#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ppa s THR 5 N 0.00 2.32 0.19 0.00 -4.23 -1.26 -4.75 115.64 107.92 2ppa s THR 5 Ca 0.00 0.10 -0.12 0.00 -1.18 0.00 0.00 61.69 60.50 2ppa s THR 5 Cb 0.00 -2.65 0.12 0.00 1.34 0.00 0.00 72.50 71.31 2ppa s THR 5 CO 0.00 -0.14 1.72 0.00 -0.54 0.00 0.00 174.62 175.66 2ppa h ALA 6 N -1.67 0.61 -0.15 3.99 0.00 -2.05 -0.28 119.26 119.71 2ppa h ALA 6 Ca -0.52 0.11 -0.14 0.00 0.00 0.00 0.00 54.91 54.36 2ppa h ALA 6 Cb 1.31 0.13 -0.01 0.00 0.00 0.00 0.00 17.79 19.22 2ppa h ALA 6 CO 0.57 -0.29 -0.49 0.00 0.00 0.00 0.00 179.25 179.05 2ppa h ALA 7 N 1.41 0.88 -0.50 0.00 0.00 -1.99 -1.93 119.26 117.13 2ppa h ALA 7 Ca 0.27 -0.47 -0.03 0.00 0.00 0.00 0.00 54.91 54.67 2ppa h ALA 7 Cb 0.36 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 2ppa h ALA 7 CO -0.34 0.66 0.19 0.93 0.00 0.00 0.00 179.25 180.70 2ppa h GLU 8 N 0.31 0.76 -0.47 0.00 5.08 -1.67 -1.36 114.58 117.22 2ppa h GLU 8 Ca 0.02 -0.14 -0.03 0.00 -1.00 0.00 0.00 59.36 58.20 2ppa h GLU 8 Cb 0.97 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 30.08 2ppa h GLU 8 CO 0.08 0.68 0.16 0.82 -1.00 0.00 0.00 179.01 179.76 2ppa h ILE 9 N 0.67 1.22 0.00 3.13 2.04 -0.98 -2.74 117.51 120.85 2ppa h ILE 9 Ca 0.17 -0.71 -0.04 0.00 1.00 0.00 0.00 64.86 65.27 2ppa h ILE 9 Cb 0.21 0.79 -0.01 0.00 -0.74 0.00 0.00 36.82 37.07 2ppa h ILE 9 CO -0.01 0.26 -0.21 0.00 0.00 0.00 0.00 178.15 178.19 2ppa h ALA 10 N 1.02 1.47 0.00 1.87 0.00 -1.18 -2.84 119.26 119.60 2ppa h ALA 10 Ca 0.16 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2ppa h ALA 10 Cb 0.24 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.00 2ppa h ALA 10 CO -0.01 0.26 -0.22 0.00 0.00 0.00 0.00 179.25 179.28 2ppa n ALA 11 N -2.42 2.60 -1.76 0.00 0.00 -0.53 -4.91 120.51 113.49 2ppa n ALA 11 Ca -0.02 -0.14 -0.39 0.00 0.00 0.00 0.00 53.44 52.90 2ppa n ALA 11 Cb 0.29 -1.35 0.02 0.00 0.00 0.00 0.00 19.45 18.41 2ppa n ALA 11 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2ppa s LEU 12 N -3.95 3.99 0.48 0.00 1.43 -1.07 -4.94 118.68 114.62 2ppa s LEU 12 Ca 0.10 2.76 -0.24 0.00 -1.03 0.00 0.00 54.13 55.73 2ppa s LEU 12 Cb 0.15 -4.12 -0.07 0.00 0.03 0.00 0.00 46.19 42.18 2ppa s LEU 12 CO 0.63 -1.30 1.34 -2.16 0.23 0.00 0.00 176.35 175.09 2ppa s PRO 13 N -2.66 3.55 -0.15 1.29 0.04 -1.26 -4.77 135.00 131.03 2ppa s PRO 13 Ca 0.66 2.22 -0.04 0.00 0.04 0.00 0.00 61.00 63.88 2ppa s PRO 13 Cb -0.40 -2.50 -0.03 0.00 0.04 0.00 0.00 34.50 31.61 2ppa s PRO 13 CO 0.50 -0.86 -0.03 1.03 0.04 0.00 0.00 177.00 177.68 2ppa s ARG 14 N -2.61 3.58 -0.09 4.56 3.00 -1.26 -0.56 118.95 125.58 2ppa s ARG 14 Ca 0.64 -0.50 -0.00 0.00 0.00 0.00 0.00 55.73 55.87 2ppa s ARG 14 Cb -0.39 -2.90 0.02 0.00 0.00 0.00 0.00 34.95 31.67 2ppa s ARG 14 CO 0.49 0.31 -0.06 -1.14 0.00 0.00 0.00 175.30 174.91 2ppa s GLN 15 N 0.18 1.20 -0.01 3.54 0.74 -0.16 -4.96 119.66 120.19 2ppa s GLN 15 Ca -0.01 -0.15 -0.24 0.00 0.05 0.00 0.00 55.36 55.00 2ppa s GLN 15 Cb -0.14 -1.30 -0.05 0.00 1.10 0.00 0.00 33.01 32.63 2ppa s GLN 15 CO 0.03 -0.22 0.74 0.15 -0.55 0.00 0.00 175.29 175.44 2ppa s LYS 16 N 1.56 4.46 -0.06 1.67 1.02 -1.26 0.49 119.74 127.62 2ppa s LYS 16 Ca 0.01 0.99 0.06 0.00 0.02 0.00 0.00 55.97 57.04 2ppa s LYS 16 Cb -0.13 -3.40 -0.01 0.00 -0.52 0.00 0.00 37.83 33.77 2ppa s LYS 16 CO -0.05 0.17 -0.25 0.08 -0.92 0.00 0.00 175.35 174.39 2ppa s VAL 17 N 0.37 2.02 -0.07 3.17 1.01 -0.48 -4.91 120.40 121.51 2ppa s VAL 17 Ca 0.38 -1.05 -0.22 0.00 0.00 0.00 0.00 61.98 61.10 2ppa s VAL 17 Cb -0.19 -1.71 -0.04 0.00 0.00 0.00 0.00 36.38 34.44 2ppa s VAL 17 CO 0.21 0.56 0.63 -1.61 0.00 0.00 0.00 175.10 174.89 2ppa s GLU 18 N -0.16 4.40 0.43 2.72 2.02 -1.26 -4.67 118.70 122.17 2ppa s GLU 18 Ca -0.03 0.75 -0.12 0.00 0.02 0.00 0.00 54.97 55.59 2ppa s GLU 18 Cb -0.14 -3.42 -0.07 0.00 0.10 0.00 0.00 34.13 30.60 2ppa s GLU 18 CO 0.04 0.14 0.82 -0.51 0.02 0.00 0.00 175.26 175.77 2ppa s LEU 19 N 0.57 3.79 0.26 1.80 1.43 -1.26 -4.66 118.68 120.61 2ppa s LEU 19 Ca 0.34 1.24 0.08 0.00 -1.03 0.00 0.00 54.13 54.76 2ppa s LEU 19 Cb -0.17 -4.13 -0.05 0.00 0.03 0.00 0.00 46.19 41.86 2ppa s LEU 19 CO 0.16 -0.43 -0.12 0.68 0.23 0.00 0.00 176.35 176.87 2ppa s VAL 20 N -2.41 1.93 0.27 -1.59 -7.23 -1.26 -4.98 120.40 105.12 2ppa s VAL 20 Ca 0.53 -2.23 -0.29 0.00 -1.81 0.00 0.00 61.98 58.19 2ppa s VAL 20 Cb -0.10 -2.30 -0.09 0.00 0.56 0.00 0.00 36.38 34.45 2ppa s VAL 20 CO 0.31 -0.41 0.95 -1.81 -0.31 0.00 0.00 175.10 173.82 2ppa s ASP 21 N -3.43 7.54 0.71 4.85 1.01 -1.26 -4.60 116.67 121.49 2ppa s ASP 21 Ca 0.27 1.94 -0.16 0.00 0.71 0.00 0.00 52.55 55.31 2ppa s ASP 21 Cb 0.00 -2.60 0.03 0.00 1.01 0.00 0.00 42.92 41.36 2ppa s ASP 21 CO 0.11 0.07 1.26 -2.84 0.21 0.00 0.00 175.17 173.99 2ppa s PRO 22 N -1.44 2.16 0.00 8.23 0.02 -1.26 -1.98 135.00 140.73 2ppa s PRO 22 Ca 0.44 1.95 0.19 0.00 0.02 0.00 0.00 61.00 63.59 2ppa s PRO 22 Cb -0.24 -1.81 0.97 0.00 0.02 0.00 0.00 34.50 33.43 2ppa s PRO 22 CO 0.30 -1.87 1.64 -0.35 -0.33 0.00 0.00 177.00 176.40 2ppa n PRO 23 N -2.48 1.21 -1.85 5.54 -0.04 -1.26 -5.02 135.00 131.10 2ppa n PRO 23 Ca 0.15 -0.31 -0.30 0.00 -0.04 0.00 0.00 63.50 62.99 2ppa n PRO 23 Cb 0.49 -1.31 0.04 0.00 -0.04 0.00 0.00 33.50 32.68 2ppa n PRO 23 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 2ppa s PHE 24 N -1.94 3.34 -0.01 0.54 0.40 -0.84 -0.64 117.98 118.83 2ppa s PHE 24 Ca 0.28 1.11 0.03 0.00 -0.60 0.00 0.00 56.93 57.75 2ppa s PHE 24 Cb 0.14 -3.00 -0.00 0.00 0.51 0.00 0.00 43.02 40.66 2ppa s PHE 24 CO 0.22 -1.13 -0.09 0.08 0.70 0.00 0.00 175.22 175.00 2ppa s VAL 25 N -3.30 0.71 1.02 -0.44 1.01 -1.26 -4.63 120.40 113.51 2ppa s VAL 25 Ca 0.58 -0.35 -0.12 0.00 0.00 0.00 0.00 61.98 62.09 2ppa s VAL 25 Cb -0.11 -0.61 0.20 0.00 0.00 0.00 0.00 36.38 35.85 2ppa s VAL 25 CO 0.52 0.21 1.08 -1.38 0.00 0.00 0.00 175.10 175.54 2ppa s HIS 26 N -0.01 1.69 0.19 5.22 -3.43 -1.26 -4.91 115.29 112.77 2ppa s HIS 26 Ca 0.00 1.39 -0.32 0.00 -0.80 0.00 0.00 55.06 55.33 2ppa s HIS 26 Cb -0.06 -3.19 -0.12 0.00 -1.43 0.00 0.00 32.58 27.79 2ppa s HIS 26 CO -0.00 -3.16 1.72 0.00 -2.00 0.00 0.00 174.74 171.29 2ppa s ALA 27 N -2.65 3.91 0.19 -1.38 0.00 -1.26 -4.99 121.76 115.58 2ppa s ALA 27 Ca 0.67 1.55 -0.18 0.00 0.00 0.00 0.00 51.96 54.00 2ppa s ALA 27 Cb -0.22 -3.70 0.03 0.00 0.00 0.00 0.00 23.12 19.23 2ppa s ALA 27 CO 0.61 -0.95 0.52 -3.38 0.00 0.00 0.00 175.76 172.56 2ppa s HIS 28 N 1.36 -0.13 -0.05 0.00 -3.43 -1.26 -5.03 115.29 106.75 2ppa s HIS 28 Ca 0.75 -0.21 0.01 0.00 -0.80 0.00 0.00 55.06 54.80 2ppa s HIS 28 Cb -0.49 0.39 -0.03 0.00 -1.43 0.00 0.00 32.58 31.03 2ppa s HIS 28 CO 0.32 -0.91 -0.04 0.45 -2.00 0.00 0.00 174.74 172.56 2ppa s SER 29 N -2.87 4.89 -0.02 7.38 0.15 -1.26 -5.03 113.70 116.94 2ppa s SER 29 Ca 0.09 0.01 -0.24 0.00 0.70 0.00 0.00 55.95 56.51 2ppa s SER 29 Cb -0.01 -1.27 -0.20 0.00 -1.71 0.00 0.00 66.02 62.83 2ppa s SER 29 CO -0.03 0.34 1.19 1.56 1.20 0.00 0.00 173.24 177.50 2ppa h GLN 30 N 4.96 0.14 -6.06 5.44 4.20 -1.97 -3.41 115.11 118.41 2ppa h GLN 30 Ca -0.49 -0.10 -0.56 0.00 0.06 0.00 0.00 58.65 57.56 2ppa h GLN 30 Cb 1.18 0.02 -0.05 0.00 0.30 0.00 0.00 27.48 28.92 2ppa h GLN 30 CO 0.54 0.70 0.19 0.08 -0.67 0.00 0.00 178.83 179.68 2ppa s VAL 31 N -3.84 4.99 0.35 -0.54 1.01 -1.26 -3.22 120.40 117.89 2ppa s VAL 31 Ca -0.16 1.57 -0.28 0.00 0.00 0.00 0.00 61.98 63.11 2ppa s VAL 31 Cb 0.02 -4.10 -0.10 0.00 0.00 0.00 0.00 36.38 32.20 2ppa s VAL 31 CO 0.71 0.19 1.30 0.00 0.00 0.00 0.00 175.10 177.30 2ppa s ALA 32 N 1.14 3.44 -0.28 5.51 0.00 0.46 -4.96 121.76 127.07 2ppa s ALA 32 Ca 0.40 1.24 -0.08 0.00 0.00 0.00 0.00 51.96 53.52 2ppa s ALA 32 Cb -0.18 -3.48 -0.01 0.00 0.00 0.00 0.00 23.12 19.46 2ppa s ALA 32 CO 0.18 -0.67 0.09 -1.21 0.00 0.00 0.00 175.76 174.15 2ppa s GLU 33 N -1.90 3.34 0.91 0.00 2.02 -1.26 -4.95 118.70 116.85 2ppa s GLU 33 Ca 0.51 -0.69 0.00 0.00 0.02 0.00 0.00 54.97 54.81 2ppa s GLU 33 Cb -0.39 -3.39 0.00 0.00 0.10 0.00 0.00 34.13 30.45 2ppa s GLU 33 CO 0.52 -0.35 0.00 0.41 0.02 0.00 0.00 175.26 175.86 2ppa n GLY 34 N 4.91 -1.71 0.00 -1.39 0.00 -1.26 -4.95 105.19 100.79 2ppa n GLY 34 Ca -0.15 -1.23 0.00 0.00 0.00 0.00 0.00 46.02 44.64 2ppa n GLY 34 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ppa n GLY 35 N -1.54 -0.40 3.66 -0.02 0.00 -1.26 -4.99 105.19 100.65 2ppa n GLY 35 Ca 0.00 -1.72 -0.42 0.00 0.00 0.00 0.00 46.02 43.88 2ppa n GLY 35 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2ppa n PRO 36 N -0.40 1.70 -4.22 1.61 -0.02 -1.26 -5.02 135.00 127.38 2ppa n PRO 36 Ca 0.00 0.60 -0.15 0.00 -2.02 0.00 0.00 63.50 61.93 2ppa n PRO 36 Cb 0.00 -2.21 -0.10 0.00 -0.02 0.00 0.00 33.50 31.17 2ppa n PRO 36 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 2ppa s LYS 37 N -2.04 0.98 -0.42 -0.52 1.02 -1.26 -4.43 119.74 113.07 2ppa s LYS 37 Ca 0.61 -1.31 -0.16 0.00 0.02 0.00 0.00 55.97 55.12 2ppa s LYS 37 Cb -0.55 -0.64 0.02 0.00 -0.52 0.00 0.00 37.83 36.14 2ppa s LYS 37 CO 0.58 0.09 0.38 0.08 -0.92 0.00 0.00 175.35 175.57 2ppa s VAL 38 N -2.80 5.16 -0.22 3.17 1.01 0.28 -1.09 120.40 125.91 2ppa s VAL 38 Ca 0.11 -0.48 -0.15 0.00 0.00 0.00 0.00 61.98 61.47 2ppa s VAL 38 Cb -0.01 -4.00 -0.04 0.00 0.00 0.00 0.00 36.38 32.33 2ppa s VAL 38 CO 0.01 -0.38 0.34 -0.69 0.00 0.00 0.00 175.10 174.37 2ppa s VAL 39 N 1.95 5.23 -0.17 2.92 1.01 0.31 -0.98 120.40 130.68 2ppa s VAL 39 Ca 0.09 0.57 -0.05 0.00 0.00 0.00 0.00 61.98 62.59 2ppa s VAL 39 Cb -0.18 -3.67 -0.03 0.00 0.00 0.00 0.00 36.38 32.50 2ppa s VAL 39 CO 0.12 0.26 0.00 -1.61 0.00 0.00 0.00 175.10 173.87 2ppa s GLU 40 N 1.34 3.76 0.13 2.72 2.02 0.18 -0.86 118.70 127.98 2ppa s GLU 40 Ca 0.16 -0.46 0.08 0.00 0.02 0.00 0.00 54.97 54.76 2ppa s GLU 40 Cb -0.15 -3.04 -0.04 0.00 0.10 0.00 0.00 34.13 31.01 2ppa s GLU 40 CO 0.07 0.21 -0.18 -0.06 0.02 0.00 0.00 175.26 175.32 2ppa s PHE 41 N 0.47 1.68 -0.04 1.61 0.40 -0.58 -1.38 117.98 120.15 2ppa s PHE 41 Ca -0.01 -0.47 0.03 0.00 -0.60 0.00 0.00 56.93 55.89 2ppa s PHE 41 Cb -0.14 -0.88 0.00 0.00 0.51 0.00 0.00 43.02 42.51 2ppa s PHE 41 CO 0.02 0.23 -0.13 0.99 0.70 0.00 0.00 175.22 177.02 2ppa s THR 42 N -1.68 1.15 -0.01 0.64 2.01 -1.26 -0.77 115.64 115.71 2ppa s THR 42 Ca 0.10 -0.55 0.02 0.00 0.31 0.00 0.00 61.69 61.57 2ppa s THR 42 Cb -0.07 -1.00 -0.00 0.00 0.01 0.00 0.00 72.50 71.43 2ppa s THR 42 CO 0.05 0.34 -0.08 -0.04 -0.69 0.00 0.00 174.62 174.20 2ppa s MET 43 N 0.17 0.74 -0.13 4.92 -1.94 -0.40 -4.91 119.30 117.74 2ppa s MET 43 Ca -0.05 -0.28 -0.05 0.00 -1.71 0.00 0.00 55.69 53.61 2ppa s MET 43 Cb -0.11 -0.71 -0.04 0.00 2.01 0.00 0.00 34.83 35.99 2ppa s MET 43 CO 0.02 0.14 0.04 0.08 -0.01 0.00 0.00 175.02 175.29 2ppa s VAL 44 N -0.01 4.64 -0.05 -6.03 1.01 -1.26 -1.45 120.40 117.24 2ppa s VAL 44 Ca 0.00 -0.11 -0.23 0.00 0.00 0.00 0.00 61.98 61.64 2ppa s VAL 44 Cb -0.05 -3.02 -0.04 0.00 0.00 0.00 0.00 36.38 33.27 2ppa s VAL 44 CO -0.00 0.54 0.71 -0.63 0.00 0.00 0.00 175.10 175.72 2ppa s ILE 45 N -0.33 5.00 -0.14 2.22 1.01 -0.43 -0.11 121.20 128.42 2ppa s ILE 45 Ca 0.08 1.46 0.01 0.00 0.00 0.00 0.00 60.65 62.20 2ppa s ILE 45 Cb -0.12 -4.05 -0.00 0.00 0.01 0.00 0.00 42.46 38.30 2ppa s ILE 45 CO 0.02 0.27 -0.16 -1.61 0.00 0.00 0.00 174.94 173.46 2ppa s GLU 46 N 0.64 3.22 -0.23 2.79 2.02 -0.09 -4.44 118.70 122.61 2ppa s GLU 46 Ca 0.37 -0.76 -0.13 0.00 0.02 0.00 0.00 