#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 3.85 0.25 0.00 -4.23 -1.26 -4.87 115.64 109.38 2ppa s THR 5 Ca 0.00 0.46 -0.04 0.00 -1.18 0.00 0.00 61.69 60.94 2ppa s THR 5 Cb 0.00 -3.58 0.22 0.00 1.34 0.00 0.00 72.50 70.49 2ppa s THR 5 CO 0.00 -0.72 1.83 0.00 -0.54 0.00 0.00 174.62 175.19 2ppa h ALA 6 N -0.45 1.23 -0.16 3.99 0.00 -2.05 -0.36 119.26 121.45 2ppa h ALA 6 Ca -0.45 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.48 2ppa h ALA 6 Cb 1.24 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.85 2ppa h ALA 6 CO 0.63 0.17 0.10 0.00 0.00 0.00 0.00 179.25 180.15 2ppa h ALA 7 N 1.45 0.21 -0.63 0.00 0.00 -1.99 -0.57 119.26 117.74 2ppa h ALA 7 Ca 0.41 -0.02 0.03 0.00 0.00 0.00 0.00 54.91 55.32 2ppa h ALA 7 Cb 0.32 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 18.00 2ppa h ALA 7 CO -0.23 -0.29 0.39 0.93 0.00 0.00 0.00 179.25 180.04 2ppa h GLU 8 N 0.21 0.73 -0.65 0.00 5.08 -1.75 -2.44 114.58 115.75 2ppa h GLU 8 Ca 0.06 -0.04 -0.05 0.00 -1.00 0.00 0.00 59.36 58.33 2ppa h GLU 8 Cb 0.00 -0.17 -0.03 0.00 0.50 0.00 0.00 28.75 29.06 2ppa h GLU 8 CO -0.01 0.49 0.23 0.82 -1.00 0.00 0.00 179.01 179.53 2ppa h ILE 9 N 0.76 1.25 0.00 3.13 2.04 -0.92 -2.71 117.51 121.05 2ppa h ILE 9 Ca 0.26 -0.81 -0.01 0.00 1.00 0.00 0.00 64.86 65.30 2ppa h ILE 9 Cb 0.04 0.54 -0.00 0.00 -0.74 0.00 0.00 36.82 36.66 2ppa h ILE 9 CO -0.11 0.31 -0.06 0.00 0.00 0.00 0.00 178.15 178.29 2ppa h ALA 10 N 1.09 1.35 0.00 1.87 0.00 -0.69 -1.88 119.26 121.00 2ppa h ALA 10 Ca 0.21 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.07 2ppa h ALA 10 Cb 0.26 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.04 2ppa h ALA 10 CO -0.01 0.07 -0.40 0.00 0.00 0.00 0.00 179.25 178.91 2ppa n ALA 11 N -2.28 3.16 -1.78 0.00 0.00 -0.96 -4.94 120.51 113.72 2ppa n ALA 11 Ca -0.02 -0.27 -0.36 0.00 0.00 0.00 0.00 53.44 52.79 2ppa n ALA 11 Cb 0.16 -1.21 -0.02 0.00 0.00 0.00 0.00 19.45 18.38 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 -3.23 3.90 0.43 0.00 1.43 -0.71 -4.98 118.68 115.53 2ppa s LEU 12 Ca 0.11 2.14 -0.26 0.00 -1.03 0.00 0.00 54.13 55.09 2ppa s LEU 12 Cb 0.17 -4.42 -0.09 0.00 0.03 0.00 0.00 46.19 41.88 2ppa s LEU 12 CO 0.66 -0.93 1.41 -2.65 0.23 0.00 0.00 176.35 175.08 2ppa n PRO 13 N -0.81 2.27 -3.92 1.29 -0.02 -1.26 -4.72 135.00 127.83 2ppa n PRO 13 Ca 0.09 0.81 -0.32 0.00 -2.02 0.00 0.00 63.50 62.06 2ppa n PRO 13 Cb 0.50 -2.59 -0.04 0.00 -0.02 0.00 0.00 33.50 31.35 2ppa n PRO 13 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 2ppa s ARG 14 N -2.34 3.43 -0.05 -0.52 3.00 -1.26 -1.34 118.95 119.87 2ppa s ARG 14 Ca 0.60 -0.41 -0.02 0.00 0.00 0.00 0.00 55.73 55.90 2ppa s ARG 14 Cb -0.47 -3.05 0.03 0.00 0.00 0.00 0.00 34.95 31.47 2ppa s ARG 14 CO 0.59 0.63 0.08 -1.14 0.00 0.00 0.00 175.30 175.46 2ppa s GLN 15 N -2.33 -0.04 -0.08 3.54 0.74 -0.51 -4.94 119.66 116.06 2ppa s GLN 15 Ca 0.32 0.39 -0.23 0.00 0.05 0.00 0.00 55.36 55.90 2ppa s GLN 15 Cb -0.13 -0.39 -0.04 0.00 1.10 0.00 0.00 33.01 33.55 2ppa s GLN 15 CO 0.25 -0.29 0.67 0.15 -0.55 0.00 0.00 175.29 175.53 2ppa s LYS 16 N 1.94 4.42 -0.07 1.67 1.02 -1.26 0.04 119.74 127.50 2ppa s LYS 16 Ca 0.01 0.83 0.01 0.00 0.02 0.00 0.00 55.97 56.84 2ppa s LYS 16 Cb -0.12 -3.45 -0.03 0.00 -0.52 0.00 0.00 37.83 33.71 2ppa s LYS 16 CO -0.04 0.07 -0.10 0.08 -0.92 0.00 0.00 175.35 174.44 2ppa s VAL 17 N 0.81 3.45 -0.32 3.17 1.01 -0.38 -4.92 120.40 123.21 2ppa s VAL 17 Ca 0.36 -0.57 -0.13 0.00 0.00 0.00 0.00 61.98 61.65 2ppa s VAL 17 Cb -0.17 -2.40 -0.03 0.00 0.00 0.00 0.00 36.38 33.78 2ppa s VAL 17 CO 0.17 0.58 0.25 -1.61 0.00 0.00 0.00 175.10 174.49 2ppa s GLU 18 N -0.59 3.66 0.57 2.72 8.01 -1.26 -4.67 118.70 127.14 2ppa s GLU 18 Ca 0.09 -0.49 -0.17 0.00 0.01 0.00 0.00 54.97 54.41 2ppa s GLU 18 Cb -0.12 -3.76 -0.04 0.00 -4.31 0.00 0.00 34.13 25.90 2ppa s GLU 18 CO 0.02 -0.37 1.06 -0.51 0.01 0.00 0.00 175.26 175.47 2ppa s LEU 19 N 1.79 3.57 0.15 1.80 1.43 -1.26 -4.73 118.68 121.43 2ppa s LEU 19 Ca 0.08 1.88 0.06 0.00 -1.03 0.00 0.00 54.13 55.12 2ppa s LEU 19 Cb -0.17 -4.54 -0.04 0.00 0.03 0.00 0.00 46.19 41.47 2ppa s LEU 19 CO 0.11 -1.13 -0.14 0.68 0.23 0.00 0.00 176.35 176.10 2ppa s VAL 20 N -2.30 1.43 0.22 -1.59 -7.23 -1.26 -5.00 120.40 104.66 2ppa s VAL 20 Ca 0.65 -1.93 -0.30 0.00 -1.81 0.00 0.00 61.98 58.59 2ppa s VAL 20 Cb -0.17 -1.75 -0.09 0.00 0.56 0.00 0.00 36.38 34.93 2ppa s VAL 20 CO 0.33 -0.53 1.27 -1.81 -0.31 0.00 0.00 175.10 174.05 2ppa s ASP 21 N -2.84 6.95 0.60 4.85 -0.00 -1.26 -4.64 116.67 120.33 2ppa s ASP 21 Ca 0.14 2.39 -0.18 0.00 -0.00 0.00 0.00 52.55 54.91 2ppa s ASP 21 Cb -0.02 -2.62 -0.07 0.00 -0.00 0.00 0.00 42.92 40.21 2ppa s ASP 21 CO 0.04 -0.47 0.64 -2.65 -0.00 0.00 0.00 175.17 172.73 2ppa n PRO 22 N 2.28 0.58 -0.03 8.23 -0.02 -1.26 -2.08 135.00 142.70 2ppa n PRO 22 Ca 0.04 0.23 0.10 0.00 -2.02 0.00 0.00 63.50 61.85 2ppa n PRO 22 Cb 0.43 -1.84 0.47 0.00 -0.02 0.00 0.00 33.50 32.54 2ppa n PRO 22 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 2ppa n PRO 23 N -0.41 1.29 -1.63 0.52 -0.04 -1.26 -5.05 135.00 128.42 2ppa n PRO 23 Ca 0.12 -0.44 -0.32 0.00 -0.04 0.00 0.00 63.50 62.83 2ppa n PRO 23 Cb 0.48 -1.33 0.05 0.00 -0.04 0.00 0.00 33.50 32.66 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 -1.92 2.91 -0.02 0.54 0.40 -0.88 -0.54 117.98 118.48 2ppa s PHE 24 Ca 0.29 1.49 0.05 0.00 -0.60 0.00 0.00 56.93 58.15 2ppa s PHE 24 Cb 0.14 -2.98 -0.01 0.00 0.51 0.00 0.00 43.02 40.69 2ppa s PHE 24 CO 0.23 -1.38 -0.16 0.08 0.70 0.00 0.00 175.22 174.70 2ppa s VAL 25 N -2.81 1.26 0.74 -0.44 1.01 -1.26 -4.65 120.40 114.25 2ppa s VAL 25 Ca 0.61 -0.67 -0.15 0.00 0.00 0.00 0.00 61.98 61.77 2ppa s VAL 25 Cb -0.16 -1.06 0.03 0.00 0.00 0.00 0.00 36.38 35.20 2ppa s VAL 25 CO 0.50 0.36 1.13 0.00 0.00 0.00 0.00 175.10 177.08 2ppa n HIS 26 N 2.81 1.17 -1.67 5.22 1.44 -1.26 -4.90 115.22 118.03 2ppa n HIS 26 Ca -0.15 0.40 -0.44 0.00 -2.01 0.00 0.00 57.72 55.52 2ppa n HIS 26 Cb 0.54 -2.13 -0.02 0.00 0.12 0.00 0.00 29.99 28.50 2ppa n HIS 26 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2ppa n ALA 27 N -2.71 0.92 -3.64 1.59 0.00 -1.26 -4.99 120.51 110.42 2ppa n ALA 27 Ca 0.14 0.39 -0.08 0.00 0.00 0.00 0.00 53.44 53.89 2ppa n ALA 27 Cb 0.50 -2.22 -0.02 0.00 0.00 0.00 0.00 19.45 17.70 2ppa n ALA 27 CO 0.00 0.00 0.00 -3.38 0.00 0.00 0.00 177.50 174.12 2ppa s HIS 28 N -0.58 -0.31 -0.09 0.00 -3.43 -1.26 -5.02 115.29 104.60 2ppa s HIS 28 Ca 0.62 0.01 -0.02 0.00 -0.80 0.00 0.00 55.06 54.88 2ppa s HIS 28 Cb -0.64 0.62 -0.03 0.00 -1.43 0.00 0.00 32.58 31.10 2ppa s HIS 28 CO 0.56 -0.92 -0.01 0.45 -2.00 0.00 0.00 174.74 172.82 2ppa s SER 29 N -2.80 5.08 -0.01 7.38 0.15 -1.26 -5.03 113.70 117.21 2ppa s SER 29 Ca 0.07 0.08 -0.23 0.00 0.70 0.00 0.00 55.95 56.57 2ppa s SER 29 Cb -0.03 -1.47 -0.19 0.00 -1.71 0.00 0.00 66.02 62.63 2ppa s SER 29 CO -0.03 0.34 1.23 1.56 1.20 0.00 0.00 173.24 177.54 2ppa h GLN 30 N 5.41 0.19 -5.94 5.44 4.20 -1.97 -3.42 115.11 119.03 2ppa h GLN 30 Ca -0.48 -0.12 -0.57 0.00 0.06 0.00 0.00 58.65 57.54 2ppa h GLN 30 Cb 1.19 0.02 -0.06 0.00 0.30 0.00 0.00 27.48 28.92 2ppa h GLN 30 CO 0.55 0.71 0.14 0.08 -0.67 0.00 0.00 178.83 179.65 2ppa s VAL 31 N -3.94 5.01 0.22 -0.54 1.01 -1.26 -3.27 120.40 117.63 2ppa s VAL 31 Ca -0.15 1.42 -0.32 0.00 0.00 0.00 0.00 61.98 62.92 2ppa s VAL 31 Cb 0.03 -4.03 -0.12 0.00 0.00 0.00 0.00 36.38 32.25 2ppa s VAL 31 CO 0.72 0.18 1.66 0.00 0.00 0.00 0.00 175.10 177.67 2ppa n ALA 32 N 4.30 2.46 -2.63 5.51 0.00 0.13 -4.92 120.51 125.35 2ppa n ALA 32 Ca -0.00 0.40 -0.42 0.00 0.00 0.00 0.00 53.44 53.42 2ppa n ALA 32 Cb 0.51 -2.47 -0.03 0.00 0.00 0.00 0.00 19.45 17.45 2ppa n ALA 32 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 2ppa s GLU 33 N 0.68 3.35 1.90 0.00 2.02 -1.26 -4.92 118.70 120.47 2ppa s GLU 33 Ca 0.73 -0.77 0.00 0.00 0.02 0.00 0.00 54.97 54.95 2ppa s GLU 33 Cb -0.54 -4.66 0.00 0.00 0.10 0.00 0.00 34.13 29.03 2ppa s GLU 33 CO 0.38 -2.09 0.00 0.41 0.02 0.00 0.00 175.26 173.98 2ppa n GLY 34 N 5.90 -1.11 2.52 -1.39 0.00 -1.26 -4.93 105.19 104.91 2ppa n GLY 34 Ca 0.14 -1.20 -0.21 0.00 0.00 0.00 0.00 46.02 44.75 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 0.00 -2.47 3.72 -0.02 0.00 -1.26 -4.96 105.19 100.20 2ppa n GLY 35 Ca 0.00 -1.52 -0.40 0.00 0.00 0.00 0.00 46.02 44.11 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 -3.72 1.90 -4.35 1.61 -0.02 -1.26 -5.02 135.00 124.13 2ppa n PRO 36 Ca 0.11 0.68 -0.18 0.00 -2.02 0.00 0.00 63.50 62.09 2ppa n PRO 36 Cb 0.41 -2.49 -0.10 0.00 -0.02 0.00 0.00 33.50 31.31 2ppa n PRO 36 CO 0.00 0.00 0.00 -1.59 1.98 0.00 0.00 175.50 175.89 2ppa s LYS 37 N -2.47 1.35 -0.40 -0.52 -2.85 -1.26 -4.38 119.74 109.20 2ppa s LYS 37 Ca 0.64 -1.62 -0.18 0.00 -1.00 0.00 0.00 55.97 53.81 2ppa s LYS 37 Cb -0.46 -1.04 0.01 0.00 -2.06 0.00 0.00 37.83 34.28 2ppa s LYS 37 CO 0.55 0.12 0.48 0.08 0.10 0.00 0.00 175.35 176.68 2ppa s VAL 38 N -3.05 5.04 -0.25 1.79 1.01 -0.45 -1.14 120.40 123.34 2ppa s VAL 38 Ca 0.24 -0.10 -0.12 0.00 0.00 0.00 0.00 61.98 61.99 2ppa s VAL 38 Cb 0.01 -4.03 -0.05 0.00 0.00 0.00 0.00 36.38 32.32 2ppa s VAL 38 CO 0.07 -0.38 0.25 -0.69 0.00 0.00 0.00 175.10 174.35 2ppa s VAL 39 N 2.28 5.28 -0.18 2.92 1.01 0.63 -1.43 120.40 130.93 2ppa s VAL 39 Ca 0.15 0.33 -0.07 0.00 0.00 0.00 0.00 61.98 62.38 2ppa s VAL 39 Cb -0.16 -3.58 -0.04 0.00 0.00 0.00 0.00 36.38 32.60 2ppa s VAL 39 CO 0.14 0.26 0.07 -1.61 0.00 0.00 0.00 175.10 173.97 2ppa s GLU 40 N 1.53 3.93 0.08 2.72 2.02 0.11 -0.74 118.70 128.34 2ppa s GLU 40 Ca 0.10 -0.32 0.06 0.00 0.02 0.00 0.00 54.97 54.83 2ppa s GLU 40 Cb -0.15 -3.21 -0.03 0.00 0.10 0.00 0.00 34.13 30.84 2ppa s GLU 40 CO 0.08 0.32 -0.16 -0.06 0.02 0.00 0.00 175.26 175.47 2ppa s PHE 41 N 0.23 1.34 -0.02 1.61 0.40 -0.49 -1.25 117.98 119.80 2ppa s PHE 41 Ca 0.05 -0.46 0.03 0.00 -0.60 0.00 0.00 56.93 55.94 2ppa s PHE 41 Cb -0.12 -0.75 0.00 0.00 0.51 0.00 0.00 43.02 42.66 2ppa s PHE 41 CO 0.00 0.09 -0.09 0.99 0.70 0.00 0.00 175.22 176.91 2ppa s THR 42 N -1.30 0.76 -0.01 0.64 2.01 -1.26 -0.75 115.64 115.72 2ppa s THR 42 Ca 0.00 -0.37 0.00 0.00 0.31 0.00 0.00 61.69 61.64 2ppa s THR 42 Cb -0.10 -0.67 0.01 0.00 0.01 0.00 0.00 72.50 71.75 2ppa s THR 42 CO 0.03 0.23 0.00 -0.04 -0.69 0.00 0.00 174.62 174.15 2ppa s MET 43 N 0.09 0.11 -0.14 4.92 -1.94 -0.56 -4.90 119.30 116.88 2ppa s MET 43 Ca -0.01 0.04 -0.07 0.00 -1.71 0.00 0.00 55.69 53.94 2ppa s MET 43 Cb -0.07 -0.23 -0.04 0.00 2.01 0.00 0.00 34.83 36.50 2ppa s MET 43 CO 0.00 -0.06 0.10 0.08 -0.01 0.00 0.00 175.02 175.13 2ppa s VAL 44 N 0.50 5.18 -0.12 -6.03 1.01 -1.26 -1.41 120.40 118.27 2ppa s VAL 44 Ca -0.04 0.09 -0.22 0.00 0.00 0.00 0.00 61.98 61.81 2ppa s VAL 44 Cb -0.07 -3.29 -0.03 0.00 0.00 0.00 0.00 36.38 32.99 2ppa s VAL 44 CO -0.01 0.55 0.63 -0.63 0.00 0.00 0.00 175.10 175.64 2ppa s ILE 45 N -0.44 5.07 -0.18 2.22 1.01 0.08 -0.67 121.20 128.28 2ppa s ILE 45 Ca 0.11 1.26 0.01 0.00 0.00 0.00 0.00 60.65 62.03 2ppa s ILE 45 Cb -0.12 -3.96 0.02 0.00 0.01 0.00 0.00 42.46 38.40 2ppa s ILE 45 CO 0.02 0.22 -0.19 -1.61 0.00 