#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h4f s THR 5 N 0.00 3.88 0.26 0.00 -4.23 -1.26 -4.82 115.64 109.47 3h4f s THR 5 Ca 0.00 0.61 -0.02 0.00 -1.18 0.00 0.00 61.69 61.10 3h4f s THR 5 Cb 0.00 -3.34 0.24 0.00 1.34 0.00 0.00 72.50 70.74 3h4f s THR 5 CO 0.00 -0.80 1.71 0.00 -0.54 0.00 0.00 174.62 175.00 3h4f h ALA 6 N -0.78 1.13 -0.24 3.99 0.00 -2.05 -0.23 119.26 121.08 3h4f h ALA 6 Ca -0.44 0.14 -0.14 0.00 0.00 0.00 0.00 54.91 54.46 3h4f h ALA 6 Cb 1.22 0.13 -0.01 0.00 0.00 0.00 0.00 17.79 19.13 3h4f h ALA 6 CO 0.57 -0.26 -0.43 0.00 0.00 0.00 0.00 179.25 179.13 3h4f h ALA 7 N 1.60 0.80 -0.33 0.00 0.00 -1.98 -1.75 119.26 117.60 3h4f h ALA 7 Ca 0.45 -0.45 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 3h4f h ALA 7 Cb 0.74 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 3h4f h ALA 7 CO -0.45 0.66 0.09 0.93 0.00 0.00 0.00 179.25 180.47 3h4f h GLU 8 N 0.48 0.52 -0.08 0.00 5.08 -1.47 -0.23 114.58 118.89 3h4f h GLU 8 Ca 0.04 -0.12 -0.00 0.00 -1.00 0.00 0.00 59.36 58.28 3h4f h GLU 8 Cb 0.94 -0.07 -0.00 0.00 0.50 0.00 0.00 28.75 30.12 3h4f h GLU 8 CO 0.08 0.57 0.05 0.82 -1.00 0.00 0.00 179.01 179.53 3h4f h ILE 9 N 0.38 1.04 -0.28 3.13 2.04 -1.11 -2.76 117.51 119.94 3h4f h ILE 9 Ca 0.11 -0.11 0.03 0.00 1.00 0.00 0.00 64.86 65.89 3h4f h ILE 9 Cb 0.27 0.98 -0.01 0.00 -0.74 0.00 0.00 36.82 37.31 3h4f h ILE 9 CO -0.00 0.04 0.19 0.00 0.00 0.00 0.00 178.15 178.38 3h4f h ALA 10 N 1.00 1.93 0.00 1.87 0.00 -1.14 -2.42 119.26 120.49 3h4f h ALA 10 Ca 0.03 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.92 3h4f h ALA 10 Cb 0.02 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.74 3h4f h ALA 10 CO -0.01 0.04 -0.12 0.00 0.00 0.00 0.00 179.25 179.16 3h4f n ALA 11 N -2.52 2.46 -1.77 0.00 0.00 -0.11 -4.91 120.51 113.65 3h4f n ALA 11 Ca 0.02 -0.09 -0.41 0.00 0.00 0.00 0.00 53.44 52.96 3h4f n ALA 11 Cb 0.16 -1.41 0.00 0.00 0.00 0.00 0.00 19.45 18.20 3h4f n ALA 11 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3h4f s LEU 12 N -4.02 4.27 0.50 0.00 1.43 -0.92 -4.95 118.68 114.98 3h4f s LEU 12 Ca 0.11 2.99 -0.22 0.00 -1.03 0.00 0.00 54.13 55.97 3h4f s LEU 12 Cb 0.14 -3.75 -0.07 0.00 0.03 0.00 0.00 46.19 42.54 3h4f s LEU 12 CO 0.60 -0.94 1.16 -0.81 0.23 0.00 0.00 176.35 176.59 3h4f n PRO 13 N 0.29 1.48 -4.64 1.29 -0.04 -1.26 -4.76 135.00 127.35 3h4f n PRO 13 Ca 0.02 0.54 -0.33 0.00 -0.04 0.00 0.00 63.50 63.69 3h4f n PRO 13 Cb 0.40 -2.30 -0.13 0.00 -0.04 0.00 0.00 33.50 31.43 3h4f n PRO 13 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 3h4f s ARG 14 N -2.47 3.34 -0.13 0.54 3.00 -1.26 -0.93 118.95 121.03 3h4f s ARG 14 Ca 0.68 -0.61 -0.02 0.00 0.00 0.00 0.00 55.73 55.78 3h4f s ARG 14 Cb -0.47 -2.70 0.04 0.00 0.00 0.00 0.00 34.95 31.82 3h4f s ARG 14 CO 0.53 0.31 -0.00 -1.14 0.00 0.00 0.00 175.30 175.00 3h4f s GLN 15 N 0.12 0.83 0.08 3.54 0.74 -0.19 -4.98 119.66 119.81 3h4f s GLN 15 Ca -0.04 -0.21 -0.30 0.00 0.05 0.00 0.00 55.36 54.85 3h4f s GLN 15 Cb -0.14 -1.60 -0.05 0.00 1.10 0.00 0.00 33.01 32.31 3h4f s GLN 15 CO 0.04 -0.44 1.10 0.15 -0.55 0.00 0.00 175.29 175.59 3h4f s LYS 16 N 1.86 4.52 -0.01 1.67 1.02 -1.26 -0.13 119.74 127.41 3h4f s LYS 16 Ca 0.02 1.64 0.07 0.00 0.02 0.00 0.00 55.97 57.73 3h4f s LYS 16 Cb -0.14 -3.36 -0.02 0.00 -0.52 0.00 0.00 37.83 33.78 3h4f s LYS 16 CO -0.07 -0.09 -0.24 0.08 -0.92 0.00 0.00 175.35 174.12 3h4f s VAL 17 N 0.66 2.28 -0.17 3.17 1.01 -0.22 -4.91 120.40 122.22 3h4f s VAL 17 Ca 0.54 -1.10 -0.16 0.00 0.00 0.00 0.00 61.98 61.26 3h4f s VAL 17 Cb -0.27 -1.83 -0.04 0.00 0.00 0.00 0.00 36.38 34.24 3h4f s VAL 17 CO 0.30 0.53 0.39 -1.61 0.00 0.00 0.00 175.10 174.72 3h4f s GLU 18 N -0.79 4.24 0.45 2.72 2.02 -1.26 -4.65 118.70 121.43 3h4f s GLU 18 Ca 0.11 0.24 -0.16 0.00 0.02 0.00 0.00 54.97 55.18 3h4f s GLU 18 Cb -0.10 -3.48 -0.08 0.00 0.10 0.00 0.00 34.13 30.56 3h4f s GLU 18 CO 0.00 0.08 0.90 -0.51 0.02 0.00 0.00 175.26 175.75 3h4f s LEU 19 N 0.93 3.78 0.21 1.80 1.43 -1.26 -4.75 118.68 120.82 3h4f s LEU 19 Ca 0.20 1.45 0.10 0.00 -1.03 0.00 0.00 54.13 54.86 3h4f s LEU 19 Cb -0.14 -4.35 -0.05 0.00 0.03 0.00 0.00 46.19 41.68 3h4f s LEU 19 CO 0.07 -0.46 -0.20 0.68 0.23 0.00 0.00 176.35 176.68 3h4f s VAL 20 N -2.41 2.13 0.33 -1.59 -7.23 -1.26 -4.98 120.40 105.39 3h4f s VAL 20 Ca 0.57 -2.11 -0.27 0.00 -1.81 0.00 0.00 61.98 58.36 3h4f s VAL 20 Cb -0.10 -2.07 -0.09 0.00 0.56 0.00 0.00 36.38 34.68 3h4f s VAL 20 CO 0.26 -0.31 1.04 -1.81 -0.31 0.00 0.00 175.10 173.97 3h4f s ASP 21 N -2.97 7.08 0.61 4.85 1.01 -1.26 -4.58 116.67 121.41 3h4f s ASP 21 Ca 0.22 2.09 -0.19 0.00 0.71 0.00 0.00 52.55 55.38 3h4f s ASP 21 Cb -0.06 -2.60 -0.04 0.00 1.01 0.00 0.00 42.92 41.24 3h4f s ASP 21 CO 0.10 -0.26 1.14 -2.65 0.21 0.00 0.00 175.17 173.70 3h4f n PRO 22 N 0.59 1.10 -0.01 8.23 -0.02 -1.26 -2.34 135.00 141.28 3h4f n PRO 22 Ca 0.02 0.42 0.12 0.00 -2.02 0.00 0.00 63.50 62.05 3h4f n PRO 22 Cb 0.48 -2.35 0.64 0.00 -0.02 0.00 0.00 33.50 32.25 3h4f n PRO 22 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 3h4f n PRO 23 N -1.29 1.25 -1.53 0.52 -0.04 -1.26 -5.03 135.00 127.62 3h4f n PRO 23 Ca 0.14 -0.37 -0.31 0.00 -0.04 0.00 0.00 63.50 62.92 3h4f n PRO 23 Cb 0.47 -1.41 0.07 0.00 -0.04 0.00 0.00 33.50 32.59 3h4f n PRO 23 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 3h4f s PHE 24 N -1.96 2.97 -0.01 0.54 0.40 -0.99 -0.48 117.98 118.45 3h4f s PHE 24 Ca 0.37 1.35 0.02 0.00 -0.60 0.00 0.00 56.93 58.06 3h4f s PHE 24 Cb 0.18 -2.97 0.00 0.00 0.51 0.00 0.00 43.02 40.74 3h4f s PHE 24 CO 0.29 -1.46 -0.06 0.08 0.70 0.00 0.00 175.22 174.77 3h4f s VAL 25 N -3.06 0.51 0.90 -0.44 1.01 -1.26 -4.61 120.40 113.44 3h4f s VAL 25 Ca 0.59 -0.24 -0.11 0.00 0.00 0.00 0.00 61.98 62.23 3h4f s VAL 25 Cb -0.14 -0.45 0.14 0.00 0.00 0.00 0.00 36.38 35.92 3h4f s VAL 25 CO 0.55 0.16 1.16 -1.38 0.00 0.00 0.00 175.10 175.59 3h4f s HIS 26 N 0.09 1.61 0.17 5.22 -3.43 -1.26 -4.91 115.29 112.77 3h4f s HIS 26 Ca -0.01 1.78 -0.34 0.00 -0.80 0.00 0.00 55.06 55.70 3h4f s HIS 26 Cb -0.05 -3.39 -0.14 0.00 -1.43 0.00 0.00 32.58 27.57 3h4f s HIS 26 CO -0.00 -2.87 1.51 0.00 -2.00 0.00 0.00 174.74 171.38 3h4f n ALA 27 N -4.07 1.02 -3.34 -1.38 0.00 -1.26 -4.99 120.51 106.48 3h4f n ALA 27 Ca 0.12 0.45 -0.10 0.00 0.00 0.00 0.00 53.44 53.92 3h4f n ALA 27 Cb 0.52 -2.30 -0.04 0.00 0.00 0.00 0.00 19.45 17.63 3h4f n ALA 27 CO 0.00 0.00 0.00 -3.38 0.00 0.00 0.00 177.50 174.12 3h4f s HIS 28 N 0.68 -0.13 -0.08 0.00 -3.43 -1.26 -5.04 115.29 106.03 3h4f s HIS 28 Ca 0.77 -0.22 -0.03 0.00 -0.80 0.00 0.00 55.06 54.79 3h4f s HIS 28 Cb -0.71 0.41 -0.04 0.00 -1.43 0.00 0.00 32.58 30.82 3h4f s HIS 28 CO 0.41 -0.94 0.05 0.45 -2.00 0.00 0.00 174.74 172.71 3h4f s SER 29 N -2.87 5.58 -0.02 7.38 0.15 -1.26 -5.03 113.70 117.62 3h4f