54.97 54.48 2ppa s GLU 46 Cb -0.18 -2.57 -0.04 0.00 0.10 0.00 0.00 34.13 31.43 2ppa s GLU 46 CO 0.19 0.08 0.27 -1.21 0.02 0.00 0.00 175.26 174.60 2ppa s GLU 47 N 0.66 4.09 -0.09 1.61 2.02 -1.26 -0.69 118.70 125.04 2ppa s GLU 47 Ca -0.08 -0.08 -0.30 0.00 0.02 0.00 0.00 54.97 54.52 2ppa s GLU 47 Cb -0.16 -3.56 0.09 0.00 0.10 0.00 0.00 34.13 30.60 2ppa s GLU 47 CO 0.02 -0.03 0.77 -1.59 0.02 0.00 0.00 175.26 174.45 2ppa s LYS 48 N 1.32 0.92 0.06 1.61 -2.85 -0.86 -4.99 119.74 114.95 2ppa s LYS 48 Ca 0.12 0.27 -0.31 0.00 -1.00 0.00 0.00 55.97 55.05 2ppa s LYS 48 Cb -0.14 0.44 -0.05 0.00 -2.06 0.00 0.00 37.83 36.01 2ppa s LYS 48 CO 0.07 -0.28 1.20 0.15 0.10 0.00 0.00 175.35 176.59 2ppa s LYS 49 N -1.08 4.43 0.12 1.78 1.02 -1.26 -0.68 119.74 124.08 2ppa s LYS 49 Ca -0.08 1.76 0.10 0.00 0.02 0.00 0.00 55.97 57.77 2ppa s LYS 49 Cb -0.00 -3.36 -0.04 0.00 -0.52 0.00 0.00 37.83 33.91 2ppa s LYS 49 CO 0.07 -0.27 -0.24 0.96 -0.92 0.00 0.00 175.35 174.95 2ppa s ILE 50 N 1.12 2.05 -0.18 2.17 -4.36 0.09 -4.92 121.20 117.18 2ppa s ILE 50 Ca 0.59 -1.70 -0.11 0.00 -0.26 0.00 0.00 60.65 59.17 2ppa s ILE 50 Cb -0.29 -1.84 -0.05 0.00 1.25 0.00 0.00 42.46 41.53 2ppa s ILE 50 CO 0.29 0.01 0.18 -0.69 0.24 0.00 0.00 174.94 174.97 2ppa s VAL 51 N -1.16 5.39 -0.72 8.37 1.01 -1.26 -0.84 120.40 131.19 2ppa s VAL 51 Ca 0.12 0.30 0.08 0.00 0.00 0.00 0.00 61.98 62.48 2ppa s VAL 51 Cb -0.10 -3.51 -0.01 0.00 0.00 0.00 0.00 36.38 32.76 2ppa s VAL 51 CO 0.06 0.45 0.54 2.30 0.00 0.00 0.00 175.10 178.45 2ppa n ILE 52 N 3.29 0.00 -3.96 2.22 -5.35 0.10 -4.86 119.36 110.79 2ppa n ILE 52 Ca -0.15 -0.40 -0.12 0.00 -0.27 0.00 0.00 62.75 61.80 2ppa n ILE 52 Cb 0.52 1.09 -0.02 0.00 -1.74 0.00 0.00 39.64 39.49 2ppa n ILE 52 CO 0.00 0.00 0.00 -0.90 -1.76 0.00 0.00 176.55 173.89 2ppa n ASP 53 N -0.40 -1.23 -0.06 7.28 3.85 -1.26 -0.23 116.55 124.51 2ppa n ASP 53 Ca 0.03 -2.60 0.12 0.00 -0.71 0.00 0.00 54.79 51.63 2ppa n ASP 53 Cb 0.17 2.26 0.70 0.00 -1.35 0.00 0.00 41.12 42.90 2ppa n ASP 53 CO 0.00 0.00 0.00 -0.90 -1.01 0.00 0.00 177.20 175.29 2ppa n ASP 54 N -1.68 0.19 -1.00 -1.12 5.75 -1.26 -3.36 116.55 114.07 2ppa n ASP 54 Ca -0.00 -1.27 0.09 0.00 -0.01 0.00 0.00 54.79 53.59 2ppa n ASP 54 Cb 0.50 -0.01 0.24 0.00 -1.03 0.00 0.00 41.12 40.83 2ppa n ASP 54 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2ppa n ALA 55 N -0.75 2.31 -1.32 2.12 0.00 -1.26 -4.96 120.51 116.65 2ppa n ALA 55 Ca 0.18 -1.25 -0.06 0.00 0.00 0.00 0.00 53.44 52.31 2ppa n ALA 55 Cb 0.12 -0.68 -0.02 0.00 0.00 0.00 0.00 19.45 18.86 2ppa n ALA 55 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2ppa n GLY 56 N 1.03 0.75 3.71 0.00 0.00 -1.21 -4.99 105.19 104.47 2ppa n GLY 56 Ca 0.18 -0.75 -0.42 0.00 0.00 0.00 0.00 46.02 45.03 2ppa n GLY 56 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2ppa s THR 57 N -2.24 3.05 -0.06 2.61 2.01 -1.26 -4.89 115.64 114.86 2ppa s THR 57 Ca 0.00 0.70 -0.03 0.00 0.31 0.00 0.00 61.69 62.67 2ppa s THR 57 Cb 0.00 -3.45 -0.04 0.00 0.01 0.00 0.00 72.50 69.02 2ppa s THR 57 CO 0.00 0.04 0.11 -1.61 -0.69 0.00 0.00 174.62 172.47 2ppa s GLU 58 N 1.50 3.25 -0.02 4.92 2.02 -1.26 -0.72 118.70 128.38 2ppa s GLU 58 Ca 0.68 -0.32 0.06 0.00 0.02 0.00 0.00 54.97 55.41 2ppa s GLU 58 Cb -0.39 -3.00 -0.01 0.00 0.10 0.00 0.00 34.13 30.82 2ppa s GLU 58 CO 0.31 0.71 -0.21 0.08 0.02 0.00 0.00 175.26 176.17 2ppa s VAL 59 N -1.12 1.63 -0.96 2.63 1.01 -0.02 -4.97 120.40 118.61 2ppa s VAL 59 Ca 0.20 -0.87 -0.24 0.00 0.00 0.00 0.00 61.98 61.06 2ppa s VAL 59 Cb -0.12 -1.36 0.04 0.00 0.00 0.00 0.00 36.38 34.93 2ppa s VAL 59 CO 0.10 0.46 1.48 -1.00 0.00 0.00 0.00 175.10 176.14 2ppa s HIS 60 N -0.40 2.41 0.49 5.22 3.76 -1.26 -0.73 115.29 124.77 2ppa s HIS 60 Ca 0.06 -0.56 -0.20 0.00 -0.15 0.00 0.00 55.06 54.21 2ppa s HIS 60 Cb -0.09 -4.62 -0.08 0.00 1.11 0.00 0.00 32.58 28.91 2ppa s HIS 60 CO -0.00 -1.95 1.07 0.00 -0.85 0.00 0.00 174.74 173.01 2ppa s ALA 61 N 5.66 2.85 -0.28 -1.40 0.00 0.15 -4.88 121.76 123.85 2ppa s ALA 61 Ca 0.47 0.69 0.01 0.00 0.00 0.00 0.00 51.96 53.13 2ppa s ALA 61 Cb -0.02 -3.29 0.08 0.00 0.00 0.00 0.00 23.12 19.89 2ppa s ALA 61 CO -0.05 -0.44 0.01 -1.64 0.00 0.00 0.00 175.76 173.64 2ppa s MET 62 N -3.16 1.38 -0.19 0.00 -1.94 -0.61 -2.02 119.30 112.76 2ppa s MET 62 Ca 0.68 -1.29 0.01 0.00 -1.71 0.00 0.00 55.69 53.38 2ppa s MET 62 Cb -0.19 -2.64 0.04 0.00 2.01 0.00 0.00 34.83 34.05 2ppa s MET 62 CO 0.23 -0.79 -0.11 0.00 -0.01 0.00 0.00 175.02 174.34 2ppa s ALA 63 N 1.29 1.99 0.13 3.03 0.00 0.14 -2.44 121.76 125.90 2ppa s ALA 63 Ca 0.03 -1.16 -0.31 0.00 0.00 0.00 0.00 51.96 50.52 2ppa s ALA 63 Cb -0.19 -1.24 -0.10 0.00 0.00 0.00 0.00 23.12 21.59 2ppa s ALA 63 CO -0.11 -0.74 1.78 -0.06 0.00 0.00 0.00 175.76 176.63 2ppa s PHE 64 N 1.41 2.33 -1.07 0.00 0.08 -1.25 -0.91 117.98 118.56 2ppa s PHE 64 Ca -0.00 0.10 0.00 0.00 0.12 0.00 0.00 56.93 57.15 2ppa s PHE 64 Cb -0.16 -4.14 0.00 0.00 -0.57 0.00 0.00 43.02 38.16 2ppa s PHE 64 CO -0.09 -4.60 0.00 -1.71 -0.10 0.00 0.00 175.22 168.72 2ppa n ASN 65 N 5.36 -5.47 0.00 1.36 5.15 0.84 -2.30 115.26 120.20 2ppa n ASN 65 Ca 0.17 0.25 0.00 0.00 -0.60 0.00 0.00 54.58 54.40 2ppa n ASN 65 Cb 0.38 -3.86 0.00 0.00 -0.53 0.00 0.00 39.78 35.77 2ppa n ASN 65 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2ppa n GLY 66 N -0.08 0.83 3.38 8.20 0.00 -0.94 -4.92 105.19 111.66 2ppa n GLY 66 Ca -0.10 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.68 2ppa n GLY 66 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2ppa s THR 67 N -3.25 2.09 -0.25 2.61 -4.23 -0.97 -4.95 115.64 106.68 2ppa s THR 67 Ca 0.00 -1.99 0.02 0.00 -1.18 0.00 0.00 61.69 58.55 2ppa s THR 67 Cb 0.00 -1.99 0.06 0.00 1.34 0.00 0.00 72.50 71.91 2ppa s THR 67 CO 0.00 -0.22 -0.09 -0.69 -0.54 0.00 0.00 174.62 173.08 2ppa s VAL 68 N -1.88 1.92 0.86 2.29 1.01 -1.26 -2.92 120.40 120.42 2ppa s VAL 68 Ca 0.18 -1.47 -0.12 0.00 0.00 0.00 0.00 61.98 60.57 2ppa s VAL 68 Cb -0.07 -2.09 0.11 0.00 0.00 0.00 0.00 36.38 34.33 2ppa s VAL 68 CO 0.08 -0.05 1.14 -2.16 0.00 0.00 0.00 175.10 174.11 2ppa s PRO 69 N 1.21 1.57 0.89 2.72 0.04 -1.26 -2.02 135.00 138.15 2ppa s PRO 69 Ca -0.08 0.29 -0.11 0.00 0.04 0.00 0.00 61.00 61.15 2ppa s PRO 69 Cb -0.20 -1.89 0.13 0.00 0.04 0.00 0.00 34.50 32.59 2ppa s PRO 69 CO -0.05 -1.90 1.16 0.20 0.04 0.00 0.00 177.00 176.44 2ppa s GLY 70 N -4.18 1.77 0.74 0.56 0.00 0.15 -4.71 107.32 101.65 2ppa s GLY 70 Ca 0.63 0.63 -0.13 0.00 0.00 0.00 0.00 44.72 45.85 2ppa s GLY 70 CO 0.52 1.05 1.12 2.56 0.00 0.00 0.00 173.10 178.35 2ppa s PRO 71 N -4.56 2.27 -0.09 2.90 0.04 -1.26 -4.39 135.00 129.91 2ppa s PRO 71 Ca 0.68 1.40 -0.26 0.00 0.04 0.00 0.00 61.00 62.85 2ppa s PRO 71 Cb -0.24 -1.88 -0.03 0.00 0.04 0.00 0.00 34.50 32.39 2ppa s PRO 71 CO 0.57 -1.67 0.85 -1.17 0.04 0.00 0.00 177.00 175.62 2ppa s LEU 72 N -5.51 4.28 -0.16 -3.56 2.96 -1.26 -4.27 118.68 111.16 2ppa s LEU 72 Ca 0.66 1.35 -0.06 0.00 -0.22 0.00 0.00 54.13 55.86 2ppa s LEU 72 Cb -0.21 -3.31 -0.04 0.00 0.50 0.00 0.00 46.19 43.13 2ppa s LEU 72 CO 0.49 -0.28 0.06 -0.04 -1.32 0.00 0.00 176.35 175.26 2ppa s MET 73 N 1.41 3.73 -0.13 1.98 -1.94 -1.15 -4.57 119.30 118.63 2ppa s MET 73 Ca 0.43 -0.34 0.03 0.00 -1.71 0.00 0.00 55.69 54.10 2ppa s MET 73 Cb -0.18 -3.12 0.01 0.00 2.01 0.00 0.00 34.83 33.54 2ppa s MET 73 CO 0.19 0.41 -0.21 0.08 -0.01 0.00 0.00 175.02 175.48 2ppa s VAL 74 N -0.03 1.97 0.31 -6.03 1.01 -1.26 -0.36 120.40 116.02 2ppa s VAL 74 Ca 0.06 -0.94 0.05 0.00 0.00 0.00 0.00 61.98 61.15 2ppa s VAL 74 Cb -0.12 -1.74 -0.03 0.00 0.00 0.00 0.00 36.38 34.48 2ppa s VAL 74 CO 0.01 0.54 0.23 0.68 0.00 0.00 0.00 175.10 176.55 2ppa s VAL 75 N 0.75 0.08 0.25 2.92 -7.23 -0.27 -4.99 120.40 111.91 2ppa s VAL 75 Ca -0.09 -2.00 0.09 0.00 -1.81 0.00 0.00 61.98 58.17 2ppa s VAL 75 Cb -0.16 -2.49 -0.04 0.00 0.56 0.00 0.00 36.38 34.25 2ppa s VAL 75 CO 0.00 0.00 0.02 -1.00 -0.31 0.00 0.00 175.10 173.81 2ppa s HIS 76 N -3.57 2.76 0.19 2.82 3.76 -1.26 -0.84 115.29 119.15 2ppa s HIS 76 Ca 0.39 -0.20 -0.33 0.00 -0.15 0.00 0.00 55.06 54.77 2ppa s HIS 76 Cb 0.03 -1.24 -0.14 0.00 1.11 0.00 0.00 32.58 32.34 2ppa s HIS 76 CO 0.23 0.60 1.37 0.94 -0.85 0.00 0.00 174.74 177.03 2ppa n GLN 77 N -0.84 1.75 -0.93 1.40 7.27 0.24 -1.26 117.38 125.01 2ppa n GLN 77 Ca -0.07 0.63 0.00 0.00 0.07 0.00 0.00 57.00 57.63 2ppa n GLN 77 Cb 0.58 -2.26 0.00 0.00 2.41 0.00 0.00 30.24 30.97 2ppa n GLN 77 CO 0.00 0.00 0.00 -0.25 0.07 0.00 0.00 177.06 176.88 2ppa n ASP 78 N 2.39 -1.96 -4.77 1.69 10.43 0.22 -4.73 116.55 119.82 2ppa n ASP 78 Ca 0.14 0.00 -0.29 0.00 2.57 0.00 0.00 54.79 57.21 2ppa n ASP 78 Cb 0.28 -1.05 0.13 0.00 1.84 0.00 0.00 41.12 42.32 2ppa n ASP 78 CO 0.00 0.00 0.00 -1.81 -1.07 0.00 0.00 177.20 174.32 2ppa s ASP 79 N -2.35 3.72 -0.08 -2.24 -0.00 -0.39 -4.62 116.67 110.71 2ppa s ASP 79 Ca 0.00 1.20 -0.00 0.00 -0.00 0.00 0.00 52.55 53.75 2ppa s ASP 79 Cb 0.00 -1.87 -0.03 0.00 -0.00 0.00 0.00 42.92 41.02 2ppa s ASP 79 CO 0.00 -2.45 -0.04 -0.31 -0.00 0.00 0.00 175.17 172.37 2ppa s TYR 80 N -3.13 3.03 -0.25 4.23 1.51 -0.25 -0.94 117.35 121.56 2ppa s TYR 80 Ca 0.63 0.09 -0.11 0.00 -1.01 0.00 0.00 57.07 56.67 2ppa s TYR 80 Cb -0.16 -1.75 -0.05 0.00 -0.11 0.00 0.00 41.96 39.90 2ppa s TYR 80 CO 0.55 0.38 0.17 -1.17 -1.11 0.00 0.00 175.55 174.37 2ppa s LEU 81 N -0.82 4.09 -0.33 -1.29 0.20 -0.03 -0.53 118.68 119.98 2ppa s LEU 81 Ca 0.12 0.09 0.03 0.00 0.69 0.00 0.00 54.13 55.07 2ppa s LEU 81 Cb -0.11 -2.12 0.09 0.00 -0.43 0.00 0.00 46.19 43.62 2ppa s LEU 81 CO 0.02 0.03 0.03 -0.70 -0.29 0.00 0.00 176.35 175.44 2ppa s GLU 82 N 1.23 1.52 -0.22 1.98 2.12 -0.04 -1.44 118.70 123.85 2ppa s GLU 82 Ca 0.08 -1.75 -0.09 0.00 0.36 0.00 0.00 54.97 53.56 2ppa s GLU 82 Cb -0.14 -3.08 -0.05 0.00 0.26 0.00 0.00 34.13 31.12 2ppa s GLU 82 CO 0.06 -0.89 0.12 -1.17 -0.54 0.00 0.00 175.26 172.84 2ppa s LEU 83 N 0.98 4.01 -0.29 2.70 2.96 0.01 -1.53 118.68 127.53 2ppa s LEU 83 Ca 0.08 0.10 -0.17 0.00 -0.22 0.00 0.00 54.13 53.93 2ppa s LEU 83 Cb -0.19 -2.06 -0.02 0.00 0.50 0.00 0.00 46.19 44.42 2ppa s LEU 83 CO -0.09 0.10 0.46 -0.89 -1.32 0.00 0.00 176.35 174.62 2ppa s THR 84 N 0.81 5.10 -0.14 3.68 2.01 0.05 -1.11 115.64 126.03 2ppa s THR 84 Ca 0.06 0.63 -0.00 0.00 0.31 0.00 0.00 61.69 62.69 2ppa s THR 84 Cb -0.13 -3.81 -0.01 0.00 0.01 0.00 0.00 72.50 68.56 2ppa s THR 84 CO 0.02 0.04 -0.13 -0.22 -0.69 0.00 0.00 174.62 173.64 2ppa s LEU 85 N 2.24 2.66 -0.08 4.42 2.96 -0.08 -1.27 118.68 129.52 2ppa s LEU 85 Ca 0.18 -0.37 0.04 0.00 -0.22 0.00 0.00 54.13 53.76 2ppa s LEU 85 Cb -0.16 -1.61 -0.00 0.00 0.50 0.00 0.00 46.19 44.93 2ppa s LEU 85 CO 0.10 0.13 -0.22 -0.63 -1.32 0.00 0.00 176.35 174.41 2ppa s ILE 86 N 0.55 1.89 -0.38 6.68 1.01 -0.53 -1.24 121.20 129.18 2ppa s ILE 86 Ca -0.08 -0.93 0.02 0.00 0.00 0.00 0.00 60.65 59.65 2ppa s ILE 86 Cb -0.16 -1.63 0.11 0.00 0.01 0.00 0.00 42.46 40.79 2ppa s ILE 86 CO 0.04 0.52 0.12 0.21 0.00 0.00 0.00 174.94 175.83 2ppa s ASN 87 N 0.26 4.88 0.68 3.58 2.47 0.18 -1.31 114.94 125.68 2ppa s ASN 87 Ca -0.14 -2.22 -0.16 0.00 0.42 0.00 0.00 52.86 50.75 2ppa s ASN 87 Cb -0.16 -1.69 0.01 0.00 -1.45 0.00 0.00 41.25 37.96 2ppa s ASN 87 CO 0.07 -0.41 1.23 -2.84 -3.72 0.00 0.00 177.10 171.43 2ppa s PRO 88 N 0.83 2.41 0.12 0.43 0.02 -1.26 0.10 135.00 137.65 2ppa s PRO 88 Ca 0.11 1.85 0.14 0.00 