0.00 0.00 174.94 173.38 2ppa s GLU 46 N 1.12 3.03 -0.28 2.79 0.41 -0.22 -4.35 118.70 121.21 2ppa s GLU 46 Ca 0.32 -0.81 -0.23 0.00 -0.41 0.00 0.00 54.97 53.84 2ppa s GLU 46 Cb -0.16 -2.60 -0.01 0.00 -1.78 0.00 0.00 34.13 29.58 2ppa s GLU 46 CO 0.14 -0.19 0.76 -1.21 -0.49 0.00 0.00 175.26 174.26 2ppa s GLU 47 N 1.26 4.04 0.01 1.61 2.02 -1.26 -0.66 118.70 125.73 2ppa s GLU 47 Ca 0.04 0.65 -0.15 0.00 0.02 0.00 0.00 54.97 55.53 2ppa s GLU 47 Cb -0.13 -3.69 0.02 0.00 0.10 0.00 0.00 34.13 30.43 2ppa s GLU 47 CO -0.11 -0.58 0.31 -1.59 0.02 0.00 0.00 175.26 173.31 2ppa s LYS 48 N 2.82 0.75 0.16 1.61 -2.85 -0.91 -4.99 119.74 116.32 2ppa s LYS 48 Ca 0.31 -0.34 -0.30 0.00 -1.00 0.00 0.00 55.97 54.64 2ppa s LYS 48 Cb -0.15 0.33 -0.07 0.00 -2.06 0.00 0.00 37.83 35.88 2ppa s LYS 48 CO 0.10 -0.22 1.15 0.15 0.10 0.00 0.00 175.35 176.63 2ppa s LYS 49 N -1.95 4.52 0.06 1.78 1.02 -1.26 -0.65 119.74 123.27 2ppa s LYS 49 Ca -0.09 1.78 0.08 0.00 0.02 0.00 0.00 55.97 57.77 2ppa s LYS 49 Cb -0.03 -3.28 -0.03 0.00 -0.52 0.00 0.00 37.83 33.97 2ppa s LYS 49 CO 0.01 -0.05 -0.22 0.96 -0.92 0.00 0.00 175.35 175.13 2ppa s ILE 50 N 0.09 2.52 -0.24 2.17 -4.36 -0.15 -4.90 121.20 116.34 2ppa s ILE 50 Ca 0.52 -1.36 -0.10 0.00 -0.26 0.00 0.00 60.65 59.46 2ppa s ILE 50 Cb -0.30 -2.05 -0.05 0.00 1.25 0.00 0.00 42.46 41.31 2ppa s ILE 50 CO 0.34 0.29 0.14 -0.69 0.24 0.00 0.00 174.94 175.26 2ppa s VAL 51 N -0.92 5.10 -0.94 8.37 1.01 -1.26 -1.06 120.40 130.70 2ppa s VAL 51 Ca 0.14 0.09 0.12 0.00 0.00 0.00 0.00 61.98 62.33 2ppa s VAL 51 Cb -0.10 -3.38 -0.05 0.00 0.00 0.00 0.00 36.38 32.85 2ppa s VAL 51 CO 0.05 0.34 0.65 2.30 0.00 0.00 0.00 175.10 178.44 2ppa n ILE 52 N 4.43 0.00 -4.03 2.22 -5.35 0.05 -4.78 119.36 111.90 2ppa n ILE 52 Ca -0.15 -0.31 -0.11 0.00 -0.27 0.00 0.00 62.75 61.91 2ppa n ILE 52 Cb 0.52 1.09 -0.05 0.00 -1.74 0.00 0.00 39.64 39.47 2ppa n ILE 52 CO 0.00 0.00 0.00 1.51 -1.76 0.00 0.00 176.55 176.30 2ppa s ASP 53 N -1.81 0.28 0.00 7.28 3.84 -1.26 -0.24 116.67 124.76 2ppa s ASP 53 Ca 0.08 -1.17 0.30 0.00 -0.00 0.00 0.00 52.55 51.76 2ppa s ASP 53 Cb 0.10 0.62 1.78 0.00 -1.38 0.00 0.00 42.92 44.03 2ppa s ASP 53 CO 0.39 -1.21 2.12 -0.90 -0.00 0.00 0.00 175.17 175.57 2ppa n ASP 54 N -0.80 0.00 -0.63 2.11 5.68 -1.26 -2.33 116.55 119.31 2ppa n ASP 54 Ca -0.01 -0.89 0.10 0.00 -0.50 0.00 0.00 54.79 53.49 2ppa n ASP 54 Cb 0.62 -0.02 0.33 0.00 -1.14 0.00 0.00 41.12 40.92 2ppa n ASP 54 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2ppa n ALA 55 N -1.02 2.50 -1.04 2.12 0.00 -1.26 -4.93 120.51 116.88 2ppa n ALA 55 Ca 0.22 -0.59 -0.01 0.00 0.00 0.00 0.00 53.44 53.06 2ppa n ALA 55 Cb 0.11 -1.05 -0.01 0.00 0.00 0.00 0.00 19.45 18.50 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 1.17 0.51 3.72 0.00 0.00 -0.99 -4.99 105.19 104.61 2ppa n GLY 56 Ca 0.16 -0.46 -0.42 0.00 0.00 0.00 0.00 46.02 45.30 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 -1.98 2.09 0.04 2.61 2.01 -1.26 -4.85 115.64 114.29 2ppa s THR 57 Ca 0.00 0.07 0.03 0.00 0.31 0.00 0.00 61.69 62.10 2ppa s THR 57 Cb 0.00 -3.04 -0.04 0.00 0.01 0.00 0.00 72.50 69.43 2ppa s THR 57 CO 0.00 0.01 -0.00 -1.61 -0.69 0.00 0.00 174.62 172.32 2ppa s GLU 58 N 0.91 2.68 -0.01 4.92 2.02 -1.26 -0.77 118.70 127.18 2ppa s GLU 58 Ca 0.72 -0.71 0.05 0.00 0.02 0.00 0.00 54.97 55.06 2ppa s GLU 58 Cb -0.49 -2.61 -0.01 0.00 0.10 0.00 0.00 34.13 31.12 2ppa s GLU 58 CO 0.34 0.59 -0.17 0.08 0.02 0.00 0.00 175.26 176.12 2ppa s VAL 59 N -1.18 1.34 -0.92 2.63 1.01 -0.22 -4.96 120.40 118.10 2ppa s VAL 59 Ca 0.22 -0.73 -0.23 0.00 0.00 0.00 0.00 61.98 61.25 2ppa s VAL 59 Cb -0.12 -1.12 0.06 0.00 0.00 0.00 0.00 36.38 35.21 2ppa s VAL 59 CO 0.14 0.38 1.32 -1.00 0.00 0.00 0.00 175.10 175.94 2ppa s HIS 60 N -0.39 2.60 0.52 5.22 3.76 -1.26 -0.98 115.29 124.77 2ppa s HIS 60 Ca 0.06 -0.77 -0.18 0.00 -0.15 0.00 0.00 55.06 54.02 2ppa s HIS 60 Cb -0.07 -4.58 -0.07 0.00 1.11 0.00 0.00 32.58 28.97 2ppa s HIS 60 CO -0.01 -1.87 1.03 0.00 -0.85 0.00 0.00 174.74 173.05 2ppa s ALA 61 N 4.65 2.86 -0.32 -1.40 0.00 0.18 -4.81 121.76 122.92 2ppa s ALA 61 Ca 0.40 0.47 0.01 0.00 0.00 0.00 0.00 51.96 52.84 2ppa s ALA 61 Cb -0.04 -3.22 0.10 0.00 0.00 0.00 0.00 23.12 19.96 2ppa s ALA 61 CO -0.04 -0.45 0.07 -1.64 0.00 0.00 0.00 175.76 173.70 2ppa s MET 62 N -3.61 1.11 -0.26 0.00 -1.94 -0.35 -2.15 119.30 112.09 2ppa s MET 62 Ca 0.65 -1.41 0.01 0.00 -1.71 0.00 0.00 55.69 53.22 2ppa s MET 62 Cb -0.15 -2.56 0.05 0.00 2.01 0.00 0.00 34.83 34.17 2ppa s MET 62 CO 0.27 -0.94 -0.09 0.00 -0.01 0.00 0.00 175.02 174.25 2ppa s ALA 63 N 1.29 2.62 0.06 3.03 0.00 0.16 -2.51 121.76 126.42 2ppa s ALA 63 Ca 0.09 -1.64 -0.31 0.00 0.00 0.00 0.00 51.96 50.10 2ppa s ALA 63 Cb -0.18 -1.64 -0.10 0.00 0.00 0.00 0.00 23.12 21.20 2ppa s ALA 63 CO -0.16 -1.03 1.92 1.19 0.00 0.00 0.00 175.76 177.67 2ppa n PHE 64 N 4.55 2.54 -1.31 0.00 3.72 -1.25 -1.05 117.46 124.65 2ppa n PHE 64 Ca -0.15 -0.26 -0.11 0.00 -0.05 0.00 0.00 57.45 56.88 2ppa n PHE 64 Cb 0.44 -2.77 -0.05 0.00 -0.94 0.00 0.00 39.48 36.17 2ppa n PHE 64 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 176.76 175.00 2ppa n ASN 65 N 6.74 -4.95 0.00 4.37 5.15 0.15 -2.59 115.26 124.13 2ppa n ASN 65 Ca 0.19 0.27 0.00 0.00 -0.60 0.00 0.00 54.58 54.44 2ppa n ASN 65 Cb 0.39 -3.39 0.00 0.00 -0.53 0.00 0.00 39.78 36.25 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 -0.79 0.81 3.40 8.20 0.00 -0.93 -4.95 105.19 110.92 2ppa n GLY 66 Ca -0.11 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.70 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 -3.20 2.07 -0.22 2.61 -4.23 -1.07 -4.95 115.64 106.64 2ppa s THR 67 Ca 0.00 -2.23 0.01 0.00 -1.18 0.00 0.00 61.69 58.29 2ppa s THR 67 Cb 0.00 -2.12 0.05 0.00 1.34 0.00 0.00 72.50 71.78 2ppa s THR 67 CO 0.00 -0.45 -0.09 -0.69 -0.54 0.00 0.00 174.62 172.85 2ppa s VAL 68 N -2.58 1.73 0.93 2.29 1.01 -1.26 -3.15 120.40 119.37 2ppa s VAL 68 Ca 0.24 -1.22 -0.13 0.00 0.00 0.00 0.00 61.98 60.87 2ppa s VAL 68 Cb -0.04 -1.87 0.15 0.00 0.00 0.00 0.00 36.38 34.62 2ppa s VAL 68 CO 0.10 0.04 1.15 -2.16 0.00 0.00 0.00 175.10 174.23 2ppa s PRO 69 N 1.33 0.97 0.94 2.72 0.04 -1.26 -2.12 135.00 137.62 2ppa s PRO 69 Ca -0.04 0.23 -0.11 0.00 0.04 0.00 0.00 61.00 61.12 2ppa s PRO 69 Cb -0.18 -1.83 0.16 0.00 0.04 0.00 0.00 34.50 32.69 2ppa s PRO 69 CO -0.07 -2.30 1.10 0.20 0.04 0.00 0.00 177.00 175.98 2ppa s GLY 70 N -4.07 1.64 0.68 0.56 0.00 0.24 -4.76 107.32 101.63 2ppa s GLY 70 Ca 0.65 0.27 -0.13 0.00 0.00 0.00 0.00 44.72 45.51 2ppa s GLY 70 CO 0.53 0.75 1.08 2.56 0.00 0.00 0.00 173.10 178.03 2ppa s PRO 71 N -4.71 2.79 -0.05 2.90 0.04 -1.26 -4.41 135.00 130.30 2ppa s PRO 71 Ca 0.66 1.21 -0.29 0.00 0.04 0.00 0.00 61.00 62.62 2ppa s PRO 71 Cb -0.21 -1.96 -0.02 0.00 0.04 0.00 0.00 34.50 32.34 2ppa s PRO 71 CO 0.59 -1.24 0.98 -1.17 0.04 0.00 0.00 177.00 176.20 2ppa s LEU 72 N -5.19 4.31 -0.15 -3.56 2.96 -1.26 -4.27 118.68 111.52 2ppa s LEU 72 Ca 0.63 1.58 -0.06 0.00 -0.22 0.00 0.00 54.13 56.06 2ppa s LEU 72 Cb -0.17 -3.54 -0.04 0.00 0.50 0.00 0.00 46.19 42.93 2ppa s LEU 72 CO 0.47 -0.34 0.07 -0.04 -1.32 0.00 0.00 176.35 175.19 2ppa s MET 73 N 1.45 3.66 -0.15 1.98 -1.94 -1.16 -4.55 119.30 118.59 2ppa s MET 73 Ca 0.50 -0.30 0.02 0.00 -1.71 0.00 0.00 55.69 54.20 2ppa s MET 73 Cb -0.20 -3.13 0.01 0.00 2.01 0.00 0.00 34.83 33.52 2ppa s MET 73 CO 0.23 0.48 -0.21 0.08 -0.01 0.00 0.00 175.02 175.59 2ppa s VAL 74 N -0.22 2.09 0.39 -6.03 1.01 -1.26 -0.34 120.40 116.05 2ppa s VAL 74 Ca 0.08 -0.96 0.05 0.00 0.00 0.00 0.00 61.98 61.15 2ppa s VAL 74 Cb -0.12 -1.85 -0.02 0.00 0.00 0.00 0.00 36.38 34.39 2ppa s VAL 74 CO 0.01 0.54 0.17 0.68 0.00 0.00 0.00 175.10 176.51 2ppa s VAL 75 N 0.97 0.42 0.28 2.92 -7.23 -0.40 -4.99 120.40 112.38 2ppa s VAL 75 Ca -0.03 -2.00 0.09 0.00 -1.81 0.00 0.00 61.98 58.23 2ppa s VAL 75 Cb -0.15 -2.37 -0.04 0.00 0.56 0.00 0.00 36.38 34.38 2ppa s VAL 75 CO -0.05 0.00 0.06 -1.00 -0.31 0.00 0.00 175.10 173.80 2ppa s HIS 76 N -3.27 2.76 0.24 2.82 3.76 -1.26 -0.89 115.29 119.44 2ppa s HIS 76 Ca 0.27 -0.25 -0.31 0.00 -0.15 0.00 0.00 55.06 54.62 2ppa s HIS 76 Cb 0.02 -1.33 -0.13 0.00 1.11 0.00 0.00 32.58 32.25 2ppa s HIS 76 CO 0.18 0.54 1.56 0.94 -0.85 0.00 0.00 174.74 177.10 2ppa n GLN 77 N -1.00 2.41 -0.79 1.40 7.27 0.32 -1.61 117.38 125.38 2ppa n GLN 77 Ca -0.06 0.86 0.00 0.00 0.07 0.00 0.00 57.00 57.87 2ppa n GLN 77 Cb 0.59 -2.61 0.00 0.00 2.41 0.00 0.00 30.24 30.63 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 2.72 0.00 -4.67 1.69 10.43 0.87 -4.77 116.55 122.83 2ppa n ASP 78 Ca 0.12 0.00 -0.30 0.00 2.57 0.00 0.00 54.79 57.19 2ppa n ASP 78 Cb 0.33 -0.15 0.16 0.00 1.84 0.00 0.00 41.12 43.31 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 -3.11 2.93 -0.16 -2.24 -0.00 -0.64 -4.73 116.67 108.72 2ppa s ASP 79 Ca 0.00 1.62 -0.05 0.00 -0.00 0.00 0.00 52.55 54.12 2ppa s ASP 79 Cb 0.00 -2.27 -0.03 0.00 -0.00 0.00 0.00 42.92 40.62 2ppa s ASP 79 CO 0.00 -3.00 0.01 -0.31 -0.00 0.00 0.00 175.17 171.87 2ppa s TYR 80 N -2.80 3.13 -0.24 4.23 1.51 -0.29 -1.00 117.35 121.89 2ppa s TYR 80 Ca 0.65 -0.09 -0.12 0.00 -1.01 0.00 0.00 57.07 56.49 2ppa s TYR 80 Cb -0.20 -1.98 -0.05 0.00 -0.11 0.00 0.00 41.96 39.62 2ppa s TYR 80 CO 0.59 0.10 0.25 -1.17 -1.11 0.00 0.00 175.55 174.21 2ppa s LEU 81 N 0.20 4.09 -0.29 -1.29 0.20 0.18 -0.26 118.68 121.51 2ppa s LEU 81 Ca 0.01 0.21 0.03 0.00 0.69 0.00 0.00 54.13 55.06 2ppa s LEU 81 Cb -0.13 -2.25 0.07 0.00 -0.43 0.00 0.00 46.19 43.45 2ppa s LEU 81 CO 0.02 -0.03 -0.05 -0.70 -0.29 0.00 0.00 176.35 175.30 2ppa s GLU 82 N 1.41 2.05 -0.17 1.98 2.12 0.08 -1.32 118.70 124.84 2ppa s GLU 82 Ca 0.11 -1.49 -0.06 0.00 0.36 0.00 0.00 54.97 53.89 2ppa s GLU 82 Cb -0.15 -3.02 -0.03 0.00 0.26 0.00 0.00 34.13 31.19 2ppa s GLU 82 CO 0.07 -0.69 0.01 -1.17 -0.54 0.00 0.00 175.26 172.95 2ppa s LEU 83 N 1.06 3.51 -0.34 2.70 2.96 0.64 -1.40 118.68 127.81 2ppa s LEU 83 Ca -0.03 -0.05 -0.16 0.00 -0.22 0.00 0.00 54.13 53.68 2ppa s LEU 83 Cb -0.20 -1.87 -0.01 0.00 0.50 0.00 0.00 46.19 44.61 2ppa s LEU 83 CO -0.05 0.15 0.40 -0.89 -1.32 0.00 0.00 176.35 174.64 2ppa s THR 84 N 0.47 5.13 -0.14 3.68 2.01 0.07 -0.82 115.64 126.04 2ppa s THR 84 Ca -0.00 0.15 -0.01 0.00 0.31 0.00 0.00 61.69 62.14 2ppa s THR 84 Cb -0.13 -3.85 -0.02 0.00 0.01 0.00 0.00 72.50 68.51 2ppa s THR 84 CO 0.02 -0.11 -0.11 -0.22 -0.69 0.00 0.00 174.62 173.51 2ppa s LEU 85 N 2.11 2.81 -0.11 4.42 2.96 -0.28 -1.50 118.68 129.10 2ppa s LEU 85 Ca 0.14 -0.30 0.04 0.00 -0.22 0.00 0.00 54.13 53.78 2ppa s LEU 85 Cb -0.16 -1.65 0.00 0.00 0.50 0.00 0.00 46.19 44.88 2ppa s LEU 85 CO 0.12 0.15 -0.23 -0.63 -1.32 0.00 0.00 176.35 174.44 2ppa s ILE 86 N 0.42 2.03 -0.41 6.68 1.01 -0.50 -1.48 121.20 128.95 2ppa s ILE 86 Ca -0.09 -0.99 -0.04 0.00 0.00 0.00 0.00 60.65 59.53 2ppa s ILE 86 Cb -0.15 -1.77 0.11 0.00 0.01 0.00 0.00 42.46 40.66 2ppa s ILE 86 CO 0.05 0.55 0.22 0.21 0.00 0.00 0.00 174.94 175.97 2ppa s ASN 87 N 0.46 5.32 0.70 3.58 2.47 -0.19 -0.74 114.94 126.54 2ppa s ASN 87 Ca -0.16 -1.96 -0.14 0.00 0.42 0.00 0.00 