#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bwi s ASP 8 N 0.00 6.47 0.36 4.52 3.68 -1.26 -4.93 116.67 125.51 2bwi s ASP 8 Ca 0.00 2.64 0.07 0.00 2.13 0.00 0.00 52.55 57.39 2bwi s ASP 8 Cb 0.00 -2.53 0.69 0.00 -1.45 0.00 0.00 42.92 39.63 2bwi s ASP 8 CO 0.00 -1.04 1.89 0.40 0.13 0.00 0.00 175.17 176.56 2bwi h ILE 9 N 5.53 1.19 0.00 4.11 2.04 -2.04 -2.46 117.51 125.88 2bwi h ILE 9 Ca -0.48 -0.78 -0.00 0.00 1.00 0.00 0.00 64.86 64.60 2bwi h ILE 9 Cb 1.23 1.07 -0.00 0.00 -0.74 0.00 0.00 36.82 38.38 2bwi h ILE 9 CO 0.94 0.26 -0.01 0.77 0.00 0.00 0.00 178.15 180.11 2bwi h SER 10 N 0.37 0.00 0.45 1.72 4.64 -2.01 -1.95 113.55 116.77 2bwi h SER 10 Ca 0.08 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.40 2bwi h SER 10 Cb 0.35 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.44 2bwi h SER 10 CO 0.02 0.01 -0.24 0.35 -0.87 0.00 0.00 176.83 176.10 2bwi n THR 11 N -3.18 0.00 -1.93 2.95 -2.24 -0.93 -4.95 114.28 104.00 2bwi n THR 11 Ca -0.02 -0.05 -0.31 0.00 -2.27 0.00 0.00 64.05 61.39 2bwi n THR 11 Cb 0.14 0.08 0.01 0.00 -2.10 0.00 0.00 70.33 68.45 2bwi n THR 11 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2bwi s LEU 12 N -2.69 3.29 0.78 3.22 1.43 -0.74 -5.02 118.68 118.94 2bwi s LEU 12 Ca 0.21 1.46 -0.14 0.00 -1.03 0.00 0.00 54.13 54.63 2bwi s LEU 12 Cb 0.19 -4.48 0.06 0.00 0.03 0.00 0.00 46.19 41.99 2bwi s LEU 12 CO 0.55 -0.87 1.15 -2.65 0.23 0.00 0.00 176.35 174.76 2bwi n PRO 13 N -2.58 0.35 -4.34 1.29 -0.02 -1.26 -4.83 135.00 123.60 2bwi n PRO 13 Ca 0.06 0.19 -0.22 0.00 -2.02 0.00 0.00 63.50 61.51 2bwi n PRO 13 Cb 0.54 -2.39 -0.11 0.00 -0.02 0.00 0.00 33.50 31.52 2bwi n PRO 13 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 2bwi s ARG 14 N -3.86 1.31 -0.11 -0.52 0.52 -1.26 -1.29 118.95 113.75 2bwi s ARG 14 Ca 0.74 -1.45 -0.20 0.00 -0.52 0.00 0.00 55.73 54.30 2bwi s ARG 14 Cb -0.31 -1.34 0.05 0.00 0.52 0.00 0.00 34.95 33.86 2bwi s ARG 14 CO 0.50 0.27 0.49 0.54 0.02 0.00 0.00 175.30 177.12 2bwi s VAL 15 N -2.18 0.02 -0.22 3.52 0.11 -0.59 -4.94 120.40 116.11 2bwi s VAL 15 Ca 0.18 -0.14 -0.10 0.00 -2.93 0.00 0.00 61.98 58.99 2bwi s VAL 15 Cb -0.05 -0.75 -0.05 0.00 -1.53 0.00 0.00 36.38 34.00 2bwi s VAL 15 CO 0.07 -0.08 0.14 -0.54 -3.33 0.00 0.00 175.10 171.37 2bwi s LYS 16 N -0.54 4.11 -0.10 1.54 1.02 -1.26 -0.44 119.74 124.07 2bwi s LYS 16 Ca -0.07 -0.25 -0.08 0.00 0.02 0.00 0.00 55.97 55.59 2bwi s LYS 16 Cb -0.03 -3.46 -0.04 0.00 -0.52 0.00 0.00 37.83 33.77 2bwi s LYS 16 CO 0.04 0.18 0.18 0.08 -0.92 0.00 0.00 175.35 174.91 2bwi s VAL 17 N 0.71 5.44 -0.27 3.17 1.01 -0.26 -4.94 120.40 125.25 2bwi s VAL 17 Ca 0.07 0.28 -0.05 0.00 0.00 0.00 0.00 61.98 62.29 2bwi s VAL 17 Cb -0.12 -3.45 0.01 0.00 0.00 0.00 0.00 36.38 32.82 2bwi s VAL 17 CO 0.01 0.60 0.02 -1.81 0.00 0.00 0.00 175.10 173.92 2bwi s ASP 18 N -1.08 4.76 0.67 3.32 1.01 -1.26 -4.61 116.67 119.48 2bwi s ASP 18 Ca 0.17 -0.67 -0.11 0.00 0.71 0.00 0.00 52.55 52.65 2bwi s ASP 18 Cb -0.13 -1.80 -0.01 0.00 1.01 0.00 0.00 42.92 42.00 2bwi s ASP 18 CO 0.06 -0.13 1.05 -0.76 0.21 0.00 0.00 175.17 175.60 2bwi s LEU 19 N 1.45 3.18 0.25 1.23 1.43 -1.26 -4.82 118.68 120.14 2bwi s LEU 19 Ca 0.03 1.59 0.08 0.00 -1.03 0.00 0.00 54.13 54.79 2bwi s LEU 19 Cb -0.16 -4.49 -0.05 0.00 0.03 0.00 0.00 46.19 41.51 2bwi s LEU 19 CO -0.00 -1.29 -0.12 0.68 0.23 0.00 0.00 176.35 175.85 2bwi s VAL 20 N -3.03 1.85 0.11 -1.59 -7.23 -1.26 -4.99 120.40 104.26 2bwi s VAL 20 Ca 0.58 -2.22 -0.30 0.00 -1.81 0.00 0.00 61.98 58.23 2bwi s VAL 20 Cb -0.13 -2.25 -0.06 0.00 0.56 0.00 0.00 36.38 34.49 2bwi s VAL 20 CO 0.53 -0.45 1.04 -0.75 -0.31 0.00 0.00 175.10 175.17 2bwi s LYS 21 N -3.65 4.61 0.60 4.82 2.20 -1.26 -4.63 119.74 122.42 2bwi s LYS 21 Ca 0.27 1.58 -0.19 0.00 -0.36 0.00 0.00 55.97 57.27 2bwi s LYS 21 Cb 0.00 -3.35 -0.05 0.00 -1.51 0.00 0.00 37.83 32.93 2bwi s LYS 21 CO 0.10 0.07 1.01 -2.30 -0.36 0.00 0.00 175.35 173.88 2bwi n PRO 22 N 2.93 0.96 -0.05 4.03 -0.02 -1.26 -2.29 135.00 139.29 2bwi n PRO 22 Ca 0.04 0.37 0.11 0.00 -2.02 0.00 0.00 63.50 62.00 2bwi n PRO 22 Cb 0.48 -2.21 0.45 0.00 -0.02 0.00 0.00 33.50 32.19 2bwi n PRO 22 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 2bwi n PRO 23 N -1.06 1.52 -1.50 0.52 -0.04 -1.26 -5.04 135.00 128.14 2bwi n PRO 23 Ca 0.14 -0.77 -0.31 0.00 -0.04 0.00 0.00 63.50 62.52 2bwi n PRO 23 Cb 0.47 -1.38 0.08 0.00 -0.04 0.00 0.00 33.50 32.63 2bwi n PRO 23 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 2bwi s PHE 24 N -1.87 2.89 -0.03 0.54 0.08 -0.97 -0.92 117.98 117.70 2bwi s PHE 24 Ca 0.32 1.33 0.02 0.00 0.12 0.00 0.00 56.93 58.71 2bwi s PHE 24 Cb 0.17 -3.01 0.01 0.00 -0.57 0.00 0.00 43.02 39.62 2bwi s PHE 24 CO 0.26 -1.58 -0.06 0.08 -0.10 0.00 0.00 175.22 173.81 2bwi s VAL 25 N -3.06 0.61 0.48 -0.44 1.01 -1.26 -4.64 120.40 113.10 2bwi s VAL 25 Ca 0.60 -0.24 -0.23 0.00 0.00 0.00 0.00 61.98 62.11 2bwi s VAL 25 Cb -0.15 -0.57 -0.08 0.00 0.00 0.00 0.00 36.38 35.58 2bwi s VAL 25 CO 0.55 0.21 1.19 0.00 0.00 0.00 0.00 175.10 177.05 2bwi n HIS 26 N 3.52 1.79 -1.77 5.22 1.44 -1.26 -4.91 115.22 119.25 2bwi n HIS 26 Ca -0.20 0.48 -0.41 0.00 -2.01 0.00 0.00 57.72 55.58 2bwi n HIS 26 Cb 0.54 -2.31 -0.00 0.00 0.12 0.00 0.00 29.99 28.33 2bwi n HIS 26 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2bwi n ALA 27 N -0.68 2.34 -3.64 1.59 0.00 -1.26 -4.97 120.51 113.89 2bwi n ALA 27 Ca 0.09 0.35 -0.09 0.00 0.00 0.00 0.00 53.44 53.78 2bwi n ALA 27 Cb 0.42 -2.42 -0.00 0.00 0.00 0.00 0.00 19.45 17.45 2bwi n ALA 27 CO 0.00 0.00 0.00 -3.38 0.00 0.00 0.00 177.50 174.12 2bwi s HIS 28 N -0.97 0.21 -0.15 0.00 -3.43 -1.26 -5.06 115.29 104.63 2bwi s HIS 28 Ca 0.55 -0.76 -0.06 0.00 -0.80 0.00 0.00 55.06 53.99 2bwi s HIS 28 Cb -0.48 0.63 -0.04 0.00 -1.43 0.00 0.00 32.58 31.26 2bwi s HIS 28 CO 0.62 -1.40 0.06 -0.51 -2.00 0.00 0.00 174.74 171.51 2bwi s ASP 29 N -3.06 5.63 -0.01 7.38 1.01 -1.26 -5.03 116.67 121.32 2bwi s ASP 29 Ca 0.17 0.15 -0.25 0.00 0.71 0.00 0.00 52.55 53.33 2bwi s ASP 29 Cb -0.04 -1.86 -0.20 0.00 1.01 0.00 0.00 42.92 41.83 2bwi s ASP 29 CO 0.12 0.26 1.27 1.56 0.21 0.00 0.00 175.17 178.59 2bwi h GLN 30 N 6.06 -0.04 -5.46 8.23 4.20 -1.97 -3.41 115.11 122.73 2bwi h GLN 30 Ca -0.43 0.00 -0.64 0.00 0.06 0.00 0.00 58.65 57.65 2bwi h GLN 30 Cb 1.18 0.01 -0.10 0.00 0.30 0.00 0.00 27.48 28.87 2bwi h GLN 30 CO 0.65 0.41 -0.49 0.08 -0.67 0.00 0.00 178.83 178.80 2bwi s VAL 31 N -4.36 5.39 -0.05 -0.54 1.01 -1.26 -3.41 120.40 117.19 2bwi s VAL 31 Ca -0.15 0.17 -0.30 0.00 0.00 0.00 0.00 61.98 61.70 2bwi s VAL 31 Cb 0.02 -3.40 -0.04 0.00 0.00 0.00 0.00 36.38 32.96 2bwi s VAL 31 CO 0.66 0.53 1.28 0.00 0.00 0.00 0.00 175.10 177.57 2bwi s ALA 32 N -0.31 3.54 -1.95 5.51 0.00 -0.26 -4.95 121.76 123.34 2bwi s ALA 32 Ca 0.11 0.70 0.27 0.00 0.00 0.00 0.00 51.96 53.03 2bwi s ALA 32 Cb -0.12 -3.56 0.79 0.00 0.00 0.00 0.00 23.12 20.23 2bwi s ALA 32 CO 0.01 -0.86 1.59 1.63 0.00 0.00 0.00 175.76 178.12 2bwi n LYS 33 N 5.43 1.06 -4.53 0.00 5.02 -1.26 -4.83 118.16 119.05 2bwi n LYS 33 Ca 0.12 -0.64 -0.25 0.00 -2.02 0.00 0.00 58.31 55.53 2bwi n LYS 33 Cb 0.45 -1.49 -0.11 0.00 -0.02 0.00 0.00 35.03 33.87 2bwi n LYS 33 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 2bwi s THR 34 N -2.38 1.89 0.71 -0.18 -4.23 -1.26 -5.16 115.64 105.03 2bwi s THR 34 Ca 0.27 -2.10 -0.12 0.00 -1.18 0.00 0.00 61.69 58.56 2bwi s THR 34 Cb 0.20 -2.72 0.17 0.00 1.34 0.00 0.00 72.50 71.48 2bwi s THR 34 CO 0.48 -0.14 0.74 0.61 -0.54 0.00 0.00 174.62 175.77 2bwi n GLY 35 N -0.78 -2.16 3.51 3.99 0.00 -1.26 -4.94 105.19 103.56 2bwi n GLY 35 Ca -0.05 -1.56 -0.50 0.00 0.00 0.00 0.00 46.02 43.92 2bwi n GLY 35 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2bwi n PRO 36 N -3.27 0.65 -4.09 1.61 -0.02 -1.26 -4.95 135.00 123.66 2bwi n PRO 36 Ca 0.10 0.23 -0.09 0.00 -2.02 0.00 0.00 63.50 61.71 2bwi n PRO 36 Cb 0.36 -1.56 -0.09 0.00 -0.02 0.00 0.00 33.50 32.19 2bwi n PRO 36 CO 0.00 0.00 0.00 -0.98 1.98 0.00 0.00 175.50 176.50 2bwi s ARG 37 N -0.67 0.93 -0.35 -0.52 1.70 -1.26 -4.38 118.95 114.40 2bwi s ARG 37 Ca 0.71 -1.34 -0.19 0.00 -0.47 0.00 0.00 55.73 54.44 2bwi s ARG 37 Cb -0.92 0.27 -0.00 0.00 -0.57 0.00 0.00 34.95 33.72 2bwi s ARG 37 CO 0.55 -0.27 0.57 0.08 -1.08 0.00 0.00 175.30 175.15 2bwi s VAL 38 N -4.01 4.96 -0.36 4.99 1.01 -0.41 -1.09 120.40 125.49 2bwi s VAL 38 Ca 0.20 0.46 -0.12 0.00 0.00 0.00 0.00 61.98 62.52 2bwi s VAL 38 Cb 0.07 -4.01 0.01 0.00 0.00 0.00 0.00 36.38 32.44 2bwi s VAL 38 CO -0.00 -0.25 0.23 -0.69 0.00 0.00 0.00 175.10 174.38 2bwi s VAL 39 N 2.53 4.92 -0.22 2.92 1.01 0.22 -1.54 120.40 130.22 2bwi s VAL 39 Ca 0.21 -0.56 -0.14 0.00 0.00 0.00 0.00 61.98 61.49 2bwi s VAL 39 Cb -0.15 -3.64 -0.04 0.00 0.00 0.00 0.00 36.38 32.55 2bwi s VAL 39 CO 0.14 -0.13 0.33 -1.61 0.00 0.00 0.00 175.10 173.82 2bwi s GLU 40 N 1.64 4.12 0.18 2.72 2.02 0.42 -1.09 118.70 128.70 2bwi s GLU 40 Ca 0.04 0.04 0.11 0.00 0.02 0.00 0.00 54.97 55.18 2bwi s GLU 40 Cb -0.18 -3.56 -0.04 0.00 0.10 0.00 0.00 34.13 30.45 2bwi s GLU 40 CO 0.08 -0.05 -0.24 -0.06 0.02 0.00 0.00 175.26 175.01 2bwi s PHE 41 N 1.38 2.24 -0.04 1.61 0.40 -0.24 -1.11 117.98 122.22 2bwi s PHE 41 Ca 0.15 -0.37 0.03 0.00 -0.60 0.00 0.00 56.93 56.14 2bwi s PHE 41 Cb -0.15 -1.13 0.00 0.00 0.51 0.00 0.00 43.02 42.26 2bwi s PHE 41 CO 0.07 0.45 -0.12 0.99 0.70 0.00 0.00 175.22 177.31 2bwi s THR 42 N -1.58 1.05 -0.01 0.64 2.01 -1.26 -1.09 115.64 115.40 2bwi s THR 42 Ca 0.19 -0.49 0.04 0.00 0.31 0.00 0.00 61.69 61.73 2bwi s THR 42 Cb -0.08 -0.93 -0.01 0.00 0.01 0.00 0.00 72.50 71.49 2bwi s THR 42 CO 0.09 0.32 -0.12 -0.04 -0.69 0.00 0.00 174.62 174.18 2bwi s MET 43 N 0.25 0.95 -0.21 4.92 -1.94 -0.44 -4.92 119.30 117.91 2bwi s MET 43 Ca -0.06 -0.43 -0.04 0.00 -1.71 0.00 0.00 55.69 53.46 2bwi s MET 43 Cb -0.11 -0.92 -0.02 0.00 2.01 0.00 0.00 34.83 35.80 2bwi s MET 43 CO 0.02 0.25 -0.03 0.99 -0.01 0.00 0.00 175.02 176.24 2bwi s THR 44 N -0.29 3.57 0.26 2.05 2.01 -1.26 -1.50 115.64 120.48 2bwi s THR 44 Ca 0.04 -0.44 -0.30 0.00 0.31 0.00 0.00 61.69 61.31 2bwi s THR 44 Cb -0.05 -2.61 -0.09 0.00 0.01 0.00 0.00 72.50 69.76 2bwi s THR 44 CO -0.00 0.43 1.23 -0.63 -0.69 0.00 0.00 174.62 174.96 2bwi s ILE 45 N 1.22 3.20 -0.13 1.82 1.01 -0.10 -0.82 121.20 127.39 2bwi s ILE 45 Ca 0.03 1.11 -0.02 0.00 0.00 0.00 0.00 60.65 61.77 2bwi s ILE 45 Cb -0.14 -3.71 0.04 0.00 0.01 0.00 0.00 42.46 38.66 2bwi s ILE 45 CO -0.00 0.22 0.03 -0.70 0.00 0.00 0.00 174.94 174.48 2bwi s GLU 46 N -0.98 0.57 -0.08 2.79 2.12 -0.29 -4.49 118.70 118.34 2bwi s GLU 46 Ca 0.50 -0.14 -0.27 0.00 0.36 0.00 0.00 54.97 55.42 2bwi s GLU 46 Cb -0.36 -1.55 -0.02 0.00 0.26 0.00 0.00 34.13 32.46 2bwi s GLU 46 CO 0.43 -0.49 0.88 -1.21 -0.54 0.00 0.00 175.26 174.33 2bwi s GLU 47 N 1.94 4.44 0.01 4.30 2.02 -1.26 -1.64 118.70 128.51 2bwi s GLU 47 Ca 0.02 1.17 -0.21 0.00 0.02 0.00 0.00 54.97 55.98 2bwi s GLU 47 Cb -0.15 -3.50 0.04 0.00 0.10 0.00 0.00 34.13 30.63 2bwi s GLU 47 CO -0.07 -0.14 0.47 -1.59 0.02 0.00 0.00 175.26 173.95 2bwi s LYS 48 N 1.43 0.90 0.24 1.61 -2.85 -0.64 -4.98 119.74 115.45 2bwi s LYS 48 Ca 0.44 -0.15 -0.30 0.00 -1.00 0.00 0.00 55.97 54.96 2bwi s LYS 48 Cb -0.19 0.41 -0.09 0.00 -2.06 0.00 0.00 37.83 35.91 2bwi s LYS 48 CO 0.20 -0.29 1.22 0.15 0.10 0.00 0.00 175.35 176.72 2bwi s LYS 49 N -1.87 4.48 -0.02 1.78 1.02 -1.26 -0.72 119.74 123.16 2bwi s LYS 49 Ca -0.09 1.96 0.01 0.00 0.02 0.00 0.00 55.97 57.87 2bwi s LYS 49 Cb -0.02 -3.19 0.01 0.00 -0.52 0.00 0.00 37.83 34.12 2bwi s LYS 49 CO 0.02 -0.06 -0.05 -0.51 -0.92 0.00 0.00 175.35 173.83 2bwi s LEU 50 N -0.81 1.66 -0.22 3.17 1.43 -0.22 -4.90 118.68 118.80 2bwi s LEU 50 Ca 0.51 -0.11 -0.20 0.00 -1.03 0.00 0.00 54.13 53.29 2bwi s LEU 50 Cb -0.35 -0.36 -0.02 0.00 0.03 0.00 0.00 46.19 45.49 2bwi s LEU 50 CO 0.41 0.01 0.61 -0.69 0.23 0.00 0.00 176.35 176.92 2bwi s VAL 51 N 0.38 5.02 -0.77 -1.59 1.01 -1.26 -0.98 120.40 122.22 2bwi s VAL 51 Ca -0.05 1.13 0.13 0.00 0.00 0.00 0.00 61.98 63.20 2bwi s VAL 51 Cb -0.08 -3.93 -0.11 0.00 0.00 0.00 0.00 36.38 32.26 2bwi s VAL 51 CO -0.00 0.10 0.60 2.30 0.00 0.00 0.00 175.10 178.10 2bwi n ILE 52 N 4.83 0.00 -4.12 2.22 -5.35 -0.36 -4.84 119.36 111.73 2bwi n ILE 52 Ca -0.02 -0.23 -0.12 0.00 -0.27 0.00 0.00 62.75 62.11 2bwi n ILE 52 Cb 0.50 1.04 -0.07 0.00 -1.74 0.00 0.00 39.64 39.36 2bwi n ILE 52 CO 0.00 0.00 0.00 1.51 -1.76 0.00 0.00 176.55 176.30 2bwi s ASP 53 N -2.10 0.31 0.48 7.28 1.47 -1.26 -1.10 116.67 121.74 2bwi s ASP 53 Ca 0.06 -1.28 0.24 0.00 1.18 0.00 0.00 52.55 52.75 2bwi s ASP 53 Cb 0.10 0.50 1.21 0.00 -0.34 0.00 0.00 42.92 44.39 2bwi s ASP 53 CO 0.49 -1.02 1.98 0.03 0.68 0.00 0.00 175.17 177.32 2bwi h ARG 54 N 2.39 0.00 0.00 2.11 2.47 -1.96 -2.77 114.38 116.62 2bwi h ARG 54 Ca -0.31 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.41 2bwi h ARG 54 Cb 1.25 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.57 2bwi h ARG 54 CO 0.44 0.19 0.00 0.93 0.56 0.00 0.00 179.97 182.08 2bwi h GLU 55 N 0.00 0.00 0.00 0.04 3.07 -2.02 -3.47 114.58 112.20 2bwi h GLU 55 Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 2bwi h GLU 55 Cb 0.48 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.39 2bwi h GLU 55 CO 0.02 0.00 0.00 0.41 -1.40 0.00 0.00 179.01 178.04 2bwi n GLY 56 N 0.09 0.89 3.68 -3.84 0.00 -1.04 -5.05 105.19 99.91 2bwi n GLY 56 Ca 0.02 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.58 2bwi n GLY 56 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2bwi n THR 57 N -2.15 0.30 -4.90 2.61 -1.04 -1.26 -4.85 114.28 102.99 2bwi n THR 57 Ca 0.00 -0.05 -0.33 0.00 -2.04 0.00 0.00 64.05 61.63 2bwi n THR 57 Cb 0.00 -1.81 -0.15 0.00 -1.82 0.00 0.00 70.33 66.55 2bwi n THR 57 CO 0.00 0.00 0.00 -0.70 -0.64 0.00 0.00 175.07 173.73 2bwi s GLU 58 N 2.48 3.23 0.35 -2.82 2.12 -1.26 -1.23 118.70 121.58 2bwi s GLU 58 Ca 0.84 -0.77 0.09 0.00 0.36 0.00 0.00 54.97 55.50 2bwi s GLU 58 Cb -0.63 -2.51 -0.07 0.00 0.26 0.00 0.00 34.13 31.18 2bwi s GLU 58 CO 0.42 0.17 -0.08 0.96 -0.54 0.00 0.00 175.26 176.19 2bwi s ILE 59 N 0.42 2.18 -0.62 -3.70 -4.36 -0.15 -4.93 121.20 110.04 2bwi s ILE 59 Ca -0.13 -2.17 -0.19 0.00 -0.26 0.00 0.00 60.65 57.90 2bwi s ILE 59 Cb -0.17 -2.69 0.11 0.00 1.25 0.00 0.00 42.46 40.97 2bwi s ILE 59 CO 0.06 -0.18 0.73 -1.00 0.24 0.00 0.00 174.94 174.79 2bwi s HIS 60 N -2.65 3.03 0.39 1.37 3.76 -1.26 -1.05 115.29 118.88 2bwi s HIS 60 Ca 0.33 -1.02 -0.14 0.00 -0.15 0.00 0.00 55.06 54.08 2bwi s HIS 60 Cb 0.04 -4.03 -0.08 0.00 1.11 0.00 0.00 32.58 29.62 2bwi s HIS 60 CO 0.16 -1.30 0.81 0.00 -0.85 0.00 0.00 174.74 173.57 2bwi s ALA 61 N 2.61 3.26 -0.23 -1.40 0.00 0.11 -4.92 121.76 121.19 2bwi s ALA 61 Ca 0.13 0.02 0.02 0.00 0.00 0.00 0.00 51.96 52.13 2bwi s ALA 61 Cb -0.23 -2.85 0.05 0.00 0.00 0.00 0.00 23.12 20.09 2bwi s ALA 61 CO 0.05 0.10 -0.14 -1.64 0.00 0.00 0.00 175.76 174.13 2bwi s MET 62 N -3.48 2.44 0.12 0.00 -1.94 -0.54 -1.62 119.30 114.28 2bwi s MET 62 Ca 0.55 -1.11 0.08 0.00 -1.71 0.00 0.00 55.69 53.50 2bwi s MET 62 Cb -0.10 -2.72 -0.04 0.00 2.01 0.00 0.00 34.83 33.98 2bwi s MET 62 CO 0.24 -0.44 -0.21 0.95 -0.01 0.00 0.00 175.02 175.55 2bwi s THR 63 N 1.20 1.77 -0.33 2.05 -4.23 -0.65 -2.02 115.64 113.44 2bwi s THR 63 Ca -0.04 -1.63 -0.19 0.00 -1.18 0.00 0.00 61.69 58.66 2bwi s THR 63 Cb -0.17 -1.64 -0.01 0.00 1.34 0.00 0.00 72.50 72.02 2bwi s THR 63 CO -0.08 -0.10 0.57 -0.36 -0.54 0.00 0.00 174.62 174.12 2bwi s PHE 64 N -1.32 3.19 -1.03 3.99 0.08 -1.26 -1.13 117.98 120.50 2bwi s PHE 64 Ca 0.09 0.39 0.00 0.00 0.12 0.00 0.00 56.93 57.53 2bwi s PHE 64 Cb -0.09 -2.96 0.00 0.00 -0.57 0.00 0.00 43.02 39.39 2bwi s PHE 64 CO 0.05 -0.51 0.00 0.09 -0.10 0.00 0.00 175.22 174.75 2bwi n ASN 65 N 5.82 -4.28 0.00 1.36 4.13 -0.00 -3.38 115.26 118.91 2bwi n ASN 65 Ca -0.03 0.24 0.00 0.00 1.68 0.00 0.00 54.58 56.47 2bwi n ASN 65 Cb 0.49 -2.64 0.00 0.00 -1.54 0.00 0.00 39.78 36.09 2bwi n ASN 65 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2bwi n GLY 66 N -1.64 0.81 3.37 7.41 0.00 -1.26 -4.99 105.19 108.89 2bwi n GLY 66 Ca -0.10 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.68 2bwi n GLY 66 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2bwi s SER 67 N -2.97 3.02 -0.20 1.61 1.04 -1.22 -5.03 113.70 109.96 2bwi s SER 67 Ca 0.00 -0.85 0.01 0.00 0.48 0.00 0.00 55.95 55.59 2bwi s SER 67 Cb 0.00 -0.20 0.02 0.00 0.10 0.00 0.00 66.02 65.94 2bwi s SER 67 CO 0.00 0.04 -0.17 -0.69 0.98 0.00 0.00 173.24 173.40 2bwi s VAL 68 N -1.81 2.22 1.03 5.02 1.01 -1.26 -3.15 120.40 123.46 2bwi s VAL 68 Ca 0.17 -0.99 -0.13 0.00 0.00 0.00 0.00 61.98 61.03 2bwi s VAL 68 Cb -0.07 -1.99 0.21 0.00 0.00 0.00 0.00 36.38 34.52 2bwi s VAL 68 CO 0.08 0.44 1.08 -2.16 0.00 0.00 0.00 175.10 174.54 2bwi s PRO 69 N 1.28 0.14 1.17 2.72 0.04 -1.26 -2.19 135.00 136.90 2bwi s PRO 69 Ca 0.03 0.55 -0.13 0.00 0.04 0.00 0.00 61.00 61.50 2bwi s PRO 69 Cb -0.14 -1.70 0.29 0.00 0.04 0.00 0.00 34.50 32.99 2bwi s PRO 69 CO -0.11 -2.94 1.03 0.20 0.04 0.00 0.00 177.00 175.22 2bwi s GLY 70 N -3.30 1.55 0.67 0.56 0.00 0.05 -4.73 107.32 102.12 2bwi s GLY 70 Ca 0.66 -0.06 -0.16 0.00 0.00 0.00 0.00 44.72 45.16 2bwi s GLY 70 CO 0.59 0.66 1.19 2.56 0.00 0.00 0.00 173.10 178.09 2bwi s PRO 71 N -4.42 2.58 -0.12 2.90 0.04 -1.26 -4.47 135.00 130.25 2bwi s PRO 71 Ca 0.69 1.70 -0.29 0.00 0.04 0.00 0.00 61.00 63.13 2bwi s PRO 71 Cb -0.26 -1.89 -0.01 0.00 0.04 0.00 0.00 34.50 32.38 2bwi s PRO 71 CO 0.65 -1.48 1.04 -1.17 0.04 0.00 0.00 177.00 176.08 2bwi s LEU 72 N -4.71 4.22 -0.02 -3.56 2.96 -1.26 -4.01 118.68 112.31 2bwi s LEU 72 Ca 0.74 1.54 -0.12 0.00 -0.22 0.00 0.00 54.13 56.07 2bwi s LEU 72 Cb -0.28 -3.55 -0.05 0.00 0.50 0.00 0.00 46.19 42.81 2bwi s LEU 72 CO 0.40 -0.51 0.34 -0.04 -1.32 0.00 0.00 176.35 175.22 2bwi s MET 73 N 2.28 3.79 -0.09 1.98 -1.94 -0.96 -4.53 119.30 119.83 2bwi s MET 73 Ca 0.49 0.26 0.02 0.00 -1.71 0.00 0.00 55.69 54.74 2bwi s MET 73 Cb -0.19 -3.19 0.02 0.00 2.01 0.00 0.00 34.83 33.48 2bwi s MET 73 CO 0.16 0.70 -0.12 0.08 -0.01 0.00 0.00 175.02 175.84 2bwi s VAL 74 N -1.10 1.19 0.27 -6.03 1.01 -1.26 -0.18 120.40 114.30 2bwi s VAL 74 Ca 0.23 -0.47 0.05 0.00 0.00 0.00 0.00 61.98 61.78 2bwi s VAL 74 Cb -0.15 -1.12 -0.02 0.00 0.00 0.00 0.00 36.38 35.09 2bwi s VAL 74 CO 0.12 0.38 0.18 1.33 0.00 0.00 0.00 175.10 177.11 2bwi n VAL 75 N 4.16 0.00 -4.30 2.92 0.24 -0.25 -5.00 118.33 116.11 2bwi n VAL 75 Ca -0.20 -1.84 -0.23 0.00 -2.04 0.00 0.00 64.34 60.03 2bwi n VAL 75 Cb 0.51 0.84 -0.07 0.00 -1.47 0.00 0.00 33.84 33.65 2bwi n VAL 75 CO 0.00 0.00 0.00 -1.00 -2.14 0.00 0.00 176.83 173.69 2bwi s HIS 76 N -2.93 2.69 0.19 6.34 3.76 -1.26 -1.07 115.29 123.00 2bwi s HIS 76 Ca 0.26 -0.22 -0.33 0.00 -0.15 0.00 0.00 55.06 54.62 2bwi s HIS 76 Cb 0.01 -1.20 -0.13 0.00 1.11 0.00 0.00 32.58 32.37 2bwi s HIS 76 CO 0.18 0.62 1.57 -1.91 -0.85 0.00 0.00 174.74 174.35 2bwi n GLU 77 N -0.82 2.24 -1.00 1.40 2.13 0.11 -1.34 120.64 123.36 2bwi n GLU 77 Ca -0.07 0.81 -0.00 0.00 0.66 0.00 0.00 57.16 58.56 2bwi n GLU 77 Cb 0.59 -2.57 -0.00 0.00 0.27 0.00 0.00 31.44 29.73 2bwi n GLU 77 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 2bwi n ASN 78 N 3.21 -4.53 -4.64 4.31 5.03 0.38 -4.76 115.26 114.26 2bwi n ASN 78 Ca 0.15 0.00 -0.29 0.00 0.87 0.00 0.00 54.58 55.31 2bwi n ASN 78 Cb 0.30 -2.04 0.18 0.00 -1.02 0.00 0.00 39.78 37.21 2bwi n ASN 78 CO 0.00 0.00 0.00 -1.81 -1.83 0.00 0.00 177.26 173.62 2bwi s ASP 79 N -2.01 2.55 -0.14 6.41 1.01 -0.45 -4.61 116.67 119.43 2bwi s ASP 79 Ca 0.00 1.58 -0.04 0.00 0.71 0.00 0.00 52.55 54.81 2bwi s ASP 79 Cb 0.00 -2.24 -0.03 0.00 1.01 0.00 0.00 42.92 41.66 2bwi s ASP 79 CO 0.00 -3.23 -0.02 -0.31 0.21 0.00 0.00 175.17 171.82 2bwi s TYR 80 N -2.75 3.07 -0.22 4.23 1.51 -0.25 -0.80 117.35 122.14 2bwi s TYR 80 Ca 0.66 -0.15 -0.17 0.00 -1.01 0.00 0.00 57.07 56.39 2bwi s TYR 80 Cb -0.21 -1.94 -0.03 0.00 -0.11 0.00 0.00 41.96 39.67 2bwi s TYR 80 CO 0.59 0.09 0.46 0.08 -1.11 0.00 0.00 175.55 175.66 2bwi s VAL 81 N 0.12 5.14 -0.27 0.71 1.01 0.12 -0.61 120.40 126.62 2bwi s VAL 81 Ca 0.00 0.81 0.02 0.00 0.00 0.00 0.00 61.98 62.82 2bwi s VAL 81 Cb -0.13 -3.78 0.07 0.00 0.00 0.00 0.00 36.38 32.53 2bwi s VAL 81 CO 0.02 0.18 -0.07 -0.70 0.00 0.00 0.00 175.10 174.54 2bwi s GLU 82 N 1.70 1.92 -0.19 2.72 2.12 -0.25 -1.32 118.70 125.40 2bwi s GLU 82 Ca 0.21 -1.32 -0.05 0.00 0.36 0.00 0.00 54.97 54.17 2bwi s GLU 82 Cb -0.15 -2.83 -0.02 0.00 0.26 0.00 0.00 34.13 31.38 2bwi s GLU 82 CO 0.09 -0.64 -0.01 -1.17 -0.54 0.00 0.00 175.26 172.98 2bwi s LEU 83 N 1.17 3.21 -0.40 2.70 2.96 0.06 -1.08 118.68 127.30 2bwi s LEU 83 Ca -0.05 -0.21 -0.20 0.00 -0.22 0.00 0.00 54.13 53.46 2bwi s LEU 83 Cb -0.19 -1.80 0.01 0.00 0.50 0.00 0.00 46.19 44.70 2bwi s LEU 83 CO -0.06 0.08 0.58 -0.60 -1.32 0.00 0.00 176.35 175.03 2bwi s ARG 84 N 0.90 3.42 -0.22 1.98 3.52 -0.25 -1.34 118.95 126.96 2bwi s ARG 84 Ca 0.01 -0.29 -0.07 0.00 -0.13 0.00 0.00 55.73 55.25 2bwi s ARG 84 Cb -0.14 -3.89 -0.03 0.00 -1.56 0.00 0.00 34.95 29.33 2bwi s ARG 84 CO 0.02 -0.84 0.05 -1.17 -0.81 0.00 0.00 175.30 172.54 2bwi s LEU 85 N 2.60 3.45 -0.13 -0.88 2.96 0.07 -1.33 118.68 125.43 2bwi s LEU 85 Ca 0.21 -0.16 0.01 0.00 -0.22 0.00 0.00 54.13 53.96 2bwi s LEU 85 Cb -0.15 -1.90 -0.01 0.00 0.50 0.00 0.00 46.19 44.63 2bwi s LEU 85 CO 0.16 0.03 -0.15 -0.63 -1.32 0.00 0.00 176.35 174.44 2bwi s ILE 86 N 1.24 2.82 -0.61 6.68 1.01 -0.56 -1.53 121.20 130.25 2bwi s ILE 86 Ca 0.04 -0.74 0.00 0.00 0.00 0.00 0.00 60.65 59.96 2bwi s ILE 86 Cb -0.15 -2.17 0.15 0.00 0.01 0.00 0.00 42.46 40.31 2bwi s ILE 86 CO 0.03 0.53 0.39 0.21 0.00 0.00 0.00 174.94 176.10 2bwi s ASN 87 N 0.45 4.88 0.83 3.58 2.47 -0.25 -0.93 114.94 125.98 2bwi s ASN 87 Ca -0.11 -3.04 -0.13 0.00 0.42 0.00 0.00 52.86 50.00 2bwi s ASN 87 Cb -0.16 -1.76 0.09 0.00 -1.45 0.00 0.00 41.25 37.97 2bwi s ASN 87 CO 0.05 -0.28 1.11 -2.65 -3.72 0.00 0.00 177.10 171.61 2bwi n PRO 88 N 3.16 0.04 0.00 0.43 -0.02 -1.26 -0.16 135.00 137.18 2bwi n PRO 88 Ca 0.08 0.09 0.10 0.00 -2.02 0.00 0.00 63.50 61.75 2bwi n PRO 88 Cb 0.35 -2.36 0.55 0.00 -0.02 0.00 0.00 33.50 32.02 2bwi n PRO 88 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 2bwi n ASP 89 N -3.21 0.00 0.05 2.55 5.68 -1.26 -1.71 116.55 118.65 2bwi n ASP 89 Ca 0.13 -0.28 0.14 0.00 -0.50 0.00 0.00 54.79 54.28 2bwi n ASP 89 Cb 0.51 -0.16 0.52 0.00 -1.14 0.00 0.00 41.12 40.84 2bwi n ASP 89 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 2bwi n THR 90 N -1.16 0.26 -1.98 2.12 -2.24 -1.26 -4.82 114.28 105.20 2bwi n THR 90 Ca 0.12 -0.13 -0.30 0.00 -2.27 0.00 0.00 64.05 61.47 2bwi n THR 90 Cb 0.12 -0.52 0.02 0.00 -2.10 