#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1haw s ASP 2 N 0.00 6.82 0.24 1.08 2.15 -1.26 -4.92 116.67 120.78 1haw s ASP 2 Ca 0.00 2.58 -0.06 0.00 0.43 0.00 0.00 52.55 55.49 1haw s ASP 2 Cb 0.00 -2.63 0.30 0.00 -0.30 0.00 0.00 42.92 40.29 1haw s ASP 2 CO 0.00 -0.53 1.86 0.00 -0.17 0.00 0.00 175.17 176.33 1haw h ALA 3 N 4.25 1.16 0.00 3.66 0.00 -2.01 -1.33 119.26 124.98 1haw h ALA 3 Ca -0.47 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.42 1haw h ALA 3 Cb 1.22 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 18.75 1haw h ALA 3 CO 0.71 0.34 -0.00 -0.44 0.00 0.00 0.00 179.25 179.85 1haw h ASP 4 N 1.02 0.00 -0.01 0.00 3.32 -2.00 -2.80 116.42 115.96 1haw h ASP 4 Ca 0.36 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.41 1haw h ASP 4 Cb 0.09 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.64 1haw h ASP 4 CO -0.14 0.00 -0.63 0.29 -1.72 0.00 0.00 179.24 177.04 1haw n LYS 5 N -3.15 0.90 -1.60 3.56 5.02 -0.51 -4.95 118.16 117.43 1haw n LYS 5 Ca -0.03 -0.68 -0.33 0.00 -2.02 0.00 0.00 58.31 55.26 1haw n LYS 5 Cb 0.10 -1.47 0.07 0.00 -0.02 0.00 0.00 35.03 33.71 1haw n LYS 5 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1haw s LEU 6 N -2.61 3.32 0.52 -0.35 1.43 -1.06 -5.02 118.68 114.90 1haw s LEU 6 Ca 0.15 2.06 -0.21 0.00 -1.03 0.00 0.00 54.13 55.10 1haw s LEU 6 Cb 0.17 -4.56 -0.06 0.00 0.03 0.00 0.00 46.19 41.78 1haw s LEU 6 CO 0.65 -1.86 1.20 -2.16 0.23 0.00 0.00 176.35 174.42 1haw s PRO 7 N -4.16 3.43 0.02 1.29 0.04 -1.26 -4.74 135.00 129.61 1haw s PRO 7 Ca 0.68 1.84 0.07 0.00 0.04 0.00 0.00 61.00 63.62 1haw s PRO 7 Cb -0.22 -2.22 -0.03 0.00 0.04 0.00 0.00 34.50 32.07 1haw s PRO 7 CO 0.44 -0.84 -0.18 -1.01 0.04 0.00 0.00 177.00 175.45 1haw s HIS 8 N -1.55 2.57 0.01 0.56 3.76 -1.26 -0.68 115.29 118.71 1haw s HIS 8 Ca 0.69 -0.25 -0.10 0.00 -0.15 0.00 0.00 55.06 55.25 1haw s HIS 8 Cb -0.30 -1.49 0.01 0.00 1.11 0.00 0.00 32.58 31.90 1haw s HIS 8 CO 0.35 0.23 0.20 -0.08 -0.85 0.00 0.00 174.74 174.59 1haw s THR 9 N -0.88 0.08 -0.11 1.30 -1.32 -0.40 -4.95 115.64 109.37 1haw s THR 9 Ca 0.14 -0.67 -0.02 0.00 -1.21 0.00 0.00 61.69 59.94 1haw s THR 9 Cb -0.10 -0.58 -0.03 0.00 -1.51 0.00 0.00 72.50 70.27 1haw s THR 9 CO 0.04 -0.37 -0.04 -0.54 -2.21 0.00 0.00 174.62 171.51 1haw s LYS 10 N -1.61 3.22 -0.05 7.08 1.02 -1.26 -0.17 119.74 127.97 1haw s LYS 10 Ca -0.13 -0.50 0.03 0.00 0.02 0.00 0.00 55.97 55.40 1haw s LYS 10 Cb -0.06 -2.79 -0.03 0.00 -0.52 0.00 0.00 37.83 34.44 1haw s LYS 10 CO 0.01 0.49 -0.13 0.08 -0.92 0.00 0.00 175.35 174.88 1haw s VAL 11 N -0.31 3.18 -0.36 3.17 1.01 -0.82 -4.94 120.40 121.32 1haw s VAL 11 Ca 0.05 -0.70 -0.15 0.00 0.00 0.00 0.00 61.98 61.18 1haw s VAL 11 Cb -0.12 -2.26 -0.00 0.00 0.00 0.00 0.00 36.38 33.99 1haw s VAL 11 CO 0.02 0.58 0.32 -0.89 0.00 0.00 0.00 175.10 175.13 1haw s THR 12 N -0.76 5.21 0.39 3.92 2.01 -1.26 -4.73 115.64 120.43 1haw s THR 12 Ca 0.12 -0.22 -0.24 0.00 0.31 0.00 0.00 61.69 61.66 1haw s THR 12 Cb -0.11 -3.83 -0.09 0.00 0.01 0.00 0.00 72.50 68.48 1haw s THR 12 CO 0.01 -0.15 1.05 -0.76 -0.69 0.00 0.00 174.62 174.08 1haw s LEU 13 N 1.88 4.16 0.33 4.42 1.43 -1.26 -4.86 118.68 124.77 1haw s LEU 13 Ca 0.09 2.04 0.10 0.00 -1.03 0.00 0.00 54.13 55.33 1haw s LEU 13 Cb -0.17 -4.16 -0.06 0.00 0.03 0.00 0.00 46.19 41.83 1haw s LEU 13 CO 0.11 -0.48 -0.06 0.68 0.23 0.00 0.00 176.35 176.83 1haw s VAL 14 N -1.64 2.46 0.34 -1.59 -7.23 -1.26 -5.05 120.40 106.43 1haw s VAL 14 Ca 0.57 -2.13 -0.21 0.00 -1.81 0.00 0.00 61.98 58.40 1haw s VAL 14 Cb -0.22 -2.67 -0.10 0.00 0.56 0.00 0.00 36.38 33.95 1haw s VAL 14 CO 0.28 -0.23 0.87 0.00 -0.31 0.00 0.00 175.10 175.71 1haw s ALA 15 N -2.55 3.21 0.65 1.32 0.00 -1.26 -4.64 121.76 118.49 1haw s ALA 15 Ca 0.33 0.34 -0.18 0.00 0.00 0.00 0.00 51.96 52.45 1haw s ALA 15 Cb 0.00 -3.03 -0.02 0.00 0.00 0.00 0.00 23.12 20.07 1haw s ALA 15 CO 0.18 0.22 1.12 -2.30 0.00 0.00 0.00 175.76 174.97 1haw n PRO 16 N 0.05 0.90 -0.07 0.00 -0.02 -1.26 -2.19 135.00 132.41 1haw n PRO 16 Ca 0.03 0.36 0.09 0.00 -2.02 0.00 0.00 63.50 61.97 1haw n PRO 16 Cb 0.52 -2.35 0.38 0.00 -0.02 0.00 0.00 33.50 32.03 1haw n PRO 16 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 1haw n PRO 17 N -1.62 1.56 -1.66 0.52 -0.04 -1.26 -5.07 135.00 127.44 1haw n PRO 17 Ca 0.15 -0.85 -0.30 0.00 -0.04 0.00 0.00 63.50 62.45 1haw n PRO 17 Cb 0.48 -1.35 0.07 0.00 -0.04 0.00 0.00 33.50 32.66 1haw n PRO 17 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 1haw s GLN 18 N -1.81 2.50 -0.03 0.54 -1.52 -0.93 -1.10 119.66 117.30 1haw s GLN 18 Ca 0.29 0.65 0.05 0.00 -1.95 0.00 0.00 55.36 54.41 1haw s GLN 18 Cb 0.15 -1.96 -0.01 0.00 -0.22 0.00 0.00 33.01 30.97 1haw s GLN 18 CO 0.23 -1.33 -0.18 0.08 -0.25 0.00 0.00 175.29 173.84 1haw s VAL 19 N -3.19 1.46 0.72 1.09 1.01 -1.26 -4.66 120.40 115.57 1haw s VAL 19 Ca 0.59 -0.76 -0.16 0.00 0.00 0.00 0.00 61.98 61.65 1haw s VAL 19 Cb -0.13 -1.23 0.03 0.00 0.00 0.00 0.00 36.38 35.05 1haw s VAL 19 CO 0.54 0.41 1.25 -1.38 0.00 0.00 0.00 175.10 175.92 1haw s HIS 20 N -0.23 1.97 0.43 5.22 -3.43 -1.26 -4.91 115.29 113.08 1haw s HIS 20 Ca 0.02 1.57 -0.25 0.00 -0.80 0.00 0.00 55.06 55.61 1haw s HIS 20 Cb -0.09 -3.59 -0.10 0.00 -1.43 0.00 0.00 32.58 27.37 1haw s HIS 20 CO 0.01 -2.86 1.20 -2.30 -2.00 0.00 0.00 174.74 168.79 1haw n PRO 21 N -2.53 1.74 -3.56 -0.38 -0.02 -1.26 -4.98 135.00 124.01 1haw n PRO 21 Ca 0.15 0.62 -0.09 0.00 -2.02 0.00 0.00 63.50 62.16 1haw n PRO 21 Cb 0.49 -2.30 -0.02 0.00 -0.02 0.00 0.00 33.50 31.65 1haw n PRO 21 CO 0.00 0.00 0.00 -3.38 1.98 0.00 0.00 175.50 174.10 1haw s HIS 22 N -1.23 -0.35 0.08 6.00 -3.43 -1.26 -5.05 115.29 110.05 1haw s HIS 22 Ca 0.62 0.12 -0.08 0.00 -0.80 0.00 0.00 55.06 54.93 1haw s HIS 22 Cb -0.51 0.58 -0.06 0.00 -1.43 0.00 0.00 32.58 31.16 1haw s HIS 22 CO 0.57 -0.77 0.37 -1.21 -2.00 0.00 0.00 174.74 171.69 1haw s GLU 23 N -3.45 3.69 0.00 -0.38 2.02 -1.26 -5.06 118.70 114.26 1haw s GLU 23 Ca 0.06 0.06 0.00 0.00 0.02 0.00 0.00 54.97 55.11 1haw s GLU 23 Cb -0.02 -2.97 0.00 0.00 0.10 0.00 0.00 34.13 31.24 1haw s GLU 23 CO -0.06 0.55 0.02 1.04 0.02 0.00 0.00 175.26 176.83 1haw n GLN 24 N 0.72 0.00 -2.90 1.61 6.02 -1.26 -4.81 117.38 116.76 1haw n GLN 24 Ca -0.07 0.06 -0.36 0.00 -0.01 0.00 0.00 57.00 56.62 1haw n GLN 24 Cb 0.52 -0.58 -0.06 0.00 1.02 0.00 0.00 30.24 31.14 1haw n GLN 24 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1haw s ALA 25 N -3.80 3.25 0.06 -1.58 0.00 -1.26 -4.28 121.76 114.15 1haw s ALA 25 Ca 0.00 0.37 0.05 0.00 0.00 0.00 0.00 51.96 52.37 1haw s ALA 25 Cb 0.00 -3.04 -0.03 0.00 0.00 0.00 0.00 23.12 20.05 1haw s ALA 25 CO 0.00 0.22 -0.13 -0.08 0.00 0.00 0.00 175.76 175.77 1haw s THR 26 N -1.70 1.00 -0.07 0.00 -1.32 -0.26 -4.94 115.64 108.36 1haw s THR 26 Ca 0.50 -1.25 0.13 0.00 -1.21 0.00 0.00 61.69 59.86 1haw s THR 26 Cb -0.16 -0.98 -0.23 0.00 -1.51 0.00 0.00 72.50 69.62 1haw s THR 26 CO 0.21 -0.25 0.56 0.29 -2.21 0.00 0.00 174.62 173.22 1haw n LYS 27 N 1.33 0.64 -1.27 7.08 5.02 -1.26 -4.75 118.16 124.96 1haw n LYS 27 Ca -0.21 0.25 -0.36 0.00 -2.02 0.00 0.00 58.31 55.96 1haw n LYS 27 Cb 0.54 -1.75 0.08 0.00 -0.02 0.00 0.00 35.03 33.88 1haw n LYS 27 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 1haw n SER 28 N -3.00 -0.79 -3.54 4.39 7.64 -1.26 -5.02 113.62 112.04 1haw n SER 28 Ca -0.20 0.60 -0.14 0.00 1.01 0.00 0.00 58.87 60.15 1haw n SER 28 Cb 1.07 -1.26 0.07 0.00 -1.01 0.00 0.00 64.21 63.07 1haw n SER 28 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1haw n GLY 29 N 1.49 0.82 3.68 0.23 0.00 -1.26 -5.04 105.19 105.12 1haw n GLY 29 Ca 0.11 -2.02 -0.41 0.00 0.00 0.00 0.00 46.02 43.70 1haw n GLY 29 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1haw n PRO 30 N -2.07 1.70 -4.28 1.61 -0.02 -1.26 -5.03 135.00 125.65 1haw n PRO 30 Ca 0.10 0.61 -0.17 0.00 -2.02 0.00 0.00 63.50 62.02 1haw n PRO 30 Cb 0.35 -2.30 -0.09 0.00 -0.02 0.00 0.00 33.50 31.44 1haw n PRO 30 CO 0.00 0.00 0.00 -1.59 1.98 0.00 0.00 175.50 175.89 1haw s LYS 31 N -2.24 1.51 -0.32 -0.52 -2.85 -1.26 -4.53 119.74 109.52 1haw s LYS 31 Ca 0.63 -1.84 -0.10 0.00 -1.00 0.00 0.00 55.97 53.66 1haw s LYS 31 Cb -0.51 0.09 -0.00 0.00 -2.06 0.00 0.00 37.83 35.35 1haw s LYS 31 CO 0.56 -0.47 0.16 0.08 0.10 0.00 0.00 175.35 175.78 1haw s VAL 32 N -3.74 4.56 -0.26 1.79 1.01 0.15 -0.90 120.40 123.00 1haw s VAL 32 Ca 0.38 -0.49 -0.09 0.00 0.00 0.00 0.00 61.98 61.78 1haw s VAL 32 Cb 0.05 -3.36 -0.03 0.00 0.00 0.00 0.00 36.38 33.04 1haw s VAL 32 CO 0.18 0.03 0.11 -0.69 0.00 0.00 0.00 175.10 174.73 1haw s VAL 33 N 1.60 4.63 -0.17 2.92 1.01 -0.22 -1.27 120.40 128.89 1haw s VAL 33 Ca 0.04 -0.08 -0.13 0.00 0.00 0.00 0.00 61.98 61.80 1haw s VAL 33 Cb -0.17 -3.19 -0.05 0.00 0.00 0.00 0.00 36.38 32.97 1haw s VAL 33 CO 0.06 0.30 0.28 -1.61 0.00 0.00 0.00 175.10 174.12 1haw s GLU 34 N 1.66 4.23 0.14 2.72 2.02 0.76 -0.07 118.70 130.16 1haw s GLU 34 Ca 0.06 0.05 0.07 0.00 0.02 0.00 0.00 54.97 55.17 1haw s GLU 34 Cb -0.15 -3.44 -0.04 0.00 0.10 0.00 0.00 34.13 30.59 1haw s GLU 34 CO 0.06 0.21 -0.16 -0.06 0.02 0.00 0.00 175.26 175.33 1haw s PHE 35 N 0.58 1.55 -0.03 1.61 0.40 0.14 -1.94 117.98 120.29 1haw s PHE 35 Ca 0.15 -0.53 0.04 0.00 -0.60 0.00 0.00 56.93 56.00 1haw s PHE 35 Cb -0.13 -0.80 -0.00 0.00 0.51 0.00 0.00 43.02 42.60 1haw s PHE 35 CO 0.04 0.21 -0.15 0.99 0.70 0.00 0.00 175.22 177.00 1haw s THR 36 N -2.11 1.23 -0.02 0.64 2.01 -1.26 -0.55 115.64 115.59 1haw s THR 36 Ca 0.11 -0.62 0.01 0.00 0.31 0.00 0.00 61.69 61.51 1haw s THR 36 Cb -0.05 -1.06 0.01 0.00 0.01 0.00 0.00 72.50 71.41 1haw s THR 36 CO 0.04 0.36 -0.04 -0.04 -0.69 0.00 0.00 174.62 174.25 1haw s MET 37 N -0.01 0.48 -0.12 4.92 -1.94 -0.65 -4.93 119.30 117.05 1haw s MET 37 Ca -0.01 -0.13 -0.00 0.00 -1.71 0.00 0.00 55.69 53.83 1haw s MET 37 Cb -0.10 -0.50 -0.02 0.00 2.01 0.00 0.00 34.83 36.23 1haw s MET 37 CO 0.01 0.04 -0.12 0.99 -0.01 0.00 0.00 175.02 175.93 1haw s THR 38 N 0.25 3.15 0.15 2.05 2.01 -1.26 -0.87 115.64 121.11 1haw s THR 38 Ca -0.03 -0.63 -0.29 0.00 0.31 0.00 0.00 61.69 61.04 1haw s THR 38 Cb -0.06 -2.32 -0.07 0.00 0.01 0.00 0.00 72.50 70.06 1haw s THR 38 CO -0.00 0.53 0.94 -0.63 -0.69 0.00 0.00 174.62 174.76 1haw s ILE 39 N 0.22 4.39 -0.16 1.82 1.01 -0.49 0.39 121.20 128.38 1haw s ILE 39 Ca -0.08 2.04 -0.01 0.00 0.00 0.00 0.00 60.65 62.60 1haw s ILE 39 Cb -0.15 -4.31 0.05 0.00 0.01 0.00 0.00 42.46 38.06 1haw s ILE 39 CO 0.05 0.38 -0.02 -0.70 0.00 0.00 0.00 174.94 174.65 1haw s GLU 40 N -0.38 1.07 -0.18 2.79 2.12 -0.27 -4.48 118.70 119.37 1haw s GLU 40 Ca 0.44 -0.41 -0.21 0.00 0.36 0.00 0.00 54.97 55.16 1haw s GLU 40 Cb -0.24 -1.89 -0.03 0.00 0.26 0.00 0.00 34.13 32.23 1haw s GLU 40 CO 0.30 -0.48 0.62 -1.21 -0.54 0.00 0.00 175.26 173.94 1haw s GLU 41 N 1.74 4.24 0.03 4.30 2.02 -1.26 -1.33 118.70 128.45 1haw s GLU 41 Ca 0.01 0.61 -0.21 0.00 0.02 0.00 0.00 54.97 55.39 1haw s GLU 41 Cb -0.15 -3.56 0.05 0.00 0.10 0.00 0.00 34.13 30.57 1haw s GLU 41 CO -0.07 -0.18 0.48 -1.59 0.02 0.00 0.00 175.26 173.92 1haw s LYS 42 N 1.71 0.97 -0.11 1.61 -2.85 -0.71 -4.99 119.74 115.38 1haw s LYS 42 Ca 0.29 -0.24 -0.25 0.00 -1.00 0.00 0.00 55.97 54.77 1haw s LYS 42 Cb -0.16 0.44 -0.03 0.00 -2.06 0.00 0.00 37.83 36.03 1haw s LYS 42 CO 0.11 -0.34 0.78 0.21 0.10 0.00 0.00 175.35 176.22 1haw s LYS 43 N -2.28 4.38 