s SER 29 Ca 0.09 0.22 -0.25 0.00 0.70 0.00 0.00 55.95 56.72 3h4f s SER 29 Cb -0.01 -1.64 -0.20 0.00 -1.71 0.00 0.00 66.02 62.46 3h4f s SER 29 CO -0.02 0.37 1.22 1.56 1.20 0.00 0.00 173.24 177.57 3h4f h GLN 30 N 4.97 0.07 -6.45 5.44 4.20 -1.97 -3.41 115.11 117.96 3h4f h GLN 30 Ca -0.52 -0.05 -0.53 0.00 0.06 0.00 0.00 58.65 57.62 3h4f h GLN 30 Cb 1.20 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.96 3h4f h GLN 30 CO 0.56 0.60 0.35 0.08 -0.67 0.00 0.00 178.83 179.75 3h4f s VAL 31 N -4.02 4.73 0.63 -0.54 1.01 -1.26 -3.41 120.40 117.53 3h4f s VAL 31 Ca -0.16 2.03 -0.19 0.00 0.00 0.00 0.00 61.98 63.66 3h4f s VAL 31 Cb 0.02 -4.30 -0.02 0.00 0.00 0.00 0.00 36.38 32.07 3h4f s VAL 31 CO 0.69 0.23 1.30 0.00 0.00 0.00 0.00 175.10 177.32 3h4f n ALA 32 N 3.43 1.21 -3.70 5.51 0.00 0.12 -4.95 120.51 122.14 3h4f n ALA 32 Ca 0.04 0.03 -0.36 0.00 0.00 0.00 0.00 53.44 53.15 3h4f n ALA 32 Cb 0.50 -2.33 -0.13 0.00 0.00 0.00 0.00 19.45 17.50 3h4f n ALA 32 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 3h4f s GLU 33 N -3.24 2.18 1.09 0.00 2.02 -1.26 -5.00 118.70 114.49 3h4f s GLU 33 Ca 0.80 -1.57 0.00 0.00 0.02 0.00 0.00 54.97 54.22 3h4f s GLU 33 Cb -0.39 -3.40 0.00 0.00 0.10 0.00 0.00 34.13 30.44 3h4f s GLU 33 CO 0.42 -0.87 0.00 0.41 0.02 0.00 0.00 175.26 175.25 3h4f n GLY 34 N 4.60 -1.77 0.53 -1.39 0.00 -1.26 -4.97 105.19 100.94 3h4f n GLY 34 Ca -0.07 -1.57 -0.04 0.00 0.00 0.00 0.00 46.02 44.34 3h4f n GLY 34 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3h4f n GLY 35 N 0.00 -0.52 3.71 -0.02 0.00 -1.26 -5.01 105.19 102.08 3h4f n GLY 35 Ca 0.00 -1.77 -0.42 0.00 0.00 0.00 0.00 46.02 43.82 3h4f n GLY 35 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3h4f n PRO 36 N -1.34 2.21 -4.32 1.61 -0.02 -1.26 -5.02 135.00 126.85 3h4f n PRO 36 Ca 0.02 0.77 -0.23 0.00 -2.02 0.00 0.00 63.50 62.05 3h4f n PRO 36 Cb 0.08 -2.39 -0.12 0.00 -0.02 0.00 0.00 33.50 31.06 3h4f n PRO 36 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 3h4f s LYS 37 N -1.77 1.23 -0.52 -0.52 1.02 -1.26 -4.42 119.74 113.49 3h4f s LYS 37 Ca 0.56 -1.33 -0.19 0.00 0.02 0.00 0.00 55.97 55.03 3h4f s LYS 37 Cb -0.56 -1.36 0.07 0.00 -0.52 0.00 0.00 37.83 35.46 3h4f s LYS 37 CO 0.61 0.29 0.62 0.08 -0.92 0.00 0.00 175.35 176.03 3h4f s VAL 38 N -1.76 4.90 -0.24 3.17 1.01 -0.11 0.08 120.40 127.45 3h4f s VAL 38 Ca 0.13 -0.68 -0.22 0.00 0.00 0.00 0.00 61.98 61.21 3h4f s VAL 38 Cb -0.07 -4.33 -0.01 0.00 0.00 0.00 0.00 36.38 31.97 3h4f s VAL 38 CO 0.06 -0.86 0.71 -0.69 0.00 0.00 0.00 175.10 174.32 3h4f s VAL 39 N 2.53 4.93 -0.17 2.92 1.01 0.67 -1.02 120.40 131.27 3h4f s VAL 39 Ca 0.13 1.32 -0.08 0.00 0.00 0.00 0.00 61.98 63.35 3h4f s VAL 39 Cb -0.21 -4.01 -0.04 0.00 0.00 0.00 0.00 36.38 32.12 3h4f s VAL 39 CO 0.10 -0.00 0.09 -1.61 0.00 0.00 0.00 175.10 173.68 3h4f s GLU 40 N 2.57 3.92 0.06 2.72 2.02 0.82 -0.01 118.70 130.80 3h4f s GLU 40 Ca 0.30 -0.27 0.04 0.00 0.02 0.00 0.00 54.97 55.06 3h4f s GLU 40 Cb -0.15 -3.26 -0.03 0.00 0.10 0.00 0.00 34.13 30.79 3h4f s GLU 40 CO 0.08 0.38 -0.13 -0.06 0.02 0.00 0.00 175.26 175.56 3h4f s PHE 41 N 0.09 1.10 -0.05 1.61 0.40 0.13 -1.06 117.98 120.20 3h4f s PHE 41 Ca 0.07 -0.44 0.04 0.00 -0.60 0.00 0.00 56.93 55.99 3h4f s PHE 41 Cb -0.12 -0.63 0.00 0.00 0.51 0.00 0.00 43.02 42.79 3h4f s PHE 41 CO -0.00 0.03 -0.15 0.99 0.70 0.00 0.00 175.22 176.78 3h4f s THR 42 N -1.20 1.32 -0.03 0.64 2.01 -1.26 -0.11 115.64 117.01 3h4f s THR 42 Ca -0.03 -0.64 0.02 0.00 0.31 0.00 0.00 61.69 61.35 3h4f s THR 42 Cb -0.09 -1.15 0.01 0.00 0.01 0.00 0.00 72.50 71.27 3h4f s THR 42 CO 0.02 0.39 -0.07 -0.04 -0.69 0.00 0.00 174.62 174.23 3h4f s MET 43 N 0.19 0.77 -0.15 4.92 -1.94 -0.64 -4.90 119.30 117.55 3h4f s MET 43 Ca -0.07 -0.21 -0.07 0.00 -1.71 0.00 0.00 55.69 53.64 3h4f s MET 43 Cb -0.12 -0.75 -0.04 0.00 2.01 0.00 0.00 34.83 35.93 3h4f s MET 43 CO 0.03 0.05 0.08 0.08 -0.01 0.00 0.00 175.02 175.25 3h4f s VAL 44 N 0.33 4.98 -0.05 -6.03 1.01 -1.26 -1.47 120.40 117.91 3h4f s VAL 44 Ca -0.04 0.02 -0.26 0.00 0.00 0.00 0.00 61.98 61.70 3h4f s VAL 44 Cb -0.09 -3.21 -0.03 0.00 0.00 0.00 0.00 36.38 33.06 3h4f s VAL 44 CO 0.00 0.52 0.83 -0.63 0.00 0.00 0.00 175.10 175.82 3h4f s ILE 45 N -0.19 4.95 -0.11 2.22 1.01 0.07 -0.25 121.20 128.91 3h4f s ILE 45 Ca 0.08 1.71 0.01 0.00 0.00 0.00 0.00 60.65 62.46 3h4f s ILE 45 Cb -0.12 -4.16 -0.01 0.00 0.01 0.00 0.00 42.46 38.17 3h4f s ILE 45 CO 0.01 0.18 -0.15 -1.61 0.00 0.00 0.00 174.94 173.37 3h4f s GLU 46 N 1.07 3.19 -0.28 2.79 2.02 -0.36 -4.47 118.70 122.67 3h4f s GLU 46 Ca 0.43 -0.73 -0.09 0.00 0.02 0.00 0.00 54.97 54.61 3h4f s GLU 46 Cb -0.19 -2.53 -0.02 0.00 0.10 0.00 0.00 34.13 31.49 3h4f s GLU 46 CO 0.21 0.27 0.12 -1.21 0.02 0.00 0.00 175.26 174.67 3h4f s GLU 47 N 0.19 3.56 0.01 1.61 2.02 -1.26 -0.57 118.70 124.26 3h4f s GLU 47 Ca -0.09 -0.56 -0.22 0.00 0.02 0.00 0.00 54.97 54.11 3h4f s GLU 47 Cb -0.16 -3.47 0.05 0.00 0.10 0.00 0.00 34.13 30.66 3h4f s GLU 47 CO 0.06 -0.28 0.51 -1.59 0.02 0.00 0.00 175.26 173.97 3h4f s LYS 48 N 1.63 0.96 -0.00 1.61 -2.85 -0.64 -4.99 119.74 115.45 3h4f s LYS 48 Ca 0.06 -0.13 -0.30 0.00 -1.00 0.00 0.00 55.97 54.60 3h4f s LYS 48 Cb -0.16 0.44 -0.05 0.00 -2.06 0.00 0.00 37.83 36.00 3h4f s LYS 48 CO 0.06 -0.32 1.23 0.15 0.10 0.00 0.00 175.35 176.57 3h4f s LYS 49 N -1.96 4.37 0.07 1.78 1.02 -1.26 -0.21 119.74 123.55 3h4f s LYS 49 Ca -0.08 1.75 0.09 0.00 0.02 0.00 0.00 55.97 57.75 3h4f s LYS 49 Cb -0.01 -3.48 -0.03 0.00 -0.52 0.00 0.00 37.83 33.79 3h4f s LYS 49 CO 0.02 -0.39 -0.24 0.96 -0.92 0.00 0.00 175.35 174.78 3h4f s ILE 50 N 1.80 1.92 -0.11 2.17 -4.36 -0.19 -4.92 121.20 117.51 3h4f s ILE 50 Ca 0.58 -1.42 -0.15 0.00 -0.26 0.00 0.00 60.65 59.40 3h4f s ILE 50 Cb -0.28 -1.68 -0.05 0.00 1.25 0.00 0.00 42.46 41.71 3h4f s ILE 50 CO 0.25 0.18 0.36 -0.69 0.24 0.00 0.00 174.94 175.29 3h4f s VAL 51 N -0.91 5.22 -0.65 8.37 1.01 -1.26 -1.52 120.40 130.65 3h4f s VAL 51 Ca 0.10 0.71 0.07 0.00 0.00 0.00 0.00 61.98 62.86 3h4f s VAL 51 Cb -0.10 -3.69 -0.01 0.00 0.00 0.00 0.00 36.38 32.59 3h4f s VAL 51 CO 0.03 0.43 0.52 2.30 0.00 0.00 0.00 175.10 178.38 3h4f n ILE 52 N 3.09 0.00 -4.05 2.22 -5.35 -0.16 -4.84 119.36 110.27 3h4f n ILE 52 Ca -0.12 -0.41 -0.13 0.00 -0.27 0.00 0.00 62.75 61.82 3h4f n ILE 52 Cb 0.52 1.08 -0.04 0.00 -1.74 0.00 0.00 39.64 39.46 3h4f n ILE 52 CO 0.00 0.00 0.00 1.51 -1.76 0.00 0.00 176.55 176.30 3h4f s ASP 53 N -1.18 0.65 0.00 7.28 3.84 -1.26 -0.61 116.67 125.39 3h4f s ASP 53 Ca 0.06 -1.37 0.22 0.00 -0.00 0.00 0.00 52.55 51.46 3h4f s ASP 53 Cb 0.06 0.66 1.29 0.00 -1.38 0.00 0.00 42.92 43.55 3h4f s ASP 53 CO 0.20 -1.29 1.69 -0.90 -0.00 0.00 0.00 175.17 174.87 3h4f n ASP 54 N -1.21 0.00 -0.87 2.11 5.68 -1.26 -2.96 116.55 118.04 3h4f n ASP 54 