0.00 0.00 70.33 67.85 2bwi n THR 90 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 2bwi s ASN 91 N -3.68 5.92 -0.12 3.42 0.01 -0.69 -4.98 114.94 114.81 2bwi s ASN 91 Ca 0.12 1.23 0.13 0.00 -0.71 0.00 0.00 52.86 53.63 2bwi s ASN 91 Cb 0.16 -2.21 -0.18 0.00 0.41 0.00 0.00 41.25 39.43 2bwi s ASN 91 CO 0.56 -1.02 0.08 1.07 -1.51 0.00 0.00 177.10 176.29 2bwi n THR 92 N -2.78 0.83 -4.08 1.60 5.66 -1.26 -4.79 114.28 109.45 2bwi n THR 92 Ca 0.06 -0.56 -0.22 0.00 -3.05 0.00 0.00 64.05 60.28 2bwi n THR 92 Cb 0.55 -0.53 -0.05 0.00 -1.55 0.00 0.00 70.33 68.76 2bwi n THR 92 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 175.07 171.26 2bwi s LEU 93 N -4.90 3.50 0.25 1.09 1.43 -1.26 -4.85 118.68 113.95 2bwi s LEU 93 Ca -0.07 -0.52 -0.29 0.00 -1.03 0.00 0.00 54.13 52.22 2bwi s LEU 93 Cb 0.05 -2.03 -0.09 0.00 0.03 0.00 0.00 46.19 44.15 2bwi s LEU 93 CO 0.58 -0.16 0.96 -0.22 0.23 0.00 0.00 176.35 177.73 2bwi s LEU 94 N -3.84 4.60 0.16 1.79 2.96 -1.26 -4.06 118.68 119.04 2bwi s LEU 94 Ca 0.36 1.97 -0.01 0.00 -0.22 0.00 0.00 54.13 56.23 2bwi s LEU 94 Cb -0.06 -3.66 -0.04 0.00 0.50 0.00 0.00 46.19 42.93 2bwi s LEU 94 CO 0.24 0.10 0.09 -1.00 -1.32 0.00 0.00 176.35 174.46 2bwi s HIS 95 N -1.23 1.00 0.00 5.38 3.76 -0.93 -4.92 115.29 118.36 2bwi s HIS 95 Ca 0.42 -1.30 0.00 0.00 -0.15 0.00 0.00 55.06 54.04 2bwi s HIS 95 Cb -0.26 -0.52 0.00 0.00 1.11 0.00 0.00 32.58 32.91 2bwi s HIS 95 CO 0.32 -0.57 0.00 0.27 -0.85 0.00 0.00 174.74 173.91 2bwi n ASN 96 N -0.18 0.00 -3.74 1.40 6.94 -1.26 -0.98 115.26 117.45 2bwi n ASN 96 Ca -0.02 -0.69 -0.12 0.00 -0.02 0.00 0.00 54.58 53.73 2bwi n ASN 96 Cb 0.65 0.00 -0.12 0.00 -2.36 0.00 0.00 39.78 37.95 2bwi n ASN 96 CO 0.00 0.00 0.00 -0.51 -1.03 0.00 0.00 177.26 175.72 2bwi s ILE 97 N -2.85 -0.02 -0.21 1.53 2.07 -1.26 -4.16 121.20 116.30 2bwi s ILE 97 Ca 0.00 0.07 -0.02 0.00 -1.41 0.00 0.00 60.65 59.29 2bwi s ILE 97 Cb 0.00 -0.46 0.00 0.00 0.13 0.00 0.00 42.46 42.13 2bwi s ILE 97 CO 0.00 0.03 -0.09 -1.81 -1.91 0.00 0.00 174.94 171.16 2bwi s ASP 98 N 0.84 3.97 -0.27 4.50 1.11 0.12 -1.46 116.67 125.50 2bwi s ASP 98 Ca -0.06 -0.47 -0.13 0.00 0.18 0.00 0.00 52.55 52.07 2bwi s ASP 98 Cb -0.06 -1.67 -0.04 0.00 1.07 0.00 0.00 42.92 42.22 2bwi s ASP 98 CO -0.06 -0.02 0.27 -0.36 1.18 0.00 0.00 175.17 176.19 2bwi s PHE 99 N 1.42 3.25 -0.44 4.23 0.08 0.16 -1.01 117.98 125.68 2bwi s PHE 99 Ca 0.05 0.28 0.23 0.00 0.12 0.00 0.00 56.93 57.62 2bwi s PHE 99 Cb -0.14 -2.45 1.01 0.00 -0.57 0.00 0.00 43.02 40.86 2bwi s PHE 99 CO -0.06 -0.15 1.71 0.72 -0.10 0.00 0.00 175.22 177.33 2bwi n HIS 100 N 5.05 0.81 0.34 0.36 8.25 -0.32 -1.89 115.22 127.81 2bwi n HIS 100 Ca -0.11 0.33 0.14 0.00 -0.26 0.00 0.00 57.72 57.82 2bwi n HIS 100 Cb 0.51 -1.03 0.51 0.00 1.12 0.00 0.00 29.99 31.10 2bwi n HIS 100 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2bwi h ALA 101 N 2.23 1.00 -2.07 -1.41 0.00 -1.91 -3.47 119.26 113.63 2bwi h ALA 101 Ca 0.00 0.00 -0.46 0.00 0.00 0.00 0.00 54.91 54.45 2bwi h ALA 101 Cb 0.32 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 2bwi h ALA 101 CO 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 179.25 178.84 2bwi s ALA 102 N -3.43 4.01 -0.17 0.00 0.00 -0.79 -4.47 121.76 116.91 2bwi s ALA 102 Ca 0.04 -1.31 0.01 0.00 0.00 0.00 0.00 51.96 50.70 2bwi s ALA 102 Cb 0.09 -1.69 0.02 0.00 0.00 0.00 0.00 23.12 21.54 2bwi s ALA 102 CO 0.54 0.16 -0.19 0.99 0.00 0.00 0.00 175.76 177.25 2bwi s THR 103 N -2.05 1.96 0.00 0.00 2.01 -1.26 -4.71 115.64 111.60 2bwi s THR 103 Ca 0.37 -0.88 0.00 0.00 0.31 0.00 0.00 61.69 61.49 2bwi s THR 103 Cb -0.09 -1.78 0.00 0.00 0.01 0.00 0.00 72.50 70.64 2bwi s THR 103 CO 0.29 0.52 0.00 0.61 -0.69 0.00 0.00 174.62 175.36 2bwi n GLY 104 N 4.59 2.66 4.02 4.40 0.00 -1.26 -4.95 105.19 114.66 2bwi n GLY 104 Ca -0.20 -1.91 -0.29 0.00 0.00 0.00 0.00 46.02 43.62 2bwi n GLY 104 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bwi n ALA 105 N 0.76 -1.72 -1.18 4.61 0.00 -1.26 -0.76 120.51 120.97 2bwi n ALA 105 Ca 0.00 -0.14 -0.06 0.00 0.00 0.00 0.00 53.44 53.23 2bwi n ALA 105 Cb 0.00 -2.38 -0.03 0.00 0.00 0.00 0.00 19.45 17.04 2bwi n ALA 105 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2bwi n LEU 106 N -4.42 -0.09 0.00 0.00 4.77 -1.26 -1.16 117.00 114.84 2bwi n LEU 106 Ca -0.16 0.15 0.00 0.00 -0.03 0.00 0.00 56.01 55.97 2bwi n LEU 106 Cb 0.61 -1.94 0.00 0.00 -2.33 0.00 0.00 43.42 39.77 2bwi n LEU 106 CO 0.78 -0.69 0.00 0.61 -1.33 0.00 0.00 177.39 176.76 2bwi n GLY 107 N -0.76 0.80 0.00 -0.72 0.00 0.06 -4.19 105.19 100.38 2bwi n GLY 107 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.96 2bwi n GLY 107 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bwi n GLY 108 N -2.17 2.17 0.24 -0.02 0.00 -0.31 -0.66 105.19 104.45 2bwi n GLY 108 Ca 0.00 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.07 2bwi n GLY 108 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2bwi h GLY 109 N 0.00 0.12 2.00 -0.02 0.00 -0.80 -1.74 103.07 102.63 2bwi h GLY 109 Ca 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 47.33 47.27 2bwi h GLY 109 CO 0.00 0.06 0.00 0.00 0.00 0.00 0.00 176.54 176.60 2bwi h ALA 110 N 1.80 1.00 -0.01 3.60 0.00 -1.75 -3.17 119.26 120.73 2bwi h ALA 110 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.93 2bwi h ALA 110 Cb 0.23 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.02 2bwi h ALA 110 CO 0.01 0.00 -0.21 1.28 0.00 0.00 0.00 179.25 180.33 2bwi n LEU 111 N -2.45 1.36 -0.31 0.00 4.77 -0.68 -4.72 117.00 114.97 2bwi n LEU 111 Ca 0.02 -0.79 0.07 0.00 -0.03 0.00 0.00 56.01 55.28 2bwi n LEU 111 Cb 0.28 0.00 0.11 0.00 -2.33 0.00 0.00 43.42 41.47 2bwi n LEU 111 CO 0.23 0.27 0.44 0.35 -1.33 0.00 0.00 177.39 177.35 2bwi n THR 112 N -0.15 1.37 -2.14 -5.08 -2.24 -1.08 -4.97 114.28 100.00 2bwi n THR 112 Ca 0.05 -1.77 -0.43 0.00 -2.27 0.00 0.00 64.05 59.63 2bwi n THR 112 Cb 0.24 0.00 -0.03 0.00 -2.10 0.00 0.00 70.33 68.45 2bwi n THR 112 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 2bwi s GLN 113 N -2.08 4.07 -0.12 -0.78 -0.21 -1.26 -4.26 119.66 115.02 2bwi s GLN 113 Ca 0.25 1.90 0.01 0.00 0.02 0.00 0.00 55.36 57.53 2bwi s GLN 113 Cb 0.23 -3.95 0.02 0.00 1.00 0.00 0.00 33.01 30.31 2bwi s GLN 113 CO 0.00 -0.95 -0.13 0.14 -2.12 0.00 0.00 175.29 172.23 2bwi s VAL 114 N 4.27 1.37 0.77 1.09 -7.23 -0.15 -5.00 120.40 115.52 2bwi s VAL 114 Ca 0.68 -0.53 -0.11 0.00 -1.81 0.00 0.00 61.98 60.21 2bwi s VAL 114 Cb -0.28 -1.30 0.05 0.00 0.56 0.00 0.00 36.38 35.41 2bwi s VAL 114 CO 0.26 0.42 1.09 0.20 -0.31 0.00 0.00 175.10 176.76 2bwi s ASN 115 N 1.36 4.72 0.21 4.85 0.01 -1.26 -2.20 114.94 122.63 2bwi s ASN 115 Ca 0.01 1.37 -0.32 0.00 -0.71 0.00 0.00 52.86 53.20 2bwi s ASN 115 Cb -0.13 -2.13 -0.13 0.00 0.41 0.00 0.00 41.25 39.26 2bwi s ASN 115 CO -0.07 -1.84 1.48 -2.65 -1.51 0.00 0.00 177.10 172.52 2bwi n PRO 116 N -3.35 2.11 -0.46 -0.60 -0.02 -1.26 -1.41 135.00 130.01 2bwi n PRO 116 Ca 0.07 0.75 0.00 0.00 -2.02 0.00 0.00 63.50 62.30 2bwi n PRO 116 Cb 0.56 -2.46 0.00 0.00 -0.02 0.00 0.00 33.50 31.58 2bwi n PRO 116 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2bwi n GLY 117 N 2.60 0.75 3.54 -1.23 0.00 0.77 -4.74 105.19 106.88 2bwi n GLY 117 Ca 0.13 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.91 2bwi n GLY 117 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2bwi s GLU 118 N -0.54 1.89 0.17 1.61 2.02 -0.50 -4.90 118.70 118.46 2bwi s GLU 118 Ca 0.00 -1.70 -0.01 0.00 0.02 0.00 0.00 54.97 53.28 2bwi s GLU 118 Cb 0.00 -1.88 -0.04 0.00 0.10 0.00 0.00 34.13 32.31 2bwi s GLU 118 CO 0.00 0.30 0.10 -1.83 0.02 0.00 0.00 175.26 173.85 2bwi s GLU 119 N -3.58 1.10 0.11 1.61 -1.05 -1.26 -1.09 118.70 114.53 2bwi s GLU 119 Ca 0.31 -1.56 -0.18 0.00 -0.15 0.00 0.00 54.97 53.39 2bwi s GLU 119 Cb -0.04 0.25 0.04 0.00 -0.44 0.00 0.00 34.13 33.94 2bwi s GLU 119 CO 0.17 -0.34 0.45 -0.08 0.95 0.00 0.00 175.26 176.41 2bwi s THR 120 N -4.11 0.05 -0.13 1.83 -1.32 -0.58 -5.01 115.64 106.36 2bwi s THR 120 Ca 0.33 -0.43 -0.00 0.00 -1.21 0.00 0.00 61.69 60.38 2bwi s THR 120 Cb 0.07 -1.09 0.03 0.00 -1.51 0.00 0.00 72.50 69.99 2bwi s THR 120 CO 0.08 -0.24 -0.10 -0.89 -2.21 0.00 0.00 174.62 171.26 2bwi s THR 121 N -3.49 1.27 -0.04 5.08 2.01 -1.26 -0.75 115.64 118.46 2bwi s THR 121 Ca 0.01 -0.47 0.00 0.00 0.31 0.00 0.00 61.69 61.54 2bwi s THR 121 Cb 0.01 -1.25 -0.03 0.00 0.01 0.00 0.00 72.50 71.23 2bwi s THR 121 CO -0.10 0.38 -0.01 -0.22 -0.69 0.00 0.00 174.62 173.99 2bwi s LEU 122 N 1.61 3.50 -0.04 4.42 2.96 -0.45 -4.96 118.68 125.71 2bwi s LEU 122 Ca 0.05 0.05 0.06 0.00 -0.22 0.00 0.00 54.13 54.06 2bwi s LEU 122 Cb -0.13 -1.90 -0.01 0.00 0.50 0.00 0.00 46.19 44.66 2bwi s LEU 122 CO -0.09 0.33 -0.22 -0.60 -1.32 0.00 0.00 176.35 174.45 2bwi s ARG 123 N -1.19 2.10 0.02 1.98 3.52 -1.26 -0.76 118.95 123.36 2bwi s ARG 123 Ca 0.16 -0.78 -0.05 0.00 -0.13 0.00 0.00 55.73 54.93 2bwi s ARG 123 Cb -0.11 -1.85 -0.01 0.00 -1.56 0.00 0.00 34.95 31.42 2bwi s ARG 123 CO 0.06 0.36 0.09 -0.59 -0.81 0.00 0.00 175.30 174.41 2bwi s PHE 124 N -0.20 0.16 -0.14 5.12 -0.12 -0.44 -4.99 117.98 117.38 2bwi s PHE 124 Ca -0.00 -0.39 -0.22 0.00 -0.05 0.00 0.00 56.93 56.26 2bwi s PHE 124 Cb -0.12 -0.12 -0.03 0.00 -0.63 0.00 0.00 43.02 42.12 2bwi s PHE 124 CO 0.02 -0.31 0.68 0.21 -0.05 0.00 0.00 175.22 175.78 2bwi s LYS 125 N -1.99 4.32 -1.26 1.99 2.20 -1.26 -0.70 119.74 123.04 2bwi s LYS 125 Ca -0.10 0.78 -0.14 0.00 -0.36 0.00 0.00 55.97 56.14 2bwi s LYS 125 Cb -0.05 -3.52 0.14 0.00 -1.51 0.00 0.00 37.83 32.89 2bwi s LYS 125 CO -0.02 -0.12 1.62 0.00 -0.36 0.00 0.00 175.35 176.47 2bwi n ALA 126 N 4.52 4.11 0.55 3.13 0.00 0.02 -4.71 120.51 128.13 2bwi n ALA 126 Ca -0.01 -4.14 0.13 0.00 0.00 0.00 0.00 53.44 49.42 2bwi n ALA 126 Cb 0.50 -3.20 0.44 0.00 0.00 0.00 0.00 19.45 17.19 2bwi n ALA 126 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2bwi n THR 127 N 4.86 0.67 -4.78 0.00 -2.24 -1.26 -0.47 114.28 111.05 2bwi n THR 127 Ca 0.41 -0.12 -0.28 0.00 -2.27 0.00 0.00 64.05 61.79 2bwi n THR 127 Cb 0.42 -0.77 -0.17 0.00 -2.10 0.00 0.00 70.33 67.71 2bwi n THR 127 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2bwi s LYS 128 N -3.17 2.34 0.29 -0.78 1.02 -1.26 -4.75 119.74 113.43 2bwi s LYS 128 Ca 0.09 -0.62 -0.28 0.00 0.02 0.00 0.00 55.97 55.17 2bwi s LYS 128 Cb 0.11 -1.86 -0.09 0.00 -0.52 0.00 0.00 37.83 35.47 2bwi s LYS 128 CO 0.53 0.06 0.97 -1.25 -0.92 0.00 0.00 175.35 174.74 2bwi s PRO 129 N 0.63 4.66 0.00 -1.68 0.04 -1.26 -4.82 135.00 132.57 2bwi s PRO 129 Ca -0.14 1.46 0.00 0.00 0.04 0.00 0.00 61.00 62.36 2bwi s PRO 129 Cb -0.16 -3.00 0.00 0.00 0.04 0.00 0.00 34.50 31.38 2bwi s PRO 129 CO 0.04 0.32 0.00 0.41 0.04 0.00 0.00 177.00 177.82 2bwi n GLY 130 N 0.95 0.20 3.87 0.56 0.00 0.04 -2.75 105.19 108.07 2bwi n GLY 130 Ca 0.00 -1.43 -0.37 0.00 0.00 0.00 0.00 46.02 44.22 2bwi n GLY 130 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2bwi s VAL 131 N -1.81 5.35 0.02 1.61 -7.23 0.00 -0.19 120.40 118.16 2bwi s VAL 131 Ca 0.00 0.39 0.00 0.00 -1.81 0.00 0.00 61.98 60.57 2bwi s VAL 131 Cb 0.00 -3.51 -0.02 0.00 0.56 0.00 0.00 36.38 33.41 2bwi s VAL 131 CO 0.00 0.58 -0.03 -0.36 -0.31 0.00 0.00 175.10 174.98 2bwi s PHE 132 N -1.07 0.30 0.43 2.82 0.40 0.07 -4.41 117.98 116.52 2bwi s PHE 132 Ca 0.19 -0.44 -0.23 0.00 -0.60 0.00 0.00 56.93 55.85 2bwi s PHE 132 Cb -0.14 -0.20 -0.08 0.00 0.51 0.00 0.00 43.02 43.11 2bwi s PHE 132 CO 0.08 -0.14 1.09 0.08 0.70 0.00 0.00 175.22 177.03 2bwi s VAL 133 N -1.19 3.49 0.11 -0.44 1.01 -1.26 -0.76 120.40 121.36 2bwi s VAL 133 Ca -0.12 1.10 0.09 0.00 0.00 0.00 0.00 61.98 63.05 2bwi s VAL 133 Cb -0.08 -3.55 -0.04 0.00 0.00 0.00 0.00 36.38 32.71 2bwi s VAL 133 CO -0.01 -0.03 -0.22 -0.72 0.00 0.00 0.00 175.10 174.13 2bwi s TYR 134 N -1.66 1.87 0.02 5.22 -0.85 -0.82 -1.17 117.35 119.97 2bwi s TYR 134 Ca 0.61 -0.41 -0.28 0.00 -0.52 0.00 0.00 57.07 56.47 2bwi s TYR 134 Cb -0.24 -1.02 0.08 0.00 0.38 0.00 0.00 41.96 41.16 2bwi s TYR 134 CO 0.29 0.24 0.69 -3.38 -1.52 0.00 0.00 175.55 171.87 2bwi s HIS 135 N -1.20 -0.58 0.57 -3.49 -3.43 -0.18 -0.97 115.29 106.02 2bwi s HIS 135 Ca 0.08 0.76 -0.19 0.00 -0.80 0.00 0.00 55.06 54.90 2bwi s HIS 135 Cb -0.10 0.47 -0.04 0.00 -1.43 0.00 0.00 32.58 31.48 2bwi s HIS 135 CO 0.05 -0.67 1.19 0.00 -2.00 0.00 0.00 174.74 173.31 2bwi n ALA 137 N -1.42 -1.28 -2.62 0.00 0.00 -1.26 -4.48 120.51 109.45 2bwi n ALA 137 Ca 0.13 -1.47 -0.42 0.00 0.00 0.00 0.00 53.44 51.68 2bwi n ALA 137 Cb 0.50 -1.32 -0.03 0.00 0.00 0.00 0.00 19.45 18.60 2bwi n ALA 137 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 2bwi s PRO 138 N 0.63 4.50 0.10 0.00 0.02 -1.26 -4.88 135.00 134.11 2bwi s PRO 138 Ca 0.32 1.52 -0.36 0.00 0.02 0.00 0.00 61.00 62.51 2bwi s PRO 138 Cb 0.23 -3.44 -0.15 0.00 0.02 0.00 0.00 34.50 31.15 2bwi s PRO 138 CO -0.24 -0.15 1.48 -1.91 -0.33 0.00 0.00 177.00 175.85 2bwi n GLU 139 N 4.06 1.61 0.00 5.54 2.13 -1.26 -1.14 120.64 131.59 2bwi n GLU 139 Ca 0.07 0.58 0.00 0.00 0.66 0.00 0.00 57.16 58.47 2bwi n GLU 139 Cb 0.49 -2.29 0.00 0.00 0.27 0.00 0.00 31.44 29.92 2bwi n GLU 139 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2bwi n GLY 140 N 3.04 2.00 0.43 8.31 0.00 -1.26 -4.82 105.19 112.89 2bwi n GLY 140 Ca 0.18 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.24 2bwi n GLY 140 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2bwi n MET 141 N -2.00 0.43 0.32 1.61 2.81 -0.29 -4.99 117.12 115.02 2bwi n MET 141 Ca 0.00 -1.60 -0.16 0.00 -1.81 0.00 0.00 57.70 54.12 2bwi n MET 141 Cb 0.00 -0.81 -0.08 0.00 -0.71 0.00 0.00 33.22 31.62 2bwi n MET 141 CO 0.00 0.00 0.00 0.28 1.51 0.00 0.00 175.97 177.76 2bwi h VAL 142 N 4.71 0.37 0.00 2.03 2.07 -1.84 -2.97 116.25 120.61 2bwi h VAL 142 Ca -0.01 -0.19 -0.05 0.00 0.82 0.00 0.00 66.70 67.27 2bwi h VAL 142 Cb 1.30 0.43 -0.01 0.00 -1.52 0.00 0.00 31.29 31.49 2bwi h VAL 142 CO 0.01 0.03 -0.23 1.55 0.02 0.00 0.00 177.57 178.95 2bwi h PRO 143 N -0.93 0.00 -0.42 1.57 0.13 -1.93 -2.29 132.00 128.13 2bwi h PRO 143 Ca -0.08 0.00 0.02 0.00 -0.87 0.00 0.00 66.00 65.06 2bwi h PRO 143 Cb 0.65 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.76 2bwi h PRO 143 CO 0.13 0.23 0.25 2.35 -0.23 0.00 0.00 178.00 180.73 2bwi h TRP 144 N 0.00 0.47 -0.16 1.56 7.01 -1.95 -0.63 115.95 122.26 2bwi h TRP 144 Ca -0.00 0.01 -0.04 0.00 2.11 0.00 0.00 58.89 60.97 2bwi h TRP 144 Cb 0.41 -0.15 -0.00 0.00 -2.10 0.00 0.00 29.16 27.31 2bwi h TRP 144 CO 0.00 0.28 -0.05 0.45 -2.79 0.00 0.00 178.44 176.33 2bwi h HIS 145 N 0.51 0.36 -0.16 2.65 3.86 -1.30 -1.95 115.15 119.13 2bwi h HIS 145 Ca 0.16 -0.08 0.00 0.00 -1.16 0.00 0.00 60.37 59.30 2bwi h HIS 145 Cb -0.00 -0.09 -0.01 0.00 1.06 0.00 0.00 27.41 28.37 2bwi h HIS 145 CO -0.07 0.60 0.10 0.28 0.86 0.00 0.00 177.93 179.71 2bwi h VAL 146 N 0.02 1.05 -0.01 2.45 2.07 -1.32 -2.36 116.25 118.16 2bwi h VAL 146 Ca 0.04 -0.10 0.00 0.00 0.82 0.00 0.00 66.70 67.47 2bwi h VAL 146 Cb 0.49 0.83 0.00 0.00 -1.52 0.00 0.00 31.29 31.08 2bwi h VAL 146 CO 0.02 0.05 0.00 0.35 0.02 0.00 0.00 177.57 178.00 2bwi n THR 147 N -4.97 0.01 0.52 2.57 -2.24 -0.25 -1.99 114.28 107.92 2bwi n THR 147 Ca -0.04 -0.03 0.09 0.00 -2.27 0.00 0.00 64.05 61.80 2bwi n THR 147 Cb 0.03 -0.34 0.24 0.00 -2.10 0.00 0.00 70.33 68.17 2bwi n THR 147 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 2bwi n SER 148 N -0.81 2.62 0.00 3.42 7.64 -0.73 -4.54 113.62 121.21 2bwi n SER 148 Ca 0.21 -1.96 0.00 0.00 1.01 0.00 0.00 58.87 58.13 2bwi n SER 148 Cb 0.13 -0.29 0.00 0.00 -1.01 0.00 0.00 64.21 63.03 2bwi n SER 148 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2bwi n GLY 149 N 1.30 0.90 2.87 0.23 0.00 -0.84 -1.46 105.19 108.18 2bwi n GLY 149 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 2bwi n GLY 149 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 2bwi n MET 150 N -1.83 3.95 -3.53 1.61 0.00 -0.85 -4.52 117.12 111.94 2bwi n MET 150 Ca 0.00 -3.82 -0.15 0.00 0.00 0.00 0.00 57.70 53.73 2bwi n MET 150 Cb 0.00 -2.79 -0.05 0.00 0.00 0.00 0.00 33.22 30.38 2bwi n MET 150 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 175.97 176.51 2bwi s ASN 151 N 0.05 -0.53 0.00 6.12 2.20 -1.26 -1.73 114.94 119.79 2bwi s ASN 151 Ca 0.38 0.32 0.00 0.00 -0.94 0.00 0.00 52.86 52.62 2bwi s ASN 151 Cb 0.09 0.53 0.00 0.00 -2.00 0.00 0.00 41.25 39.87 2bwi s ASN 151 CO 0.02 -0.73 0.00 0.61 -2.94 0.00 0.00 177.10 174.07 2bwi n GLY 152 N 0.44 3.72 3.28 0.45 0.00 -0.14 -0.77 105.19 112.16 2bwi n GLY 152 Ca -0.18 -0.63 -0.10 0.00 0.00 0.00 0.00 46.02 45.10 2bwi n GLY 152 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bwi s ALA 153 N -1.19 -0.67 -0.04 4.61 0.00 -1.26 -1.94 121.76 121.28 2bwi s ALA 153 Ca 0.00 -0.26 0.03 0.00 0.00 0.00 0.00 51.96 51.73 2bwi s ALA 153 Cb 0.00 0.62 0.00 0.00 0.00 0.00 0.00 23.12 23.74 2bwi s ALA 153 CO 0.00 -0.60 -0.13 -1.50 0.00 0.00 0.00 175.76 173.53 2bwi s ILE 154 N -3.83 1.12 -0.24 0.00 2.07 0.06 -2.26 121.20 118.13 2bwi s ILE 154 Ca 0.04 -0.54 -0.08 0.00 -1.41 0.00 0.00 60.65 58.66 2bwi s ILE 154 Cb 0.03 -0.98 -0.04 0.00 0.13 0.00 0.00 42.46 41.60 2bwi s ILE 154 CO -0.11 0.33 0.09 -0.32 -1.91 0.00 0.00 174.94 173.02 2bwi s MET 155 N 0.15 3.79 -0.55 3.50 -2.45 0.75 -0.75 119.30 123.74 2bwi s MET 155 Ca -0.04 -0.41 -0.08 0.00 -1.25 0.00 0.00 55.69 53.90 2bwi s MET 155 Cb -0.10 -3.35 0.14 0.00 1.25 0.00 0.00 34.83 32.77 2bwi s MET 155 CO 0.01 -0.06 0.42 0.08 1.05 0.00 0.00 175.02 176.52 2bwi s VAL 156 N 1.29 4.27 0.40 10.11 1.01 0.74 -1.09 120.40 137.13 2bwi s VAL 156 Ca 0.05 -2.12 -0.24 0.00 0.00 0.00 0.00 61.98 59.68 2bwi s VAL 156 Cb -0.15 -3.78 -0.09 0.00 0.00 0.00 0.00 36.38 32.36 2bwi s VAL 156 CO 0.04 -0.83 1.01 -0.76 0.00 0.00 0.00 175.10 174.56 2bwi s LEU 157 N 0.92 4.12 0.64 3.92 1.43 -0.23 -0.78 118.68 128.69 2bwi s LEU 157 Ca 0.10 1.92 -0.18 0.00 -1.03 0.00 0.00 54.13 54.94 2bwi s LEU 157 Cb -0.23 -4.25 -0.03 0.00 0.03 0.00 0.00 46.19 41.72 2bwi s LEU 157 CO -0.02 -0.40 1.07 -2.65 0.23 0.00 0.00 176.35 174.57 2bwi n PRO 158 N -0.13 0.89 0.25 1.29 -0.02 -1.26 -0.71 135.00 135.31 2bwi n PRO 158 Ca 0.05 0.35 0.07 0.00 -2.02 0.00 0.00 63.50 61.96 2bwi n PRO 158 Cb 0.51 -2.29 0.59 0.00 -0.02 0.00 0.00 33.50 32.29 2bwi n PRO 158 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2bwi h ARG 159 N 0.35 0.00 -0.68 -0.52 3.08 -1.88 -1.25 114.38 113.49 2bwi h ARG 159 Ca -0.49 0.00 -0.20 0.00 0.07 0.00 0.00 59.98 59.36 2bwi h ARG 159 Cb 1.35 0.00 -0.12 0.00 0.08 0.00 0.00 29.97 31.29 2bwi h ARG 159 CO 0.51 0.08 0.23 -3.47 -1.07 0.00 0.00 179.97 176.24 2bwi n ASP 160 N -4.42 4.63 0.00 7.04 4.64 -1.26 -1.11 116.55 126.08 2bwi n ASP 160 Ca -0.03 -3.24 0.00 0.00 -1.38 0.00 0.00 54.79 50.14 2bwi n ASP 160 Cb 0.15 -0.72 0.00 0.00 -1.04 0.00 0.00 41.12 39.51 2bwi n ASP 160 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 2bwi n GLY 161 N -0.25 -2.28 3.81 0.27 0.00 -0.47 -4.78 105.19 101.49 2bwi n GLY 161 Ca 0.39 -1.53 -0.33 0.00 0.00 0.00 0.00 46.02 44.55 2bwi n GLY 161 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2bwi s LEU 162 N 0.00 3.76 0.03 0.99 1.43 -1.26 -4.51 118.68 119.12 2bwi s LEU 162 Ca 0.00 1.80 0.02 0.00 -1.03 0.00 0.00 54.13 54.92 2bwi s LEU 162 Cb 0.00 -4.54 -0.02 0.00 0.03 0.00 0.00 46.19 41.66 2bwi s LEU 162 CO 0.00 -0.73 -0.07 -0.54 0.23 0.00 0.00 176.35 175.24 2bwi s LYS 163 N -3.51 0.49 0.00 1.70 -0.14 -1.26 -1.27 119.74 115.74 2bwi s LYS 163 Ca 0.64 -0.62 0.00 0.00 -1.36 0.00 0.00 55.97 54.64 2bwi s LYS 163 Cb -0.14 -0.29 0.00 0.00 -1.68 0.00 0.00 37.83 35.72 2bwi s LYS 163 CO 0.23 0.06 0.00 -0.40 -0.76 0.00 0.00 175.35 174.48 2bwi n ASP 164 N 1.81 0.00 0.05 2.83 5.68 -0.22 -4.80 116.55 121.90 2bwi n ASP 164 Ca -0.21 -0.41 0.09 0.00 -0.50 0.00 0.00 54.79 53.76 2bwi n ASP 164 Cb 0.55 0.00 0.38 0.00 -1.14 0.00 0.00 41.12 40.91 2bwi n ASP 164 CO 0.00 0.00 0.00 -1.84 -1.33 0.00 0.00 177.20 174.03 2bwi n GLU 165 N -0.41 0.08 -0.01 0.11 0.00 -1.26 -2.05 120.64 117.10 2bwi n GLU 165 Ca 0.00 0.33 0.06 0.00 0.00 0.00 0.00 57.16 57.55 2bwi n GLU 165 Cb 0.00 -1.65 0.06 0.00 0.00 0.00 0.00 31.44 29.85 2bwi n GLU 165 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 2bwi n LYS 166 N -1.80 0.79 -0.55 3.44 5.02 -1.26 -4.97 118.16 118.84 2bwi n LYS 166 Ca 0.03 -1.27 0.00 0.00 -2.02 0.00 0.00 58.31 55.05 2bwi n LYS 166 Cb 0.19 -1.24 0.00 0.00 -0.02 0.00 0.00 35.03 33.96 2bwi n LYS 166 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2bwi n GLY 167 N 0.68 0.71 3.89 0.72 0.00 -0.87 -5.12 105.19 105.21 2bwi n GLY 167 Ca 0.07 -0.12 -0.29 0.00 0.00 0.00 0.00 46.02 45.68 2bwi n GLY 167 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2bwi s GLN 168 N -0.58 3.70 0.42 1.61 1.11 -1.26 -4.69 119.66 119.98 2bwi s GLN 168 Ca 0.00 0.25 -0.26 0.00 0.01 0.00 0.00 55.36 55.36 2bwi s GLN 168 Cb 0.00 -2.50 -0.09 0.00 -1.01 0.00 0.00 33.01 29.41 2bwi s GLN 168 CO 0.00 0.07 1.42 -2.14 0.01 0.00 0.00 175.29 174.65 2bwi s PRO 169 N -3.76 3.86 -0.27 2.91 0.02 -1.26 -1.06 135.00 135.44 2bwi s PRO 169 Ca 0.48 2.41 0.00 0.00 0.02 0.00 0.00 61.00 63.91 2bwi s PRO 169 Cb -0.10 -2.77 0.05 0.00 0.02 0.00 0.00 34.50 31.69 2bwi s PRO 169 CO 0.31 -0.67 -0.06 -0.51 -0.33 0.00 0.00 177.00 175.74 2bwi s LEU 170 N -2.48 3.52 -0.22 -5.54 1.43 -0.40 -4.74 118.68 110.25 2bwi s LEU 170 Ca 0.58 -1.21 -0.02 0.00 -1.03 0.00 0.00 54.13 52.45 2bwi s LEU 170 Cb -0.43 -1.64 0.01 0.00 0.03 0.00 0.00 46.19 44.16 2bwi s LEU 170 CO 0.57 -0.20 -0.07 -0.89 0.23 0.00 0.00 176.35 175.99 2bwi s THR 171 N 1.22 3.02 0.26 5.49 2.01 -1.26 -4.14 115.64 122.23 2bwi s THR 171 Ca -0.05 -0.73 -0.19 0.00 0.31 0.00 0.00 61.69 61.03 2bwi s THR 171 Cb -0.19 -2.41 -0.09 0.00 0.01 0.00 0.00 72.50 69.82 2bwi s THR 171 CO -0.04 0.37 0.75 -0.72 -0.69 0.00 0.00 174.62 174.29 2bwi s TYR 172 N 1.40 3.57 -0.01 4.92 -0.85 -1.26 -4.87 117.35 120.26 2bwi s TYR 172 Ca 0.04 1.37 0.11 0.00 -0.52 0.00 0.00 57.07 58.08 2bwi s TYR 172 Cb -0.15 -2.62 -0.22 0.00 0.38 0.00 0.00 41.96 39.35 2bwi s TYR 172 CO -0.05 0.25 0.82 -0.44 -1.52 0.00 0.00 175.55 174.61 2bwi h ASP 173 N 3.05 0.00 -4.67 -0.18 3.32 -0.98 -3.48 116.42 113.48 2bwi h ASP 173 Ca -0.48 0.00 -0.19 0.00 0.02 0.00 0.00 57.03 56.38 2bwi h ASP 173 Cb 1.19 0.00 -0.23 0.00 0.22 0.00 0.00 39.33 40.51 2bwi h ASP 173 CO 0.65 0.99 -0.71 -0.54 -1.72 0.00 0.00 179.24 177.91 2bwi s LYS 174 N -2.63 0.24 -0.02 3.56 1.02 -1.00 -5.03 119.74 115.88 2bwi s LYS 174 Ca -0.03 -0.47 0.02 0.00 0.02 0.00 0.00 55.97 55.51 2bwi s LYS 174 Cb 0.08 0.07 0.00 0.00 -0.52 0.00 0.00 37.83 37.46 2bwi s LYS 174 CO 0.82 -0.03 -0.08 -1.50 -0.92 0.00 0.00 175.35 173.64 2bwi s ILE 175 