0.13 1.78 2.20 -1.26 -0.98 119.74 123.71 1haw s LYS 43 Ca -0.06 0.99 0.06 0.00 -0.36 0.00 0.00 55.97 56.60 1haw s LYS 43 Cb -0.01 -3.51 -0.04 0.00 -1.51 0.00 0.00 37.83 32.76 1haw s LYS 43 CO -0.01 -0.13 -0.15 0.00 -0.36 0.00 0.00 175.35 174.71 1haw s MET 44 N 1.44 1.05 -0.26 4.03 0.23 0.01 -4.94 119.30 120.86 1haw s MET 44 Ca 0.39 -1.25 -0.21 0.00 -1.03 0.00 0.00 55.69 53.59 1haw s MET 44 Cb -0.18 -0.97 -0.01 0.00 -1.53 0.00 0.00 34.83 32.14 1haw s MET 44 CO 0.17 0.19 0.67 0.08 -2.03 0.00 0.00 175.02 174.09 1haw s VAL 45 N -2.08 4.94 -1.54 5.16 1.01 -1.26 -0.52 120.40 126.12 1haw s VAL 45 Ca 0.09 1.15 0.17 0.00 0.00 0.00 0.00 61.98 63.40 1haw s VAL 45 Cb -0.05 -3.98 -0.01 0.00 0.00 0.00 0.00 36.38 32.34 1haw s VAL 45 CO 0.03 -0.03 0.88 2.30 0.00 0.00 0.00 175.10 178.29 1haw n ILE 46 N 5.26 0.00 -4.03 2.22 -6.64 0.42 -4.85 119.36 111.73 1haw n ILE 46 Ca 0.01 -0.32 -0.05 0.00 -1.77 0.00 0.00 62.75 60.61 1haw n ILE 46 Cb 0.49 1.20 -0.02 0.00 -1.44 0.00 0.00 39.64 39.86 1haw n ILE 46 CO 0.00 0.00 0.00 -0.90 -1.77 0.00 0.00 176.55 173.88 1haw n ASP 47 N -0.11 -0.23 -0.42 7.28 5.68 -1.25 -0.66 116.55 126.84 1haw n ASP 47 Ca 0.07 -1.62 0.13 0.00 -0.50 0.00 0.00 54.79 52.87 1haw n ASP 47 Cb 0.35 0.52 0.34 0.00 -1.14 0.00 0.00 41.12 41.19 1haw n ASP 47 CO 0.00 0.00 0.00 -0.90 -1.33 0.00 0.00 177.20 174.97 1haw n ASP 48 N -2.53 1.49 -0.99 -1.12 5.75 -1.26 -3.68 116.55 114.20 1haw n ASP 48 Ca 0.02 -1.26 0.12 0.00 -0.01 0.00 0.00 54.79 53.66 1haw n ASP 48 Cb 0.17 0.13 0.21 0.00 -1.03 0.00 0.00 41.12 40.60 1haw n ASP 48 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 1haw n LYS 49 N -0.14 2.33 -0.60 0.11 5.02 -1.26 -4.96 118.16 118.66 1haw n LYS 49 Ca 0.14 -1.97 0.00 0.00 -2.02 0.00 0.00 58.31 54.46 1haw n LYS 49 Cb 0.39 -1.48 0.00 0.00 -0.02 0.00 0.00 35.03 33.92 1haw n LYS 49 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1haw n GLY 50 N 1.40 0.70 3.75 0.72 0.00 -1.24 -5.04 105.19 105.48 1haw n GLY 50 Ca 0.17 -0.05 -0.41 0.00 0.00 0.00 0.00 46.02 45.72 1haw n GLY 50 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1haw s THR 51 N -2.00 2.63 0.19 2.61 2.01 -1.26 -4.88 115.64 114.94 1haw s THR 51 Ca 0.00 0.55 0.06 0.00 0.31 0.00 0.00 61.69 62.62 1haw s THR 51 Cb 0.00 -3.35 -0.04 0.00 0.01 0.00 0.00 72.50 69.12 1haw s THR 51 CO 0.00 0.10 0.09 0.42 -0.69 0.00 0.00 174.62 174.54 1haw s THR 52 N -0.29 4.17 -0.04 -0.82 -4.23 -1.26 -0.44 115.64 112.74 1haw s THR 52 Ca 0.57 -1.29 0.03 0.00 -1.18 0.00 0.00 61.69 59.82 1haw s THR 52 Cb -0.42 -3.14 0.00 0.00 1.34 0.00 0.00 72.50 70.28 1haw s THR 52 CO 0.46 -0.16 -0.11 -0.22 -0.54 0.00 0.00 174.62 174.05 1haw s LEU 53 N -3.19 1.78 -0.79 4.79 2.96 0.33 -4.90 118.68 119.66 1haw s LEU 53 Ca 0.30 -0.24 -0.25 0.00 -0.22 0.00 0.00 54.13 53.72 1haw s LEU 53 Cb -0.09 -0.69 0.04 0.00 0.50 0.00 0.00 46.19 45.95 1haw s LEU 53 CO 0.22 0.08 1.26 -1.10 -1.32 0.00 0.00 176.35 175.49 1haw s GLN 54 N 0.25 3.27 0.34 1.98 -1.52 -1.26 -0.81 119.66 121.90 1haw s GLN 54 Ca -0.05 -0.53 0.07 0.00 -1.95 0.00 0.00 55.36 52.90 1haw s GLN 54 Cb -0.11 -4.43 -0.01 0.00 -0.22 0.00 0.00 33.01 28.24 1haw s GLN 54 CO 0.01 -2.10 0.43 0.00 -0.25 0.00 0.00 175.29 173.37 1haw s ALA 55 N 5.28 4.14 -0.04 6.09 0.00 -0.15 -4.93 121.76 132.16 1haw s ALA 55 Ca 0.35 -1.51 -0.01 0.00 0.00 0.00 0.00 51.96 50.79 1haw s ALA 55 Cb -0.08 -1.55 0.03 0.00 0.00 0.00 0.00 23.12 21.52 1haw s ALA 55 CO 0.09 -0.02 0.05 -1.64 0.00 0.00 0.00 175.76 174.23 1haw s MET 56 N -4.13 -0.01 0.13 0.00 -1.94 -0.78 -1.73 119.30 110.85 1haw s MET 56 Ca 0.44 0.30 0.01 0.00 -1.71 0.00 0.00 55.69 54.74 1haw s MET 56 Cb -0.09 -0.48 -0.04 0.00 2.01 0.00 0.00 34.83 36.23 1haw s MET 56 CO 0.30 -0.28 -0.01 0.95 -0.01 0.00 0.00 175.02 175.96 1haw s THR 57 N 1.85 0.56 -0.33 2.05 -4.23 -0.44 -2.60 115.64 112.50 1haw s THR 57 Ca 0.01 -1.94 -0.13 0.00 -1.18 0.00 0.00 61.69 58.45 1haw s THR 57 Cb -0.12 -1.92 -0.02 0.00 1.34 0.00 0.00 72.50 71.78 1haw s THR 57 CO -0.03 -0.65 0.24 -0.36 -0.54 0.00 0.00 174.62 173.28 1haw s PHE 58 N -3.73 3.23 -0.94 3.99 0.08 -1.26 -1.11 117.98 118.24 1haw s PHE 58 Ca 0.19 -0.15 0.00 0.00 0.12 0.00 0.00 56.93 57.08 1haw s PHE 58 Cb 0.06 -2.47 0.00 0.00 -0.57 0.00 0.00 43.02 40.05 1haw s PHE 58 CO -0.00 -0.33 0.00 0.09 -0.10 0.00 0.00 175.22 174.88 1haw n ASN 59 N 5.10 -4.46 0.00 1.36 4.13 0.16 -3.05 115.26 118.50 1haw n ASN 59 Ca -0.13 0.22 0.00 0.00 1.68 0.00 0.00 54.58 56.35 1haw n ASN 59 Cb 0.50 -2.74 0.00 0.00 -1.54 0.00 0.00 39.78 36.00 1haw n ASN 59 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1haw n GLY 60 N -1.37 0.73 3.33 7.41 0.00 -1.26 -5.00 105.19 109.02 1haw n GLY 60 Ca -0.09 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.76 1haw n GLY 60 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1haw s SER 61 N -2.41 2.33 -0.15 1.61 1.04 -1.17 -5.02 113.70 109.93 1haw s SER 61 Ca 0.00 -1.05 0.02 0.00 0.48 0.00 0.00 55.95 55.39 1haw s SER 61 Cb 0.00 -0.10 0.02 0.00 0.10 0.00 0.00 66.02 66.04 1haw s SER 61 CO 0.00 -0.26 -0.19 -0.04 0.98 0.00 0.00 173.24 173.74 1haw s MET 62 N -3.70 2.70 1.04 4.02 -1.94 -1.26 -3.45 119.30 116.72 1haw s MET 62 Ca 0.22 -0.73 -0.17 0.00 -1.71 0.00 0.00 55.69 53.31 1haw s MET 62 Cb 0.01 -2.29 0.22 0.00 2.01 0.00 0.00 34.83 34.78 1haw s MET 62 CO 0.06 -0.12 1.22 -1.25 -0.01 0.00 0.00 175.02 174.92 1haw s PRO 63 N 1.11 0.01 1.08 2.03 0.04 -1.26 -3.37 135.00 134.64 1haw s PRO 63 Ca -0.01 -0.19 -0.12 0.00 0.04 0.00 0.00 61.00 60.71 1haw s PRO 63 Cb -0.14 -1.75 0.24 0.00 0.04 0.00 0.00 34.50 32.88 1haw s PRO 63 CO -0.07 -2.87 1.06 0.20 0.04 0.00 0.00 177.00 175.36 1haw s GLY 64 N -4.40 1.56 0.69 0.56 0.00 0.04 -4.73 107.32 101.04 1haw s GLY 64 Ca 0.71 -0.18 -0.15 0.00 0.00 0.00 0.00 44.72 45.10 1haw s GLY 64 CO 0.54 0.48 1.18 2.56 0.00 0.00 0.00 173.10 177.86 1haw s PRO 65 N -4.68 2.43 -0.03 2.90 0.04 -1.26 -4.51 135.00 129.88 1haw s PRO 65 Ca 0.67 1.66 -0.27 0.00 0.04 0.00 0.00 61.00 63.10 1haw s PRO 65 Cb -0.22 -1.88 -0.03 0.00 0.04 0.00 0.00 34.50 32.41 1haw s PRO 65 CO 0.61 -1.59 0.84 0.99 0.04 0.00 0.00 177.00 177.89 1haw s THR 66 N -2.04 4.96 -0.18 1.26 2.01 -1.26 -4.23 115.64 116.16 1haw s THR 66 Ca 0.72 1.74 -0.08 0.00 0.31 0.00 0.00 61.69 64.39 1haw s THR 66 Cb -0.27 -4.18 -0.04 0.00 0.01 0.00 0.00 72.50 68.02 1haw s THR 66 CO 0.43 0.21 0.09 -0.76 -0.69 0.00 0.00 174.62 173.90 1haw s LEU 67 N 0.88 4.02 -0.09 4.42 1.43 -0.54 -4.59 118.68 124.21 1haw s LEU 67 Ca 0.45 0.18 0.04 0.00 -1.03 0.00 0.00 54.13 53.76 1haw s LEU 67 Cb -0.19 -2.02 -0.01 0.00 0.03 0.00 0.00 46.19 44.00 1haw s LEU 67 CO 0.23 0.21 -0.23 -0.69 0.23 0.00 0.00 176.35 176.10 1haw s VAL 68 N 0.18 2.21 0.31 -1.59 1.01 -1.26 -0.38 120.40 120.89 1haw s VAL 68 Ca 0.06 -0.98 0.02 0.00 0.00 0.00 0.00 61.98 61.09 1haw s VAL 68 Cb -0.12 -1.84 -0.02 0.00 0.00 0.00 0.00 36.38 34.40 1haw s VAL 68 CO -0.00 0.56 0.33 0.68 0.00 0.00 0.00 175.10 176.66 1haw s VAL 69 N 0.16 0.00 0.19 2.92 -7.23 -0.54 -4.99 120.40 110.92 1haw s VAL 69 Ca -0.13 -1.85 0.08 0.00 -1.81 0.00 0.00 61.98 58.28 1haw s VAL 69 Cb -0.16 -2.54 -0.04 0.00 0.56 0.00 0.00 36.38 34.20 1haw s VAL 69 CO 0.07 0.00 -0.02 -1.00 -0.31 0.00 0.00 175.10 173.84 1haw s HIS 70 N -3.44 2.77 0.09 2.82 3.76 -1.26 -0.97 115.29 119.05 1haw s HIS 70 Ca 0.37 -0.17 -0.34 0.00 -0.15 0.00 0.00 55.06 54.76 1haw s HIS 70 Cb 0.02 -1.32 -0.14 0.00 1.11 0.00 0.00 32.58 32.25 1haw s HIS 70 CO 0.22 0.54 1.62 -1.91 -0.85 0.00 0.00 174.74 174.36 1haw n GLU 71 N -0.25 2.02 0.00 1.40 2.13 0.76 -1.10 120.64 125.60 1haw n GLU 71 Ca -0.09 0.73 0.00 0.00 0.66 0.00 0.00 57.16 58.46 1haw n GLU 71 Cb 0.56 -2.50 0.00 0.00 0.27 0.00 0.00 31.44 29.77 1haw n GLU 71 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1haw n GLY 72 N 3.55 3.03 3.74 8.31 0.00 0.14 -4.67 105.19 119.29 1haw n GLY 72 Ca 0.19 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.91 1haw n GLY 72 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1haw s ASP 73 N -1.22 3.50 -0.12 1.61 1.01 -0.26 -4.68 116.67 116.51 1haw s ASP 73 Ca 0.00 1.26 0.01 0.00 0.71 0.00 0.00 52.55 54.53 1haw s ASP 73 Cb 0.00 -1.93 -0.02 0.00 1.01 0.00 0.00 42.92 41.98 1haw s ASP 73 CO 0.00 -2.59 -0.14 -0.31 0.21 0.00 0.00 175.17 172.34 1haw s TYR 74 N -3.06 2.79 -0.09 4.23 1.51 -0.08 -0.81 117.35 121.83 1haw s TYR 74 Ca 0.63 -0.59 -0.19 0.00 -1.01 0.00 0.00 57.07 55.92 1haw s TYR 74 Cb -0.17 -1.81 -0.04 0.00 -0.11 0.00 0.00 41.96 39.83 1haw s TYR 74 CO 0.56 -0.16 0.51 0.08 -1.11 0.00 0.00 175.55 175.43 1haw s VAL 75 N 0.20 5.12 -0.28 0.71 1.01 0.12 -1.06 120.40 126.22 1haw s VAL 75 Ca -0.08 1.04 0.02 0.00 0.00 0.00 0.00 61.98 62.95 1haw s VAL 75 Cb -0.15 -3.85 0.08 0.00 0.00 0.00 0.00 36.38 32.45 1haw s VAL 75 CO 0.05 0.35 -0.02 -1.58 0.00 0.00 0.00 175.10 173.90 1haw s GLN 76 N 0.41 1.56 -0.14 2.72 0.74 0.90 -1.57 119.66 124.28 1haw s GLN 76 Ca 0.28 -1.29 -0.03 0.00 0.05 0.00 0.00 55.36 54.37 1haw s GLN 76 Cb -0.16 -2.72 -0.03 0.00 1.10 0.00 0.00 33.01 31.21 1haw s GLN 76 CO 0.12 -0.73 -0.04 -1.17 -0.55 0.00 0.00 175.29 172.92 1haw s LEU 77 N 1.25 3.27 -0.32 3.68 2.96 0.49 -0.68 118.68 129.33 1haw s LEU 77 Ca 0.00 -0.10 -0.11 0.00 -0.22 0.00 0.00 54.13 53.70 1haw s LEU 77 Cb -0.19 -1.78 -0.01 0.00 0.50 0.00 0.00 46.19 44.71 1haw s LEU 77 CO -0.09 0.20 0.19 -0.89 -1.32 0.00 0.00 176.35 174.44 1haw s THR 78 N 0.18 4.86 -0.26 3.68 2.01 0.29 -1.25 115.64 125.15 1haw s THR 78 Ca -0.02 -0.36 -0.12 0.00 0.31 0.00 0.00 61.69 61.51 1haw s THR 78 Cb -0.14 -3.49 -0.05 0.00 0.01 0.00 0.00 72.50 68.83 1haw s THR 78 CO 0.03 0.03 0.22 -0.22 -0.69 0.00 0.00 174.62 173.98 1haw s LEU 79 N 1.65 4.05 -0.19 4.42 2.96 0.71 -1.63 118.68 130.65 1haw s LEU 79 Ca 0.05 0.09 -0.03 0.00 -0.22 0.00 0.00 54.13 54.02 1haw s LEU 79 Cb -0.17 -2.18 -0.01 0.00 0.50 0.00 0.00 46.19 44.33 1haw s LEU 79 CO 0.08 -0.04 -0.06 -0.69 -1.32 0.00 0.00 176.35 174.32 1haw s VAL 80 N 1.59 3.33 -0.52 1.68 1.01 -0.05 -1.45 120.40 125.99 1haw s VAL 80 Ca 0.09 -0.52 -0.00 0.00 0.00 0.00 0.00 61.98 61.54 1haw s VAL 80 Cb -0.15 -2.48 0.13 0.00 0.00 0.00 0.00 36.38 33.88 1haw s VAL 80 CO 0.09 0.46 0.29 0.21 0.00 0.00 0.00 175.10 176.15 1haw s ASN 81 N 1.11 4.96 0.75 3.32 2.47 -0.38 -1.39 114.94 125.77 1haw s ASN 81 Ca 0.01 -2.62 -0.16 0.00 0.42 0.00 0.00 52.86 50.51 1haw s ASN 81 Cb -0.15 -1.77 -0.01 0.00 -1.45 0.00 0.00 41.25 37.87 1haw s ASN 81 CO -0.01 -0.38 0.66 -2.65 -3.72 0.00 0.00 177.10 171.01 1haw n PRO 82 N 3.73 0.28 0.08 0.43 -0.02 -1.26 0.12 135.00 138.36 1haw n PRO 82 Ca 0.04 0.14 0.09 0.00 -2.02 0.00 0.00 63.50 61.75 1haw n PRO 82 Cb 0.38 -1.96 0.39 0.00 -0.02 0.00 0.00 33.50 32.29 1haw n PRO 82 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1haw n ALA 83 N -2.60 1.49 0.58 3.55 0.00 -1.26 -1.74 120.51 120.54 1haw n ALA 83 Ca 0.11 0.05 0.13 0.00 0.00 0.00 0.00 53.44 53.73 1haw n ALA 83 Cb 0.50 -1.28 0.37 0.00 0.00 0.00 0.00 19.45 19.04 1haw n ALA 83 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 1haw h THR 84 N 0.00 0.00 -4.16 0.00 1.35 -1.95 -3.45 112.91 104.70 1haw h THR 84 Ca 0.00 -0.53 -0.47 0.00 -0.55 0.00 0.00 66.41 64.85 1haw h THR 84 Cb 0.23 1.51 0.13 0.00 -1.73 0.00 0.00 68.15 68.30 1haw h THR 84 CO 0.00 0.00 0.28 0.20 -0.25 0.00 0.00 175.52 175.75 1haw s ASN 85 N -4.69 3.69 -0.06 5.36 0.01 -0.71 -5.00 114.94 113.53 