Ca -0.00 -0.62 0.07 0.00 -0.50 0.00 0.00 54.79 53.74 3h4f n ASP 54 Cb 0.62 -0.03 0.22 0.00 -1.14 0.00 0.00 41.12 40.78 3h4f n ASP 54 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3h4f n ALA 55 N -1.03 2.50 -1.08 2.12 0.00 -1.26 -4.97 120.51 116.79 3h4f n ALA 55 Ca 0.16 -1.49 -0.03 0.00 0.00 0.00 0.00 53.44 52.09 3h4f n ALA 55 Cb 0.09 -0.61 -0.01 0.00 0.00 0.00 0.00 19.45 18.92 3h4f n ALA 55 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3h4f n GLY 56 N 0.44 0.58 3.73 0.00 0.00 -1.16 -5.00 105.19 103.78 3h4f n GLY 56 Ca 0.17 -0.39 -0.42 0.00 0.00 0.00 0.00 46.02 45.38 3h4f n GLY 56 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3h4f s THR 57 N -1.96 2.31 0.04 2.61 2.01 -1.26 -4.87 115.64 114.52 3h4f s THR 57 Ca 0.00 0.24 0.02 0.00 0.31 0.00 0.00 61.69 62.26 3h4f s THR 57 Cb 0.00 -3.15 -0.04 0.00 0.01 0.00 0.00 72.50 69.32 3h4f s THR 57 CO 0.00 0.02 0.03 -1.61 -0.69 0.00 0.00 174.62 172.37 3h4f s GLU 58 N 0.66 2.78 -0.01 4.92 2.02 -1.26 -0.98 118.70 126.82 3h4f s GLU 58 Ca 0.69 -0.67 0.03 0.00 0.02 0.00 0.00 54.97 55.04 3h4f s GLU 58 Cb -0.46 -2.67 -0.01 0.00 0.10 0.00 0.00 34.13 31.09 3h4f s GLU 58 CO 0.36 0.59 -0.10 0.08 0.02 0.00 0.00 175.26 176.21 3h4f s VAL 59 N -1.23 0.84 -0.96 2.63 1.01 -0.57 -4.97 120.40 117.16 3h4f s VAL 59 Ca 0.24 -0.44 -0.24 0.00 0.00 0.00 0.00 61.98 61.54 3h4f s VAL 59 Cb -0.12 -0.71 0.02 0.00 0.00 0.00 0.00 36.38 35.57 3h4f s VAL 59 CO 0.15 0.24 1.60 -1.00 0.00 0.00 0.00 175.10 176.10 3h4f s HIS 60 N -0.14 2.27 0.31 5.22 3.76 -1.26 -1.03 115.29 124.42 3h4f s HIS 60 Ca 0.02 -0.30 -0.29 0.00 -0.15 0.00 0.00 55.06 54.34 3h4f s HIS 60 Cb -0.05 -4.48 -0.10 0.00 1.11 0.00 0.00 32.58 29.05 3h4f s HIS 60 CO -0.00 -1.90 1.33 0.00 -0.85 0.00 0.00 174.74 173.32 3h4f s ALA 61 N 6.68 3.52 -0.33 -1.40 0.00 0.70 -4.86 121.76 126.08 3h4f s ALA 61 Ca 0.53 1.26 0.01 0.00 0.00 0.00 0.00 51.96 53.77 3h4f s ALA 61 Cb -0.03 -3.49 0.08 0.00 0.00 0.00 0.00 23.12 19.68 3h4f s ALA 61 CO -0.05 -0.65 0.04 -0.51 0.00 0.00 0.00 175.76 174.58 3h4f s LEU 62 N -1.39 4.41 -0.21 0.00 1.43 -0.89 -1.62 118.68 120.40 3h4f s LEU 62 Ca 0.51 -1.79 -0.01 0.00 -1.03 0.00 0.00 54.13 51.81 3h4f s LEU 62 Cb -0.40 -1.67 0.06 0.00 0.03 0.00 0.00 46.19 44.21 3h4f s LEU 62 CO 0.50 -0.35 -0.02 0.00 0.23 0.00 0.00 176.35 176.71 3h4f s ALA 63 N 1.06 1.55 0.03 4.21 0.00 0.26 -2.20 121.76 126.67 3h4f s ALA 63 Ca 0.03 -1.03 -0.32 0.00 0.00 0.00 0.00 51.96 50.64 3h4f s ALA 63 Cb -0.20 -1.28 -0.11 0.00 0.00 0.00 0.00 23.12 21.52 3h4f s ALA 63 CO -0.05 -1.10 1.86 1.19 0.00 0.00 0.00 175.76 177.65 3h4f n PHE 64 N 4.84 2.45 -1.26 0.00 3.72 -1.26 -1.22 117.46 124.73 3h4f n PHE 64 Ca -0.11 -0.10 -0.09 0.00 -0.05 0.00 0.00 57.45 57.10 3h4f n PHE 64 Cb 0.46 -2.70 -0.04 0.00 -0.94 0.00 0.00 39.48 36.26 3h4f n PHE 64 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 176.76 175.00 3h4f n ASN 65 N 6.19 -5.37 0.00 4.37 5.15 0.66 -2.59 115.26 123.66 3h4f n ASN 65 Ca 0.20 0.22 0.00 0.00 -0.60 0.00 0.00 54.58 54.40 3h4f n ASN 65 Cb 0.34 -3.67 0.00 0.00 -0.53 0.00 0.00 39.78 35.92 3h4f n ASN 65 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3h4f n GLY 66 N -0.16 0.60 3.29 8.20 0.00 -0.66 -4.91 105.19 111.54 3h4f n GLY 66 Ca -0.09 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.71 3h4f n GLY 66 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3h4f s THR 67 N -2.29 1.66 -0.25 2.61 -4.23 -1.07 -4.98 115.64 107.09 3h4f s THR 67 Ca 0.00 -1.68 0.03 0.00 -1.18 0.00 0.00 61.69 58.85 3h4f s THR 67 Cb 0.00 -1.62 0.06 0.00 1.34 0.00 0.00 72.50 72.27 3h4f s THR 67 CO 0.00 -0.21 -0.11 -0.69 -0.54 0.00 0.00 174.62 173.07 3h4f s VAL 68 N -1.62 2.10 0.83 2.29 1.01 -1.26 -2.68 120.40 121.08 3h4f s VAL 68 Ca 0.09 -1.53 -0.12 0.00 0.00 0.00 0.00 61.98 60.42 3h4f s VAL 68 Cb -0.08 -2.19 0.09 0.00 0.00 0.00 0.00 36.38 34.20 3h4f s VAL 68 CO 0.05 0.02 1.13 -2.16 0.00 0.00 0.00 175.10 174.13 3h4f s PRO 69 N 1.15 1.78 0.90 2.72 0.04 -1.26 -2.00 135.00 138.33 3h4f s PRO 69 Ca -0.07 0.40 -0.11 0.00 0.04 0.00 0.00 61.00 61.26 3h4f s PRO 69 Cb -0.19 -1.90 0.14 0.00 0.04 0.00 0.00 34.50 32.58 3h4f s PRO 69 CO -0.06 -1.78 1.16 0.20 0.04 0.00 0.00 177.00 176.57 3h4f s GLY 70 N -4.10 1.78 0.68 0.56 0.00 0.52 -4.72 107.32 102.03 3h4f s GLY 70 Ca 0.62 0.66 -0.15 0.00 0.00 0.00 0.00 44.72 45.84 3h4f s GLY 70 CO 0.53 1.08 1.14 2.56 0.00 0.00 0.00 173.10 178.41 3h4f s PRO 71 N -4.54 2.61 -0.08 2.90 0.04 -1.26 -4.37 135.00 130.30 3h4f s PRO 71 Ca 0.68 1.53 -0.30 0.00 0.04 0.00 0.00 61.00 62.95 3h4f s PRO 71 Cb -0.24 -1.91 -0.03 0.00 0.04 0.00 0.00 34.50 32.36 3h4f s PRO 71 CO 0.57 -1.42 1.16 -1.17 0.04 0.00 0.00 177.00 176.18 3h4f s LEU 72 N -4.89 4.26 -0.17 -3.56 2.96 -1.26 -4.37 118.68 111.65 3h4f s LEU 72 Ca 0.70 1.73 -0.08 0.00 -0.22 0.00 0.00 54.13 56.26 3h4f s LEU 72 Cb -0.24 -3.56 -0.04 0.00 0.50 0.00 0.00 46.19 42.85 3h4f s LEU 72 CO 0.42 -0.58 0.10 -0.04 -1.32 0.00 0.00 176.35 174.93 3h4f s MET 73 N 2.33 3.91 -0.16 1.98 -1.94 -1.18 -4.59 119.30 119.66 3h4f s MET 73 Ca 0.54 -0.25 0.01 0.00 -1.71 0.00 0.00 55.69 54.28 3h4f s MET 73 Cb -0.23 -3.28 0.02 0.00 2.01 0.00 0.00 34.83 33.35 3h4f s MET 73 CO 0.20 0.41 -0.18 0.08 -0.01 0.00 0.00 175.02 175.52 3h4f s VAL 74 N 0.00 1.86 0.33 -6.03 1.01 -1.26 -0.23 120.40 116.08 3h4f s VAL 74 Ca 0.08 -0.83 0.05 0.00 0.00 0.00 0.00 61.98 61.28 3h4f s VAL 74 Cb -0.12 -1.69 -0.03 0.00 0.00 0.00 0.00 36.38 34.54 3h4f s VAL 74 CO 0.00 0.51 0.19 0.68 0.00 0.00 0.00 175.10 176.48 3h4f s VAL 75 N 1.23 0.25 0.26 2.92 -7.23 -0.26 -5.00 120.40 112.58 3h4f s VAL 75 Ca 0.02 -2.00 0.09 0.00 -1.81 0.00 0.00 61.98 58.27 3h4f s VAL 75 Cb -0.14 -2.47 -0.04 0.00 0.56 0.00 0.00 36.38 34.30 3h4f s VAL 75 CO -0.09 0.00 0.06 -1.00 -0.31 0.00 0.00 175.10 173.75 3h4f s HIS 76 N -3.49 2.83 0.21 2.82 3.76 -1.26 -0.38 115.29 119.78 3h4f s HIS 76 Ca 0.35 -0.18 -0.32 0.00 -0.15 0.00 0.00 55.06 54.75 3h4f s HIS 76 Cb 0.04 -1.26 -0.13 0.00 1.11 0.00 0.00 32.58 32.33 3h4f s HIS 76 CO 0.20 0.59 1.57 0.94 -0.85 0.00 0.00 174.74 177.19 3h4f n GLN 77 N -0.94 2.32 -0.92 1.40 7.27 0.43 -1.69 117.38 125.25 3h4f n GLN 77 Ca -0.07 0.83 0.00 0.00 0.07 0.00 0.00 57.00 57.83 3h4f n GLN 77 Cb 0.58 -2.59 0.00 0.00 2.41 0.00 0.00 30.24 30.64 3h4f n GLN 77 CO 0.00 0.00 0.00 -0.25 0.07 0.00 0.00 177.06 176.88 3h4f n ASP 78 N 3.02 0.00 -4.61 1.69 10.43 0.14 -4.73 116.55 122.49 3h4f n ASP 78 Ca 0.14 0.00 -0.29 0.00 2.57 0.00 0.00 54.79 57.21 3h4f n ASP 78 Cb 0.32 -0.37 0.20 0.00 1.84 0.00 0.00 41.12 43.11 3h4f n ASP 78 CO 0.00 0.00 0.00 -1.81 -1.07 0.00 0.00 177.20 174.32 3h4f s ASP 79 N -2.86 2.18 -0.03 -2.24 -0.00 -0.68 -4.61 116.67 108.43 3h4f s ASP 79 Ca 0.00 1.59 0.01 0.00 -0.00 0.00 0.00 52.55 54.15 3h4f s ASP 79 Cb 0.00 -2.26 -0.03 0.00 -0.00 0.00 0.00 42.92 40.63 3h4f s ASP 79 CO 0.00 -3.46 -0.04 -0.31 -0.00 0.00 0.00 175.17 171.36 3h4f s TYR 80 N -2.68 3.00 -0.26 4.23 1.51 0.11 -1.28 117.35 121.98 3h4f s TYR 80 Ca 0.66 0.05 -0.09 0.00 -1.01 0.00 0.00 57.07 56.69 3h4f s TYR 80 Cb -0.22 -1.69 -0.04 0.00 -0.11 0.00 0.00 41.96 39.91 3h4f s TYR 80 CO 0.60 0.41 0.13 -1.17 -1.11 0.00 0.00 175.55 174.41 3h4f s LEU 81 N -1.20 3.77 -0.30 -1.29 0.20 -0.17 -0.23 118.68 119.45 3h4f s LEU 81 Ca 0.16 -0.08 0.01 0.00 0.69 0.00 0.00 54.13 54.91 3h4f s LEU 81 Cb -0.11 -2.03 0.07 0.00 -0.43 0.00 0.00 46.19 43.69 3h4f s LEU 81 CO 0.06 -0.02 -0.02 -0.70 -0.29 0.00 0.00 176.35 175.37 3h4f s GLU 82 N 1.58 2.17 -0.20 1.98 2.12 0.98 -1.84 118.70 125.49 3h4f s GLU 82 Ca 0.07 -1.44 -0.06 0.00 0.36 0.00 0.00 54.97 53.90 3h4f s GLU 82 Cb -0.15 -3.09 -0.03 0.00 0.26 0.00 0.00 34.13 31.12 3h4f s GLU 82 CO 0.07 -0.68 0.02 -1.17 -0.54 0.00 0.00 175.26 172.96 3h4f s LEU 83 N 1.12 3.38 -0.37 2.70 0.20 0.65 -0.69 118.68 125.67 3h4f s LEU 83 Ca -0.03 -0.15 -0.20 0.00 0.69 0.00 0.00 54.13 54.44 3h4f s LEU 83 Cb -0.20 -1.86 0.01 0.00 -0.43 0.00 0.00 46.19 43.70 3h4f s LEU 83 CO -0.04 0.07 0.61 -0.89 -0.29 0.00 0.00 176.35 175.81 3h4f s THR 84 N 0.97 4.90 -0.21 3.68 2.01 0.84 -1.00 115.64 126.83 3h4f s THR 84 Ca 0.02 0.42 -0.06 0.00 0.31 0.00 0.00 61.69 62.39 3h4f s THR 84 Cb -0.14 -4.08 -0.03 0.00 0.01 0.00 0.00 72.50 68.26 3h4f s THR 84 CO 0.02 -0.35 0.02 -0.22 -0.69 0.00 0.00 174.62 173.40 3h4f s LEU 85 N 2.66 3.35 -0.13 4.42 2.96 0.37 -1.62 118.68 130.70 3h4f s LEU 85 Ca 0.23 -0.18 0.00 0.00 -0.22 0.00 0.00 54.13 53.96 3h4f s LEU 85 Cb -0.15 -1.86 -0.01 0.00 0.50 0.00 0.00 46.19 44.67 3h4f s LEU 85 CO 0.15 0.05 -0.14 -0.63 -1.32 0.00 0.00 176.35 174.46 3h4f s ILE 86 N 1.07 2.91 -0.45 6.68 1.01 -0.54 -1.30 121.20 130.57 3h4f s ILE 86 Ca 0.03 -0.71 0.02 0.00 0.00 0.00 0.00 60.65 59.99 3h4f s ILE 86 Cb -0.14 -2.21 0.12 0.00 0.01 0.00 0.00 42.46 40.24 3h4f s ILE 86 CO 0.02 0.53 0.20 0.21 0.00 0.00 0.00 174.94 175.90 3h4f s ASN 87 N 0.38 4.75 0.58 3.58 2.47 0.31 -0.75 114.94 126.26 3h4f s ASN 87 Ca -0.12 -2.54 -0.20 0.00 0.42 0.00 0.00 52.86 50.42 3h4f s ASN 87 Cb -0.16 -1.69 -0.04 0.00 -1.45 0.00 0.00 41.25 37.90 3h4f s ASN 87 CO 0.06 -0.35 1.19 -2.65 -3.72 0.00 0.00 177.10 171.63 3h4f n PRO 88 N 3.79 1.29 0.29 0.43 -0.02 -1.26 0.66 135.00 140.18 3h4f n PRO 88 Ca 0.04 0.48 0.20 0.00 -2.02 0.00 0.00 63.50 62.20 3h4f n PRO 88 Cb 0.38 -2.40 1.02 0.00 -0.02 0.00 0.00 33.50 32.48 3h4f n PRO 88 CO 0.00 0.00 0.00 1.05 1.98 0.00 0.00 175.50 178.53 3h4f h GLU 89 N 0.94 0.00 0.00 -0.52 4.11 -1.90 -1.20 114.58 116.01 3h4f h GLU 89 Ca -0.50 0.00 -0.01 0.00 0.07 0.00 0.00 59.36 58.92 3h4f h GLU 89 Cb 1.33 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.58 3h4f h GLU 89 CO 0.54 0.00 -0.07 1.79 0.07 0.00 0.00 179.01 181.34 3h4f h THR 90 N 0.00 0.18 -4.17 -1.06 1.35 -1.95 -3.43 112.91 103.82 3h4f h THR 90 Ca 0.00 -0.74 -0.49 0.00 -0.55 0.00 0.00 66.41 64.63 3h4f h THR 90 Cb 0.08 1.63 0.14 0.00 -1.73 0.00 0.00 68.15 68.26 3h4f h THR 90 CO 0.00 0.07 0.28 0.20 -0.25 0.00 0.00 175.52 175.82 3h4f s ASN 91 N -5.89 3.92 -0.04 5.36 0.01 -0.45 -5.01 114.94 112.84 3h4f s ASN 91 Ca 0.01 1.58 0.11 0.00 -0.71 0.00 0.00 52.86 53.85 3h4f s ASN 91 Cb 0.09 -2.27 -0.16 0.00 0.41 0.00 0.00 41.25 39.31 3h4f s ASN 91 CO 0.58 -2.37 0.20 0.35 -1.51 0.00 0.00 177.10 174.35 3h4f n THR 92 N -3.72 0.17 -4.31 1.60 -2.24 -1.26 -4.75 114.28 99.77 3h4f n THR 92 Ca 0.08 -0.30 -0.30 0.00 -2.27 0.00 0.00 64.05 61.25 3h4f n THR 92 Cb 0.55 0.01 -0.10 0.00 -2.10 0.00 0.00 70.33 68.69 3h4f n THR 92 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 3h4f s LEU 93 N -4.02 3.03 0.31 3.22 1.43 -1.26 -4.91 118.68 116.49 3h4f s LEU 93 Ca -0.04 -0.35 -0.29 0.00 -1.03 0.00 0.00 54.13 52.42 3h4f s LEU 93 Cb 0.06 -1.81 -0.10 0.00 0.03 0.00 0.00 46.19 44.37 3h4f s LEU 93 CO 0.46 0.20 1.30 -0.32 0.23 0.00 0.00 176.35 178.22 3h4f s MET 94 N -2.00 4.37 0.23 1.70 -2.45 -1.26 -4.13 119.30 115.76 3h4f s MET 94 Ca 0.20 2.19 0.03 0.00 -1.25 0.00 0.00 55.69 56.85 3h4f s MET 94 Cb -0.11 -3.09 -0.05 0.00 1.25 0.00 0.00 34.83 32.83 3h4f s MET 94 CO 0.12 -0.18 0.02 -1.01 1.05 0.00 0.00 175.02 175.01 3h4f s HIS 95 N -0.96 1.54 0.00 4.11 0.09 -0.63 -4.92 115.29 114.51 3h4f s HIS 95 Ca 0.50 -0.98 0.00 0.00 -0.00 0.00 0.00 55.06 54.58 3h4f s HIS 95 Cb -0.39 -0.90 0.00 0.00 -0.00 0.00 0.00 32.58 31.29 3h4f s HIS 95 CO 0.50 -0.11 0.00 0.27 -0.00 0.00 0.00 174.74 175.40 3h4f n ASN 96 N -0.42 0.00 -3.76 1.40 6.94 -1.26 -0.54 115.26 117.62 3h4f n ASN 96 Ca -0.04 -0.88 -0.14 0.00 -0.02 0.00 0.00 54.58 53.50 3h4f n ASN 96 Cb 0.64 0.00 -0.15 0.00 -2.36 0.00 0.00 39.78 37.92 3h4f n ASN 96 CO 0.00 0.00 0.00 -0.51 -1.03 0.00 0.00 177.26 175.72 3h4f s ILE 97 N -2.58 -0.05 -0.23 1.53 2.07 -1.26 -4.11 121.20 116.57 3h4f s ILE 97 Ca 0.00 0.17 -0.06 0.00 -1.41 0.00 0.00 60.65 59.35 3h4f s ILE 97 Cb 0.00 -0.20 -0.02 0.00 0.13 0.00 0.00 42.46 42.37 3h4f s ILE 97 CO 0.00 0.07 0.03 -1.81 -1.91 0.00 0.00 174.94 171.32 3h4f s ASP 98 N 1.02 4.91 -0.38 4.50 -0.00 0.17 -1.30 116.67 125.59 3h4f s ASP 98 Ca -0.08 -0.23 -0.15 0.00 -0.00 0.00 0.00 52.55 52.08 3h4f s ASP 98 Cb -0.11 -1.86 0.00 0.00 -0.00 0.00 0.00 42.92 40.96 3h4f s ASP 98 CO -0.05 -0.00 0.35 -0.36 -0.00 0.00 0.00 175.17 175.12 3h4f s PHE 99 N 1.39 3.21 0.64 4.23 0.40 0.17 -0.87 117.98 127.15 3h4f s PHE 99 Ca 0.05 -0.29 0.34 0.00 -0.60 0.00 0.00 56.93 56.44 3h4f s PHE 99 Cb -0.15 -2.69 1.92 0.00 0.51 0.00 0.00 43.02 42.61 3h4f s PHE 99 CO 0.02 -0.54 2.15 0.45 0.70 0.00 0.00 175.22 178.00 3h4f h HIS 100 N 8.59 0.00 0.00 0.36 3.86 -1.55 -1.65 115.15 124.75 3h4f h HIS 100 Ca -0.28 0.00 -0.03 0.00 -1.16 0.00 0.00 60.37 58.90 3h4f h HIS 100 Cb 1.13 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 29.60 3h4f h HIS 100 CO 0.63 0.00 -0.15 0.00 0.86 0.00 0.00 177.93 179.27 3h4f h ALA 101 N 1.73 0.95 -2.22 2.45 0.00 -1.90 -3.47 119.26 116.80 3h4f h ALA 101 Ca 0.03 -0.14 -0.47 0.00 0.00 0.00 0.00 54.91 54.33 3h4f h ALA 101 Cb 0.36 -0.02 0.02 0.00 0.00 0.00 0.00 17.79 18.15 3h4f h ALA 101 CO -0.00 0.19 -0.11 0.00 0.00 0.00 0.00 179.25 179.32 3h4f s ALA 102 N -3.40 3.65 -0.17 0.00 0.00 -0.62 -4.66 121.76 116.57 3h4f s ALA 102 Ca 0.03 -0.86 0.01 0.00 0.00 0.00 0.00 51.96 51.15 3h4f s ALA 102 Cb 0.08 -2.21 0.01 0.00 0.00 0.00 0.00 23.12 21.00 3h4f s ALA 102 CO 0.64 -0.15 -0.20 0.99 0.00 0.00 0.00 175.76 177.05 3h4f s THR 103 N -2.44 2.15 0.00 0.00 2.01 -1.26 -4.62 115.64 111.48 3h4f s THR 103 Ca 0.43 -0.93 0.00 0.00 0.31 0.00 0.00 61.69 61.50 3h4f s THR 103 Cb -0.10 -1.89 0.00 0.00 0.01 0.00 0.00 72.50 70.52 3h4f s THR 103 CO 0.38 0.54 0.00 0.61 -0.69 0.00 0.00 174.62 175.46 