0.02 0.00 0.00 61.00 63.12 2ppa s PRO 88 Cb -0.21 -1.86 0.64 0.00 0.02 0.00 0.00 34.50 33.10 2ppa s PRO 88 CO -0.06 -1.65 1.43 -0.85 -0.33 0.00 0.00 177.00 175.54 2ppa n GLU 89 N -2.29 0.07 0.21 5.54 0.28 -1.26 -1.82 120.64 121.37 2ppa n GLU 89 Ca 0.14 0.43 0.10 0.00 -0.16 0.00 0.00 57.16 57.66 2ppa n GLU 89 Cb 0.50 -1.67 0.26 0.00 1.43 0.00 0.00 31.44 31.96 2ppa n GLU 89 CO 0.00 0.00 0.00 1.79 -0.16 0.00 0.00 177.13 178.76 2ppa h THR 90 N 0.00 0.33 -4.19 3.84 1.35 -1.94 -3.44 112.91 108.86 2ppa h THR 90 Ca 0.00 -1.27 -0.49 0.00 -0.55 0.00 0.00 66.41 64.10 2ppa h THR 90 Cb 0.17 1.99 0.13 0.00 -1.73 0.00 0.00 68.15 68.71 2ppa h THR 90 CO 0.00 0.17 0.29 0.20 -0.25 0.00 0.00 175.52 175.93 2ppa s ASN 91 N -6.19 4.02 -0.00 5.36 0.01 -0.75 -5.01 114.94 112.37 2ppa s ASN 91 Ca 0.04 1.50 0.04 0.00 -0.71 0.00 0.00 52.86 53.73 2ppa s ASN 91 Cb 0.07 -2.21 -0.05 0.00 0.41 0.00 0.00 41.25 39.47 2ppa s ASN 91 CO 0.66 -2.30 0.15 1.07 -1.51 0.00 0.00 177.10 175.18 2ppa n THR 92 N -3.66 0.00 -4.25 1.60 5.66 -1.26 -4.74 114.28 107.62 2ppa n THR 92 Ca 0.07 -0.31 -0.29 0.00 -3.05 0.00 0.00 64.05 60.48 2ppa n THR 92 Cb 0.55 0.82 -0.10 0.00 -1.55 0.00 0.00 70.33 70.05 2ppa n THR 92 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 175.07 171.26 2ppa s LEU 93 N -2.54 2.96 0.35 1.09 1.43 -1.26 -4.91 118.68 115.79 2ppa s LEU 93 Ca 0.01 -0.46 -0.26 0.00 -1.03 0.00 0.00 54.13 52.38 2ppa s LEU 93 Cb 0.03 -1.74 -0.09 0.00 0.03 0.00 0.00 46.19 44.42 2ppa s LEU 93 CO 0.18 0.16 1.06 -0.32 0.23 0.00 0.00 176.35 177.66 2ppa s MET 94 N -2.34 4.38 0.16 1.70 -2.45 -1.26 -4.10 119.30 115.39 2ppa s MET 94 Ca 0.21 1.62 0.00 0.00 -1.25 0.00 0.00 55.69 56.28 2ppa s MET 94 Cb -0.10 -2.82 -0.04 0.00 1.25 0.00 0.00 34.83 33.11 2ppa s MET 94 CO 0.13 0.03 0.04 -1.01 1.05 0.00 0.00 175.02 175.26 2ppa s HIS 95 N -1.45 1.08 0.00 4.11 0.09 -0.70 -4.91 115.29 113.51 2ppa s HIS 95 Ca 0.52 -1.16 0.00 0.00 -0.00 0.00 0.00 55.06 54.42 2ppa s HIS 95 Cb -0.26 -0.61 0.00 0.00 -0.00 0.00 0.00 32.58 31.71 2ppa s HIS 95 CO 0.33 -0.39 0.00 0.27 -0.00 0.00 0.00 174.74 174.95 2ppa n ASN 96 N -0.20 0.00 -3.77 1.40 0.23 -1.26 -0.51 115.26 111.15 2ppa n ASN 96 Ca -0.05 -0.71 -0.13 0.00 -0.53 0.00 0.00 54.58 53.16 2ppa n ASN 96 Cb 0.64 0.00 -0.13 0.00 -2.08 0.00 0.00 39.78 38.20 2ppa n ASN 96 CO 0.00 0.00 0.00 -0.51 -0.93 0.00 0.00 177.26 175.82 2ppa s ILE 97 N -2.40 -0.03 -0.19 1.53 2.07 -1.26 -4.19 121.20 116.74 2ppa s ILE 97 Ca 0.00 0.10 -0.01 0.00 -1.41 0.00 0.00 60.65 59.34 2ppa s ILE 97 Cb 0.00 -0.26 0.01 0.00 0.13 0.00 0.00 42.46 42.34 2ppa s ILE 97 CO 0.00 0.04 -0.14 -1.81 -1.91 0.00 0.00 174.94 171.12 2ppa s ASP 98 N 0.75 3.64 -0.27 4.50 -0.00 0.96 -1.48 116.67 124.77 2ppa s ASP 98 Ca -0.05 -0.52 -0.10 0.00 -0.00 0.00 0.00 52.55 51.87 2ppa s ASP 98 Cb -0.07 -1.58 -0.04 0.00 -0.00 0.00 0.00 42.92 41.22 2ppa s ASP 98 CO -0.04 0.02 0.16 -0.36 -0.00 0.00 0.00 175.17 174.95 2ppa s PHE 99 N 1.22 3.19 0.44 4.23 0.40 0.26 -1.16 117.98 126.57 2ppa s PHE 99 Ca 0.02 -0.01 0.40 0.00 -0.60 0.00 0.00 56.93 56.74 2ppa s PHE 99 Cb -0.14 -2.34 1.98 0.00 0.51 0.00 0.00 43.02 43.03 2ppa s PHE 99 CO -0.06 -0.20 2.21 0.45 0.70 0.00 0.00 175.22 178.32 2ppa h HIS 100 N 8.30 0.00 0.00 0.36 3.86 -1.50 -2.17 115.15 124.00 2ppa h HIS 100 Ca -0.36 0.00 -0.02 0.00 -1.16 0.00 0.00 60.37 58.83 2ppa h HIS 100 Cb 1.19 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 29.65 2ppa h HIS 100 CO 0.73 0.01 -0.10 0.00 0.86 0.00 0.00 177.93 179.43 2ppa h ALA 101 N 1.99 1.00 -2.06 2.45 0.00 -1.90 -3.47 119.26 117.27 2ppa h ALA 101 Ca -0.00 -0.09 -0.46 0.00 0.00 0.00 0.00 54.91 54.36 2ppa h ALA 101 Cb 0.21 -0.02 0.03 0.00 0.00 0.00 0.00 17.79 18.01 2ppa h ALA 101 CO 0.00 0.13 -0.09 0.00 0.00 0.00 0.00 179.25 179.29 2ppa s ALA 102 N -3.60 3.75 -0.11 0.00 0.00 -0.82 -4.56 121.76 116.43 2ppa s ALA 102 Ca 0.02 -1.06 0.01 0.00 0.00 0.00 0.00 51.96 50.92 2ppa s ALA 102 Cb 0.09 -2.15 0.02 0.00 0.00 0.00 0.00 23.12 21.08 2ppa s ALA 102 CO 0.60 -0.40 -0.11 0.99 0.00 0.00 0.00 175.76 176.84 2ppa s THR 103 N -2.57 1.24 0.00 0.00 2.01 -1.26 -4.70 115.64 110.36 2ppa s THR 103 Ca 0.49 -0.46 0.00 0.00 0.31 0.00 0.00 61.69 62.03 2ppa s THR 103 Cb -0.10 -1.19 0.00 0.00 0.01 0.00 0.00 72.50 71.22 2ppa s THR 103 CO 0.38 0.40 0.00 0.61 -0.69 0.00 0.00 174.62 175.32 2ppa n GLY 104 N 4.60 2.78 4.07 4.40 0.00 -1.26 -4.92 105.19 114.85 2ppa n GLY 104 Ca -0.16 -1.88 -0.29 0.00 0.00 0.00 0.00 46.02 43.69 2ppa n GLY 104 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ppa n ALA 105 N 0.44 -1.79 -1.70 4.61 0.00 -1.26 -0.33 120.51 120.49 2ppa n ALA 105 Ca 0.00 -0.21 -0.21 0.00 0.00 0.00 0.00 53.44 53.03 2ppa n ALA 105 Cb 0.00 -2.01 -0.08 0.00 0.00 0.00 0.00 19.45 17.36 2ppa n ALA 105 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2ppa n LEU 106 N -4.42 -1.55 0.00 0.00 4.77 -1.26 -0.90 117.00 113.64 2ppa n LEU 106 Ca -0.20 0.44 0.00 0.00 -0.03 0.00 0.00 56.01 56.22 2ppa n LEU 106 Cb 0.63 -2.84 0.00 0.00 -2.33 0.00 0.00 43.42 38.88 2ppa n LEU 106 CO 0.79 -0.97 0.00 0.61 -1.33 0.00 0.00 177.39 176.50 2ppa n GLY 107 N -0.52 0.60 0.00 -0.72 0.00 0.55 -4.24 105.19 100.86 2ppa n GLY 107 Ca -0.21 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.81 2ppa n GLY 107 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ppa n GLY 108 N -2.01 1.85 0.33 -0.02 0.00 -0.08 -0.57 105.19 104.70 2ppa n GLY 108 Ca 0.00 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.04 2ppa n GLY 108 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2ppa h GLY 109 N 0.00 0.88 2.00 -0.02 0.00 -0.63 -1.65 103.07 103.64 2ppa h GLY 109 Ca 0.00 -0.32 -0.01 0.00 0.00 0.00 0.00 47.33 47.00 2ppa h GLY 109 CO 0.00 0.31 -0.04 -1.33 0.00 0.00 0.00 176.54 175.49 2ppa h GLY 110 N 0.84 0.00 -1.00 4.60 0.00 -1.70 -2.98 103.07 102.83 2ppa h GLY 110 Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.56 2ppa h GLY 110 CO -0.05 0.00 -0.05 1.04 0.00 0.00 0.00 176.54 177.47 2ppa n LEU 111 N -3.24 2.00 -0.39 3.11 4.77 -0.65 -4.65 117.00 117.95 2ppa n LEU 111 Ca -0.01 -0.95 0.04 0.00 -0.03 0.00 0.00 56.01 55.06 2ppa n LEU 111 Cb 0.21 0.00 0.06 0.00 -2.33 0.00 0.00 43.42 41.36 2ppa n LEU 111 CO 0.26 0.37 0.37 0.35 -1.33 0.00 0.00 177.39 177.40 2ppa n THR 112 N 0.58 0.82 -2.02 -5.08 -2.24 -1.05 -4.93 114.28 100.36 2ppa n THR 112 Ca 0.07 -1.06 -0.41 0.00 -2.27 0.00 0.00 64.05 60.38 2ppa n THR 112 Cb 0.33 0.21 -0.03 0.00 -2.10 0.00 0.00 70.33 68.74 2ppa n THR 112 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 2ppa s GLU 113 N -1.24 3.12 -0.17 -0.78 2.02 -1.24 -4.17 118.70 116.24 2ppa s GLU 113 Ca 0.16 1.18 0.01 0.00 0.02 0.00 0.00 54.97 56.34 2ppa s GLU 113 Cb 0.14 -4.25 0.02 0.00 0.10 0.00 0.00 34.13 30.14 2ppa s GLU 113 CO -0.00 -2.12 -0.20 0.96 0.02 0.00 0.00 175.26 173.92 2ppa s ILE 114 N 7.56 2.07 0.75 -1.63 -4.36 0.33 -4.97 121.20 120.95 2ppa s ILE 114 Ca 0.76 -0.95 -0.11 0.00 -0.26 0.00 0.00 60.65 60.09 2ppa s ILE 114 Cb -0.19 -1.86 0.04 0.00 1.25 0.00 0.00 42.46 41.70 2ppa s ILE 114 CO 0.30 0.54 1.08 0.20 0.24 0.00 0.00 174.94 177.30 2ppa s ASN 115 N 1.16 4.93 0.16 4.36 -0.87 -1.26 -1.73 114.94 121.69 2ppa s ASN 115 Ca 0.02 1.49 -0.34 0.00 -1.57 0.00 0.00 52.86 52.45 2ppa s ASN 115 Cb -0.14 -2.29 -0.15 0.00 -0.02 0.00 0.00 41.25 38.65 2ppa s ASN 115 CO -0.10 -1.71 1.35 -2.65 -2.57 0.00 0.00 177.10 171.42 2ppa n PRO 116 N -3.29 1.54 -0.54 -0.60 -0.02 -1.26 -0.99 135.00 129.84 2ppa n PRO 116 Ca 0.07 0.55 0.00 0.00 -2.02 0.00 0.00 63.50 62.10 2ppa n PRO 116 Cb 0.55 -2.18 0.00 0.00 -0.02 0.00 0.00 33.50 31.85 2ppa n PRO 116 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2ppa n GLY 117 N 2.46 0.75 3.53 -1.23 0.00 0.28 -4.68 105.19 106.30 2ppa n GLY 117 Ca 0.16 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.90 2ppa n GLY 117 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2ppa s GLU 118 N -0.46 1.90 0.32 1.61 2.02 -0.16 -4.89 118.70 119.03 2ppa s GLU 118 Ca 0.00 -1.31 0.04 0.00 0.02 0.00 0.00 54.97 53.71 2ppa s GLU 118 Cb 0.00 -2.08 -0.06 0.00 0.10 0.00 0.00 34.13 32.08 2ppa s GLU 118 CO 0.00 0.43 0.06 -1.59 0.02 0.00 0.00 175.26 174.18 2ppa s LYS 119 N -2.70 1.63 0.07 1.61 -2.85 -1.26 -0.65 119.74 115.58 2ppa s LYS 119 Ca 0.23 -1.90 -0.17 0.00 -1.00 0.00 0.00 55.97 53.13 2ppa s LYS 119 Cb -0.09 -0.82 0.04 0.00 -2.06 0.00 0.00 37.83 34.90 2ppa s LYS 119 CO 0.13 -0.19 0.41 -0.08 0.10 0.00 0.00 175.35 175.72 2ppa s THR 120 N -3.33 0.06 -0.13 3.79 -1.32 -0.37 -5.00 115.64 109.34 2ppa s THR 120 Ca 0.36 -0.50 -0.00 0.00 -1.21 0.00 0.00 61.69 60.34 2ppa s THR 120 Cb 0.09 -1.03 0.03 0.00 -1.51 0.00 0.00 72.50 70.07 2ppa s THR 120 CO 0.15 -0.27 -0.08 -0.63 -2.21 0.00 0.00 174.62 171.58 2ppa s ILE 121 N -2.94 1.10 -0.11 5.08 1.01 -1.26 -0.90 121.20 123.17 2ppa s ILE 121 Ca -0.02 -0.39 -0.01 0.00 0.00 0.00 0.00 60.65 60.23 2ppa s ILE 121 Cb 0.00 -1.14 -0.02 0.00 0.01 0.00 0.00 42.46 41.31 2ppa s ILE 121 CO -0.06 0.33 -0.08 -0.22 0.00 0.00 0.00 174.94 174.91 2ppa s LEU 122 N 1.67 3.02 -0.06 2.97 2.96 -0.27 -4.96 118.68 124.02 2ppa s LEU 122 Ca 0.04 -0.16 0.06 0.00 -0.22 0.00 0.00 54.13 53.86 2ppa s LEU 122 Cb -0.13 -1.68 -0.01 0.00 0.50 0.00 0.00 46.19 44.87 2ppa s LEU 122 CO -0.08 0.25 -0.25 -0.60 -1.32 0.00 0.00 176.35 174.35 2ppa s ARG 123 N -0.12 2.53 0.03 1.98 3.52 -1.26 -0.81 118.95 124.82 2ppa s ARG 123 Ca 0.01 -0.90 0.00 0.00 -0.13 0.00 0.00 55.73 54.71 2ppa s ARG 123 Cb -0.13 -2.16 -0.03 0.00 -1.56 0.00 0.00 34.95 31.07 2ppa s ARG 123 CO 0.03 0.40 -0.04 -0.59 -0.81 0.00 0.00 175.30 174.29 2ppa s PHE 124 N -0.20 0.40 -0.10 5.12 -0.12 -0.52 -4.99 117.98 117.57 2ppa s PHE 124 Ca -0.02 -0.68 -0.22 0.00 -0.05 0.00 0.00 56.93 55.96 2ppa s PHE 124 Cb -0.13 -0.28 -0.03 0.00 -0.63 0.00 0.00 43.02 41.94 2ppa s PHE 124 CO 0.03 -0.22 0.66 0.21 -0.05 0.00 0.00 175.22 175.85 2ppa s LYS 125 N -2.20 4.38 -1.11 1.99 2.20 -1.26 -0.85 119.74 122.89 2ppa s LYS 125 Ca -0.08 0.77 -0.16 0.00 -0.36 0.00 0.00 55.97 56.14 2ppa s LYS 125 Cb -0.05 -3.47 0.14 0.00 -1.51 0.00 0.00 37.83 32.95 2ppa s LYS 125 CO -0.03 0.02 1.36 0.00 -0.36 0.00 0.00 175.35 176.33 2ppa s ALA 126 N 0.99 3.67 -0.50 3.13 0.00 -0.11 -4.82 121.76 124.11 2ppa s ALA 126 Ca 0.34 -3.07 0.24 0.00 0.00 0.00 0.00 51.96 49.47 2ppa s ALA 126 Cb -0.17 -4.16 0.44 0.00 0.00 0.00 0.00 23.12 19.23 2ppa s ALA 126 CO 0.15 -2.93 1.64 1.79 0.00 0.00 0.00 175.76 176.42 2ppa h THR 127 N 5.24 0.00 -3.65 0.00 1.35 -1.85 0.65 112.91 114.64 2ppa h THR 127 Ca 0.27 -0.88 -0.56 0.00 -0.55 0.00 0.00 66.41 64.68 2ppa h THR 127 Cb 0.93 1.88 -0.32 0.00 -1.73 0.00 0.00 68.15 68.91 2ppa h THR 127 CO 1.22 0.00 -0.83 -0.54 -0.25 0.00 0.00 175.52 175.12 2ppa s LYS 128 N -3.19 1.93 0.16 4.72 1.02 -1.26 -4.73 119.74 118.39 2ppa s LYS 128 Ca 0.08 -0.58 -0.30 0.00 0.02 0.00 0.00 55.97 55.19 2ppa s LYS 128 Cb 0.07 -1.60 -0.07 0.00 -0.52 0.00 0.00 37.83 35.71 2ppa s LYS 128 CO 0.65 0.16 0.99 -1.25 -0.92 0.00 0.00 175.35 174.98 2ppa s PRO 129 N 0.30 4.71 0.00 -1.68 0.04 -1.26 -4.82 135.00 132.29 2ppa s PRO 129 Ca -0.10 1.53 0.00 0.00 0.04 0.00 0.00 61.00 62.47 2ppa s PRO 129 Cb -0.14 -3.33 0.00 0.00 0.04 0.00 0.00 34.50 31.07 2ppa s PRO 129 CO 0.04 0.25 0.00 0.41 0.04 0.00 0.00 177.00 177.74 2ppa n GLY 130 N 2.00 -0.52 3.86 0.56 0.00 0.69 -1.88 105.19 109.90 2ppa n GLY 130 Ca 0.01 -1.29 -0.37 