1haw s ASN 85 Ca 0.10 1.23 0.09 0.00 -0.71 0.00 0.00 52.86 53.57 1haw s ASN 85 Cb 0.12 -1.90 -0.12 0.00 0.41 0.00 0.00 41.25 39.75 1haw s ASN 85 CO 0.61 -2.47 0.10 0.00 -1.51 0.00 0.00 177.10 173.83 1haw n ALA 86 N -3.75 2.01 -2.70 0.60 0.00 -1.26 -4.80 120.51 110.61 1haw n ALA 86 Ca 0.07 -0.44 -0.22 0.00 0.00 0.00 0.00 53.44 52.84 1haw n ALA 86 Cb 0.57 -0.09 -0.05 0.00 0.00 0.00 0.00 19.45 19.88 1haw n ALA 86 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 1haw s MET 87 N -2.39 2.67 0.38 0.00 -1.94 -1.26 -4.88 119.30 111.87 1haw s MET 87 Ca -0.04 -1.23 -0.20 0.00 -1.71 0.00 0.00 55.69 52.50 1haw s MET 87 Cb 0.04 -2.40 -0.10 0.00 2.01 0.00 0.00 34.83 34.38 1haw s MET 87 CO 0.37 0.33 0.89 -1.25 -0.01 0.00 0.00 175.02 175.35 1haw s PRO 88 N -3.81 4.23 0.28 2.03 0.04 -1.26 -4.22 135.00 132.29 1haw s PRO 88 Ca 0.34 1.04 0.04 0.00 0.04 0.00 0.00 61.00 62.45 1haw s PRO 88 Cb -0.07 -2.36 -0.03 0.00 0.04 0.00 0.00 34.50 32.07 1haw s PRO 88 CO 0.23 0.08 0.23 -1.01 0.04 0.00 0.00 177.00 176.57 1haw s HIS 89 N -2.02 1.52 0.09 0.56 3.76 -0.81 -4.91 115.29 113.48 1haw s HIS 89 Ca 0.57 -1.55 -0.12 0.00 -0.15 0.00 0.00 55.06 53.81 1haw s HIS 89 Cb -0.11 -0.64 0.04 0.00 1.11 0.00 0.00 32.58 32.98 1haw s HIS 89 CO 0.16 -0.79 0.59 0.27 -0.85 0.00 0.00 174.74 174.12 1haw n ASN 90 N -1.06 -0.95 -3.87 1.40 0.23 -1.26 -0.80 115.26 108.95 1haw n ASN 90 Ca 0.05 -1.48 -0.12 0.00 -0.53 0.00 0.00 54.58 52.51 1haw n ASN 90 Cb 0.64 1.54 -0.14 0.00 -2.08 0.00 0.00 39.78 39.74 1haw n ASN 90 CO 0.00 0.00 0.00 0.54 -0.93 0.00 0.00 177.26 176.87 1haw s VAL 91 N -2.27 0.01 -0.26 3.53 0.11 -1.26 -4.16 120.40 116.10 1haw s VAL 91 Ca 0.13 -0.05 0.02 0.00 -2.93 0.00 0.00 61.98 59.14 1haw s VAL 91 Cb -0.01 -0.05 0.05 0.00 -1.53 0.00 0.00 36.38 34.83 1haw s VAL 91 CO 0.03 -0.03 -0.09 -0.62 -3.33 0.00 0.00 175.10 171.05 1haw s ASP 92 N -0.08 4.39 -0.31 3.54 -1.08 0.27 -1.70 116.67 121.70 1haw s ASP 92 Ca -0.01 -1.26 -0.15 0.00 -0.52 0.00 0.00 52.55 50.61 1haw s ASP 92 Cb -0.01 -1.58 -0.02 0.00 -1.46 0.00 0.00 42.92 39.85 1haw s ASP 92 CO -0.00 -0.18 0.37 -0.36 0.52 0.00 0.00 175.17 175.52 1haw s PHE 93 N 1.17 3.22 -0.21 -5.34 0.08 0.17 -1.24 117.98 115.83 1haw s PHE 93 Ca -0.06 0.18 0.27 0.00 0.12 0.00 0.00 56.93 57.44 1haw s PHE 93 Cb -0.19 -2.64 1.22 0.00 -0.57 0.00 0.00 43.02 40.85 1haw s PHE 93 CO -0.05 -0.34 1.81 0.45 -0.10 0.00 0.00 175.22 176.99 1haw h HIS 94 N 8.34 0.00 -0.00 0.36 3.86 -1.51 -2.14 115.15 124.05 1haw h HIS 94 Ca -0.31 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.90 1haw h HIS 94 Cb 1.15 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.62 1haw h HIS 94 CO 0.72 0.00 -0.12 0.41 0.86 0.00 0.00 177.93 179.80 1haw n GLY 95 N -0.38 -0.95 3.94 2.45 0.00 -1.26 -4.91 105.19 104.09 1haw n GLY 95 Ca 0.01 -0.27 -0.26 0.00 0.00 0.00 0.00 46.02 45.49 1haw n GLY 95 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1haw s ALA 96 N -2.51 3.96 -0.20 4.61 0.00 -0.81 -4.63 121.76 122.18 1haw s ALA 96 Ca 0.28 -1.02 -0.03 0.00 0.00 0.00 0.00 51.96 51.19 1haw s ALA 96 Cb 0.20 -1.80 -0.01 0.00 0.00 0.00 0.00 23.12 21.51 1haw s ALA 96 CO 0.48 0.52 -0.06 0.99 0.00 0.00 0.00 175.76 177.70 1haw s THR 97 N -1.76 3.30 0.00 0.00 2.01 -1.26 -4.73 115.64 113.20 1haw s THR 97 Ca 0.35 -0.53 0.00 0.00 0.31 0.00 0.00 61.69 61.82 1haw s THR 97 Cb -0.11 -2.48 0.00 0.00 0.01 0.00 0.00 72.50 69.92 1haw s THR 97 CO 0.29 0.45 0.00 0.61 -0.69 0.00 0.00 174.62 175.27 1haw n GLY 98 N 4.54 2.02 3.92 4.40 0.00 -1.26 -4.95 105.19 113.86 1haw n GLY 98 Ca -0.18 -1.94 -0.30 0.00 0.00 0.00 0.00 46.02 43.59 1haw n GLY 98 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1haw n ALA 99 N 1.73 -1.33 -3.71 4.61 0.00 -1.26 -1.04 120.51 119.52 1haw n ALA 99 Ca 0.00 0.17 -0.25 0.00 0.00 0.00 0.00 53.44 53.36 1haw n ALA 99 Cb 0.00 -4.32 0.05 0.00 0.00 0.00 0.00 19.45 15.19 1haw n ALA 99 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1haw n LEU 100 N -4.66 -3.13 0.00 0.00 4.77 -1.26 -1.94 117.00 110.78 1haw n LEU 100 Ca 0.02 -0.69 0.00 0.00 -0.03 0.00 0.00 56.01 55.32 1haw n LEU 100 Cb 0.53 -2.81 0.00 0.00 -2.33 0.00 0.00 43.42 38.81 1haw n LEU 100 CO 0.76 0.51 0.00 0.61 -1.33 0.00 0.00 177.39 177.93 1haw n GLY 101 N -1.70 0.47 0.00 -0.72 0.00 -0.21 -2.29 105.19 100.74 1haw n GLY 101 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.94 1haw n GLY 101 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1haw n GLY 102 N -2.01 0.69 0.28 -0.02 0.00 -0.82 -0.66 105.19 102.66 1haw n GLY 102 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.03 1haw n GLY 102 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1haw h ALA 103 N 0.00 1.45 0.00 4.61 0.00 -0.90 -2.06 119.26 122.36 1haw h ALA 103 Ca 0.00 -0.15 -0.05 0.00 0.00 0.00 0.00 54.91 54.71 1haw h ALA 103 Cb 0.00 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 1haw h ALA 103 CO 0.00 0.40 -0.22 -0.22 0.00 0.00 0.00 179.25 179.21 1haw h LYS 104 N 0.54 0.00 -0.30 0.00 1.63 -1.74 -3.10 116.57 113.60 1haw h LYS 104 Ca 0.13 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.93 1haw h LYS 104 Cb 0.22 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.85 1haw h LYS 104 CO -0.00 0.22 0.00 1.28 -3.45 0.00 0.00 179.45 177.50 1haw n LEU 105 N -3.68 3.17 -0.89 5.20 4.77 -0.79 -4.50 117.00 120.28 1haw n LEU 105 Ca -0.01 -1.45 0.05 0.00 -0.03 0.00 0.00 56.01 54.57 1haw n LEU 105 Cb 0.34 -0.19 0.09 0.00 -2.33 0.00 0.00 43.42 41.33 1haw n LEU 105 CO 0.33 0.67 0.25 0.35 -1.33 0.00 0.00 177.39 177.66 1haw n THR 106 N 1.26 0.93 -2.14 -5.08 -2.24 -1.11 -4.83 114.28 101.07 1haw n THR 106 Ca 0.16 -1.72 -0.43 0.00 -2.27 0.00 0.00 64.05 59.80 1haw n THR 106 Cb 0.54 0.38 -0.02 0.00 -2.10 0.00 0.00 70.33 69.13 1haw n THR 106 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 1haw s ASN 107 N -2.35 6.12 -0.13 3.42 0.01 -1.25 -4.08 114.94 116.69 1haw s ASN 107 Ca 0.30 1.17 0.01 0.00 -0.71 0.00 0.00 52.86 53.63 1haw s ASN 107 Cb 0.31 -2.53 0.02 0.00 0.41 0.00 0.00 41.25 39.45 1haw s ASN 107 CO -0.09 -1.54 -0.16 0.68 -1.51 0.00 0.00 177.10 174.48 1haw s VAL 108 N 6.12 1.63 0.55 1.60 -7.23 0.02 -4.99 120.40 118.09 1haw s VAL 108 Ca 0.72 -0.70 -0.07 0.00 -1.81 0.00 0.00 61.98 60.12 1haw s VAL 108 Cb -0.20 -1.49 -0.02 0.00 0.56 0.00 0.00 36.38 35.24 1haw s VAL 108 CO 0.33 0.47 0.88 0.20 -0.31 0.00 0.00 175.10 176.67 1haw s ASN 109 N 1.10 5.98 0.04 4.85 0.01 -1.26 -1.93 114.94 123.74 1haw s ASN 109 Ca -0.03 0.94 -0.36 0.00 -0.71 0.00 0.00 52.86 52.70 1haw s ASN 109 Cb -0.14 -2.08 -0.16 0.00 0.41 0.00 0.00 41.25 39.28 1haw s ASN 109 CO -0.04 -0.84 1.48 -2.65 -1.51 0.00 0.00 177.10 173.54 1haw n PRO 110 N -2.49 1.42 -0.22 -0.60 -0.02 -1.26 -1.32 135.00 130.50 1haw n PRO 110 Ca 0.03 0.51 0.00 0.00 -2.02 0.00 0.00 63.50 62.02 1haw n PRO 110 Cb 0.56 -2.20 0.00 0.00 -0.02 0.00 0.00 33.50 31.84 1haw n PRO 110 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1haw n GLY 111 N 3.06 0.80 3.42 -1.23 0.00 0.33 -4.69 105.19 106.88 1haw n GLY 111 Ca 0.19 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.00 1haw n GLY 111 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1haw s GLU 112 N -0.78 1.52 0.06 1.61 2.02 -0.44 -4.87 118.70 117.82 1haw s GLU 112 Ca 0.00 -1.71 -0.03 0.00 0.02 0.00 0.00 54.97 53.25 1haw s GLU 112 Cb 0.00 -1.39 -0.03 0.00 0.10 0.00 0.00 34.13 32.81 1haw s GLU 112 CO 0.00 0.20 0.03 1.14 0.02 0.00 0.00 175.26 176.65 1haw s GLN 113 N -3.61 0.67 0.06 1.61 -2.07 -1.26 -1.25 119.66 113.80 1haw s GLN 113 Ca 0.27 -1.14 -0.15 0.00 -1.82 0.00 0.00 55.36 52.51 1haw s GLN 113 Cb -0.01 0.24 0.03 0.00 -1.09 0.00 0.00 33.01 32.18 1haw s GLN 113 CO 0.11 -0.15 0.35 0.00 -1.32 0.00 0.00 175.29 174.29 1haw s ALA 114 N -3.86 -0.82 -0.08 2.60 0.00 -0.53 -4.99 121.76 114.08 1haw s ALA 114 Ca 0.06 0.06 0.02 0.00 0.00 0.00 0.00 51.96 52.11 1haw s ALA 114 Cb 0.07 0.42 0.01 0.00 0.00 0.00 0.00 23.12 23.62 1haw s ALA 114 CO -0.10 -0.48 -0.14 0.99 0.00 0.00 0.00 175.76 176.02 1haw s THR 115 N -2.87 1.35 0.05 0.00 2.01 -1.26 -0.21 115.64 114.71 1haw s THR 115 Ca -0.03 -0.59 0.08 0.00 0.31 0.00 0.00 61.69 61.46 1haw s THR 115 Cb 0.00 -1.22 -0.03 0.00 0.01 0.00 0.00 72.50 71.26 1haw s THR 115 CO -0.05 0.41 -0.23 -0.22 -0.69 0.00 0.00 174.62 173.84 1haw s LEU 116 N 0.73 2.17 -0.03 4.42 2.96 -0.38 -4.96 118.68 123.59 1haw s LEU 116 Ca -0.13 -0.55 0.05 0.00 -0.22 0.00 0.00 54.13 53.28 1haw s LEU 116 Cb -0.16 -1.07 -0.01 0.00 0.50 0.00 0.00 46.19 45.45 1haw s LEU 116 CO 0.03 0.19 -0.16 -0.60 -1.32 0.00 0.00 176.35 174.49 1haw s ARG 117 N -1.22 1.52 0.01 1.98 3.52 -1.26 -0.38 118.95 123.12 1haw s ARG 117 Ca 0.09 -0.58 -0.12 0.00 -0.13 0.00 0.00 55.73 54.99 1haw s ARG 117 Cb -0.09 -1.39 0.01 0.00 -1.56 0.00 0.00 34.95 31.93 1haw s ARG 117 CO 0.02 0.28 0.24 -0.59 -0.81 0.00 0.00 175.30 174.45 1haw s PHE 118 N -0.14 -0.07 -0.17 5.12 -0.12 -0.61 -4.96 117.98 117.03 1haw s PHE 118 Ca 0.01 0.02 -0.24 0.00 -0.05 0.00 0.00 56.93 56.67 1haw s PHE 118 Cb -0.09 0.04 -0.02 0.00 -0.63 0.00 0.00 43.02 42.32 1haw s PHE 118 CO 0.01 -0.39 0.78 0.21 -0.05 0.00 0.00 175.22 175.78 1haw s LYS 119 N -1.75 4.29 -1.24 1.99 2.20 -1.26 0.11 119.74 124.08 1haw s LYS 119 Ca -0.11 0.92 -0.14 0.00 -0.36 0.00 0.00 55.97 56.28 1haw s LYS 119 Cb -0.04 -3.57 0.15 0.00 -1.51 0.00 0.00 37.83 32.86 1haw s LYS 119 CO 0.01 -0.28 1.56 0.00 -0.36 0.00 0.00 175.35 176.27 1haw n ALA 120 N 5.10 4.05 0.81 3.13 0.00 0.01 -4.73 120.51 128.88 1haw n ALA 120 Ca 0.03 -4.19 0.11 0.00 0.00 0.00 0.00 53.44 49.39 1haw n ALA 120 Cb 0.49 -3.14 0.29 0.00 0.00 0.00 0.00 19.45 17.09 1haw n ALA 120 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1haw n ASP 121 N 5.85 2.50 -3.96 0.00 5.75 -1.26 -0.68 116.55 124.75 1haw n ASP 121 Ca 0.39 -1.85 -0.24 0.00 -0.01 0.00 0.00 54.79 53.09 1haw n ASP 121 Cb 0.42 -0.17 -0.17 0.00 -1.03 0.00 0.00 41.12 40.18 1haw n ASP 121 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 1haw s ARG 122 N -1.66 1.40 0.36 0.11 0.52 -1.26 -4.77 118.95 113.65 1haw s ARG 122 Ca 0.35 -0.29 -0.18 0.00 -0.52 0.00 0.00 55.73 55.08 1haw s ARG 122 Cb 0.20 -1.27 -0.10 0.00 0.52 0.00 0.00 34.95 34.30 1haw s ARG 122 CO 0.28 -0.06 0.84 -1.54 0.02 0.00 0.00 175.30 174.84 1haw s SER 123 N 0.94 6.89 0.00 0.23 1.04 -1.26 -4.79 113.70 116.76 1haw s SER 123 Ca -0.10 1.50 0.00 0.00 0.48 0.00 0.00 55.95 57.83 1haw s SER 123 Cb -0.15 -2.46 0.00 0.00 0.10 0.00 0.00 66.02 63.51 1haw s SER 123 CO 0.00 -0.25 0.00 0.61 0.98 0.00 0.00 173.24 174.59 1haw n GLY 124 N -0.36 1.12 3.71 7.32 0.00 0.18 -3.02 105.19 114.14 1haw n GLY 124 Ca 0.05 -1.77 -0.36 0.00 0.00 0.00 0.00 46.02 43.93 1haw n GLY 124 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1haw s THR 125 N -1.39 5.33 0.00 2.61 -4.23 0.43 -0.32 115.64 118.07 1haw s THR 125 Ca 0.00 0.42 0.06 0.00 -1.18 0.00 0.00 61.69 60.99 1haw s THR 125 Cb 0.00 -3.58 -0.02 0.00 1.34 0.00 0.00 72.50 70.24 1haw s THR 125 CO 0.00 0.38 -0.18 -0.36 -0.54 0.00 0.00 174.62 173.92 1haw s PHE 126 N 0.62 1.59 0.50 3.99 0.40 0.78 -4.34 117.98 121.52 1haw s PHE 126 Ca 0.13 -0.32 -0.19 0.00 -0.60 0.00 0.00 56.93 55.95 1haw s PHE 126 Cb -0.13 -1.00 -0.08 0.00 0.51 0.00 0.00 43.02 42.33 1haw s PHE 126 CO 0.03 0.01 1.03 0.08 0.70 0.00 0.00 175.22 177.07 1haw s VAL 127 N -0.55 3.88 0.09 -0.44 1.01 -1.26 -0.08 120.40 123.05 