3h4f n GLY 104 N 4.39 2.80 4.25 4.40 0.00 -1.26 -4.91 105.19 114.86 3h4f n GLY 104 Ca -0.20 -1.91 -0.33 0.00 0.00 0.00 0.00 46.02 43.58 3h4f n GLY 104 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h4f n ALA 105 N 0.37 -1.70 -2.46 4.61 0.00 -1.26 -0.44 120.51 119.63 3h4f n ALA 105 Ca 0.00 -0.26 -0.19 0.00 0.00 0.00 0.00 53.44 52.99 3h4f n ALA 105 Cb 0.00 -1.85 -0.00 0.00 0.00 0.00 0.00 19.45 17.60 3h4f n ALA 105 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3h4f n LEU 106 N -4.40 -1.99 0.00 0.00 4.77 -1.26 -1.45 117.00 112.67 3h4f n LEU 106 Ca -0.16 -0.06 0.00 0.00 -0.03 0.00 0.00 56.01 55.77 3h4f n LEU 106 Cb 0.61 -2.74 0.00 0.00 -2.33 0.00 0.00 43.42 38.95 3h4f n LEU 106 CO 0.85 -0.13 0.00 0.61 -1.33 0.00 0.00 177.39 177.39 3h4f n GLY 107 N -1.09 0.81 0.00 -0.72 0.00 0.42 -3.89 105.19 100.72 3h4f n GLY 107 Ca -0.21 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.81 3h4f n GLY 107 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3h4f n GLY 108 N -2.24 1.98 0.37 -0.02 0.00 -0.53 -0.66 105.19 104.09 3h4f n GLY 108 Ca 0.00 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.05 3h4f n GLY 108 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3h4f h GLY 109 N 0.00 1.42 2.00 -0.02 0.00 -0.81 -1.90 103.07 103.76 3h4f h GLY 109 Ca 0.00 -0.45 -0.01 0.00 0.00 0.00 0.00 47.33 46.87 3h4f h GLY 109 CO 0.00 0.34 -0.03 -1.33 0.00 0.00 0.00 176.54 175.52 3h4f h GLY 110 N 1.13 0.00 -0.98 4.60 0.00 -1.77 -3.05 103.07 102.99 3h4f h GLY 110 Ca 0.41 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.74 3h4f h GLY 110 CO -0.15 0.00 -0.16 1.04 0.00 0.00 0.00 176.54 177.27 3h4f n LEU 111 N -3.39 1.93 -0.18 3.11 4.77 -0.74 -4.64 117.00 117.87 3h4f n LEU 111 Ca -0.02 -0.88 0.06 0.00 -0.03 0.00 0.00 56.01 55.14 3h4f n LEU 111 Cb 0.15 0.00 0.08 0.00 -2.33 0.00 0.00 43.42 41.32 3h4f n LEU 111 CO 0.25 0.36 0.46 0.35 -1.33 0.00 0.00 177.39 177.48 3h4f n THR 112 N 0.36 1.19 -2.02 -5.08 -2.24 -1.07 -4.94 114.28 100.48 3h4f n THR 112 Ca 0.08 -1.41 -0.39 0.00 -2.27 0.00 0.00 64.05 60.05 3h4f n THR 112 Cb 0.36 0.10 -0.03 0.00 -2.10 0.00 0.00 70.33 68.66 3h4f n THR 112 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 3h4f s GLU 113 N -1.76 2.77 -0.20 -0.78 2.02 -1.24 -4.17 118.70 115.34 3h4f s GLU 113 Ca 0.18 0.82 -0.02 0.00 0.02 0.00 0.00 54.97 55.98 3h4f s GLU 113 Cb 0.16 -4.35 0.00 0.00 0.10 0.00 0.00 34.13 30.04 3h4f s GLU 113 CO 0.02 -2.55 -0.11 0.96 0.02 0.00 0.00 175.26 173.60 3h4f s ILE 114 N 8.69 2.87 0.72 -1.63 -4.36 0.30 -4.97 121.20 122.81 3h4f s ILE 114 Ca 0.71 -0.67 -0.13 0.00 -0.26 0.00 0.00 60.65 60.30 3h4f s ILE 114 Cb -0.15 -2.27 0.03 0.00 1.25 0.00 0.00 42.46 41.32 3h4f s ILE 114 CO 0.24 0.47 1.10 0.20 0.24 0.00 0.00 174.94 177.20 3h4f s ASN 115 N 1.33 4.78 0.16 4.36 0.02 -1.26 -1.60 114.94 122.73 3h4f s ASN 115 Ca 0.04 1.93 -0.34 0.00 -1.02 0.00 0.00 52.86 53.48 3h4f s ASN 115 Cb -0.14 -2.54 -0.16 0.00 0.02 0.00 0.00 41.25 38.44 3h4f s ASN 115 CO -0.06 -1.85 1.25 -2.65 0.02 0.00 0.00 177.10 173.81 3h4f n PRO 116 N -2.94 1.30 -0.44 -0.60 -0.02 -1.26 -1.12 135.00 129.91 3h4f n PRO 116 Ca 0.10 0.47 0.00 0.00 -2.02 0.00 0.00 63.50 62.04 3h4f n PRO 116 Cb 0.52 -2.03 0.00 0.00 -0.02 0.00 0.00 33.50 31.97 3h4f n PRO 116 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3h4f n GLY 117 N 2.22 0.75 3.37 -1.23 0.00 0.21 -4.69 105.19 105.83 3h4f n GLY 117 Ca 0.16 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.91 3h4f n GLY 117 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3h4f s GLU 118 N -0.56 1.37 0.30 1.61 2.02 -0.28 -4.89 118.70 118.27 3h4f s GLU 118 Ca 0.00 -1.38 0.03 0.00 0.02 0.00 0.00 54.97 53.64 3h4f s GLU 118 Cb 0.00 -1.71 -0.06 0.00 0.10 0.00 0.00 34.13 32.46 3h4f s GLU 118 CO 0.00 0.39 0.07 -1.59 0.02 0.00 0.00 175.26 174.15 3h4f s LYS 119 N -2.33 1.57 0.00 1.61 -2.85 -1.26 -0.53 119.74 115.96 3h4f s LYS 119 Ca 0.15 -1.86 -0.24 0.00 -1.00 0.00 0.00 55.97 53.02 3h4f s LYS 119 Cb -0.09 -0.65 0.05 0.00 -2.06 0.00 0.00 37.83 35.09 3h4f s LYS 119 CO 0.07 -0.23 0.53 -0.08 0.10 0.00 0.00 175.35 175.75 3h4f s THR 120 N -3.46 0.03 -0.15 3.79 -1.32 -0.42 -5.00 115.64 109.10 3h4f s THR 120 Ca 0.37 -0.21 0.00 0.00 -1.21 0.00 0.00 61.69 60.65 3h4f s THR 120 Cb 0.08 -0.91 0.03 0.00 -1.51 0.00 0.00 72.50 70.19 3h4f s THR 120 CO 0.15 -0.11 -0.12 -0.63 -2.21 0.00 0.00 174.62 171.70 3h4f s ILE 121 N -1.81 1.45 -0.13 5.08 1.01 -1.26 -0.48 121.20 125.07 3h4f s ILE 121 Ca -0.09 -0.63 -0.02 0.00 0.00 0.00 0.00 60.65 59.91 3h4f s ILE 121 Cb -0.01 -1.43 -0.02 0.00 0.01 0.00 0.00 42.46 41.01 3h4f s ILE 121 CO 0.03 0.37 -0.07 -0.22 0.00 0.00 0.00 174.94 175.05 3h4f s LEU 122 N 1.52 3.09 -0.05 2.97 2.96 -0.17 -4.96 118.68 124.04 3h4f s LEU 122 Ca 0.04 -0.15 0.06 0.00 -0.22 0.00 0.00 54.13 53.85 3h4f s LEU 122 Cb -0.13 -1.71 -0.02 0.00 0.50 0.00 0.00 46.19 44.83 3h4f s LEU 122 CO -0.10 0.22 -0.23 -0.60 -1.32 0.00 0.00 176.35 174.33 3h4f s ARG 123 N 0.06 2.51 0.02 1.98 3.52 -1.26 -0.25 118.95 125.52 3h4f s ARG 123 Ca -0.02 -0.86 -0.02 0.00 -0.13 0.00 0.00 55.73 54.70 3h4f s ARG 123 Cb -0.14 -2.21 -0.02 0.00 -1.56 0.00 0.00 34.95 31.03 3h4f s ARG 123 CO 0.03 0.45 0.02 -0.59 -0.81 0.00 0.00 175.30 174.40 3h4f s PHE 124 N -0.32 0.23 -0.14 5.12 -0.12 -0.76 -5.00 117.98 116.99 3h4f s PHE 124 Ca 0.02 -0.49 -0.22 0.00 -0.05 0.00 0.00 56.93 56.18 3h4f s PHE 124 Cb -0.13 -0.17 -0.03 0.00 -0.63 0.00 0.00 43.02 42.06 3h4f s PHE 124 CO 0.02 -0.25 0.67 0.21 -0.05 0.00 0.00 175.22 175.82 3h4f s LYS 125 N -1.81 4.32 -1.17 1.99 2.20 -1.26 -1.00 119.74 123.01 3h4f s LYS 125 Ca -0.12 0.76 -0.17 0.00 -0.36 0.00 0.00 55.97 56.08 3h4f s LYS 125 Cb -0.07 -3.51 0.13 0.00 -1.51 0.00 0.00 37.83 32.86 3h4f s LYS 125 CO -0.02 -0.10 1.48 0.00 -0.36 0.00 0.00 175.35 176.35 3h4f s ALA 126 N 1.40 3.60 -0.24 3.13 0.00 -0.41 -4.79 121.76 124.46 3h4f s ALA 126 Ca 0.33 -3.05 0.23 0.00 0.00 0.00 0.00 51.96 49.47 3h4f s ALA 126 Cb -0.17 -4.30 0.47 0.00 0.00 0.00 0.00 23.12 19.12 3h4f s ALA 126 CO 0.13 -3.03 1.64 1.79 0.00 0.00 0.00 175.76 176.30 3h4f h THR 127 N 5.29 0.27 -3.73 0.00 1.35 -1.85 0.39 112.91 114.63 3h4f h THR 127 Ca 0.32 -1.25 -0.59 0.00 -0.55 0.00 0.00 66.41 64.35 3h4f h THR 127 Cb 0.91 2.01 -0.32 0.00 -1.73 0.00 0.00 68.15 69.02 3h4f h THR 127 CO 1.30 0.14 -0.85 -0.54 -0.25 0.00 0.00 175.52 175.33 3h4f s LYS 128 N -3.26 2.07 0.19 4.72 1.02 -1.26 -4.71 119.74 118.52 3h4f s LYS 128 Ca 0.05 -0.65 -0.30 0.00 0.02 0.00 0.00 55.97 55.09 3h4f s LYS 128 Cb 0.07 -1.72 -0.08 0.00 -0.52 0.00 0.00 37.83 35.57 3h4f s LYS 128 CO 0.67 0.21 1.10 -1.25 -0.92 0.00 0.00 175.35 175.15 3h4f s PRO 129 N 0.18 4.61 0.00 -1.68 0.04 -1.26 -4.81 135.00 132.08 3h4f s PRO 129 Ca -0.08 1.73 0.00 0.00 0.04 0.00 0.00 