0.00 0.00 0.00 0.00 46.02 44.37 2ppa n GLY 130 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2ppa s VAL 131 N -2.00 5.27 -0.00 1.61 -7.23 0.14 0.53 120.40 118.73 2ppa s VAL 131 Ca 0.00 0.44 -0.01 0.00 -1.81 0.00 0.00 61.98 60.60 2ppa s VAL 131 Cb 0.00 -3.56 -0.00 0.00 0.56 0.00 0.00 36.38 33.38 2ppa s VAL 131 CO 0.00 0.53 0.01 -0.36 -0.31 0.00 0.00 175.10 174.97 2ppa s PHE 132 N -1.13 0.05 0.51 2.82 0.08 -0.23 -4.46 117.98 115.63 2ppa s PHE 132 Ca 0.22 -0.10 -0.21 0.00 0.12 0.00 0.00 56.93 56.96 2ppa s PHE 132 Cb -0.14 -0.04 -0.06 0.00 -0.57 0.00 0.00 43.02 42.20 2ppa s PHE 132 CO 0.11 -0.07 1.16 0.08 -0.10 0.00 0.00 175.22 176.40 2ppa s VAL 133 N -0.41 3.04 0.08 -0.44 1.01 -1.26 -0.48 120.40 121.94 2ppa s VAL 133 Ca -0.05 0.71 0.06 0.00 0.00 0.00 0.00 61.98 62.70 2ppa s VAL 133 Cb -0.03 -3.32 -0.03 0.00 0.00 0.00 0.00 36.38 33.00 2ppa s VAL 133 CO -0.00 -0.09 -0.16 -0.72 0.00 0.00 0.00 175.10 174.13 2ppa s TYR 134 N -1.64 1.40 0.13 5.22 -0.85 -0.68 -1.33 117.35 119.59 2ppa s TYR 134 Ca 0.70 -0.45 -0.24 0.00 -0.52 0.00 0.00 57.07 56.56 2ppa s TYR 134 Cb -0.27 -0.78 0.07 0.00 0.38 0.00 0.00 41.96 41.36 2ppa s TYR 134 CO 0.31 0.11 0.60 -3.38 -1.52 0.00 0.00 175.55 171.66 2ppa s HIS 135 N -1.24 -0.53 0.48 -3.49 -3.43 -0.31 -0.43 115.29 106.34 2ppa s HIS 135 Ca 0.01 0.42 -0.22 0.00 -0.80 0.00 0.00 55.06 54.47 2ppa s HIS 135 Cb -0.10 0.51 -0.07 0.00 -1.43 0.00 0.00 32.58 31.49 2ppa s HIS 135 CO 0.03 -0.80 1.12 0.00 -2.00 0.00 0.00 174.74 173.09 2ppa n ALA 137 N -0.73 -1.22 -2.39 0.00 0.00 -1.26 -4.48 120.51 110.43 2ppa n ALA 137 Ca 0.09 -1.49 -0.42 0.00 0.00 0.00 0.00 53.44 51.62 2ppa n ALA 137 Cb 0.50 -1.32 -0.03 0.00 0.00 0.00 0.00 19.45 18.60 2ppa n ALA 137 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 2ppa s PRO 138 N 0.61 4.40 0.09 0.00 0.02 -1.26 -4.86 135.00 134.00 2ppa s PRO 138 Ca 0.32 1.81 -0.36 0.00 0.02 0.00 0.00 61.00 62.78 2ppa s PRO 138 Cb 0.21 -3.37 -0.16 0.00 0.02 0.00 0.00 34.50 31.19 2ppa s PRO 138 CO -0.22 -0.32 1.36 -2.30 -0.33 0.00 0.00 177.00 175.19 2ppa n PRO 139 N 4.15 1.23 -0.24 5.54 -0.02 -1.26 -0.88 135.00 143.52 2ppa n PRO 139 Ca 0.10 0.44 0.00 0.00 -2.02 0.00 0.00 63.50 62.02 2ppa n PRO 139 Cb 0.46 -2.10 0.00 0.00 -0.02 0.00 0.00 33.50 31.84 2ppa n PRO 139 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2ppa n GLY 140 N 2.59 2.06 1.65 -1.23 0.00 -1.26 -4.79 105.19 104.21 2ppa n GLY 140 Ca 0.18 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.24 2ppa n GLY 140 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2ppa n MET 141 N -2.00 0.31 0.45 1.61 2.81 -0.06 -4.98 117.12 115.27 2ppa n MET 141 Ca 0.00 -2.26 -0.18 0.00 -1.81 0.00 0.00 57.70 53.45 2ppa n MET 141 Cb 0.00 -0.29 -0.08 0.00 -0.71 0.00 0.00 33.22 32.14 2ppa n MET 141 CO 0.00 0.00 0.00 0.28 1.51 0.00 0.00 175.97 177.76 2ppa h VAL 142 N 6.57 0.00 -0.02 2.03 2.07 -1.81 -2.74 116.25 122.35 2ppa h VAL 142 Ca -0.21 -0.10 -0.02 0.00 0.82 0.00 0.00 66.70 67.19 2ppa h VAL 142 Cb 1.78 0.00 -0.00 0.00 -1.52 0.00 0.00 31.29 31.55 2ppa h VAL 142 CO 0.11 0.00 -0.10 1.55 0.02 0.00 0.00 177.57 179.15 2ppa h PRO 143 N -1.26 0.03 -0.46 1.57 0.13 -1.92 -2.26 132.00 127.84 2ppa h PRO 143 Ca -0.12 -0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.99 2ppa h PRO 143 Cb 0.89 -0.01 -0.02 0.00 0.13 0.00 0.00 31.00 31.99 2ppa h PRO 143 CO 0.19 0.13 0.23 2.35 -0.23 0.00 0.00 178.00 180.68 2ppa h TRP 144 N 0.03 0.65 -0.71 1.56 7.01 -1.94 0.14 115.95 122.69 2ppa h TRP 144 Ca 0.01 -0.03 -0.07 0.00 2.11 0.00 0.00 58.89 60.91 2ppa h TRP 144 Cb 0.20 -0.20 -0.03 0.00 -2.10 0.00 0.00 29.16 27.03 2ppa h TRP 144 CO 0.00 0.51 0.17 0.45 -2.79 0.00 0.00 178.44 176.78 2ppa h HIS 145 N 0.60 1.19 -0.21 2.65 3.86 -1.17 -2.43 115.15 119.64 2ppa h HIS 145 Ca 0.16 -0.14 -0.06 0.00 -1.16 0.00 0.00 60.37 59.17 2ppa h HIS 145 Cb 0.09 -0.34 -0.01 0.00 1.06 0.00 0.00 27.41 28.22 2ppa h HIS 145 CO -0.01 0.97 -0.11 0.28 0.86 0.00 0.00 177.93 179.91 2ppa h VAL 146 N 1.07 1.31 -0.02 2.45 2.07 -0.81 -2.27 116.25 120.05 2ppa h VAL 146 Ca 0.22 -1.19 0.00 0.00 0.82 0.00 0.00 66.70 66.56 2ppa h VAL 146 Cb 0.37 1.64 0.00 0.00 -1.52 0.00 0.00 31.29 31.78 2ppa h VAL 146 CO 0.00 0.36 0.00 1.33 0.02 0.00 0.00 177.57 179.28 2ppa n VAL 147 N -4.53 0.03 0.75 2.57 0.24 0.41 -1.32 118.33 116.47 2ppa n VAL 147 Ca -0.05 -0.07 0.10 0.00 -2.04 0.00 0.00 64.34 62.28 2ppa n VAL 147 Cb 0.34 -0.20 0.27 0.00 -1.47 0.00 0.00 33.84 32.78 2ppa n VAL 147 CO 0.00 0.00 0.00 -1.20 -2.14 0.00 0.00 176.83 173.49 2ppa n SER 148 N -0.63 2.36 0.00 -1.34 7.64 -0.92 -4.63 113.62 116.11 2ppa n SER 148 Ca 0.18 -1.89 0.00 0.00 1.01 0.00 0.00 58.87 58.17 2ppa n SER 148 Cb 0.14 -0.22 0.00 0.00 -1.01 0.00 0.00 64.21 63.12 2ppa n SER 148 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2ppa n GLY 149 N 1.25 0.92 2.85 0.23 0.00 -0.44 -1.58 105.19 108.43 2ppa n GLY 149 Ca 0.17 -0.02 -0.42 0.00 0.00 0.00 0.00 46.02 45.74 2ppa n GLY 149 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 2ppa n MET 150 N -2.15 3.90 -3.53 1.61 0.00 -0.88 -4.52 117.12 111.54 2ppa n MET 150 Ca 0.00 -3.74 -0.14 0.00 0.00 0.00 0.00 57.70 53.82 2ppa n MET 150 Cb 0.00 -2.81 -0.05 0.00 0.00 0.00 0.00 33.22 30.36 2ppa n MET 150 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 175.97 176.51 2ppa s ASN 151 N 0.25 -0.51 0.00 6.12 2.20 -1.26 -1.66 114.94 120.07 2ppa s ASN 151 Ca 0.39 0.26 0.00 0.00 -0.94 0.00 0.00 52.86 52.57 2ppa s ASN 151 Cb 0.10 0.52 0.00 0.00 -2.00 0.00 0.00 41.25 39.87 2ppa s ASN 151 CO 0.01 -0.74 0.00 0.61 -2.94 0.00 0.00 177.10 174.04 2ppa n GLY 152 N 0.37 3.72 3.40 0.45 0.00 0.43 -0.68 105.19 112.87 2ppa n GLY 152 Ca -0.18 -0.67 -0.10 0.00 0.00 0.00 0.00 46.02 45.07 2ppa n GLY 152 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ppa s ALA 153 N -1.20 -0.46 0.22 4.61 0.00 -1.26 -1.69 121.76 121.97 2ppa s ALA 153 Ca 0.00 -0.53 0.07 0.00 0.00 0.00 0.00 51.96 51.50 2ppa s ALA 153 Cb 0.00 0.81 -0.05 0.00 0.00 0.00 0.00 23.12 23.88 2ppa s ALA 153 CO 0.00 -0.70 -0.12 0.96 0.00 0.00 0.00 175.76 175.90 2ppa s ILE 154 N -3.91 1.69 -0.11 0.00 -4.36 0.37 -2.95 121.20 111.93 2ppa s ILE 154 Ca 0.12 -2.19 0.03 0.00 -0.26 0.00 0.00 60.65 58.36 2ppa s ILE 154 Cb 0.02 -2.15 0.00 0.00 1.25 0.00 0.00 42.46 41.58 2ppa s ILE 154 CO -0.03 -0.52 -0.22 -0.32 0.24 0.00 0.00 174.94 174.09 2ppa s MET 155 N -3.67 2.88 -0.46 0.37 -2.45 0.52 -1.07 119.30 115.42 2ppa s MET 155 Ca 0.24 -0.81 -0.06 0.00 -1.25 0.00 0.00 55.69 53.81 2ppa s MET 155 Cb 0.01 -2.23 0.12 0.00 1.25 0.00 0.00 34.83 33.97 2ppa s MET 155 CO 0.08 0.10 0.29 0.08 1.05 0.00 0.00 175.02 176.62 2ppa s VAL 156 N 0.53 3.72 0.38 10.11 1.01 0.19 -1.12 120.40 135.22 2ppa s VAL 156 Ca -0.15 -2.02 -0.24 0.00 0.00 0.00 0.00 61.98 59.57 2ppa s VAL 156 Cb -0.17 -3.49 -0.10 0.00 0.00 0.00 0.00 36.38 32.62 2ppa s VAL 156 CO 0.05 -0.74 0.98 -0.76 0.00 0.00 0.00 175.10 174.63 2ppa s LEU 157 N 1.13 4.15 0.63 3.92 1.43 -0.02 -0.22 118.68 129.70 2ppa s LEU 157 Ca 0.08 1.87 -0.18 0.00 -1.03 0.00 0.00 54.13 54.86 2ppa s LEU 157 Cb -0.24 -4.22 -0.02 0.00 0.03 0.00 0.00 46.19 41.74 2ppa s LEU 157 CO -0.03 -0.31 1.30 -2.84 0.23 0.00 0.00 176.35 174.71 2ppa s PRO 158 N -2.53 2.63 0.55 1.29 0.02 -1.26 -0.59 135.00 135.10 2ppa s PRO 158 Ca 0.56 2.09 0.21 0.00 0.02 0.00 0.00 61.00 63.88 2ppa s PRO 158 Cb -0.17 -1.90 1.47 0.00 0.02 0.00 0.00 34.50 33.93 2ppa s PRO 158 CO 0.22 -1.55 2.18 0.00 -0.33 0.00 0.00 177.00 177.52 2ppa h ARG 159 N 0.66 0.00 -0.66 5.54 3.08 -1.89 0.40 114.38 121.52 2ppa h ARG 159 Ca -0.51 0.00 -0.05 0.00 0.07 0.00 0.00 59.98 59.49 2ppa h ARG 159 Cb 1.33 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 31.36 2ppa h ARG 159 CO 0.54 0.00 0.06 0.39 -1.07 0.00 0.00 179.97 179.88 2ppa n GLU 160 N -4.28 4.31 -0.27 0.04 -0.58 -1.26 -0.40 120.64 118.20 2ppa n GLU 160 Ca -0.02 -2.85 0.04 0.00 -0.42 0.00 0.00 57.16 53.91 2ppa n GLU 160 Cb 0.12 -2.19 -0.01 0.00 -0.57 0.00 0.00 31.44 28.79 2ppa n GLU 160 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2ppa n GLY 161 N 0.41 -2.08 3.80 0.62 0.00 0.13 -4.78 105.19 103.29 2ppa n GLY 161 Ca 0.28 -1.41 -0.34 0.00 0.00 0.00 0.00 46.02 44.55 2ppa n GLY 161 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2ppa s LEU 162 N 0.00 3.75 0.05 0.99 1.43 -1.25 -4.43 118.68 119.21 2ppa s LEU 162 Ca 0.00 1.91 -0.00 0.00 -1.03 0.00 0.00 54.13 55.01 2ppa s LEU 162 Cb 0.00 -4.55 -0.03 0.00 0.03 0.00 0.00 46.19 41.63 2ppa s LEU 162 CO 0.00 -0.90 -0.04 -1.00 0.23 0.00 0.00 176.35 174.64 2ppa s HIS 163 N -2.10 0.50 0.49 0.29 3.76 -1.26 -1.11 115.29 115.86 2ppa s HIS 163 Ca 0.67 -0.83 -0.08 0.00 -0.15 0.00 0.00 55.06 54.67 2ppa s HIS 163 Cb -0.17 -0.35 0.11 0.00 1.11 0.00 0.00 32.58 33.29 2ppa s HIS 163 CO 0.25 -0.26 0.67 -0.40 -0.85 0.00 0.00 174.74 174.15 2ppa n ASP 164 N 0.68 0.08 0.02 1.40 3.85 -0.41 -4.82 116.55 117.35 2ppa n ASP 164 Ca -0.18 -1.26 0.04 0.00 -0.71 0.00 0.00 54.79 52.68 2ppa n ASP 164 Cb 0.58 -0.51 0.17 0.00 -1.35 0.00 0.00 41.12 40.02 2ppa n ASP 164 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 2ppa n GLY 165 N 0.59 -0.74 0.65 6.12 0.00 -1.26 -1.90 105.19 108.66 2ppa n GLY 165 Ca 0.08 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.17 2ppa n GLY 165 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2ppa n LYS 166 N -1.59 2.28 -1.00 1.61 5.02 -1.26 -4.98 118.16 118.25 2ppa n LYS 166 Ca 0.01 -1.88 0.00 0.00 -2.02 0.00 0.00 58.31 54.43 2ppa n LYS 166 Cb 0.07 -1.28 0.00 0.00 -0.02 0.00 0.00 35.03 33.80 2ppa n LYS 166 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2ppa n GLY 167 N 0.64 0.48 3.72 0.72 0.00 -0.80 -5.02 105.19 104.94 2ppa n GLY 167 Ca 0.11 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.72 2ppa n GLY 167 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ppa s LYS 168 N -0.16 4.55 0.31 1.61 -0.14 -1.26 -4.82 119.74 119.83 2ppa s LYS 168 Ca 0.00 1.63 -0.29 0.00 -1.36 0.00 0.00 55.97 55.95 2ppa s LYS 168 Cb 0.00 -3.36 -0.12 0.00 -1.68 0.00 0.00 37.83 32.68 2ppa s LYS 168 CO 0.00 -0.05 1.53 0.00 -0.76 0.00 0.00 175.35 176.07 2ppa n ALA 169 N 3.30 2.28 -3.75 5.17 0.00 -1.26 -1.29 120.51 124.96 2ppa n ALA 169 Ca 0.05 0.37 -0.34 0.00 0.00 0.00 0.00 53.44 53.52 2ppa n ALA 169 Cb 0.48 -2.42 -0.14 0.00 0.00 0.00 0.00 19.45 17.36 2ppa n ALA 169 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2ppa s LEU 170 N -0.86 3.27 -0.20 0.00 1.43 -0.27 -4.81 118.68 117.22 2ppa s LEU 170 Ca 0.61 -0.95 -0.01 0.00 -1.03 0.00 0.00 54.13 52.75 2ppa s LEU 170 Cb -0.51 -1.66 0.01 0.00 0.03 0.00 0.00 46.19 44.07 2ppa s LEU 170 CO 0.54 -0.15 -0.13 -0.89 0.23 0.00 0.00 176.35 175.95 2ppa s THR 171 N 1.30 2.53 0.37 5.49 2.01 -1.26 -3.97 115.64 122.11 2ppa s THR 171 Ca -0.01 -0.86 -0.12 0.00 0.31 0.00 0.00 61.69 61.01 2ppa s THR 171 Cb -0.17 -2.14 -0.08 0.00 0.01 0.00 0.00 72.50 70.12 2ppa s THR 171 CO -0.04 0.44 0.75 -0.72 -0.69 0.00 0.00 174.62 174.36 2ppa s TYR 172 N 1.34 3.43 0.02 4.92 -0.85 -1.26 -4.87 117.35 120.08 2ppa s TYR 172 Ca 0.04 1.12 0.06 0.00 -0.52 0.00 0.00 57.07 57.77 2ppa s TYR 172 Cb -0.14 -2.48 -0.24 0.00 0.38 0.00 0.00 41.96 39.48 2ppa s TYR 172 CO -0.09 -0.02 0.90 -0.44 -1.52 0.00 0.00 175.55 174.39 2ppa h ASP 173 N 1.70 0.11 -5.15 -0.18 3.32 -0.99 -3.48 116.42 111.75 2ppa h ASP 173 Ca -0.47 -0.17 -0.07 0.00 0.02 0.00 0.00 57.03 56.34 