52.86 51.01 2ppa s ASN 87 Cb -0.17 -1.86 0.02 0.00 -1.45 0.00 0.00 41.25 37.79 2ppa s ASN 87 CO 0.06 -0.56 1.14 -2.84 -3.72 0.00 0.00 177.10 171.19 2ppa s PRO 88 N 1.19 2.46 0.06 0.43 0.02 -1.26 0.63 135.00 138.53 2ppa s PRO 88 Ca 0.07 1.51 0.11 0.00 0.02 0.00 0.00 61.00 62.71 2ppa s PRO 88 Cb -0.23 -1.90 0.50 0.00 0.02 0.00 0.00 34.50 32.89 2ppa s PRO 88 CO -0.03 -1.54 1.35 -0.85 -0.33 0.00 0.00 177.00 175.60 2ppa n GLU 89 N -2.68 0.04 0.03 5.54 0.28 -1.26 -1.46 120.64 121.13 2ppa n GLU 89 Ca 0.11 0.40 0.12 0.00 -0.16 0.00 0.00 57.16 57.63 2ppa n GLU 89 Cb 0.51 -1.59 0.50 0.00 1.43 0.00 0.00 31.44 32.29 2ppa n GLU 89 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 177.13 177.22 2ppa n THR 90 N -1.67 0.42 -2.47 3.84 -2.24 -1.26 -4.83 114.28 106.07 2ppa n THR 90 Ca 0.02 0.03 -0.25 0.00 -2.27 0.00 0.00 64.05 61.58 2ppa n THR 90 Cb 0.10 -0.69 0.04 0.00 -2.10 0.00 0.00 70.33 67.68 2ppa n THR 90 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 2ppa s ASN 91 N -3.38 5.32 -0.01 3.42 0.01 -0.54 -4.96 114.94 114.81 2ppa s ASN 91 Ca 0.11 0.42 0.05 0.00 -0.71 0.00 0.00 52.86 52.73 2ppa s ASN 91 Cb 0.15 -1.33 -0.07 0.00 0.41 0.00 0.00 41.25 40.41 2ppa s ASN 91 CO 0.47 -1.19 0.13 0.35 -1.51 0.00 0.00 177.10 175.35 2ppa n THR 92 N -2.56 0.00 -4.35 1.60 -2.24 -1.26 -4.78 114.28 100.68 2ppa n THR 92 Ca 0.06 -0.17 -0.27 0.00 -2.27 0.00 0.00 64.05 61.40 2ppa n THR 92 Cb 0.59 0.52 -0.11 0.00 -2.10 0.00 0.00 70.33 69.23 2ppa n THR 92 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2ppa s LEU 93 N -3.10 2.71 0.40 3.22 1.43 -1.26 -4.89 118.68 117.18 2ppa s LEU 93 Ca -0.01 -0.72 -0.25 0.00 -1.03 0.00 0.00 54.13 52.13 2ppa s LEU 93 Cb 0.03 -1.42 -0.09 0.00 0.03 0.00 0.00 46.19 44.75 2ppa s LEU 93 CO 0.20 0.11 1.10 -0.32 0.23 0.00 0.00 176.35 177.68 2ppa s MET 94 N -2.73 4.11 0.16 1.70 -2.45 -1.26 -4.12 119.30 114.71 2ppa s MET 94 Ca 0.23 1.66 -0.01 0.00 -1.25 0.00 0.00 55.69 56.32 2ppa s MET 94 Cb -0.08 -2.61 -0.04 0.00 1.25 0.00 0.00 34.83 33.34 2ppa s MET 94 CO 0.12 -0.22 0.09 -1.01 1.05 0.00 0.00 175.02 175.05 2ppa s HIS 95 N -1.53 0.96 0.00 4.11 0.09 -0.73 -4.91 115.29 113.28 2ppa s HIS 95 Ca 0.57 -1.28 0.00 0.00 -0.00 0.00 0.00 55.06 54.35 2ppa s HIS 95 Cb -0.26 -0.50 0.00 0.00 -0.00 0.00 0.00 32.58 31.82 2ppa s HIS 95 CO 0.33 -0.57 0.00 0.27 -0.00 0.00 0.00 174.74 174.77 2ppa n ASN 96 N -0.16 0.00 -3.78 1.40 6.94 -1.26 -0.85 115.26 117.54 2ppa n ASN 96 Ca -0.03 -0.80 -0.13 0.00 -0.02 0.00 0.00 54.58 53.61 2ppa n ASN 96 Cb 0.64 0.00 -0.13 0.00 -2.36 0.00 0.00 39.78 37.93 2ppa n ASN 96 CO 0.00 0.00 0.00 -0.51 -1.03 0.00 0.00 177.26 175.72 2ppa s ILE 97 N -2.74 -0.02 -0.18 1.53 2.07 -1.26 -4.14 121.20 116.45 2ppa s ILE 97 Ca 0.00 0.09 0.00 0.00 -1.41 0.00 0.00 60.65 59.33 2ppa s ILE 97 Cb 0.00 -0.23 0.01 0.00 0.13 0.00 0.00 42.46 42.37 2ppa s ILE 97 CO 0.00 0.04 -0.16 -1.81 -1.91 0.00 0.00 174.94 171.09 2ppa s ASP 98 N 0.65 3.43 -0.27 4.50 -0.00 0.21 -1.16 116.67 124.03 2ppa s ASP 98 Ca -0.05 -0.57 -0.11 0.00 -0.00 0.00 0.00 52.55 51.82 2ppa s ASP 98 Cb -0.06 -1.54 -0.05 0.00 -0.00 0.00 0.00 42.92 41.27 2ppa s ASP 98 CO -0.03 0.01 0.18 -0.36 -0.00 0.00 0.00 175.17 174.97 2ppa s PHE 99 N 1.24 3.23 0.43 4.23 0.40 0.11 -1.29 117.98 126.32 2ppa s PHE 99 Ca 0.03 0.10 0.37 0.00 -0.60 0.00 0.00 56.93 56.83 2ppa s PHE 99 Cb -0.14 -2.35 1.85 0.00 0.51 0.00 0.00 43.02 42.89 2ppa s PHE 99 CO -0.09 -0.13 2.18 0.45 0.70 0.00 0.00 175.22 178.33 2ppa h HIS 100 N 8.21 0.00 0.00 0.36 3.86 -1.54 -2.10 115.15 123.94 2ppa h HIS 100 Ca -0.36 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.85 2ppa h HIS 100 Cb 1.19 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.66 2ppa h HIS 100 CO 0.74 0.03 0.00 0.00 0.86 0.00 0.00 177.93 179.56 2ppa h ALA 101 N 1.97 1.00 -1.89 2.45 0.00 -1.90 -3.47 119.26 117.42 2ppa h ALA 101 Ca -0.00 0.00 -0.45 0.00 0.00 0.00 0.00 54.91 54.46 2ppa h ALA 101 Cb 0.24 0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.05 2ppa h ALA 101 CO 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 179.25 179.00 2ppa s ALA 102 N -3.36 4.07 -0.15 0.00 0.00 -0.79 -4.59 121.76 116.94 2ppa s ALA 102 Ca 0.05 -1.32 0.00 0.00 0.00 0.00 0.00 51.96 50.69 2ppa s ALA 102 Cb 0.09 -1.84 0.02 0.00 0.00 0.00 0.00 23.12 21.39 2ppa s ALA 102 CO 0.55 -0.16 -0.14 0.99 0.00 0.00 0.00 175.76 177.00 2ppa s THR 103 N -2.31 1.55 0.00 0.00 2.01 -1.26 -4.68 115.64 110.94 2ppa s THR 103 Ca 0.46 -0.64 0.00 0.00 0.31 0.00 0.00 61.69 61.82 2ppa s THR 103 Cb -0.10 -1.47 0.00 0.00 0.01 0.00 0.00 72.50 70.94 2ppa s THR 103 CO 0.33 0.43 0.00 0.61 -0.69 0.00 0.00 174.62 175.31 2ppa n GLY 104 N 4.77 2.92 4.06 4.40 0.00 -1.26 -4.91 105.19 115.17 2ppa n GLY 104 Ca -0.17 -1.91 -0.30 0.00 0.00 0.00 0.00 46.02 43.64 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 0.04 -1.73 -1.92 4.61 0.00 -1.26 -0.17 120.51 120.07 2ppa n ALA 105 Ca 0.00 -0.17 -0.20 0.00 0.00 0.00 0.00 53.44 53.07 2ppa n ALA 105 Cb 0.00 -2.23 -0.06 0.00 0.00 0.00 0.00 19.45 17.16 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 -1.64 0.00 0.00 4.77 -1.26 -0.85 117.00 113.60 2ppa n LEU 106 Ca -0.17 0.30 0.00 0.00 -0.03 0.00 0.00 56.01 56.11 2ppa n LEU 106 Cb 0.62 -2.83 0.00 0.00 -2.33 0.00 0.00 43.42 38.88 2ppa n LEU 106 CO 0.79 -0.72 0.00 0.61 -1.33 0.00 0.00 177.39 176.75 2ppa n GLY 107 N -0.63 0.76 0.00 -0.72 0.00 0.75 -4.14 105.19 101.22 2ppa n GLY 107 Ca -0.22 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.80 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 -2.20 1.83 0.22 -0.02 0.00 -0.03 0.04 105.19 105.02 2ppa n GLY 108 Ca 0.00 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.06 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 0.05 2.00 -0.02 0.00 -0.50 -2.14 103.07 102.46 2ppa h GLY 109 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 47.33 47.30 2ppa h GLY 109 CO 0.00 0.03 0.00 -1.33 0.00 0.00 0.00 176.54 175.24 2ppa h GLY 110 N 0.73 0.00 -1.18 4.60 0.00 -1.69 -3.12 103.07 102.41 2ppa h GLY 110 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.34 2ppa h GLY 110 CO 0.03 0.00 0.00 1.04 0.00 0.00 0.00 176.54 177.61 2ppa n LEU 111 N -3.04 2.27 -0.27 3.11 4.77 -0.83 -4.67 117.00 118.33 2ppa n LEU 111 Ca 0.01 -1.09 0.05 0.00 -0.03 0.00 0.00 56.01 54.96 2ppa n LEU 111 Cb 0.33 -0.03 0.07 0.00 -2.33 0.00 0.00 43.42 41.47 2ppa n LEU 111 CO 0.28 0.43 0.42 0.35 -1.33 0.00 0.00 177.39 177.54 2ppa n THR 112 N 0.79 0.99 -2.25 -5.08 -2.24 -1.07 -4.94 114.28 100.47 2ppa n THR 112 Ca 0.09 -1.19 -0.43 0.00 -2.27 0.00 0.00 64.05 60.25 2ppa n THR 112 Cb 0.36 0.11 -0.02 0.00 -2.10 0.00 0.00 70.33 68.68 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 -1.51 3.58 -0.12 -0.78 2.02 -1.25 -4.25 118.70 116.40 2ppa s GLU 113 Ca 0.17 1.16 0.03 0.00 0.02 0.00 0.00 54.97 56.34 2ppa s GLU 113 Cb 0.15 -4.05 0.01 0.00 0.10 0.00 0.00 34.13 30.34 2ppa s GLU 113 CO 0.02 -1.55 -0.21 0.96 0.02 0.00 0.00 175.26 174.49 2ppa s ILE 114 N 5.61 1.93 0.77 -1.63 -4.36 -0.03 -4.97 121.20 118.52 2ppa s ILE 114 Ca 0.66 -0.91 -0.12 0.00 -0.26 0.00 0.00 60.65 60.02 2ppa s ILE 114 Cb -0.17 -1.70 0.05 0.00 1.25 0.00 0.00 42.46 41.89 2ppa s ILE 114 CO 0.31 0.53 1.10 0.20 0.24 0.00 0.00 174.94 177.32 2ppa s ASN 115 N 0.72 4.77 0.21 4.36 0.02 -1.26 -1.77 114.94 121.99 2ppa s ASN 115 Ca -0.10 1.22 -0.32 0.00 -1.02 0.00 0.00 52.86 52.63 2ppa s ASN 115 Cb -0.16 -1.96 -0.14 0.00 0.02 0.00 0.00 41.25 39.02 2ppa s ASN 115 CO 0.01 -1.78 1.48 -2.65 0.02 0.00 0.00 177.10 174.18 2ppa n PRO 116 N -3.30 2.10 -0.23 -0.60 -0.02 -1.26 -1.44 135.00 130.25 2ppa n PRO 116 Ca 0.07 0.75 0.00 0.00 -2.02 0.00 0.00 63.50 62.30 2ppa n PRO 116 Cb 0.57 -2.46 0.00 0.00 -0.02 0.00 0.00 33.50 31.59 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 2.67 0.68 3.52 -1.23 0.00 0.20 -4.71 105.19 106.33 2ppa n GLY 117 Ca 0.14 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.91 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 -0.77 1.88 0.20 1.61 2.02 -0.52 -4.91 118.70 118.20 2ppa s GLU 118 Ca 0.00 -1.56 0.00 0.00 0.02 0.00 0.00 54.97 53.43 2ppa s GLU 118 Cb 0.00 -1.95 -0.04 0.00 0.10 0.00 0.00 34.13 32.24 2ppa s GLU 118 CO 0.00 0.37 0.07 -1.59 0.02 0.00 0.00 175.26 174.13 2ppa s LYS 119 N -3.32 1.19 0.10 1.61 -2.85 -1.26 -1.02 119.74 114.18 2ppa s LYS 119 Ca 0.28 -1.61 -0.15 0.00 -1.00 0.00 0.00 55.97 53.49 2ppa s LYS 119 Cb -0.06 -0.03 0.03 0.00 -2.06 0.00 0.00 37.83 35.70 2ppa s LYS 119 CO 0.16 -0.27 0.37 -0.08 0.10 0.00 0.00 175.35 175.63 2ppa s THR 120 N -3.89 0.08 -0.09 3.79 -1.32 -0.55 -5.00 115.64 108.65 2ppa s THR 120 Ca 0.32 -0.63 0.01 0.00 -1.21 0.00 0.00 61.69 60.18 2ppa s THR 120 Cb 0.07 -1.12 0.02 0.00 -1.51 0.00 0.00 72.50 69.96 2ppa s THR 120 CO 0.08 -0.35 -0.10 -0.63 -2.21 0.00 0.00 174.62 171.41 2ppa s ILE 121 N -3.43 1.14 -0.07 5.08 1.01 -1.26 -1.13 121.20 122.54 2ppa s ILE 121 Ca 0.01 -0.41 0.05 0.00 0.00 0.00 0.00 60.65 60.30 2ppa s ILE 121 Cb 0.01 -1.09 -0.01 0.00 0.01 0.00 0.00 42.46 41.39 2ppa s ILE 121 CO -0.09 0.37 -0.24 -0.22 0.00 0.00 0.00 174.94 174.76 2ppa s LEU 122 N 1.20 2.14 -0.10 2.97 2.96 0.00 -4.96 118.68 122.88 2ppa s LEU 122 Ca -0.04 -0.50 0.03 0.00 -0.22 0.00 0.00 54.13 53.40 2ppa s LEU 122 Cb -0.14 -1.40 0.01 0.00 0.50 0.00 0.00 46.19 45.15 2ppa s LEU 122 CO -0.03 0.23 -0.21 -0.60 -1.32 0.00 0.00 176.35 174.42 2ppa s ARG 123 N -0.06 2.72 0.07 1.98 3.52 -1.26 -0.26 118.95 125.66 2ppa s ARG 123 Ca -0.07 -0.76 0.04 0.00 -0.13 0.00 0.00 55.73 54.81 2ppa s ARG 123 Cb -0.15 -2.11 -0.03 0.00 -1.56 0.00 0.00 34.95 31.10 2ppa s ARG 123 CO 0.05 0.10 -0.10 -0.59 -0.81 0.00 0.00 175.30 173.95 2ppa s PHE 124 N 0.53 0.96 -0.14 5.12 -0.12 -0.43 -4.98 117.98 118.91 2ppa s PHE 124 Ca -0.15 -0.55 -0.26 0.00 -0.05 0.00 0.00 56.93 55.92 2ppa s PHE 124 Cb -0.17 -0.54 -0.02 0.00 -0.63 0.00 0.00 43.02 41.66 2ppa s PHE 124 CO 0.05 -0.02 0.84 0.21 -0.05 0.00 0.00 175.22 176.26 2ppa s LYS 125 N -2.06 4.34 -1.25 1.99 2.20 -1.26 -0.64 119.74 123.05 2ppa s LYS 125 Ca -0.02 1.06 -0.16 0.00 -0.36 0.00 0.00 55.97 56.48 2ppa s LYS 125 Cb -0.07 -3.55 0.11 0.00 -1.51 0.00 0.00 37.83 32.81 2ppa s LYS 125 CO 0.01 -0.27 1.60 0.00 -0.36 0.00 0.00 175.35 176.33 2ppa s ALA 126 N 1.92 3.58 -0.47 3.13 0.00 -0.17 -4.79 121.76 124.96 2ppa s ALA 126 Ca 0.40 -3.08 0.24 0.00 0.00 0.00 0.00 51.96 49.52 2ppa s ALA 126 Cb -0.17 -4.43 0.45 0.00 0.00 0.00 0.00 23.12 18.97 2ppa s ALA 126 CO 0.14 -3.09 1.65 1.79 0.00 0.00 0.00 175.76 176.25 2ppa h THR 127 N 5.24 0.00 -3.28 0.00 1.35 -1.85 0.25 112.91 114.62 2ppa h THR 127 Ca 0.38 -0.90 -0.65 0.00 -0.55 0.00 0.00 66.41 64.69 2ppa h THR 127 Cb 0.88 1.90 -0.34 0.00 -1.73 0.00 0.00 68.15 68.86 2ppa h THR 127 CO 1.37 0.00 -0.86 -0.54 -0.25 0.00 0.00 175.52 175.23 2ppa s LYS 128 N -3.21 2.80 0.15 4.72 1.02 -1.26 -4.74 119.74 119.22 2ppa s LYS 128 Ca 0.07 -0.78 -0.29 0.00 0.02 0.00 0.00 55.97 54.99 2ppa s LYS 128 Cb 0.06 -2.22 -0.07 0.00 -0.52 0.00 0.00 37.83 35.08 2ppa s LYS 128 CO 0.65 0.05 0.91 -1.25 -0.92 0.00 0.00 175.35 174.79 2ppa s PRO 129 N 0.67 4.72 0.00 -1.68 0.04 -1.26 -4.77 135.00 132.72 2ppa s PRO 129 Ca -0.12 1.39 0.00 0.00 0.04 0.00 0.00 61.00 62.32 2ppa s PRO 129 Cb -0.16 -3.33 0.00 0.00 0.04 0.00 0.00 34.50 31.05 2ppa s PRO 129 CO 0.02 0.37 0.00 0.41 0.04 0.00 0.00 177.00 177.84 2ppa n GLY 130 N 1.93 -1.87 3.85 0.56 0.00 0.57 -1.85 105.19 108.37 2ppa n GLY 130 Ca -0.01 -1.38 -0.37 0.00 0.00 0.00 0.00 46.02 44.26 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 -2.27 5.25 0.00 1.61 -7.23 0.98 0.11 120.40 118.86 2ppa s VAL 131 Ca 0.00 0.56 0.00 0.00 -1.81 0.00 0.00 61.98 60.73 2ppa s VAL 131 Cb 0.00 -3.58 -0.00 0.00 0.56 0.00 0.00 36.38 33.36 2ppa s VAL 131 CO 0.00 0.58 -0.00 -0.36 -0.31 0.00 0.00 175.10 175.01 2ppa s PHE 132 N -0.95 0.03 0.46 2.82 0.08 -0.10 -4.47 117.98 115.85 2ppa s PHE 132 Ca 0.20 -0.01 -0.23 0.00 0.12 0.00 0.00 56.93 57.01 2ppa s PHE 132 Cb -0.14 -0.02 -0.07 0.00 -0.57 0.00 0.00 43.02 42.21 2ppa s PHE 132 CO 0.09 -0.00 1.14 0.08 -0.10 0.00 0.00 175.22 176.43 2ppa s VAL 133 N -0.03 3.21 0.12 -0.44 1.01 -1.26 -0.20 120.40 122.82 2ppa s VAL 133 Ca -0.00 0.89 0.08 0.00 0.00 0.00 0.00 61.98 62.95 2ppa s VAL 133 Cb -0.00 -3.44 -0.04 0.00 0.00 0.00 0.00 36.38 32.90 2ppa s VAL 133 CO -0.00 -0.03 -0.20 -0.72 0.00 0.00 0.00 175.10 174.15 2ppa s TYR 134 N -1.59 1.76 0.07 5.22 -0.85 -0.47 -1.46 117.35 120.03 2ppa s TYR 134 Ca 0.64 -0.44 -0.26 0.00 -0.52 0.00 0.00 57.07 56.49 2ppa s TYR 134 Cb -0.27 -0.94 0.07 0.00 0.38 0.00 0.00 41.96 41.21 2ppa s TYR 134 CO 0.33 0.23 0.65 -3.38 -1.52 0.00 0.00 175.55 171.86 2ppa s HIS 135 N -1.47 -0.56 0.54 -3.49 -3.43 -0.41 -0.21 115.29 106.26 2ppa s HIS 135 Ca 0.09 0.58 -0.20 0.00 -0.80 0.00 0.00 55.06 54.74 2ppa s HIS 135 Cb -0.09 0.51 -0.06 0.00 -1.43 0.00 0.00 32.58 31.52 2ppa s HIS 135 CO 0.05 -0.74 1.14 0.00 -2.00 0.00 0.00 174.74 173.19 2ppa n ALA 137 N -1.26 -1.16 -2.38 0.00 0.00 -1.26 -4.45 120.51 109.99 2ppa n ALA 137 Ca 0.11 -1.48 -0.42 0.00 0.00 0.00 0.00 53.44 51.65 2ppa n ALA 137 Cb 0.51 -1.33 -0.03 0.00 0.00 0.00 0.00 19.45 18.59 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 0.60 4.42 0.03 0.00 0.02 -1.26 -4.86 135.00 133.95 2ppa s PRO 138 Ca 0.32 1.81 -0.37 0.00 0.02 0.00 0.00 61.00 62.77 2ppa s PRO 138 Cb 0.15 -3.33 -0.17 0.00 0.02 0.00 0.00 34.50 31.17 2ppa s PRO 138 CO -0.18 -0.28 1.41 -2.30 -0.33 0.00 0.00 177.00 175.32 2ppa n PRO 139 N 3.91 1.15 -0.23 5.54 -0.02 -1.26 -0.56 135.00 143.53 2ppa n PRO 139 Ca 0.09 0.42 0.00 0.00 -2.02 0.00 0.00 63.50 61.99 2ppa n PRO 139 Cb 0.46 -2.07 0.00 0.00 -0.02 0.00 0.00 33.50 31.87 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 2.79 2.17 0.96 -1.23 0.00 -1.26 -4.80 105.19 103.82 2ppa n GLY 140 Ca 0.20 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.25 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 0.33 0.37 1.61 2.81 0.28 -4.98 117.12 115.54 2ppa n MET 141 Ca 0.00 -1.95 -0.15 0.00 -1.81 0.00 0.00 57.70 53.80 2ppa n MET 141 Cb 0.00 -0.50 -0.07 0.00 -0.71 0.00 0.00 33.22 31.94 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 5.55 0.00 -0.10 2.03 2.07 -1.80 -2.75 116.25 121.25 2ppa h VAL 142 Ca -0.11 -0.14 -0.03 0.00 0.82 0.00 0.00 66.70 67.24 2ppa h VAL 142 Cb 1.55 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 31.31 2ppa h VAL 142 CO 0.05 0.00 -0.08 1.55 0.02 0.00 0.00 177.57 179.10 2ppa h PRO 143 N -1.10 0.15 -0.44 1.57 0.13 -1.92 -2.45 132.00 127.94 2ppa h PRO 143 Ca -0.10 -0.03 0.05 0.00 -0.87 0.00 0.00 66.00 65.05 2ppa h PRO 143 Cb 0.74 -0.03 -0.04 0.00 0.13 0.00 0.00 31.00 31.80 2ppa h PRO 143 CO 0.16 0.25 0.18 2.35 -0.23 0.00 0.00 178.00 180.71 2ppa h TRP 144 N 0.15 0.32 -0.50 1.56 7.01 -1.94 0.51 115.95 123.06 2ppa h TRP 144 Ca 0.03 0.02 -0.09 0.00 2.11 0.00 0.00 58.89 60.96 2ppa h TRP 144 Cb 0.25 -0.08 -0.02 0.00 -2.10 0.00 0.00 29.16 27.22 2ppa h TRP 144 CO 0.00 0.14 -0.04 0.45 -2.79 0.00 0.00 178.44 176.20 2ppa h HIS 145 N 0.36 1.01 -0.48 2.65 3.86 -1.16 -1.84 115.15 119.55 2ppa h HIS 145 Ca 0.20 -0.19 -0.04 0.00 -1.16 0.00 0.00 60.37 59.18 2ppa h HIS 145 Cb 0.16 -0.26 -0.02 0.00 1.06 0.00 0.00 27.41 28.35 2ppa h HIS 145 CO -0.13 0.95 0.13 0.28 0.86 0.00 0.00 177.93 180.02 2ppa h VAL 146 N 0.78 1.23 -0.05 2.45 2.07 -1.07 -2.27 116.25 119.39 2ppa h VAL 146 Ca 0.14 -0.80 0.00 0.00 0.82 0.00 0.00 66.70 66.86 2ppa h VAL 146 Cb 0.57 0.84 0.00 0.00 -1.52 0.00 0.00 31.29 31.19 2ppa h VAL 146 CO 0.03 0.29 0.00 1.33 0.02 0.00 0.00 177.57 179.24 2ppa n VAL 147 N -4.50 0.05 0.76 2.57 0.24 0.14 -1.66 118.33 115.92 2ppa n VAL 147 Ca 0.01 -0.16 0.08 0.00 -2.04 0.00 0.00 64.34 62.23 2ppa n VAL 147 Cb 0.21 0.04 0.23 0.00 -1.47 0.00 0.00 33.84 32.85 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 -0.30 2.21 0.00 -1.34 7.64 -0.70 -4.70 113.62 116.43 2ppa n SER 148 Ca 0.18 -1.93 0.00 0.00 1.01 0.00 0.00 58.87 58.13 2ppa n SER 148 Cb 0.22 -0.24 0.00 0.00 -1.01 0.00 0.00 64.21 63.18 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 1.19 0.81 2.79 0.23 0.00 -0.67 -1.22 105.19 108.33 2ppa n GLY 149 Ca 0.15 -0.07 -0.42 0.00 0.00 0.00 0.00 46.02 45.68 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 -2.36 3.63 -3.52 1.61 0.00 -0.90 -4.52 117.12 111.07 2ppa n MET 150 Ca 0.00 -3.37 -0.12 0.00 0.00 0.00 0.00 57.70 54.21 2ppa n MET 150 Cb 0.00 -2.94 -0.04 0.00 0.00 0.00 0.00 33.22 30.25 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 1.12 -0.46 0.00 6.12 2.20 -1.26 -1.77 114.94 120.88 2ppa s ASN 151 Ca 0.43 0.01 0.00 0.00 -0.94 0.00 0.00 52.86 52.36 2ppa s ASN 151 Cb 0.11 0.54 0.00 0.00 -2.00 0.00 0.00 41.25 39.90 2ppa s ASN 151 CO -0.02 -0.86 0.00 0.61 -2.94 0.00 0.00 177.10 173.89 2ppa n GLY 152 N -0.07 3.24 3.42 0.45 0.00 0.71 -0.59 105.19 112.35 2ppa n GLY 152 Ca -0.17 -0.54 -0.10 0.00 0.00 0.00 0.00 46.02 45.22 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 -1.00 -0.64 0.21 4.61 0.00 -1.26 -1.37 121.76 122.31 2ppa s ALA 153 Ca 0.00 -0.40 0.06 0.00 0.00 0.00 0.00 51.96 51.62 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 -0.72 -0.09 0.96 0.00 0.00 0.00 175.76 175.91 2ppa s ILE 154 N -3.89 1.44 -0.11 0.00 -4.36 0.73 -2.98 121.20 112.04 2ppa s ILE 154 Ca 0.10 -2.12 0.02 0.00 -0.26 0.00 0.00 60.65 58.39 2ppa s ILE 154 Cb 0.01 -2.11 0.01 0.00 1.25 0.00 0.00 42.46 41.62 2ppa s ILE 154 CO -0.04 -0.54 -0.17 -0.32 0.24 0.00 0.00 174.94 174.11 2ppa s MET 155 N -3.73 2.38 -0.45 0.37 -2.45 0.54 -0.92 119.30 115.04 2ppa s MET 155 Ca 0.23 -0.63 -0.09 0.00 -1.25 0.00 0.00 55.69 53.96 2ppa s MET 155 Cb 0.02 -1.96 0.10 0.00 1.25 0.00 0.00 34.83 34.25 2ppa s MET 155 CO 0.06 -0.01 0.31 0.08 1.05 0.00 0.00 175.02 176.51 2ppa s VAL 156 N 0.84 4.19 0.37 10.11 1.01 0.12 -1.27 120.40 135.76 2ppa s VAL 156 Ca -0.09 -1.66 -0.24 0.00 0.00 0.00 0.00 61.98 59.98 2ppa s VAL 156 Cb -0.16 -3.69 -0.10 0.00 0.00 0.00 0.00 36.38 32.43 2ppa s VAL 156 CO 0.00 -0.68 0.96 -0.76 0.00 0.00 0.00 175.10 174.63 2ppa s LEU 157 N 1.38 4.20 0.62 3.92 1.43 -0.07 -0.31 118.68 129.84 2ppa s LEU 157 Ca 0.05 1.83 -0.19 0.00 -1.03 0.00 0.00 54.13 54.78 2ppa s LEU 157 Cb -0.25 -4.19 -0.02 0.00 0.03 0.00 0.00 46.19 41.76 2ppa s LEU 157 CO 0.00 -0.22 1.31 -2.84 0.23 0.00 0.00 176.35 174.83 2ppa s PRO 158 N -2.44 2.74 0.54 1.29 0.02 -1.26 -0.52 135.00 135.37 2ppa s PRO 158 Ca 0.55 2.10 0.23 0.00 0.02 0.00 0.00 61.00 63.90 2ppa s PRO 158 Cb -0.16 -1.96 1.48 0.00 0.02 0.00 0.00 34.50 33.87 2ppa s PRO 158 CO 0.21 -1.46 2.16 0.00 -0.33 0.00 0.00 177.00 177.58 2ppa h ARG 159 N 0.82 0.00 -0.65 5.54 3.08 -1.88 -0.01 114.38 121.28 2ppa h ARG 159 Ca -0.51 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.54 2ppa h ARG 159 Cb 1.33 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.38 2ppa h ARG 159 CO 0.54 0.04 0.00 0.39 -1.07 0.00 0.00 179.97 179.88 2ppa n GLU 160 N -4.11 4.05 -0.09 0.04 -0.58 -1.26 0.18 120.64 118.88 2ppa n GLU 160 Ca -0.03 -2.55 0.01 0.00 -0.42 0.00 0.00 57.16 54.18 2ppa n GLU 160 Cb 0.13 -2.08 -0.00 0.00 -0.57 0.00 0.00 31.44 28.92 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 0.59 -1.88 3.80 0.62 0.00 -0.02 -4.76 105.19 103.54 2ppa n GLY 161 Ca 0.23 -1.34 -0.35 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 4.09 0.10 0.99 1.43 -1.26 -4.41 118.68 119.63 2ppa s LEU 162 Ca 0.00 1.80 0.02 0.00 -1.03 0.00 0.00 54.13 54.92 2ppa s LEU 162 Cb 0.00 -4.32 -0.04 0.00 0.03 0.00 0.00 46.19 41.86 2ppa s LEU 162 CO 0.00 -0.31 -0.06 -1.00 0.23 0.00 0.00 176.35 175.21 2ppa s HIS 163 N -1.91 0.89 0.44 0.29 3.76 -1.26 -0.74 115.29 116.76 2ppa s HIS 163 Ca 0.58 -0.92 -0.07 0.00 -0.15 0.00 0.00 55.06 54.50 2ppa s HIS 163 Cb -0.14 -0.52 0.10 0.00 1.11 0.00 0.00 32.58 33.13 2ppa s HIS 163 CO 0.19 -0.15 0.53 -0.40 -0.85 0.00 0.00 174.74 174.06 2ppa n ASP 164 N -0.04 -0.33 0.05 1.40 5.75 0.15 -4.84 116.55 118.68 2ppa n ASP 164 Ca -0.12 -1.10 0.07 0.00 -0.01 0.00 0.00 54.79 53.64 2ppa n ASP 164 Cb 0.61 -0.43 0.32 0.00 -1.03 0.00 0.00 41.12 40.60 2ppa n ASP 164 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2ppa n GLY 165 N 0.88 -0.95 0.97 6.12 0.00 -1.26 -3.61 105.19 107.34 2ppa n GLY 165 Ca 0.07 0.02 0.05 0.00 0.00 0.00 0.00 46.02 46.16 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 -1.76 0.84 -0.22 1.61 4.01 -1.26 -5.00 118.16 116.37 2ppa n LYS 166 Ca 0.02 -2.65 0.00 0.00 -0.51 0.00 0.00 58.31 55.17 2ppa n LYS 166 Cb 0.14 -0.88 0.00 0.00 -0.51 0.00 0.00 35.03 33.78 2ppa n LYS 166 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 2ppa n GLY 167 N -0.39 1.14 3.71 0.72 0.00 -1.24 -5.04 105.19 104.09 2ppa n GLY 167 Ca 0.13 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.73 2ppa n GLY 167 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2ppa s LYS 168 N -0.51 4.53 0.39 1.61 2.20 -1.26 -4.88 119.74 121.82 2ppa s LYS 168 Ca 0.00 1.54 -0.27 0.00 -0.36 0.00 0.00 55.97 56.88 2ppa s LYS 168 Cb 0.00 -3.41 -0.10 0.00 -1.51 0.00 0.00 37.83 32.81 2ppa s LYS 168 CO 0.00 -0.09 1.36 0.00 -0.36 0.00 0.00 175.35 176.26 2ppa s ALA 169 N 0.91 3.38 -0.22 3.13 0.00 -1.26 -0.68 121.76 127.02 2ppa s ALA 169 Ca 0.54 1.34 0.01 0.00 0.00 0.00 0.00 51.96 53.85 2ppa s ALA 169 Cb -0.24 -3.52 0.05 0.00 0.00 0.00 0.00 23.12 19.41 2ppa s ALA 169 CO 0.29 -0.88 -0.08 -0.51 0.00 0.00 0.00 175.76 174.58 2ppa s LEU 170 N -2.24 2.46 -0.20 0.00 1.43 0.08 -4.80 118.68 115.41 2ppa s LEU 170 Ca 0.55 -1.04 -0.00 0.00 -1.03 0.00 0.00 54.13 52.60 2ppa s LEU 170 Cb -0.41 -1.21 0.02 0.00 0.03 0.00 0.00 46.19 44.61 2ppa s LEU 170 CO 0.54 -0.19 -0.14 -0.89 0.23 0.00 0.00 176.35 175.90 2ppa s THR 171 N 1.39 2.45 0.33 5.49 2.01 -1.26 -3.98 115.64 122.07 2ppa s THR 171 Ca -0.04 -0.90 -0.11 0.00 0.31 0.00 0.00 61.69 60.95 2ppa s THR 171 Cb -0.18 -2.11 -0.07 0.00 0.01 0.00 0.00 72.50 70.15 2ppa s THR 171 CO -0.07 0.44 0.69 -0.72 -0.69 0.00 0.00 174.62 174.27 2ppa s TYR 172 N 1.32 3.42 -0.09 4.92 -0.85 -1.26 -4.84 117.35 119.97 2ppa s TYR 172 Ca 0.04 1.03 0.13 0.00 -0.52 0.00 0.00 57.07 57.75 2ppa s TYR 172 Cb -0.14 -2.40 -0.24 0.00 0.38 0.00 0.00 41.96 39.56 2ppa s TYR 172 CO -0.09 0.07 0.48 -0.25 -1.52 0.00 0.00 175.55 174.24 2ppa n ASP 173 N -0.69 0.71 -4.07 -0.18 8.00 