1haw s VAL 127 Ca 0.06 1.10 0.07 0.00 0.00 0.00 0.00 61.98 63.22 1haw s VAL 127 Cb -0.07 -3.46 -0.03 0.00 0.00 0.00 0.00 36.38 32.81 1haw s VAL 127 CO 0.00 -0.32 -0.20 -0.72 0.00 0.00 0.00 175.10 173.87 1haw s TYR 128 N -2.11 1.68 0.20 5.22 -0.85 -0.07 -1.34 117.35 120.07 1haw s TYR 128 Ca 0.66 -0.41 -0.22 0.00 -0.52 0.00 0.00 57.07 56.57 1haw s TYR 128 Cb -0.15 -0.94 0.05 0.00 0.38 0.00 0.00 41.96 41.30 1haw s TYR 128 CO 0.23 0.16 0.63 -3.38 -1.52 0.00 0.00 175.55 171.67 1haw s HIS 129 N -1.11 -0.42 0.44 -3.49 -3.43 -0.37 -1.85 115.29 105.06 1haw s HIS 129 Ca 0.05 0.12 -0.22 0.00 -0.80 0.00 0.00 55.06 54.22 1haw s HIS 129 Cb -0.10 0.60 -0.09 0.00 -1.43 0.00 0.00 32.58 31.56 1haw s HIS 129 CO 0.03 -0.97 1.03 0.00 -2.00 0.00 0.00 174.74 172.83 1haw n ALA 131 N -0.56 -0.01 -2.32 0.00 0.00 -1.26 -4.52 120.51 111.83 1haw n ALA 131 Ca 0.07 -2.08 -0.42 0.00 0.00 0.00 0.00 53.44 51.02 1haw n ALA 131 Cb 0.52 -1.12 -0.03 0.00 0.00 0.00 0.00 19.45 18.81 1haw n ALA 131 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1haw s PRO 132 N -0.27 4.46 -0.05 0.00 0.05 -1.26 -4.88 135.00 133.04 1haw s PRO 132 Ca 0.30 1.78 -0.38 0.00 0.05 0.00 0.00 61.00 62.76 1haw s PRO 132 Cb 0.26 -3.32 -0.16 0.00 0.05 0.00 0.00 34.50 31.33 1haw s PRO 132 CO -0.13 -0.20 1.51 -1.91 0.05 0.00 0.00 177.00 176.32 1haw n GLU 133 N 3.54 1.19 -0.49 4.56 2.13 -1.26 -0.90 120.64 129.41 1haw n GLU 133 Ca 0.08 0.43 0.00 0.00 0.66 0.00 0.00 57.16 58.33 1haw n GLU 133 Cb 0.46 -2.10 0.00 0.00 0.27 0.00 0.00 31.44 30.07 1haw n GLU 133 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1haw n GLY 134 N 3.20 1.76 0.69 8.31 0.00 -1.26 -4.78 105.19 113.11 1haw n GLY 134 Ca 0.21 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.27 1haw n GLY 134 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1haw n MET 135 N -2.00 0.35 0.26 1.61 2.81 -0.08 -4.96 117.12 115.12 1haw n MET 135 Ca 0.00 -1.72 -0.16 0.00 -1.81 0.00 0.00 57.70 54.01 1haw n MET 135 Cb 0.00 -0.64 -0.08 0.00 -0.71 0.00 0.00 33.22 31.79 1haw n MET 135 CO 0.00 0.00 0.00 0.28 1.51 0.00 0.00 175.97 177.76 1haw h VAL 136 N 5.31 0.27 -0.66 2.03 2.07 -1.82 -2.71 116.25 120.74 1haw h VAL 136 Ca -0.06 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.50 1haw h VAL 136 Cb 1.43 0.27 -0.05 0.00 -1.52 0.00 0.00 31.29 31.42 1haw h VAL 136 CO 0.03 0.00 0.40 -0.65 0.02 0.00 0.00 177.57 177.36 1haw h PRO 137 N -0.80 0.74 -0.40 1.57 0.10 -1.92 -2.13 132.00 129.16 1haw h PRO 137 Ca -0.04 -0.04 0.00 0.00 0.10 0.00 0.00 66.00 66.02 1haw h PRO 137 Cb 0.69 -0.17 -0.02 0.00 0.10 0.00 0.00 31.00 31.60 1haw h PRO 137 CO -0.01 0.49 0.26 2.35 0.10 0.00 0.00 178.00 181.19 1haw h TRP 138 N 0.76 0.51 -0.34 0.65 7.01 -1.92 0.26 115.95 122.88 1haw h TRP 138 Ca 0.28 0.01 -0.08 0.00 2.11 0.00 0.00 58.89 61.21 1haw h TRP 138 Cb 0.08 -0.17 -0.02 0.00 -2.10 0.00 0.00 29.16 26.95 1haw h TRP 138 CO -0.06 0.33 -0.13 0.45 -2.79 0.00 0.00 178.44 176.24 1haw h HIS 139 N 0.54 0.65 -0.05 2.65 3.86 -1.19 -1.90 115.15 119.70 1haw h HIS 139 Ca 0.15 -0.11 -0.02 0.00 -1.16 0.00 0.00 60.37 59.23 1haw h HIS 139 Cb -0.05 -0.17 -0.00 0.00 1.06 0.00 0.00 27.41 28.25 1haw h HIS 139 CO -0.05 0.70 -0.05 0.28 0.86 0.00 0.00 177.93 179.68 1haw h VAL 140 N 0.54 1.36 0.00 2.45 2.07 -1.09 -2.55 116.25 119.04 1haw h VAL 140 Ca 0.10 -1.16 0.00 0.00 0.82 0.00 0.00 66.70 66.45 1haw h VAL 140 Cb 0.55 2.02 0.00 0.00 -1.52 0.00 0.00 31.29 32.34 1haw h VAL 140 CO 0.03 0.32 0.00 1.33 0.02 0.00 0.00 177.57 179.27 1haw n VAL 141 N -4.76 0.80 1.08 2.57 0.24 0.05 -1.93 118.33 116.37 1haw n VAL 141 Ca -0.08 0.16 0.13 0.00 -2.04 0.00 0.00 64.34 62.52 1haw n VAL 141 Cb 0.28 -1.07 0.49 0.00 -1.47 0.00 0.00 33.84 32.07 1haw n VAL 141 CO 0.00 0.00 0.00 -1.20 -2.14 0.00 0.00 176.83 173.49 1haw n SER 142 N -2.21 0.26 0.00 -1.34 7.64 -0.72 -4.75 113.62 112.50 1haw n SER 142 Ca 0.03 0.04 0.00 0.00 1.01 0.00 0.00 58.87 59.95 1haw n SER 142 Cb 0.25 -0.16 0.00 0.00 -1.01 0.00 0.00 64.21 63.29 1haw n SER 142 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1haw n GLY 143 N 1.46 -0.27 3.51 0.23 0.00 -0.82 -1.86 105.19 107.44 1haw n GLY 143 Ca 0.08 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.66 1haw n GLY 143 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1haw s MET 144 N 0.00 4.04 0.19 1.61 -1.94 -0.97 -4.61 119.30 117.62 1haw s MET 144 Ca 0.00 -2.34 -0.20 0.00 -1.71 0.00 0.00 55.69 51.44 1haw s MET 144 Cb 0.00 -5.25 0.04 0.00 2.01 0.00 0.00 34.83 31.63 1haw s MET 144 CO 0.00 -1.96 0.57 -1.54 -0.01 0.00 0.00 175.02 172.08 1haw s SER 145 N 3.40 -0.38 0.00 3.03 1.04 -1.26 -2.02 113.70 117.51 1haw s SER 145 Ca 0.47 -0.29 0.00 0.00 0.48 0.00 0.00 55.95 56.61 1haw s SER 145 Cb -0.00 0.60 0.00 0.00 0.10 0.00 0.00 66.02 66.72 1haw s SER 145 CO 0.03 -1.04 0.00 0.61 0.98 0.00 0.00 173.24 173.82 1haw n GLY 146 N -0.36 1.73 3.20 7.32 0.00 -0.77 -0.78 105.19 115.53 1haw n GLY 146 Ca -0.12 -0.82 -0.23 0.00 0.00 0.00 0.00 46.02 44.84 1haw n GLY 146 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1haw s THR 147 N -2.62 1.42 -0.23 2.61 2.01 -1.26 -0.89 115.64 116.67 1haw s THR 147 Ca 0.00 -1.08 -0.05 0.00 0.31 0.00 0.00 61.69 60.86 1haw s THR 147 Cb 0.00 -1.25 -0.02 0.00 0.01 0.00 0.00 72.50 71.25 1haw s THR 147 CO 0.00 0.14 0.01 -0.22 -0.69 0.00 0.00 174.62 173.86 1haw s LEU 148 N -1.10 3.16 -0.24 4.42 2.96 0.89 -1.47 118.68 127.29 1haw s LEU 148 Ca 0.05 -0.30 -0.07 0.00 -0.22 0.00 0.00 54.13 53.59 1haw s LEU 148 Cb -0.08 -1.83 -0.03 0.00 0.50 0.00 0.00 46.19 44.75 1haw s LEU 148 CO 0.01 -0.02 0.07 -0.32 -1.32 0.00 0.00 176.35 174.77 1haw s MET 149 N 1.53 3.72 -0.44 1.98 -2.45 0.49 -0.16 119.30 123.97 1haw s MET 149 Ca 0.06 -0.45 -0.08 0.00 -1.25 0.00 0.00 55.69 53.97 1haw s MET 149 Cb -0.15 -3.32 0.10 0.00 1.25 0.00 0.00 34.83 32.72 1haw s MET 149 CO 0.00 -0.11 0.29 0.08 1.05 0.00 0.00 175.02 176.32 1haw s VAL 150 N 1.41 4.02 0.34 10.11 1.01 0.56 -1.46 120.40 136.39 1haw s VAL 150 Ca 0.05 -1.71 -0.18 0.00 0.00 0.00 0.00 61.98 60.15 1haw s VAL 150 Cb -0.15 -3.60 -0.10 0.00 0.00 0.00 0.00 36.38 32.54 1haw s VAL 150 CO 0.04 -0.66 0.82 -0.76 0.00 0.00 0.00 175.10 174.53 1haw s LEU 151 N 1.34 4.09 0.41 3.92 1.43 -0.15 -0.65 118.68 129.07 1haw s LEU 151 Ca 0.05 1.47 -0.26 0.00 -1.03 0.00 0.00 54.13 54.36 1haw s LEU 151 Cb -0.24 -4.14 -0.08 0.00 0.03 0.00 0.00 46.19 41.75 1haw s LEU 151 CO -0.01 -0.21 1.27 -2.84 0.23 0.00 0.00 176.35 174.79 1haw s PRO 152 N -2.83 3.97 0.54 1.29 0.02 -1.26 -0.17 135.00 136.56 1haw s PRO 152 Ca 0.55 2.07 0.22 0.00 0.02 0.00 0.00 61.00 63.85 1haw s PRO 152 Cb -0.11 -2.72 1.41 0.00 0.02 0.00 0.00 34.50 33.09 1haw s PRO 152 CO 0.17 -0.46 2.09 -0.09 -0.33 0.00 0.00 177.00 178.38 1haw h ARG 153 N 2.63 0.00 -0.17 5.54 2.43 -1.88 -0.40 114.38 122.52 1haw h ARG 153 Ca -0.49 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.68 1haw h ARG 153 Cb 1.24 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.79 1haw h ARG 153 CO 0.62 0.00 0.00 -0.40 -1.51 0.00 0.00 179.97 178.68 1haw n ASP 154 N -4.33 1.18 -0.10 -3.80 5.75 -1.26 -1.10 116.55 112.90 1haw n ASP 154 Ca 0.02 -1.80 0.01 0.00 -0.01 0.00 0.00 54.79 53.02 1haw n ASP 154 Cb 0.31 -0.11 -0.00 0.00 -1.03 0.00 0.00 41.12 40.28 1haw n ASP 154 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1haw n GLY 155 N 0.95 -1.69 3.77 6.12 0.00 -0.16 -4.70 105.19 109.47 1haw n GLY 155 Ca 0.12 -1.49 -0.37 0.00 0.00 0.00 0.00 46.02 44.28 1haw n GLY 155 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1haw s LEU 156 N -3.93 3.94 0.06 0.99 1.43 -1.26 -4.65 118.68 115.27 1haw s LEU 156 Ca 0.00 2.31 0.03 0.00 -1.03 0.00 0.00 54.13 55.44 1haw s LEU 156 Cb 0.00 -4.32 -0.03 0.00 0.03 0.00 0.00 46.19 41.87 1haw s LEU 156 CO 0.00 -1.03 -0.10 -0.54 0.23 0.00 0.00 176.35 174.91 1haw s LYS 157 N -2.84 0.67 0.97 1.70 -0.14 -1.26 -1.26 119.74 117.57 1haw s LYS 157 Ca 0.66 -0.88 -0.15 0.00 -1.36 0.00 0.00 55.97 54.23 1haw s LYS 157 Cb -0.28 -0.50 0.21 0.00 -1.68 0.00 0.00 37.83 35.58 1haw s LYS 157 CO 0.34 0.10 1.32 0.16 -0.76 0.00 0.00 175.35 176.50 1haw s ASP 158 N -1.77 3.03 0.59 2.83 1.47 0.49 -4.73 116.67 118.58 1haw s ASP 158 Ca -0.05 0.16 0.34 0.00 1.18 0.00 0.00 52.55 54.18 1haw s ASP 158 Cb -0.09 -0.17 1.83 0.00 -0.34 0.00 0.00 42.92 44.15 1haw s ASP 158 CO 0.01 -2.78 2.20 -0.65 0.68 0.00 0.00 175.17 174.63 1haw h PRO 159 N -1.64 0.00 -0.61 2.11 0.11 -1.88 -1.45 132.00 128.63 1haw h PRO 159 Ca -0.44 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.67 1haw h PRO 159 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 1haw h PRO 159 CO 0.35 0.04 0.00 1.04 -0.21 0.00 0.00 178.00 179.22 1haw n GLN 160 N -3.47 2.48 -0.90 1.05 6.02 -1.26 -4.94 117.38 116.36 1haw n GLN 160 Ca -0.02 -2.29 0.00 0.00 -0.01 0.00 0.00 57.00 54.67 1haw n GLN 160 Cb 0.16 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 29.91 1haw n GLN 160 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1haw n GLY 161 N 1.52 0.60 3.75 1.08 0.00 -0.55 -5.03 105.19 106.56 1haw n GLY 161 Ca 0.21 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.83 1haw n GLY 161 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1haw s LYS 162 N -0.10 4.84 0.31 1.61 1.02 -1.26 -4.72 119.74 121.44 1haw s LYS 162 Ca 0.00 1.50 -0.29 0.00 0.02 0.00 0.00 55.97 57.20 1haw s LYS 162 Cb 0.00 -3.28 -0.10 0.00 -0.52 0.00 0.00 37.83 33.92 1haw s LYS 162 CO 0.00 0.49 1.37 -1.25 -0.92 0.00 0.00 175.35 175.03 1haw s PRO 163 N -1.10 4.30 0.05 -1.68 0.04 -1.26 -0.38 135.00 134.97 1haw s PRO 163 Ca 0.42 2.28 0.08 0.00 0.04 0.00 0.00 61.00 63.82 1haw s PRO 163 Cb -0.26 -3.07 -0.03 0.00 0.04 0.00 0.00 34.50 31.17 1haw s PRO 163 CO 0.32 -0.30 -0.22 -0.51 0.04 0.00 0.00 177.00 176.33 1haw s LEU 164 N -1.34 2.43 -0.00 -3.56 1.43 -0.39 -4.82 118.68 112.41 1haw s LEU 164 Ca 0.53 -0.51 -0.04 0.00 -1.03 0.00 0.00 54.13 53.08 1haw s LEU 164 Cb -0.41 -1.41 -0.00 0.00 0.03 0.00 0.00 46.19 44.39 1haw s LEU 164 CO 0.51 0.25 0.07 -2.28 0.23 0.00 0.00 176.35 175.13 1haw s HIS 165 N -0.89 0.07 0.12 0.29 5.65 -1.26 -4.18 115.29 115.09 1haw s HIS 165 Ca 0.14 -0.16 0.10 0.00 0.25 0.00 0.00 55.06 55.39 1haw s HIS 165 Cb -0.10 -0.07 -0.04 0.00 -1.18 0.00 0.00 32.58 31.19 1haw s HIS 165 CO 0.04 -0.19 -0.26 1.52 -0.65 0.00 0.00 174.74 175.21 1haw s TYR 166 N -1.01 2.19 -0.02 3.88 1.13 -1.26 -4.85 117.35 117.41 1haw s TYR 166 Ca -0.11 -0.39 0.06 0.00 -1.41 0.00 0.00 57.07 55.22 1haw s TYR 166 Cb -0.06 -1.20 -0.24 0.00 -1.10 0.00 0.00 41.96 39.36 1haw s TYR 166 CO 0.00 0.29 0.76 -0.44 -2.51 0.00 0.00 175.55 173.65 1haw h ASP 167 N 4.00 0.14 -4.48 -0.18 3.32 -0.91 -3.48 116.42 114.83 1haw h ASP 167 Ca -0.49 -0.24 -0.13 0.00 0.02 0.00 0.00 57.03 56.18 1haw h ASP 167 Cb 1.17 -0.05 -0.22 0.00 0.22 0.00 0.00 39.33 40.45 1haw h ASP 167 CO 0.40 1.21 -0.32 -0.60 -1.72 0.00 0.00 179.24 178.21 1haw s ARG 168 N -2.61 0.52 -0.04 3.56 6.06 -1.09 -5.02 118.95 120.33 1haw s ARG 168 Ca -0.07 0.07 0.04 0.00 -2.50 0.00 0.00 55.73 53.28 1haw s ARG 168 Cb 0.08 0.24 -0.00 0.00 0.06 0.00 0.00 34.95 35.32 1haw s ARG 168 CO 0.82 -0.12 -0.16 0.00 -2.50 0.00 0.00 175.30 173.34 1haw s ALA 169 N -0.67 1.45 0.07 6.12 0.00 -1.26 -0.67 121.76 126.79 1haw s ALA 169 Ca -0.08 -0.66 0.07 0.00 0.00 0.00 0.00 51.96 51.29 1haw s ALA 169 Cb -0.04 -0.46 -0.03 0.00 0.00 0.00 0.00 23.12 22.59 