca -0.00 -0.83 -0.11 0.00 0.00 0.00 0.00 61.98 61.03 1et5 s VAL 178 Cb -0.16 -3.20 -0.05 0.00 0.00 0.00 0.00 36.38 32.97 1et5 s VAL 178 CO -0.07 -0.06 0.20 -0.83 0.00 0.00 0.00 175.10 174.34 1et5 s GLY 179 N 1.49 1.93 -0.14 4.51 0.00 -1.26 -2.39 107.32 111.46 1et5 s GLY 179 Ca 0.01 -1.04 -0.14 0.00 0.00 0.00 0.00 44.72 43.55 1et5 s GLY 179 CO 0.04 0.64 0.31 1.85 0.00 0.00 0.00 173.10 175.94 1et5 s GLU 180 N 1.69 4.20 -0.08 2.90 2.12 -0.32 -2.09 118.70 127.12 1et5 s GLU 180 Ca 0.08 0.14 0.03 0.00 0.36 0.00 0.00 54.97 55.57 1et5 s GLU 180 Cb -0.16 -3.40 0.01 0.00 0.26 0.00 0.00 34.13 30.84 1et5 s GLU 180 CO 0.10 0.29 -0.16 -1.14 -0.54 0.00 0.00 175.26 173.82 1et5 s GLN 181 N 0.29 2.15 -0.25 4.30 2.00 0.34 -4.52 119.66 123.97 1et5 s GLN 181 Ca 0.18 -0.56 -0.12 0.00 -2.00 0.00 0.00 55.36 52.86 1et5 s GLN 181 Cb -0.13 -1.74 -0.05 0.00 0.80 0.00 0.00 33.01 31.89 1et5 s GLN 181 CO 0.05 0.04 0.23 0.16 -0.50 0.00 0.00 175.29 175.27 1et5 s ASP 182 N 0.67 6.14 0.13 6.67 3.84 -1.26 -1.30 116.67 131.56 1et5 s ASP 182 Ca -0.14 0.15 0.07 0.00 -0.00 0.00 0.00 52.55 52.63 1et5 s ASP 182 Cb -0.16 -2.14 -0.04 0.00 -1.38 0.00 0.00 42.92 39.20 1et5 s ASP 182 CO 0.04 -0.02 -0.05 -0.36 -0.00 0.00 0.00 175.17 174.77 1et5 s PHE 183 N 1.45 2.81 -0.48 2.11 0.08 -0.31 -4.75 117.98 118.90 1et5 s PHE 183 Ca 0.10 -0.13 0.03 0.00 0.12 0.00 0.00 56.93 57.05 1et5 s PHE 183 Cb -0.15 -1.43 0.15 0.00 -0.57 0.00 0.00 43.02 41.02 1et5 s PHE 183 CO 0.08 0.47 0.29 0.71 -0.10 0.00 0.00 175.22 176.67 1et5 s TYR 184 N -1.42 2.14 -0.21 0.36 1.51 -1.26 -1.08 117.35 117.40 1et5 s TYR 184 Ca 0.24 -2.57 -0.16 0.00 -1.01 0.00 0.00 57.07 53.57 1et5 s TYR 184 Cb -0.11 -1.90 -0.04 0.00 -0.11 0.00 0.00 41.96 39.81 1et5 s TYR 184 CO 0.16 -0.75 0.42 0.08 -1.11 0.00 0.00 175.55 174.36 1et5 s VAL 185 N 0.01 5.18 0.49 0.71 1.01 -1.26 -4.80 120.40 121.74 1et5 s VAL 185 Ca 0.21 0.75 -0.23 0.00 0.00 0.00 0.00 61.98 62.71 1et5 s VAL 185 Cb -0.17 -3.75 -0.07 0.00 0.00 0.00 0.00 36.38 32.39 1et5 s VAL 185 CO -0.05 0.23 1.28 -2.84 0.00 0.00 0.00 175.10 173.71 1et5 s PRO 186 N 1.44 3.52 -0.05 2.72 0.02 -1.26 -4.90 135.00 136.49 1et5 s PRO 186 Ca 0.20 2.05 0.06 0.00 0.02 0.00 0.00 61.00 63.34 1et5 s PRO 186 Cb -0.15 -2.41 -0.01 0.00 0.02 0.00 0.00 34.50 31.95 1et5 s PRO 186 CO 0.08 -0.82 -0.25 1.03 -0.33 0.00 0.00 177.00 176.71 1et5 s ARG 187 N -2.71 2.48 0.69 5.54 0.52 -1.26 -1.14 118.95 123.07 1et5 s ARG 187 Ca 0.66 -0.91 -0.12 0.00 -0.52 0.00 0.00 55.73 54.84 1et5 s ARG 187 Cb -0.36 -2.14 0.17 0.00 0.52 0.00 0.00 34.95 33.14 1et5 s ARG 187 CO 0.43 0.41 0.60 -0.40 0.02 0.00 0.00 175.30 176.36 1et5 n ASP 188 N 2.85 -1.72 0.07 0.23 5.68 -0.25 -4.82 116.55 118.60 1et5 n ASP 188 Ca -0.17 -0.84 0.07 0.00 -0.50 0.00 0.00 54.79 53.35 1et5 n ASP 188 Cb 0.52 -0.56 0.33 0.00 -1.14 0.00 0.00 41.12 40.27 1et5 n ASP 188 CO 0.00 0.00 0.00 -1.84 -1.33 0.00 0.00 177.20 174.03 1et5 n GLU 189 N -3.41 0.08 -0.15 0.11 0.28 -1.26 -2.18 120.64 114.11 1et5 n GLU 189 Ca 0.08 0.48 0.07 0.00 -0.16 0.00 0.00 57.16 57.63 1et5 n GLU 189 Cb 0.33 -1.71 0.15 0.00 1.43 0.00 0.00 31.44 31.64 1et5 n GLU 189 CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06 1et5 n ASN 190 N -1.87 2.86 0.00 -1.84 3.02 -1.26 -4.99 115.26 111.18 1et5 n ASN 190 Ca 0.01 -1.87 0.00 0.00 -0.03 0.00 0.00 54.58 52.68 1et5 n ASN 190 Cb 0.09 -0.20 0.00 0.00 -0.61 0.00 0.00 39.78 39.06 1et5 n ASN 190 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1et5 n GLY 191 N 0.77 3.04 3.78 7.41 0.00 -0.93 -5.05 105.19 114.22 1et5 n GLY 191 Ca 0.13 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.79 1et5 n GLY 191 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1et5 s LYS 192 N -0.65 3.65 0.13 1.61 3.01 -1.26 -4.70 119.74 121.53 1et5 s LYS 192 Ca 0.00 1.54 -0.30 0.00 -1.01 0.00 0.00 55.97 56.19 1et5 s LYS 192 Cb 0.00 -2.14 -0.07 0.00 -1.01 0.00 0.00 37.83 34.61 1et5 s LYS 192 CO 0.00 -0.59 1.18 0.71 0.51 0.00 0.00 175.35 177.15 1et5 s TYR 193 N -1.80 3.47 0.52 3.18 1.51 -1.26 -1.09 117.35 121.88 1et5 s TYR 193 Ca 0.68 1.41 -0.11 0.00 -1.01 0.00 0.00 57.07 58.04 1et5 s TYR 193 Cb -0.22 -3.39 -0.05 0.00 -0.11 0.00 0.00 41.96 38.19 1et5 s TYR 193 CO 0.25 -1.10 0.91 0.15 -1.11 0.00 0.00 175.55 174.66 1et5 s LYS 194 N 0.32 3.70 0.09 -0.62 1.02 -0.29 -4.88 119.74 119.07 1et5 s LYS 194 Ca 0.55 0.62 0.07 0.00 0.02 0.00 0.00 55.97 57.23 1et5 s LYS 194 Cb -0.30 -2.22 -0.03 0.00 -0.52 0.00 0.00 37.83 34.75 1et5 s LYS 194 CO 0.33 -0.32 -0.19 0.15 -0.92 0.00 0.00 175.35 174.40 1et5 s LYS 195 N -4.57 1.02 0.12 1.68 1.02 -1.26 -4.82 119.74 112.93 1et5 s LYS 195 Ca 0.53 -1.09 0.04 0.00 0.02 0.00 0.00 55.97 55.48 1et5 s LYS 195 Cb -0.10 -1.20 -0.04 0.00 -0.52 0.00 0.00 37.83 35.97 1et5 s LYS 195 CO 0.42 0.28 -0.10 0.71 -0.92 0.00 0.00 175.35 175.74 1et5 s TYR 196 N -1.19 1.18 -0.02 3.18 2.02 -1.26 -5.07 117.35 116.19 1et5 s TYR 196 Ca 0.04 -0.70 -0.21 0.00 -0.37 0.00 0.00 57.07 55.83 1et5 s TYR 196 Cb -0.10 -0.62 -0.28 0.00 -0.40 0.00 0.00 41.96 40.56 1et5 s TYR 196 CO 0.04 0.05 0.99 0.93 -1.57 0.00 0.00 175.55 175.98 1et5 h GLU 197 N 3.19 0.34 -5.04 -0.62 3.07 -2.02 -3.47 114.58 110.04 1et5 h GLU 197 Ca -0.37 -0.47 -0.32 0.00 -0.50 0.00 0.00 59.36 57.70 1et5 h GLU 197 Cb 1.19 0.16 -0.16 0.00 -0.84 0.00 0.00 28.75 29.10 1et5 h GLU 197 CO 0.58 1.17 -0.72 0.00 -1.40 0.00 0.00 179.01 178.63 1et5 s ALA 198 N -2.80 1.32 0.16 3.43 0.00 -1.26 -5.06 121.76 117.55 1et5 s ALA 198 Ca -0.13 -1.38 -0.22 0.00 