0.12 -4.97 116.55 115.48 2ppa n ASP 173 Ca 0.02 0.29 -0.11 0.00 0.71 0.00 0.00 54.79 55.70 2ppa n ASP 173 Cb 0.53 0.18 -0.11 0.00 -0.02 0.00 0.00 41.12 41.70 2ppa n ASP 173 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 2ppa s LYS 174 N -2.57 0.55 -0.01 -1.24 1.02 -0.81 -5.01 119.74 111.67 2ppa s LYS 174 Ca -0.07 -0.88 0.02 0.00 0.02 0.00 0.00 55.97 55.05 2ppa s LYS 174 Cb 0.07 -0.14 -0.00 0.00 -0.52 0.00 0.00 37.83 37.24 2ppa s LYS 174 CO 0.82 -0.00 -0.06 -1.50 -0.92 0.00 0.00 175.35 173.69 2ppa s ILE 175 N -2.07 0.50 0.04 2.17 2.07 -1.26 -0.69 121.20 121.95 2ppa s ILE 175 Ca -0.05 -0.24 0.04 0.00 -1.41 0.00 0.00 60.65 58.99 2ppa s ILE 175 Cb -0.05 -0.44 -0.02 0.00 0.13 0.00 0.00 42.46 42.08 2ppa s ILE 175 CO -0.02 0.15 -0.13 -0.31 -1.91 0.00 0.00 174.94 172.73 2ppa s TYR 176 N 0.03 1.12 -0.26 3.50 2.02 -0.44 -4.44 117.35 118.87 2ppa s TYR 176 Ca 0.00 -0.35 -0.02 0.00 -0.37 0.00 0.00 57.07 56.33 2ppa s TYR 176 Cb -0.04 -0.67 0.03 0.00 -0.40 0.00 0.00 41.96 40.88 2ppa s TYR 176 CO -0.00 0.02 -0.05 -0.47 -1.57 0.00 0.00 175.55 173.48 2ppa s TYR 177 N -0.86 3.13 -0.35 2.71 5.04 0.30 -0.84 117.35 126.48 2ppa s TYR 177 Ca 0.00 -1.67 -0.10 0.00 -2.44 0.00 0.00 57.07 52.86 2ppa s TYR 177 Cb -0.08 -2.07 0.02 0.00 0.35 0.00 0.00 41.96 40.18 2ppa s TYR 177 CO 0.01 -0.76 0.17 0.08 -1.34 0.00 0.00 175.55 173.72 2ppa s VAL 178 N 1.30 4.46 -0.27 3.14 1.01 0.81 -4.16 120.40 126.69 2ppa s VAL 178 Ca -0.02 -0.75 -0.11 0.00 0.00 0.00 0.00 61.98 61.10 2ppa s VAL 178 Cb -0.18 -3.42 -0.05 0.00 0.00 0.00 0.00 36.38 32.73 2ppa s VAL 178 CO -0.03 -0.13 0.20 -0.83 0.00 0.00 0.00 175.10 174.31 2ppa s GLY 179 N 1.55 1.94 -0.15 4.51 0.00 -1.26 -1.78 107.32 112.13 2ppa s GLY 179 Ca 0.02 -1.04 -0.10 0.00 0.00 0.00 0.00 44.72 43.60 2ppa s GLY 179 CO 0.06 0.63 0.19 1.85 0.00 0.00 0.00 173.10 175.83 2ppa s GLU 180 N 1.67 3.92 -0.09 2.90 2.12 -0.49 -1.73 118.70 127.00 2ppa s GLU 180 Ca 0.08 -0.08 0.02 0.00 0.36 0.00 0.00 54.97 55.35 2ppa s GLU 180 Cb -0.16 -3.33 0.01 0.00 0.26 0.00 0.00 34.13 30.92 2ppa s GLU 180 CO 0.10 0.48 -0.13 -1.14 -0.54 0.00 0.00 175.26 174.03 2ppa s GLN 181 N -0.21 1.94 -0.18 4.30 2.00 0.91 -4.49 119.66 123.93 2ppa s GLN 181 Ca 0.13 -0.47 -0.17 0.00 -2.00 0.00 0.00 55.36 52.85 2ppa s GLN 181 Cb -0.12 -1.66 -0.04 0.00 0.80 0.00 0.00 33.01 31.99 2ppa s GLN 181 CO 0.02 -0.04 0.47 0.16 -0.50 0.00 0.00 175.29 175.40 2ppa s ASP 182 N 0.92 6.56 0.21 6.67 3.84 -1.26 -0.82 116.67 132.79 2ppa s ASP 182 Ca -0.09 0.66 0.10 0.00 -0.00 0.00 0.00 52.55 53.22 2ppa s ASP 182 Cb -0.15 -2.27 -0.04 0.00 -1.38 0.00 0.00 42.92 39.08 2ppa s ASP 182 CO 0.00 -0.09 -0.13 -0.36 -0.00 0.00 0.00 175.17 174.59 2ppa s PHE 183 N 1.23 2.52 -0.49 2.11 0.08 -0.28 -4.76 117.98 118.39 2ppa s PHE 183 Ca 0.23 -0.27 0.05 0.00 0.12 0.00 0.00 56.93 57.06 2ppa s PHE 183 Cb -0.15 -1.20 0.18 0.00 -0.57 0.00 0.00 43.02 41.28 2ppa s PHE 183 CO 0.09 0.55 0.42 0.66 -0.10 0.00 0.00 175.22 176.84 2ppa n TYR 184 N -0.12 0.36 -3.26 0.36 4.02 -1.26 -1.17 117.16 116.10 2ppa n TYR 184 Ca -0.10 -3.62 -0.39 0.00 -0.01 0.00 0.00 57.90 53.78 2ppa n TYR 184 Cb 0.57 -0.06 -0.07 0.00 -0.02 0.00 0.00 39.34 39.75 2ppa n TYR 184 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 176.86 175.93 2ppa s VAL 185 N -0.58 5.10 0.56 -0.72 1.01 -1.26 -4.73 120.40 119.78 2ppa s VAL 185 Ca 0.32 0.88 -0.20 0.00 0.00 0.00 0.00 61.98 62.97 2ppa s VAL 185 Cb 0.04 -3.82 -0.06 0.00 0.00 0.00 0.00 36.38 32.55 2ppa s VAL 185 CO -0.17 0.13 1.04 -2.65 0.00 0.00 0.00 175.10 173.45 2ppa n PRO 186 N 5.20 1.10 -4.35 2.72 -0.02 -1.26 -4.87 135.00 133.53 2ppa n PRO 186 Ca -0.05 0.42 -0.26 0.00 -2.02 0.00 0.00 63.50 61.59 2ppa n PRO 186 Cb 0.50 -2.22 -0.12 0.00 -0.02 0.00 0.00 33.50 31.64 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 -2.66 1.30 0.13 -0.52 0.52 -1.26 -0.89 118.95 115.57 2ppa s ARG 187 Ca 0.73 -1.32 -0.02 0.00 -0.52 0.00 0.00 55.73 54.60 2ppa s ARG 187 Cb -0.44 -1.61 0.03 0.00 0.52 0.00 0.00 34.95 33.45 2ppa s ARG 187 CO 0.49 0.36 0.18 -0.40 0.02 0.00 0.00 175.30 175.95 2ppa n ASP 188 N 0.76 0.09 0.27 0.23 5.68 0.48 -4.85 116.55 119.21 2ppa n ASP 188 Ca -0.17 -1.11 0.13 0.00 -0.50 0.00 0.00 54.79 53.14 2ppa n ASP 188 Cb 0.54 -0.13 0.78 0.00 -1.14 0.00 0.00 41.12 41.17 2ppa n ASP 188 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 2ppa h GLU 189 N 0.00 0.00 -0.28 0.11 4.39 -2.02 -1.92 114.58 114.86 2ppa h GLU 189 Ca -0.06 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.64 2ppa h GLU 189 Cb 0.18 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.83 2ppa h GLU 189 CO 0.05 0.08 0.00 0.09 -1.16 0.00 0.00 179.01 178.07 2ppa n ASN 190 N -3.75 2.49 -0.02 1.42 5.03 -1.26 -4.93 115.26 114.23 2ppa n ASN 190 Ca -0.02 -1.86 -0.00 0.00 0.87 0.00 0.00 54.58 53.57 2ppa n ASN 190 Cb 0.18 -0.18 -0.00 0.00 -1.02 0.00 0.00 39.78 38.76 2ppa n ASN 190 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2ppa n GLY 191 N 1.30 0.47 3.75 7.41 0.00 -0.72 -5.03 105.19 112.36 2ppa n GLY 191 Ca 0.17 -0.29 -0.40 0.00 0.00 0.00 0.00 46.02 45.50 2ppa n GLY 191 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2ppa s LYS 192 N -0.66 4.57 0.31 1.61 2.20 -1.26 -4.77 119.74 121.74 2ppa s LYS 192 Ca 0.00 1.18 -0.29 0.00 -0.36 0.00 0.00 55.97 56.50 2ppa s LYS 192 Cb 0.00 -3.35 -0.10 0.00 -1.51 0.00 0.00 37.83 32.87 2ppa s LYS 192 CO 0.00 0.32 1.41 0.71 -0.36 0.00 0.00 175.35 177.43 2ppa s TYR 193 N -0.26 2.92 0.27 4.03 1.51 -1.26 -0.39 117.35 124.17 2ppa s TYR 193 Ca 0.40 1.20 -0.17 0.00 -1.01 0.00 0.00 57.07 57.48 2ppa s TYR 193 Cb -0.22 -3.82 -0.09 0.00 -0.11 0.00 0.00 41.96 37.72 2ppa s TYR 193 CO 0.25 -2.47 0.73 0.15 -1.11 0.00 0.00 175.55 173.10 2ppa s LYS 194 N -1.31 4.14 0.11 -0.62 1.02 -0.07 -4.84 119.74 118.17 2ppa s LYS 194 Ca 0.54 0.78 0.06 0.00 0.02 0.00 0.00 55.97 57.37 2ppa s LYS 194 Cb -0.42 -2.67 -0.04 0.00 -0.52 0.00 0.00 37.83 34.18 2ppa s LYS 194 CO 0.52 0.28 -0.05 0.15 -0.92 0.00 0.00 175.35 175.33 2ppa s LYS 195 N -2.45 2.31 0.08 1.68 1.02 -1.26 -4.73 119.74 116.40 2ppa s LYS 195 Ca 0.48 -0.98 0.02 0.00 0.02 0.00 0.00 55.97 55.51 2ppa s LYS 195 Cb -0.14 -2.39 -0.04 0.00 -0.52 0.00 0.00 37.83 34.75 2ppa s LYS 195 CO 0.19 0.51 -0.07 0.71 -0.92 0.00 0.00 175.35 175.77 2ppa s TYR 196 N -1.35 0.85 -1.64 3.18 2.02 -1.26 -5.06 117.35 114.10 2ppa s TYR 196 Ca 0.24 -0.77 0.17 0.00 -0.37 0.00 0.00 57.07 56.34 2ppa s TYR 196 Cb -0.11 -0.49 0.43 0.00 -0.40 0.00 0.00 41.96 41.39 2ppa s TYR 196 CO 0.16 -0.11 1.35 0.39 -1.57 0.00 0.00 175.55 175.77 2ppa n GLU 197 N 0.42 2.56 -3.60 -0.62 -0.58 -1.26 -4.95 120.64 112.61 2ppa n GLU 197 Ca -0.15 -2.24 -0.16 0.00 -0.42 0.00 0.00 57.16 54.18 2ppa n GLU 197 Cb 0.59 -1.42 -0.07 0.00 -0.57 0.00 0.00 31.44 29.97 2ppa n GLU 197 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2ppa s ALA 198 N -1.09 -1.46 0.16 0.62 0.00 -1.26 -5.05 121.76 113.68 2ppa s ALA 198 Ca 0.34 1.09 -0.14 0.00 0.00 0.00 0.00 51.96 53.25 2ppa s ALA 198 Cb 0.19 -0.10 0.05 0.00 0.00 0.00 0.00 23.12 23.26 2ppa s ALA 198 CO 0.25 -0.33 1.76 -1.35 0.00 0.00 0.00 175.76 176.09 2ppa h PRO 199 N 3.50 0.71 -0.39 0.00 0.11 -1.96 -1.46 132.00 132.51 2ppa h PRO 199 Ca -0.28 -0.09 0.10 0.00 0.11 0.00 0.00 66.00 65.85 2ppa h PRO 199 Cb 1.15 -0.14 -0.02 0.00 0.11 0.00 0.00 31.00 32.11 2ppa h PRO 199 CO 0.36 0.56 0.28 0.78 -0.21 0.00 0.00 178.00 179.77 2ppa h GLY 200 N 0.67 0.08 1.84 -0.55 0.00 -2.00 -1.69 103.07 101.42 2ppa h GLY 200 Ca 0.18 -0.02 -0.04 0.00 0.00 0.00 0.00 47.33 47.45 2ppa h GLY 200 CO -0.03 0.01 -0.09 -0.55 0.00 0.00 0.00 176.54 175.89 2ppa h ASP 201 N 0.05 0.18 0.80 0.19 3.32 -1.67 -2.86 116.42 116.44 2ppa h ASP 201 Ca 0.19 -0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.21 2ppa h ASP 201 Cb 0.67 -0.05 0.00 0.00 0.22 0.00 0.00 39.33 40.17 2ppa h ASP 201 CO -0.01 0.30 -0.50 0.00 -1.72 0.00 0.00 179.24 177.31 2ppa n ALA 202 N -2.50 3.02 0.11 3.45 0.00 -0.64 -4.56 120.51 119.39 2ppa n ALA 202 Ca -0.01 -0.25 -0.13 0.00 0.00 0.00 0.00 53.44 53.05 2ppa n ALA 202 Cb 0.22 -1.20 -0.08 0.00 0.00 0.00 0.00 19.45 18.40 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 -1.21 -0.44 0.00 5.03 -1.46 -0.93 116.97 117.96 2ppa h TYR 203 Ca 0.00 0.03 0.05 0.00 2.58 0.00 0.00 58.73 61.39 2ppa h TYR 203 Cb 0.65 0.51 -0.05 0.00 1.55 0.00 0.00 36.73 39.40 2ppa h TYR 203 CO 0.00 -0.48 0.18 1.49 -1.32 0.00 0.00 178.16 178.03 2ppa h GLU 204 N -0.62 0.36 -0.66 1.82 4.81 -1.80 -0.20 114.58 118.28 2ppa h GLU 204 Ca -0.01 -0.02 -0.07 0.00 -0.13 0.00 0.00 59.36 59.13 2ppa h GLU 204 Cb 0.61 -0.08 -0.03 0.00 0.63 0.00 0.00 28.75 29.88 2ppa h GLU 204 CO -0.21 0.24 0.13 -0.44 -0.73 0.00 0.00 179.01 178.00 2ppa h ASP 205 N 0.37 1.02 -0.48 1.04 3.45 -1.83 -2.55 116.42 117.45 2ppa h ASP 205 Ca 0.20 -0.22 -0.09 0.00 0.43 0.00 0.00 57.03 57.35 2ppa h ASP 205 Cb 0.17 -0.27 -0.02 0.00 -0.56 0.00 0.00 39.33 38.65 2ppa h ASP 205 CO -0.18 0.99 -0.04 0.74 -1.57 0.00 0.00 179.24 179.18 2ppa h THR 206 N 1.01 1.27 -0.74 0.35 2.02 -0.66 -2.84 112.91 113.32 2ppa h THR 206 Ca 0.21 -1.13 0.02 0.00 0.77 0.00 0.00 66.41 66.27 2ppa h THR 206 Cb 0.39 1.04 -0.04 0.00 -1.74 0.00 0.00 68.15 67.80 2ppa h THR 206 CO 0.01 0.39 0.48 0.58 0.37 0.00 0.00 175.52 177.35 2ppa h VAL 207 N 0.72 1.14 -0.77 3.16 2.07 -0.87 -0.01 116.25 121.68 2ppa h VAL 207 Ca 0.13 -0.33 0.09 0.00 0.82 0.00 0.00 66.70 67.41 2ppa h VAL 207 Cb 0.57 0.11 -0.07 0.00 -1.52 0.00 0.00 31.29 30.38 2ppa h VAL 207 CO 0.03 0.17 0.43 0.50 0.02 0.00 0.00 177.57 178.72 2ppa h LYS 208 N 0.95 0.71 -0.40 1.57 3.64 -1.30 -1.61 116.57 120.12 2ppa h LYS 208 Ca 0.29 -0.04 -0.14 0.00 -1.27 0.00 0.00 60.65 59.49 2ppa h LYS 208 Cb -0.03 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 31.62 2ppa h LYS 208 CO -0.09 0.47 -0.29 0.28 -2.27 0.00 0.00 179.45 177.55 2ppa h VAL 209 N 0.73 1.28 -0.91 2.00 2.07 -1.14 -3.12 116.25 117.15 2ppa h VAL 209 Ca 0.37 -1.46 0.04 0.00 0.82 0.00 0.00 66.70 66.48 2ppa h VAL 209 Cb 0.33 1.32 -0.05 0.00 -1.52 0.00 0.00 31.29 31.37 2ppa h VAL 209 CO -0.24 0.49 0.60 0.24 0.02 0.00 0.00 177.57 178.68 2ppa h MET 210 N 0.73 1.09 0.00 1.57 2.86 -0.45 -1.87 114.93 118.86 2ppa h MET 210 Ca 0.08 -0.07 0.00 0.00 -2.06 0.00 0.00 59.70 57.65 2ppa h MET 210 Cb 0.87 -0.25 0.00 0.00 0.06 0.00 0.00 31.60 32.29 2ppa h MET 210 CO 0.08 0.72 0.00 0.00 1.06 0.00 0.00 176.91 178.77 2ppa h ARG 211 N 1.12 0.00 0.00 1.72 3.08 -1.25 -0.49 114.38 118.56 2ppa h ARG 211 Ca 0.37 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.42 2ppa h ARG 211 Cb 0.06 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.11 2ppa h ARG 211 CO -0.12 0.00 0.00 0.25 -1.07 0.00 0.00 179.97 179.03 2ppa n THR 212 N -2.59 0.22 -1.66 2.04 -2.24 -0.70 -4.90 114.28 104.46 2ppa n THR 212 Ca 0.00 0.06 -0.17 0.00 -2.27 0.00 0.00 64.05 61.67 2ppa n THR 212 Cb 0.19 -0.62 -0.06 0.00 -2.10 0.00 0.00 70.33 67.75 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 -1.47 -1.29 -3.96 3.22 4.77 -0.19 -4.93 117.00 113.15 2ppa n LEU 213 Ca 0.07 0.36 -0.31 0.00 -0.03 0.00 0.00 56.01 56.10 2ppa n LEU 213 