61.00 62.68 3h4f s PRO 129 Cb -0.14 -3.26 0.00 0.00 0.04 0.00 0.00 34.50 31.14 3h4f s PRO 129 CO 0.04 0.10 0.00 0.41 0.04 0.00 0.00 177.00 177.59 3h4f n GLY 130 N 1.91 0.85 3.81 0.56 0.00 0.77 -2.30 105.19 110.79 3h4f n GLY 130 Ca 0.02 -1.35 -0.38 0.00 0.00 0.00 0.00 46.02 44.31 3h4f n GLY 130 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3h4f s VAL 131 N -1.89 4.96 -0.01 1.61 -7.23 0.30 0.38 120.40 118.52 3h4f s VAL 131 Ca 0.00 0.97 0.00 0.00 -1.81 0.00 0.00 61.98 61.14 3h4f s VAL 131 Cb 0.00 -3.78 0.01 0.00 0.56 0.00 0.00 36.38 33.16 3h4f s VAL 131 CO 0.00 0.54 0.01 -0.36 -0.31 0.00 0.00 175.10 174.97 3h4f s PHE 132 N -0.84 0.02 0.45 2.82 0.08 0.32 -4.45 117.98 116.38 3h4f s PHE 132 Ca 0.26 0.04 -0.25 0.00 0.12 0.00 0.00 56.93 57.09 3h4f s PHE 132 Cb -0.17 -0.07 -0.08 0.00 -0.57 0.00 0.00 43.02 42.12 3h4f s PHE 132 CO 0.15 -0.03 1.42 0.08 -0.10 0.00 0.00 175.22 176.74 3h4f s VAL 133 N 0.32 2.09 0.13 -0.44 1.01 -1.26 -0.10 120.40 122.15 3h4f s VAL 133 Ca -0.03 0.08 0.08 0.00 0.00 0.00 0.00 61.98 62.12 3h4f s VAL 133 Cb -0.04 -3.05 -0.04 0.00 0.00 0.00 0.00 36.38 33.26 3h4f s VAL 133 CO -0.01 0.01 -0.20 -0.72 0.00 0.00 0.00 175.10 174.18 3h4f s TYR 134 N -1.21 1.81 0.02 5.22 -0.85 -0.68 -1.50 117.35 120.17 3h4f s TYR 134 Ca 0.61 -0.44 -0.28 0.00 -0.52 0.00 0.00 57.07 56.44 3h4f s TYR 134 Cb -0.43 -0.95 0.08 0.00 0.38 0.00 0.00 41.96 41.03 3h4f s TYR 134 CO 0.56 0.26 0.68 -3.38 -1.52 0.00 0.00 175.55 172.15 3h4f s HIS 135 N -1.54 -0.58 0.55 -3.49 -3.43 -0.05 -0.66 115.29 106.10 3h4f s HIS 135 Ca 0.10 0.74 -0.20 0.00 -0.80 0.00 0.00 55.06 54.91 3h4f s HIS 135 Cb -0.08 0.48 -0.06 0.00 -1.43 0.00 0.00 32.58 31.49 3h4f s HIS 135 CO 0.05 -0.68 1.15 0.00 -2.00 0.00 0.00 174.74 173.27 3h4f n ALA 137 N -1.29 -1.03 -2.42 0.00 0.00 -1.26 -4.49 120.51 110.02 3h4f n ALA 137 Ca 0.12 -1.54 -0.42 0.00 0.00 0.00 0.00 53.44 51.60 3h4f n ALA 137 Cb 0.50 -1.27 -0.03 0.00 0.00 0.00 0.00 19.45 18.66 3h4f n ALA 137 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 3h4f s PRO 138 N 0.46 4.40 -0.08 0.00 0.02 -1.26 -4.86 135.00 133.68 3h4f s PRO 138 Ca 0.30 1.76 -0.40 0.00 0.02 0.00 0.00 61.00 62.67 3h4f s PRO 138 Cb 0.24 -3.42 -0.18 0.00 0.02 0.00 0.00 34.50 31.16 3h4f s PRO 138 CO -0.19 -0.32 1.33 -2.30 -0.33 0.00 0.00 177.00 175.18 3h4f n PRO 139 N 4.35 0.52 -0.56 5.54 -0.02 -1.26 -0.95 135.00 142.63 3h4f n PRO 139 Ca 0.10 0.19 0.00 0.00 -2.02 0.00 0.00 63.50 61.77 3h4f n PRO 139 Cb 0.46 -1.76 0.00 0.00 -0.02 0.00 0.00 33.50 32.18 3h4f n PRO 139 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3h4f n GLY 140 N 2.56 1.67 1.33 -1.23 0.00 -1.26 -4.79 105.19 103.46 3h4f n GLY 140 Ca 0.22 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.26 3h4f n GLY 140 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 3h4f n MET 141 N -2.00 0.00 0.47 1.61 2.81 -0.12 -4.99 117.12 114.90 3h4f n MET 141 Ca 0.00 -1.77 -0.18 0.00 -1.81 0.00 0.00 57.70 53.93 3h4f n MET 141 Cb 0.00 -0.01 -0.09 0.00 -0.71 0.00 0.00 33.22 32.41 3h4f n MET 141 CO 0.00 0.00 0.00 0.28 1.51 0.00 0.00 175.97 177.76 3h4f h VAL 142 N 6.80 0.00 -0.14 2.03 2.07 -1.82 -2.72 116.25 122.48 3h4f h VAL 142 Ca -0.23 -0.01 -0.03 0.00 0.82 0.00 0.00 66.70 67.25 3h4f h VAL 142 Cb 1.79 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 31.55 3h4f h VAL 142 CO 0.05 0.00 -0.03 1.55 0.02 0.00 0.00 177.57 179.16 3h4f h PRO 143 N -1.21 0.20 -0.56 1.57 0.13 -1.92 -2.48 132.00 127.73 3h4f h PRO 143 Ca -0.12 -0.03 -0.01 0.00 -0.87 0.00 0.00 66.00 64.97 3h4f h PRO 143 Cb 0.92 -0.04 -0.03 0.00 0.13 0.00 0.00 31.00 31.99 3h4f h PRO 143 CO 0.20 0.25 0.30 2.35 -0.23 0.00 0.00 178.00 180.87 3h4f h TRP 144 N 0.19 0.77 -0.67 1.56 7.01 -1.95 0.15 115.95 123.01 3h4f h TRP 144 Ca 0.05 -0.02 -0.07 0.00 2.11 0.00 0.00 58.89 60.96 3h4f h TRP 144 Cb 0.19 -0.24 -0.03 0.00 -2.10 0.00 0.00 29.16 26.98 3h4f h TRP 144 CO 0.00 0.57 0.15 0.45 -2.79 0.00 0.00 178.44 176.82 3h4f h HIS 145 N 0.75 1.14 -0.07 2.65 3.86 -1.23 -2.65 115.15 119.59 3h4f h HIS 145 Ca 0.19 -0.14 -0.01 0.00 -1.16 0.00 0.00 60.37 59.25 3h4f h HIS 145 Cb 0.06 -0.32 -0.00 0.00 1.06 0.00 0.00 27.41 28.21 3h4f h HIS 145 CO -0.01 0.94 0.00 0.28 0.86 0.00 0.00 177.93 180.00 3h4f h VAL 146 N 1.01 1.24 0.00 2.45 2.07 -1.01 -2.13 116.25 119.88 3h4f h VAL 146 Ca 0.21 -0.74 0.00 0.00 0.82 0.00 0.00 66.70 66.99 3h4f h VAL 146 Cb 0.38 1.60 0.00 0.00 -1.52 0.00 0.00 31.29 31.75 3h4f h VAL 146 CO 0.00 0.21 0.00 1.33 0.02 0.00 0.00 177.57 179.13 3h4f n VAL 147 N -4.86 0.00 0.15 2.57 0.24 0.47 -1.24 118.33 115.65 3h4f n VAL 147 Ca -0.07 0.00 0.09 0.00 -2.04 0.00 0.00 64.34 62.33 3h4f n VAL 147 Cb 0.18 -0.51 0.26 0.00 -1.47 0.00 0.00 33.84 32.29 3h4f n VAL 147 CO 0.00 0.00 0.00 -1.20 -2.14 0.00 0.00 176.83 173.49 3h4f n SER 148 N -0.96 3.12 0.00 -1.34 7.64 -1.00 -4.59 113.62 116.50 3h4f n SER 148 Ca 0.19 -2.01 0.00 0.00 1.01 0.00 0.00 58.87 58.07 3h4f n SER 148 Cb 0.09 -0.39 0.00 0.00 -1.01 0.00 0.00 64.21 62.90 3h4f n SER 148 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3h4f n GLY 149 N 1.41 0.90 2.69 0.23 0.00 -0.38 -2.10 105.19 107.95 3h4f n GLY 149 Ca 0.19 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.80 3h4f n GLY 149 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 3h4f n MET 150 N -2.13 3.47 -3.56 1.61 0.00 -0.83 -4.50 117.12 111.18 3h4f n MET 150 Ca 0.00 -3.00 -0.16 0.00 0.00 0.00 0.00 57.70 54.54 3h4f n MET 150 Cb 0.00 -3.01 -0.06 0.00 0.00 0.00 0.00 33.22 30.15 3h4f n MET 150 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 175.97 176.51 3h4f s ASN 151 N 1.83 -0.53 0.00 6.12 2.20 -1.26 -1.57 114.94 121.73 3h4f s ASN 151 Ca 0.48 0.43 0.00 0.00 -0.94 0.00 0.00 52.86 52.83 3h4f s ASN 151 Cb 0.13 0.50 0.00 0.00 -2.00 0.00 0.00 41.25 39.88 3h4f s ASN 151 CO -0.05 -0.64 0.00 0.61 -2.94 0.00 0.00 177.10 174.08 3h4f n GLY 152 N 0.74 4.47 3.33 0.45 0.00 0.16 -0.35 105.19 114.00 3h4f n GLY 152 Ca -0.19 -0.88 -0.09 0.00 0.00 0.00 0.00 46.02 44.86 3h4f n GLY 152 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h4f s ALA 153 N -1.55 -0.06 0.20 4.61 0.00 -1.26 -1.68 121.76 122.02 3h4f s ALA 153 Ca 0.00 -0.83 0.08 0.00 0.00 0.00 0.00 51.96 51.21 3h4f s ALA 153 Cb 0.00 0.82 -0.05 0.00 0.00 0.00 0.00 23.12 23.90 3h4f s ALA 153 CO 0.00 -0.64 -0.14 0.96 0.00 0.00 0.00 175.76 175.94 3h4f s ILE 154 N -3.95 1.71 -0.13 0.00 -4.36 0.86 -3.10 121.20 112.23 3h4f s ILE 154 Ca 0.16 -2.21 0.02 0.00 -0.26 0.00 0.00 60.65 58.36 3h4f s ILE 154 Cb 0.03 -2.04 0.01 0.00 1.25 0.00 0.00 42.46 41.71 3h4f s ILE 154 CO -0.01 -0.60 -0.21 -0.32 0.24 0.00 0.00 174.94 174.04 3h4f s MET 155 N -3.65 2.88 -0.50 0.37 -2.45 0.68 -0.52 119.30 116.11 3h4f s MET 155 Ca 0.22 -0.81 -0.09 0.00 -1.25 0.00 0.00 55.69 53.77 3h4f s