N -1.10 0.66 0.13 2.17 2.07 -1.26 -1.49 121.20 122.39 2bwi s ILE 175 Ca -0.12 -0.30 0.08 0.00 -1.41 0.00 0.00 60.65 58.90 2bwi s ILE 175 Cb -0.08 -0.60 -0.04 0.00 0.13 0.00 0.00 42.46 41.88 2bwi s ILE 175 CO -0.01 0.21 -0.20 -0.31 -1.91 0.00 0.00 174.94 172.72 2bwi s TYR 176 N 0.18 1.82 -0.24 3.50 2.02 -0.59 -4.50 117.35 119.53 2bwi s TYR 176 Ca -0.02 -0.44 0.01 0.00 -0.37 0.00 0.00 57.07 56.25 2bwi s TYR 176 Cb -0.07 -0.96 0.04 0.00 -0.40 0.00 0.00 41.96 40.57 2bwi s TYR 176 CO 0.00 0.26 -0.12 -0.47 -1.57 0.00 0.00 175.55 173.65 2bwi s TYR 177 N -1.53 3.09 -0.39 2.71 5.04 -0.10 -1.05 117.35 125.12 2bwi s TYR 177 Ca 0.10 -1.98 -0.12 0.00 -2.44 0.00 0.00 57.07 52.63 2bwi s TYR 177 Cb -0.08 -1.96 0.03 0.00 0.35 0.00 0.00 41.96 40.30 2bwi s TYR 177 CO 0.05 -0.83 0.25 0.08 -1.34 0.00 0.00 175.55 173.76 2bwi s VAL 178 N 1.20 4.82 -0.19 3.14 1.01 0.22 -4.26 120.40 126.35 2bwi s VAL 178 Ca -0.03 -0.81 -0.15 0.00 0.00 0.00 0.00 61.98 60.98 2bwi s VAL 178 Cb -0.17 -3.70 -0.04 0.00 0.00 0.00 0.00 36.38 32.46 2bwi s VAL 178 CO -0.07 -0.28 0.37 -0.83 0.00 0.00 0.00 175.10 174.29 2bwi s GLY 179 N 1.63 2.12 -0.20 4.51 0.00 -1.26 -1.70 107.32 112.41 2bwi s GLY 179 Ca 0.03 -0.51 -0.07 0.00 0.00 0.00 0.00 44.72 44.17 2bwi s GLY 179 CO 0.08 0.73 0.05 1.85 0.00 0.00 0.00 173.10 175.81 2bwi s GLU 180 N 1.12 3.82 -0.16 2.90 2.12 -0.64 -2.10 118.70 125.76 2bwi s GLU 180 Ca 0.18 -0.42 0.01 0.00 0.36 0.00 0.00 54.97 55.11 2bwi s GLU 180 Cb -0.14 -3.21 0.01 0.00 0.26 0.00 0.00 34.13 31.05 2bwi s GLU 180 CO 0.07 0.11 -0.20 -1.14 -0.54 0.00 0.00 175.26 173.56 2bwi s GLN 181 N 0.81 3.04 -0.21 4.30 2.00 -0.04 -4.50 119.66 125.05 2bwi s GLN 181 Ca 0.03 -0.83 -0.21 0.00 -2.00 0.00 0.00 55.36 52.35 2bwi s GLN 181 Cb -0.14 -2.53 -0.02 0.00 0.80 0.00 0.00 33.01 31.12 2bwi s GLN 181 CO 0.02 -0.11 0.65 0.16 -0.50 0.00 0.00 175.29 175.52 2bwi s ASP 182 N 1.05 6.68 0.15 6.67 -4.77 -1.26 -1.34 116.67 123.86 2bwi s ASP 182 Ca -0.01 0.83 0.06 0.00 -3.30 0.00 0.00 52.55 50.13 2bwi s ASP 182 Cb -0.14 -2.36 -0.04 0.00 -1.09 0.00 0.00 42.92 39.29 2bwi s ASP 182 CO -0.07 -0.32 0.06 -0.36 0.70 0.00 0.00 175.17 175.18 2bwi s PHE 183 N 2.13 3.00 -0.53 2.11 0.08 -0.36 -4.73 117.98 119.68 2bwi s PHE 183 Ca 0.29 -0.06 0.06 0.00 0.12 0.00 0.00 56.93 57.34 2bwi s PHE 183 Cb -0.16 -1.46 0.23 0.00 -0.57 0.00 0.00 43.02 41.06 2bwi s PHE 183 CO 0.10 0.51 0.58 0.66 -0.10 0.00 0.00 175.22 176.97 2bwi n TYR 184 N -0.08 1.51 -2.42 0.36 4.02 -1.26 -1.05 117.16 118.23 2bwi n TYR 184 Ca -0.09 -3.84 -0.42 0.00 -0.01 0.00 0.00 57.90 53.53 2bwi n TYR 184 Cb 0.54 -0.38 -0.03 0.00 -0.02 0.00 0.00 39.34 39.46 2bwi n TYR 184 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 176.86 175.93 2bwi s VAL 185 N -1.53 4.16 0.37 -0.72 1.01 -1.26 -4.70 120.40 117.74 2bwi s VAL 185 Ca 0.35 1.49 -0.28 0.00 0.00 0.00 0.00 61.98 63.54 2bwi s VAL 185 Cb 0.12 -3.96 -0.11 0.00 0.00 0.00 0.00 36.38 32.43 2bwi s VAL 185 CO -0.09 -0.00 1.49 -2.84 0.00 0.00 0.00 175.10 173.66 2bwi s PRO 186 N 2.26 4.11 0.08 2.72 0.02 -1.26 -4.89 135.00 138.03 2bwi s PRO 186 Ca 0.57 2.57 0.09 0.00 0.02 0.00 0.00 61.00 64.26 2bwi s PRO 186 Cb -0.26 -2.97 -0.03 0.00 0.02 0.00 0.00 34.50 31.26 2bwi s PRO 186 CO 0.23 -0.54 -0.24 0.15 -0.33 0.00 0.00 177.00 176.27 2bwi s LYS 187 N -1.99 1.44 0.84 5.54 1.02 -1.26 -0.83 119.74 124.51 2bwi s LYS 187 Ca 0.53 -1.12 -0.12 0.00 0.02 0.00 0.00 55.97 55.28 2bwi s LYS 187 Cb -0.47 -1.70 0.11 0.00 -0.52 0.00 0.00 37.83 35.26 2bwi s LYS 187 CO 0.62 0.42 1.19 0.16 -0.92 0.00 0.00 175.35 176.82 2bwi s ASP 188 N -1.55 4.14 0.58 2.83 1.47 -0.23 -4.90 116.67 119.01 2bwi s ASP 188 Ca 0.10 0.54 0.34 0.00 1.18 0.00 0.00 52.55 54.71 2bwi s ASP 188 Cb -0.10 -0.92 1.77 0.00 -0.34 0.00 0.00 42.92 43.33 2bwi s ASP 188 CO 0.03 -2.10 2.17 1.05 0.68 0.00 0.00 175.17 177.00 2bwi h GLU 189 N -1.14 0.00 0.00 2.11 4.11 -2.01 -0.49 114.58 117.16 2bwi h GLU 189 Ca -0.45 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.98 2bwi h GLU 189 Cb 1.30 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.55 2bwi h GLU 189 CO 0.56 0.05 0.00 0.00 0.07 0.00 0.00 179.01 179.69 2bwi h ALA 190 N 1.95 1.00 0.00 1.06 0.00 -2.06 -3.47 119.26 117.74 2bwi h ALA 190 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2bwi h ALA 190 Cb 0.22 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.01 2bwi h ALA 190 CO 0.01 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.67 2bwi n GLY 191 N 0.88 0.88 3.84 0.00 0.00 -0.19 -5.09 105.19 105.51 2bwi n GLY 191 Ca 0.04 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.70 2bwi n GLY 191 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2bwi s ASN 192 N -2.24 6.82 0.27 1.61 0.02 -1.26 -4.77 114.94 115.39 2bwi s ASN 192 Ca 0.00 1.04 -0.29 0.00 -1.02 0.00 0.00 52.86 52.59 2bwi s ASN 192 Cb 0.00 -2.28 -0.10 0.00 0.02 0.00 0.00 41.25 38.90 2bwi s ASN 192 CO 0.00 0.16 1.31 -0.31 0.02 0.00 0.00 177.10 178.28 2bwi s TYR 193 N -1.37 3.16 0.36 2.20 2.02 -1.26 -1.06 117.35 121.39 2bwi s TYR 193 Ca 0.34 1.32 -0.10 0.00 -0.37 0.00 0.00 57.07 58.27 2bwi s TYR 193 Cb -0.16 -3.64 -0.07 0.00 -0.40 0.00 0.00 41.96 37.70 2bwi s TYR 193 CO 0.18 -1.86 0.71 0.15 -1.57 0.00 0.00 175.55 173.16 2bwi s LYS 194 N -1.03 3.79 0.16 -0.62 1.02 -0.01 -4.89 119.74 118.17 2bwi s LYS 194 Ca 0.52 0.41 0.10 0.00 0.02 0.00 0.00 55.97 57.02 2bwi s LYS 194 Cb -0.38 -2.46 -0.04 0.00 -0.52 0.00 0.00 37.83 34.42 2bwi s LYS 194 CO 0.46 0.06 -0.20 0.15 -0.92 0.00 0.00 175.35 174.90 2bwi s LYS 195 N -3.58 1.68 0.12 1.68 1.02 -1.26 -4.76 119.74 114.63 2bwi s LYS 195 Ca 0.50 -1.36 0.04 0.00 0.02 0.00 0.00 55.97 55.17 2bwi s LYS 195 Cb -0.10 -1.98 -0.04 0.00 -0.52 0.00 0.00 37.83 35.18 2bwi s LYS 195 CO 0.28 0.43 -0.11 0.71 -0.92 0.00 0.00 175.35 175.74 2bwi s TYR 196 N -1.46 1.21 -0.03 3.18 1.51 -1.26 -5.07 117.35 115.43 2bwi s TYR 196 Ca 0.20 -0.67 0.12 0.00 -1.01 0.00 0.00 57.07 55.71 2bwi s TYR 196 Cb -0.09 -0.64 -0.19 0.00 -0.11 0.00 0.00 41.96 40.93 2bwi s TYR 196 CO 0.10 0.06 0.89 0.93 -1.11 0.00 0.00 175.55 176.42 2bwi h GLU 197 N 3.28 0.00 -4.01 -0.62 4.39 -2.02 -3.48 114.58 112.13 2bwi h GLU 197 Ca -0.38 0.00 -0.10 0.00 0.34 0.00 0.00 59.36 59.22 2bwi h GLU 197 Cb 1.19 0.00 -0.14 0.00 -0.10 0.00 0.00 28.75 29.70 2bwi h GLU 197 CO 0.56 0.57 -0.51 0.95 -1.16 0.00 0.00 179.01 179.42 2bwi s THR 198 N -2.71 0.18 0.29 1.13 -4.23 -1.26 -5.05 115.64 104.00 2bwi s THR 198 Ca -0.02 -1.47 -0.00 0.00 -1.18 0.00 0.00 61.69 59.01 2bwi s THR 198 Cb 0.09 -1.43 0.28 0.00 1.34 0.00 0.00 72.50 72.77 2bwi s THR 198 CO 0.82 -0.80 1.91 -0.65 -0.54 0.00 0.00 174.62 175.35 2bwi h PRO 199 N 2.93 1.05 -0.71 3.99 0.11 -1.99 -2.37 132.00 135.01 2bwi h PRO 199 Ca -0.34 -0.06 -0.06 0.00 0.11 0.00 0.00 66.00 65.65 2bwi h PRO 199 Cb 1.17 -0.24 -0.03 0.00 0.11 0.00 0.00 31.00 32.02 2bwi h PRO 199 CO 0.61 0.69 0.21 0.78 -0.21 0.00 0.00 178.00 180.08 2bwi h GLY 200 N 1.08 1.19 2.00 -0.55 0.00 -2.00 -1.29 103.07 103.50 2bwi h GLY 200 Ca 0.39 -0.72 -0.07 0.00 0.00 0.00 0.00 47.33 46.94 2bwi h GLY 200 CO -0.14 0.67 -0.31 0.83 0.00 0.00 0.00 176.54 177.59 2bwi h GLU 201 N 1.05 0.00 0.00 4.80 5.08 -1.90 -3.07 114.58 120.53 2bwi h GLU 201 Ca 0.23 0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.52 2bwi h GLU 201 Cb 0.32 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.56 2bwi h GLU 201 CO -0.00 0.31 -0.30 0.00 -1.00 0.00 0.00 179.01 178.02 2bwi h ALA 202 N 1.69 0.83 -0.07 3.43 0.00 -0.91 -3.41 119.26 120.82 2bwi h ALA 202 Ca -0.00 -0.27 0.03 0.00 0.00 0.00 0.00 54.91 54.67 2bwi h ALA 202 Cb 0.60 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.30 2bwi h ALA 202 CO 0.04 0.38 -0.17 -0.92 0.00 0.00 0.00 179.25 178.58 2bwi h TYR 203 N 0.00 -0.43 -0.44 0.00 3.20 -1.15 0.37 116.97 118.52 2bwi h TYR 203 Ca -0.00 0.02 -0.07 0.00 3.14 0.00 0.00 58.73 61.82 2bwi h TYR 203 Cb 1.15 0.20 -0.02 0.00 1.54 0.00 0.00 36.73 39.61 2bwi h TYR 203 CO 0.00 -0.24 0.01 1.49 -1.64 0.00 0.00 178.16 177.78 2bwi h GLU 204 N -0.24 0.77 0.00 1.82 4.57 -1.80 -0.44 114.58 119.26 2bwi h GLU 204 Ca 0.07 -0.24 -0.08 0.00 -1.18 0.00 0.00 59.36 57.94 2bwi h GLU 204 Cb 0.35 -0.07 -0.01 0.00 -0.16 0.00 0.00 28.75 28.85 2bwi h GLU 204 CO -0.21 0.83 -0.37 -0.44 -1.18 0.00 0.00 179.01 177.64 2bwi h ASP 205 N 0.61 0.00 -0.52 1.04 3.32 -1.79 -0.80 116.42 118.29 2bwi h ASP 205 Ca 0.13 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.18 2bwi h ASP 205 Cb 0.47 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.00 2bwi h ASP 205 CO 0.02 0.37 0.34 0.00 -1.72 0.00 0.00 179.24 178.25 2bwi h ALA 206 N 1.63 0.66 -0.49 3.45 0.00 -0.11 0.17 119.26 124.57 2bwi h ALA 206 Ca -0.00 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 2bwi h ALA 206 Cb 0.82 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.38 2bwi h ALA 206 CO 0.05 0.11 0.27 0.28 0.00 0.00 0.00 179.25 179.96 2bwi h VAL 207 N 0.70 1.16 -0.62 0.00 2.07 -0.75 0.11 116.25 118.93 2bwi h VAL 207 Ca 0.19 -0.41 -0.01 0.00 0.82 0.00 0.00 66.70 67.29 2bwi h VAL 207 Cb -0.07 0.55 -0.03 0.00 -1.52 0.00 0.00 31.29 30.22 2bwi h VAL 207 CO -0.04 0.17 0.35 0.50 0.02 0.00 0.00 177.57 178.57 2bwi h LYS 208 N 0.65 0.85 -0.32 1.57 3.64 -0.99 -0.85 116.57 121.12 2bwi h LYS 208 Ca 0.17 -0.09 -0.02 0.00 -1.27 0.00 0.00 60.65 59.44 2bwi h LYS 208 Cb 0.03 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 31.67 2bwi h LYS 208 CO -0.03 0.63 0.13 0.00 -2.27 0.00 0.00 179.45 177.91 2bwi h ALA 209 N 1.17 0.41 -0.80 5.00 0.00 -0.69 -2.74 119.26 121.61 2bwi h ALA 209 Ca 0.22 -0.12 0.06 0.00 0.00 0.00 0.00 54.91 55.06 2bwi h ALA 209 Cb 0.02 -0.12 -0.06 0.00 0.00 0.00 0.00 17.79 17.63 2bwi h ALA 209 CO -0.04 0.01 0.49 0.52 0.00 0.00 0.00 179.25 180.23 2bwi h MET 210 N 0.37 0.87 0.00 0.00 2.86 -0.73 -2.79 114.93 115.51 2bwi h MET 210 Ca 0.11 -0.05 0.00 0.00 -2.06 0.00 0.00 59.70 57.69 2bwi h MET 210 Cb 0.18 -0.20 0.00 0.00 0.06 0.00 0.00 31.60 31.64 2bwi h MET 210 CO -0.01 0.58 0.00 0.00 1.06 0.00 0.00 176.91 178.54 2bwi h ARG 211 N 0.90 0.00 0.00 1.72 3.08 -0.85 0.29 114.38 119.52 2bwi h ARG 211 Ca 0.35 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.39 2bwi h ARG 211 Cb 0.15 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.20 2bwi h ARG 211 CO -0.17 0.00 -0.02 1.79 -1.07 0.00 0.00 179.97 180.50 2bwi h THR 212 N 0.00 0.09 0.00 2.04 1.35 -1.37 -3.46 112.91 111.56 2bwi h THR 212 Ca 0.00 -0.29 0.00 0.00 -0.55 0.00 0.00 66.41 65.57 2bwi h THR 212 Cb 0.26 1.26 0.00 0.00 -1.73 0.00 0.00 68.15 67.94 2bwi h THR 212 CO 0.00 0.02 0.00 0.18 -0.25 0.00 0.00 175.52 175.47 2bwi n LEU 213 N -3.18 0.74 -4.33 3.87 4.77 0.09 -4.98 117.00 113.99 2bwi n LEU 213 Ca -0.01 0.00 -0.40 0.00 -0.03 0.00 0.00 56.01 55.56 2bwi n LEU 213 Cb 0.19 -1.62 -0.11 0.00 -2.33 0.00 0.00 43.42 39.55 2bwi n LEU 213 CO 0.25 -0.59 -0.15 -0.89 -1.33 0.00 0.00 177.39 174.68 2bwi s THR 214 N -1.47 4.37 0.48 -5.08 2.01 -1.26 -5.08 115.64 109.61 2bwi s THR 214 Ca 0.00 -1.09 -0.23 0.00 0.31 0.00 0.00 61.69 60.68 2bwi s THR 214 Cb 0.00 -3.53 -0.07 0.00 0.01 0.00 0.00 72.50 68.91 2bwi s THR 214 CO 0.00 -0.33 1.30 -2.84 -0.69 0.00 0.00 174.62 172.06 2bwi s PRO 215 N 1.49 3.55 0.14 4.92 0.02 -1.26 -4.89 135.00 138.96 2bwi s PRO 215 Ca 0.02 2.11 0.14 0.00 0.02 0.00 0.00 61.00 63.29 2bwi s PRO 215 Cb -0.21 -2.45 -0.09 0.00 0.02 0.00 0.00 34.50 31.77 2bwi s PRO 215 CO 0.05 -0.82 1.09 1.79 -0.33 0.00 0.00 177.00 178.78 2bwi h THR 216 N 1.88 0.84 -3.30 0.99 1.35 -1.44 -3.47 112.91 109.76 2bwi h THR 216 Ca -0.50 -2.35 -0.16 0.00 -0.55 0.00 0.00 66.41 62.85 2bwi h THR 216 Cb 1.27 2.33 -0.23 0.00 -1.73 0.00 0.00 68.15 69.78 2bwi h THR 216 CO 0.60 0.48 -0.45 -1.00 -0.25 0.00 0.00 175.52 174.89 2bwi s HIS 217 N -2.87 -0.13 -0.14 4.73 3.76 -1.20 -4.94 115.29 114.49 2bwi s HIS 217 Ca -0.00 0.29 -0.03 0.00 -0.15 0.00 0.00 55.06 55.16 2bwi s HIS 217 Cb 0.08 0.04 0.05 0.00 1.11 0.00 0.00 32.58 33.86 2bwi s HIS 217 CO 0.79 -0.21 0.06 0.42 -0.85 0.00 0.00 174.74 174.95 2bwi s ILE 218 N -0.60 0.13 0.15 0.60 1.01 -0.57 -1.23 121.20 120.69 2bwi s ILE 218 Ca -0.07 -0.13 0.06 0.00 0.00 0.00 0.00 60.65 60.50 2bwi s ILE 218 Cb -0.04 -0.62 -0.04 0.00 0.01 0.00 0.00 42.46 41.77 2bwi s ILE 218 CO 0.01 -0.12 -0.12 0.68 0.00 0.00 0.00 174.94 175.39 2bwi s VAL 219 N 2.05 1.33 -0.12 2.92 -7.23 -0.45 -0.76 120.40 118.13 2bwi s VAL 219 Ca 0.02 -2.01 -0.06 0.00 -1.81 0.00 0.00 61.98 58.12 2bwi s VAL 219 Cb -0.15 -1.81 -0.04 0.00 0.56 0.00 0.00 36.38 34.94 2bwi s VAL 219 CO -0.07 -0.63 0.10 -0.36 -0.31 0.00 0.00 175.10 173.82 2bwi s PHE 220 N -2.95 3.45 -1.35 2.82 0.08 -1.26 -0.86 117.98 117.90 2bwi s PHE 220 Ca 0.16 0.39 -0.05 0.00 0.12 0.00 0.00 56.93 57.55 2bwi s PHE 220 Cb -0.00 -1.94 0.03 0.00 -0.57 0.00 0.00 43.02 40.54 2bwi s PHE 220 CO 0.03 0.58 0.35 -1.71 -0.10 0.00 0.00 175.22 174.36 2bwi n ASN 221 N 2.30 -4.69 0.00 1.36 5.15 -0.89 -3.25 115.26 115.24 2bwi n ASN 221 Ca -0.19 -0.17 0.00 0.00 -0.60 0.00 0.00 54.58 53.62 2bwi n ASN 221 Cb 0.54 -3.87 0.00 0.00 -0.53 0.00 0.00 39.78 35.92 2bwi n ASN 221 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2bwi n GLY 222 N -1.16 1.28 3.52 8.20 0.00 -0.93 -4.77 105.19 111.33 2bwi n GLY 222 Ca -0.10 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.78 2bwi n GLY 222 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bwi s ALA 223 N -2.63 -1.80 0.14 4.61 0.00 -1.20 -4.70 121.76 116.18 2bwi s ALA 223 Ca 0.00 1.25 -0.35 0.00 0.00 0.00 0.00 51.96 52.86 2bwi s ALA 223 Cb 0.00 -0.04 -0.15 0.00 0.00 0.00 0.00 23.12 22.93 2bwi s ALA 223 CO 0.00 -0.44 1.46 0.28 0.00 0.00 0.00 175.76 177.06 2bwi n VAL 224 N 0.55 0.08 -0.97 0.00 0.31 -0.26 -1.99 118.33 116.05 2bwi n VAL 224 Ca -0.15 -0.02 0.00 0.00 -0.01 0.00 0.00 64.34 64.16 2bwi n VAL 224 Cb 0.59 -1.22 0.00 0.00 -0.91 0.00 0.00 33.84 32.30 2bwi n VAL 224 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2bwi n GLY 225 N 2.94 0.60 0.33 2.92 0.00 -1.26 -4.84 105.19 105.88 2bwi n GLY 225 Ca 0.17 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.24 2bwi n GLY 225 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bwi h ALA 226 N 0.00 1.67 -1.02 4.61 0.00 -1.61 -2.65 119.26 120.26 2bwi h ALA 226 Ca 0.00 -0.03 -0.70 0.00 0.00 0.00 0.00 54.91 54.17 2bwi h ALA 226 Cb 0.08 -0.20 -0.30 0.00 0.00 0.00 0.00 17.79 17.37 2bwi h ALA 226 CO 0.00 0.27 0.73 1.28 0.00 0.00 0.00 179.25 181.53 2bwi n LEU 227 N -4.46 7.23 -4.25 0.00 4.77 -1.26 -4.68 117.00 114.34 2bwi n LEU 227 Ca 0.07 -4.63 -0.14 0.00 -0.03 0.00 0.00 56.01 51.28 2bwi n LEU 227 Cb 0.12 -0.94 -0.10 0.00 -2.33 0.00 0.00 43.42 40.17 2bwi n LEU 227 CO 0.35 1.70 -0.24 0.42 -1.33 0.00 0.00 177.39 178.29 2bwi s THR 228 N -4.98 0.21 0.00 -5.08 -4.23 -1.00 -0.86 115.64 99.71 2bwi s THR 228 Ca 0.57 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 59.08 2bwi s THR 228 Cb 0.46 -2.55 0.00 0.00 1.34 0.00 0.00 72.50 71.75 2bwi s THR 228 CO -0.20 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.49 2bwi n GLY 229 N -0.35 3.13 0.13 3.99 0.00 -1.26 -1.63 105.19 109.20 2bwi n GLY 229 Ca 0.01 -0.18 0.11 0.00 0.00 0.00 0.00 46.02 45.97 2bwi n GLY 229 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2bwi n ASP 230 N 6.00 0.57 -0.81 1.61 8.00 -1.26 -1.97 116.55 128.69 2bwi n ASP 230 Ca 0.00 0.69 0.09 0.00 0.71 0.00 0.00 54.79 56.27 2bwi n ASP 230 Cb 0.00 -0.79 0.25 0.00 -0.02 0.00 0.00 41.12 40.56 2bwi n ASP 230 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 2bwi n HIS 231 N -2.18 0.84 -1.76 1.24 8.25 -0.65 -5.02 115.22 115.95 2bwi n HIS 231 Ca 0.01 -0.88 -0.39 0.00 -0.26 0.00 0.00 57.72 56.20 2bwi n HIS 231 Cb 0.14 -0.29 0.04 0.00 1.12 0.00 0.00 29.99 31.00 2bwi n HIS 231 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2bwi s ALA 232 N -2.80 2.87 0.68 -1.41 0.00 -0.83 -3.75 121.76 116.52 2bwi s ALA 232 Ca 0.41 1.38 -0.16 0.00 0.00 0.00 0.00 51.96 53.59 2bwi s ALA 232 Cb 0.33 -3.58 0.01 0.00 0.00 0.00 0.00 23.12 19.88 2bwi s ALA 232 CO 0.08 -1.39 1.16 -0.51 0.00 0.00 0.00 175.76 175.10 2bwi s LEU 233 N -3.44 3.40 0.10 0.00 1.43 -0.28 -4.84 118.68 115.05 2bwi s LEU 233 Ca 0.71 2.20 0.03 0.00 -1.03 0.00 0.00 54.13 56.04 2bwi s LEU 233 Cb -0.42 -4.57 -0.04 0.00 0.03 0.00 0.00 46.19 41.19 2bwi s LEU 233 CO 0.50 -1.89 -0.09 0.42 0.23 0.00 0.00 176.35 175.51 2bwi s THR 234 N -2.08 0.91 0.21 5.49 -4.23 -1.26 -0.67 115.64 114.00 2bwi s THR 234 Ca 0.71 -1.71 -0.23 0.00 -1.18 0.00 0.00 61.69 59.29 2bwi s THR 234 Cb -0.25 -1.43 0.05 0.00 1.34 0.00 0.00 72.50 72.20 2bwi s THR 234 CO 0.42 -0.62 0.72 0.00 -0.54 0.00 0.00 174.62 174.60 2bwi s ALA 235 N -2.67 -1.44 0.13 3.99 0.00 -1.09 -4.94 121.76 115.74 2bwi s ALA 235 Ca 0.07 0.10 0.06 0.00 0.00 0.00 0.00 51.96 52.19 2bwi s ALA 235 Cb -0.01 0.81 -0.04 0.00 0.00 0.00 0.00 23.12 23.88 2bwi s ALA 235 CO -0.01 -0.93 0.00 0.00 0.00 0.00 0.00 175.76 174.83 2bwi s ALA 236 N -3.73 3.25 0.20 0.00 0.00 -1.26 -1.42 121.76 118.79 2bwi s ALA 236 Ca 0.07 -1.24 -0.32 0.00 0.00 0.00 0.00 51.96 50.47 2bwi s ALA 236 Cb -0.03 -1.10 -0.14 0.00 0.00 0.00 0.00 23.12 21.85 2bwi s ALA 236 CO -0.01 0.59 1.42 0.28 0.00 0.00 0.00 175.76 178.03 2bwi n VAL 237 N 0.21 0.65 -0.01 0.00 0.31 -0.37 -1.54 118.33 117.59 2bwi n VAL 237 Ca -0.10 -0.16 0.00 0.00 -0.01 0.00 0.00 64.34 64.06 2bwi n VAL 237 Cb 0.54 -1.39 0.00 0.00 -0.91 0.00 0.00 33.84 32.08 2bwi n VAL 237 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2bwi n GLY 238 N 2.48 1.45 3.76 2.92 0.00 0.58 -5.00 105.19 111.38 2bwi n GLY 238 Ca 0.14 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.76 2bwi n GLY 238 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2bwi s GLU 239 N -0.51 4.77 -0.28 1.61 2.02 -0.59 -4.77 118.70 120.96 2bwi s GLU 239 Ca 0.00 1.47 -0.17 0.00 0.02 0.00 0.00 54.97 56.29 2bwi s GLU 239 Cb 0.00 -3.15 -0.03 0.00 0.10 0.00 0.00 34.13 31.05 2bwi s GLU 239 CO 0.00 0.43 0.47 1.03 0.02 0.00 0.00 175.26 177.22 2bwi s ARG 240 N -1.42 3.97 -0.08 1.61 0.52 -1.26 -1.89 118.95 120.39 2bwi s ARG 240 Ca 0.44 0.15 0.04 0.00 -0.52 0.00 0.00 55.73 55.84 2bwi s ARG 240 Cb -0.25 -3.68 -0.00 0.00 0.52 0.00 0.00 34.95 31.54 2bwi s ARG 240 CO 0.31 -0.38 -0.22 0.08 0.02 0.00 0.00 175.30 175.10 2bwi s VAL 241 N 2.26 1.89 -0.23 3.52 1.01 0.10 -0.20 120.40 128.73 2bwi s VAL 241 Ca 0.19 -0.93 -0.10 0.00 0.00 0.00 0.00 61.98 61.14 2bwi s VAL 241 Cb -0.16 -1.63 -0.05 0.00 0.00 0.00 0.00 36.38 34.55 2bwi s VAL 241 CO 0.10 0.52 0.14 -0.22 0.00 0.00 0.00 175.10 175.64 2bwi s LEU 242 N 0.28 4.01 -0.33 3.92 2.96 -0.55 -1.33 118.68 127.64 2bwi s LEU 242 Ca -0.15 0.07 -0.05 0.00 -0.22 0.00 0.00 54.13 53.78 2bwi s LEU 242 Cb -0.17 -2.07 0.04 0.00 0.50 0.00 0.00 46.19 44.50 2bwi s LEU 242 CO 0.07 0.07 0.08 -0.69 -1.32 0.00 0.00 176.35 174.56 2bwi s VAL 243 N 1.05 3.59 -0.01 1.68 1.01 0.05 -1.55 120.40 126.23 2bwi s VAL 243 Ca 0.07 -1.21 -0.24 0.00 0.00 0.00 0.00 61.98 60.60 2bwi s VAL 243 Cb -0.14 -3.05 -0.05 0.00 0.00 0.00 0.00 36.38 33.15 2bwi s VAL 243 CO 0.04 -0.17 0.72 -0.69 0.00 0.00 0.00 175.10 175.00 2bwi s VAL 244 N 1.36 4.89 -0.05 2.92 1.01 -0.21 -1.54 120.40 128.78 2bwi s VAL 244 Ca -0.02 1.51 0.00 0.00 0.00 0.00 0.00 61.98 63.47 2bwi s VAL 244 Cb -0.20 -4.07 0.03 0.00 0.00 0.00 0.00 36.38 32.14 2bwi s VAL 244 CO 0.02 0.32 -0.02 -2.28 0.00 0.00 0.00 175.10 173.14 2bwi s HIS 245 N 0.31 0.62 0.18 5.22 5.04 -0.25 -0.61 115.29 125.80 2bwi s HIS 245 Ca 0.38 -0.14 0.10 0.00 -1.54 0.00 0.00 55.06 53.85 2bwi s HIS 245 Cb -0.19 -0.66 -0.04 0.00 0.04 0.00 0.00 32.58 31.73 2bwi s HIS 245 CO 0.20 -0.23 -0.22 -1.54 -2.34 0.00 0.00 174.74 170.61 2bwi s SER 246 N 1.33 3.16 -0.25 9.88 1.04 -0.69 -0.86 113.70 127.30 2bwi s SER 246 Ca -0.05 -0.86 -0.02 0.00 0.48 0.00 0.00 55.95 55.51 2bwi s SER 246 Cb -0.13 -0.22 0.13 0.00 0.10 0.00 0.00 66.02 65.90 2bwi s SER 246 CO -0.02 0.07 0.35 -1.58 0.98 0.00 0.00 173.24 173.04 2bwi s GLN 247 N -2.68 0.34 0.00 4.02 -0.44 -0.87 -1.62 119.66 118.41 2bwi s GLN 247 Ca 0.19 0.32 0.27 0.00 -2.50 0.00 0.00 55.36 53.63 2bwi s GLN 247 Cb -0.07 -0.56 1.20 0.00 -1.64 0.00 0.00 33.01 31.94 2bwi s GLN 247 CO 0.09 -0.78 1.88 0.00 0.50 0.00 0.00 175.29 176.98 2bwi n ALA 248 N 5.35 2.26 0.00 1.58 0.00 -1.26 -0.41 120.51 128.03 2bwi n ALA 248 Ca -0.03 -0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.31 2bwi n ALA 248 Cb 0.49 -1.44 0.00 0.00 0.00 0.00 0.00 19.45 18.51 2bwi n ALA 248 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 2bwi n ASN 249 N -1.45 0.00 -4.01 0.00 5.15 -1.26 -3.11 115.26 110.58 2bwi n ASN 249 Ca 0.08 0.00 -0.08 0.00 -0.60 0.00 0.00 54.58 53.97 2bwi n ASN 249 Cb 0.29 0.00 -0.11 0.00 -0.53 0.00 0.00 39.78 39.44 2bwi n ASN 249 CO 0.00 0.00 0.00 -0.13 1.40 0.00 0.00 177.26 178.53 2bwi s ARG 250 N -0.18 0.41 0.61 1.20 0.52 -1.26 -4.74 118.95 115.50 2bwi s ARG 250 Ca 0.00 -0.78 -0.19 0.00 -0.52 0.00 0.00 55.73 54.24 2bwi s ARG 250 Cb 0.00 0.14 -0.03 0.00 0.52 0.00 0.00 34.95 35.58 2bwi s ARG 250 CO 0.00 -0.07 1.17 -0.25 0.02 0.00 0.00 175.30 176.17 2bwi n ASP 251 N 1.15 1.63 -4.21 0.23 8.00 -1.26 -3.21 116.55 118.89 2bwi n ASP 251 Ca -0.21 0.84 -0.12 0.00 0.71 0.00 0.00 54.79 56.01 2bwi n ASP 251 Cb 0.57 -1.49 -0.10 0.00 -0.02 0.00 0.00 41.12 40.08 2bwi n ASP 251 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 2bwi s THR 252 N -1.42 0.38 -0.47 -3.53 -1.32 -0.31 -4.82 115.64 104.15 2bwi s THR 252 Ca 0.78 -1.95 0.05 0.00 -1.21 0.00 0.00 61.69 59.36 2bwi s THR 252 Cb -0.40 -2.17 0.19 0.00 -1.51 0.00 0.00 72.50 68.61 2bwi s THR 252 CO 0.44 -0.39 0.41 -2.11 -2.21 0.00 0.00 174.62 170.77 2bwi n ARG 253 N -0.21 0.65 -1.93 7.08 1.85 -1.26 -1.33 116.66 121.52 2bwi n ARG 253 Ca -0.05 -3.46 -0.34 0.00 -1.00 0.00 0.00 57.85 53.00 2bwi n ARG 253 Cb 0.64 -1.72 0.04 0.00 -1.05 0.00 0.00 32.46 30.37 2bwi n ARG 253 CO 0.00 0.00 0.00 -2.14 -0.01 0.00 0.00 177.63 175.48 2bwi s PRO 254 N -0.52 2.94 -0.25 2.89 0.02 -1.19 -0.77 135.00 138.12 2bwi s PRO 254 Ca 0.32 1.58 -0.16 0.00 0.02 0.00 0.00 61.00 62.76 2bwi s PRO 254 Cb 0.05 -1.95 0.07 0.00 0.02 0.00 0.00 34.50 32.69 2bwi s PRO 254 CO -0.17 -1.18 0.63 -1.58 -0.33 0.00 0.00 177.00 174.38 2bwi s HIS 255 N -1.99 -0.91 -0.46 6.54 2.46 -0.28 -3.13 115.29 117.52 2bwi s HIS 255 Ca 0.71 1.91 -0.17 0.00 0.47 0.00 0.00 55.06 57.98 2bwi s HIS 255 Cb -0.24 0.49 0.04 0.00 -0.13 0.00 0.00 32.58 32.74 2bwi s HIS 255 CO 0.36 -0.46 0.48 -1.17 -2.47 0.00 0.00 174.74 171.48 2bwi s LEU 256 N 1.30 5.08 -0.27 8.88 2.96 -1.26 -1.20 118.68 134.18 2bwi s LEU 256 Ca -0.08 -0.91 -0.29 0.00 -0.22 0.00 0.00 54.13 52.64 2bwi s LEU 256 Cb -0.05 -2.35 -0.01 0.00 0.50 0.00 0.00 46.19 44.27 2bwi s LEU 256 