Cb 0.29 -2.44 -0.15 0.00 -2.33 0.00 0.00 43.42 38.79 2ppa n LEU 213 CO 0.23 -0.75 -0.35 -0.89 -1.33 0.00 0.00 177.39 174.29 2ppa s THR 214 N -2.50 1.89 0.50 -5.08 2.01 -1.26 -5.11 115.64 106.08 2ppa s THR 214 Ca 0.00 -1.95 -0.23 0.00 0.31 0.00 0.00 61.69 59.83 2ppa s THR 214 Cb 0.00 -2.33 -0.06 0.00 0.01 0.00 0.00 72.50 70.12 2ppa s THR 214 CO 0.00 -0.50 1.28 -2.16 -0.69 0.00 0.00 174.62 172.55 2ppa s PRO 215 N 1.13 3.46 0.23 4.92 0.04 -1.26 -4.91 135.00 138.60 2ppa s PRO 215 Ca 0.07 2.05 0.14 0.00 0.04 0.00 0.00 61.00 63.30 2ppa s PRO 215 Cb -0.19 -2.36 0.00 0.00 0.04 0.00 0.00 34.50 32.00 2ppa s PRO 215 CO -0.11 -0.88 1.34 1.79 0.04 0.00 0.00 177.00 179.19 2ppa h THR 216 N 1.71 0.92 -3.76 1.26 1.35 -1.50 -3.46 112.91 109.43 2ppa h THR 216 Ca -0.50 -2.34 -0.18 0.00 -0.55 0.00 0.00 66.41 62.83 2ppa h THR 216 Cb 1.27 2.43 -0.23 0.00 -1.73 0.00 0.00 68.15 69.89 2ppa h THR 216 CO 0.59 0.53 -0.65 -1.00 -0.25 0.00 0.00 175.52 174.74 2ppa s HIS 217 N -2.92 0.11 -0.14 4.73 3.76 -1.15 -4.86 115.29 114.82 2ppa s HIS 217 Ca 0.03 -0.22 -0.03 0.00 -0.15 0.00 0.00 55.06 54.68 2ppa s HIS 217 Cb 0.08 -0.09 0.05 0.00 1.11 0.00 0.00 32.58 33.73 2ppa s HIS 217 CO 0.76 -0.15 0.05 0.08 -0.85 0.00 0.00 174.74 174.63 2ppa s VAL 218 N -0.92 0.22 0.08 -0.90 1.01 -0.36 -1.13 120.40 118.40 2ppa s VAL 218 Ca -0.10 -0.16 0.02 0.00 0.00 0.00 0.00 61.98 61.74 2ppa s VAL 218 Cb -0.06 -0.67 -0.04 0.00 0.00 0.00 0.00 36.38 35.61 2ppa s VAL 218 CO -0.00 -0.08 -0.08 0.68 0.00 0.00 0.00 175.10 175.62 2ppa s VAL 219 N 2.01 0.71 -0.11 2.92 -7.23 0.00 -0.43 120.40 118.28 2ppa s VAL 219 Ca 0.02 -1.65 -0.05 0.00 -1.81 0.00 0.00 61.98 58.49 2ppa s VAL 219 Cb -0.15 -1.33 -0.04 0.00 0.56 0.00 0.00 36.38 35.42 2ppa s VAL 219 CO -0.07 -0.68 0.10 -0.36 -0.31 0.00 0.00 175.10 173.79 2ppa s PHE 220 N -2.77 3.48 -1.47 2.82 0.08 -1.26 -0.06 117.98 118.79 2ppa s PHE 220 Ca 0.05 0.43 -0.11 0.00 0.12 0.00 0.00 56.93 57.42 2ppa s PHE 220 Cb -0.01 -1.89 0.07 0.00 -0.57 0.00 0.00 43.02 40.62 2ppa s PHE 220 CO -0.02 0.66 0.83 -1.71 -0.10 0.00 0.00 175.22 174.88 2ppa n ASN 221 N 1.98 -4.91 0.00 1.36 4.05 -0.71 -2.99 115.26 114.04 2ppa n ASN 221 Ca -0.19 -0.59 0.00 0.00 0.45 0.00 0.00 54.58 54.24 2ppa n ASN 221 Cb 0.55 -3.95 0.00 0.00 1.23 0.00 0.00 39.78 37.60 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 -1.57 2.06 3.42 8.20 0.00 -0.90 -4.78 105.19 111.63 2ppa n GLY 222 Ca 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.88 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 -2.78 -1.46 0.15 4.61 0.00 -1.16 -4.56 121.76 116.55 2ppa s ALA 223 Ca 0.00 0.75 -0.34 0.00 0.00 0.00 0.00 51.96 52.38 2ppa s ALA 223 Cb 0.00 0.36 -0.13 0.00 0.00 0.00 0.00 23.12 23.35 2ppa s ALA 223 CO 0.00 -0.51 1.63 0.28 0.00 0.00 0.00 175.76 177.17 2ppa n VAL 224 N 0.43 0.06 -1.00 0.00 0.31 0.67 -1.86 118.33 116.94 2ppa n VAL 224 Ca -0.18 -0.01 -0.00 0.00 -0.01 0.00 0.00 64.34 64.14 2ppa n VAL 224 Cb 0.60 -1.65 -0.00 0.00 -0.91 0.00 0.00 33.84 31.88 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 3.60 0.36 0.15 2.92 0.00 -1.26 -4.83 105.19 106.13 2ppa n GLY 225 Ca 0.17 -0.01 -0.08 0.00 0.00 0.00 0.00 46.02 46.10 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 0.40 -0.75 4.61 0.00 -1.58 -2.29 119.26 119.66 2ppa h ALA 226 Ca -0.00 -0.01 -0.57 0.00 0.00 0.00 0.00 54.91 54.33 2ppa h ALA 226 Cb 0.30 -0.11 -0.22 0.00 0.00 0.00 0.00 17.79 17.76 2ppa h ALA 226 CO 0.00 -0.15 0.68 1.28 0.00 0.00 0.00 179.25 181.06 2ppa n LEU 227 N -4.89 7.06 -4.45 0.00 4.77 -1.26 -4.45 117.00 113.79 2ppa n LEU 227 Ca -0.01 -4.10 -0.21 0.00 -0.03 0.00 0.00 56.01 51.65 2ppa n LEU 227 Cb 0.04 -1.08 -0.11 0.00 -2.33 0.00 0.00 43.42 39.94 2ppa n LEU 227 CO 0.33 1.54 -0.28 0.42 -1.33 0.00 0.00 177.39 178.07 2ppa s THR 228 N -3.61 1.22 0.00 -5.08 -4.23 -0.86 -0.91 115.64 102.17 2ppa s THR 228 Ca 0.52 -2.01 0.00 0.00 -1.18 0.00 0.00 61.69 59.02 2ppa s THR 228 Cb 0.40 -2.76 0.00 0.00 1.34 0.00 0.00 72.50 71.48 2ppa s THR 228 CO -0.15 -0.03 0.00 0.61 -0.54 0.00 0.00 174.62 174.51 2ppa n GLY 229 N -0.67 2.13 0.23 3.99 0.00 -1.26 -1.07 105.19 108.54 2ppa n GLY 229 Ca -0.03 0.40 0.16 0.00 0.00 0.00 0.00 46.02 46.55 2ppa n GLY 229 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 2ppa h ASP 230 N 0.00 0.00 0.00 1.61 2.03 -1.95 -2.54 116.42 115.58 2ppa h ASP 230 Ca 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 2ppa h ASP 230 Cb 0.00 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.50 2ppa h ASP 230 CO 0.00 0.00 -0.01 0.29 -1.03 0.00 0.00 179.24 178.49 2ppa n LYS 231 N -2.60 2.30 -1.72 4.15 5.02 -0.23 -5.02 118.16 120.06 2ppa n LYS 231 Ca -0.02 -1.83 -0.42 0.00 -2.02 0.00 0.00 58.31 54.03 2ppa n LYS 231 Cb 0.08 -1.15 -0.00 0.00 -0.02 0.00 0.00 35.03 33.94 2ppa n LYS 231 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2ppa n ALA 232 N -0.79 1.56 -1.78 7.82 0.00 -0.96 -4.13 120.51 122.23 2ppa n ALA 232 Ca 0.05 0.33 -0.33 0.00 0.00 0.00 0.00 53.44 53.50 2ppa n ALA 232 Cb 0.39 -2.30 -0.03 0.00 0.00 0.00 0.00 19.45 17.52 2ppa n ALA 232 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 2ppa s MET 233 N -2.02 3.79 0.14 0.00 -1.94 -0.12 -4.83 119.30 114.32 2ppa s MET 233 Ca 0.56 1.12 0.07 0.00 -1.71 0.00 0.00 55.69 55.73 2ppa s MET 233 Cb -0.53 -2.11 -0.04 0.00 2.01 0.00 0.00 34.83 34.16 2ppa s MET 233 CO 0.62 -0.42 -0.17 0.95 -0.01 0.00 0.00 175.02 175.99 2ppa s THR 234 N -2.40 1.57 0.36 2.05 -4.23 -1.26 -0.82 115.64 110.91 2ppa s THR 234 Ca 0.62 -1.77 -0.17 0.00 -1.18 0.00 0.00 61.69 59.20 2ppa s THR 234 Cb -0.13 -1.65 0.06 0.00 1.34 0.00 0.00 72.50 72.12 2ppa s THR 234 CO 0.28 -0.32 0.83 0.00 -0.54 0.00 0.00 174.62 174.87 2ppa s ALA 235 N -1.95 -0.87 0.08 3.99 0.00 -0.97 -4.94 121.76 117.10 2ppa s ALA 235 Ca 0.11 -0.70 0.04 0.00 0.00 0.00 0.00 51.96 51.41 2ppa s ALA 235 Cb -0.06 0.68 -0.03 0.00 0.00 0.00 0.00 23.12 23.71 2ppa s ALA 235 CO 0.05 -1.00 -0.12 0.00 0.00 0.00 0.00 175.76 174.69 2ppa s ALA 236 N -2.24 1.09 0.15 0.00 0.00 -1.26 -1.54 121.76 117.96 2ppa s ALA 236 Ca 0.17 -1.05 -0.34 0.00 0.00 0.00 0.00 51.96 50.73 2ppa s ALA 236 Cb -0.05 -0.03 -0.15 0.00 0.00 0.00 0.00 23.12 22.89 2ppa s ALA 236 CO 0.11 0.06 1.37 0.28 0.00 0.00 0.00 175.76 177.58 2ppa n VAL 237 N 0.99 0.39 0.00 0.00 0.31 0.07 -1.49 118.33 118.60 2ppa n VAL 237 Ca -0.19 -0.10 0.00 0.00 -0.01 0.00 0.00 64.34 64.04 2ppa n VAL 237 Cb 0.56 -1.13 0.00 0.00 -0.91 0.00 0.00 33.84 32.35 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 2.56 1.94 3.78 2.92 0.00 0.41 -4.99 105.19 111.81 2ppa n GLY 238 Ca 0.16 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.79 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 -0.87 4.57 -0.23 1.61 2.12 -0.55 -4.78 118.70 120.56 2ppa s GLU 239 Ca 0.00 1.16 -0.11 0.00 0.36 0.00 0.00 54.97 56.38 2ppa s GLU 239 Cb 0.00 -3.25 -0.05 0.00 0.26 0.00 0.00 34.13 31.09 2ppa s GLU 239 CO 0.00 0.57 0.19 0.15 -0.54 0.00 0.00 175.26 175.62 2ppa s LYS 240 N -1.17 4.10 -0.06 4.30 1.02 -1.26 -1.66 119.74 125.00 2ppa s LYS 240 Ca 0.36 -0.20 0.04 0.00 0.02 0.00 0.00 55.97 56.19 2ppa s LYS 240 Cb -0.23 -3.52 -0.00 0.00 -0.52 0.00 0.00 37.83 33.55 2ppa s LYS 240 CO 0.26 0.08 -0.20 0.08 -0.92 0.00 0.00 175.35 174.66 2ppa s VAL 241 N 1.00 1.67 -0.21 3.17 1.01 0.32 0.13 120.40 127.49 2ppa s VAL 241 Ca 0.09 -0.82 -0.10 0.00 0.00 0.00 0.00 61.98 61.15 2ppa s VAL 241 Cb -0.13 -1.44 -0.05 0.00 0.00 0.00 0.00 36.38 34.76 2ppa s VAL 241 CO 0.04 0.47 0.12 -0.22 0.00 0.00 0.00 175.10 175.51 2ppa s LEU 242 N 0.18 4.09 -0.30 3.92 2.96 0.13 -1.21 118.68 128.45 2ppa s LEU 242 Ca -0.09 0.16 -0.03 0.00 -0.22 0.00 0.00 54.13 53.95 2ppa s LEU 242 Cb -0.14 -2.06 0.04 0.00 0.50 0.00 0.00 46.19 44.53 2ppa s LEU 242 CO 0.04 0.15 0.02 -0.63 -1.32 0.00 0.00 176.35 174.61 2ppa s ILE 243 N 0.54 3.19 -0.03 6.68 1.01 0.43 -1.33 121.20 131.69 2ppa s ILE 243 Ca 0.07 -1.26 -0.17 0.00 0.00 0.00 0.00 60.65 59.29 2ppa s ILE 243 Cb -0.12 -2.79 -0.05 0.00 0.01 0.00 0.00 42.46 39.50 2ppa s ILE 243 CO -0.00 -0.08 0.47 -0.69 0.00 0.00 0.00 174.94 174.65 2ppa s VAL 244 N 1.30 5.02 -0.03 2.92 1.01 -0.02 -1.27 120.40 129.34 2ppa s VAL 244 Ca -0.04 0.97 0.01 0.00 0.00 0.00 0.00 61.98 62.93 2ppa s VAL 244 Cb -0.19 -3.80 0.02 0.00 0.00 0.00 0.00 36.38 32.41 2ppa s VAL 244 CO -0.00 0.48 -0.03 -2.28 0.00 0.00 0.00 175.10 173.27 2ppa s HIS 245 N -0.44 0.47 0.15 5.22 2.46 -0.55 -0.13 115.29 122.47 2ppa s HIS 245 Ca 0.26 -0.08 0.06 0.00 0.47 0.00 0.00 55.06 55.76 2ppa s HIS 245 Cb -0.17 -0.45 -0.04 0.00 -0.13 0.00 0.00 32.58 31.79 2ppa s HIS 245 CO 0.14 -0.12 -0.13 -1.54 -2.47 0.00 0.00 174.74 170.62 2ppa s SER 246 N 0.70 2.05 -0.25 9.88 1.04 -0.73 -0.75 113.70 125.64 2ppa s SER 246 Ca -0.08 -0.93 -0.02 0.00 0.48 0.00 0.00 55.95 55.40 2ppa s SER 246 Cb -0.11 -0.06 0.14 0.00 0.10 0.00 0.00 66.02 66.08 2ppa s SER 246 CO -0.01 -0.22 0.38 -1.58 0.98 0.00 0.00 173.24 172.80 2ppa s GLN 247 N -3.27 0.36 0.22 4.02 -0.44 -0.79 -1.40 119.66 118.35 2ppa s GLN 247 Ca 0.15 0.52 0.26 0.00 -2.50 0.00 0.00 55.36 53.79 2ppa s GLN 247 Cb -0.01 -0.45 0.84 0.00 -1.64 0.00 0.00 33.01 31.74 2ppa s GLN 247 CO 0.03 -0.66 1.77 0.00 0.50 0.00 0.00 175.29 176.93 2ppa n ALA 248 N 5.37 2.19 0.00 1.58 0.00 -1.26 0.28 120.51 128.67 2ppa n ALA 248 Ca -0.03 -0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.40 2ppa n ALA 248 Cb 0.50 -1.46 0.00 0.00 0.00 0.00 0.00 19.45 18.49 2ppa n ALA 248 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 2ppa n ASN 249 N -2.26 2.07 -3.89 0.00 5.15 -1.26 -3.13 115.26 111.93 2ppa n ASN 249 Ca 0.05 0.00 -0.11 0.00 -0.60 0.00 0.00 54.58 53.92 2ppa n ASN 249 Cb 0.40 0.34 -0.11 0.00 -0.53 0.00 0.00 39.78 39.88 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 -1.04 0.38 0.62 1.20 3.52 -1.26 -4.70 118.95 117.67 2ppa s ARG 250 Ca 0.00 -0.35 -0.19 0.00 -0.13 0.00 0.00 55.73 55.06 2ppa s ARG 250 Cb 0.00 0.16 -0.03 0.00 -1.56 0.00 0.00 34.95 33.52 2ppa s ARG 250 CO 0.00 -0.08 1.19 -0.25 -0.81 0.00 0.00 175.30 175.35 2ppa n ASP 251 N 1.77 1.72 -4.06 -2.12 10.43 -1.26 -3.48 116.55 119.55 2ppa n ASP 251 Ca -0.21 0.84 -0.09 0.00 2.57 0.00 0.00 54.79 57.90 2ppa n ASP 251 Cb 0.56 -1.50 -0.09 0.00 1.84 0.00 0.00 41.12 41.93 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 -1.41 0.13 -0.44 -3.53 -1.32 -0.19 -4.82 115.64 104.05 2ppa s THR 252 Ca 0.79 -1.68 0.05 0.00 -1.21 0.00 0.00 61.69 59.64 2ppa s THR 252 Cb -0.40 -1.79 0.18 0.00 -1.51 0.00 0.00 72.50 68.98 2ppa s THR 252 CO 0.44 -0.57 0.38 -2.11 -2.21 0.00 0.00 174.62 170.54 2ppa n ARG 253 N -0.07 0.42 -1.91 7.08 1.85 -1.26 -1.48 116.66 121.29 2ppa n ARG 253 Ca -0.09 -3.32 -0.35 0.00 -1.00 0.00 0.00 57.85 53.09 2ppa n ARG 253 Cb 0.63 -1.69 0.04 0.00 -1.05 0.00 0.00 32.46 30.39 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 -0.25 2.88 -0.22 2.89 0.02 -1.04 -0.09 135.00 139.19 2ppa s PRO 254 Ca 0.33 1.67 -0.11 0.00 0.02 0.00 0.00 61.00 62.90 2ppa s PRO 254 Cb 0.05 -1.93 0.08 0.00 0.02 0.00 0.00 34.50 32.71 2ppa s PRO 254 CO -0.19 -1.24 0.51 -1.58 -0.33 0.00 0.00 177.00 174.17 2ppa s HIS 