1haw s ALA 169 CO 0.02 0.28 -0.19 0.71 0.00 0.00 0.00 175.76 176.58 1haw s TYR 170 N -0.02 1.67 -0.14 0.00 2.02 0.09 -4.15 117.35 116.81 1haw s TYR 170 Ca -0.02 -0.39 0.02 0.00 -0.37 0.00 0.00 57.07 56.31 1haw s TYR 170 Cb -0.10 -0.96 0.01 0.00 -0.40 0.00 0.00 41.96 40.51 1haw s TYR 170 CO 0.02 0.12 -0.19 -0.08 -1.57 0.00 0.00 175.55 173.85 1haw s THR 171 N -0.97 1.82 -0.14 -0.71 -1.32 -0.26 -1.23 115.64 112.82 1haw s THR 171 Ca 0.05 -0.82 0.01 0.00 -1.21 0.00 0.00 61.69 59.72 1haw s THR 171 Cb -0.09 -1.64 -0.00 0.00 -1.51 0.00 0.00 72.50 69.26 1haw s THR 171 CO 0.03 0.50 -0.16 -0.63 -2.21 0.00 0.00 174.62 172.15 1haw s ILE 172 N 1.02 2.64 -0.10 5.08 1.09 0.17 -4.42 121.20 126.67 1haw s ILE 172 Ca -0.04 -0.79 -0.02 0.00 -1.10 0.00 0.00 60.65 58.70 1haw s ILE 172 Cb -0.15 -2.10 -0.03 0.00 -1.06 0.00 0.00 42.46 39.12 1haw s ILE 172 CO -0.04 0.52 -0.01 -0.83 -0.10 0.00 0.00 174.94 174.48 1haw s GLY 173 N 0.69 1.81 -0.19 6.18 0.00 -1.26 -1.40 107.32 113.14 1haw s GLY 173 Ca -0.08 -0.81 -0.00 0.00 0.00 0.00 0.00 44.72 43.82 1haw s GLY 173 CO 0.02 -0.44 -0.15 1.85 0.00 0.00 0.00 173.10 174.38 1haw s GLU 174 N -0.54 3.12 -0.20 2.90 2.12 -0.67 -0.54 118.70 124.89 1haw s GLU 174 Ca 0.09 -0.77 -0.01 0.00 0.36 0.00 0.00 54.97 54.64 1haw s GLU 174 Cb -0.12 -2.70 0.01 0.00 0.26 0.00 0.00 34.13 31.58 1haw s GLU 174 CO 0.02 -0.18 -0.13 -0.06 -0.54 0.00 0.00 175.26 174.37 1haw s PHE 175 N 1.29 2.87 -0.36 5.30 0.08 -0.24 -4.52 117.98 122.39 1haw s PHE 175 Ca 0.04 -1.34 -0.25 0.00 0.12 0.00 0.00 56.93 55.50 1haw s PHE 175 Cb -0.14 -2.00 0.01 0.00 -0.57 0.00 0.00 43.02 40.32 1haw s PHE 175 CO -0.09 -0.69 0.89 0.16 -0.10 0.00 0.00 175.22 175.39 1haw s ASP 176 N 1.37 6.66 -0.00 1.36 -4.77 -1.26 -1.11 116.67 118.91 1haw s ASP 176 Ca 0.05 0.54 0.00 0.00 -3.30 0.00 0.00 52.55 49.85 1haw s ASP 176 Cb -0.14 -2.45 -0.04 0.00 -1.09 0.00 0.00 42.92 39.21 1haw s ASP 176 CO -0.09 -0.82 0.05 -0.76 0.70 0.00 0.00 175.17 174.26 1haw s LEU 177 N 3.36 3.74 -0.62 2.11 1.43 -0.28 -4.86 118.68 123.56 1haw s LEU 177 Ca 0.36 0.08 0.06 0.00 -1.03 0.00 0.00 54.13 53.60 1haw s LEU 177 Cb -0.12 -2.16 0.23 0.00 0.03 0.00 0.00 46.19 44.16 1haw s LEU 177 CO 0.18 0.28 0.65 -1.22 0.23 0.00 0.00 176.35 176.46 1haw n TYR 178 N 1.27 2.93 -3.21 0.29 4.01 -1.26 -0.55 117.16 120.63 1haw n TYR 178 Ca -0.14 -4.10 -0.39 0.00 -0.16 0.00 0.00 57.90 53.11 1haw n TYR 178 Cb 0.53 -0.52 -0.07 0.00 -0.31 0.00 0.00 39.34 38.97 1haw n TYR 178 CO 0.00 0.00 0.00 0.42 -0.46 0.00 0.00 176.86 176.82 1haw s ILE 179 N -1.99 5.08 0.49 -0.72 1.01 -1.26 -4.74 121.20 119.07 1haw s ILE 179 Ca 0.36 1.01 -0.22 0.00 0.00 0.00 0.00 60.65 61.79 1haw s ILE 179 Cb 0.10 -3.87 -0.06 0.00 0.01 0.00 0.00 42.46 38.64 1haw s ILE 179 CO -0.07 0.15 1.23 -2.84 0.00 0.00 0.00 174.94 173.41 1haw s PRO 180 N 1.79 3.52 0.01 2.79 0.02 -1.26 -4.83 135.00 137.04 1haw s PRO 180 Ca 0.25 1.93 0.06 0.00 0.02 0.00 0.00 61.00 63.26 1haw s PRO 180 Cb -0.16 -2.34 -0.03 0.00 0.02 0.00 0.00 34.50 32.00 1haw s PRO 180 CO 0.10 -0.79 -0.17 0.15 -0.33 0.00 0.00 177.00 175.95 1haw s LYS 181 N -2.79 2.23 0.50 5.54 1.02 -1.26 -0.60 119.74 124.37 1haw s LYS 181 Ca 0.67 -0.88 0.07 0.00 0.02 0.00 0.00 55.97 55.85 1haw s LYS 181 Cb -0.33 -2.25 0.03 0.00 -0.52 0.00 0.00 37.83 34.77 1haw s LYS 181 CO 0.39 0.57 0.51 0.20 -0.92 0.00 0.00 175.35 176.10 1haw s GLY 182 N -1.15 2.10 0.31 -3.33 0.00 0.09 -4.85 107.32 100.50 1haw s GLY 182 Ca 0.13 -1.72 0.03 0.00 0.00 0.00 0.00 44.72 43.17 1haw s GLY 182 CO 0.03 -1.77 1.58 -2.55 0.00 0.00 0.00 173.10 170.40 1haw h PRO 183 N 0.69 0.03 -1.48 2.90 0.11 -2.02 0.69 132.00 132.92 1haw h PRO 183 Ca -0.37 -0.00 0.43 0.00 0.11 0.00 0.00 66.00 66.18 1haw h PRO 183 Cb 1.29 -0.01 -0.08 0.00 0.11 0.00 0.00 31.00 32.31 1haw h PRO 183 CO 0.52 0.02 1.04 0.38 -0.21 0.00 0.00 178.00 179.75 1haw h ASP 184 N 0.03 0.08 -0.01 -2.05 3.04 -2.03 -3.42 116.42 112.06 1haw h ASP 184 Ca 0.61 0.03 0.00 0.00 -3.24 0.00 0.00 57.03 54.44 1haw h ASP 184 Cb 1.30 0.02 0.00 0.00 -1.04 0.00 0.00 39.33 39.62 1haw h ASP 184 CO -0.88 -0.03 0.00 0.61 -2.04 0.00 0.00 179.24 176.90 1haw n GLY 185 N -1.75 1.15 3.30 7.15 0.00 0.24 -5.06 105.19 110.23 1haw n GLY 185 Ca 0.34 -0.46 -0.29 0.00 0.00 0.00 0.00 46.02 45.62 1haw n GLY 185 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1haw s LYS 186 N -2.55 1.75 0.31 1.61 1.02 -1.22 -4.94 119.74 115.73 1haw s LYS 186 Ca 0.00 -1.00 -0.29 0.00 0.02 0.00 0.00 55.97 54.70 1haw s LYS 186 Cb 0.00 -1.85 -0.10 0.00 -0.52 0.00 0.00 37.83 35.36 1haw s LYS 186 CO 0.00 0.49 1.24 0.71 -0.92 0.00 0.00 175.35 176.87 1haw s TYR 187 N -0.73 3.22 0.49 3.18 2.02 -1.26 -0.73 117.35 123.54 1haw s TYR 187 Ca 0.10 1.50 -0.21 0.00 -0.37 0.00 0.00 57.07 58.09 1haw s TYR 187 Cb -0.10 -3.55 -0.07 0.00 -0.40 0.00 0.00 41.96 37.84 1haw s TYR 187 CO 0.01 -1.45 1.10 0.15 -1.57 0.00 0.00 175.55 173.79 1haw s LYS 188 N -1.63 3.68 -0.09 -0.62 1.02 0.23 -4.85 119.74 117.48 1haw s LYS 188 Ca 0.48 1.55 0.03 0.00 0.02 0.00 0.00 55.97 58.05 1haw s LYS 188 Cb -0.37 -2.18 -0.02 0.00 -0.52 0.00 0.00 37.83 34.74 1haw s LYS 188 CO 0.49 -0.57 -0.17 0.34 -0.92 0.00 0.00 175.35 174.52 1haw s ASP 189 N -1.73 3.70 -0.05 2.83 -1.08 -1.26 -4.78 116.67 114.30 1haw s ASP 189 Ca 0.67 -0.36 0.03 0.00 -0.52 0.00 0.00 52.55 52.38 1haw s ASP 189 Cb -0.22 -1.19 -0.03 0.00 -1.46 0.00 0.00 42.92 40.02 1haw s ASP 189 CO 0.26 0.23 -0.12 -0.31 0.52 0.00 0.00 175.17 175.76 1haw s TYR 190 N -0.08 2.77 0.14 -5.34 2.02 -1.26 -5.03 117.35 110.57 1haw s TYR 190 Ca -0.04 -0.11 -0.12 0.00 -0.37 0.00 0.00 57.07 56.44 1haw s TYR 190 Cb -0.14 -1.64 -0.02 0.00 -0.40 0.00 0.00 41.96 39.76 1haw s TYR 190 CO 0.04 0.24 1.53 0.00 -1.57 0.00 0.00 175.55 175.78 1haw h ALA 191 N 5.23 0.62 -2.20 3.71 0.00 -2.00 -3.46 119.26 121.16 1haw h ALA 191 Ca -0.47 -0.38 -0.39 0.00 0.00 0.00 0.00 54.91 53.67 1haw h ALA 191 Cb 1.16 -0.15 -0.14 0.00 0.00 0.00 0.00 17.79 18.65 1haw h ALA 191 CO 0.51 0.59 -0.70 0.95 0.00 0.00 0.00 179.25 180.60 1haw s THR 192 N -4.65 1.34 0.11 0.00 -4.23 -1.26 -5.05 115.64 101.89 1haw s THR 192 Ca -0.12 -2.10 -0.26 0.00 -1.18 0.00 0.00 61.69 58.03 1haw s THR 192 Cb 0.11 -2.10 -0.10 0.00 1.34 0.00 0.00 72.50 71.76 1haw s THR 192 CO 0.86 -0.55 1.67 0.25 -0.54 0.00 0.00 174.62 176.31 1haw h LEU 193 N 2.58 -0.51 -1.49 4.79 5.85 -1.95 -2.74 115.31 121.84 1haw h LEU 193 Ca -0.38 0.06 0.16 0.00 0.84 0.00 0.00 57.88 58.56 1haw h LEU 193 Cb 1.21 0.19 -0.06 0.00 0.37 0.00 0.00 40.66 42.37 1haw h LEU 193 CO 0.64 -0.27 0.54 0.00 -0.34 0.00 0.00 178.44 179.01 1haw h ALA 194 N 0.45 2.05 0.00 1.25 0.00 -1.99 -0.93 119.26 120.08 1haw h ALA 194 Ca 0.02 0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.89 1haw h ALA 194 Cb 0.38 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 1haw h ALA 194 CO -0.09 -0.28 -0.23 1.49 0.00 0.00 0.00 179.25 180.14 1haw h GLU 195 N 0.49 0.00 0.00 0.00 4.81 -1.91 -3.06 114.58 114.91 1haw h GLU 195 Ca 0.41 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.64 1haw h GLU 195 Cb 0.87 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.25 1haw h GLU 195 CO -0.15 0.23 0.00 0.66 -0.73 0.00 0.00 179.01 179.01 1haw h SER 196 N 0.00 0.00 -0.01 1.04 4.64 -1.14 -3.41 113.55 114.67 1haw h SER 196 Ca -0.00 0.00 0.01 0.00 -0.47 0.00 0.00 61.79 61.33 1haw h SER 196 Cb 0.54 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.60 1haw h SER 196 CO 0.03 0.00 -0.29 0.22 -0.87 0.00 0.00 176.83 175.92 1haw h TYR 197 N 0.00 -0.85 -0.43 4.77 3.20 -1.60 -2.05 116.97 120.01 1haw h TYR 197 Ca 0.00 0.03 0.08 0.00 3.14 0.00 0.00 58.73 61.98 1haw h TYR 197 Cb 0.89 0.37 -0.08 0.00 1.54 0.00 0.00 36.73 39.46 1haw h TYR 197 CO 0.00 -0.31 -0.05 0.78 -1.64 0.00 0.00 178.16 176.95 1haw h GLY 198 N -0.35 0.39 1.02 1.82 0.00 -1.82 -0.85 103.07 103.28 1haw h GLY 198 Ca 0.01 0.09 -0.07 0.00 0.00 0.00 0.00 47.33 47.36 1haw h GLY 198 CO -0.20 -0.14 0.05 -0.55 0.00 0.00 0.00 176.54 175.71 1haw h ASP 199 N 0.06 0.89 -0.64 0.19 3.32 -1.84 -3.09 116.42 115.31 1haw h ASP 199 Ca 0.21 -0.28 -0.03 0.00 0.02 0.00 0.00 57.03 56.95 1haw h ASP 199 Cb 0.32 -0.24 -0.03 0.00 0.22 0.00 0.00 39.33 39.60 1haw h ASP 199 CO -0.40 0.95 0.28 0.74 -1.72 0.00 0.00 179.24 179.09 1haw h THR 200 N 0.80 1.23 -0.40 0.35 2.02 -0.58 -2.47 112.91 113.86 1haw h THR 200 Ca 0.16 -0.67 -0.02 0.00 0.77 0.00 0.00 66.41 66.65 1haw h THR 200 Cb 0.46 0.49 -0.02 0.00 -1.74 0.00 0.00 68.15 67.34 1haw h THR 200 CO 0.02 0.27 0.17 0.58 0.37 0.00 0.00 175.52 176.93 1haw h VAL 201 N 0.88 1.15 -0.57 3.16 2.07 -1.18 0.58 116.25 122.35 1haw h VAL 201 Ca 0.22 -0.44 -0.09 0.00 0.82 0.00 0.00 66.70 67.21 1haw h VAL 201 Cb 0.16 0.66 -0.02 0.00 -1.52 0.00 0.00 31.29 30.57 1haw h VAL 201 CO -0.02 0.17 0.01 -0.61 0.02 0.00 0.00 177.57 177.14 1haw h GLN 202 N 0.56 0.97 -0.27 1.57 4.15 -1.38 -1.77 115.11 118.95 1haw h GLN 202 Ca 0.14 -0.29 -0.12 0.00 0.77 0.00 0.00 58.65 59.16 1haw h GLN 202 Cb 0.09 -0.10 -0.00 0.00 0.21 0.00 0.00 27.48 27.68 1haw h GLN 202 CO -0.02 0.95 -0.29 0.28 -1.93 0.00 0.00 178.83 177.82 1haw h VAL 203 N 0.90 1.31 -0.54 2.39 2.07 -0.96 -3.23 116.25 118.19 1haw h VAL 203 Ca 0.17 -1.47 0.10 0.00 0.82 0.00 0.00 66.70 66.31 1haw h VAL 203 Cb 0.51 1.63 -0.08 0.00 -1.52 0.00 0.00 31.29 31.83 1haw h VAL 203 CO 0.02 0.47 0.10 0.24 0.02 0.00 0.00 177.57 178.42 1haw h MET 204 N 0.41 0.23 0.00 1.57 2.86 -0.58 -2.09 114.93 117.32 1haw h MET 204 Ca 0.04 -0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.67 1haw h MET 204 Cb 0.87 -0.05 0.00 0.00 0.06 0.00 0.00 31.60 32.47 1haw h MET 204 CO 0.07 0.15 0.05 0.00 1.06 0.00 0.00 176.91 178.24 1haw h ARG 205 N 0.24 0.00 0.00 1.72 3.08 -1.34 -0.62 114.38 117.45 1haw h ARG 205 Ca 0.27 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.32 1haw h ARG 205 Cb 0.39 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.44 1haw h ARG 205 CO -0.36 0.00 0.00 0.25 -1.07 0.00 0.00 179.97 178.79 1haw n THR 206 N -2.65 0.18 -1.46 2.04 -2.24 -0.79 -4.92 114.28 104.44 1haw n THR 206 Ca -0.02 -0.08 -0.16 0.00 -2.27 0.00 0.00 64.05 61.52 1haw n THR 206 Cb 0.10 -0.53 -0.07 0.00 -2.10 0.00 0.00 70.33 67.73 1haw n THR 206 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1haw n LEU 207 N -1.72 -0.97 -4.03 3.22 4.77 -0.24 -4.95 117.00 113.07 1haw n LEU 207 Ca 0.07 0.39 -0.31 0.00 -0.03 0.00 0.00 56.01 56.12 1haw n LEU 207 Cb 0.36 -2.65 -0.15 0.00 -2.33 0.00 0.00 43.42 38.65 1haw n LEU 207 CO 0.28 -1.01 -0.40 -0.89 -1.33 0.00 0.00 177.39 174.04 1haw s THR 208 N -2.41 2.16 0.59 -5.08 2.01 -1.26 -5.11 115.64 106.55 1haw s THR 208 Ca 0.00 -1.93 -0.19 0.00 0.31 0.00 0.00 61.69 59.87 1haw s THR 208 Cb 0.00 -2.43 -0.04 0.00 0.01 0.00 0.00 72.50 70.04 1haw s THR 208 CO 0.00 -0.30 1.24 -2.84 -0.69 0.00 0.00 174.62 172.02 1haw s PRO 209 N 1.03 2.97 0.07 4.92 0.02 -1.26 -4.90 135.00 137.85 1haw s PRO 209 Ca 0.01 1.91 0.10 0.00 0.02 0.00 0.00 61.00 63.04 1haw s PRO 209 Cb -0.19 -1.98 -0.19 0.00 0.02 0.00 0.00 34.50 32.15 1haw s PRO 209 CO -0.07 -1.23 1.03 0.66 -0.33 0.00 0.00 177.00 177.07 1haw h SER 210 N 0.97 0.00 -4.90 2.53 4.64 -1.15 -3.47 113.55 112.17 1haw h SER 210 Ca -0.51 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 60.68 1haw h SER 210 Cb 1.30 0.00 -0.21 0.00 -0.31 0.00 0.00 62.40 63.19 1haw h SER 210 CO 0.55 0.94 -0.36 -1.00 -0.87 0.00 0.00 176.83 176.09 1haw s HIS 211 N -2.70 -0.11 -0.12 4.77 3.76 -1.20 -4.90 115.29 114.79 1haw s HIS 211 Ca -0.01 0.16 -0.02 0.00 -0.15 0.00 0.00 55.06 55.04 1haw s HIS 211 Cb 0.09 0.05 0.04 0.00 1.11 0.00 0.00 32.58 33.87 1haw s HIS 211 CO 0.82 -0.34 0.02 0.42 -0.85 0.00 0.00 174.74 174.81 1haw s ILE 212 N -1.24 0.44 0.18 0.60 1.01 -0.32 -1.13 121.20 120.74 1haw s ILE 212 Ca -0.13 -0.16 0.08 0.00 0.00 0.00 0.00 60.65 60.44 1haw s ILE 212 Cb -0.06 -0.74 -0.04 0.00 0.01 0.00 0.00 42.46 41.62 1haw s ILE 212 CO 0.03 0.06 -0.17 0.68 0.00 0.00 0.00 174.94 175.54 1haw s VAL 213 N 1.93 1.82 -0.02 2.92 -7.23 -0.27 -1.64 120.40 117.91 1haw s VAL 213 Ca 0.03 -2.00 -0.20 0.00 -1.81 0.00 0.00 61.98 58.00 1haw s VAL 213 Cb -0.14 -1.90 -0.05 0.00 0.56 0.00 0.00 36.38 34.84 1haw s VAL 213 CO -0.07 -0.38 0.56 -0.36 -0.31 0.00 0.00 175.10 174.54 1haw s PHE 214 N -2.28 3.66 -1.47 2.82 0.08 -1.26 -1.08 117.98 118.45 1haw s PHE 214 Ca 0.18 1.13 -0.02 0.00 0.12 0.00 0.00 56.93 58.34 1haw s PHE 214 Cb -0.05 -2.57 0.00 0.00 -0.57 0.00 0.00 43.02 39.83 1haw s PHE 214 CO 0.07 0.34 0.21 0.09 -0.10 0.00 0.00 175.22 175.83 1haw n ASN 215 N 2.82 0.12 0.00 1.36 4.13 0.30 -3.09 115.26 120.90 1haw n ASN 215 Ca -0.07 -1.17 0.00 0.00 1.68 0.00 0.00 54.58 55.02 1haw n ASN 215 Cb 0.51 -2.21 0.00 0.00 -1.54 0.00 0.00 39.78 36.54 1haw n ASN 215 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1haw n GLY 216 N -2.31 2.41 3.54 7.41 0.00 -1.22 -4.74 105.19 110.28 1haw n GLY 216 Ca -0.31 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.63 1haw n GLY 216 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1haw s LYS 217 N -0.85 0.67 0.31 1.61 -2.85 -1.18 -4.63 119.74 112.81 1haw s LYS 217 Ca 0.00 -0.15 -0.30 0.00 -1.00 0.00 0.00 55.97 54.53 1haw s LYS 217 Cb 0.00 0.31 -0.11 0.00 -2.06 0.00 0.00 37.83 35.97 1haw s LYS 217 CO 0.00 -0.27 1.55 0.08 0.10 0.00 0.00 175.35 176.81 1haw s VAL 218 N -2.45 2.12 -0.05 1.79 1.01 0.17 -1.86 120.40 121.12 1haw s VAL 218 Ca 0.04 0.11 0.00 0.00 0.00 0.00 0.00 61.98 62.13 1haw s VAL 218 Cb -0.01 -3.07 0.00 0.00 0.00 0.00 0.00 36.38 33.30 1haw s VAL 218 CO -0.05 0.02 0.00 0.61 0.00 0.00 0.00 175.10 175.67 1haw n GLY 219 N 1.76 0.44 0.34 4.51 0.00 -1.26 -4.77 105.19 106.21 1haw n GLY 219 Ca 0.06 -0.11 -0.00 0.00 0.00 0.00 0.00 46.02 45.97 1haw n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1haw h ALA 220 N 0.00 1.40 -0.21 4.61 0.00 -1.61 -2.64 119.26 120.81 1haw h ALA 220 Ca -0.01 -0.09 -0.07 0.00 0.00 0.00 0.00 54.91 54.75 1haw h ALA 220 Cb 0.20 -0.29 -0.04 0.00 0.00 0.00 0.00 17.79 17.65 1haw h ALA 220 CO 0.01 0.52 -0.09 1.28 0.00 0.00 0.00 179.25 180.97 1haw n LEU 221 N -4.39 3.51 -4.74 0.00 4.77 -1.26 -4.72 117.00 110.17 1haw n LEU 221 Ca 0.07 -3.43 -0.23 0.00 -0.03 0.00 0.00 56.01 52.39 1haw n LEU 221 Cb 0.07 -0.55 -0.06 0.00 -2.33 0.00 0.00 43.42 40.54 1haw n LEU 221 CO 0.37 0.99 -0.18 0.42 -1.33 0.00 0.00 177.39 177.66 1haw s THR 222 N -3.05 2.93 0.00 -5.08 -4.23 -1.00 -0.34 115.64 104.87 1haw s THR 222 Ca 0.40 -1.67 0.00 0.00 -1.18 0.00 0.00 61.69 59.24 1haw s THR 222 Cb 0.36 -2.98 0.00 0.00 1.34 0.00 0.00 72.50 71.21 1haw s THR 222 CO 0.02 -0.15 0.00 0.61 -0.54 0.00 0.00 174.62 174.56 1haw n GLY 223 N -1.18 3.25 0.25 3.99 0.00 -1.26 -1.39 105.19 108.85 1haw n GLY 223 Ca -0.02 0.26 0.10 0.00 0.00 0.00 0.00 46.02 46.36 1haw n GLY 223 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1haw h ALA 224 N -0.68 1.54 -0.61 4.61 0.00 -1.94 -2.53 119.26 119.66 1haw h ALA 224 Ca 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.80 1haw h ALA 224 Cb 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.77 1haw h ALA 224 CO 0.00 0.15 0.00 0.09 0.00 0.00 0.00 179.25 179.49 1haw n ASN 225 N -4.02 4.51 -4.41 0.00 3.02 -0.48 -4.99 115.26 108.89 1haw n ASN 225 Ca -0.02 -2.43 -0.35 0.00 -0.03 0.00 0.00 54.58 51.75 1haw n ASN 225 Cb 0.21 -0.56 0.09 0.00 -0.61 0.00 0.00 39.78 38.91 1haw n ASN 225 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1haw n ALA 226 N 1.04 -2.35 -1.66 5.41 0.00 -0.95 -4.35 120.51 117.65 1haw n ALA 226 Ca 0.24 -0.45 -0.31 0.00 0.00 0.00 0.00 53.44 52.92 1haw n ALA 226 Cb 0.85 -1.77 0.04 0.00 0.00 0.00 0.00 19.45 18.57 1haw n ALA 226 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1haw s LEU 227 N 0.01 3.18 0.10 0.00 1.43 0.56 -4.84 118.68 119.13 1haw s LEU 227 Ca 0.59 1.57 0.05 0.00 -1.03 0.00 0.00 54.13 55.31 1haw s LEU 227 Cb -0.27 -4.49 -0.03 0.00 0.03 0.00 0.00 46.19 41.42 1haw s LEU 227 CO 0.64 -1.26 -0.12 0.42 0.23 0.00 0.00 176.35 176.26 1haw s THR 228 N -3.05 1.09 0.27 5.49 -4.23 -1.26 -0.08 115.64 113.87 1haw s THR 228 Ca 0.57 -1.58 -0.20 0.00 -1.18 0.00 0.00 61.69 59.30 1haw s THR 228 Cb -0.13 -1.34 0.06 0.00 1.34 0.00 0.00 72.50 72.43 1haw s THR 228 CO 0.53 -0.44 0.90 0.00 -0.54 0.00 0.00 174.62 175.07 1haw s ALA 229 N -2.08 -1.23 0.07 3.99 0.00 -0.88 -4.91 121.76 116.73 1haw s ALA 229 Ca 0.05 -0.43 0.06 0.00 0.00 0.00 0.00 51.96 51.63 1haw s ALA 229 Cb -0.05 0.72 -0.03 0.00 0.00 0.00 0.00 23.12 23.76 1haw s ALA 229 CO 0.01 -1.03 -0.15 0.15 0.00 0.00 0.00 175.76 174.74 1haw s LYS 230 N -2.55 0.89 0.23 0.00 1.02 -1.26 -1.74 119.74 116.32 1haw s LYS 230 Ca 0.17 -0.96 -0.31 0.00 0.02 0.00 0.00 55.97 54.89 1haw s LYS 230 Cb -0.04 -0.94 -0.14 0.00 -0.52 0.00 0.00 37.83 36.20 1haw s LYS 230 CO 0.07 0.21 1.39 0.28 -0.92 0.00 0.00 175.35 176.38 1haw n VAL 231 N 1.35 0.95 0.00 3.17 0.31 0.04 -1.09 118.33 123.05 1haw n VAL 231 Ca -0.20 -0.24 0.00 0.00 -0.01 0.00 0.00 64.34 63.89 1haw n VAL 231 Cb 0.54 -1.42 0.00 0.00 -0.91 0.00 0.00 33.84 32.05 1haw n VAL 231 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1haw n GLY 232 N 2.14 2.24 3.81 2.92 0.00 0.42 -4.99 105.19 111.74 1haw n GLY 232 Ca 0.12 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.78 1haw n GLY 232 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1haw s GLU 233 N -0.75 4.30 -0.27 1.61 2.02 -0.25 -4.82 118.70 120.54 1haw s GLU 233 Ca 0.00 1.00 -0.09 0.00 0.02 0.00 0.00 54.97 55.90 1haw s GLU 233 Cb 0.00 -2.70 -0.03 0.00 0.10 0.00 0.00 34.13 31.50 1haw s GLU 233 CO 0.00 0.27 0.12 0.99 0.02 0.00 0.00 175.26 176.66 1haw s THR 234 N -1.70 4.61 0.02 3.63 2.01 -1.26 -1.95 115.64 120.99 1haw s THR 234 Ca 0.49 -0.14 0.02 0.00 0.31 0.00 0.00 61.69 62.37 1haw s THR 234 Cb -0.15 -3.21 -0.04 0.00 0.01 0.00 0.00 72.50 69.11 1haw s THR 234 CO 0.20 0.26 0.01 0.68 -0.69 0.00 0.00 174.62 175.08 1haw s VAL 235 N 1.65 4.15 -0.24 3.82 -7.23 -0.02 -0.13 120.40 122.39 1haw s VAL 235 Ca 0.06 -0.69 -0.07 0.00 -1.81 0.00 0.00 61.98 59.47 1haw s VAL 235 Cb -0.16 -2.89 -0.03 0.00 0.56 0.00 0.00 36.38 33.87 1haw s VAL 235 CO 0.06 0.31 0.06 -0.22 -0.31 0.00 0.00 175.10 175.00 1haw s LEU 236 N -1.77 3.41 -0.34 1.32 2.96 0.16 -1.88 118.68 122.53 1haw s LEU 236 Ca 0.21 -0.21 -0.08 0.00 -0.22 0.00 0.00 54.13 53.84 1haw s LEU 236 Cb -0.12 -1.91 0.03 0.00 0.50 0.00 0.00 46.19 44.69 1haw s LEU 236 CO 0.13 -0.03 0.13 -0.76 -1.32 0.00 0.00 176.35 174.50 1haw s LEU 237 N 1.56 4.34 -0.15 -0.68 1.43 -0.02 -0.73 118.68 124.42 1haw s LEU 237 Ca 0.06 -1.03 -0.15 0.00 -1.03 0.00 0.00 54.13 51.98 1haw s LEU 237 Cb -0.15 -1.91 -0.04 0.00 0.03 0.00 0.00 46.19 44.12 1haw s LEU 237 CO 0.03 -0.32 0.35 -0.63 0.23 0.00 0.00 176.35 176.01 1haw s ILE 238 N 1.46 5.27 -0.09 -0.59 1.01 -0.37 -1.58 121.20 126.31 1haw s ILE 238 Ca -0.00 0.67 -0.00 0.00 0.00 0.00 0.00 60.65 61.31 1haw s ILE 238 Cb -0.19 -3.69 0.02 0.00 0.01 0.00 0.00 42.46 38.62 1haw s ILE 238 CO 0.04 0.37 -0.05 -2.28 0.00 0.00 0.00 174.94 173.01 1haw s HIS 239 N 0.52 1.15 0.07 3.97 2.46 -0.31 -0.65 115.29 122.50 1haw s HIS 239 Ca 0.19 -0.49 0.09 0.00 0.47 0.00 0.00 55.06 55.32 1haw s HIS 239 Cb -0.14 -1.02 -0.03 0.00 -0.13 0.00 0.00 32.58 31.26 1haw s HIS 239 CO 0.06 -0.40 -0.21 -1.54 -2.47 0.00 0.00 174.74 170.17 1haw s SER 240 N 1.60 3.60 -0.22 9.88 1.04 -0.50 -1.79 113.70 127.32 1haw s SER 240 Ca 0.01 -0.54 -0.04 0.00 0.48 0.00 0.00 55.95 55.87 1haw s SER 240 Cb -0.13 -0.46 0.10 0.00 0.10 0.00 0.00 66.02 65.62 1haw s SER 240 CO -0.05 0.23 0.21 -1.58 0.98 0.00 0.00 173.24 173.02 1haw s GLN 241 N -1.64 0.20 0.00 4.02 -0.44 -0.82 -1.68 119.66 119.30 1haw s GLN 241 Ca 0.15 0.05 0.28 0.00 -2.50 0.00 0.00 55.36 53.34 1haw s GLN 241 Cb -0.10 -1.20 1.13 0.00 -1.64 0.00 0.00 33.01 31.20 1haw s GLN 241 CO 0.06 -0.75 1.82 0.00 0.50 0.00 0.00 175.29 176.92 1haw n ALA 242 N 5.31 2.73 0.00 1.58 0.00 -1.26 -0.38 120.51 128.48 1haw n ALA 242 Ca -0.05 -0.21 0.00 0.00 0.00 0.00 0.00 53.44 53.18 1haw n ALA 242 Cb 0.48 -1.36 0.00 0.00 0.00 0.00 0.00 19.45 18.57 1haw n ALA 242 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1haw n ASN 243 N -1.28 1.94 -3.94 0.00 5.15 -1.26 -3.18 115.26 112.68 1haw n ASN 243 Ca 0.10 0.00 -0.10 0.00 -0.60 0.00 0.00 54.58 53.98 1haw n ASN 243 Cb 0.30 0.25 -0.12 0.00 -0.53 0.00 0.00 39.78 39.69 1haw n ASN 243 CO 0.00 0.00 0.00 -0.60 1.40 0.00 0.00 177.26 178.06 1haw s ARG 244 N -1.21 0.24 0.81 1.20 3.52 -1.26 -4.68 118.95 117.56 1haw s ARG 244 Ca 0.00 -0.40 -0.12 0.00 -0.13 0.00 0.00 55.73 55.07 1haw s ARG 244 Cb 0.00 0.09 0.09 0.00 -1.56 0.00 0.00 34.95 33.56 1haw s ARG 244 CO 0.00 -0.04 1.17 -0.51 -0.81 0.00 0.00 175.30 175.11 1haw s ASP 245 N -1.01 3.71 0.15 -2.12 1.01 -1.26 -3.71 116.67 113.44 1haw s ASP 245 Ca -0.11 2.22 -0.09 0.00 0.71 0.00 0.00 52.55 55.27 1haw s ASP 245 Cb -0.07 -2.57 -0.01 0.00 1.01 0.00 0.00 42.92 41.28 1haw s ASP 245 CO -0.00 -2.58 0.27 0.28 0.21 0.00 0.00 175.17 173.35 1haw s THR 246 N -2.38 0.08 -0.40 -1.27 -1.32 -0.37 -4.87 115.64 105.10 1haw s THR 246 Ca 0.69 -1.33 0.03 0.00 -1.21 0.00 0.00 61.69 59.87 1haw s THR 246 Cb -0.25 -1.75 0.17 0.00 -1.51 0.00 0.00 72.50 69.16 1haw s THR 246 CO 0.52 -0.35 0.32 0.00 -2.21 0.00 0.00 174.62 172.90 1haw s ARG 247 N -3.95 0.85 0.50 7.08 1.70 -1.26 -1.29 118.95 122.58 1haw s ARG 247 Ca 0.15 -2.01 -0.22 0.00 -0.47 0.00 0.00 55.73 53.18 1haw s ARG 247 Cb 0.03 -1.39 -0.06 0.00 -0.57 0.00 0.00 34.95 32.96 1haw s ARG 247 CO -0.02 -1.37 1.20 -2.14 -1.08 0.00 0.00 175.30 171.90 1haw s PRO 248 N 0.19 3.53 -0.18 3.89 0.02 -1.16 -0.55 135.00 140.74 1haw s PRO 248 Ca 0.31 1.85 -0.18 0.00 0.02 0.00 0.00 61.00 63.00 1haw s PRO 248 Cb 0.01 -2.30 0.05 0.00 0.02 0.00 0.00 34.50 32.28 1haw s PRO 248 CO -0.17 -0.76 0.50 -1.58 -0.33 0.00 0.00 177.00 174.66 1haw s HIS 249 N -1.52 -0.54 -0.29 6.54 2.46 -0.55 -1.02 115.29 120.35 1haw s HIS 249 Ca 0.67 1.31 -0.07 0.00 0.47 0.00 0.00 55.06 57.43 1haw s HIS 249 Cb -0.31 0.19 0.00 0.00 -0.13 0.00 0.00 32.58 32.34 1haw s HIS 249 CO 0.36 -0.28 0.09 -1.17 -2.47 0.00 0.00 174.74 171.27 1haw s LEU 250 N 0.16 3.86 -0.06 8.88 2.96 -1.26 -1.16 118.68 132.06 1haw s LEU 250 Ca -0.01 -0.63 -0.30 0.00 -0.22 0.00 0.00 54.13 52.97 1haw s LEU 250 Cb -0.03 -1.90 -0.04 0.00 0.50 0.00 0.00 46.19 44.71 1haw s LEU 250 CO 0.01 -0.18 1.45 -0.63 -1.32 0.00 0.00 176.35 175.68 1haw s ILE 251 N 1.53 3.81 0.00 6.68 1.01 0.03 -1.65 121.20 132.61 1haw s ILE 251 Ca 0.03 1.09 0.00 0.00 0.00 0.00 0.00 60.65 61.77 1haw s ILE 251 Cb -0.17 -3.70 0.00 0.00 0.01 0.00 0.00 42.46 38.60 1haw s ILE 251 CO 0.03 -0.06 0.00 0.61 0.00 0.00 0.00 174.94 175.53 1haw n GLY 252 N 3.79 0.80 0.00 6.18 0.00 -1.26 -3.92 105.19 110.78 1haw n GLY 252 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.17 