CO -0.14 -0.68 1.52 -0.63 -1.32 0.00 0.00 176.35 175.09 2bwi s ILE 257 N 2.15 3.83 0.00 6.68 1.01 0.15 -1.23 121.20 133.78 2bwi s ILE 257 Ca 0.11 0.92 0.00 0.00 0.00 0.00 0.00 60.65 61.68 2bwi s ILE 257 Cb -0.19 -3.89 0.00 0.00 0.01 0.00 0.00 42.46 38.39 2bwi s ILE 257 CO 0.11 -0.41 0.00 0.61 0.00 0.00 0.00 174.94 175.26 2bwi n GLY 258 N 4.66 0.60 0.00 6.18 0.00 -1.26 -3.77 105.19 111.60 2bwi n GLY 258 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.20 2bwi n GLY 258 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bwi n GLY 259 N -2.00 5.58 3.56 -0.02 0.00 -0.37 -5.02 105.19 106.92 2bwi n GLY 259 Ca 0.00 -1.43 -0.10 0.00 0.00 0.00 0.00 46.02 44.49 2bwi n GLY 259 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2bwi s HIS 260 N 0.27 0.47 -0.48 1.61 0.09 -1.26 -4.72 115.29 111.27 2bwi s HIS 260 Ca 0.00 -0.82 -0.16 0.00 -0.00 0.00 0.00 55.06 54.08 2bwi s HIS 260 Cb 0.00 0.12 0.07 0.00 -0.00 0.00 0.00 32.58 32.77 2bwi s HIS 260 CO 0.00 -0.99 0.45 0.20 -0.00 0.00 0.00 174.74 174.40 2bwi s GLY 261 N -3.05 1.99 0.19 -2.22 0.00 -0.17 -4.75 107.32 99.32 2bwi s GLY 261 Ca 0.24 -2.05 -0.11 0.00 0.00 0.00 0.00 44.72 42.81 2bwi s GLY 261 CO 0.10 1.15 1.77 -0.55 0.00 0.00 0.00 173.10 175.57 2bwi h ASP 262 N 8.81 0.88 -3.30 1.64 3.32 -1.39 -0.35 116.42 126.02 2bwi h ASP 262 Ca -0.28 -0.13 -0.46 0.00 0.02 0.00 0.00 57.03 56.17 2bwi h ASP 262 Cb 1.11 -0.23 -0.36 0.00 0.22 0.00 0.00 39.33 40.07 2bwi h ASP 262 CO 0.90 0.77 -0.78 -0.31 -1.72 0.00 0.00 179.24 178.09 2bwi s TYR 263 N -5.70 0.98 -0.08 4.55 2.02 -0.95 -1.81 117.35 116.38 2bwi s TYR 263 Ca -0.13 -0.37 0.01 0.00 -0.37 0.00 0.00 57.07 56.21 2bwi s TYR 263 Cb 0.14 -0.91 0.02 0.00 -0.40 0.00 0.00 41.96 40.81 2bwi s TYR 263 CO 0.80 -0.34 -0.08 0.08 -1.57 0.00 0.00 175.55 174.44 2bwi s VAL 264 N 1.51 0.87 -0.93 0.71 1.01 0.24 -0.64 120.40 123.16 2bwi s VAL 264 Ca -0.01 -0.26 -0.13 0.00 0.00 0.00 0.00 61.98 61.58 2bwi s VAL 264 Cb -0.13 -0.87 0.23 0.00 0.00 0.00 0.00 36.38 35.61 2bwi s VAL 264 CO -0.04 0.32 0.92 0.26 0.00 0.00 0.00 175.10 176.56 2bwi s TRP 265 N 1.19 3.86 0.31 5.22 0.51 -0.20 -0.62 118.94 129.21 2bwi s TRP 265 Ca -0.06 -2.16 0.00 0.00 -2.12 0.00 0.00 56.10 51.76 2bwi s TRP 265 Cb -0.14 -3.88 0.50 0.00 -0.81 0.00 0.00 33.47 29.14 2bwi s TRP 265 CO -0.02 -1.03 1.92 0.00 -0.51 0.00 0.00 176.95 177.31 2bwi h ALA 266 N 7.51 1.38 -0.66 0.98 0.00 -1.90 -1.23 119.26 125.34 2bwi h ALA 266 Ca 0.14 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.93 2bwi h ALA 266 Cb 0.98 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.52 2bwi h ALA 266 CO 0.87 0.49 0.00 0.25 0.00 0.00 0.00 179.25 180.87 2bwi n THR 267 N -4.36 1.14 -0.82 0.00 -2.24 -1.26 -4.19 114.28 102.55 2bwi n THR 267 Ca 0.06 -1.04 0.00 0.00 -2.27 0.00 0.00 64.05 60.80 2bwi n THR 267 Cb 0.12 0.44 0.00 0.00 -2.10 0.00 0.00 70.33 68.79 2bwi n THR 267 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2bwi n GLY 268 N 1.38 0.63 3.23 3.38 0.00 -0.54 -4.77 105.19 108.49 2bwi n GLY 268 Ca 0.23 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.90 2bwi n GLY 268 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2bwi s LYS 269 N -0.18 2.97 0.19 1.61 -0.14 -1.26 -0.82 119.74 122.10 2bwi s LYS 269 Ca 0.00 -0.89 0.24 0.00 -1.36 0.00 0.00 55.97 53.96 2bwi s LYS 269 Cb 0.00 -3.00 0.91 0.00 -1.68 0.00 0.00 37.83 34.06 2bwi s LYS 269 CO 0.00 -0.36 1.73 1.19 -0.76 0.00 0.00 175.35 177.15 2bwi n PHE 270 N 4.71 0.68 0.44 3.18 3.72 -1.11 -2.20 117.46 126.88 2bwi n PHE 270 Ca -0.17 0.24 0.12 0.00 -0.05 0.00 0.00 57.45 57.58 2bwi n PHE 270 Cb 0.48 -0.88 0.47 0.00 -0.94 0.00 0.00 39.48 38.61 2bwi n PHE 270 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 2bwi n ARG 271 N -2.09 0.18 -3.29 -1.08 1.74 -1.26 -4.72 116.66 106.14 2bwi n ARG 271 Ca 0.04 0.38 -0.35 0.00 -0.77 0.00 0.00 57.85 57.15 2bwi n ARG 271 Cb 0.30 -1.83 -0.06 0.00 -1.02 0.00 0.00 32.46 29.86 2bwi n ARG 271 CO 0.00 0.00 0.00 -0.80 -1.52 0.00 0.00 177.63 175.31 2bwi s ASN 272 N -4.16 6.86 0.36 0.55 0.01 -0.94 -5.06 114.94 112.56 2bwi s ASN 272 Ca 0.05 1.16 -0.28 0.00 -0.71 0.00 0.00 52.86 53.08 2bwi s ASN 272 Cb 0.10 -2.32 -0.10 0.00 0.41 0.00 0.00 41.25 39.33 2bwi s ASN 272 CO 0.41 0.05 1.39 -2.16 -1.51 0.00 0.00 177.10 175.27 2bwi s PRO 273 N -2.10 4.21 0.61 -0.60 0.04 -1.26 -4.97 135.00 130.93 2bwi s PRO 273 Ca 0.41 2.37 -0.16 0.00 0.04 0.00 0.00 61.00 63.65 2bwi s PRO 273 Cb -0.15 -3.00 -0.02 0.00 0.04 0.00 0.00 34.50 31.37 2bwi s PRO 273 CO 0.20 -0.37 1.10 -1.25 0.04 0.00 0.00 177.00 176.72 2bwi s PRO 274 N -1.96 3.07 0.19 0.56 0.04 -1.26 -4.96 135.00 130.68 2bwi s PRO 274 Ca 0.51 1.39 -0.30 0.00 0.04 0.00 0.00 61.00 62.65 2bwi s PRO 274 Cb -0.43 -1.99 -0.08 0.00 0.04 0.00 0.00 34.50 32.05 2bwi s PRO 274 CO 0.57 -1.03 1.07 -0.51 0.04 0.00 0.00 177.00 177.14 2bwi s ASP 275 N -2.44 7.33 0.00 6.66 1.01 0.21 -4.77 116.67 124.67 2bwi s ASP 275 Ca 0.67 2.07 -0.04 0.00 0.71 0.00 0.00 52.55 55.97 2bwi s ASP 275 Cb -0.20 -2.61 -0.04 0.00 1.01 0.00 0.00 42.92 41.08 2bwi s ASP 275 CO 0.37 -0.16 0.21 -0.76 0.21 0.00 0.00 175.17 175.04 2bwi s LEU 276 N -0.56 4.37 -1.51 1.23 1.43 -1.26 -0.59 118.68 121.78 2bwi s LEU 276 Ca 0.48 0.41 0.00 0.00 -1.03 0.00 0.00 54.13 53.98 2bwi s LEU 276 Cb -0.29 -2.66 0.00 0.00 0.03 0.00 0.00 46.19 43.27 2bwi s LEU 276 CO 0.35 0.25 0.00 0.47 0.23 0.00 0.00 176.35 177.65 2bwi n ASP 277 N 0.94 -5.03 -4.77 2.29 8.00 -0.75 -4.94 116.55 112.29 2bwi n ASP 277 Ca -0.10 0.05 -0.40 0.00 0.71 0.00 0.00 54.79 55.04 2bwi n ASP 277 Cb 0.53 -4.11 -0.02 0.00 -0.02 0.00 0.00 41.12 37.50 2bwi n ASP 277 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 2bwi s GLN 278 N -4.64 4.26 -0.11 -1.24 -1.52 -0.16 -4.83 119.66 111.41 2bwi s GLN 278 Ca 0.00 2.24 -0.24 0.00 -1.95 0.00 0.00 55.36 55.41 2bwi s GLN 278 Cb 0.00 -3.00 -0.28 0.00 -0.22 0.00 0.00 33.01 29.51 2bwi s GLN 278 CO 0.00 -0.28 0.74 1.05 -0.25 0.00 0.00 175.29 176.55 2bwi h GLU 279 N 3.21 0.14 -3.16 2.91 4.11 -1.92 -0.42 114.58 119.45 2bwi h GLU 279 Ca -0.49 -0.24 -0.11 0.00 0.07 0.00 0.00 59.36 58.59 2bwi h GLU 279 Cb 1.23 0.09 -0.19 0.00 0.50 0.00 0.00 28.75 30.38 2bwi h GLU 279 CO 0.65 1.11 -0.28 0.99 0.07 0.00 0.00 179.01 181.55 2bwi s THR 280 N -2.34 0.07 0.10 -1.06 2.01 -1.26 -4.39 115.64 108.77 2bwi s THR 280 Ca -0.18 -0.57 -0.05 0.00 0.31 0.00 0.00 61.69 61.20 2bwi s THR 280 Cb 0.00 -0.71 -0.02 0.00 0.01 0.00 0.00 72.50 71.77 2bwi s THR 280 CO 0.74 -0.31 0.11 -1.66 -0.69 0.00 0.00 174.62 172.81 2bwi s TRP 281 N -1.75 0.44 -0.32 4.92 -2.14 -1.18 -5.01 118.94 113.89 2bwi s TRP 281 Ca -0.11 -0.89 -0.07 0.00 2.66 0.00 0.00 56.10 57.69 2bwi s TRP 281 Cb -0.04 -0.24 0.02 0.00 -3.10 0.00 0.00 33.47 30.11 2bwi s TRP 281 CO 0.02 -0.52 0.10 -1.17 -2.66 0.00 0.00 176.95 172.72 2bwi s LEU 282 N -2.93 4.12 -0.41 -4.66 1.98 -1.26 -3.15 118.68 112.37 2bwi s LEU 282 Ca 0.11 -0.92 -0.16 0.00 -2.89 0.00 0.00 54.13 50.26 2bwi s LEU 282 Cb 0.06 -1.89 0.02 0.00 0.66 0.00 0.00 46.19 45.04 2bwi s LEU 282 CO -0.07 -0.27 0.39 -0.63 -1.89 0.00 0.00 176.35 173.89 2bwi s ILE 283 N 1.46 5.14 0.54 6.68 1.01 -0.44 -4.61 121.20 130.99 2bwi s ILE 283 Ca 0.01 -0.43 -0.20 0.00 0.00 0.00 0.00 60.65 60.02 2bwi s ILE 283 Cb -0.18 -4.00 -0.05 0.00 0.01 0.00 0.00 42.46 38.24 2bwi s ILE 283 CO 0.03 -0.38 1.21 -2.84 0.00 0.00 0.00 174.94 172.97 2bwi s PRO 284 N 1.99 3.25 0.29 2.79 0.02 -1.26 -1.16 135.00 140.92 2bwi s PRO 284 Ca 0.10 1.86 -0.30 0.00 0.02 0.00 0.00 61.00 62.68 2bwi s PRO 284 Cb -0.18 -2.12 -0.13 0.00 0.02 0.00 0.00 34.50 32.10 2bwi s PRO 284 CO 0.12 -0.99 1.40 0.41 -0.33 0.00 0.00 177.00 177.61 2bwi n GLY 285 N 0.49 0.81 1.11 0.52 0.00 -1.20 -1.92 105.19 105.00 2bwi n GLY 285 Ca 0.11 0.42 0.00 0.00 0.00 0.00 0.00 46.02 46.55 2bwi n GLY 285 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bwi n GLY 286 N 1.62 0.68 3.08 -0.02 0.00 0.45 -4.79 105.19 106.22 2bwi n GLY 286 Ca 0.08 -0.41 -0.11 0.00 0.00 0.00 0.00 46.02 45.58 2bwi n GLY 286 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2bwi s THR 287 N -2.00 0.48 -0.05 2.61 2.01 -0.81 -4.75 115.64 113.13 2bwi s THR 287 Ca 0.00 -1.34 0.01 0.00 0.31 0.00 0.00 61.69 60.68 2bwi s THR 287 Cb 0.00 -0.91 -0.03 0.00 0.01 0.00 0.00 72.50 71.57 2bwi s THR 287 CO 0.00 -0.58 -0.06 0.00 -0.69 0.00 0.00 174.62 173.28 2bwi s ALA 288 N -2.19 3.02 0.41 7.40 0.00 -1.26 -2.06 121.76 127.08 2bwi s ALA 288 Ca -0.04 -0.93 0.04 0.00 0.00 0.00 0.00 51.96 51.04 2bwi s ALA 288 Cb -0.04 -1.21 -0.05 0.00 0.00 0.00 0.00 23.12 21.81 2bwi s ALA 288 CO -0.02 0.59 0.04 0.20 0.00 0.00 0.00 175.76 176.56 2bwi s GLY 289 N -1.02 2.54 -0.09 0.00 0.00 -0.04 -3.11 107.32 105.59 2bwi s GLY 289 Ca 0.14 -1.63 -0.07 0.00 0.00 0.00 0.00 44.72 43.17 2bwi s GLY 289 CO 0.04 -2.02 0.23 0.00 0.00 0.00 0.00 173.10 171.35 2bwi s ALA 290 N -2.97 -0.55 -0.04 3.20 0.00 -0.73 -1.10 121.76 119.57 2bwi s ALA 290 Ca 0.27 0.80 0.04 0.00 0.00 0.00 0.00 51.96 53.06 2bwi s ALA 290 Cb 0.07 -0.49 -0.00 0.00 0.00 0.00 0.00 23.12 22.70 2bwi s ALA 290 CO 0.13 -0.15 -0.15 0.00 0.00 0.00 0.00 175.76 175.60 2bwi s ALA 291 N 0.64 1.36 -0.15 0.00 0.00 -0.59 -1.03 121.76 121.98 2bwi s ALA 291 Ca -0.04 -0.59 -0.02 0.00 0.00 0.00 0.00 51.96 51.30 2bwi s ALA 291 Cb -0.06 -0.47 -0.02 0.00 0.00 0.00 0.00 23.12 22.58 2bwi s ALA 291 CO -0.04 0.23 -0.07 0.12 0.00 0.00 0.00 175.76 176.01 2bwi s PHE 292 N 0.11 2.94 -0.02 0.00 2.19 0.19 -0.77 117.98 122.63 2bwi s PHE 292 Ca -0.04 -0.49 -0.01 0.00 0.33 0.00 0.00 56.93 56.72 2bwi s PHE 292 Cb -0.11 -1.93 0.00 0.00 -1.31 0.00 0.00 43.02 39.67 2bwi s PHE 292 CO 0.02 -0.15 0.04 -0.47 1.83 0.00 0.00 175.22 176.48 2bwi s TYR 293 N 0.48 -0.04 -0.32 10.12 5.04 -0.44 -1.06 117.35 131.12 2bwi s TYR 293 Ca -0.06 0.11 -0.11 0.00 -2.44 0.00 0.00 57.07 54.57 2bwi s TYR 293 Cb -0.15 0.01 -0.01 0.00 0.35 0.00 0.00 41.96 42.15 2bwi s TYR 293 CO 0.03 -0.02 0.20 0.99 -1.34 0.00 0.00 175.55 175.41 2bwi s THR 294 N 0.06 4.99 0.36 4.34 2.01 -1.26 -0.72 115.64 125.41 2bwi s THR 294 Ca -0.00 -0.29 -0.28 0.00 0.31 0.00 0.00 61.69 61.43 2bwi s THR 294 Cb -0.01 -3.55 -0.10 0.00 0.01 0.00 0.00 72.50 68.86 2bwi s THR 294 CO -0.00 0.04 1.34 -0.36 -0.69 0.00 0.00 174.62 174.95 2bwi s PHE 295 N 1.68 2.89 0.00 4.92 0.08 -0.79 -4.88 117.98 121.87 2bwi s PHE 295 Ca 0.05 1.36 0.00 0.00 0.12 0.00 0.00 56.93 58.47 2bwi s PHE 295 Cb -0.17 -3.75 0.00 0.00 -0.57 0.00 0.00 43.02 38.53 2bwi s PHE 295 CO 0.09 -2.15 0.00 0.54 -0.10 0.00 0.00 175.22 173.59 2bwi n ARG 296 N 0.54 5.54 -3.91 0.44 1.74 -1.26 -0.31 116.66 119.45 2bwi n ARG 296 Ca 0.01 0.00 -0.11 0.00 -0.77 0.00 0.00 57.85 56.98 2bwi n ARG 296 Cb 0.42 -0.43 -0.12 0.00 -1.02 0.00 0.00 32.46 31.31 2bwi n ARG 296 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 2bwi s GLN 297 N -0.85 0.19 0.85 5.56 -1.52 -1.26 -4.68 119.66 117.95 2bwi s GLN 297 Ca 0.00 -0.27 -0.12 0.00 -1.95 0.00 0.00 55.36 53.03 2bwi s GLN 297 Cb 0.00 0.07 0.14 0.00 -0.22 0.00 0.00 33.01 33.00 2bwi s GLN 297 CO 0.00 -0.03 1.19 -1.25 -0.25 0.00 0.00 175.29 174.95 2bwi s PRO 298 N -0.72 1.37 0.00 2.91 0.04 -1.26 -4.82 135.00 132.52 2bwi s PRO 298 Ca -0.08 -0.33 0.00 0.00 0.04 0.00 0.00 61.00 60.63 2bwi s PRO 298 Cb -0.05 -1.99 0.00 0.00 0.04 0.00 0.00 34.50 32.50 2bwi s PRO 298 CO -0.00 -1.88 0.00 0.41 0.04 