2ppa h ASP 173 Cb 1.18 -0.04 -0.12 0.00 0.22 0.00 0.00 39.33 40.57 2ppa h ASP 173 CO 0.65 1.14 -0.19 -1.59 -1.72 0.00 0.00 179.24 177.52 2ppa s LYS 174 N -2.64 1.10 -0.02 3.56 -2.85 -1.03 -5.03 119.74 112.84 2ppa s LYS 174 Ca -0.04 -0.93 0.01 0.00 -1.00 0.00 0.00 55.97 54.01 2ppa s LYS 174 Cb 0.08 0.42 0.01 0.00 -2.06 0.00 0.00 37.83 36.28 2ppa s LYS 174 CO 0.83 -0.42 -0.04 -1.50 0.10 0.00 0.00 175.35 174.32 2ppa s ILE 175 N -3.88 0.40 0.11 3.79 2.07 -1.26 -1.44 121.20 121.00 2ppa s ILE 175 Ca 0.09 -0.14 0.10 0.00 -1.41 0.00 0.00 60.65 59.29 2ppa s ILE 175 Cb 0.02 -0.38 -0.04 0.00 0.13 0.00 0.00 42.46 42.19 2ppa s ILE 175 CO -0.07 0.15 -0.26 -0.31 -1.91 0.00 0.00 174.94 172.55 2ppa s TYR 176 N 0.34 2.20 -0.26 3.50 2.02 -0.24 -4.48 117.35 120.43 2ppa s TYR 176 Ca -0.04 -0.39 -0.02 0.00 -0.37 0.00 0.00 57.07 56.25 2ppa s TYR 176 Cb -0.07 -1.21 0.03 0.00 -0.40 0.00 0.00 41.96 40.31 2ppa s TYR 176 CO -0.00 0.29 -0.04 -0.47 -1.57 0.00 0.00 175.55 173.75 2ppa s TYR 177 N -1.04 3.12 -0.38 2.71 5.04 0.18 -1.04 117.35 125.94 2ppa s TYR 177 Ca 0.12 -1.61 -0.13 0.00 -2.44 0.00 0.00 57.07 53.01 2ppa s TYR 177 Cb -0.10 -2.08 0.02 0.00 0.35 0.00 0.00 41.96 40.15 2ppa s TYR 177 CO 0.05 -0.74 0.25 0.08 -1.34 0.00 0.00 175.55 173.85 2ppa s VAL 178 N 1.31 4.91 -0.23 3.14 1.01 0.39 -4.18 120.40 126.75 2ppa s VAL 178 Ca -0.01 -0.72 -0.13 0.00 0.00 0.00 0.00 61.98 61.12 2ppa s VAL 178 Cb -0.17 -3.71 -0.05 0.00 0.00 0.00 0.00 36.38 32.45 2ppa s VAL 178 CO -0.03 -0.24 0.26 -0.83 0.00 0.00 0.00 175.10 174.26 2ppa s GLY 179 N 1.62 2.02 -0.17 4.51 0.00 -1.26 -1.96 107.32 112.07 2ppa s GLY 179 Ca 0.04 -0.75 -0.08 0.00 0.00 0.00 0.00 44.72 43.93 2ppa s GLY 179 CO 0.08 0.59 0.08 1.85 0.00 0.00 0.00 173.10 175.70 2ppa s GLU 180 N 1.22 3.91 -0.12 2.90 2.12 -0.62 -1.88 118.70 126.23 2ppa s GLU 180 Ca 0.12 -0.30 0.01 0.00 0.36 0.00 0.00 54.97 55.16 2ppa s GLU 180 Cb -0.14 -3.23 0.02 0.00 0.26 0.00 0.00 34.13 31.04 2ppa s GLU 180 CO 0.06 0.36 -0.14 -1.14 -0.54 0.00 0.00 175.26 173.86 2ppa s GLN 181 N 0.14 2.14 -0.17 4.30 2.00 0.58 -4.48 119.66 124.17 2ppa s GLN 181 Ca 0.06 -0.52 -0.23 0.00 -2.00 0.00 0.00 55.36 52.67 2ppa s GLN 181 Cb -0.12 -1.88 -0.02 0.00 0.80 0.00 0.00 33.01 31.78 2ppa s GLN 181 CO 0.00 -0.12 0.70 0.16 -0.50 0.00 0.00 175.29 175.53 2ppa s ASP 182 N 1.16 6.81 0.14 6.67 3.84 -1.26 -0.72 116.67 133.31 2ppa s ASP 182 Ca -0.03 0.99 0.09 0.00 -0.00 0.00 0.00 52.55 53.60 2ppa s ASP 182 Cb -0.14 -2.39 -0.04 0.00 -1.38 0.00 0.00 42.92 38.97 2ppa s ASP 182 CO -0.04 -0.29 -0.13 -0.36 -0.00 0.00 0.00 175.17 174.35 2ppa s PHE 183 N 1.81 2.62 -0.54 2.11 0.08 -0.14 -4.75 117.98 119.17 2ppa s PHE 183 Ca 0.33 -0.22 0.04 0.00 0.12 0.00 0.00 56.93 57.20 2ppa s PHE 183 Cb -0.16 -1.34 0.17 0.00 -0.57 0.00 0.00 43.02 41.11 2ppa s PHE 183 CO 0.12 0.45 0.39 0.71 -0.10 0.00 0.00 175.22 176.79 2ppa s TYR 184 N -1.40 2.25 -0.23 0.36 1.51 -1.26 -0.99 117.35 117.58 2ppa s TYR 184 Ca 0.22 -2.77 -0.16 0.00 -1.01 0.00 0.00 57.07 53.35 2ppa s TYR 184 Cb -0.10 -1.79 -0.04 0.00 -0.11 0.00 0.00 41.96 39.92 2ppa s TYR 184 CO 0.13 -0.70 0.42 0.08 -1.11 0.00 0.00 175.55 174.36 2ppa s VAL 185 N -0.55 5.16 0.57 0.71 1.01 -1.26 -4.76 120.40 121.28 2ppa s VAL 185 Ca 0.28 0.70 -0.21 0.00 0.00 0.00 0.00 61.98 62.75 2ppa s VAL 185 Cb -0.03 -3.74 -0.04 0.00 0.00 0.00 0.00 36.38 32.56 2ppa s VAL 185 CO -0.16 0.19 1.29 -2.65 0.00 0.00 0.00 175.10 173.76 2ppa n PRO 186 N 4.96 1.47 -4.43 2.72 -0.02 -1.26 -4.89 135.00 133.56 2ppa n PRO 186 Ca -0.07 0.55 -0.26 0.00 -2.02 0.00 0.00 63.50 61.69 2ppa n PRO 186 Cb 0.51 -2.50 -0.11 0.00 -0.02 0.00 0.00 33.50 31.38 2ppa n PRO 186 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 2ppa s ARG 187 N -2.93 1.55 0.89 -0.52 0.52 -1.26 -0.84 118.95 116.36 2ppa s ARG 187 Ca 0.74 -1.58 -0.11 0.00 -0.52 0.00 0.00 55.73 54.26 2ppa s ARG 187 Cb -0.42 -1.82 0.18 0.00 0.52 0.00 0.00 34.95 33.41 2ppa s ARG 187 CO 0.47 0.38 1.22 0.16 0.02 0.00 0.00 175.30 177.56 2ppa s ASP 188 N -2.86 3.47 0.00 0.23 1.47 0.15 -4.83 116.67 114.30 2ppa s ASP 188 Ca 0.23 0.02 0.15 0.00 1.18 0.00 0.00 52.55 54.13 2ppa s ASP 188 Cb -0.07 -0.15 0.78 0.00 -0.34 0.00 0.00 42.92 43.13 2ppa s ASP 188 CO 0.11 -2.48 1.43 -1.84 0.68 0.00 0.00 175.17 173.06 2ppa n GLU 189 N -3.47 0.22 -0.06 2.11 0.28 -1.26 -1.38 120.64 117.08 2ppa n GLU 189 Ca 0.16 0.14 0.12 0.00 -0.16 0.00 0.00 57.16 57.41 2ppa n GLU 189 Cb 0.60 -1.50 0.27 0.00 1.43 0.00 0.00 31.44 32.24 2ppa n GLU 189 CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06 2ppa n ASN 190 N -1.28 2.54 0.00 -1.84 3.02 -1.26 -4.94 115.26 111.50 2ppa n ASN 190 Ca 0.07 -1.84 0.00 0.00 -0.03 0.00 0.00 54.58 52.79 2ppa n ASN 190 Cb 0.12 -0.08 0.00 0.00 -0.61 0.00 0.00 39.78 39.21 2ppa n ASN 190 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2ppa n GLY 191 N 1.31 0.75 3.72 7.41 0.00 -0.48 -5.04 105.19 112.87 2ppa n GLY 191 Ca 0.17 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.79 2ppa n GLY 191 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ppa s LYS 192 N -0.29 4.48 0.31 1.61 3.01 -1.26 -4.79 119.74 122.82 2ppa s LYS 192 Ca 0.00 1.04 -0.30 0.00 -1.01 0.00 0.00 55.97 55.71 2ppa s LYS 192 Cb 0.00 -3.43 -0.11 0.00 -1.01 0.00 0.00 37.83 33.28 2ppa s LYS 192 CO 0.00 0.10 1.56 0.71 0.51 0.00 0.00 175.35 178.23 2ppa s TYR 193 N 0.61 2.74 0.36 3.18 1.51 -1.26 -0.67 117.35 123.81 2ppa s TYR 193 Ca 0.41 0.89 -0.13 0.00 -1.01 0.00 0.00 57.07 57.22 2ppa s TYR 193 Cb -0.19 -4.04 -0.08 0.00 -0.11 0.00 0.00 41.96 37.54 2ppa s TYR 193 CO 0.21 -3.38 0.75 0.15 -1.11 0.00 0.00 175.55 172.18 2ppa s LYS 194 N -0.87 3.92 0.09 -0.62 1.02 -0.02 -4.84 119.74 118.42 2ppa s LYS 194 Ca 0.60 0.60 0.08 0.00 0.02 0.00 0.00 55.97 57.28 2ppa s LYS 194 Cb -0.47 -2.41 -0.04 0.00 -0.52 0.00 0.00 37.83 34.40 2ppa s LYS 194 CO 0.51 0.07 -0.18 0.15 -0.92 0.00 0.00 175.35 174.99 2ppa s LYS 195 N -3.33 1.89 0.08 1.68 1.02 -1.26 -4.76 119.74 115.06 2ppa s LYS 195 Ca 0.53 -1.11 0.05 0.00 0.02 0.00 0.00 55.97 55.47 2ppa s LYS 195 Cb -0.10 -2.15 -0.03 0.00 -0.52 0.00 0.00 37.83 35.03 2ppa s LYS 195 CO 0.23 0.50 -0.14 0.71 -0.92 0.00 0.00 175.35 175.73 2ppa s TYR 196 N -1.07 1.19 0.09 3.18 2.02 -1.26 -5.07 117.35 116.43 2ppa s TYR 196 Ca 0.17 -0.48 -0.14 0.00 -0.37 0.00 0.00 57.07 56.25 2ppa s TYR 196 Cb -0.11 -0.66 -0.15 0.00 -0.40 0.00 0.00 41.96 40.64 2ppa s TYR 196 CO 0.09 0.05 1.30 0.93 -1.57 0.00 0.00 175.55 176.35 2ppa h GLU 197 N 4.19 0.74 -4.99 -0.62 5.08 -2.01 -3.47 114.58 113.51 2ppa h GLU 197 Ca -0.40 -0.58 -0.33 0.00 -1.00 0.00 0.00 59.36 57.05 2ppa h GLU 197 Cb 1.19 0.11 -0.18 0.00 0.50 0.00 0.00 28.75 30.38 2ppa h GLU 197 CO 0.42 1.19 -0.74 0.00 -1.00 0.00 0.00 179.01 178.89 2ppa s ALA 198 N -3.79 1.12 0.23 3.43 0.00 -1.26 -5.06 121.76 116.42 2ppa s ALA 198 Ca -0.11 -1.17 -0.07 0.00 0.00 0.00 0.00 51.96 50.60 2ppa s ALA 198 Cb 0.08 0.02 0.28 0.00 0.00 0.00 0.00 23.12 23.50 2ppa s ALA 198 CO 0.88 -0.02 1.83 -1.00 0.00 0.00 0.00 175.76 177.45 2ppa h PRO 199 N 3.62 0.82 -0.17 0.00 0.13 -1.95 -2.22 132.00 132.24 2ppa h PRO 199 Ca -0.37 -0.05 -0.00 0.00 -0.87 0.00 0.00 66.00 64.70 2ppa h PRO 199 Cb 1.19 -0.18 -0.01 0.00 0.13 0.00 0.00 31.00 32.13 2ppa h PRO 199 CO 0.52 0.54 0.09 0.78 -0.23 0.00 0.00 178.00 179.70 2ppa h GLY 200 N 0.84 0.24 2.00 1.56 0.00 -2.00 -1.96 103.07 103.75 2ppa h GLY 200 Ca 0.33 -0.09 -0.01 0.00 0.00 0.00 0.00 47.33 47.57 2ppa h GLY 200 CO -0.17 0.09 -0.03 -0.55 0.00 0.00 0.00 176.54 175.88 2ppa h ASP 201 N 0.23 0.00 0.66 0.19 3.45 -1.82 -2.04 116.42 117.09 2ppa h ASP 201 Ca 0.06 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.52 2ppa h ASP 201 Cb 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.77 2ppa h ASP 201 CO -0.01 0.03 -0.39 0.00 -1.57 0.00 0.00 179.24 177.29 2ppa n ALA 202 N -2.42 3.20 0.04 3.45 0.00 -0.74 -4.57 120.51 119.47 2ppa n ALA 202 Ca -0.03 -0.28 -0.13 0.00 0.00 0.00 0.00 53.44 53.00 2ppa n ALA 202 Cb 0.11 -1.21 -0.06 0.00 0.00 0.00 0.00 19.45 18.29 2ppa n ALA 202 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.50 176.58 2ppa h TYR 203 N 0.00 -1.16 -0.36 0.00 5.03 -1.38 0.26 116.97 119.36 2ppa h TYR 203 Ca 0.00 0.04 -0.05 0.00 2.58 0.00 0.00 58.73 61.30 2ppa h TYR 203 Cb 0.53 0.51 -0.01 0.00 1.55 0.00 0.00 36.73 39.31 2ppa h TYR 203 CO 0.00 -0.48 0.04 0.93 -1.32 0.00 0.00 178.16 177.33 2ppa h GLU 204 N -0.54 0.60 -0.58 1.82 5.08 -1.80 -0.91 114.58 118.24 2ppa h GLU 204 Ca 0.06 -0.17 -0.05 0.00 -1.00 0.00 0.00 59.36 58.20 2ppa h GLU 204 Cb 0.64 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.79 2ppa h GLU 204 CO -0.34 0.68 0.17 -0.44 -1.00 0.00 0.00 179.01 178.09 2ppa h ASP 205 N 0.43 0.82 -0.24 1.42 3.45 -1.82 -2.24 116.42 118.24 2ppa h ASP 205 Ca 0.11 -0.14 -0.13 0.00 0.43 0.00 0.00 57.03 57.30 2ppa h ASP 205 Cb 0.38 -0.21 -0.00 0.00 -0.56 0.00 0.00 39.33 38.94 2ppa h ASP 205 CO 0.01 0.78 -0.34 0.74 -1.57 0.00 0.00 179.24 178.85 2ppa h THR 206 N 0.85 1.31 -0.82 0.35 2.02 -0.65 -2.95 112.91 113.02 2ppa h THR 206 Ca 0.19 -1.54 0.02 0.00 0.77 0.00 0.00 66.41 65.85 2ppa h THR 206 Cb 0.26 1.73 -0.04 0.00 -1.74 0.00 0.00 68.15 68.36 2ppa h THR 206 CO -0.01 0.49 0.55 0.58 0.37 0.00 0.00 175.52 177.49 2ppa h VAL 207 N 0.37 1.19 -0.69 3.16 2.07 -1.05 0.11 116.25 121.41 2ppa h VAL 207 Ca 0.02 -0.37 0.05 0.00 0.82 0.00 0.00 66.70 67.22 2ppa h VAL 207 Cb 0.93 0.00 -0.05 0.00 -1.52 0.00 0.00 31.29 30.65 2ppa h VAL 207 CO 0.08 0.20 0.41 0.50 0.02 0.00 0.00 177.57 178.78 2ppa h LYS 208 N 1.09 0.75 -0.36 1.57 3.64 -1.30 -1.33 116.57 120.62 2ppa h LYS 208 Ca 0.31 -0.04 -0.07 0.00 -1.27 0.00 0.00 60.65 59.57 2ppa h LYS 208 Cb -0.08 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 31.56 2ppa h LYS 208 CO -0.08 0.49 -0.07 0.28 -2.27 0.00 0.00 179.45 177.81 2ppa h VAL 209 N 0.77 1.27 -0.97 2.00 2.07 -1.18 -3.12 116.25 117.10 2ppa h VAL 209 Ca 0.30 -1.12 0.11 0.00 0.82 0.00 0.00 66.70 66.81 2ppa h VAL 209 Cb 0.12 1.27 -0.08 0.00 -1.52 0.00 0.00 31.29 31.08 2ppa h VAL 209 CO -0.15 0.37 0.62 0.24 0.02 0.00 0.00 177.57 178.67 2ppa h MET 210 N 0.47 0.94 0.00 1.57 2.86 -0.36 -2.13 114.93 118.28 2ppa h MET 210 Ca 0.09 -0.06 -0.01 0.00 -2.06 0.00 0.00 59.70 57.66 2ppa h MET 210 Cb 0.56 -0.21 -0.00 0.00 0.06 0.00 0.00 31.60 32.01 2ppa h MET 210 CO 0.03 0.62 -0.07 0.00 1.06 0.00 0.00 176.91 178.56 2ppa h ARG 211 N 0.97 0.00 0.00 1.72 3.08 -1.19 -1.05 114.38 117.90 2ppa h ARG 211 Ca 0.47 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.52 2ppa h ARG 211 Cb 0.46 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.51 2ppa h ARG 211 CO -0.23 0.07 0.00 0.25 -1.07 0.00 0.00 179.97 178.99 2ppa n THR 212 N -3.25 0.80 -1.74 2.04 -2.24 -0.80 -4.89 114.28 104.19 2ppa n THR 212 Ca -0.00 0.16 -0.20 0.00 -2.27 0.00 0.00 64.05 61.73 2ppa n THR 212 Cb 0.28 -1.03 -0.07 0.00 -2.10 0.00 0.00 70.33 67.41 2ppa n THR 212 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2ppa n LEU 213 N -2.09 -1.53 -3.97 3.22 4.77 -0.40 -4.95 117.00 112.06 2ppa n LEU 213 Ca 0.03 0.40 -0.31 0.00 -0.03 0.00 0.00 56.01 56.10 2ppa n LEU 213 Cb 0.25 -2.77 -0.15 0.00 -2.33 0.00 0.00 43.42 38.42 2ppa n LEU 213 CO 0.20 -0.87 -0.36 -0.89 -1.33 0.00 0.00 177.39 174.14 2ppa s THR 214 N -2.74 1.95 0.52 -5.08 2.01 -1.26 -5.10 115.64 105.94 2ppa s THR 214 Ca 0.00 -1.97 -0.22 0.00 0.31 0.00 0.00 61.69 