0.00 0.00 0.00 51.96 50.23 1et5 s ALA 198 Cb 0.02 0.04 0.06 0.00 0.00 0.00 0.00 23.12 23.24 1et5 s ALA 198 CO 0.82 -0.07 1.62 -1.35 0.00 0.00 0.00 175.76 176.78 1et5 h PRO 199 N 3.08 -0.21 -0.54 0.00 0.11 -1.94 -1.75 132.00 130.74 1et5 h PRO 199 Ca -0.37 0.01 0.16 0.00 0.11 0.00 0.00 66.00 65.91 1et5 h PRO 199 Cb 1.19 0.05 -0.02 0.00 0.11 0.00 0.00 31.00 32.33 1et5 h PRO 199 CO 0.60 -0.14 0.40 0.78 -0.21 0.00 0.00 178.00 179.42 1et5 h GLY 200 N -0.22 0.00 2.00 -0.55 0.00 -1.99 -1.69 103.07 100.61 1et5 h GLY 200 Ca 0.17 0.00 -0.06 0.00 0.00 0.00 0.00 47.33 47.44 1et5 h GLY 200 CO -0.48 0.00 -0.28 -0.55 0.00 0.00 0.00 176.54 175.23 1et5 h ASP 201 N 0.00 0.00 0.46 0.19 3.45 -1.73 -2.97 116.42 115.82 1et5 h ASP 201 Ca 0.26 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.72 1et5 h ASP 201 Cb 1.05 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.82 1et5 h ASP 201 CO -0.00 0.28 -0.42 0.00 -1.57 0.00 0.00 179.24 177.53 1et5 n ALA 202 N -2.34 3.38 0.08 3.45 0.00 -0.64 -4.57 120.51 119.87 1et5 n ALA 202 Ca -0.01 -0.35 -0.12 0.00 0.00 0.00 0.00 53.44 52.96 1et5 n ALA 202 Cb 0.38 -1.14 -0.07 0.00 0.00 0.00 0.00 19.45 18.62 1et5 n ALA 202 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.50 176.58 1et5 h TYR 203 N 0.27 -1.11 -0.48 0.00 5.03 -1.53 -0.72 116.97 118.43 1et5 h TYR 203 Ca 0.00 0.03 0.09 0.00 2.58 0.00 0.00 58.73 61.43 1et5 h TYR 203 Cb 0.50 0.47 -0.07 0.00 1.55 0.00 0.00 36.73 39.18 1et5 h TYR 203 CO 0.00 -0.43 0.06 1.49 -1.32 0.00 0.00 178.16 177.95 1et5 h GLU 204 N -0.55 0.17 -0.27 1.82 4.81 -1.81 0.06 114.58 118.81 1et5 h GLU 204 Ca -0.01 -0.01 -0.09 0.00 -0.13 0.00 0.00 59.36 59.13 1et5 h GLU 204 Cb 0.55 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.88 1et5 h GLU 204 CO -0.20 0.11 -0.20 -0.44 -0.73 0.00 0.00 179.01 177.55 1et5 h ASP 205 N 0.18 0.49 0.14 1.04 3.45 -1.83 -2.85 116.42 117.04 1et5 h ASP 205 Ca 0.24 -0.15 -0.17 0.00 0.43 0.00 0.00 57.03 57.38 1et5 h ASP 205 Cb 0.34 -0.13 -0.00 0.00 -0.56 0.00 0.00 39.33 38.97 1et5 h ASP 205 CO -0.35 0.70 -0.65 0.74 -1.57 0.00 0.00 179.24 178.11 1et5 h THR 206 N 0.45 1.35 -0.41 0.35 2.02 -0.52 -3.04 112.91 113.11 1et5 h THR 206 Ca 0.07 -1.98 -0.07 0.00 0.77 0.00 0.00 66.41 65.21 1et5 h THR 206 Cb 0.60 1.96 -0.02 0.00 -1.74 0.00 0.00 68.15 68.95 1et5 h THR 206 CO 0.04 0.60 -0.03 0.58 0.37 0.00 0.00 175.52 177.08 1et5 h VAL 207 N 0.35 1.23 -0.57 3.16 2.07 -0.84 -1.52 116.25 120.13 1et5 h VAL 207 Ca -0.02 -0.97 -0.03 0.00 0.82 0.00 0.00 66.70 66.50 1et5 h VAL 207 Cb 1.21 0.95 -0.03 0.00 -1.52 0.00 0.00 31.29 31.91 1et5 h VAL 207 CO 0.12 0.34 0.23 0.50 0.02 0.00 0.00 177.57 178.77 1et5 h LYS 208 N 0.64 0.82 -0.15 1.57 3.64 -1.40 -1.77 116.57 119.92 1et5 h LYS 208 Ca 0.12 -0.12 -0.21 0.00 -1.27 0.00 0.00 60.65 59.17 1et5 h LYS 208 Cb 0.44 -0.15 0.01 0.00 -0.41 0.00 0.00 32.23 32.13 1et5 h LYS 208 CO 0.02 0.68 -0.72 0.28 -2.27 0.00 0.00 179.45 177.43 1et5 h VAL 209 N 0.81 1.29 -0.95 2.00 2.07 -1.40 -3.22 116.25 116.86 1et5 h VAL 209 Ca 0.19 -1.93 0.09 0.00 0.82 0.00 0.00 66.70 65.87 1et5 h VAL 209 Cb 0.16 2.00 -0.07 0.00 -1.52 0.00 0.00 31.29 31.86 1et5 h VAL 209 CO -0.02 0.61 0.59 0.24 0.02 0.00 0.00 177.57 179.01 1et5 h MET 210 N 0.47 0.99 0.00 1.57 2.86 -0.79 -1.64 114.93 118.39 1et5 h MET 210 Ca -0.05 -0.06 0.00 0.00 -2.06 0.00 0.00 59.70 57.53 1et5 h MET 210 Cb 1.35 -0.22 0.00 0.00 0.06 0.00 0.00 31.60 32.79 1et5 h MET 210 CO 0.15 0.65 0.00 0.54 1.06 0.00 0.00 176.91 179.31 1et5 n ARG 211 N -4.60 0.14 0.00 1.72 1.74 -0.71 -1.00 116.66 113.94 1et5 n ARG 211 Ca 0.16 0.52 0.13 0.00 -0.77 0.00 0.00 57.85 57.89 1et5 n ARG 211 Cb 0.25 -1.85 0.46 0.00 -1.02 0.00 0.00 32.46 30.30 1et5 n ARG 211 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 1et5 n THR 212 N -2.13 0.00 -1.56 0.55 -2.24 -0.62 -4.90 114.28 103.39 1et5 n THR 212 Ca 0.00 -0.07 -0.16 0.00 -2.27 0.00 0.00 64.05 61.55 1et5 n THR 212 Cb 0.11 0.13 -0.06 0.00 -2.10 0.00 0.00 70.33 68.41 1et5 n THR 212 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1et5 n LEU 213 N -0.96 -1.19 -4.10 3.22 4.77 -0.17 -4.93 117.00 113.64 1et5 n LEU 213 Ca 0.12 0.37 -0.33 0.00 -0.03 0.00 0.00 56.01 56.13 1et5 n LEU 213 Cb 0.32 -2.32 -0.15 0.00 -2.33 0.00 0.00 43.42 38.94 1et5 n LEU 213 CO 0.27 -0.77 -0.43 -0.89 -1.33 0.00 0.00 177.39 174.23 1et5 s THR 214 N -2.40 2.38 0.53 -5.08 2.01 -1.26 -5.11 115.64 106.71 1et5 s THR 214 Ca 0.00 -1.57 -0.18 0.00 0.31 0.00 0.00 61.69 60.25 1et5 s THR 214 Cb 0.00 -2.39 -0.07 0.00 0.01 0.00 0.00 72.50 70.05 1et5 s THR 214 CO 0.00 -0.05 1.02 -2.16 -0.69 0.00 0.00 174.62 172.74 1et5 s PRO 215 N 1.14 3.71 0.03 4.92 0.04 -1.26 -4.88 135.00 138.69 1et5 s PRO 215 Ca -0.08 1.17 0.15 0.00 0.04 0.00 0.00 61.00 62.28 1et5 s PRO 215 Cb -0.20 -2.09 -0.17 0.00 0.04 0.00 0.00 34.50 32.08 1et5 s PRO 215 CO -0.04 -0.49 0.78 1.79 0.04 0.00 0.00 177.00 179.08 1et5 h THR 216 N 1.01 0.63 -3.85 1.26 1.35 -1.45 -3.47 112.91 108.40 1et5 h THR 216 Ca -0.48 -2.26 -0.19 0.00 -0.55 0.00 0.00 66.41 62.94 1et5 h THR 216 Cb 1.21 2.18 -0.23 0.00 -1.73 0.00 0.00 68.15 69.58 1et5 h THR 216 CO 0.59 0.36 -0.68 -1.00 -0.25 0.00 0.00 175.52 174.54 1et5 s HIS 217 N -2.80 0.15 -0.21 4.73 3.76 -1.17 -4.89 115.29 114.86 1et5 s HIS 217 Ca -0.03 -0.31 -0.04 0.00 -0.15 0.00 0.00 55.06 54.53 1et5 s HIS 217 Cb 0.08 -0.11 0.07 0.00 1.11 0.00 0.00 32.58 33.73 1et5 s HIS 217 CO 0.82 -0.14 0.09 0.08 -0.85 0.00 0.00 174.74 174.74 1et5 s VAL 218 N -0.97 0.07 0.23 -0.90 