1haw n GLY 252 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1haw n GLY 253 N -2.00 5.22 3.49 -0.02 0.00 -0.66 -5.03 105.19 106.18 1haw n GLY 253 Ca 0.00 -1.68 -0.13 0.00 0.00 0.00 0.00 46.02 44.22 1haw n GLY 253 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1haw s HIS 254 N -0.94 0.87 -0.48 1.61 0.09 -1.26 -4.71 115.29 110.47 1haw s HIS 254 Ca 0.00 -1.14 -0.15 0.00 -0.00 0.00 0.00 55.06 53.77 1haw s HIS 254 Cb 0.00 -0.05 0.08 0.00 -0.00 0.00 0.00 32.58 32.61 1haw s HIS 254 CO 0.00 -1.05 0.40 0.20 -0.00 0.00 0.00 174.74 174.30 1haw s GLY 255 N -3.17 2.05 0.12 -2.22 0.00 -0.16 -4.76 107.32 99.18 1haw s GLY 255 Ca 0.29 -2.20 -0.20 0.00 0.00 0.00 0.00 44.72 42.62 1haw s GLY 255 CO 0.16 1.07 1.76 -0.55 0.00 0.00 0.00 173.10 175.55 1haw h ASP 256 N 8.75 0.15 -3.35 1.64 3.32 -1.31 -2.06 116.42 123.56 1haw h ASP 256 Ca -0.28 0.00 -0.39 0.00 0.02 0.00 0.00 57.03 56.38 1haw h ASP 256 Cb 1.11 -0.03 -0.37 0.00 0.22 0.00 0.00 39.33 40.26 1haw h ASP 256 CO 0.90 0.12 -0.75 0.26 -1.72 0.00 0.00 179.24 178.04 1haw s TRP 257 N -6.18 0.42 -0.03 4.55 0.52 -1.15 -3.00 118.94 114.08 1haw s TRP 257 Ca -0.13 -0.02 0.02 0.00 0.02 0.00 0.00 56.10 56.00 1haw s TRP 257 Cb 0.09 -0.60 0.00 0.00 -1.15 0.00 0.00 33.47 31.81 1haw s TRP 257 CO 0.69 -0.23 -0.09 0.08 0.02 0.00 0.00 176.95 177.42 1haw s VAL 258 N 1.69 0.78 -0.77 4.03 1.01 0.74 -0.20 120.40 127.67 1haw s VAL 258 Ca -0.00 -0.36 -0.03 0.00 0.00 0.00 0.00 61.98 61.58 1haw s VAL 258 Cb -0.13 -0.70 0.19 0.00 0.00 0.00 0.00 36.38 35.75 1haw s VAL 258 CO -0.03 0.25 0.63 0.26 0.00 0.00 0.00 175.10 176.20 1haw s TRP 259 N 0.19 3.66 0.12 5.22 0.51 -0.34 -0.88 118.94 127.43 1haw s TRP 259 Ca -0.03 -2.79 0.21 0.00 -2.12 0.00 0.00 56.10 51.36 1haw s TRP 259 Cb -0.08 -3.28 0.73 0.00 -0.81 0.00 0.00 33.47 30.02 1haw s TRP 259 CO 0.00 -0.81 1.75 1.05 -0.51 0.00 0.00 176.95 178.44 1haw h GLU 260 N 6.63 0.00 -0.00 4.98 4.11 -1.87 -1.73 114.58 126.70 1haw h GLU 260 Ca 0.08 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.51 1haw h GLU 260 Cb 0.90 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.15 1haw h GLU 260 CO 0.78 0.31 -0.17 0.25 0.07 0.00 0.00 179.01 180.26 1haw n THR 261 N -3.44 0.00 -1.02 -1.06 -2.24 -1.26 -4.39 114.28 100.87 1haw n THR 261 Ca 0.00 -0.01 -0.01 0.00 -2.27 0.00 0.00 64.05 61.76 1haw n THR 261 Cb 0.49 -0.19 -0.00 0.00 -2.10 0.00 0.00 70.33 68.52 1haw n THR 261 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1haw n GLY 262 N 1.44 0.45 3.14 3.38 0.00 -0.68 -4.78 105.19 108.14 1haw n GLY 262 Ca 0.09 -0.90 -0.33 0.00 0.00 0.00 0.00 46.02 44.87 1haw n GLY 262 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1haw s LYS 263 N -1.79 2.75 0.00 1.61 -0.14 -1.26 -0.43 119.74 120.48 1haw s LYS 263 Ca 0.00 -1.02 0.19 0.00 -1.36 0.00 0.00 55.97 53.78 1haw s LYS 263 Cb 0.00 -2.83 0.83 0.00 -1.68 0.00 0.00 37.83 34.14 1haw s LYS 263 CO 0.00 -0.38 1.59 1.19 -0.76 0.00 0.00 175.35 176.99 1haw n PHE 264 N 4.60 0.00 0.71 3.18 3.72 -1.17 -1.71 117.46 126.79 1haw n PHE 264 Ca -0.17 0.00 0.12 0.00 -0.05 0.00 0.00 57.45 57.35 1haw n PHE 264 Cb 0.47 -0.45 0.48 0.00 -0.94 0.00 0.00 39.48 39.04 1haw n PHE 264 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1haw n ALA 265 N -1.45 2.13 -2.56 4.37 0.00 -1.26 -4.73 120.51 117.00 1haw n ALA 265 Ca 0.05 -0.04 -0.31 0.00 0.00 0.00 0.00 53.44 53.15 1haw n ALA 265 Cb 0.20 -1.43 -0.05 0.00 0.00 0.00 0.00 19.45 18.18 1haw n ALA 265 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 1haw s ASN 266 N -3.73 6.53 0.26 0.00 0.01 -0.69 -5.05 114.94 112.26 1haw s ASN 266 Ca 0.10 0.72 -0.30 0.00 -0.71 0.00 0.00 52.86 52.67 1haw s ASN 266 Cb 0.14 -2.14 -0.10 0.00 0.41 0.00 0.00 41.25 39.56 1haw s ASN 266 CO 0.50 -0.04 1.40 -2.16 -1.51 0.00 0.00 177.10 175.29 1haw s PRO 267 N -2.89 4.30 0.88 -0.60 0.04 -1.26 -4.97 135.00 130.50 1haw s PRO 267 Ca 0.44 2.26 -0.12 0.00 0.04 0.00 0.00 61.00 63.62 1haw s PRO 267 Cb -0.11 -3.11 0.12 0.00 0.04 0.00 0.00 34.50 31.44 1haw s PRO 267 CO 0.24 -0.35 1.11 -1.25 0.04 0.00 0.00 177.00 176.79 1haw s PRO 268 N -0.70 1.39 0.10 0.56 0.04 -1.26 -4.96 135.00 130.17 1haw s PRO 268 Ca 0.57 0.56 0.03 0.00 0.04 0.00 0.00 61.00 62.20 1haw s PRO 268 Cb -0.41 -1.84 -0.04 0.00 0.04 0.00 0.00 34.50 32.25 1haw s PRO 268 CO 0.45 -2.09 0.10 -0.65 0.04 0.00 0.00 177.00 174.86 1haw s GLN 269 N -5.12 2.92 0.33 4.56 -0.21 -0.06 -4.78 119.66 117.30 1haw s GLN 269 Ca 0.63 -0.72 0.09 0.00 0.02 0.00 0.00 55.36 55.37 1haw s GLN 269 Cb -0.16 -2.72 -0.05 0.00 1.00 0.00 0.00 33.01 31.08 1haw s GLN 269 CO 0.55 0.55 0.05 -0.98 -2.12 0.00 0.00 175.29 173.34 1haw s ARG 270 N -2.59 2.19 -1.73 2.91 1.70 -1.26 -0.19 118.95 119.99 1haw s ARG 270 Ca 0.30 -1.65 0.00 0.00 -0.47 0.00 0.00 55.73 53.91 1haw s ARG 270 Cb -0.12 -2.03 0.00 0.00 -0.57 0.00 0.00 34.95 32.23 1haw s ARG 270 CO 0.23 0.15 0.00 -0.25 -1.08 0.00 0.00 175.30 174.35 1haw n ASP 271 N -1.01 -5.58 -4.77 -2.89 8.00 -0.84 -4.97 116.55 104.50 1haw n ASP 271 Ca -0.04 0.07 -0.39 0.00 0.71 0.00 0.00 54.79 55.14 1haw n ASP 271 Cb 0.62 -4.69 -0.03 0.00 -0.02 0.00 0.00 41.12 37.00 1haw n ASP 271 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1haw s LEU 272 N -5.83 4.34 -0.05 0.64 1.43 -0.84 -4.78 118.68 113.60 1haw s LEU 272 Ca 0.00 2.40 -0.13 0.00 -1.03 0.00 0.00 54.13 55.37 1haw s LEU 272 Cb 0.00 -3.84 -0.31 0.00 0.03 0.00 0.00 46.19 42.07 1haw s LEU 272 CO 0.00 -0.50 0.70 1.05 0.23 0.00 0.00 176.35 177.83 1haw h GLU 273 N 3.10 0.40 -3.19 1.70 4.11 -1.91 -0.40 114.58 118.38 1haw h GLU 273 Ca -0.48 -0.68 -0.20 0.00 0.07 0.00 0.00 59.36 58.07 1haw h GLU 273 Cb 1.23 0.25 -0.28 0.00 0.50 0.00 0.00 28.75 30.44 1haw h GLU 273 CO 0.64 1.32 -0.51 0.99 0.07 0.00 0.00 179.01 181.53 1haw s THR 274 N -2.56 -0.02 0.52 -1.06 2.01 -1.26 -4.28 115.64 108.98 1haw s THR 274 Ca -0.16 0.08 0.01 0.00 0.31 0.00 0.00 61.69 61.93 1haw s THR 274 Cb 0.05 -0.30 -0.00 0.00 0.01 0.00 0.00 72.50 72.25 1haw s THR 274 CO 0.85 0.03 0.01 -1.66 -0.69 0.00 0.00 174.62 173.17 1haw s TRP 275 N 0.66 1.77 -0.08 4.92 -2.14 -0.19 -4.97 118.94 118.91 1haw s TRP 275 Ca -0.05 -1.02 0.00 0.00 2.66 0.00 0.00 56.10 57.70 1haw s TRP 275 Cb -0.06 -1.56 0.02 0.00 -3.10 0.00 0.00 33.47 28.77 1haw s TRP 275 CO -0.04 0.17 -0.06 0.12 -2.66 0.00 0.00 176.95 174.48 1haw s PHE 276 N -2.92 1.14 -0.31 1.66 5.36 -1.26 -3.00 117.98 118.65 1haw s PHE 276 Ca 0.03 -0.46 -0.07 0.00 -0.96 0.00 0.00 56.93 55.47 1haw s PHE 276 Cb 0.00 -0.98 0.01 0.00 -0.34 0.00 0.00 43.02 41.72 1haw s PHE 276 CO 0.02 -0.35 0.10 0.42 -1.46 0.00 0.00 175.22 173.94 1haw s ILE 277 N 1.38 4.04 0.18 3.12 -1.09 -0.41 -4.60 121.20 123.81 1haw s ILE 277 Ca -0.03 -0.72 -0.30 0.00 -2.23 0.00 0.00 60.65 57.37 1haw s ILE 277 Cb -0.14 -3.11 -0.08 0.00 -1.58 0.00 0.00 42.46 37.55 1haw s ILE 277 CO -0.03 0.03 1.25 -0.13 -1.23 0.00 0.00 174.94 174.84 1haw s ARG 278 N 1.50 4.43 0.16 2.79 0.52 -1.26 -1.24 118.95 125.86 1haw s ARG 278 Ca 0.02 1.95 -0.34 0.00 -0.52 0.00 0.00 55.73 56.84 1haw s ARG 278 Cb -0.17 -3.23 -0.15 0.00 0.52 0.00 0.00 34.95 31.91 1haw s ARG 278 CO 0.03 -0.19 1.35 0.41 0.02 0.00 0.00 175.30 176.92 1haw n GLY 279 N 2.42 0.54 0.76 -3.53 0.00 -1.24 -1.87 105.19 102.27 1haw n GLY 279 Ca 0.06 0.60 0.00 0.00 0.00 0.00 0.00 46.02 46.68 1haw n GLY 279 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1haw n GLY 280 N 2.48 0.84 3.52 -0.02 0.00 0.49 -4.78 105.19 107.71 1haw n GLY 280 Ca 0.16 -0.41 -0.09 0.00 0.00 0.00 0.00 46.02 45.68 1haw n GLY 280 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1haw s SER 281 N -2.38 -0.09 0.06 1.61 1.04 -0.78 -4.77 113.70 108.38 1haw s SER 281 Ca 0.00 -0.83 0.07 0.00 0.48 0.00 0.00 55.95 55.67 1haw s SER 281 Cb 0.00 0.55 -0.03 0.00 0.10 0.00 0.00 66.02 66.64 1haw s SER 281 CO 0.00 -1.06 -0.20 0.00 0.98 0.00 0.00 173.24 172.96 1haw s ALA 282 N -3.98 1.69 0.34 5.32 0.00 -1.26 -1.95 121.76 121.92 1haw s ALA 282 Ca 0.19 -1.07 0.04 0.00 0.00 0.00 0.00 51.96 51.12 1haw s ALA 282 Cb 0.00 -0.30 -0.04 0.00 0.00 0.00 0.00 23.12 22.79 1haw s ALA 282 CO 0.05 0.36 0.15 0.20 0.00 0.00 0.00 175.76 176.52 1haw s GLY 283 N -1.33 2.22 -0.08 0.00 0.00 -0.74 -3.82 107.32 103.57 1haw s GLY 283 Ca 0.06 -1.66 -0.10 0.00 0.00 0.00 0.00 44.72 43.02 1haw s GLY 283 CO 0.02 -1.67 0.27 0.00 0.00 0.00 0.00 173.10 171.72 1haw s ALA 284 N -3.46 -0.67 0.04 3.20 0.00 -1.01 -1.16 121.76 118.71 1haw s ALA 284 Ca 0.33 0.62 0.04 0.00 0.00 0.00 0.00 51.96 52.94 1haw s ALA 284 Cb 0.05 -0.31 -0.02 0.00 0.00 0.00 0.00 23.12 22.83 1haw s ALA 284 CO 0.17 -0.16 -0.12 0.00 0.00 0.00 0.00 175.76 175.64 1haw s ALA 285 N -0.26 1.02 -0.06 0.00 0.00 -0.62 -1.19 121.76 120.65 1haw s ALA 285 Ca -0.04 -0.79 0.01 0.00 0.00 0.00 0.00 51.96 51.14 1haw s ALA 285 Cb -0.03 -0.13 -0.03 0.00 0.00 0.00 0.00 23.12 22.93 1haw s ALA 285 CO 0.01 0.16 -0.07 -0.51 0.00 0.00 0.00 175.76 175.35 1haw s LEU 286 N -1.22 3.15 -0.06 0.00 1.43 0.72 -0.84 118.68 121.86 1haw s LEU 286 Ca -0.01 -0.04 -0.04 0.00 -1.03 0.00 0.00 54.13 53.01 1haw s LEU 286 Cb -0.08 -1.69 0.02 0.00 0.03 0.00 0.00 46.19 44.47 1haw s LEU 286 CO 0.01 0.36 0.14 -0.47 0.23 0.00 0.00 176.35 176.62 1haw s TYR 287 N -0.82 -0.16 -0.28 0.29 5.04 -0.79 -0.87 117.35 119.77 1haw s TYR 287 Ca 0.13 0.41 -0.08 0.00 -2.44 0.00 0.00 57.07 55.09 1haw s TYR 287 Cb -0.11 0.02 -0.01 0.00 0.35 0.00 0.00 41.96 42.21 1haw s TYR 287 CO 0.02 -0.10 0.10 0.99 -1.34 0.00 0.00 175.55 175.21 1haw s THR 288 N 0.36 4.33 0.20 4.34 2.01 -1.26 -0.84 115.64 124.78 1haw s THR 288 Ca -0.02 -0.36 -0.30 0.00 0.31 0.00 0.00 61.69 61.32 1haw s THR 288 Cb -0.04 -3.12 -0.09 0.00 0.01 0.00 0.00 72.50 69.26 1haw s THR 288 CO -0.01 0.20 1.33 -0.36 -0.69 0.00 0.00 174.62 175.08 1haw s PHE 289 N 1.59 3.23 -0.06 4.92 0.08 -0.82 -4.90 117.98 122.02 1haw s PHE 289 Ca 0.05 1.19 0.03 0.00 0.12 0.00 0.00 56.93 58.33 1haw s PHE 289 Cb -0.16 -3.63 -0.05 0.00 -0.57 0.00 0.00 43.02 38.61 1haw s PHE 289 CO 0.04 -1.98 0.10 1.63 -0.10 0.00 0.00 175.22 174.91 1haw n LYS 290 N 2.62 2.02 -4.15 0.44 5.02 -1.26 -0.43 118.16 122.42 1haw n LYS 290 Ca 0.06 -0.02 -0.15 0.00 -2.02 0.00 0.00 58.31 56.18 1haw n LYS 290 Cb 0.42 -0.94 -0.13 0.00 -0.02 0.00 0.00 35.03 34.36 1haw n LYS 290 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 1haw s GLN 291 N -1.94 0.50 0.88 1.97 -1.52 -1.26 -4.70 119.66 113.60 1haw s GLN 291 Ca -0.00 -0.41 -0.13 0.00 -1.95 0.00 0.00 55.36 52.86 1haw s GLN 291 Cb 0.02 -0.42 0.15 0.00 -0.22 0.00 0.00 33.01 32.54 1haw s GLN 291 CO 0.14 0.10 1.24 -1.25 -0.25 0.00 0.00 175.29 175.28 1haw s PRO 292 N -0.66 1.25 0.00 2.91 0.04 -1.26 -4.85 135.00 132.43 1haw s PRO 292 Ca -0.02 -0.24 0.00 0.00 0.04 0.00 0.00 61.00 60.78 1haw s PRO 292 Cb -0.05 -1.92 0.00 0.00 0.04 0.00 0.00 34.50 32.57 1haw s PRO 292 CO 0.00 -2.01 0.00 0.41 0.04 0.00 0.00 177.00 175.44 1haw n GLY 293 N -3.52 0.72 3.81 0.56 0.00 -0.47 -4.95 105.19 101.35 1haw n GLY 293 Ca 0.12 -2.32 -0.38 0.00 0.00 0.00 0.00 46.02 43.44 1haw n GLY 293 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1haw s VAL 294 N -0.77 5.09 0.17 1.61 1.01 -1.26 -1.59 120.40 124.67 1haw s VAL 294 Ca 0.00 0.80 0.11 0.00 0.00 0.00 0.00 61.98 62.89 1haw s VAL 294 Cb 0.00 -3.71 -0.04 0.00 0.00 0.00 0.00 36.38 32.63 1haw s VAL 294 CO 0.00 0.53 -0.22 -0.31 0.00 0.00 