59.81 2ppa s THR 214 Cb 0.00 -2.37 -0.06 0.00 0.01 0.00 0.00 72.50 70.09 2ppa s THR 214 CO 0.00 -0.48 1.28 -2.16 -0.69 0.00 0.00 174.62 172.57 2ppa s PRO 215 N 1.10 3.33 0.14 4.92 0.04 -1.26 -4.90 135.00 138.36 2ppa s PRO 215 Ca 0.06 2.04 0.09 0.00 0.04 0.00 0.00 61.00 63.23 2ppa s PRO 215 Cb -0.19 -2.27 -0.16 0.00 0.04 0.00 0.00 34.50 31.92 2ppa s PRO 215 CO -0.10 -0.98 1.26 1.79 0.04 0.00 0.00 177.00 179.01 2ppa h THR 216 N 1.53 1.47 -3.84 1.26 1.35 -1.42 -3.46 112.91 109.80 2ppa h THR 216 Ca -0.50 -3.12 -0.21 0.00 -0.55 0.00 0.00 66.41 62.03 2ppa h THR 216 Cb 1.28 2.72 -0.25 0.00 -1.73 0.00 0.00 68.15 70.17 2ppa h THR 216 CO 0.58 0.84 -0.71 -1.00 -0.25 0.00 0.00 175.52 174.98 2ppa s HIS 217 N -2.75 0.13 -0.15 4.73 3.76 -1.17 -4.88 115.29 114.95 2ppa s HIS 217 Ca 0.01 -0.23 -0.01 0.00 -0.15 0.00 0.00 55.06 54.68 2ppa s HIS 217 Cb 0.09 -0.09 0.04 0.00 1.11 0.00 0.00 32.58 33.73 2ppa s HIS 217 CO 0.81 -0.08 -0.03 0.08 -0.85 0.00 0.00 174.74 174.67 2ppa s VAL 218 N -0.62 0.86 0.12 -0.90 1.01 -0.41 -0.97 120.40 119.49 2ppa s VAL 218 Ca -0.07 -0.44 0.04 0.00 0.00 0.00 0.00 61.98 61.51 2ppa s VAL 218 Cb -0.04 -1.08 -0.04 0.00 0.00 0.00 0.00 36.38 35.22 2ppa s VAL 218 CO -0.00 0.12 -0.10 0.68 0.00 0.00 0.00 175.10 175.79 2ppa s VAL 219 N 1.74 1.04 -0.10 2.92 -7.23 0.10 -0.81 120.40 118.05 2ppa s VAL 219 Ca 0.02 -1.81 -0.04 0.00 -1.81 0.00 0.00 61.98 58.33 2ppa s VAL 219 Cb -0.15 -1.56 -0.04 0.00 0.56 0.00 0.00 36.38 35.19 2ppa s VAL 219 CO -0.07 -0.63 0.06 -0.36 -0.31 0.00 0.00 175.10 173.78 2ppa s PHE 220 N -2.80 3.33 -1.40 2.82 0.08 -1.26 -0.31 117.98 118.45 2ppa s PHE 220 Ca 0.10 0.32 -0.05 0.00 0.12 0.00 0.00 56.93 57.42 2ppa s PHE 220 Cb -0.01 -1.86 0.02 0.00 -0.57 0.00 0.00 43.02 40.61 2ppa s PHE 220 CO 0.00 0.56 0.38 -1.71 -0.10 0.00 0.00 175.22 174.35 2ppa n ASN 221 N 2.16 -4.90 0.00 1.36 4.05 -0.79 -3.24 115.26 113.90 2ppa n ASN 221 Ca -0.19 -0.19 0.00 0.00 0.45 0.00 0.00 54.58 54.65 2ppa n ASN 221 Cb 0.54 -4.03 0.00 0.00 1.23 0.00 0.00 39.78 37.52 2ppa n ASN 221 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 2ppa n GLY 222 N -1.21 0.85 3.56 8.20 0.00 -0.86 -4.75 105.19 110.98 2ppa n GLY 222 Ca -0.10 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.80 2ppa n GLY 222 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ppa s ALA 223 N -3.01 -1.89 0.16 4.61 0.00 -1.20 -4.70 121.76 115.74 2ppa s ALA 223 Ca 0.00 1.45 -0.34 0.00 0.00 0.00 0.00 51.96 53.07 2ppa s ALA 223 Cb 0.00 -0.41 -0.14 0.00 0.00 0.00 0.00 23.12 22.57 2ppa s ALA 223 CO 0.00 -0.38 1.51 0.28 0.00 0.00 0.00 175.76 177.17 2ppa n VAL 224 N 0.59 0.16 -1.02 0.00 0.31 0.69 -2.36 118.33 116.71 2ppa n VAL 224 Ca -0.11 -0.04 -0.01 0.00 -0.01 0.00 0.00 64.34 64.17 2ppa n VAL 224 Cb 0.58 -1.42 -0.00 0.00 -0.91 0.00 0.00 33.84 32.09 2ppa n VAL 224 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2ppa n GLY 225 N 3.08 0.31 0.26 2.92 0.00 -1.26 -4.84 105.19 105.66 2ppa n GLY 225 Ca 0.16 -0.03 0.10 0.00 0.00 0.00 0.00 46.02 46.25 2ppa n GLY 225 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ppa h ALA 226 N 0.00 1.78 -0.32 4.61 0.00 -1.68 -2.49 119.26 121.16 2ppa h ALA 226 Ca -0.01 -0.03 -0.18 0.00 0.00 0.00 0.00 54.91 54.68 2ppa h ALA 226 Cb 0.48 -0.01 -0.11 0.00 0.00 0.00 0.00 17.79 18.15 2ppa h ALA 226 CO 0.02 0.05 -0.22 1.28 0.00 0.00 0.00 179.25 180.37 2ppa n LEU 227 N -4.26 3.95 -4.65 0.00 4.77 -1.26 -4.76 117.00 110.78 2ppa n LEU 227 Ca -0.03 -3.92 -0.29 0.00 -0.03 0.00 0.00 56.01 51.74 2ppa n LEU 227 Cb 0.12 -0.60 -0.08 0.00 -2.33 0.00 0.00 43.42 40.53 2ppa n LEU 227 CO 0.32 1.39 -0.24 0.42 -1.33 0.00 0.00 177.39 177.94 2ppa s THR 228 N -3.41 1.13 0.00 -5.08 -4.23 -0.94 -0.67 115.64 102.44 2ppa s THR 228 Ca 0.44 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.95 2ppa s THR 228 Cb 0.40 -2.38 0.00 0.00 1.34 0.00 0.00 72.50 71.86 2ppa s THR 228 CO -0.02 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.67 2ppa n GLY 229 N -1.08 3.60 0.00 3.99 0.00 -1.26 -1.44 105.19 108.99 2ppa n GLY 229 Ca -0.12 -0.10 0.05 0.00 0.00 0.00 0.00 46.02 45.84 2ppa n GLY 229 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2ppa n ASP 230 N 4.90 0.00 -0.33 1.61 10.43 -1.26 -2.07 116.55 129.84 2ppa n ASP 230 Ca 0.00 0.05 0.08 0.00 2.57 0.00 0.00 54.79 57.48 2ppa n ASP 230 Cb 0.00 -0.22 0.15 0.00 1.84 0.00 0.00 41.12 42.89 2ppa n ASP 230 CO 0.00 0.00 0.00 0.29 -1.07 0.00 0.00 177.20 176.42 2ppa n LYS 231 N -1.22 2.15 -1.88 -1.24 5.02 -0.52 -5.03 118.16 115.43 2ppa n LYS 231 Ca 0.05 -2.42 -0.36 0.00 -2.02 0.00 0.00 58.31 53.55 2ppa n LYS 231 Cb 0.07 -1.49 0.05 0.00 -0.02 0.00 0.00 35.03 33.64 2ppa n LYS 231 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2ppa s ALA 232 N -2.39 2.48 0.72 7.82 0.00 -0.88 -4.02 121.76 125.50 2ppa s ALA 232 Ca 0.29 1.12 -0.11 0.00 0.00 0.00 0.00 51.96 53.25 2ppa s ALA 232 Cb 0.24 -3.50 0.02 0.00 0.00 0.00 0.00 23.12 19.88 2ppa s ALA 232 CO 0.05 -1.37 1.07 -1.64 0.00 0.00 0.00 175.76 173.88 2ppa s MET 233 N -3.33 2.72 0.12 0.00 -1.94 -0.25 -4.82 119.30 111.80 2ppa s MET 233 Ca 0.80 0.79 0.05 0.00 -1.71 0.00 0.00 55.69 55.61 2ppa s MET 233 Cb -0.34 -1.98 -0.04 0.00 2.01 0.00 0.00 34.83 34.48 2ppa s MET 233 CO 0.36 -1.21 -0.12 0.95 -0.01 0.00 0.00 175.02 174.99 2ppa s THR 234 N -3.12 1.23 0.38 2.05 -4.23 -1.26 0.06 115.64 110.74 2ppa s THR 234 Ca 0.59 -1.77 -0.16 0.00 -1.18 0.00 0.00 61.69 59.16 2ppa s THR 234 Cb -0.14 -1.56 0.05 0.00 1.34 0.00 0.00 72.50 72.19 2ppa s THR 234 CO 0.54 -0.51 0.78 0.00 -0.54 0.00 0.00 174.62 174.89 2ppa s ALA 235 N -2.43 -0.74 0.13 3.99 0.00 -0.85 -4.90 121.76 116.96 2ppa s ALA 235 Ca 0.10 -0.74 0.07 0.00 0.00 0.00 0.00 51.96 51.39 2ppa s ALA 235 Cb -0.03 0.70 -0.04 0.00 0.00 0.00 0.00 23.12 23.75 2ppa s ALA 235 CO 0.02 -0.99 -0.16 0.00 0.00 0.00 0.00 175.76 174.63 2ppa s ALA 236 N -2.45 1.71 0.21 0.00 0.00 -1.26 -1.63 121.76 118.33 2ppa s ALA 236 Ca 0.16 -1.35 -0.32 0.00 0.00 0.00 0.00 51.96 50.44 2ppa s ALA 236 Cb -0.05 -0.13 -0.14 0.00 0.00 0.00 0.00 23.12 22.80 2ppa s ALA 236 CO 0.11 0.18 1.48 0.28 0.00 0.00 0.00 175.76 177.82 2ppa n VAL 237 N 0.53 0.56 0.00 0.00 0.31 0.21 -0.98 118.33 118.95 2ppa n VAL 237 Ca -0.15 -0.14 0.00 0.00 -0.01 0.00 0.00 64.34 64.04 2ppa n VAL 237 Cb 0.57 -1.51 0.00 0.00 -0.91 0.00 0.00 33.84 31.99 2ppa n VAL 237 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2ppa n GLY 238 N 2.66 1.87 3.76 2.92 0.00 0.15 -4.98 105.19 111.56 2ppa n GLY 238 Ca 0.14 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.77 2ppa n GLY 238 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2ppa s GLU 239 N -0.70 4.76 -0.23 1.61 2.12 -0.16 -4.80 118.70 121.31 2ppa s GLU 239 Ca 0.00 1.44 -0.10 0.00 0.36 0.00 0.00 54.97 56.67 2ppa s GLU 239 Cb 0.00 -3.11 -0.05 0.00 0.26 0.00 0.00 34.13 31.23 2ppa s GLU 239 CO 0.00 0.43 0.14 0.15 -0.54 0.00 0.00 175.26 175.44 2ppa s LYS 240 N -1.49 4.00 -0.06 4.30 1.02 -1.26 -1.59 119.74 124.66 2ppa s LYS 240 Ca 0.44 -0.31 0.04 0.00 0.02 0.00 0.00 55.97 56.16 2ppa s LYS 240 Cb -0.24 -3.47 0.00 0.00 -0.52 0.00 0.00 37.83 33.60 2ppa s LYS 240 CO 0.29 0.05 -0.17 0.08 -0.92 0.00 0.00 175.35 174.68 2ppa s VAL 241 N 1.06 1.45 -0.22 3.17 1.01 0.80 -0.22 120.40 127.45 2ppa s VAL 241 Ca 0.07 -0.70 -0.10 0.00 0.00 0.00 0.00 61.98 61.25 2ppa s VAL 241 Cb -0.14 -1.26 -0.05 0.00 0.00 0.00 0.00 36.38 34.93 2ppa s VAL 241 CO 0.04 0.42 0.13 -0.22 0.00 0.00 0.00 175.10 175.48 2ppa s LEU 242 N 0.24 4.10 -0.32 3.92 2.96 -0.52 -0.97 118.68 128.10 2ppa s LEU 242 Ca -0.09 0.15 -0.03 0.00 -0.22 0.00 0.00 54.13 53.94 2ppa s LEU 242 Cb -0.14 -2.08 0.05 0.00 0.50 0.00 0.00 46.19 44.53 2ppa s LEU 242 CO 0.04 0.12 0.03 -0.63 -1.32 0.00 0.00 176.35 174.59 2ppa s ILE 243 N 0.71 3.15 -0.01 6.68 1.01 0.76 -1.07 121.20 132.42 2ppa s ILE 243 Ca 0.07 -1.40 -0.21 0.00 0.00 0.00 0.00 60.65 59.11 2ppa s ILE 243 Cb -0.12 -2.83 -0.05 0.00 0.01 0.00 0.00 42.46 39.46 2ppa s ILE 243 CO 0.01 -0.17 0.62 -0.69 0.00 0.00 0.00 174.94 174.72 2ppa s VAL 244 N 1.27 4.92 -0.04 2.92 1.01 -0.20 -1.28 120.40 129.00 2ppa s VAL 244 Ca -0.03 1.30 0.02 0.00 0.00 0.00 0.00 61.98 63.27 2ppa s VAL 244 Cb -0.20 -3.96 0.01 0.00 0.00 0.00 0.00 36.38 32.23 2ppa s VAL 244 CO -0.01 0.38 -0.08 -2.28 0.00 0.00 0.00 175.10 173.11 2ppa s HIS 245 N 0.02 0.95 0.15 5.22 2.46 -0.04 -0.46 115.29 123.58 2ppa s HIS 245 Ca 0.33 -0.27 0.05 0.00 0.47 0.00 0.00 55.06 55.64 2ppa s HIS 245 Cb -0.18 -0.72 -0.04 0.00 -0.13 0.00 0.00 32.58 31.50 2ppa s HIS 245 CO 0.18 -0.15 -0.11 -1.54 -2.47 0.00 0.00 174.74 170.64 2ppa s SER 246 N 0.46 1.90 -0.27 9.88 1.04 -0.83 -0.55 113.70 125.33 2ppa s SER 246 Ca -0.07 -0.96 -0.00 0.00 0.48 0.00 0.00 55.95 55.40 2ppa s SER 246 Cb -0.11 -0.04 0.16 0.00 0.10 0.00 0.00 66.02 66.13 2ppa s SER 246 CO 0.01 -0.27 0.45 -1.58 0.98 0.00 0.00 173.24 172.83 2ppa s GLN 247 N -3.44 0.43 0.35 4.02 -0.44 -0.88 -1.59 119.66 118.11 2ppa s GLN 247 Ca 0.15 0.52 0.25 0.00 -2.50 0.00 0.00 55.36 53.78 2ppa s GLN 247 Cb 0.00 -0.16 0.66 0.00 -1.64 0.00 0.00 33.01 31.88 2ppa s GLN 247 CO 0.02 -0.78 1.72 0.00 0.50 0.00 0.00 175.29 176.74 2ppa h ALA 248 N 8.12 1.00 0.00 1.58 0.00 -1.81 0.23 119.26 128.38 2ppa h ALA 248 Ca -0.16 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.75 2ppa h ALA 248 Cb 1.15 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.94 2ppa h ALA 248 CO 0.26 0.00 -0.67 -1.71 0.00 0.00 0.00 179.25 177.13 2ppa n ASN 249 N -2.73 3.34 -3.75 0.00 5.15 -1.26 -2.70 115.26 113.31 2ppa n ASN 249 Ca 0.04 0.00 -0.13 0.00 -0.60 0.00 0.00 54.58 53.89 2ppa n ASN 249 Cb 0.45 0.66 -0.10 0.00 -0.53 0.00 0.00 39.78 40.26 2ppa n ASN 249 CO 0.00 0.00 0.00 -0.60 1.40 0.00 0.00 177.26 178.06 2ppa s ARG 250 N -1.35 0.53 0.55 1.20 3.52 -1.26 -4.67 118.95 117.47 2ppa s ARG 250 Ca 0.00 0.21 -0.20 0.00 -0.13 0.00 0.00 55.73 55.60 2ppa s ARG 250 Cb 0.00 0.24 -0.06 0.00 -1.56 0.00 0.00 34.95 33.57 2ppa s ARG 250 CO 0.00 -0.11 1.02 -0.25 -0.81 0.00 0.00 175.30 175.15 2ppa n ASP 251 N 2.20 1.11 -4.10 -2.12 10.43 -1.26 -3.62 116.55 119.18 2ppa n ASP 251 Ca -0.17 0.88 -0.09 0.00 2.57 0.00 0.00 54.79 57.98 2ppa n ASP 251 Cb 0.57 -1.40 -0.09 0.00 1.84 0.00 0.00 41.12 42.03 2ppa n ASP 251 CO 0.00 0.00 0.00 0.28 -1.07 0.00 0.00 177.20 176.41 2ppa s THR 252 N -1.43 0.10 -0.42 -3.53 -1.32 -0.19 -4.84 115.64 104.01 2ppa s THR 252 Ca 0.72 -1.79 0.05 0.00 -1.21 0.00 0.00 61.69 59.45 2ppa s THR 252 Cb -0.45 -1.96 0.18 0.00 -1.51 0.00 0.00 72.50 68.76 2ppa s THR 252 CO 0.50 -0.47 0.37 -2.11 -2.21 0.00 0.00 174.62 170.70 2ppa n ARG 253 N -0.10 0.31 -1.93 7.08 1.85 -1.26 -1.12 116.66 121.49 2ppa n ARG 253 Ca -0.06 -3.22 -0.36 0.00 -1.00 0.00 0.00 57.85 53.20 2ppa n ARG 253 Cb 0.63 -1.62 0.04 0.00 -1.05 0.00 0.00 32.46 30.46 2ppa n ARG 253 CO 0.00 0.00 0.00 -2.14 -0.01 0.00 0.00 177.63 175.48 2ppa s PRO 254 N -0.17 2.90 -0.19 2.89 0.02 -1.03 -0.12 135.00 139.31 2ppa s PRO 254 Ca 0.33 1.93 -0.10 0.00 0.02 0.00 0.00 61.00 63.18 2ppa s PRO 254 Cb 0.06 -1.95 0.07 0.00 0.02 0.00 0.00 34.50 32.69 2ppa s PRO 254 CO -0.19 -1.29 0.45 -1.58 -0.33 0.00 0.00 177.00 174.06 2ppa s HIS 255 N -1.51 -0.69 -0.55 6.54 2.46 0.05 -1.55 115.29 120.04 2ppa s HIS 255 Ca 0.78 1.44 -0.19 0.00 0.47 0.00 0.00 55.06 57.56 2ppa s HIS 255 Cb -0.33 0.32 0.08 0.00 -0.13 0.00 0.00 32.58 32.52 2ppa s HIS 255 CO 0.36 -0.39 0.66 -1.17 -2.47 0.00 0.00 174.74 171.74 2ppa s LEU 256 N 1.59 5.17 -0.27 8.88 2.96 -1.26 -1.06 118.68 134.69 2ppa s LEU 256 Ca -0.09 -1.16 -0.29 0.00 -0.22 0.00 0.00 54.13 52.37 2ppa s LEU 256 Cb -0.08 -2.37 -0.02 0.00 0.50 0.00 0.00 46.19 44.22 2ppa s LEU 256 CO -0.14 -1.00 1.54 -0.63 -1.32 0.00 0.00 176.35 174.81 2ppa s ILE 257 N 2.65 3.79 0.00 6.68 1.01 0.12 -1.26 121.20 134.19 2ppa s ILE 257 Ca 0.13 0.88 0.00 0.00 0.00 0.00 0.00 60.65 61.66 2ppa s ILE 257 Cb -0.22 -3.85 0.00 0.00 0.01 0.00 0.00 42.46 38.40 2ppa s ILE 257 CO 0.09 -0.39 0.00 0.61 0.00 0.00 0.00 174.94 175.25 2ppa n GLY 258 N 4.70 2.08 0.00 6.18 0.00 -1.26 -3.31 105.19 113.58 2ppa n GLY 258 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.20 2ppa n GLY 258 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ppa n GLY 259 N -1.34 5.64 3.65 -0.02 0.00 -0.39 -4.99 105.19 107.74 2ppa n GLY 259 Ca 0.00 -1.54 -0.10 0.00 0.00 0.00 0.00 46.02 44.38 2ppa n GLY 259 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2ppa s HIS 260 N 0.97 0.38 -0.47 1.61 0.09 -1.26 -4.75 115.29 111.86 2ppa s HIS 260 Ca 0.00 -0.79 -0.12 0.00 -0.00 0.00 0.00 55.06 54.15 2ppa s HIS 260 Cb 0.00 0.33 0.10 0.00 -0.00 0.00 0.00 32.58 33.01 2ppa s HIS 260 CO 0.00 -1.17 0.36 0.20 -0.00 0.00 0.00 174.74 174.14 2ppa s GLY 261 N -3.06 2.03 0.14 -2.22 0.00 -0.18 -4.72 107.32 99.32 2ppa s GLY 261 Ca 0.21 -2.31 -0.15 0.00 0.00 0.00 0.00 44.72 42.47 2ppa s GLY 261 CO 0.11 1.07 1.70 -0.55 0.00 0.00 0.00 173.10 175.44 2ppa h ASP 262 N 8.60 0.61 -3.37 1.64 3.32 -1.41 0.13 116.42 125.94 2ppa h ASP 262 Ca -0.25 -0.15 -0.54 0.00 0.02 0.00 0.00 57.03 56.10 2ppa h ASP 262 Cb 1.09 -0.16 -0.34 0.00 0.22 0.00 0.00 39.33 40.14 2ppa h ASP 262 CO 0.87 0.60 -0.82 -0.31 -1.72 0.00 0.00 179.24 177.85 2ppa s TYR 263 N -5.61 1.62 -0.18 4.55 1.51 -0.91 -1.68 117.35 116.66 2ppa s TYR 263 Ca -0.13 -0.65 -0.00 0.00 -1.01 0.00 0.00 57.07 55.27 2ppa s TYR 263 Cb 0.11 -1.19 0.05 0.00 -0.11 0.00 0.00 41.96 40.82 2ppa s TYR 263 CO 0.76 -0.34 -0.04 0.08 -1.11 0.00 0.00 175.55 174.90 2ppa s VAL 264 N 0.77 1.14 -1.22 0.71 1.01 0.11 0.06 120.40 122.98 2ppa s VAL 264 Ca -0.12 -0.76 -0.18 0.00 0.00 0.00 0.00 61.98 60.92 2ppa s VAL 264 Cb -0.16 -1.37 0.08 0.00 0.00 0.00 0.00 36.38 34.93 2ppa s VAL 264 CO 0.02 0.04 1.62 0.26 0.00 0.00 0.00 175.10 177.04 2ppa s TRP 265 N 1.60 2.84 0.41 5.22 0.51 -0.03 -0.29 118.94 129.20 2ppa s TRP 265 Ca -0.01 -1.54 0.09 0.00 -2.12 0.00 0.00 56.10 52.52 2ppa s TRP 265 Cb -0.16 -4.67 0.86 0.00 -0.81 0.00 0.00 33.47 28.68 2ppa s TRP 265 CO -0.07 -1.77 2.00 0.00 -0.51 0.00 0.00 176.95 176.60 2ppa h ALA 266 N 7.99 1.64 0.00 0.98 0.00 -1.89 0.31 119.26 128.29 2ppa h ALA 266 Ca 0.37 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.18 2ppa h ALA 266 Cb 0.90 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.58 2ppa h ALA 266 CO 1.41 0.28 -0.23 0.25 0.00 0.00 0.00 179.25 180.96 2ppa n THR 267 N -4.40 0.02 -0.75 0.00 -2.24 -1.26 -4.53 114.28 101.12 2ppa n THR 267 Ca 0.01 -0.01 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 2ppa n THR 267 Cb 0.15 -0.17 0.00 0.00 -2.10 0.00 0.00 70.33 68.21 2ppa n THR 267 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2ppa n GLY 268 N 1.49 0.75 3.34 3.38 0.00 0.07 -4.73 105.19 109.50 2ppa n GLY 268 Ca 0.06 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.75 2ppa n GLY 268 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ppa s LYS 269 N -0.25 3.38 0.31 1.61 -0.14 -1.26 0.27 119.74 123.65 2ppa s LYS 269 Ca 0.00 -0.67 0.25 0.00 -1.36 0.00 0.00 55.97 54.19 2ppa s LYS 269 Cb 0.00 -2.76 0.59 0.00 -1.68 0.00 0.00 37.83 33.97 2ppa s LYS 269 CO 0.00 0.06 1.69 0.74 -0.76 0.00 0.00 175.35 177.08 2ppa h PHE 270 N 7.21 0.00 0.00 3.18 0.05 -1.75 -2.53 116.94 123.11 2ppa h PHE 270 Ca -0.32 0.00 0.00 0.00 3.82 0.00 0.00 57.97 61.47 2ppa h PHE 270 Cb 1.19 0.00 0.00 0.00 2.00 0.00 0.00 35.95 39.14 2ppa h PHE 270 CO 0.53 0.00 -0.06 0.09 -0.18 0.00 0.00 178.31 178.69 2ppa n ASN 271 N -2.64 0.34 -4.62 2.17 3.02 -1.26 -4.58 115.26 107.70 2ppa n ASN 271 Ca 0.05 0.46 -0.40 0.00 -0.03 0.00 0.00 54.58 54.66 2ppa n ASN 271 Cb 0.48 -0.53 -0.07 0.00 -0.61 0.00 0.00 39.78 39.05 2ppa n ASN 271 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 2ppa s THR 272 N -3.04 5.04 0.40 3.41 2.01 -0.95 -5.03 115.64 117.48 2ppa s THR 272 Ca 0.12 0.96 -0.26 0.00 0.31 0.00 0.00 61.69 62.82 2ppa s THR 272 Cb 0.16 -3.87 -0.10 0.00 0.01 0.00 0.00 72.50 68.71 2ppa s THR 272 CO 0.57 0.06 1.36 -2.65 -0.69 0.00 0.00 174.62 173.27 2ppa n PRO 273 N 5.60 2.20 -2.22 4.92 -0.02 -1.26 -4.83 135.00 139.39 2ppa n PRO 273 Ca -0.03 0.78 -0.37 0.00 -2.02 0.00 0.00 63.50 61.86 2ppa n PRO 273 Cb 0.49 -2.49 -0.01 0.00 -0.02 0.00 0.00 33.50 31.48 2ppa n PRO 273 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 2ppa s PRO 274 N -2.18 3.72 0.65 0.52 0.04 -1.26 -4.92 135.00 131.57 2ppa s PRO 274 Ca 0.58 1.82 -0.14 0.00 0.04 0.00 0.00 61.00 63.30 2ppa s PRO 274 Cb -0.50 -2.41 -0.01 0.00 0.04 0.00 0.00 34.50 31.63 2ppa s PRO 274 CO 0.60 -0.60 1.07 -0.51 0.04 0.00 0.00 177.00 177.61 2ppa s ASP 275 N -1.31 5.39 0.17 6.66 1.01 0.60 -4.76 116.67 124.42 2ppa s ASP 275 Ca 0.64 1.81 0.08 0.00 0.71 0.00 0.00 52.55 55.79 2ppa s ASP 275 Cb -0.30 -2.53 -0.04 0.00 1.01 0.00 0.00 42.92 41.06 2ppa s ASP 275 CO 0.36 -1.44 -0.17 0.68 0.21 0.00 0.00 175.17 174.81 2ppa s VAL 276 N -2.61 1.76 -1.36 -1.27 -7.23 -1.26 0.07 120.40 108.49 2ppa s VAL 276 Ca 0.63 -1.93 -0.03 0.00 -1.81 0.00 0.00 61.98 58.84 2ppa s VAL 276 Cb -0.17 -1.83 0.00 0.00 0.56 0.00 0.00 36.38 34.94 2ppa s VAL 276 CO 0.44 -0.36 0.36 0.47 -0.31 0.00 0.00 175.10 175.70 2ppa n ASP 277 N 0.23 -5.32 -4.75 4.85 10.43 -0.67 -4.92 116.55 116.40 2ppa n ASP 277 Ca -0.13 -0.17 -0.40 0.00 2.57 0.00 0.00 54.79 56.66 2ppa n ASP 277 Cb 0.57 -4.23 -0.05 0.00 1.84 0.00 0.00 41.12 39.26 2ppa n ASP 277 CO 0.00 0.00 0.00 -1.10 -1.07 0.00 0.00 177.20 175.03 2ppa s GLN 278 N -5.32 4.72 -0.19 -1.24 -1.52 0.41 -4.83 119.66 111.70 2ppa s GLN 278 Ca 0.18 1.68 -0.21 0.00 -1.95 0.00 0.00 55.36 55.06 2ppa s GLN 278 Cb -0.08 -3.23 -0.18 0.00 -0.22 0.00 0.00 33.01 29.30 2ppa s GLN 278 CO 0.22 0.31 0.26 1.05 -0.25 0.00 0.00 175.29 176.89 2ppa h GLU 279 N 4.08 0.00 -3.42 2.91 4.11 -1.91 -0.46 114.58 119.88 2ppa h GLU 279 Ca -0.46 0.00 -0.33 0.00 0.07 0.00 0.00 59.36 58.65 2ppa h GLU 279 Cb 1.21 0.00 -0.36 0.00 0.50 0.00 0.00 28.75 30.10 2ppa h GLU 279 CO 0.68 0.86 -0.73 0.99 0.07 0.00 0.00 179.01 180.88 2ppa s THR 280 N -2.30 -0.08 0.44 -1.06 2.01 -1.26 -4.32 115.64 109.07 2ppa s THR 280 Ca -0.25 0.30 0.08 0.00 0.31 0.00 0.00 61.69 62.13 2ppa s THR 280 Cb 0.04 -0.11 -0.01 0.00 0.01 0.00 0.00 72.50 72.43 2ppa s THR 280 CO 0.55 0.13 0.41 -1.66 -0.69 0.00 0.00 174.62 173.35 2ppa s TRP 281 N 1.52 2.49 -0.08 4.92 -2.14 -0.60 -4.97 118.94 120.08 2ppa s TRP 281 Ca -0.03 -0.55 0.02 0.00 2.66 0.00 0.00 56.10 58.19 2ppa s TRP 281 Cb -0.13 -2.15 0.02 0.00 -3.10 0.00 0.00 33.47 28.11 2ppa s TRP 281 CO -0.03 -0.24 -0.12 0.12 -2.66 0.00 0.00 176.95 174.02 2ppa s PHE 282 N -2.52 1.56 -0.19 1.66 5.36 -1.26 -2.45 117.98 120.13 2ppa s PHE 282 Ca 0.47 -0.65 0.01 0.00 -0.96 0.00 0.00 56.93 55.81 2ppa s PHE 282 Cb -0.03 -1.17 0.03 0.00 -0.34 0.00 0.00 43.02 41.51 2ppa s PHE 282 CO 0.28 -0.36 -0.15 0.42 -1.46 0.00 0.00 175.22 173.95 2ppa s ILE 283 N 0.94 1.90 0.47 3.12 1.01 -0.28 -4.72 121.20 123.64 2ppa s ILE 283 Ca -0.09 -1.03 -0.21 0.00 0.00 0.00 0.00 60.65 59.32 2ppa s ILE 283 Cb -0.15 -1.83 -0.09 0.00 0.01 0.00 0.00 42.46 40.40 2ppa s ILE 283 CO 0.00 0.34 1.04 -2.16 0.00 0.00 0.00 174.94 174.16 2ppa s PRO 284 N 1.32 3.86 0.17 2.79 0.04 -1.26 -1.02 135.00 140.90 2ppa s PRO 284 Ca 0.01 1.37 -0.33 0.00 0.04 0.00 0.00 61.00 62.09 2ppa s PRO 284 Cb -0.15 -2.15 -0.15 0.00 0.04 0.00 0.00 34.50 32.09 2ppa s PRO 284 CO -0.10 -0.38 1.21 0.41 0.04 0.00 0.00 177.00 178.18 2ppa n GLY 285 N -0.20 0.18 1.07 0.56 0.00 -1.24 -2.25 105.19 103.32 2ppa n GLY 285 Ca 0.09 0.54 0.00 0.00 0.00 0.00 0.00 46.02 46.65 2ppa n GLY 285 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ppa n GLY 286 N 2.09 0.73 3.32 -0.02 0.00 0.78 -4.74 105.19 107.35 2ppa n GLY 286 Ca 0.15 -0.57 -0.10 0.00 0.00 0.00 0.00 46.02 45.50 2ppa n GLY 286 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ppa s ALA 287 N -2.00 0.23 0.21 4.61 0.00 -0.95 -4.75 121.76 119.11 2ppa s ALA 287 Ca 0.00 -1.06 0.11 0.00 0.00 0.00 0.00 51.96 51.01 2ppa s ALA 287 Cb 0.00 0.94 -0.05 0.00 0.00 0.00 0.00 23.12 24.01 2ppa s ALA 287 CO 0.00 -0.64 -0.22 0.00 0.00 0.00 0.00 175.76 174.90 2ppa s ALA 288 N -4.01 2.54 0.25 0.00 0.00 -1.26 -2.07 121.76 117.21 2ppa s ALA 288 Ca 0.21 -1.69 0.01 0.00 0.00 0.00 0.00 51.96 50.49 2ppa s ALA 288 Cb 0.04 -0.30 -0.05 0.00 0.00 0.00 0.00 23.12 22.82 2ppa s ALA 288 CO 0.02 0.37 0.12 0.20 0.00 0.00 0.00 175.76 176.47 2ppa s GLY 289 N -2.89 1.69 -0.05 0.00 0.00 0.29 -3.37 107.32 102.98 2ppa s GLY 289 Ca 0.23 -1.80 -0.04 0.00 0.00 0.00 0.00 44.72 43.11 2ppa s GLY 289 CO 0.11 -1.53 0.13 0.00 0.00 0.00 0.00 173.10 171.81 2ppa s ALA 290 N -3.86 -0.29 -0.01 3.20 0.00 -1.05 -0.86 121.76 118.89 2ppa s ALA 290 Ca 0.38 0.48 0.06 0.00 0.00 0.00 0.00 51.96 52.89 2ppa s ALA 290 Cb 0.07 -0.31 -0.02 0.00 0.00 0.00 0.00 23.12 22.87 2ppa s ALA 290 CO 0.14 -0.10 -0.20 0.00 0.00 0.00 0.00 175.76 175.60 2ppa s ALA 291 N 0.52 1.67 -0.16 0.00 0.00 -0.41 -0.85 121.76 122.53 2ppa s ALA 291 Ca -0.04 -0.88 -0.01 0.00 0.00 0.00 0.00 51.96 51.04 2ppa s ALA 291 Cb -0.05 -0.42 -0.01 0.00 0.00 0.00 0.00 23.12 22.64 2ppa s ALA 291 CO -0.02 0.41 -0.12 0.12 0.00 0.00 0.00 175.76 176.14 2ppa s PHE 292 N -0.49 2.84 -0.00 0.00 2.19 0.11 -0.17 117.98 122.46 2ppa s PHE 292 Ca 0.08 -0.90 0.01 0.00 0.33 0.00 0.00 56.93 56.45 2ppa s PHE 292 Cb -0.08 -1.93 -0.00 0.00 -1.31 0.00 0.00 43.02 39.70 2ppa s PHE 292 CO -0.01 -0.41 -0.05 -0.47 1.83 0.00 0.00 175.22 176.12 2ppa s TYR 293 N 0.83 0.42 -0.31 10.12 5.04 -0.14 -1.09 117.35 132.22 2ppa s TYR 293 Ca -0.04 -0.08 -0.10 0.00 -2.44 0.00 0.00 57.07 54.41 2ppa s TYR 293 Cb -0.15 -0.27 -0.01 0.00 0.35 0.00 0.00 41.96 41.88 2ppa s TYR 293 CO 0.00 -0.01 0.16 0.99 -1.34 0.00 0.00 175.55 175.36 2ppa s THR 294 N -0.12 4.74 0.22 4.34 2.01 -1.26 -0.14 115.64 125.43 2ppa s THR 294 Ca 0.02 -0.34 -0.30 0.00 0.31 0.00 0.00 61.69 61.38 2ppa s THR 294 Cb -0.02 -3.40 -0.10 0.00 0.01 0.00 0.00 72.50 69.00 2ppa s THR 294 CO -0.00 0.08 1.45 -0.36 -0.69 0.00 0.00 174.62 175.10 2ppa s PHE 295 N 1.64 3.06 -0.01 4.92 0.40 -0.62 -4.88 117.98 122.49 2ppa s PHE 295 Ca 0.05 0.97 0.04 0.00 -0.60 0.00 0.00 56.93 57.40 2ppa s PHE 295 Cb -0.17 -3.81 -0.06 0.00 0.51 0.00 0.00 43.02 39.49 2ppa s PHE 295 CO 0.07 -2.70 0.08 1.04 0.70 0.00 0.00 175.22 174.41 2ppa n GLN 296 N 2.72 0.43 -4.41 0.44 1.13 -1.26 0.30 117.38 116.73 2ppa n GLN 296 Ca 0.08 -0.03 -0.20 0.00 -1.94 0.00 0.00 57.00 54.91 2ppa n GLN 296 Cb 0.40 -1.10 -0.14 0.00 0.11 0.00 0.00 30.24 29.51 2ppa n GLN 296 CO 0.00 0.00 0.00 -0.65 -1.44 0.00 0.00 177.06 174.97 2ppa s GLN 297 N -2.27 0.88 0.80 -1.09 -1.52 -1.26 -4.63 119.66 110.57 2ppa s GLN 297 Ca -0.02 -0.53 -0.12 0.00 -1.95 0.00 0.00 55.36 52.75 2ppa s GLN 297 Cb 0.03 -0.86 0.08 0.00 -0.22 0.00 0.00 33.01 32.04 2ppa s GLN 297 CO 0.17 0.22 1.17 -1.25 -0.25 0.00 0.00 175.29 175.36 2ppa s