1.01 -0.93 -1.16 120.40 117.74 1et5 s VAL 218 Ca -0.11 -0.43 0.05 0.00 0.00 0.00 0.00 61.98 61.49 1et5 s VAL 218 Cb -0.07 -0.80 -0.05 0.00 0.00 0.00 0.00 36.38 35.46 1et5 s VAL 218 CO -0.00 -0.39 -0.04 0.68 0.00 0.00 0.00 175.10 175.34 1et5 s VAL 219 N 2.06 1.26 -0.10 2.92 -7.23 -0.42 -0.07 120.40 118.83 1et5 s VAL 219 Ca 0.03 -2.07 -0.03 0.00 -1.81 0.00 0.00 61.98 58.10 1et5 s VAL 219 Cb -0.16 -2.27 -0.03 0.00 0.56 0.00 0.00 36.38 34.47 1et5 s VAL 219 CO -0.16 -0.41 0.02 -0.36 -0.31 0.00 0.00 175.10 173.89 1et5 s PHE 220 N -3.27 3.23 -1.50 2.82 0.08 -1.26 -0.50 117.98 117.58 1et5 s PHE 220 Ca 0.26 0.23 -0.12 0.00 0.12 0.00 0.00 56.93 57.42 1et5 s PHE 220 Cb 0.04 -1.83 0.07 0.00 -0.57 0.00 0.00 43.02 40.74 1et5 s PHE 220 CO 0.08 0.49 0.98 -1.71 -0.10 0.00 0.00 175.22 174.96 1et5 n ASN 221 N 2.19 -4.66 0.00 1.36 5.15 -0.89 -3.17 115.26 115.24 1et5 n ASN 221 Ca -0.19 -0.76 0.00 0.00 -0.60 0.00 0.00 54.58 53.03 1et5 n ASN 221 Cb 0.54 -4.02 0.00 0.00 -0.53 0.00 0.00 39.78 35.77 1et5 n ASN 221 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1et5 n GLY 222 N -1.72 0.27 3.57 8.20 0.00 -0.52 -4.78 105.19 110.21 1et5 n GLY 222 Ca 0.01 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.93 1et5 n GLY 222 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1et5 s ALA 223 N -1.63 -1.92 0.35 4.61 0.00 -1.19 -4.61 121.76 117.36 1et5 s ALA 223 Ca 0.00 1.51 -0.29 0.00 0.00 0.00 0.00 51.96 53.18 1et5 s ALA 223 Cb 0.00 -0.53 -0.11 0.00 0.00 0.00 0.00 23.12 22.48 1et5 s ALA 223 CO 0.00 -0.37 1.40 0.08 0.00 0.00 0.00 175.76 176.87 1et5 s VAL 224 N -1.45 2.39 0.00 0.00 1.01 -0.46 -2.01 120.40 119.89 1et5 s VAL 224 Ca -0.00 0.39 0.00 0.00 0.00 0.00 0.00 61.98 62.37 1et5 s VAL 224 Cb -0.01 -3.25 0.00 0.00 0.00 0.00 0.00 36.38 33.13 1et5 s VAL 224 CO -0.00 0.09 0.00 0.61 0.00 0.00 0.00 175.10 175.80 1et5 n GLY 225 N 0.77 0.44 0.38 4.51 0.00 -1.26 -4.81 105.19 105.22 1et5 n GLY 225 Ca 0.01 0.00 0.16 0.00 0.00 0.00 0.00 46.02 46.19 1et5 n GLY 225 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1et5 h ALA 226 N 0.00 1.99 -0.77 4.61 0.00 -1.64 -2.21 119.26 121.24 1et5 h ALA 226 Ca 0.00 0.03 -0.55 0.00 0.00 0.00 0.00 54.91 54.39 1et5 h ALA 226 Cb 0.12 -0.07 -0.39 0.00 0.00 0.00 0.00 17.79 17.45 1et5 h ALA 226 CO 0.00 -0.28 -0.49 1.28 0.00 0.00 0.00 179.25 179.76 1et5 n LEU 227 N -4.58 5.35 -4.53 0.00 4.77 -1.26 -4.75 117.00 112.01 1et5 n LEU 227 Ca 0.20 -4.63 -0.24 0.00 -0.03 0.00 0.00 56.01 51.31 1et5 n LEU 227 Cb 0.61 -0.47 -0.11 0.00 -2.33 0.00 0.00 43.42 41.13 1et5 n LEU 227 CO 0.28 1.96 -0.28 0.42 -1.33 0.00 0.00 177.39 178.44 1et5 s THR 228 N -4.57 1.58 0.00 -5.08 -4.23 -0.83 -0.65 115.64 101.85 1et5 s THR 228 Ca 0.53 -2.01 0.00 0.00 -1.18 0.00 0.00 61.69 59.03 1et5 s THR 228 Cb 0.43 -2.87 0.00 0.00 1.34 0.00 0.00 72.50 71.39 1et5 s THR 228 CO 0.03 -0.01 0.00 0.61 -0.54 0.00 0.00 174.62 174.70 1et5 n GLY 229 N -0.81 4.27 0.00 3.99 0.00 -1.26 -1.65 105.19 109.73 1et5 n GLY 229 Ca -0.04 0.17 0.13 0.00 0.00 0.00 0.00 46.02 46.29 1et5 n GLY 229 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1et5 n ASP 230 N 8.60 0.00 -1.08 1.61 10.43 -1.26 -2.88 116.55 131.97 1et5 n ASP 230 Ca 0.00 0.12 0.08 0.00 2.57 0.00 0.00 54.79 57.56 1et5 n ASP 230 Cb 0.00 -0.37 0.29 0.00 1.84 0.00 0.00 41.12 42.88 1et5 n ASP 230 CO 0.00 0.00 0.00 0.29 -1.07 0.00 0.00 177.20 176.42 1et5 n LYS 231 N -1.37 3.30 -2.01 -1.24 5.02 -0.66 -5.00 118.16 116.21 1et5 n LYS 231 Ca 0.10 -2.89 -0.37 0.00 -2.02 0.00 0.00 58.31 53.14 1et5 n LYS 231 Cb 0.25 -1.91 0.03 0.00 -0.02 0.00 0.00 35.03 33.38 1et5 n LYS 231 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1et5 s ALA 232 N -2.76 2.70 0.54 7.82 0.00 -1.14 -4.26 121.76 124.66 1et5 s ALA 232 Ca 0.44 1.08 -0.17 0.00 0.00 0.00 0.00 51.96 53.31 1et5 s ALA 232 Cb 0.35 -3.47 -0.07 0.00 0.00 0.00 0.00 23.12 19.94 1et5 s ALA 232 CO 0.10 -1.11 1.01 -1.64 0.00 0.00 0.00 175.76 174.13 1et5 s MET 233 N -3.09 3.72 0.18 0.00 -1.94 -0.46 -4.83 119.30 112.90 1et5 s MET 233 Ca 0.73 1.09 0.09 0.00 -1.71 0.00 0.00 55.69 55.89 1et5 s MET 233 Cb -0.33 -2.10 -0.04 0.00 2.01 0.00 0.00 34.83 34.37 1et5 s MET 233 CO 0.37 -0.47 -0.18 0.95 -0.01 0.00 0.00 175.02 175.68 1et5 s THR 234 N -2.47 1.89 0.33 2.05 -4.23 -1.26 -0.85 115.64 111.09 1et5 s THR 234 Ca 0.62 -2.03 -0.18 0.00 -1.18 0.00 0.00 61.69 58.92 1et5 s THR 234 Cb -0.13 -1.94 0.05 0.00 1.34 0.00 0.00 72.50 71.83 1et5 s THR 234 CO 0.31 -0.37 0.83 0.00 -0.54 0.00 0.00 174.62 174.85 1et5 s ALA 235 N -2.26 -0.99 0.06 3.99 0.00 -1.03 -4.94 121.76 116.60 1et5 s ALA 235 Ca 0.19 -0.58 0.01 0.00 0.00 0.00 0.00 51.96 51.58 1et5 s ALA 235 Cb -0.05 0.71 -0.03 0.00 0.00 0.00 0.00 23.12 23.75 1et5 s ALA 235 CO 0.08 -1.01 -0.06 0.00 0.00 0.00 0.00 175.76 174.76 1et5 s ALA 236 N -2.59 0.69 0.30 0.00 0.00 -1.26 -2.52 121.76 116.39 1et5 s ALA 236 Ca 0.16 -1.05 -0.30 0.00 0.00 0.00 0.00 51.96 50.77 1et5 s ALA 236 Cb -0.05 0.13 -0.12 0.00 0.00 0.00 0.00 23.12 23.08 1et5 s ALA 236 CO 0.09 -0.16 1.50 0.28 0.00 0.00 0.00 175.76 177.47 1et5 n VAL 237 N 0.68 1.29 0.00 0.00 0.31 -0.05 -1.26 118.33 119.30 1et5 n VAL 237 Ca -0.17 -0.32 0.00 0.00 -0.01 0.00 0.00 64.34 63.83 1et5 n VAL 237 Cb 0.58 -1.81 0.00 0.00 -0.91 0.00 0.00 33.84 31.70 1et5 n VAL 237 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1et5 n GLY 238 N 1.71 3.38 3.76 2.92 0.00 0.22 -4.99 105.19 112.19 1et5 n GLY 238 Ca 0.08 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.71 