0.00 175.10 175.10 1haw s TYR 295 N -0.73 2.37 -0.03 5.22 1.51 0.07 -4.98 117.35 120.78 1haw s TYR 295 Ca 0.23 -0.33 0.02 0.00 -1.01 0.00 0.00 57.07 55.98 1haw s TYR 295 Cb -0.16 -1.20 -0.03 0.00 -0.11 0.00 0.00 41.96 40.46 1haw s TYR 295 CO 0.12 0.47 -0.08 0.00 -1.11 0.00 0.00 175.55 174.95 1haw s ALA 296 N -1.53 2.97 -0.21 3.71 0.00 -1.25 -1.10 121.76 124.34 1haw s ALA 296 Ca 0.20 -0.97 0.01 0.00 0.00 0.00 0.00 51.96 51.21 1haw s ALA 296 Cb -0.09 -1.15 0.03 0.00 0.00 0.00 0.00 23.12 21.91 1haw s ALA 296 CO 0.10 0.59 -0.15 -0.47 0.00 0.00 0.00 175.76 175.83 1haw s TYR 297 N -0.90 2.96 0.22 0.00 5.04 0.45 -0.79 117.35 124.34 1haw s TYR 297 Ca 0.15 -1.81 -0.11 0.00 -2.44 0.00 0.00 57.07 52.86 1haw s TYR 297 Cb -0.11 -1.95 -0.01 0.00 0.35 0.00 0.00 41.96 40.25 1haw s TYR 297 CO 0.04 -0.81 0.39 -0.48 -1.34 0.00 0.00 175.55 173.35 1haw s LEU 298 N 1.25 0.55 -0.04 6.97 0.05 -0.30 -0.46 118.68 126.68 1haw s LEU 298 Ca 0.00 -0.96 -0.30 0.00 0.05 0.00 0.00 54.13 52.93 1haw s LEU 298 Cb -0.15 1.48 -0.03 0.00 -2.05 0.00 0.00 46.19 45.43 1haw s LEU 298 CO -0.09 -1.04 1.11 0.21 -0.55 0.00 0.00 176.35 175.98 1haw s ASN 299 N -3.02 7.16 -0.11 1.48 3.84 -0.83 -1.49 114.94 121.98 1haw s ASN 299 Ca 0.23 1.74 0.04 0.00 0.21 0.00 0.00 52.86 55.08 1haw s ASN 299 Cb 0.01 -2.56 0.28 0.00 -0.55 0.00 0.00 41.25 38.43 1haw s ASN 299 CO 0.07 -0.48 1.05 1.57 -2.79 0.00 0.00 177.10 176.52 1haw n HIS 300 N 4.76 0.85 -2.81 0.43 -0.00 0.29 -4.08 115.22 114.65 1haw n HIS 300 Ca 0.09 -0.44 -0.43 0.00 -0.00 0.00 0.00 57.72 56.94 1haw n HIS 300 Cb 0.48 -0.31 -0.04 0.00 -0.00 0.00 0.00 29.99 30.11 1haw n HIS 300 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 176.34 177.55 1haw s ASN 301 N -0.17 6.26 0.55 0.26 3.84 -1.26 -4.92 114.94 119.51 1haw s ASN 301 Ca 0.20 -0.60 0.34 0.00 0.21 0.00 0.00 52.86 53.01 1haw s ASN 301 Cb 0.16 -2.44 1.44 0.00 -0.55 0.00 0.00 41.25 39.86 1haw s ASN 301 CO 0.05 -1.37 2.01 -0.07 -2.79 0.00 0.00 177.10 174.93 1haw h LEU 302 N 11.33 0.00 -0.16 3.21 3.38 -1.99 -0.97 115.31 130.11 1haw h LEU 302 Ca -0.27 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.64 1haw h LEU 302 Cb 1.07 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.82 1haw h LEU 302 CO 1.14 0.00 -0.12 0.40 0.09 0.00 0.00 178.44 179.96 1haw h ILE 303 N 0.00 1.33 -0.92 1.22 2.04 -1.91 0.78 117.51 120.05 1haw h ILE 303 Ca 0.00 -1.23 -0.01 0.00 1.00 0.00 0.00 64.86 64.62 1haw h ILE 303 Cb 0.46 1.79 -0.04 0.00 -0.74 0.00 0.00 36.82 38.29 1haw h ILE 303 CO 0.00 0.36 0.55 -0.33 0.00 0.00 0.00 178.15 178.73 1haw h GLU 304 N 0.02 1.25 0.35 2.37 5.08 -1.62 -0.36 114.58 121.67 1haw h GLU 304 Ca 0.03 -0.12 -0.02 0.00 -1.00 0.00 0.00 59.36 58.25 1haw h GLU 304 Cb 0.63 -0.26 0.00 0.00 0.50 0.00 0.00 28.75 29.62 1haw h GLU 304 CO 0.03 0.88 -0.17 0.00 -1.00 0.00 0.00 179.01 178.76 1haw h ALA 305 N 1.33 -0.47 0.08 3.43 0.00 -1.19 -2.37 119.26 120.06 1haw h ALA 305 Ca 0.33 -0.15 -0.29 0.00 0.00 0.00 0.00 54.91 54.80 1haw h ALA 305 Cb -0.04 0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 1haw h ALA 305 CO -0.06 -0.47 -1.50 0.74 0.00 0.00 0.00 179.25 177.95 1haw h PHE 306 N -1.06 0.31 0.16 0.00 0.04 -0.88 -2.49 116.94 113.01 1haw h PHE 306 Ca -0.05 -0.22 -0.31 0.00 2.80 0.00 0.00 57.97 60.19 1haw h PHE 306 Cb 0.46 -0.01 0.01 0.00 2.20 0.00 0.00 35.95 38.60 1haw h PHE 306 CO 0.02 1.28 -1.53 0.93 -0.60 0.00 0.00 178.31 178.40 1haw h GLU 307 N 0.05 0.33 0.00 1.51 4.39 -1.22 -3.41 114.58 116.22 1haw h GLU 307 Ca -0.22 -0.56 0.00 0.00 0.34 0.00 0.00 59.36 58.92 1haw h GLU 307 Cb 1.98 0.21 0.00 0.00 -0.10 0.00 0.00 28.75 30.84 1haw h GLU 307 CO 0.14 1.27 -1.09 1.28 -1.16 0.00 0.00 179.01 179.45 1haw n LEU 308 N -3.78 0.61 0.00 1.33 4.77 -0.68 -5.01 117.00 114.23 1haw n LEU 308 Ca -0.24 -0.08 0.00 0.00 -0.03 0.00 0.00 56.01 55.66 1haw n LEU 308 Cb 0.98 -0.08 0.00 0.00 -2.33 0.00 0.00 43.42 41.99 1haw n LEU 308 CO 0.47 0.07 0.00 0.61 -1.33 0.00 0.00 177.39 177.21 1haw n GLY 309 N 1.38 1.23 2.79 -0.72 0.00 -0.94 -1.17 105.19 107.75 1haw n GLY 309 Ca 0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.62 1haw n GLY 309 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1haw n ALA 310 N -0.02 5.60 -3.37 4.61 0.00 -0.65 -4.13 120.51 122.55 1haw n ALA 310 Ca 0.00 -4.19 -0.14 0.00 0.00 0.00 0.00 53.44 49.11 1haw n ALA 310 Cb 0.00 -3.08 -0.09 0.00 0.00 0.00 0.00 19.45 16.28 1haw n ALA 310 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1haw s ALA 311 N 0.85 -1.20 0.32 0.00 0.00 -1.26 -1.96 121.76 118.50 1haw s ALA 311 Ca 0.43 1.18 0.02 0.00 0.00 0.00 0.00 51.96 53.58 1haw s ALA 311 Cb 0.12 -0.55 -0.02 0.00 0.00 0.00 0.00 23.12 22.67 1haw s ALA 311 CO -0.02 -0.25 0.35 0.20 0.00 0.00 0.00 175.76 176.03 1haw s GLY 312 N -0.20 1.82 0.09 0.00 0.00 0.39 -4.62 107.32 104.79 1haw s GLY 312 Ca -0.04 -1.76 0.05 0.00 0.00 0.00 0.00 44.72 42.98 1haw s GLY 312 CO 0.02 -1.24 -0.14 0.30 0.00 0.00 0.00 173.10 172.05 1haw s HIS 313 N -3.38 1.26 -0.11 1.90 3.76 0.54 -0.41 115.29 118.84 1haw s HIS 313 Ca 0.36 -0.50 0.01 0.00 -0.15 0.00 0.00 55.06 54.77 1haw s HIS 313 Cb 0.02 -0.69 0.02 0.00 1.11 0.00 0.00 32.58 33.03 1haw s HIS 313 CO 0.22 0.08 -0.11 0.42 -0.85 0.00 0.00 174.74 174.50 1haw s ILE 314 N -1.62 1.26 -0.28 0.60 1.01 -0.26 -0.32 121.20 121.59 1haw s ILE 314 Ca 0.02 -0.47 -0.09 0.00 0.00 0.00 0.00 60.65 60.11 1haw s ILE 314 Cb -0.08 -1.21 -0.02 0.00 0.01 0.00 0.00 42.46 41.16 1haw s ILE 314 CO 0.02 0.40 0.12 -0.75 0.00 0.00 0.00 174.94 174.73 1haw s LYS 315 N 1.34 3.56 -0.15 2.79 2.47 0.88 -0.75 119.74 129.89 1haw s LYS 315 Ca -0.00 -0.56 -0.01 0.00 -1.56 0.00 0.00 55.97 53.83 1haw s LYS 315 Cb -0.14 -3.47 -0.01 0.00 -1.46 0.00 0.00 37.83 32.75 1haw s LYS 315 CO -0.06 -0.28 -0.11 0.08 0.16 0.00 0.00 175.35 175.14 1haw s VAL 316 N 1.63 3.17 0.15 4.02 1.01 -0.62 -2.07 120.40 127.70 1haw s VAL 316 Ca 0.06 -0.61 -0.08 0.00 0.00 0.00 0.00 61.98 61.35 1haw s VAL 316 Cb -0.16 -2.36 -0.06 0.00 0.00 0.00 0.00 36.38 33.80 1haw s VAL 316 CO 0.06 0.51 0.45 -1.61 0.00 0.00 0.00 175.10 174.50 1haw s GLU 317 N 0.55 3.73 0.00 2.72 0.41 -0.71 -1.37 118.70 124.03 1haw s GLU 317 Ca -0.07 0.12 0.00 0.00 -0.41 0.00 0.00 54.97 54.61 1haw s GLU 317 Cb -0.15 -2.83 0.00 0.00 -1.78 0.00 0.00 34.13 29.37 1haw s GLU 317 CO 0.03 0.45 0.00 0.41 -0.49 0.00 0.00 175.26 175.66 1haw n GLY 318 N 0.27 -0.29 3.73 -1.39 0.00 -1.26 -0.78 105.19 105.47 1haw n GLY 318 Ca -0.03 -1.58 -0.35 0.00 0.00 0.00 0.00 46.02 44.06 1haw n GLY 318 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1haw s LYS 319 N -1.95 3.74 0.60 1.61 2.20 -1.26 -4.72 119.74 119.97 1haw s LYS 319 Ca 0.00 -0.27 -0.19 0.00 -0.36 0.00 0.00 55.97 55.15 1haw s LYS 319 Cb 0.00 -3.19 -0.04 0.00 -1.51 0.00 0.00 37.83 33.09 1haw s LYS 319 CO 0.00 0.47 1.14 1.87 -0.36 0.00 0.00 175.35 178.48 1haw n TRP 320 N 2.93 1.47 -3.96 4.03 -0.00 -1.26 -4.58 117.44 116.06 1haw n TRP 320 Ca -0.18 0.44 -0.31 0.00 -0.00 0.00 0.00 57.50 57.45 1haw n TRP 320 Cb 0.53 -2.23 -0.15 0.00 -0.00 0.00 0.00 31.31 29.46 1haw n TRP 320 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 177.69 178.90 1haw s ASN 321 N -1.20 4.35 0.51 5.87 3.84 -1.26 -4.99 114.94 122.06 1haw s ASN 321 Ca 0.77 -1.69 0.34 0.00 0.21 0.00 0.00 52.86 52.49 1haw s ASN 321 Cb -0.41 -1.37 1.56 0.00 -0.55 0.00 0.00 41.25 40.48 1haw s ASN 321 CO 0.46 -0.32 2.01 0.44 -2.79 0.00 0.00 177.10 176.90 1haw h ASP 322 N 7.81 0.00 -0.20 -4.21 3.32 -1.95 -2.58 116.42 118.62 1haw h ASP 322 Ca -0.12 0.00 -0.14 0.00 0.02 0.00 0.00 57.03 56.79 1haw h ASP 322 Cb 1.04 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.58 1haw h ASP 322 CO 0.47 0.00 -0.38 -0.78 -1.72 0.00 0.00 179.24 176.83 1haw h ASP 323 N 0.00 0.78 0.15 6.45 3.58 -2.02 -3.28 116.42 122.08 1haw h ASP 323 Ca 0.00 -0.34 -0.23 0.00 0.42 0.00 0.00 57.03 56.87 1haw h ASP 323 Cb 0.31 -0.22 0.01 0.00 1.72 0.00 0.00 39.33 41.15 1haw h ASP 323 CO 0.00 1.07 -0.92 -0.07 -2.88 0.00 0.00 179.24 176.44 1haw h LEU 324 N 0.60 0.71 -7.05 2.28 3.38 -1.90 -3.46 115.31 109.87 1haw h LEU 324 Ca 0.05 -0.54 -0.05 0.00 0.09 0.00 0.00 57.88 57.43 1haw h LEU 324 Cb 0.92 -0.21 -0.21 0.00 0.09 0.00 0.00 40.66 41.24 1haw h LEU 324 CO 0.08 1.33 0.07 -0.32 0.09 0.00 0.00 178.44 179.70 1haw s MET 325 N -3.40 0.79 -0.18 1.13 0.00 -1.17 -5.16 119.30 111.31 1haw s MET 325 Ca -0.08 0.91 -0.09 0.00 0.00 0.00 0.00 55.69 56.43 1haw s MET 325 Cb 0.08 0.38 0.06 0.00 0.00 0.00 0.00 34.83 35.36 1haw s MET 325 CO 0.89 -0.10 0.42 0.21 0.00 0.00 0.00 175.02 176.44 1haw s LYS 326 N 0.30 0.40 -0.29 4.11 2.20 -1.26 -4.26 119.74 120.95 1haw s LYS 326 Ca -0.00 0.82 -0.29 0.00 -0.36 0.00 0.00 55.97 56.13 1haw s LYS 326 Cb -0.05 -0.00 -0.01 0.00 -1.51 0.00 0.00 37.83 36.26 1haw s LYS 326 CO 0.01 -0.16 1.41 -1.14 -0.36 0.00 0.00 175.35 175.11 1haw s GLN 327 N 1.46 3.84 0.02 4.03 0.74 -1.26 -4.89 119.66 123.59 1haw s GLN 327 Ca -0.09 1.34 -0.16 0.00 0.05 0.00 0.00 55.36 56.50 1haw s GLN 327 Cb -0.08 -3.94 -0.35 0.00 1.10 0.00 0.00 33.01 29.73 1haw s GLN 327 CO -0.13 -1.22 0.96 0.82 -0.55 0.00 0.00 175.29 175.16 1haw h ILE 328 N 6.07 1.25 -3.09 -2.34 1.08 -2.03 -3.44 117.51 115.02 1haw h ILE 328 Ca -0.29 -2.67 -0.44 0.00 -0.39 0.00 0.00 64.86 61.07 1haw h ILE 328 Cb 1.12 3.02 -0.41 0.00 -3.07 0.00 0.00 36.82 37.48 1haw h ILE 328 CO 1.03 0.81 -0.75 -0.54 -0.69 0.00 0.00 178.15 178.01 1haw s LYS 329 N -2.59 0.04 0.92 2.37 -0.14 -1.26 -5.15 119.74 113.93 1haw s LYS 329 Ca -0.10 -0.00 -0.11 0.00 -1.36 0.00 0.00 55.97 54.40 1haw s LYS 329 Cb 0.04 -1.60 0.12 0.00 -1.68 0.00 0.00 37.83 34.70 1haw s LYS 329 CO 0.93 -0.61 0.96 0.00 -0.76 0.00 0.00 175.35 175.87 1haw n ALA 330 N 5.28 -1.21 -1.66 5.17 0.00 -1.26 -4.89 120.51 121.94 1haw n ALA 330 Ca -0.06 -0.55 -0.46 0.00 0.00 0.00 0.00 53.44 52.36 1haw n ALA 330 Cb 0.49 -2.10 -0.04 0.00 0.00 0.00 0.00 19.45 17.81 1haw n ALA 330 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1haw n PRO 331 N -3.52 1.95 -3.59 0.00 -0.02 -1.26 -4.96 135.00 123.59 1haw n PRO 331 Ca 0.11 0.70 -0.10 0.00 -2.02 0.00 0.00 63.50 62.18 1haw n PRO 331 Cb 0.52 -2.38 -0.02 0.00 -0.02 0.00 0.00 33.50 31.60 1haw n PRO 331 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1haw s ALA 332 N 0.31 -1.38 0.30 3.55 0.00 -1.26 -5.14 121.76 118.15 1haw s ALA 332 Ca 0.73 0.15 -0.28 0.00 0.00 0.00 0.00 51.96 52.56 1haw s ALA 332 Cb -0.70 0.87 -0.13 0.00 0.00 0.00 0.00 23.12 23.16 1haw s ALA 332 CO 0.45 -0.84 1.16 -2.30 0.00 0.00 0.00 175.76 174.23 1haw n PRO 333 N -0.39 1.71 -0.67 0.00 -0.02 -1.26 -4.89 135.00 129.47 1haw n PRO 333 Ca -0.12 0.60 -0.31 0.00 -2.02 0.00 0.00 63.50 61.64 1haw n PRO 333 Cb 0.63 -2.08 0.17 0.00 -0.02 0.00 0.00 33.50 32.20 1haw n PRO 333 CO 0.00 0.00 0.00 -0.89 1.98 0.00 0.00 175.50 176.59 1haw n ILE 334 N 0.46 0.00 -2.02 4.25 5.41 -1.26 -4.92 119.36 121.28 1haw n ILE 334 Ca 0.08 -0.12 -0.41 0.00 1.00 0.00 0.00 62.75 63.30 1haw n ILE 334 Cb 0.33 -0.89 -0.02 0.00 -0.71 0.00 0.00 39.64 38.35 1haw n ILE 334 CO 0.00 0.00 0.00 -2.84 0.00 0.00 0.00 176.55 173.71 1haw s PRO 335 N -4.32 4.27 0.00 0.38 0.02 -1.26 -5.35 135.00 128.75 1haw s PRO 335 Ca 0.64 2.29 0.19 0.00 0.02 0.00 0.00 61.00 64.14 1haw s PRO 335 Cb -0.22 -3.11 0.15 0.00 0.02 0.00 0.00 34.50 31.33 1haw s PRO 335 CO 0.62 -0.42 1.09 0.54 -0.33 0.00 0.00 177.00 178.50