0.00 0.00 177.00 175.56 2bwi n GLY 299 N -3.39 -0.62 3.73 0.56 0.00 0.01 -4.92 105.19 100.56 2bwi n GLY 299 Ca 0.12 -2.20 -0.40 0.00 0.00 0.00 0.00 46.02 43.54 2bwi n GLY 299 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2bwi s VAL 300 N 0.00 4.87 0.11 1.61 1.01 -1.26 -1.16 120.40 125.57 2bwi s VAL 300 Ca 0.00 1.59 0.09 0.00 0.00 0.00 0.00 61.98 63.67 2bwi s VAL 300 Cb 0.00 -4.10 -0.04 0.00 0.00 0.00 0.00 36.38 32.24 2bwi s VAL 300 CO 0.00 0.30 -0.21 -0.31 0.00 0.00 0.00 175.10 174.88 2bwi s TYR 301 N 0.36 2.45 0.11 5.22 1.51 -0.24 -4.99 117.35 121.77 2bwi s TYR 301 Ca 0.39 -0.31 -0.04 0.00 -1.01 0.00 0.00 57.07 56.11 2bwi s TYR 301 Cb -0.19 -1.33 -0.05 0.00 -0.11 0.00 0.00 41.96 40.28 2bwi s TYR 301 CO 0.22 0.35 0.33 0.00 -1.11 0.00 0.00 175.55 175.33 2bwi s ALA 302 N -1.08 3.85 -0.13 3.71 0.00 -1.25 -1.19 121.76 125.68 2bwi s ALA 302 Ca 0.16 -0.63 0.00 0.00 0.00 0.00 0.00 51.96 51.49 2bwi s ALA 302 Cb -0.10 -2.05 0.02 0.00 0.00 0.00 0.00 23.12 20.99 2bwi s ALA 302 CO 0.08 0.71 -0.12 -0.47 0.00 0.00 0.00 175.76 175.96 2bwi s TYR 303 N -1.59 1.92 0.06 0.00 5.04 0.14 -0.68 117.35 122.24 2bwi s TYR 303 Ca 0.38 -1.03 0.00 0.00 -2.44 0.00 0.00 57.07 53.99 2bwi s TYR 303 Cb -0.12 -1.45 -0.04 0.00 0.35 0.00 0.00 41.96 40.69 2bwi s TYR 303 CO 0.25 -0.59 -0.04 0.14 -1.34 0.00 0.00 175.55 173.96 2bwi s VAL 304 N 1.49 0.39 -0.17 3.14 -7.23 -0.34 -0.78 120.40 116.91 2bwi s VAL 304 Ca 0.04 -1.75 -0.29 0.00 -1.81 0.00 0.00 61.98 58.16 2bwi s VAL 304 Cb -0.13 -1.44 -0.01 0.00 0.56 0.00 0.00 36.38 35.36 2bwi s VAL 304 CO -0.09 -0.89 1.21 0.21 -0.31 0.00 0.00 175.10 175.23 2bwi s ASN 305 N -2.79 6.99 -0.03 4.85 3.84 -0.85 -1.12 114.94 125.83 2bwi s ASN 305 Ca 0.06 1.64 0.01 0.00 0.21 0.00 0.00 52.86 54.78 2bwi s ASN 305 Cb 0.05 -2.54 0.07 0.00 -0.55 0.00 0.00 41.25 38.28 2bwi s ASN 305 CO -0.07 -0.72 0.70 1.57 -2.79 0.00 0.00 177.10 175.79 2bwi n HIS 306 N 6.37 0.21 -2.71 0.43 -0.00 0.05 -3.97 115.22 115.61 2bwi n HIS 306 Ca 0.13 -0.16 -0.42 0.00 -0.00 0.00 0.00 57.72 57.27 2bwi n HIS 306 Cb 0.45 -0.17 -0.03 0.00 -0.00 0.00 0.00 29.99 30.24 2bwi n HIS 306 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 176.34 177.55 2bwi s ASN 307 N 0.08 6.19 0.57 0.26 3.84 -1.26 -4.92 114.94 119.70 2bwi s ASN 307 Ca 0.05 -0.79 0.33 0.00 0.21 0.00 0.00 52.86 52.66 2bwi s ASN 307 Cb 0.04 -2.49 1.70 0.00 -0.55 0.00 0.00 41.25 39.95 2bwi s ASN 307 CO 0.01 -1.62 2.14 -0.07 -2.79 0.00 0.00 177.10 174.77 2bwi h LEU 308 N 12.16 0.00 -0.12 3.21 3.38 -1.99 -0.33 115.31 131.62 2bwi h LEU 308 Ca -0.25 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.70 2bwi h LEU 308 Cb 1.06 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.80 2bwi h LEU 308 CO 1.24 0.06 -0.01 0.40 0.09 0.00 0.00 178.44 180.21 2bwi h ILE 309 N 0.00 1.27 -0.99 1.22 2.04 -1.91 -0.64 117.51 118.50 2bwi h ILE 309 Ca -0.00 -0.88 0.05 0.00 1.00 0.00 0.00 64.86 65.03 2bwi h ILE 309 Cb 0.28 1.62 -0.06 0.00 -0.74 0.00 0.00 36.82 37.92 2bwi h ILE 309 CO 0.01 0.25 0.64 -0.33 0.00 0.00 0.00 178.15 178.72 2bwi h GLU 310 N -0.08 1.18 0.64 2.37 5.08 -1.44 -0.27 114.58 122.05 2bwi h GLU 310 Ca 0.03 -0.07 -0.03 0.00 -1.00 0.00 0.00 59.36 58.29 2bwi h GLU 310 Cb 0.39 -0.27 0.01 0.00 0.50 0.00 0.00 28.75 29.39 2bwi h GLU 310 CO 0.01 0.78 -0.31 0.00 -1.00 0.00 0.00 179.01 178.49 2bwi h ALA 311 N 1.44 -0.86 0.00 3.43 0.00 -1.12 -1.09 119.26 121.07 2bwi h ALA 311 Ca 0.40 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 55.12 2bwi h ALA 311 Cb 0.06 0.33 0.00 0.00 0.00 0.00 0.00 17.79 18.18 2bwi h ALA 311 CO -0.14 -0.81 -1.47 1.19 0.00 0.00 0.00 179.25 178.03 2bwi n PHE 312 N -5.35 0.07 -0.11 0.00 3.72 -0.25 -2.09 117.46 113.45 2bwi n PHE 312 Ca -0.11 0.02 -0.15 0.00 -0.05 0.00 0.00 57.45 57.16 2bwi n PHE 312 Cb 0.34 -0.33 -0.10 0.00 -0.94 0.00 0.00 39.48 38.46 2bwi n PHE 312 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 2bwi n GLU 313 N -1.96 0.55 -0.00 -1.08 -0.58 -0.17 -4.78 120.64 112.62 2bwi n GLU 313 Ca -0.00 0.12 0.09 0.00 -0.42 0.00 0.00 57.16 56.95 2bwi n GLU 313 Cb 0.46 -1.43 -0.11 0.00 -0.57 0.00 0.00 31.44 29.79 2bwi n GLU 313 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 2bwi n LEU 314 N -3.13 0.90 0.00 -4.62 4.77 -0.84 -5.02 117.00 109.06 2bwi n LEU 314 Ca -0.38 -0.49 0.00 0.00 -0.03 0.00 0.00 56.01 55.11 2bwi n LEU 314 Cb 0.91 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 42.00 2bwi n LEU 314 CO 0.22 0.22 0.00 0.61 -1.33 0.00 0.00 177.39 177.11 2bwi n GLY 315 N 1.46 1.00 2.62 -0.72 0.00 -0.78 -1.52 105.19 107.25 2bwi n GLY 315 Ca 0.04 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.65 2bwi n GLY 315 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bwi n ALA 316 N 0.00 6.29 -3.68 4.61 0.00 0.06 -4.03 120.51 123.76 2bwi n ALA 316 Ca 0.00 -4.17 -0.11 0.00 0.00 0.00 0.00 53.44 49.16 2bwi n ALA 316 Cb 0.00 -2.85 -0.12 0.00 0.00 0.00 0.00 19.45 16.49 2bwi n ALA 316 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2bwi s ALA 317 N -0.59 -0.87 0.43 0.00 0.00 -1.25 -2.01 121.76 117.46 2bwi s ALA 317 Ca 0.49 1.32 0.04 0.00 0.00 0.00 0.00 51.96 53.81 2bwi s ALA 317 Cb 0.15 -0.81 -0.02 0.00 0.00 0.00 0.00 23.12 22.44 2bwi s ALA 317 CO -0.06 -0.24 0.15 0.20 0.00 0.00 0.00 175.76 175.81 2bwi s GLY 318 N 1.29 2.72 0.08 0.00 0.00 0.04 -4.54 107.32 106.91 2bwi s GLY 318 Ca -0.09 -1.14 0.07 0.00 0.00 0.00 0.00 44.72 43.56 2bwi s GLY 318 CO -0.11 -1.83 -0.20 0.30 0.00 0.00 0.00 173.10 171.27 2bwi s HIS 319 N -3.17 1.69 -0.04 1.90 3.76 -0.04 -0.69 115.29 118.70 2bwi s HIS 319 Ca 0.22 -0.41 0.00 0.00 -0.15 0.00 0.00 55.06 54.73 2bwi s HIS 319 Cb 0.01 -0.95 -0.03 0.00 1.11 0.00 0.00 32.58 32.72 2bwi s HIS 319 CO 0.15 0.15 -0.00 -0.06 -0.85 0.00 0.00 174.74 174.13 2bwi s PHE 320 N -1.06 3.09 -0.25 1.40 0.08 -0.33 -1.12 117.98 119.79 2bwi s PHE 320 Ca 0.05 0.12 -0.04 0.00 0.12 0.00 0.00 56.93 57.18 2bwi s PHE 320 Cb -0.10 -1.72 0.00 0.00 -0.57 0.00 0.00 43.02 40.64 2bwi s PHE 320 CO 0.03 0.45 -0.00 0.15 -0.10 0.00 0.00 175.22 175.75 2bwi s LYS 321 N -1.25 3.17 -0.14 0.44 1.02 0.15 -1.08 119.74 122.04 2bwi s LYS 321 Ca 0.17 -0.78 -0.01 0.00 0.02 0.00 0.00 55.97 55.37 2bwi s LYS 321 Cb -0.11 -3.13 -0.01 0.00 -0.52 0.00 0.00 37.83 34.05 2bwi s LYS 321 CO 0.07 -0.32 -0.12 0.08 -0.92 0.00 0.00 175.35 174.14 2bwi s VAL 322 N 1.45 3.13 -0.11 3.17 1.01 -0.31 -2.67 120.40 126.08 2bwi s VAL 322 Ca 0.03 -0.63 -0.06 0.00 0.00 0.00 0.00 61.98 61.33 2bwi s VAL 322 Cb -0.16 -2.33 -0.04 0.00 0.00 0.00 0.00 36.38 33.85 2bwi s VAL 322 CO -0.01 0.51 0.13 -0.89 0.00 0.00 0.00 175.10 174.83 2bwi s THR 323 N 0.49 5.37 -5.00 3.92 2.01 -0.51 -0.81 115.64 121.10 2bwi s THR 323 Ca -0.08 0.14 0.00 0.00 0.31 0.00 0.00 61.69 62.05 2bwi s THR 323 Cb -0.16 -3.34 0.00 0.00 0.01 0.00 0.00 72.50 69.02 2bwi s THR 323 CO 0.04 0.60 0.00 0.61 -0.69 0.00 0.00 174.62 175.18 2bwi n GLY 324 N 1.95 0.84 3.80 4.40 0.00 -1.26 -1.23 105.19 113.69 2bwi n GLY 324 Ca -0.19 -1.85 -0.36 0.00 0.00 0.00 0.00 46.02 43.62 2bwi n GLY 324 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2bwi s GLU 325 N -2.00 4.38 0.01 1.61 1.03 -1.26 -4.65 118.70 117.82 2bwi s GLU 325 Ca 0.00 1.11 -0.24 0.00 0.03 0.00 0.00 54.97 55.87 2bwi s GLU 325 Cb 0.00 -2.68 -0.05 0.00 -0.80 0.00 0.00 34.13 30.60 2bwi s GLU 325 CO 0.00 0.24 0.72 -0.46 -1.33 0.00 0.00 175.26 174.43 2bwi s TRP 326 N -1.73 3.69 -0.47 4.83 -0.11 -1.26 -4.20 118.94 119.70 2bwi s TRP 326 Ca 0.51 1.37 -0.12 0.00 1.22 0.00 0.00 56.10 59.08 2bwi s TRP 326 Cb -0.16 -2.77 0.10 0.00 -1.50 0.00 0.00 33.47 29.14 2bwi s TRP 326 CO 0.20 0.25 0.36 1.21 -4.62 0.00 0.00 176.95 174.36 2bwi s ASN 327 N 0.09 5.87 0.48 5.86 3.84 -1.26 -4.96 114.94 124.86 2bwi s ASN 327 Ca 0.37 -1.67 0.31 0.00 0.21 0.00 0.00 52.86 52.07 2bwi s ASN 327 Cb -0.19 -2.08 1.19 0.00 -0.55 0.00 0.00 41.25 39.61 2bwi s ASN 327 CO 0.21 -0.68 1.90 0.44 -2.79 0.00 0.00 177.10 176.18 2bwi h ASP 328 N 8.59 0.00 -0.50 -4.21 3.32 -1.98 -2.52 116.42 119.12 2bwi h ASP 328 Ca -0.25 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 56.75 2bwi h ASP 328 Cb 1.09 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.62 2bwi h ASP 328 CO 0.87 0.00 0.11 -0.78 -1.72 0.00 0.00 179.24 177.73 2bwi h ASP 329 N 0.00 0.76 -0.37 6.45 3.58 -2.02 -3.20 116.42 121.61 2bwi h ASP 329 Ca 0.00 -0.24 -0.14 0.00 0.42 0.00 0.00 57.03 57.08 2bwi h ASP 329 Cb 0.54 -0.20 -0.01 0.00 1.72 0.00 0.00 39.33 41.38 2bwi h ASP 329 CO 0.00 0.80 -0.31 0.25 -2.88 0.00 0.00 179.24 177.10 2bwi h LEU 330 N 0.68 0.91 -7.01 2.28 5.85 -1.90 -3.46 115.31 112.67 2bwi h LEU 330 Ca 0.15 -0.45 -0.04 0.00 0.84 0.00 0.00 57.88 58.38 2bwi h LEU 330 Cb 0.34 -0.26 -0.21 0.00 0.37 0.00 0.00 40.66 40.90 2bwi h LEU 330 CO 0.00 1.17 0.11 -0.32 -0.34 0.00 0.00 178.44 179.07 2bwi s MET 331 N -4.46 0.82 0.01 1.25 1.75 -0.99 -5.14 119.30 112.55 2bwi s MET 331 Ca -0.12 0.98 -0.20 0.00 -1.25 0.00 0.00 55.69 55.11 2bwi s MET 331 Cb 0.10 0.40 0.04 0.00 2.84 0.00 0.00 34.83 38.22 2bwi s MET 331 CO 0.86 -0.10 0.45 -0.08 -0.65 0.00 0.00 175.02 175.50 2bwi s THR 332 N 0.38 0.04 -0.40 10.11 -1.32 -1.25 -4.07 115.64 119.13 2bwi s THR 332 Ca -0.00 -0.35 -0.27 0.00 -1.21 0.00 0.00 61.69 59.86 2bwi s THR 332 Cb -0.05 -0.87 0.02 0.00 -1.51 0.00 0.00 72.50 70.10 2bwi s THR 332 CO 0.01 -0.19 1.00 -0.55 -2.21 0.00 0.00 174.62 172.68 2bwi s SER 333 N -1.65 6.68 -0.06 8.08 0.15 -1.26 -4.92 113.70 120.72 2bwi s SER 333 Ca -0.09 0.56 -0.27 0.00 0.70 0.00 0.00 55.95 56.85 2bwi s SER 333 Cb -0.02 -2.50 -0.22 0.00 -1.71 0.00 0.00 66.02 61.57 2bwi s SER 333 CO 0.02 -0.99 1.08 0.58 1.20 0.00 0.00 173.24 175.13 2bwi h VAL 334 N 5.95 1.54 -3.37 4.45 2.07 -2.02 -3.42 116.25 121.45 2bwi h VAL 334 Ca -0.23 -1.62 -0.54 0.00 0.82 0.00 0.00 66.70 65.13 2bwi h VAL 334 Cb 1.07 2.62 -0.39 0.00 -1.52 0.00 0.00 31.29 33.07 2bwi h VAL 334 CO 1.03 0.43 -0.78 -0.69 0.02 0.00 0.00 177.57 177.58 2bwi s VAL 335 N -3.48 0.91 0.69 2.57 1.01 -1.26 -5.14 120.40 115.70 2bwi s VAL 335 Ca -0.17 -0.68 -0.16 0.00 0.00 0.00 0.00 61.98 60.97 2bwi s VAL 335 Cb 0.00 -1.24 0.02 0.00 0.00 0.00 0.00 36.38 35.15 2bwi s VAL 335 CO 0.69 -0.06 1.18 -0.54 0.00 0.00 0.00 175.10 176.37 2bwi s LYS 336 N 1.70 2.45 0.15 2.72 1.02 -1.26 -4.89 119.74 121.62 2bwi s LYS 336 Ca -0.01 1.68 -0.34 0.00 0.02 0.00 0.00 55.97 57.32 2bwi s LYS 336 Cb -0.17 -1.88 -0.16 0.00 -0.52 0.00 0.00 37.83 35.11 2bwi s LYS 336 CO -0.07 -1.58 1.24 -2.30 -0.92 0.00 0.00 175.35 171.72 2bwi n PRO 337 N -2.44 1.22 -3.45 -1.68 -0.02 -1.26 -4.95 135.00 122.42 2bwi n PRO 337 Ca 0.13 0.44 -0.12 0.00 -2.02 0.00 0.00 63.50 61.93 2bwi n PRO 337 Cb 0.51 -2.00 -0.02 0.00 -0.02 0.00 0.00 33.50 31.97 2bwi n PRO 337 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2bwi s ALA 338 N 0.07 -1.66 0.35 3.55 0.00 -1.26 -5.15 121.76 117.66 2bwi s ALA 338 Ca 0.77 0.66 -0.28 0.00 0.00 0.00 0.00 51.96 53.11 2bwi s ALA 338 Cb -0.87 0.72 -0.12 0.00 0.00 0.00 0.00 23.12 22.84 2bwi s ALA 338 CO 0.50 -0.72 1.36 0.43 0.00 0.00 0.00 175.76 177.32 2bwi n SER 339 N -0.26 3.09 0.00 0.00 7.64 -1.26 -5.27 113.62 117.57 2bwi n SER 339 Ca -0.15 1.21 0.00 0.00 1.01 0.00 0.00 58.87 60.94 2bwi n SER 339 Cb 0.64 -1.53 0.00 0.00 -1.01 0.00 0.00 64.21 62.31 2bwi n SER 339 CO 0.00 0.00 0.00 0.23 -3.01 0.00 0.00 175.04 172.26