1et5 n GLY 238 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1et5 s GLU 239 N -0.77 4.66 -0.28 1.61 2.02 -0.39 -4.80 118.70 120.75 1et5 s GLU 239 Ca 0.00 1.53 -0.12 0.00 0.02 0.00 0.00 54.97 56.40 1et5 s GLU 239 Cb 0.00 -3.06 -0.04 0.00 0.10 0.00 0.00 34.13 31.13 1et5 s GLU 239 CO 0.00 0.31 0.25 0.15 0.02 0.00 0.00 175.26 175.99 1et5 s LYS 240 N -1.60 3.92 -0.07 1.61 1.02 -1.26 -2.09 119.74 121.27 1et5 s LYS 240 Ca 0.46 -0.25 0.04 0.00 0.02 0.00 0.00 55.97 56.25 1et5 s LYS 240 Cb -0.25 -3.67 -0.01 0.00 -0.52 0.00 0.00 37.83 33.37 1et5 s LYS 240 CO 0.32 -0.24 -0.20 0.08 -0.92 0.00 0.00 175.35 174.39 1et5 s VAL 241 N 1.85 2.48 -0.22 3.17 1.01 0.50 0.15 120.40 129.34 1et5 s VAL 241 Ca 0.09 -0.91 -0.06 0.00 0.00 0.00 0.00 61.98 61.10 1et5 s VAL 241 Cb -0.16 -1.95 -0.03 0.00 0.00 0.00 0.00 36.38 34.24 1et5 s VAL 241 CO 0.11 0.57 0.04 -0.22 0.00 0.00 0.00 175.10 175.59 1et5 s LEU 242 N -0.20 3.42 -0.32 3.92 2.96 -0.34 -1.39 118.68 126.73 1et5 s LEU 242 Ca -0.02 -0.16 -0.05 0.00 -0.22 0.00 0.00 54.13 53.68 1et5 s LEU 242 Cb -0.13 -1.89 0.04 0.00 0.50 0.00 0.00 46.19 44.71 1et5 s LEU 242 CO 0.03 0.04 0.07 -0.63 -1.32 0.00 0.00 176.35 174.54 1et5 s ILE 243 N 1.18 3.57 -0.08 6.68 1.01 0.80 -1.75 121.20 132.60 1et5 s ILE 243 Ca 0.04 -1.16 -0.18 0.00 0.00 0.00 0.00 60.65 59.35 1et5 s ILE 243 Cb -0.14 -3.01 -0.05 0.00 0.01 0.00 0.00 42.46 39.27 1et5 s ILE 243 CO 0.02 -0.13 0.47 -0.69 0.00 0.00 0.00 174.94 174.61 1et5 s VAL 244 N 1.37 5.12 -0.04 2.92 1.01 -0.42 -1.15 120.40 129.21 1et5 s VAL 244 Ca -0.02 0.95 0.02 0.00 0.00 0.00 0.00 61.98 62.93 1et5 s VAL 244 Cb -0.19 -3.80 0.01 0.00 0.00 0.00 0.00 36.38 32.40 1et5 s VAL 244 CO 0.02 0.39 -0.07 -2.28 0.00 0.00 0.00 175.10 173.15 1et5 s HIS 245 N 0.18 0.91 0.08 5.22 2.46 -0.22 -0.52 115.29 123.40 1et5 s HIS 245 Ca 0.26 -0.26 0.03 0.00 0.47 0.00 0.00 55.06 55.56 1et5 s HIS 245 Cb -0.16 -0.71 -0.03 0.00 -0.13 0.00 0.00 32.58 31.55 1et5 s HIS 245 CO 0.11 -0.16 -0.09 -1.54 -2.47 0.00 0.00 174.74 170.60 1et5 s SER 246 N 0.56 1.22 -0.24 9.88 1.04 -1.01 -0.12 113.70 125.03 1et5 s SER 246 Ca -0.09 -0.78 -0.02 0.00 0.48 0.00 0.00 55.95 55.54 1et5 s SER 246 Cb -0.12 0.04 0.13 0.00 0.10 0.00 0.00 66.02 66.16 1et5 s SER 246 CO 0.01 -0.29 0.33 -1.58 0.98 0.00 0.00 173.24 172.69 1et5 s GLN 247 N -2.67 0.31 0.00 4.02 -0.44 -0.89 -1.17 119.66 118.81 1et5 s GLN 247 Ca 0.02 0.31 0.23 0.00 -2.50 0.00 0.00 55.36 53.43 1et5 s GLN 247 Cb -0.03 -0.68 1.05 0.00 -1.64 0.00 0.00 33.01 31.70 1et5 s GLN 247 CO -0.01 -0.74 1.75 0.00 0.50 0.00 0.00 175.29 176.79 1et5 n ALA 248 N 5.34 2.10 0.00 1.58 0.00 -1.26 0.08 120.51 128.36 1et5 n ALA 248 Ca -0.03 -0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.32 1et5 n ALA 248 Cb 0.49 -1.38 0.00 0.00 0.00 0.00 0.00 19.45 18.57 1et5 n ALA 248 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1et5 n ASN 249 N -1.43 0.33 -4.01 0.00 5.15 -1.26 -3.42 115.26 110.62 1et5 n ASN 249 Ca 0.07 0.00 -0.09 0.00 -0.60 0.00 0.00 54.58 53.97 1et5 n ASN 249 Cb 0.24 0.05 -0.11 0.00 -0.53 0.00 0.00 39.78 39.44 1et5 n ASN 249 CO 0.00 0.00 0.00 -0.60 1.40 0.00 0.00 177.26 178.06 1et5 s ARG 250 N -0.59 0.39 0.63 1.20 3.52 -1.26 -4.66 118.95 118.17 1et5 s ARG 250 Ca 0.00 -0.75 -0.18 0.00 -0.13 0.00 0.00 55.73 54.68 1et5 s ARG 250 Cb 0.00 0.11 -0.02 0.00 -1.56 0.00 0.00 34.95 33.48 1et5 s ARG 250 CO 0.00 -0.06 1.20 -0.51 -0.81 0.00 0.00 175.30 175.13 1et5 s ASP 251 N -1.78 4.95 0.13 -2.12 -0.00 -1.26 -3.52 116.67 113.07 1et5 s ASP 251 Ca -0.11 2.36 -0.10 0.00 -0.00 0.00 0.00 52.55 54.71 1et5 s ASP 251 Cb -0.06 -2.59 -0.00 0.00 -0.00 0.00 0.00 42.92 40.26 1et5 s ASP 251 CO -0.03 -1.76 0.26 0.28 -0.00 0.00 0.00 175.17 173.93 1et5 s THR 252 N -1.72 0.10 -0.40 -1.27 -1.32 -0.54 -4.88 115.64 105.61 1et5 s THR 252 Ca 0.76 -1.22 0.03 0.00 -1.21 0.00 0.00 61.69 60.06 1et5 s THR 252 Cb -0.30 -1.58 0.16 0.00 -1.51 0.00 0.00 72.50 69.28 1et5 s THR 252 CO 0.37 -0.43 0.32 0.00 -2.21 0.00 0.00 174.62 172.66 1et5 s ARG 253 N -3.91 0.81 0.56 7.08 1.70 -1.26 -1.20 118.95 122.73 1et5 s ARG 253 Ca 0.11 -1.84 -0.21 0.00 -0.47 0.00 0.00 55.73 53.32 1et5 s ARG 253 Cb 0.04 -1.32 -0.04 0.00 -0.57 0.00 0.00 34.95 33.06 1et5 s ARG 253 CO -0.05 -1.34 1.33 -2.14 -1.08 0.00 0.00 175.30 172.02 1et5 s PRO 254 N 0.39 3.07 -0.16 3.89 0.02 -0.94 0.34 135.00 141.60 1et5 s PRO 254 Ca 0.29 2.15 -0.12 0.00 0.02 0.00 0.00 61.00 63.34 1et5 s PRO 254 Cb -0.04 -2.18 0.05 0.00 0.02 0.00 0.00 34.50 32.36 1et5 s PRO 254 CO -0.14 -1.22 0.41 -1.58 -0.33 0.00 0.00 177.00 174.14 1et5 s HIS 255 N -1.35 -0.51 -0.39 6.54 2.46 0.72 -1.74 115.29 121.01 1et5 s HIS 255 Ca 0.73 1.17 -0.11 0.00 0.47 0.00 0.00 55.06 57.33 1et5 s HIS 255 Cb -0.39 0.20 0.04 0.00 -0.13 0.00 0.00 32.58 32.30 1et5 s HIS 255 CO 0.45 -0.27 0.24 -1.17 -2.47 0.00 0.00 174.74 171.52 1et5 s LEU 256 N 0.67 4.91 -0.15 8.88 2.96 -1.26 -0.56 118.68 134.12 1et5 s LEU 256 Ca -0.04 -1.15 -0.29 0.00 -0.22 0.00 0.00 54.13 52.43 1et5 s LEU 256 Cb -0.05 -2.03 -0.04 0.00 0.50 0.00 0.00 46.19 44.57 1et5 s LEU 256 CO -0.05 -0.45 1.61 -0.63 -1.32 0.00 0.00 176.35 175.52 1et5 s ILE 257 N 1.53 3.69 0.00 6.68 1.01 0.12 -1.07 121.20 133.16 1et5 s ILE 257 Ca 0.02 0.81 0.00 0.00 0.00 0.00 0.00 60.65 61.48 1et5 s ILE 257 Cb -0.21 -3.62 0.00 0.00 0.01 0.00 0.00 42.46 38.64 1et5 s ILE 257 CO 0.06 -0.19 0.00 0.61 0.00 0.00 0.00 174.94 175.42 1et5 n GLY 258 N 4.39 0.52 0.00 6.18 0.00 -1.26 -3.75 105.19 111.27 1et5 n GLY 258 