255 N -1.87 -0.83 -0.61 6.54 2.46 0.45 -1.87 115.29 119.56 2ppa s HIS 255 Ca 0.73 1.66 -0.22 0.00 0.47 0.00 0.00 55.06 57.70 2ppa s HIS 255 Cb -0.26 0.42 0.07 0.00 -0.13 0.00 0.00 32.58 32.68 2ppa s HIS 255 CO 0.36 -0.44 0.89 -1.17 -2.47 0.00 0.00 174.74 171.90 2ppa s LEU 256 N 1.77 4.53 -0.22 8.88 2.96 -1.26 -0.69 118.68 134.65 2ppa s LEU 256 Ca -0.08 -0.93 -0.29 0.00 -0.22 0.00 0.00 54.13 52.61 2ppa s LEU 256 Cb -0.08 -2.48 -0.03 0.00 0.50 0.00 0.00 46.19 44.11 2ppa s LEU 256 CO -0.15 -1.30 1.58 -0.63 -1.32 0.00 0.00 176.35 174.53 2ppa s ILE 257 N 3.70 3.74 0.00 6.68 1.01 0.15 -1.15 121.20 135.34 2ppa s ILE 257 Ca 0.21 0.84 0.00 0.00 0.00 0.00 0.00 60.65 61.71 2ppa s ILE 257 Cb -0.17 -3.74 0.00 0.00 0.01 0.00 0.00 42.46 38.56 2ppa s ILE 257 CO 0.11 -0.29 0.00 0.61 0.00 0.00 0.00 174.94 175.37 2ppa n GLY 258 N 4.57 1.64 0.00 6.18 0.00 -1.26 -3.32 105.19 113.00 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 -1.86 6.40 3.55 -0.02 0.00 -0.30 -4.99 105.19 107.97 2ppa n GLY 259 Ca 0.00 -1.77 -0.12 0.00 0.00 0.00 0.00 46.02 44.12 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 0.91 0.74 -0.55 1.61 0.09 -1.26 -4.76 115.29 112.07 2ppa s HIS 260 Ca 0.00 -1.07 -0.15 0.00 -0.00 0.00 0.00 55.06 53.85 2ppa s HIS 260 Cb 0.00 0.10 0.13 0.00 -0.00 0.00 0.00 32.58 32.81 2ppa s HIS 260 CO 0.00 -1.13 0.50 0.20 -0.00 0.00 0.00 174.74 174.30 2ppa s GLY 261 N -3.15 2.12 0.16 -2.22 0.00 -0.03 -4.77 107.32 99.44 2ppa s GLY 261 Ca 0.26 -2.59 -0.15 0.00 0.00 0.00 0.00 44.72 42.25 2ppa s GLY 261 CO 0.16 1.19 1.80 -0.55 0.00 0.00 0.00 173.10 175.70 2ppa h ASP 262 N 8.77 0.55 -3.38 1.64 3.32 -1.44 0.55 116.42 126.43 2ppa h ASP 262 Ca -0.27 -0.04 -0.50 0.00 0.02 0.00 0.00 57.03 56.25 2ppa h ASP 262 Cb 1.09 -0.14 -0.34 0.00 0.22 0.00 0.00 39.33 40.16 2ppa h ASP 262 CO 1.00 0.42 -0.80 -0.31 -1.72 0.00 0.00 179.24 177.83 2ppa s TYR 263 N -6.06 1.33 -0.17 4.55 1.51 -1.01 -1.78 117.35 115.72 2ppa s TYR 263 Ca -0.13 -0.51 -0.01 0.00 -1.01 0.00 0.00 57.07 55.41 2ppa s TYR 263 Cb 0.11 -1.03 0.05 0.00 -0.11 0.00 0.00 41.96 40.98 2ppa s TYR 263 CO 0.74 -0.30 -0.04 0.08 -1.11 0.00 0.00 175.55 174.91 2ppa s VAL 264 N 0.90 1.09 -1.18 0.71 1.01 0.75 0.04 120.40 123.72 2ppa s VAL 264 Ca -0.10 -0.68 -0.19 0.00 0.00 0.00 0.00 61.98 61.01 2ppa s VAL 264 Cb -0.15 -1.31 0.09 0.00 0.00 0.00 0.00 36.38 35.01 2ppa s VAL 264 CO 0.01 0.07 1.56 0.26 0.00 0.00 0.00 175.10 177.00 2ppa s TRP 265 N 1.63 2.85 0.33 5.22 0.51 0.18 -0.62 118.94 129.05 2ppa s TRP 265 Ca -0.00 -1.47 0.04 0.00 -2.12 0.00 0.00 56.10 52.55 2ppa s TRP 265 Cb -0.16 -4.63 0.59 0.00 -0.81 0.00 0.00 33.47 28.45 2ppa s TRP 265 CO -0.07 -1.76 1.87 0.00 -0.51 0.00 0.00 176.95 176.48 2ppa h ALA 266 N 8.23 1.35 -0.00 0.98 0.00 -1.90 0.13 119.26 128.05 2ppa h ALA 266 Ca 0.34 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 55.04 2ppa h ALA 266 Cb 0.92 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.56 2ppa h ALA 266 CO 1.39 0.45 -0.07 0.25 0.00 0.00 0.00 179.25 181.27 2ppa n THR 267 N -4.27 0.00 -0.97 0.00 -2.24 -1.26 -4.54 114.28 101.00 2ppa n THR 267 Ca 0.01 -0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.79 2ppa n THR 267 Cb 0.25 -0.39 0.00 0.00 -2.10 0.00 0.00 70.33 68.09 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 1.46 0.71 3.39 3.38 0.00 0.40 -4.72 105.19 109.80 2ppa n GLY 268 Ca 0.08 0.00 -0.35 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 -0.16 3.52 0.38 1.61 -0.14 -1.26 -0.01 119.74 123.68 2ppa s LYS 269 Ca 0.00 -0.56 0.27 0.00 -1.36 0.00 0.00 55.97 54.32 2ppa s LYS 269 Cb 0.00 -3.08 0.89 0.00 -1.68 0.00 0.00 37.83 33.96 2ppa s LYS 269 CO 0.00 -0.10 1.78 0.74 -0.76 0.00 0.00 175.35 177.01 2ppa h PHE 270 N 7.85 0.00 -0.00 3.18 0.05 -1.74 -1.88 116.94 124.41 2ppa h PHE 270 Ca -0.38 0.00 0.00 0.00 3.82 0.00 0.00 57.97 61.41 2ppa h PHE 270 Cb 1.17 0.00 0.00 0.00 2.00 0.00 0.00 35.95 39.12 2ppa h PHE 270 CO 0.60 0.00 -0.15 0.09 -0.18 0.00 0.00 178.31 178.67 2ppa n ASN 271 N -2.72 0.15 -4.58 2.17 3.02 -1.26 -4.60 115.26 107.44 2ppa n ASN 271 Ca 0.03 0.27 -0.41 0.00 -0.03 0.00 0.00 54.58 54.44 2ppa n ASN 271 Cb 0.37 -0.27 -0.08 0.00 -0.61 0.00 0.00 39.78 39.19 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 -3.00 5.05 0.36 3.41 2.01 -0.71 -5.04 115.64 117.73 2ppa s THR 272 Ca 0.13 0.51 -0.26 0.00 0.31 0.00 0.00 61.69 62.38 2ppa s THR 272 Cb 0.19 -3.89 -0.12 0.00 0.01 0.00 0.00 72.50 68.68 2ppa s THR 272 CO 0.58 -0.09 1.04 -2.65 -0.69 0.00 0.00 174.62 172.81 2ppa n PRO 273 N 5.64 1.44 -2.32 4.92 -0.02 -1.26 -4.81 135.00 138.59 2ppa n PRO 273 Ca -0.05 0.51 -0.36 0.00 -2.02 0.00 0.00 63.50 61.58 2ppa n PRO 273 Cb 0.49 -2.00 -0.01 0.00 -0.02 0.00 0.00 33.50 31.97 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 -1.82 3.65 0.64 0.52 0.04 -1.26 -4.91 135.00 131.86 2ppa s PRO 274 Ca 0.60 1.64 -0.13 0.00 0.04 0.00 0.00 61.00 63.15 2ppa s PRO 274 Cb -0.61 -2.23 -0.02 0.00 0.04 0.00 0.00 34.50 31.68 2ppa s PRO 274 CO 0.59 -0.61 1.05 -0.51 0.04 0.00 0.00 177.00 177.56 2ppa s ASP 275 N -1.61 5.67 0.16 6.66 1.01 0.21 -4.77 116.67 124.00 2ppa s ASP 275 Ca 0.67 1.69 0.08 0.00 0.71 0.00 0.00 52.55 55.70 2ppa s ASP 275 Cb -0.25 -2.51 -0.04 0.00 1.01 0.00 0.00 42.92 41.13 2ppa s ASP 275 CO 0.29 -1.24 -0.17 0.68 0.21 0.00 0.00 175.17 174.94 2ppa s VAL 276 N -2.77 1.72 -1.51 -1.27 -7.23 -1.26 -0.18 120.40 107.90 2ppa s VAL 276 Ca 0.60 -1.91 -0.06 0.00 -1.81 0.00 0.00 61.98 58.80 2ppa s VAL 276 Cb -0.14 -1.81 0.01 0.00 0.56 0.00 0.00 36.38 35.00 2ppa s VAL 276 CO 0.46 -0.37 0.75 0.47 -0.31 0.00 0.00 175.10 176.10 2ppa n ASP 277 N 0.26 -6.05 -4.74 4.85 10.43 -0.74 -4.92 116.55 115.64 2ppa n ASP 277 Ca -0.13 -0.36 -0.41 0.00 2.57 0.00 0.00 54.79 56.46 2ppa n ASP 277 Cb 0.57 -4.86 -0.04 0.00 1.84 0.00 0.00 41.12 38.63 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 -5.89 4.58 -0.18 -1.24 -1.52 0.17 -4.83 119.66 110.75 2ppa s GLN 278 Ca 0.39 1.77 -0.22 0.00 -1.95 0.00 0.00 55.36 55.35 2ppa s GLN 278 Cb -0.17 -3.25 -0.19 0.00 -0.22 0.00 0.00 33.01 29.18 2ppa s GLN 278 CO 0.48 0.07 0.32 1.05 -0.25 0.00 0.00 175.29 176.95 2ppa h GLU 279 N 4.86 0.00 -3.64 2.91 4.11 -1.91 -0.04 114.58 120.87 2ppa h GLU 279 Ca -0.45 0.00 -0.30 0.00 0.07 0.00 0.00 59.36 58.68 2ppa h GLU 279 Cb 1.21 0.00 -0.33 0.00 0.50 0.00 0.00 28.75 30.13 2ppa h GLU 279 CO 0.72 0.88 -0.73 0.99 0.07 0.00 0.00 179.01 180.94 2ppa s THR 280 N -2.29 0.03 0.46 -1.06 2.01 -1.26 -4.39 115.64 109.15 2ppa s THR 280 Ca -0.24 0.13 0.06 0.00 0.31 0.00 0.00 61.69 61.94 2ppa s THR 280 Cb 0.03 -0.13 -0.02 0.00 0.01 0.00 0.00 72.50 72.39 2ppa s THR 280 CO 0.56 0.09 0.20 -1.66 -0.69 0.00 0.00 174.62 173.12 2ppa s TRP 281 N 0.82 2.23 -0.06 4.92 -2.14 -0.78 -4.99 118.94 118.95 2ppa s TRP 281 Ca -0.07 -0.72 0.01 0.00 2.66 0.00 0.00 56.10 57.98 2ppa s TRP 281 Cb -0.10 -1.88 0.02 0.00 -3.10 0.00 0.00 33.47 28.40 2ppa s TRP 281 CO -0.02 0.04 -0.05 0.12 -2.66 0.00 0.00 176.95 174.37 2ppa s PHE 282 N -2.69 0.95 -0.20 1.66 5.36 -1.26 -2.50 117.98 119.30 2ppa s PHE 282 Ca 0.33 -0.32 0.01 0.00 -0.96 0.00 0.00 56.93 55.98 2ppa s PHE 282 Cb 0.02 -0.83 0.04 0.00 -0.34 0.00 0.00 43.02 41.91 2ppa s PHE 282 CO 0.19 -0.27 -0.12 0.42 -1.46 0.00 0.00 175.22 173.98 2ppa s ILE 283 N 1.14 1.73 0.57 3.12 1.01 -0.55 -4.71 121.20 123.50 2ppa s ILE 283 Ca -0.07 -1.02 -0.18 0.00 0.00 0.00 0.00 60.65 59.38 2ppa s ILE 283 Cb -0.14 -1.76 -0.05 0.00 0.01 0.00 0.00 42.46 40.52 2ppa s ILE 283 CO -0.01 0.22 1.09 -2.16 0.00 0.00 0.00 174.94 174.08 2ppa s PRO 284 N 1.37 3.32 0.18 2.79 0.04 -1.26 -1.03 135.00 140.40 2ppa s PRO 284 Ca -0.01 1.43 -0.33 0.00 0.04 0.00 0.00 61.00 62.13 2ppa s PRO 284 Cb -0.16 -2.02 -0.14 0.00 0.04 0.00 0.00 34.50 32.22 2ppa s PRO 284 CO -0.09 -0.84 1.45 0.41 0.04 0.00 0.00 177.00 177.97 2ppa n GLY 285 N -0.30 0.82 0.37 0.56 0.00 -1.23 -2.10 105.19 103.32 2ppa n GLY 285 Ca 0.10 0.60 0.00 0.00 0.00 0.00 0.00 46.02 46.72 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 2.74 0.89 3.25 -0.02 0.00 0.14 -4.75 105.19 107.44 2ppa n GLY 286 Ca 0.15 -0.13 -0.10 0.00 0.00 0.00 0.00 46.02 45.94 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 0.59 0.18 4.61 0.00 -0.89 -4.76 121.76 119.50 2ppa s ALA 287 Ca 0.00 -1.30 0.11 0.00 0.00 0.00 0.00 51.96 50.77 2ppa s ALA 287 Cb 0.00 0.99 -0.04 0.00 0.00 0.00 0.00 23.12 24.06 2ppa s ALA 287 CO 0.00 -0.58 -0.24 0.00 0.00 0.00 0.00 175.76 174.93 2ppa s ALA 288 N -4.05 2.51 0.29 0.00 0.00 -1.26 -1.89 121.76 117.36 2ppa s ALA 288 Ca 0.25 -1.62 0.02 0.00 0.00 0.00 0.00 51.96 50.61 2ppa s ALA 288 Cb 0.06 -0.34 -0.05 0.00 0.00 0.00 0.00 23.12 22.79 2ppa s ALA 288 CO 0.04 0.45 0.12 0.20 0.00 0.00 0.00 175.76 176.56 2ppa s GLY 289 N -2.58 1.93 -0.06 0.00 0.00 0.07 -3.16 107.32 103.52 2ppa s GLY 289 Ca 0.20 -1.80 -0.05 0.00 0.00 0.00 0.00 44.72 43.06 2ppa s GLY 289 CO 0.09 -1.63 0.15 0.00 0.00 0.00 0.00 173.10 171.71 2ppa s ALA 290 N -3.63 -0.37 -0.02 3.20 0.00 -0.94 -1.48 121.76 118.52 2ppa s ALA 290 Ca 0.36 0.42 0.05 0.00 0.00 0.00 0.00 51.96 52.80 2ppa s ALA 290 Cb 0.07 -0.25 -0.01 0.00 0.00 0.00 0.00 23.12 22.93 2ppa s ALA 290 CO 0.15 -0.07 -0.19 0.00 0.00 0.00 0.00 175.76 175.65 2ppa s ALA 291 N 0.09 1.59 -0.12 0.00 0.00 -0.40 -0.64 121.76 122.27 2ppa s ALA 291 Ca -0.00 -0.79 -0.01 0.00 0.00 0.00 0.00 51.96 51.16 2ppa s ALA 291 Cb -0.01 -0.44 -0.02 0.00 0.00 0.00 0.00 23.12 22.65 2ppa s ALA 291 CO 0.00 0.36 -0.09 0.12 0.00 0.00 0.00 175.76 176.15 2ppa s PHE 292 N -0.30 2.90 -0.06 0.00 2.19 0.11 -0.43 117.98 122.39 2ppa s PHE 292 Ca 0.04 -0.38 -0.04 0.00 0.33 0.00 0.00 56.93 56.88 2ppa s PHE 292 Cb -0.09 -1.85 0.02 0.00 -1.31 0.00 0.00 43.02 39.80 2ppa s PHE 292 CO 0.00 -0.03 0.15 -0.47 1.83 0.00 0.00 175.22 176.70 2ppa s TYR 293 N 0.11 -0.17 -0.29 10.12 5.04 -0.35 -1.17 117.35 130.64 2ppa s TYR 293 Ca -0.03 0.44 -0.11 0.00 -2.44 0.00 0.00 57.07 54.92 2ppa s TYR 293 Cb -0.14 0.00 -0.03 0.00 0.35 0.00 0.00 41.96 42.13 2ppa s TYR 293 CO 0.04 -0.12 0.18 0.99 -1.34 0.00 0.00 175.55 175.30 2ppa s THR 294 N 0.55 5.08 0.29 4.34 2.01 -1.26 -0.52 115.64 126.13 2ppa s THR 294 Ca -0.04 -0.03 -0.29 0.00 0.31 0.00 0.00 61.69 61.63 2ppa s THR 294 Cb -0.05 -3.48 -0.10 0.00 0.01 0.00 0.00 72.50 68.88 2ppa s THR 294 CO -0.03 0.18 1.27 -0.36 -0.69 0.00 0.00 174.62 175.00 2ppa s PHE 295 N 1.71 3.21 0.00 4.92 0.40 -0.67 -4.89 117.98 122.67 2ppa s PHE 295 Ca 0.06 1.41 0.00 0.00 -0.60 0.00 0.00 56.93 57.81 2ppa s PHE 295 Cb -0.16 -3.59 0.00 0.00 0.51 0.00 0.00 43.02 39.78 2ppa s PHE 295 CO 0.09 -1.62 0.00 1.04 0.70 0.00 0.00 175.22 175.43 2ppa n GLN 296 N 1.36 3.42 -4.32 0.44 6.02 -1.26 -0.45 117.38 122.60 2ppa n GLN 296 Ca 0.01 0.00 -0.18 0.00 -0.01 0.00 0.00 57.00 56.82 2ppa n GLN 296 Cb 0.43 -0.67 -0.14 0.00 1.02 0.00 0.00 30.24 30.87 2ppa n GLN 296 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 2ppa s GLN 297 N -1.27 0.75 0.86 -1.09 -1.52 -1.26 -4.60 119.66 111.52 2ppa s GLN 297 Ca 0.00 -0.49 -0.13 0.00 -1.95 0.00 0.00 55.36 52.79 2ppa s GLN 297 Cb 0.00 -0.71 0.13 0.00 -0.22 0.00 0.00 33.01 32.21 2ppa