PRO 298 N -0.62 2.00 0.00 2.91 0.04 -1.26 -4.77 135.00 133.29 2ppa s PRO 298 Ca 0.03 0.10 0.00 0.00 0.04 0.00 0.00 61.00 61.17 2ppa s PRO 298 Cb -0.06 -1.96 0.00 0.00 0.04 0.00 0.00 34.50 32.52 2ppa s PRO 298 CO 0.00 -1.57 0.00 0.41 0.04 0.00 0.00 177.00 175.88 2ppa n GLY 299 N -3.29 0.61 3.73 0.56 0.00 0.33 -4.95 105.19 102.18 2ppa n GLY 299 Ca 0.08 -2.27 -0.40 0.00 0.00 0.00 0.00 46.02 43.43 2ppa n GLY 299 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2ppa s ILE 300 N -0.63 4.97 0.16 -0.61 -1.09 -1.26 -1.26 121.20 121.47 2ppa s ILE 300 Ca 0.00 1.46 0.08 0.00 -2.23 0.00 0.00 60.65 59.96 2ppa s ILE 300 Cb 0.00 -4.04 -0.04 0.00 -1.58 0.00 0.00 42.46 36.79 2ppa s ILE 300 CO 0.00 0.29 -0.07 -0.31 -1.23 0.00 0.00 174.94 173.62 2ppa s TYR 301 N 0.51 2.72 -0.02 3.97 1.51 -0.01 -4.98 117.35 121.05 2ppa s TYR 301 Ca 0.37 -0.18 0.02 0.00 -1.01 0.00 0.00 57.07 56.27 2ppa s TYR 301 Cb -0.18 -1.35 -0.03 0.00 -0.11 0.00 0.00 41.96 40.28 2ppa s TYR 301 CO 0.19 0.49 -0.05 0.00 -1.11 0.00 0.00 175.55 175.07 2ppa s ALA 302 N -1.56 3.08 -0.17 3.71 0.00 -1.21 -1.26 121.76 124.34 2ppa s ALA 302 Ca 0.24 -0.97 0.01 0.00 0.00 0.00 0.00 51.96 51.25 2ppa s ALA 302 Cb -0.10 -1.21 0.02 0.00 0.00 0.00 0.00 23.12 21.83 2ppa s ALA 302 CO 0.16 0.61 -0.19 -0.47 0.00 0.00 0.00 175.76 175.87 2ppa s TYR 303 N -0.97 2.64 0.13 0.00 5.04 0.61 0.11 117.35 124.91 2ppa s TYR 303 Ca 0.16 -1.54 0.01 0.00 -2.44 0.00 0.00 57.07 53.26 2ppa s TYR 303 Cb -0.11 -1.84 -0.04 0.00 0.35 0.00 0.00 41.96 40.31 2ppa s TYR 303 CO 0.07 -0.77 -0.01 0.14 -1.34 0.00 0.00 175.55 173.64 2ppa s VAL 304 N 1.31 0.49 -0.24 3.14 -7.23 -0.23 -0.04 120.40 117.61 2ppa s VAL 304 Ca 0.04 -1.93 -0.29 0.00 -1.81 0.00 0.00 61.98 57.99 2ppa s VAL 304 Cb -0.13 -1.92 0.01 0.00 0.56 0.00 0.00 36.38 34.90 2ppa s VAL 304 CO -0.12 -0.64 1.07 0.21 -0.31 0.00 0.00 175.10 175.31 2ppa s ASN 305 N -3.08 7.05 -0.05 4.85 3.84 -0.93 -0.77 114.94 125.85 2ppa s ASN 305 Ca 0.19 1.35 0.02 0.00 0.21 0.00 0.00 52.86 54.62 2ppa s ASN 305 Cb 0.06 -2.54 0.13 0.00 -0.55 0.00 0.00 41.25 38.35 2ppa s ASN 305 CO -0.01 -0.72 0.79 1.57 -2.79 0.00 0.00 177.10 175.94 2ppa n HIS 306 N 6.47 0.37 -2.69 0.43 -0.00 0.83 -3.94 115.22 116.70 2ppa n HIS 306 Ca 0.12 -0.24 -0.43 0.00 -0.00 0.00 0.00 57.72 57.18 2ppa n HIS 306 Cb 0.46 -0.21 -0.03 0.00 -0.00 0.00 0.00 29.99 30.21 2ppa n HIS 306 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 176.34 177.55 2ppa s ASN 307 N 0.02 6.51 0.46 0.26 3.84 -1.26 -4.91 114.94 119.85 2ppa s ASN 307 Ca 0.09 0.16 0.30 0.00 0.21 0.00 0.00 52.86 53.62 2ppa s ASN 307 Cb 0.07 -2.51 1.09 0.00 -0.55 0.00 0.00 41.25 39.36 2ppa s ASN 307 CO 0.02 -1.25 1.86 -0.07 -2.79 0.00 0.00 177.10 174.87 2ppa h LEU 308 N 11.19 0.00 -0.19 3.21 3.38 -1.99 0.64 115.31 131.55 2ppa h LEU 308 Ca -0.24 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.63 2ppa h LEU 308 Cb 1.07 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.81 2ppa h LEU 308 CO 1.11 0.00 -0.26 0.40 0.09 0.00 0.00 178.44 179.78 2ppa h ILE 309 N 0.00 1.34 -0.73 1.22 2.04 -1.91 0.08 117.51 119.55 2ppa h ILE 309 Ca 0.00 -1.46 -0.06 0.00 1.00 0.00 0.00 64.86 64.35 2ppa h ILE 309 Cb 0.58 1.83 -0.03 0.00 -0.74 0.00 0.00 36.82 38.45 2ppa h ILE 309 CO 0.00 0.44 0.24 -0.33 0.00 0.00 0.00 178.15 178.50 2ppa h GLU 310 N 0.18 1.12 -0.02 2.37 5.08 -1.42 0.11 114.58 121.99 2ppa h GLU 310 Ca 0.02 -0.23 -0.00 0.00 -1.00 0.00 0.00 59.36 58.15 2ppa h GLU 310 Cb 0.83 -0.17 -0.00 0.00 0.50 0.00 0.00 28.75 29.91 2ppa h GLU 310 CO 0.06 0.94 -0.01 0.00 -1.00 0.00 0.00 179.01 179.01 2ppa h ALA 311 N 1.18 0.02 0.00 3.43 0.00 -0.87 -0.84 119.26 122.18 2ppa h ALA 311 Ca 0.24 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.93 2ppa h ALA 311 Cb 0.29 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.07 2ppa h ALA 311 CO -0.01 -0.26 -1.28 1.19 0.00 0.00 0.00 179.25 178.89 2ppa n PHE 312 N -4.87 0.00 -0.09 0.00 3.01 0.01 -2.05 117.46 113.47 2ppa n PHE 312 Ca -0.08 0.00 -0.11 0.00 1.01 0.00 0.00 57.45 58.28 2ppa n PHE 312 Cb 0.22 -0.21 -0.12 0.00 -0.01 0.00 0.00 39.48 39.37 2ppa n PHE 312 CO 0.00 0.00 0.00 0.39 1.01 0.00 0.00 176.76 178.16 2ppa n GLU 313 N -1.75 1.01 -0.00 -1.08 -0.58 0.28 -4.73 120.64 113.79 2ppa n GLU 313 Ca -0.01 0.04 0.08 0.00 -0.42 0.00 0.00 57.16 56.85 2ppa n GLU 313 Cb 0.31 -1.43 -0.10 0.00 -0.57 0.00 0.00 31.44 29.65 2ppa n GLU 313 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 2ppa n LEU 314 N -2.79 0.68 0.00 -4.62 4.77 -0.62 -5.01 117.00 109.41 2ppa n LEU 314 Ca -0.31 -0.44 0.00 0.00 -0.03 0.00 0.00 56.01 55.23 2ppa n LEU 314 Cb 1.00 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 42.09 2ppa n LEU 314 CO 0.31 0.17 0.00 0.61 -1.33 0.00 0.00 177.39 177.15 2ppa n GLY 315 N 1.41 1.15 2.66 -0.72 0.00 -0.45 -1.28 105.19 107.96 2ppa n GLY 315 Ca 0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.63 2ppa n GLY 315 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ppa n ALA 316 N -0.12 6.13 -3.71 4.61 0.00 0.01 -4.26 120.51 123.17 2ppa n ALA 316 Ca 0.00 -4.19 -0.14 0.00 0.00 0.00 0.00 53.44 49.11 2ppa n ALA 316 Cb 0.00 -2.89 -0.14 0.00 0.00 0.00 0.00 19.45 16.42 2ppa n ALA 316 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2ppa s ALA 317 N -0.34 -0.30 0.37 0.00 0.00 -1.24 -2.19 121.76 118.06 2ppa s ALA 317 Ca 0.47 0.72 0.08 0.00 0.00 0.00 0.00 51.96 53.23 2ppa s ALA 317 Cb 0.14 -0.63 -0.07 0.00 0.00 0.00 0.00 23.12 22.56 2ppa s ALA 317 CO -0.04 -0.32 0.00 0.00 0.00 0.00 0.00 175.76 175.40 2ppa s ALA 318 N 1.61 3.17 0.17 0.00 0.00 0.94 -4.56 121.76 123.09 2ppa s ALA 318 Ca -0.05 -2.13 0.10 0.00 0.00 0.00 0.00 51.96 49.87 2ppa s ALA 318 Cb -0.12 -0.10 -0.04 0.00 0.00 0.00 0.00 23.12 22.86 2ppa s ALA 318 CO -0.07 -0.02 -0.21 -1.01 0.00 0.00 0.00 175.76 174.45 2ppa s HIS 319 N -2.62 2.03 -0.05 0.00 3.76 0.16 -0.28 115.29 118.29 2ppa s HIS 319 Ca 0.35 -0.41 0.05 0.00 -0.15 0.00 0.00 55.06 54.90 2ppa s HIS 319 Cb 0.04 -1.03 -0.02 0.00 1.11 0.00 0.00 32.58 32.69 2ppa s HIS 319 CO 0.18 0.38 -0.20 -0.06 -0.85 0.00 0.00 174.74 174.19 2ppa s PHE 320 N -1.71 2.55 -0.27 1.40 0.08 -0.39 -1.09 117.98 118.54 2ppa s PHE 320 Ca 0.16 -0.44 -0.04 0.00 0.12 0.00 0.00 56.93 56.73 2ppa s PHE 320 Cb -0.07 -1.61 0.02 0.00 -0.57 0.00 0.00 43.02 40.78 2ppa s PHE 320 CO 0.07 -0.03 0.01 0.15 -0.10 0.00 0.00 175.22 175.33 2ppa s LYS 321 N -0.42 2.97 -0.14 0.44 1.02 0.11 -0.83 119.74 122.89 2ppa s LYS 321 Ca 0.04 -0.91 0.01 0.00 0.02 0.00 0.00 55.97 55.13 2ppa s LYS 321 Cb -0.12 -3.18 0.00 0.00 -0.52 0.00 0.00 37.83 34.01 2ppa s LYS 321 CO 0.02 -0.42 -0.18 0.08 -0.92 0.00 0.00 175.35 173.93 2ppa s VAL 322 N 1.41 2.48 0.45 3.17 1.01 -0.39 -2.01 120.40 126.51 2ppa s VAL 322 Ca 0.01 -0.84 -0.02 0.00 0.00 0.00 0.00 61.98 61.13 2ppa s VAL 322 Cb -0.17 -2.02 -0.02 0.00 0.00 0.00 0.00 36.38 34.17 2ppa s VAL 322 CO -0.01 0.53 0.69 0.42 0.00 0.00 0.00 175.10 176.74 2ppa s THR 323 N 0.72 4.53 -1.86 3.92 -4.23 -0.65 -0.51 115.64 117.56 2ppa s THR 323 Ca -0.08 -0.23 0.00 0.00 -1.18 0.00 0.00 61.69 60.20 2ppa s THR 323 Cb -0.16 -3.69 0.00 0.00 1.34 0.00 0.00 72.50 69.99 2ppa s THR 323 CO 0.01 -0.56 0.00 0.61 -0.54 0.00 0.00 174.62 174.14 2ppa n GLY 324 N -2.10 0.59 3.78 3.99 0.00 -1.26 -0.62 105.19 109.57 2ppa n GLY 324 Ca -0.00 -2.15 -0.36 0.00 0.00 0.00 0.00 46.02 43.51 2ppa n GLY 324 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2ppa s GLU 325 N -0.75 3.93 0.41 1.61 2.12 -1.26 -4.66 118.70 120.10 2ppa s GLU 325 Ca 0.00 -0.18 -0.26 0.00 0.36 0.00 0.00 54.97 54.89 2ppa s GLU 325 Cb 0.00 -3.34 -0.09 0.00 0.26 0.00 0.00 34.13 30.96 2ppa s GLU 325 CO 0.00 0.47 1.38 -0.46 -0.54 0.00 0.00 175.26 176.11 2ppa s TRP 326 N -0.13 2.66 -0.36 5.30 -0.11 -1.26 -4.44 118.94 120.59 2ppa s TRP 326 Ca 0.11 1.32 -0.02 0.00 1.22 0.00 0.00 56.10 58.72 2ppa s TRP 326 Cb -0.11 -3.82 0.09 0.00 -1.50 0.00 0.00 33.47 28.12 2ppa s TRP 326 CO 0.00 -2.54 0.12 1.21 -4.62 0.00 0.00 176.95 171.12 2ppa s ASN 327 N -0.54 5.09 0.49 5.86 3.84 -1.26 -4.97 114.94 123.44 2ppa s ASN 327 Ca 0.57 -1.75 0.28 0.00 0.21 0.00 0.00 52.86 52.17 2ppa s ASN 327 Cb -0.42 -1.77 0.92 0.00 -0.55 0.00 0.00 41.25 39.44 2ppa s ASN 327 CO 0.54 -0.42 1.82 0.44 -2.79 0.00 0.00 177.10 176.69 2ppa h ASP 328 N 8.00 0.00 -0.32 -4.21 5.19 -1.95 -2.77 116.42 120.35 2ppa h ASP 328 Ca -0.15 0.00 -0.01 0.00 -0.62 0.00 0.00 57.03 56.25 2ppa h ASP 328 Cb 1.05 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 40.55 2ppa h ASP 328 CO 0.62 0.06 0.16 -0.78 -3.12 0.00 0.00 179.24 176.19 2ppa h ASP 329 N 0.00 0.42 -0.30 6.45 -0.00 -2.02 -3.15 116.42 117.82 2ppa h ASP 329 Ca -0.00 -0.11 -0.15 0.00 -0.00 0.00 0.00 57.03 56.77 2ppa h ASP 329 Cb 0.74 -0.11 -0.01 0.00 -0.00 0.00 0.00 39.33 39.95 2ppa h ASP 329 CO 0.01 0.41 -0.38 -0.07 -0.00 0.00 0.00 179.24 179.21 2ppa h LEU 330 N 0.39 0.90 -7.04 2.28 3.38 -1.94 -3.45 115.31 109.83 2ppa h LEU 330 Ca 0.11 -0.41 -0.03 0.00 0.09 0.00 0.00 57.88 57.65 2ppa h LEU 330 Cb 0.10 -0.25 -0.22 0.00 0.09 0.00 0.00 40.66 40.38 2ppa h LEU 330 CO -0.02 1.17 0.03 -0.32 0.09 0.00 0.00 178.44 179.39 2ppa s MET 331 N -4.38 0.73 -0.01 1.13 0.00 -1.07 -5.14 119.30 110.56 2ppa s MET 331 Ca -0.10 1.05 -0.06 0.00 0.00 0.00 0.00 55.69 56.58 2ppa s MET 331 Cb 0.12 0.25 0.00 0.00 0.00 0.00 0.00 34.83 35.20 2ppa s MET 331 CO 0.87 -0.12 0.12 -0.08 0.00 0.00 0.00 175.02 175.80 2ppa s THR 332 N 0.96 0.07 -0.58 10.11 -1.32 -1.25 -4.10 115.64 119.52 2ppa s THR 332 Ca -0.05 -0.57 -0.25 0.00 -1.21 0.00 0.00 61.69 59.61 2ppa s THR 332 Cb -0.05 -0.37 0.04 0.00 -1.51 0.00 0.00 72.50 70.62 2ppa s THR 332 CO -0.09 -0.32 1.00 -0.55 -2.21 0.00 0.00 174.62 172.46 2ppa s SER 333 N -1.09 6.31 0.05 8.08 0.15 -1.26 -4.89 113.70 121.05 2ppa s SER 333 Ca -0.12 -0.40 -0.17 0.00 0.70 0.00 0.00 55.95 55.96 2ppa s SER 333 Cb -0.07 -2.46 -0.16 0.00 -1.71 0.00 0.00 66.02 61.63 2ppa s SER 333 CO 0.01 -1.34 1.27 0.58 1.20 0.00 0.00 173.24 174.97 2ppa h VAL 334 N 6.03 1.35 -3.24 4.45 2.07 -2.02 -3.41 116.25 121.48 2ppa h VAL 334 Ca -0.27 -1.72 -0.48 0.00 0.82 0.00 0.00 66.70 65.05 2ppa h VAL 334 Cb 1.07 2.06 -0.39 0.00 -1.52 0.00 0.00 31.29 32.50 2ppa h VAL 334 CO 1.13 0.52 -0.76 -0.22 0.02 0.00 0.00 177.57 178.26 2ppa s LEU 335 N -8.69 0.89 0.58 2.57 2.96 -1.26 -5.14 118.68 110.59 2ppa s LEU 335 Ca -0.13 -0.54 -0.19 0.00 -0.22 0.00 0.00 54.13 53.05 2ppa s LEU 335 Cb 0.06 -0.51 -0.04 0.00 0.50 0.00 0.00 46.19 46.20 2ppa s LEU 335 CO 0.82 -0.27 1.22 0.00 -1.32 0.00 0.00 176.35 176.81 2ppa s ALA 336 N 1.92 2.59 -0.46 5.97 0.00 -1.26 -4.87 121.76 125.65 2ppa s ALA 336 Ca 0.01 1.04 -0.46 0.00 0.00 0.00 0.00 51.96 52.56 2ppa s ALA 336 Cb -0.15 -3.46 -0.19 0.00 0.00 0.00 0.00 23.12 19.31 2ppa s ALA 336 CO -0.07 -1.16 1.62 -2.30 0.00 0.00 0.00 175.76 173.85 2ppa n PRO 337 N -1.47 0.17 -3.54 0.00 -0.02 -1.26 -4.93 135.00 123.95 2ppa n PRO 337 Ca 0.13 0.06 -0.17 0.00 -2.02 0.00 0.00 63.50 61.50 2ppa n PRO 337 Cb 0.49 -1.59 -0.06 0.00 -0.02 0.00 0.00 33.50 32.32 2ppa n PRO 337 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 2ppa s SER 338 N 3.06 -0.66 0.00 2.55 1.04 -1.26 -5.29 113.70 113.14 2ppa s SER 338 Ca 1.04 0.79 0.00 0.00 0.48 0.00 0.00 55.95 58.26 2ppa s SER 338 Cb -1.43 0.64 0.00 0.00 0.10 0.00 0.00 66.02 65.33 2ppa s SER 338 CO 0.79 -0.56 0.45 0.61 0.98 0.00 0.00 173.24 175.51