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.20 1et5 n GLY 258 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1et5 n GLY 259 N -2.00 5.96 3.69 -0.02 0.00 -0.23 -5.01 105.19 107.57 1et5 n GLY 259 Ca 0.00 -1.58 -0.10 0.00 0.00 0.00 0.00 46.02 44.33 1et5 n GLY 259 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1et5 s HIS 260 N 0.03 0.40 -0.49 1.61 0.09 -1.26 -4.73 115.29 110.95 1et5 s HIS 260 Ca 0.00 -0.87 -0.06 0.00 -0.00 0.00 0.00 55.06 54.12 1et5 s HIS 260 Cb 0.00 0.45 0.13 0.00 -0.00 0.00 0.00 32.58 33.16 1et5 s HIS 260 CO 0.00 -1.32 0.33 0.20 -0.00 0.00 0.00 174.74 173.95 1et5 s GLY 261 N -3.09 2.11 0.17 -2.22 0.00 0.04 -4.77 107.32 99.56 1et5 s GLY 261 Ca 0.20 -2.67 -0.14 0.00 0.00 0.00 0.00 44.72 42.11 1et5 s GLY 261 CO 0.13 1.09 1.78 -0.55 0.00 0.00 0.00 173.10 175.55 1et5 h ASP 262 N 8.09 0.33 -3.40 1.64 3.32 -1.48 -1.14 116.42 123.77 1et5 h ASP 262 Ca -0.14 0.02 -0.43 0.00 0.02 0.00 0.00 57.03 56.50 1et5 h ASP 262 Cb 1.05 -0.04 -0.35 0.00 0.22 0.00 0.00 39.33 40.21 1et5 h ASP 262 CO 0.78 0.23 -0.78 -0.31 -1.72 0.00 0.00 179.24 177.45 1et5 s TYR 263 N -6.14 0.83 -0.08 4.55 1.51 -1.01 -1.87 117.35 115.14 1et5 s TYR 263 Ca -0.13 -0.26 -0.01 0.00 -1.01 0.00 0.00 57.07 55.66 1et5 s TYR 263 Cb 0.13 -0.76 0.03 0.00 -0.11 0.00 0.00 41.96 41.25 1et5 s TYR 263 CO 0.73 -0.24 -0.03 0.08 -1.11 0.00 0.00 175.55 174.97 1et5 s VAL 264 N 1.14 0.62 -0.96 0.71 1.01 0.58 -0.09 120.40 123.41 1et5 s VAL 264 Ca -0.07 -0.04 -0.15 0.00 0.00 0.00 0.00 61.98 61.72 1et5 s VAL 264 Cb -0.14 -0.72 0.19 0.00 0.00 0.00 0.00 36.38 35.71 1et5 s VAL 264 CO -0.01 0.30 1.04 0.26 0.00 0.00 0.00 175.10 176.69 1et5 s TRP 265 N 1.81 3.59 0.36 5.22 0.51 -0.43 -0.17 118.94 129.82 1et5 s TRP 265 Ca 0.04 -1.92 0.07 0.00 -2.12 0.00 0.00 56.10 52.17 1et5 s TRP 265 Cb -0.12 -4.05 0.69 0.00 -0.81 0.00 0.00 33.47 29.17 1et5 s TRP 265 CO -0.06 -1.21 1.89 0.00 -0.51 0.00 0.00 176.95 177.06 1et5 h ALA 266 N 7.87 1.43 0.00 0.98 0.00 -1.89 -1.58 119.26 126.08 1et5 h ALA 266 Ca 0.17 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1et5 h ALA 266 Cb 0.98 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.65 1et5 h ALA 266 CO 0.99 0.40 -0.20 0.25 0.00 0.00 0.00 179.25 180.69 1et5 n THR 267 N -4.28 0.18 -1.00 0.00 -2.24 -1.26 -4.52 114.28 101.16 1et5 n THR 267 Ca 0.00 -0.10 0.00 0.00 -2.27 0.00 0.00 64.05 61.68 1et5 n THR 267 Cb 0.25 -0.31 0.00 0.00 -2.10 0.00 0.00 70.33 68.18 1et5 n THR 267 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1et5 n GLY 268 N 1.43 0.40 3.35 3.38 0.00 -0.65 -4.69 105.19 108.41 1et5 n GLY 268 Ca 0.06 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.72 1et5 n GLY 268 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1et5 s LYS 269 N -0.42 3.47 0.52 1.61 -0.14 -1.26 0.31 119.74 123.82 1et5 s LYS 269 Ca 0.00 -0.58 0.35 0.00 -1.36 0.00 0.00 55.97 54.38 1et5 s LYS 269 Cb 0.00 -3.11 1.70 0.00 -1.68 0.00 0.00 37.83 34.74 1et5 s LYS 269 CO 0.00 -0.19 2.04 0.74 -0.76 0.00 0.00 175.35 177.18 1et5 h PHE 270 N 8.14 0.00 -0.00 3.18 0.05 -1.84 -1.72 116.94 124.75 1et5 h PHE 270 Ca -0.40 0.00 0.00 0.00 3.82 0.00 0.00 57.97 61.39 1et5 h PHE 270 Cb 1.17 0.00 0.00 0.00 2.00 0.00 0.00 35.95 39.12 1et5 h PHE 270 CO 0.61 0.00 -0.16 0.09 -0.18 0.00 0.00 178.31 178.68 1et5 n ASN 271 N -2.83 0.35 -4.63 2.17 3.02 -1.26 -4.64 115.26 107.44 1et5 n ASN 271 Ca -0.01 -0.23 -0.38 0.00 -0.03 0.00 0.00 54.58 53.93 1et5 n ASN 271 Cb 0.16 -0.12 -0.10 0.00 -0.61 0.00 0.00 39.78 39.11 1et5 n ASN 271 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1et5 s THR 272 N -2.71 5.27 0.38 3.41 2.01 -0.65 -5.05 115.64 118.31 1et5 s THR 272 Ca 0.22 0.36 -0.26 0.00 0.31 0.00 0.00 61.69 62.31 1et5 s THR 272 Cb 0.19 -3.59 -0.11 0.00 0.01 0.00 0.00 72.50 69.00 1et5 s THR 272 CO 0.53 0.26 1.14 -2.65 -0.69 0.00 0.00 174.62 173.21 1et5 n PRO 273 N 4.81 1.67 -2.47 4.92 -0.02 -1.26 -4.87 135.00 137.79 1et5 n PRO 273 Ca -0.12 0.59 -0.33 0.00 -2.02 0.00 0.00 63.50 61.62 1et5 n PRO 273 Cb 0.52 -2.16 -0.03 0.00 -0.02 0.00 0.00 33.50 31.80 1et5 n PRO 273 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 1et5 s PRO 274 N -1.97 3.79 0.56 0.52 0.04 -1.26 -4.95 135.00 131.73 1et5 s PRO 274 Ca 0.60 1.24 -0.14 0.00 0.04 0.00 0.00 61.00 62.74 1et5 s PRO 274 Cb -0.57 -2.10 -0.06 0.00 0.04 0.00 0.00 34.50 31.81 1et5 s PRO 274 CO 0.59 -0.42 1.00 -0.51 0.04 0.00 0.00 177.00 177.69 1et5 s ASP 275 N -2.32 6.44 0.17 6.66 1.01 0.76 -4.76 116.67 124.62 1et5 s ASP 275 Ca 0.65 1.48 0.07 0.00 0.71 0.00 0.00 52.55 55.45 1et5 s ASP 275 Cb -0.14 -2.48 -0.04 0.00 1.01 0.00 0.00 42.92 41.26 1et5 s ASP 275 CO 0.24 -0.71 -0.14 0.68 0.21 0.00 0.00 175.17 175.45 1et5 s VAL 276 N -2.87 1.57 -1.52 -1.27 -7.23 -1.26 -0.31 120.40 107.51 1et5 s VAL 276 Ca 0.57 -2.05 -0.00 0.00 -1.81 0.00 0.00 61.98 58.68 1et5 s VAL 276 Cb -0.10 -1.88 0.00 0.00 0.56 0.00 0.00 36.38 34.95 1et5 s VAL 276 CO 0.42 -0.55 0.03 0.47 -0.31 0.00 0.00 175.10 175.15 1et5 n ASP 277 N -0.08 -5.20 -4.76 4.85 10.43 -0.78 -4.94 116.55 116.07 1et5 n ASP 277 Ca -0.10 0.04 -0.41 0.00 2.57 0.00 0.00 54.79 56.89 1et5 n ASP 277 Cb 0.59 -4.35 -0.02 0.00 1.84 0.00 0.00 41.12 39.19 1et5 n ASP 277 CO 0.00 0.00 0.00 -1.10 -1.07 0.00 0.00 177.20 175.03 1et5 s GLN 278 N -5.07 4.33 -0.18 -1.24 -1.52 -0.45 -4.80 119.66 110.72 1et5 s GLN 278 Ca 0.01 2.24 -0.13 0.00 -1.95 0.00 0.00 55.36 55.54 1et5 s GLN 278 Cb -0.01 -3.08 -0.21 0.00 -0.22 0.00 0.00 33.01 29.49 1et5 s GLN 278 CO 0.02 -0.25 0.18 -0.85 -0.25 0.00 0.00 175.29 174.13 1et5 n GLU 279 N 1.15 0.66 -3.76 2.91 0.28 -1.26 -0.78 120.64 119.83 1et5 n GLU 279 Ca 0.02 0.38 -0.14 0.00 -0.16 0.00 0.00 57.16 57.25 1et5 n GLU 279 Cb 0.41 -1.68 -0.15 0.00 1.43 0.00 0.00 31.44 31.45 1et5 n GLU 279 CO 0.00 0.00 0.00 0.99 -0.16 0.00 0.00 177.13 177.96 1et5 s THR 280 N -2.47 -0.05 0.35 3.84 2.01 -1.26 -4.38 115.64 113.67 1et5 s THR 280 Ca -0.28 0.18 0.08 0.00 0.31 0.00 0.00 61.69 61.99 1et5 s THR 280 Cb 0.07 -0.17 -0.05 0.00 0.01 0.00 0.00 72.50 72.36 1et5 s THR 280 CO 0.65 0.08 0.09 -1.66 -0.69 0.00 0.00 174.62 173.09 1et5 s TRP 281 N 1.06 2.61 -0.10 4.92 -2.14 -0.71 -4.99 118.94 119.60 1et5 s TRP 281 Ca -0.08 -0.45 0.04 0.00 2.66 0.00 0.00 56.10 58.27 1et5 s TRP 281 Cb -0.11 -1.63 0.00 0.00 -3.10 0.00 0.00 33.47 28.63 1et5 s TRP 281 CO -0.04 0.38 -0.23 0.12 -2.66 0.00 0.00 176.95 174.51 1et5 s PHE 282 N -2.50 2.50 -0.22 1.66 5.36 -1.26 -2.23 117.98 121.29 1et5 s PHE 282 Ca 0.37 -1.06 0.02 0.00 -0.96 0.00 0.00 56.93 55.30 1et5 s PHE 282 Cb -0.00 -1.68 0.05 0.00 -0.34 0.00 0.00 43.02 41.04 1et5 s PHE 282 CO 0.21 -0.44 -0.12 0.42 -1.46 0.00 0.00 175.22 173.84 1et5 s ILE 283 N 0.43 1.91 0.59 3.12 1.01 -0.34 -4.74 121.20 123.17 1et5 s ILE 283 Ca -0.17 -1.26 -0.17 0.00 0.00 0.00 0.00 60.65 59.05 1et5 s ILE 283 Cb -0.18 -1.96 -0.04 0.00 0.01 0.00 0.00 42.46 40.29 1et5 s ILE 283 CO 0.07 0.13 1.10 -2.16 0.00 0.00 0.00 174.94 174.08 1et5 s PRO 284 N 1.26 3.21 0.28 2.79 0.04 -1.26 -1.46 135.00 139.86 1et5 s PRO 284 Ca -0.04 1.43 -0.30 0.00 0.04 0.00 0.00 61.00 62.13 1et5 s PRO 284 Cb -0.17 -2.00 -0.12 0.00 0.04 0.00 0.00 34.50 32.25 1et5 s PRO 284 CO -0.08 -0.93 1.59 0.41 0.04 0.00 0.00 177.00 178.04 1et5 n GLY 285 N -0.35 1.31 0.27 0.56 0.00 -1.23 -2.05 105.19 103.70 1et5 n GLY 285 Ca 0.10 0.48 0.00 0.00 0.00 0.00 0.00 46.02 46.61 1et5 n GLY 285 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1et5 n GLY 286 N 2.36 0.93 3.14 -0.02 0.00 0.11 -4.77 105.19 106.95 1et5 n GLY 286 Ca 0.10 -0.05 -0.09 0.00 0.00 0.00 0.00 46.02 45.98 1et5 n GLY 286 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1et5 s ALA 287 N -2.00 0.71 0.13 4.61 0.00 -0.87 -4.76 121.76 119.58 1et5 s ALA 287 Ca 0.00 -1.36 0.10 0.00 0.00 0.00 0.00 51.96 50.70 1et5 s ALA 287 Cb 0.00 0.71 -0.04 0.00 0.00 0.00 0.00 23.12 23.79 1et5 s ALA 287 CO 0.00 -0.47 -0.24 0.00 0.00 0.00 0.00 175.76 175.05 1et5 s ALA 288 N -4.01 2.17 0.25 0.00 0.00 -1.26 -2.10 121.76 116.81 1et5 s ALA 288 Ca 0.19 -1.41 0.01 0.00 0.00 0.00 0.00 51.96 50.76 1et5 s ALA 288 Cb 0.07 -0.32 -0.04 0.00 0.00 0.00 0.00 23.12 22.84 1et5 s ALA 288 CO -0.02 0.45 0.14 0.20 0.00 0.00 0.00 175.76 176.54 1et5 s GLY 289 N -2.10 1.73 -0.05 0.00 0.00 0.83 -3.21 107.32 104.53 1et5 s GLY 289 Ca 0.12 -1.79 -0.07 0.00 0.00 0.00 0.00 44.72 42.98 1et5 s GLY 289 CO 0.06 -1.49 0.17 0.00 0.00 0.00 0.00 173.10 171.84 1et5 s ALA 290 N -3.89 -0.43 -0.03 3.20 0.00 -0.85 -1.06 121.76 118.70 1et5 s ALA 290 Ca 0.38 0.32 0.04 0.00 0.00 0.00 0.00 51.96 52.70 1et5 s ALA 290 Cb 0.06 -0.17 -0.00 0.00 0.00 0.00 0.00 23.12 23.01 1et5 s ALA 290 CO 0.15 -0.13 -0.15 0.00 0.00 0.00 0.00 175.76 175.64 1et5 s ALA 291 N -0.38 1.30 -0.13 0.00 0.00 -0.30 -1.31 121.76 120.92 1et5 s ALA 291 Ca -0.05 -0.58 -0.02 0.00 0.00 0.00 0.00 51.96 51.31 1et5 s ALA 291 Cb -0.03 -0.42 -0.03 0.00 0.00 0.00 0.00 23.12 22.64 1et5 s ALA 291 CO 0.01 0.24 -0.06 0.12 0.00 0.00 0.00 175.76 176.07 1et5 s PHE 292 N 0.02 2.97 -0.03 0.00 2.19 0.87 -0.14 117.98 123.85 1et5 s PHE 292 Ca -0.02 -0.30 -0.10 0.00 0.33 0.00 0.00 56.93 56.84 1et5 s PHE 292 Cb -0.10 -1.89 0.02 0.00 -1.31 0.00 0.00 43.02 39.74 1et5 s PHE 292 CO 0.01 0.00 0.23 -0.47 1.83 0.00 0.00 175.22 176.83 1et5 s TYR 293 N 0.13 -0.13 -0.27 10.12 5.04 -0.48 -1.29 117.35 130.46 1et5 s TYR 293 Ca -0.02 0.25 -0.03 0.00 -2.44 0.00 0.00 57.07 54.82 1et5 s TYR 293 Cb -0.14 0.04 0.02 0.00 0.35 0.00 0.00 41.96 42.24 1et5 s TYR 293 CO 0.03 -0.27 -0.01 0.99 -1.34 0.00 0.00 175.55 174.95 1et5 s THR 294 N -0.89 3.24 0.27 4.34 2.01 -1.26 -0.37 115.64 122.97 1et5 s THR 294 Ca -0.10 -0.93 -0.30 0.00 0.31 0.00 0.00 61.69 60.68 1et5 s THR 294 Cb -0.05 -2.66 -0.10 0.00 0.01 0.00 0.00 72.50 69.70 1et5 s THR 294 CO 0.02 0.15 1.35 -0.36 -0.69 0.00 0.00 174.62 175.09 1et5 s PHE 295 N 1.38 3.11 -0.01 4.92 0.40 -0.89 -4.89 117.98 122.00 1et5 s PHE 295 Ca 0.01 1.23 0.02 0.00 -0.60 0.00 0.00 56.93 57.59 1et5 s PHE 295 Cb -0.17 -3.70 -0.04 0.00 0.51 0.00 0.00 43.02 39.63 1et5 s PHE 295 CO -0.02 -2.12 0.05 1.04 0.70 0.00 0.00 175.22 174.87 1et5 n GLN 296 N 1.84 0.44 -4.53 0.44 1.13 -1.26 -0.61 117.38 114.83 1et5 n GLN 296 Ca 0.04 -0.02 -0.22 0.00 -1.94 0.00 0.00 57.00 54.87 1et5 n GLN 296 Cb 0.42 -1.06 -0.14 0.00 0.11 0.00 0.00 30.24 29.57 1et5 n GLN 296 CO 0.00 0.00 0.00 -0.65 -1.44 0.00 0.00 177.06 174.97 1et5 s GLN 297 N -2.15 1.07 0.94 -1.09 -1.52 -1.26 -4.66 119.66 110.98 1et5 s GLN 297 Ca -0.01 -0.63 -0.15 0.00 -1.95 0.00 0.00 55.36 52.62 1et5 s GLN 297 Cb 0.01 -1.06 0.18 0.00 -0.22 0.00 0.00 33.01 31.93 1et5 s GLN 297 CO 0.10 0.28 1.30 -1.25 -0.25 0.00 0.00 175.29 175.46 1et5 s PRO 298 N -0.70 0.84 0.00 2.91 0.04 -1.26 -4.83 135.00 131.99 1et5 s PRO 298 Ca 0.04 -0.36 0.00 0.00 0.04 0.00 0.00 61.00 60.72 1et5 s PRO 298 Cb -0.07 -1.87 0.00 0.00 0.04 0.00 0.00 34.50 32.60 1et5 s PRO 298 CO 0.00 -2.28 0.00 0.41 0.04 0.00 0.00 177.00 175.17 1et5 n GLY 299 N -3.69 -0.15 3.83 0.56 0.00 0.21 -4.93 105.19 101.03 