s GLN 297 CO 0.00 0.18 1.22 -1.25 -0.25 0.00 0.00 175.29 175.19 2ppa s PRO 298 N -0.64 1.42 0.00 2.91 0.04 -1.26 -4.76 135.00 132.71 2ppa s PRO 298 Ca 0.01 -0.19 0.00 0.00 0.04 0.00 0.00 61.00 60.86 2ppa s PRO 298 Cb -0.05 -1.94 0.00 0.00 0.04 0.00 0.00 34.50 32.54 2ppa s PRO 298 CO 0.00 -1.90 0.00 0.41 0.04 0.00 0.00 177.00 175.55 2ppa n GLY 299 N -3.45 0.09 3.75 0.56 0.00 0.55 -4.92 105.19 101.78 2ppa n GLY 299 Ca 0.11 -2.29 -0.39 0.00 0.00 0.00 0.00 46.02 43.46 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 -0.36 4.99 0.09 -0.61 1.01 -1.26 -1.17 121.20 123.90 2ppa s ILE 300 Ca 0.00 1.18 0.09 0.00 0.00 0.00 0.00 60.65 61.92 2ppa s ILE 300 Cb 0.00 -3.91 -0.04 0.00 0.01 0.00 0.00 42.46 38.53 2ppa s ILE 300 CO 0.00 0.39 -0.20 -0.31 0.00 0.00 0.00 174.94 174.82 2ppa s TYR 301 N 0.06 2.50 -0.12 3.97 1.51 0.12 -4.97 117.35 120.41 2ppa s TYR 301 Ca 0.30 -0.28 -0.04 0.00 -1.01 0.00 0.00 57.07 56.04 2ppa s TYR 301 Cb -0.17 -1.37 -0.03 0.00 -0.11 0.00 0.00 41.96 40.27 2ppa s TYR 301 CO 0.16 0.32 0.01 0.00 -1.11 0.00 0.00 175.55 174.93 2ppa s ALA 302 N -1.04 3.27 -0.21 3.71 0.00 -1.21 -0.92 121.76 125.36 2ppa s ALA 302 Ca 0.16 -0.79 -0.04 0.00 0.00 0.00 0.00 51.96 51.29 2ppa s ALA 302 Cb -0.10 -1.61 -0.01 0.00 0.00 0.00 0.00 23.12 21.39 2ppa s ALA 302 CO 0.08 0.42 -0.04 -0.47 0.00 0.00 0.00 175.76 175.74 2ppa s TYR 303 N -0.34 2.96 0.12 0.00 5.04 0.81 0.29 117.35 126.23 2ppa s TYR 303 Ca 0.07 -0.87 0.01 0.00 -2.44 0.00 0.00 57.07 53.84 2ppa s TYR 303 Cb -0.12 -2.09 -0.04 0.00 0.35 0.00 0.00 41.96 40.05 2ppa s TYR 303 CO 0.02 -0.50 -0.02 0.14 -1.34 0.00 0.00 175.55 173.85 2ppa s VAL 304 N 1.38 0.53 -0.21 3.14 -7.23 0.13 -0.26 120.40 117.87 2ppa s VAL 304 Ca 0.05 -1.92 -0.29 0.00 -1.81 0.00 0.00 61.98 58.00 2ppa s VAL 304 Cb -0.14 -1.83 0.00 0.00 0.56 0.00 0.00 36.38 34.97 2ppa s VAL 304 CO -0.02 -0.72 1.13 0.21 -0.31 0.00 0.00 175.10 175.38 2ppa s ASN 305 N -3.06 7.02 -0.09 4.85 3.84 -0.98 -0.41 114.94 126.11 2ppa s ASN 305 Ca 0.16 1.47 0.03 0.00 0.21 0.00 0.00 52.86 54.73 2ppa s ASN 305 Cb 0.06 -2.54 0.21 0.00 -0.55 0.00 0.00 41.25 38.43 2ppa s ASN 305 CO -0.02 -0.73 1.00 1.57 -2.79 0.00 0.00 177.10 176.13 2ppa n HIS 306 N 6.51 0.68 -2.75 0.43 -0.00 0.88 -3.82 115.22 117.14 2ppa n HIS 306 Ca 0.13 -0.45 -0.43 0.00 -0.00 0.00 0.00 57.72 56.97 2ppa n HIS 306 Cb 0.46 -0.30 -0.04 0.00 -0.00 0.00 0.00 29.99 30.11 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 0.01 6.35 0.59 0.26 3.84 -1.26 -4.92 114.94 119.80 2ppa s ASN 307 Ca 0.15 -0.26 0.37 0.00 0.21 0.00 0.00 52.86 53.34 2ppa s ASN 307 Cb 0.12 -2.48 1.74 0.00 -0.55 0.00 0.00 41.25 40.09 2ppa s ASN 307 CO 0.04 -1.35 2.12 -0.07 -2.79 0.00 0.00 177.10 175.05 2ppa h LEU 308 N 11.39 0.00 -0.21 3.21 3.38 -1.99 0.15 115.31 131.24 2ppa h LEU 308 Ca -0.26 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.64 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 1.13 0.00 -0.13 0.40 0.09 0.00 0.00 178.44 179.93 2ppa h ILE 309 N 0.00 1.31 -0.62 1.22 2.04 -1.91 0.13 117.51 119.69 2ppa h ILE 309 Ca -0.00 -1.24 -0.08 0.00 1.00 0.00 0.00 64.86 64.54 2ppa h ILE 309 Cb 0.33 1.67 -0.02 0.00 -0.74 0.00 0.00 36.82 38.05 2ppa h ILE 309 CO 0.00 0.38 0.07 -0.33 0.00 0.00 0.00 178.15 178.27 2ppa h GLU 310 N 0.16 1.03 -0.05 2.37 5.08 -1.11 0.13 114.58 122.19 2ppa h GLU 310 Ca 0.04 -0.28 -0.01 0.00 -1.00 0.00 0.00 59.36 58.11 2ppa h GLU 310 Cb 0.65 -0.12 -0.00 0.00 0.50 0.00 0.00 28.75 29.78 2ppa h GLU 310 CO 0.04 0.97 -0.00 0.00 -1.00 0.00 0.00 179.01 179.01 2ppa h ALA 311 N 1.10 0.06 0.00 3.43 0.00 -0.98 -0.65 119.26 122.23 2ppa h ALA 311 Ca 0.19 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.92 2ppa h ALA 311 Cb 0.46 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.23 2ppa h ALA 311 CO 0.02 -0.26 -0.63 1.19 0.00 0.00 0.00 179.25 179.57 2ppa n PHE 312 N -4.87 0.00 -0.06 0.00 3.01 0.03 -2.05 117.46 113.52 2ppa n PHE 312 Ca -0.07 0.00 -0.08 0.00 1.01 0.00 0.00 57.45 58.31 2ppa n PHE 312 Cb 0.19 -0.03 -0.07 0.00 -0.01 0.00 0.00 39.48 39.57 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 -1.33 0.95 0.02 -1.08 -0.58 0.36 -4.77 120.64 114.22 2ppa n GLU 313 Ca 0.02 0.05 0.11 0.00 -0.42 0.00 0.00 57.16 56.92 2ppa n GLU 313 Cb 0.19 -1.26 -0.08 0.00 -0.57 0.00 0.00 31.44 29.72 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 -2.72 0.48 0.00 -4.62 4.77 -0.55 -5.01 117.00 109.34 2ppa n LEU 314 Ca -0.21 -0.07 0.00 0.00 -0.03 0.00 0.00 56.01 55.70 2ppa n LEU 314 Cb 0.77 -0.04 0.00 0.00 -2.33 0.00 0.00 43.42 41.82 2ppa n LEU 314 CO 0.16 0.04 0.00 0.61 -1.33 0.00 0.00 177.39 176.87 2ppa n GLY 315 N 1.33 1.19 2.62 -0.72 0.00 -0.59 -1.23 105.19 107.81 2ppa n GLY 315 Ca -0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 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 -0.06 6.26 -3.71 4.61 0.00 0.43 -4.24 120.51 123.81 2ppa n ALA 316 Ca 0.00 -4.06 -0.14 0.00 0.00 0.00 0.00 53.44 49.24 2ppa n ALA 316 Cb 0.00 -3.03 -0.15 0.00 0.00 0.00 0.00 19.45 16.27 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 0.43 -0.22 0.33 0.00 0.00 -1.25 -2.31 121.76 118.74 2ppa s ALA 317 Ca 0.50 0.61 0.08 0.00 0.00 0.00 0.00 51.96 53.16 2ppa s ALA 317 Cb 0.15 -0.41 -0.06 0.00 0.00 0.00 0.00 23.12 22.79 2ppa s ALA 317 CO -0.05 -0.15 -0.08 0.00 0.00 0.00 0.00 175.76 175.48 2ppa s ALA 318 N 1.11 2.76 0.16 0.00 0.00 0.64 -4.48 121.76 121.95 2ppa s ALA 318 Ca -0.09 -2.04 0.11 0.00 0.00 0.00 0.00 51.96 49.94 2ppa s ALA 318 Cb -0.11 0.05 -0.04 0.00 0.00 0.00 0.00 23.12 23.01 2ppa s ALA 318 CO -0.05 0.02 -0.25 -1.01 0.00 0.00 0.00 175.76 174.47 2ppa s HIS 319 N -2.75 2.27 -0.09 0.00 3.76 -0.09 -0.13 115.29 118.26 2ppa s HIS 319 Ca 0.32 -0.37 0.01 0.00 -0.15 0.00 0.00 55.06 54.86 2ppa s HIS 319 Cb 0.03 -1.18 -0.02 0.00 1.11 0.00 0.00 32.58 32.51 2ppa s HIS 319 CO 0.15 0.40 -0.10 -0.06 -0.85 0.00 0.00 174.74 174.28 2ppa s PHE 320 N -1.35 2.84 -0.26 1.40 0.08 -0.09 -0.94 117.98 119.66 2ppa s PHE 320 Ca 0.17 -0.27 -0.07 0.00 0.12 0.00 0.00 56.93 56.88 2ppa s PHE 320 Cb -0.09 -1.76 -0.01 0.00 -0.57 0.00 0.00 43.02 40.58 2ppa s PHE 320 CO 0.08 0.08 0.06 0.15 -0.10 0.00 0.00 175.22 175.48 2ppa s LYS 321 N -0.28 3.45 -0.12 0.44 1.02 0.00 -0.70 119.74 123.55 2ppa s LYS 321 Ca 0.03 -0.61 0.02 0.00 0.02 0.00 0.00 55.97 55.43 2ppa s LYS 321 Cb -0.13 -3.30 -0.00 0.00 -0.52 0.00 0.00 37.83 33.88 2ppa s LYS 321 CO 0.03 -0.27 -0.20 0.08 -0.92 0.00 0.00 175.35 174.07 2ppa s VAL 322 N 1.57 2.40 0.40 3.17 1.01 -0.32 -2.29 120.40 126.35 2ppa s VAL 322 Ca 0.05 -0.89 0.00 0.00 0.00 0.00 0.00 61.98 61.15 2ppa s VAL 322 Cb -0.16 -1.96 -0.02 0.00 0.00 0.00 0.00 36.38 34.25 2ppa s VAL 322 CO 0.02 0.54 0.62 0.42 0.00 0.00 0.00 175.10 176.70 2ppa s THR 323 N 0.44 4.50 -3.09 3.92 -4.23 -0.59 -0.33 115.64 116.27 2ppa s THR 323 Ca -0.14 -0.47 0.00 0.00 -1.18 0.00 0.00 61.69 59.90 2ppa s THR 323 Cb -0.17 -3.65 0.00 0.00 1.34 0.00 0.00 72.50 70.02 2ppa s THR 323 CO 0.06 -0.44 0.00 0.61 -0.54 0.00 0.00 174.62 174.31 2ppa n GLY 324 N -1.95 0.81 3.76 3.99 0.00 -1.26 -0.75 105.19 109.79 2ppa n GLY 324 Ca -0.01 -2.08 -0.38 0.00 0.00 0.00 0.00 46.02 43.55 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 -1.14 4.22 0.28 1.61 2.12 -1.26 -4.65 118.70 119.88 2ppa s GLU 325 Ca 0.00 0.51 -0.29 0.00 0.36 0.00 0.00 54.97 55.54 2ppa s GLU 325 Cb 0.00 -3.35 -0.10 0.00 0.26 0.00 0.00 34.13 30.94 2ppa s GLU 325 CO 0.00 0.36 1.34 -0.46 -0.54 0.00 0.00 175.26 175.96 2ppa s TRP 326 N -0.07 3.10 -0.44 5.30 -0.11 -1.26 -4.38 118.94 121.08 2ppa s TRP 326 Ca 0.26 1.28 -0.10 0.00 1.22 0.00 0.00 56.10 58.77 2ppa s TRP 326 Cb -0.16 -3.69 0.08 0.00 -1.50 0.00 0.00 33.47 28.20 2ppa s TRP 326 CO 0.13 -2.03 0.30 1.21 -4.62 0.00 0.00 176.95 171.93 2ppa s ASN 327 N -0.11 5.73 0.39 5.86 3.84 -1.26 -4.96 114.94 124.44 2ppa s ASN 327 Ca 0.53 -1.55 0.27 0.00 0.21 0.00 0.00 52.86 52.32 2ppa s ASN 327 Cb -0.39 -2.02 0.83 0.00 -0.55 0.00 0.00 41.25 39.11 2ppa s ASN 327 CO 0.47 -0.58 1.77 0.44 -2.79 0.00 0.00 177.10 176.40 2ppa h ASP 328 N 8.48 0.00 -0.24 -4.21 5.19 -1.96 -2.63 116.42 121.06 2ppa h ASP 328 Ca -0.24 0.00 -0.05 0.00 -0.62 0.00 0.00 57.03 56.13 2ppa h ASP 328 Cb 1.09 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 40.59 2ppa h ASP 328 CO 0.80 0.00 -0.04 -0.78 -3.12 0.00 0.00 179.24 176.10 2ppa h ASP 329 N 0.00 0.45 -0.43 6.45 -0.00 -2.02 -3.23 116.42 117.64 2ppa h ASP 329 Ca 0.00 -0.35 -0.07 0.00 -0.00 0.00 0.00 57.03 56.61 2ppa h ASP 329 Cb 0.71 -0.12 -0.02 0.00 -0.00 0.00 0.00 39.33 39.90 2ppa h ASP 329 CO 0.00 0.69 -0.02 -0.07 -0.00 0.00 0.00 179.24 179.84 2ppa h LEU 330 N 0.20 0.77 -7.11 2.28 3.38 -1.96 -3.45 115.31 109.42 2ppa h LEU 330 Ca 0.06 -0.32 -0.06 0.00 0.09 0.00 0.00 57.88 57.66 2ppa h LEU 330 Cb 0.48 -0.21 -0.23 0.00 0.09 0.00 0.00 40.66 40.80 2ppa h LEU 330 CO 0.02 0.90 -0.05 -0.32 0.09 0.00 0.00 178.44 179.08 2ppa s MET 331 N -4.96 0.65 -0.03 1.13 0.00 -1.00 -5.15 119.30 109.95 2ppa s MET 331 Ca -0.13 0.92 -0.12 0.00 0.00 0.00 0.00 55.69 56.37 2ppa s MET 331 Cb 0.11 0.23 0.02 0.00 0.00 0.00 0.00 34.83 35.19 2ppa s MET 331 CO 0.81 -0.11 0.26 -0.08 0.00 0.00 0.00 175.02 175.89 2ppa s THR 332 N 0.82 0.05 -0.65 10.11 -1.32 -1.25 -4.03 115.64 119.38 2ppa s THR 332 Ca -0.04 -0.45 -0.25 0.00 -1.21 0.00 0.00 61.69 59.74 2ppa s THR 332 Cb -0.05 -0.53 0.04 0.00 -1.51 0.00 0.00 72.50 70.46 2ppa s THR 332 CO -0.07 -0.25 1.10 -0.55 -2.21 0.00 0.00 174.62 172.65 2ppa s SER 333 N -1.09 6.24 0.12 8.08 0.15 -1.26 -4.88 113.70 121.06 2ppa s SER 333 Ca -0.12 -0.51 -0.13 0.00 0.70 0.00 0.00 55.95 55.89 2ppa s SER 333 Cb -0.05 -2.49 -0.04 0.00 -1.71 0.00 0.00 66.02 61.73 2ppa s SER 333 CO 0.03 -1.54 1.50 0.58 1.20 0.00 0.00 173.24 175.01 2ppa h VAL 334 N 6.03 1.28 -3.24 4.45 2.07 -2.01 -3.40 116.25 121.42 2ppa h VAL 334 Ca -0.27 -1.29 -0.48 0.00 0.82 0.00 0.00 66.70 65.48 2ppa h VAL 334 Cb 1.06 1.30 -0.39 0.00 -1.52 0.00 0.00 31.29 31.74 2ppa h VAL 334 CO 1.20 0.43 -0.76 -0.22 0.02 0.00 0.00 177.57 178.23 2ppa s LEU 335 N -9.15 0.82 0.62 2.57 2.96 -1.26 -5.14 118.68 110.11 2ppa s LEU 335 Ca -0.12 -0.49 -0.18 0.00 -0.22 0.00 0.00 54.13 53.12 2ppa s LEU 335 Cb 0.10 -0.48 -0.02 0.00 0.50 0.00 0.00 46.19 46.29 2ppa s LEU 335 CO 0.83 -0.27 1.19 0.00 -1.32 0.00 0.00 176.35 176.78 2ppa s ALA 336 N 1.94 2.47 -0.32 5.97 0.00 -1.26 -4.87 121.76 125.69 2ppa s ALA 336 Ca 0.02 0.90 -0.44 0.00 0.00 0.00 0.00 51.96 52.44 2ppa s ALA 336 Cb -0.15 -3.43 -0.20 0.00 0.00 0.00 0.00 23.12 19.35 2ppa s ALA 336 CO -0.07 -1.28 1.44 -2.30 0.00 0.00 0.00 175.76 173.55 2ppa n PRO 337 N -1.90 0.08 -3.48 0.00 -0.02 -1.26 -4.92 135.00 123.50 2ppa n PRO 337 Ca 0.13 0.03 -0.11 0.00 -2.02 0.00 0.00 63.50 61.53 2ppa n PRO 337 Cb 0.50 -1.54 -0.03 0.00 -0.02 0.00 0.00 33.50 32.41 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 2.05 -0.48 0.00 2.55 1.04 -1.26 -5.29 113.70 112.31 2ppa s SER 338 Ca 1.00 0.15 0.00 0.00 0.48 0.00 0.00 55.95 57.58 2ppa s SER 338 Cb -1.40 0.47 0.00 0.00 0.10 0.00 0.00 66.02 65.20 2ppa s SER 338 CO 0.73 -0.71 0.25 0.61 0.98 0.00 0.00 173.24 175.09