1et5 n GLY 299 Ca 0.14 -2.25 -0.37 0.00 0.00 0.00 0.00 46.02 43.54 1et5 n GLY 299 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1et5 s ILE 300 N 0.00 5.44 0.21 -0.61 2.07 -1.26 -0.07 121.20 126.97 1et5 s ILE 300 Ca 0.00 0.27 0.10 0.00 -1.41 0.00 0.00 60.65 59.60 1et5 s ILE 300 Cb 0.00 -3.45 -0.05 0.00 0.13 0.00 0.00 42.46 39.09 1et5 s ILE 300 CO 0.00 0.56 -0.19 -0.31 -1.91 0.00 0.00 174.94 173.10 1et5 s TYR 301 N -0.63 1.99 0.07 3.50 1.51 0.04 -4.99 117.35 118.84 1et5 s TYR 301 Ca 0.14 -0.44 0.08 0.00 -1.01 0.00 0.00 57.07 55.83 1et5 s TYR 301 Cb -0.12 -0.94 -0.04 0.00 -0.11 0.00 0.00 41.96 40.75 1et5 s TYR 301 CO 0.03 0.46 -0.17 0.00 -1.11 0.00 0.00 175.55 174.76 1et5 s ALA 302 N -2.30 2.66 -0.20 3.71 0.00 -1.25 -1.39 121.76 122.99 1et5 s ALA 302 Ca 0.21 -1.24 0.01 0.00 0.00 0.00 0.00 51.96 50.94 1et5 s ALA 302 Cb -0.05 -0.73 0.04 0.00 0.00 0.00 0.00 23.12 22.38 1et5 s ALA 302 CO 0.09 0.58 -0.10 -0.47 0.00 0.00 0.00 175.76 175.86 1et5 s TYR 303 N -1.02 2.44 0.17 0.00 5.04 0.12 0.10 117.35 124.21 1et5 s TYR 303 Ca 0.16 -1.61 0.02 0.00 -2.44 0.00 0.00 57.07 53.20 1et5 s TYR 303 Cb -0.11 -1.65 -0.05 0.00 0.35 0.00 0.00 41.96 40.51 1et5 s TYR 303 CO 0.07 -0.75 -0.01 0.14 -1.34 0.00 0.00 175.55 173.67 1et5 s VAL 304 N 1.39 0.73 -0.19 3.14 -7.23 0.28 -0.99 120.40 117.52 1et5 s VAL 304 Ca -0.01 -1.98 -0.25 0.00 -1.81 0.00 0.00 61.98 57.92 1et5 s VAL 304 Cb -0.16 -2.09 -0.01 0.00 0.56 0.00 0.00 36.38 34.68 1et5 s VAL 304 CO -0.08 -0.51 0.84 0.21 -0.31 0.00 0.00 175.10 175.25 1et5 s ASN 305 N -3.17 6.93 0.00 4.85 3.84 -1.13 -0.20 114.94 126.06 1et5 s ASN 305 Ca 0.23 1.15 0.00 0.00 0.21 0.00 0.00 52.86 54.45 1et5 s ASN 305 Cb 0.06 -2.45 0.00 0.00 -0.55 0.00 0.00 41.25 38.30 1et5 s ASN 305 CO 0.03 -0.45 0.46 1.57 -2.79 0.00 0.00 177.10 175.92 1et5 n HIS 306 N 5.52 0.00 -3.02 0.43 -0.00 0.15 -4.07 115.22 114.23 1et5 n HIS 306 Ca 0.05 -0.01 -0.44 0.00 -0.00 0.00 0.00 57.72 57.33 1et5 n HIS 306 Cb 0.48 -0.09 -0.05 0.00 -0.00 0.00 0.00 29.99 30.33 1et5 n HIS 306 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 176.34 177.55 1et5 s ASN 307 N -0.08 6.22 0.60 0.26 3.84 -1.26 -4.89 114.94 119.63 1et5 s ASN 307 Ca 0.00 -1.00 0.31 0.00 0.21 0.00 0.00 52.86 52.38 1et5 s ASN 307 Cb 0.00 -2.35 1.79 0.00 -0.55 0.00 0.00 41.25 40.14 1et5 s ASN 307 CO 0.00 -1.15 2.17 -0.07 -2.79 0.00 0.00 177.10 175.25 1et5 h LEU 308 N 10.41 0.00 -0.38 3.21 3.38 -2.00 -0.28 115.31 129.66 1et5 h LEU 308 Ca -0.28 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.60 1et5 h LEU 308 Cb 1.08 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.82 1et5 h LEU 308 CO 1.08 0.00 -0.11 0.40 0.09 0.00 0.00 178.44 179.90 1et5 h ILE 309 N 0.00 1.28 -0.27 1.22 2.04 -1.90 0.20 117.51 120.08 1et5 h ILE 309 Ca 0.05 -1.20 -0.09 0.00 1.00 0.00 0.00 64.86 64.61 1et5 h ILE 309 Cb 0.30 1.27 -0.01 0.00 -0.74 0.00 0.00 36.82 37.63 1et5 h ILE 309 CO -0.00 0.40 -0.22 -0.33 0.00 0.00 0.00 178.15 178.00 1et5 h GLU 310 N 0.55 0.50 0.12 2.37 5.08 -1.40 0.22 114.58 122.02 1et5 h GLU 310 Ca 0.09 -0.18 -0.01 0.00 -1.00 0.00 0.00 59.36 58.27 1et5 h GLU 310 Cb 0.63 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.85 1et5 h GLU 310 CO 0.04 0.69 -0.06 0.00 -1.00 0.00 0.00 179.01 178.69 1et5 h ALA 311 N 1.32 -0.16 0.00 3.43 0.00 -1.12 -1.52 119.26 121.22 1et5 h ALA 311 Ca 0.07 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.73 1et5 h ALA 311 Cb 0.63 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.48 1et5 h ALA 311 CO 0.04 -0.26 -0.93 1.19 0.00 0.00 0.00 179.25 179.29 1et5 n PHE 312 N -4.88 0.09 -0.06 0.00 3.01 0.04 -2.75 117.46 112.91 1et5 n PHE 312 Ca -0.08 0.03 -0.09 0.00 1.01 0.00 0.00 57.45 58.31 1et5 n PHE 312 Cb 0.28 -0.23 -0.06 0.00 -0.01 0.00 0.00 39.48 39.46 1et5 n PHE 312 CO 0.00 0.00 0.00 0.39 1.01 0.00 0.00 176.76 178.16 1et5 n GLU 313 N -1.69 0.30 0.08 -1.08 -0.58 -0.01 -4.74 120.64 112.92 1et5 n GLU 313 Ca 0.03 0.08 0.12 0.00 -0.42 0.00 0.00 57.16 56.97 1et5 n GLU 313 Cb 0.38 -1.21 0.02 0.00 -0.57 0.00 0.00 31.44 30.07 1et5 n GLU 313 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 1et5 n LEU 314 N -2.96 0.76 0.00 -4.62 4.32 -0.76 -5.00 117.00 108.74 1et5 n LEU 314 Ca -0.22 0.26 0.00 0.00 -0.02 0.00 0.00 56.01 56.02 1et5 n LEU 314 Cb 0.73 -0.08 0.00 0.00 -1.62 0.00 0.00 43.42 42.44 1et5 n LEU 314 CO 0.11 -0.13 0.00 0.61 -1.22 0.00 0.00 177.39 176.76 1et5 n GLY 315 N 1.23 1.01 2.75 -0.72 0.00 -0.71 -2.19 105.19 106.56 1et5 n GLY 315 Ca 0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.61 1et5 n GLY 315 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1et5 n ALA 316 N -0.18 5.68 -3.43 4.61 0.00 0.90 -4.19 120.51 123.90 1et5 n ALA 316 Ca 0.00 -4.06 -0.13 0.00 0.00 0.00 0.00 53.44 49.25 1et5 n ALA 316 Cb 0.00 -3.24 -0.13 0.00 0.00 0.00 0.00 19.45 16.08 1et5 n ALA 316 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1et5 s ALA 317 N 1.64 -0.37 0.16 0.00 0.00 -1.25 -2.82 121.76 119.12 1et5 s ALA 317 Ca 0.46 0.63 0.04 0.00 0.00 0.00 0.00 51.96 53.08 1et5 s ALA 317 Cb 0.13 -0.40 -0.05 0.00 0.00 0.00 0.00 23.12 22.80 1et5 s ALA 317 CO -0.05 -0.13 -0.07 0.00 0.00 0.00 0.00 175.76 175.52 1et5 s ALA 318 N 0.71 1.43 0.14 0.00 0.00 -0.16 -4.57 121.76 119.31 1et5 s ALA 318 Ca -0.05 -1.53 0.09 0.00 0.00 0.00 0.00 51.96 50.47 1et5 s ALA 318 Cb -0.07 0.20 -0.04 0.00 0.00 0.00 0.00 23.12 23.22 1et5 s ALA 318 CO -0.04 -0.17 -0.14 -1.01 0.00 0.00 0.00 175.76 174.40 1et5 s HIS 319 N -3.43 2.59 -0.08 0.00 3.76 0.18 0.13 115.29 118.43 1et5 s HIS 319 Ca 0.19 -0.24 0.02 0.00 -0.15 0.00 0.00 55.06 54.89 1et5 s HIS 319 Cb 0.04 -1.32 0.01 0.00 1.11 0.00 0.00 32.58 32.42 1et5 s HIS 319 CO 0.02 0.45 -0.16 -0.06 -0.85 0.00 0.00 174.74 174.14 1et5 s PHE 320 N -1.40 1.83 -0.23 1.40 0.08 -0.49 -1.35 117.98 117.82 1et5 s PHE 320 Ca 0.21 -0.75 -0.05 0.00 0.12 0.00 0.00 56.93 56.47 1et5 s PHE 320 Cb -0.10 -1.30 -0.01 0.00 -0.57 0.00 0.00 43.02 41.04 1et5 s PHE 320 CO 0.13 -0.36 -0.01 0.21 -0.10 0.00 0.00 175.22 175.09 1et5 s LYS 321 N 0.68 3.42 -0.10 0.44 2.36 -0.03 -0.78 119.74 125.72 1et5 s LYS 321 Ca -0.14 -0.61 0.03 0.00 -2.55 0.00 0.00 55.97 52.71 1et5 s LYS 321 Cb -0.16 -3.10 0.00 0.00 -1.05 0.00 0.00 37.83 33.52 1et5 s LYS 321 CO 0.04 -0.21 -0.21 0.08 1.55 0.00 0.00 175.35 176.59 1et5 s VAL 322 N 1.51 1.89 0.31 4.02 1.01 0.89 -2.47 120.40 127.57 1et5 s VAL 322 Ca 0.06 -0.91 0.03 0.00 0.00 0.00 0.00 61.98 61.16 1et5 s VAL 322 Cb -0.15 -1.65 -0.02 0.00 0.00 0.00 0.00 36.38 34.56 1et5 s VAL 322 CO -0.01 0.52 0.47 0.42 0.00 0.00 0.00 175.10 176.50 1et5 s THR 323 N 0.53 4.85 -4.65 3.92 -4.23 -1.05 0.67 115.64 115.68 1et5 s THR 323 Ca -0.15 -0.78 0.00 0.00 -1.18 0.00 0.00 61.69 59.58 1et5 s THR 323 Cb -0.17 -3.73 0.00 0.00 1.34 0.00 0.00 72.50 69.94 1et5 s THR 323 CO 0.05 -0.37 0.00 0.61 -0.54 0.00 0.00 174.62 174.38 1et5 n GLY 324 N -1.64 0.95 3.88 3.99 0.00 -1.26 -0.87 105.19 110.24 1et5 n GLY 324 Ca -0.05 -1.94 -0.35 0.00 0.00 0.00 0.00 46.02 43.68 1et5 n GLY 324 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1et5 s GLU 325 N -1.86 3.42 0.26 1.61 2.02 -1.26 -4.72 118.70 118.17 1et5 s GLU 325 Ca 0.00 -0.21 -0.30 0.00 0.02 0.00 0.00 54.97 54.48 1et5 s GLU 325 Cb 0.00 -3.14 -0.09 0.00 0.10 0.00 0.00 34.13 31.00 1et5 s GLU 325 CO 0.00 0.74 1.13 -0.46 0.02 0.00 0.00 175.26 176.69 1et5 s TRP 326 N -1.14 3.51 -0.45 1.61 -0.11 -1.26 -4.36 118.94 116.74 1et5 s TRP 326 Ca 0.20 1.62 -0.08 0.00 1.22 0.00 0.00 56.10 59.06 1et5 s TRP 326 Cb -0.12 -3.34 0.11 0.00 -1.50 0.00 0.00 33.47 28.62 1et5 s TRP 326 CO 0.10 -0.77 0.31 1.21 -4.62 0.00 0.00 176.95 173.18 1et5 s ASN 327 N -0.62 5.62 0.00 5.86 3.84 -1.26 -4.95 114.94 123.44 1et5 s ASN 327 Ca 0.47 -1.87 0.16 0.00 0.21 0.00 0.00 52.86 51.82 1et5 s ASN 327 Cb -0.33 -1.98 0.79 0.00 -0.55 0.00 0.00 41.25 39.19 1et5 s ASN 327 CO 0.41 -0.65 1.47 0.47 -2.79 0.00 0.00 177.10 176.01 1et5 n ASP 328 N 4.86 0.00 0.05 -4.21 10.43 -1.26 -2.61 116.55 123.81 1et5 n ASP 328 Ca -0.07 0.13 -0.20 0.00 2.57 0.00 0.00 54.79 57.21 1et5 n ASP 328 Cb 0.41 -0.32 -0.14 0.00 1.84 0.00 0.00 41.12 42.91 1et5 n ASP 328 CO 0.00 0.00 0.00 -0.78 -1.07 0.00 0.00 177.20 175.35 1et5 h ASP 329 N 0.00 0.54 0.16 -2.24 -0.00 -2.02 -3.32 116.42 109.54 1et5 h ASP 329 Ca 0.00 -0.90 -0.13 0.00 -0.00 0.00 0.00 57.03 56.00 1et5 h ASP 329 Cb 0.17 -0.17 -0.01 0.00 -0.00 0.00 0.00 39.33 39.32 1et5 h ASP 329 CO 0.00 1.40 -0.49 -0.07 -0.00 0.00 0.00 179.24 180.08 1et5 h LEU 330 N -0.22 0.41 -7.00 2.28 3.38 -1.94 -3.45 115.31 108.77 1et5 h LEU 330 Ca -0.14 -0.20 0.01 0.00 0.09 0.00 0.00 57.88 57.64 1et5 h LEU 330 Cb 1.63 -0.12 -0.23 0.00 0.09 0.00 0.00 40.66 42.03 1et5 h LEU 330 CO 0.16 0.84 0.27 -0.32 0.09 0.00 0.00 178.44 179.48 1et5 s MET 331 N -4.04 0.68 -0.09 1.13 0.00 -1.13 -5.15 119.30 110.70 1et5 s MET 331 Ca -0.06 0.83 -0.22 0.00 0.00 0.00 0.00 55.69 56.24 1et5 s MET 331 Cb 0.12 0.32 0.05 0.00 0.00 0.00 0.00 34.83 35.32 1et5 s MET 331 CO 0.80 -0.08 0.52 -0.08 0.00 0.00 0.00 175.02 176.18 1et5 s THR 332 N 0.38 0.02 -0.56 10.11 -1.32 -1.26 -4.05 115.64 118.97 1et5 s THR 332 Ca 0.01 -0.15 -0.22 0.00 -1.21 0.00 0.00 61.69 60.12 1et5 s THR 332 Cb -0.05 -0.80 0.05 0.00 -1.51 0.00 0.00 72.50 70.19 1et5 s THR 332 CO -0.03 -0.08 0.86 -0.55 -2.21 0.00 0.00 174.62 172.61 1et5 s SER 333 N -0.75 6.28 0.12 8.08 0.15 -1.26 -4.90 113.70 121.41 1et5 s SER 333 Ca -0.08 -0.62 -0.11 0.00 0.70 0.00 0.00 55.95 55.84 1et5 s SER 333 Cb -0.03 -2.39 -0.11 0.00 -1.71 0.00 0.00 66.02 61.78 1et5 s SER 333 CO 0.05 -1.17 1.35 0.58 1.20 0.00 0.00 173.24 175.25 1et5 h VAL 334 N 5.97 1.29 -3.15 4.45 2.07 -2.02 -3.42 116.25 121.45 1et5 h VAL 334 Ca -0.27 -1.94 -0.46 0.00 0.82 0.00 0.00 66.70 64.85 1et5 h VAL 334 Cb 1.08 1.92 -0.40 0.00 -1.52 0.00 0.00 31.29 32.37 1et5 h VAL 334 CO 1.07 0.62 -0.75 -0.22 0.02 0.00 0.00 177.57 178.30 1et5 s LEU 335 N -8.41 0.50 0.70 2.57 2.96 -1.26 -5.14 118.68 110.60 1et5 s LEU 335 Ca -0.10 -0.52 -0.15 0.00 -0.22 0.00 0.00 54.13 53.15 1et5 s LEU 335 Cb 0.09 -0.31 0.02 0.00 0.50 0.00 0.00 46.19 46.50 1et5 s LEU 335 CO 0.89 -0.32 1.16 0.00 -1.32 0.00 0.00 176.35 176.77 1et5 s ALA 336 N 2.08 2.26 -0.05 5.97 0.00 -1.26 -4.84 121.76 125.92 1et5 s ALA 336 Ca 0.02 0.71 -0.39 0.00 0.00 0.00 0.00 51.96 52.30 1et5 s ALA 336 Cb -0.15 -3.40 -0.18 0.00 0.00 0.00 0.00 23.12 19.39 1et5 s ALA 336 CO -0.08 -1.63 1.34 -2.30 0.00 0.00 0.00 175.76 173.10 1et5 n PRO 337 N -2.63 0.69 -3.57 0.00 -0.02 -1.26 -4.92 135.00 123.29 1et5 n PRO 337 Ca 0.12 0.25 -0.13 0.00 -2.02 0.00 0.00 63.50 61.72 1et5 n PRO 337 Cb 0.51 -1.84 -0.05 0.00 -0.02 0.00 0.00 33.50 32.10 1et5 n PRO 337 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 1et5 s SER 338 N 1.02 -0.42 0.00 2.55 1.04 -1.26 -5.28 113.70 111.34 1et5 s SER 338 Ca 0.90 0.09 0.00 0.00 0.48 0.00 0.00 55.95 57.43 1et5 s SER 338 Cb -1.12 0.50 0.00 0.00 0.10 0.00 0.00 66.02 65.50 1et5 s SER 338 CO 0.56 -0.76 0.32 0.61 0.98 0.00 0.00 173.24 174.96