MET 155 Cb -0.01 -2.33 0.13 0.00 1.25 0.00 0.00 34.83 33.87 3h4f s MET 155 CO 0.07 -0.01 0.37 0.08 1.05 0.00 0.00 175.02 176.58 3h4f s VAL 156 N 0.81 4.27 0.40 10.11 1.01 0.16 -1.10 120.40 136.05 3h4f s VAL 156 Ca -0.08 -1.88 -0.23 0.00 0.00 0.00 0.00 61.98 59.80 3h4f s VAL 156 Cb -0.16 -3.80 -0.10 0.00 0.00 0.00 0.00 36.38 32.32 3h4f s VAL 156 CO -0.01 -0.80 0.96 -0.76 0.00 0.00 0.00 175.10 174.49 3h4f s LEU 157 N 1.24 4.06 0.54 3.92 1.43 0.49 -0.16 118.68 130.20 3h4f s LEU 157 Ca 0.07 1.76 -0.22 0.00 -1.03 0.00 0.00 54.13 54.70 3h4f s LEU 157 Cb -0.25 -4.37 -0.05 0.00 0.03 0.00 0.00 46.19 41.54 3h4f s LEU 157 CO -0.01 -0.29 1.37 -2.84 0.23 0.00 0.00 176.35 174.80 3h4f s PRO 158 N -2.82 3.16 0.47 1.29 0.02 -1.26 -0.43 135.00 135.42 3h4f s PRO 158 Ca 0.59 2.26 0.21 0.00 0.02 0.00 0.00 61.00 64.08 3h4f s PRO 158 Cb -0.13 -2.28 1.22 0.00 0.02 0.00 0.00 34.50 33.34 3h4f s PRO 158 CO 0.17 -1.18 1.91 0.00 -0.33 0.00 0.00 177.00 177.57 3h4f h ARG 159 N 1.50 0.23 -0.59 5.54 2.47 -1.88 -0.00 114.38 121.65 3h4f h ARG 159 Ca -0.51 -0.01 0.00 0.00 -1.26 0.00 0.00 59.98 58.20 3h4f h ARG 159 Cb 1.30 -0.05 0.00 0.00 -1.65 0.00 0.00 29.97 29.57 3h4f h ARG 159 CO 0.57 0.15 0.00 -0.85 0.56 0.00 0.00 179.97 180.41 3h4f n GLU 160 N -4.42 4.83 -0.23 0.04 0.00 -1.26 0.14 120.64 119.74 3h4f n GLU 160 Ca 0.15 -3.10 0.03 0.00 0.00 0.00 0.00 57.16 54.24 3h4f n GLU 160 Cb 0.68 -2.25 -0.01 0.00 0.00 0.00 0.00 31.44 29.85 3h4f n GLU 160 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 3h4f n GLY 161 N 0.63 -1.87 3.81 -1.84 0.00 -0.02 -4.81 105.19 101.09 3h4f n GLY 161 Ca 0.27 -1.32 -0.35 0.00 0.00 0.00 0.00 46.02 44.62 3h4f n GLY 161 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3h4f s LEU 162 N 0.00 4.22 0.16 0.99 1.43 -1.25 -4.47 118.68 119.75 3h4f s LEU 162 Ca 0.00 1.65 0.04 0.00 -1.03 0.00 0.00 54.13 54.79 3h4f s LEU 162 Cb 0.00 -4.05 -0.05 0.00 0.03 0.00 0.00 46.19 42.13 3h4f s LEU 162 CO 0.00 -0.13 -0.09 -1.00 0.23 0.00 0.00 176.35 175.36 3h4f s HIS 163 N -1.77 1.32 0.55 0.29 3.76 -1.26 0.19 115.29 118.38 3h4f s HIS 163 Ca 0.52 -0.78 -0.06 0.00 -0.15 0.00 0.00 55.06 54.59 3h4f s HIS 163 Cb -0.15 -0.69 0.12 0.00 1.11 0.00 0.00 32.58 32.97 3h4f s HIS 163 CO 0.20 0.07 0.75 -0.40 -0.85 0.00 0.00 174.74 174.51 3h4f n ASP 164 N -0.24 0.40 0.31 1.40 3.85 0.06 -4.79 116.55 117.54 3h4f n ASP 164 Ca -0.09 -1.48 0.21 0.00 -0.71 0.00 0.00 54.79 52.71 3h4f n ASP 164 Cb 0.61 -0.54 1.08 0.00 -1.35 0.00 0.00 41.12 40.91 3h4f n ASP 164 CO 0.00 0.00 0.00 1.23 -1.01 0.00 0.00 177.20 177.42 3h4f h GLY 165 N -0.80 0.00 0.11 6.12 0.00 -1.89 -2.16 103.07 104.45 3h4f h GLY 165 Ca -0.25 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.08 3h4f h GLY 165 CO 0.21 0.00 -0.86 0.28 0.00 0.00 0.00 176.54 176.17 3h4f n LYS 166 N -3.01 0.10 -0.14 4.80 5.02 -1.26 -4.97 118.16 118.71 3h4f n LYS 166 Ca -0.02 -0.08 0.00 0.00 -2.02 0.00 0.00 58.31 56.19 3h4f n LYS 166 Cb 0.11 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.62 3h4f n LYS 166 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3h4f n GLY 167 N 1.49 0.83 3.74 0.72 0.00 -0.81 -5.07 105.19 106.08 3h4f n GLY 167 Ca 0.05 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.66 3h4f n GLY 167 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3h4f s LYS 168 N -0.86 4.65 0.33 1.61 -0.14 -1.26 -4.77 119.74 119.29 3h4f s LYS 168 Ca 0.00 1.62 -0.29 0.00 -1.36 0.00 0.00 55.97 55.94 3h4f s LYS 168 Cb 0.00 -3.31 -0.11 0.00 -1.68 0.00 0.00 37.83 32.73 3h4f s LYS 168 CO 0.00 0.15 1.47 0.00 -0.76 0.00 0.00 175.35 176.22 3h4f s ALA 169 N -0.24 3.61 -0.24 5.17 0.00 -1.26 -0.76 121.76 128.04 3h4f s ALA 169 Ca 0.48 1.48 -0.00 0.00 0.00 0.00 0.00 51.96 53.92 3h4f s ALA 169 Cb -0.27 -3.59 0.03 0.00 0.00 0.00 0.00 23.12 19.29 3h4f s ALA 169 CO 0.33 -0.91 -0.10 -0.51 0.00 0.00 0.00 175.76 174.57 3h4f s LEU 170 N -1.35 3.05 -0.20 0.00 1.43 0.13 -4.81 118.68 116.92 3h4f s LEU 170 Ca 0.56 -0.95 -0.00 0.00 -1.03 0.00 0.00 54.13 52.71 3h4f s LEU 170 Cb -0.45 -1.60 0.02 0.00 0.03 0.00 0.00 46.19 44.18 3h4f s LEU 170 CO 0.54 -0.12 -0.15 -0.89 0.23 0.00 0.00 176.35 175.97 3h4f s THR 171 N 1.27 2.44 0.30 5.49 2.01 -1.26 -3.92 115.64 121.97 3h4f s THR 171 Ca -0.01 -0.88 -0.15 0.00 0.31 0.00 0.00 61.69 60.96 3h4f s THR 171 Cb -0.17 -2.09 -0.09 0.00 0.01 0.00 0.00 72.50 70.17 3h4f s THR 171 CO -0.06 0.45 0.72 -0.72 -0.69 0.00 0.00 174.62 174.32 3h4f s TYR 172 N 1.33 3.41 0.04 4.92 -0.85 -1.26 -4.85 117.35 120.08 3h4f s TYR 172 Ca 0.04 1.21 -0.03 0.00 -0.52 0.00 0.00 57.07 57.76 3h4f s TYR 172 Cb -0.14 -2.52 -0.28 0.00 0.38 0.00 0.00 41.96 39.40 3h4f s TYR 172 CO -0.10 0.13 0.99 -0.44 -1.52 0.00 0.00 175.55 174.62 3h4f h ASP 173 N 2.40 0.40 -4.99 -0.18 3.32 -0.23 -3.48 116.42 113.66 3h4f h ASP 173 Ca -0.48 -0.49 -0.18 0.00 0.02 0.00 0.00 57.03 55.91 3h4f h ASP 173 Cb 1.18 -0.13 -0.18 0.00 0.22 0.00 0.00 39.33 40.41 3h4f h ASP 173 CO 0.66 1.40 -0.70 -0.54 -1.72 0.00 0.00 179.24 178.34 3h4f s LYS 174 N -2.63 0.51 -0.05 3.56 1.02 -0.96 -5.02 119.74 116.17 3h4f s LYS 174 Ca -0.06 -0.93 0.01 0.00 0.02 0.00 0.00 55.97 55.00 3h4f s LYS 174 Cb 0.07 0.04 0.02 0.00 -0.52 0.00 0.00 37.83 37.44 3h4f s LYS 174 CO 0.87 -0.05 -0.07 -1.50 -0.92 0.00 0.00 175.35 173.67 3h4f s ILE 175 N -2.57 0.77 0.14 2.17 2.07 -1.26 -1.22 121.20 121.30 3h4f s ILE 175 Ca -0.04 -0.26 0.09 0.00 -1.41 0.00 0.00 60.65 59.03 3h4f s ILE 175 Cb -0.02 -0.76 -0.04 0.00 0.13 0.00 0.00 42.46 41.78 3h4f s ILE 175 CO -0.04 0.28 -0.16 -0.31 -1.91 0.00 0.00 174.94 172.80 3h4f s TYR 176 N 0.85 2.56 -0.25 3.50 2.02 -0.47 -4.44 117.35 121.13 3h4f s TYR 176 Ca -0.12 -0.25 0.01 0.00 -0.37 0.00 0.00 57.07 56.34 3h4f s TYR 176 Cb -0.15 -1.32 0.04 0.00 -0.40 0.00 0.00 41.96 40.13 3h4f s TYR 176 CO 0.01 0.43 -0.11 -0.47 -1.57 0.00 0.00 175.55 173.84 3h4f s TYR 177 N -1.32 3.13 -0.44 2.71 5.04 0.37 -1.09 117.35 125.73 3h4f s TYR 177 Ca 0.20 -1.98 -0.15 0.00 -2.44 0.00 0.00 57.07 52.70 3h4f s TYR 177 Cb -0.10 -1.97 0.06 0.00 0.35 0.00 0.00 41.96 40.29 3h4f s TYR 177 CO 0.12 -0.83 0.35 0.08 -1.34 0.00 0.00 175.55 173.93 3h4f s VAL 178 N 1.20 5.11 -0.15 3.14 1.01 0.51 -4.09 120.40 127.14 3h4f s VAL 178 Ca -0.04 -0.97 -0.21 0.00 0.00 0.00 0.00 61.98 60.77 3h4f s VAL 178 Cb -0.18 -3.99 -0.03 0.00 0.00 0.00 0.00 36.38 32.18 3h4f s VAL 178 CO -0.06 -0.48 0.60 -0.83 0.00 0.00 0.00 175.10 174.33 3h4f s GLY 179 N 2.24 2.27 -0.15 4.51 0.00 -1.26 -2.09 107.32 112.85 3h4f s GLY 179 Ca 0.04 -0.17 -0.05 0.00 0.00 0.00 0.00 44.72 44.54 3h4f s GLY 179 CO 0.07 1.12 0.03 1.85 0.00 0.00 0.00 173.10 176.17 3h4f s GLU 180 N 1.30 3.63 -0.14 2.90 2.12 -0.03 -2.39 118.70 126.09 3h4f s GLU 180 Ca 0.30 -0.38 0.00 0.00 0.36 0.00 0.00 54.97 55.25 3h4f s GLU 180 Cb -0.16 -3.04 0.02 0.00 0.26 0.00 0.00 34.13 31.21 3h4f s GLU 180 CO 0.12 0.41 -0.14 -1.14 -0.54 0.00 0.00 175.26 173.97 3h4f s GLN 181 N -0.04 2.22 -0.19 4.30 2.00 0.07 -4.47 119.66 123.56 3h4f s GLN 181 Ca 0.05 -0.53 -0.25 0.00 -2.00 0.00 0.00 55.36 52.62 3h4f s GLN 181 Cb -0.12 -2.03 -0.01 0.00 0.80 0.00 0.00 33.01 31.64 3h4f s GLN 181 CO 0.01 -0.21 0.83 0.16 -0.50 0.00 0.00 175.29 175.58 3h4f s ASP 182 N 1.43 6.92 0.07 6.67 3.84 -1.26 -0.76 116.67 133.59 3h4f s ASP 182 Ca 0.03 1.14 0.05 0.00 -0.00 0.00 0.00 52.55 53.77 3h4f s ASP 182 Cb -0.13 -2.45 -0.04 0.00 -1.38 0.00 0.00 42.92 38.92 3h4f s ASP 182 CO -0.09 -0.42 -0.05 -0.36 -0.00 0.00 0.00 175.17 174.24 3h4f s PHE 183 N 2.30 2.87 -0.48 2.11 0.08 -0.53 -4.72 117.98 119.61 3h4f s PHE 183 Ca 0.37 -0.08 0.03 0.00 0.12 0.00 0.00 56.93 57.38 3h4f s PHE 183 Cb -0.16 -1.52 0.14 0.00 -0.57 0.00 0.00 43.02 40.91 3h4f s PHE 183 CO 0.11 0.43 0.29 0.71 -0.10 0.00 0.00 175.22 176.66 3h4f s TYR 184 N -1.19 2.18 -0.23 0.36 1.51 -1.26 -1.27 117.35 117.45 3h4f s TYR 184 Ca 0.22 -2.59 -0.13 0.00 -1.01 0.00 0.00 57.07 53.56 3h4f s TYR 184 Cb -0.11 -1.96 -0.04 0.00 -0.11 0.00 0.00 41.96 39.74 3h4f s TYR 184 CO 0.14 -0.75 0.27 0.08 -1.11 0.00 0.00 175.55 174.18 3h4f s VAL 185 N 0.03 5.28 0.60 0.71 1.01 -1.26 -4.80 120.40 121.97 3h4f s VAL 185 Ca 0.20 0.41 -0.19 0.00 0.00 0.00 0.00 61.98 62.41 3h4f s VAL 185 Cb -0.19 -3.61 -0.03 0.00 0.00 0.00 0.00 36.38 32.56 3h4f s VAL 185 CO -0.04 0.28 1.22 -2.84 0.00 0.00 0.00 175.10 173.72 3h4f s PRO 186 N 1.31 2.92 0.13 2.72 0.02 -1.26 -4.91 135.00 135.93 3h4f s PRO 186 Ca 0.12 1.86 0.09 0.00 0.02 0.00 0.00 61.00 63.10 3h4f s PRO 186 Cb -0.14 -1.92 -0.04 0.00 0.02 0.00 0.00 34.50 32.42 3h4f s PRO 186 CO 0.07 -1.26 -0.22 1.03 -0.33 0.00 0.00 177.00 176.29 3h4f s ARG 187 N -3.34 1.27 1.03 5.54 0.52 -1.26 -1.07 118.95 121.63 3h4f s ARG 187 Ca 0.78 -1.30 -0.17 0.00 -0.52 0.00 0.00 55.73 54.52 3h4f s ARG 187 Cb -0.31 -1.55 0.22 0.00 0.52 0.00 0.00 34.95 33.83 3h4f s ARG 187 CO 0.34 0.35 1.25 0.16 0.02 0.00 0.00 175.30 177.42 3h4f s ASP 188 N -2.20 2.51 0.25 0.23 1.47 0.33 -4.85 116.67 114.41 3h4f s ASP 188 Ca 0.12 0.40 0.22 0.00 1.18 0.00 0.00 52.55 54.47 3h4f s ASP 188 Cb -0.09 -0.52 0.98 0.00 -0.34 0.00 0.00 42.92 42.95 3h4f s ASP 188 CO 0.06 -3.12 1.67 -1.84 0.68 0.00 0.00 175.17 172.62 3h4f n GLU 189 N -4.05 0.17 0.00 2.11 0.28 -1.26 -0.65 120.64 117.24 3h4f n GLU 189 Ca 0.14 0.46 0.14 0.00 -0.16 0.00 0.00 57.16 57.74 3h4f n GLU 189 Cb 0.59 -1.86 0.59 0.00 1.43 0.00 0.00 31.44 32.19 3h4f n GLU 189 CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06 3h4f n ASN 190 N -2.19 0.77 0.00 -1.84 3.02 -1.26 -4.94 115.26 108.82 3h4f n ASN 190 Ca 0.01 -0.92 0.00 0.00 -0.03 0.00 0.00 54.58 53.64 3h4f n ASN 190 Cb 0.18 -0.01 0.00 0.00 -0.61 0.00 0.00 39.78 39.35 3h4f n ASN 190 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3h4f n GLY 191 N 1.23 0.62 3.77 7.41 0.00 0.18 -5.05 105.19 113.34 3h4f n GLY 191 Ca 0.16 -0.13 -0.38 0.00 0.00 0.00 0.00 46.02 45.67 3h4f n GLY 191 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3h4f s LYS 192 N -0.45 4.23 0.18 1.61 3.01 -1.26 -4.81 119.74 122.26 3h4f s LYS 192 Ca 0.00 0.61 -0.31 0.00 -1.01 0.00 0.00 55.97 55.27 3h4f s LYS 192 Cb 0.00 -3.33 -0.09 0.00 -1.01 0.00 0.00 37.83 33.40 3h4f s LYS 192 CO 0.00 0.42 1.40 0.71 0.51 0.00 0.00 175.35 178.39 3h4f s TYR 193 N -0.30 3.17 0.56 3.18 1.51 -1.26 -0.52 117.35 123.69 3h4f s TYR 193 Ca 0.28 1.02 -0.13 0.00 -1.01 0.00 0.00 57.07 57.23 3h4f s TYR 193 Cb -0.17 -3.72 -0.06 0.00 -0.11 0.00 0.00 41.96 37.90 3h4f s TYR 193 CO 0.15 -2.43 0.99 0.15 -1.11 0.00 0.00 175.55 173.31 3h4f s LYS 194 N 0.33 3.74 0.20 -0.62 1.02 -0.23 -4.86 119.74 119.31 3h4f s LYS 194 Ca 0.61 0.79 0.11 0.00 0.02 0.00 0.00 55.97 57.51 3h4f s LYS 194 Cb -0.39 -2.13 -0.04 0.00 -0.52 0.00 0.00 37.83 34.75 3h4f s LYS 194 CO 0.36 -0.41 -0.23 0.15 -0.92 0.00 0.00 175.35 174.30 3h4f s LYS 195 N -4.67 1.55 0.06 1.68 1.02 -1.26 -4.74 119.74 113.37 3h4f s LYS 195 Ca 0.56 -1.55 0.02 0.00 0.02 0.00 0.00 55.97 55.02 3h4f s LYS 195 Cb -0.11 -1.84 -0.03 0.00 -0.52 0.00 0.00 37.83 35.33 3h4f s LYS 195 CO 0.44 0.39 -0.07 0.71 -0.92 0.00 0.00 175.35 175.90 3h4f s TYR 196 N -1.76 0.72 -0.06 3.18 2.02 -1.26 -5.07 117.35 115.13 3h4f s TYR 196 Ca 0.22 -0.65 -0.26 0.00 -0.37 0.00 0.00 57.07 56.01 3h4f s TYR 196 Cb -0.08 -0.43 -0.21 0.00 -0.40 0.00 0.00 41.96 40.85 3h4f s TYR 196 CO 0.10 -0.12 1.05 0.93 -1.57 0.00 0.00 175.55 175.94 3h4f h GLU 197 N 3.97 -0.04 -5.97 -0.62 5.08 -2.01 -3.47 114.58 111.51 3h4f h GLU 197 Ca -0.35 0.00 -0.55 0.00 -1.00 0.00 0.00 59.36 57.46 3h4f h GLU 197 Cb 1.19 0.01 -0.15 0.00 0.50 0.00 0.00 28.75 30.30 3h4f h GLU 197 CO 0.49 0.57 -0.76 0.00 -1.00 0.00 0.00 179.01 178.32 3h4f s ALA 198 N -3.59 2.40 0.19 3.43 0.00 -1.26 -5.06 121.76 117.87 3h4f s ALA 198 Ca -0.16 -1.75 -0.14 0.00 0.00 0.00 0.00 51.96 49.91 3h4f s ALA 198 Cb 0.00 -0.19 0.18 0.00 0.00 0.00 0.00 23.12 23.11 3h4f s ALA 198 CO 0.64 0.21 1.67 -1.35 0.00 0.00 0.00 175.76 176.93 3h4f h PRO 199 N 2.52 0.08 0.00 0.00 0.11 -1.94 -2.72 132.00 130.05 3h4f h PRO 199 Ca -0.40 -0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.70 3h4f h PRO 199 Cb 1.24 -0.02 -0.00 0.00 0.11 0.00 0.00 31.00 32.33 3h4f h PRO 199 CO 0.59 0.05 -0.05 0.78 -0.21 0.00 0.00 178.00 179.16 3h4f h GLY 200 N 0.08 0.00 2.00 -0.55 0.00 -2.00 -2.30 103.07 100.31 3h4f h GLY 200 Ca 0.25 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.53 3h4f h GLY 200 CO -0.44 0.00 -0.23 -0.55 0.00 0.00 0.00 176.54 175.33 3h4f h ASP 201 N 0.00 0.00 0.92 0.19 3.45 -1.90 -2.84 116.42 116.23 3h4f h ASP 201 Ca -0.00 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.46 3h4f h ASP 201 Cb 0.16 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.93 3h4f h ASP 201 CO 0.01 0.23 -0.31 0.00 -1.57 0.00 0.00 179.24 177.60 3h4f n ALA 202 N -2.49 2.81 -0.05 3.45 0.00 -0.87 -4.57 120.51 118.80 3h4f n ALA 202 Ca -0.02 -0.19 -0.14 0.00 0.00 0.00 0.00 53.44 53.09 3h4f n ALA 202 Cb 0.28 -1.29 -0.08 0.00 0.00 0.00 0.00 19.45 18.36 3h4f n ALA 202 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.50 176.58 3h4f h TYR 203 N 0.00 -1.51 -0.31 0.00 5.03 -1.57 0.64 116.97 119.24 3h4f h TYR 203 Ca 0.00 0.06 -0.03 0.00 2.58 0.00 0.00 58.73 61.35 3h4f h TYR 203 Cb 0.61 0.69 -0.01 0.00 1.55 0.00 0.00 36.73 39.57 3h4f h TYR 203 CO 0.00 -0.51 0.10 1.49 -1.32 0.00 0.00 178.16 177.91 3h4f h GLU 204 N -0.50 0.49 -0.60 1.82 4.81 -1.81 -0.99 114.58 117.79 3h4f h GLU 204 Ca 0.06 -0.11 -0.03 0.00 -0.13 0.00 0.00 59.36 59.16 3h4f h GLU 204 Cb 0.65 -0.07 -0.03 0.00 0.63 0.00 0.00 28.75 29.93 3h4f h GLU 204 CO -0.48 0.53 0.26 -0.44 -0.73 0.00 0.00 179.01 178.16 3h4f h ASP 205 N 0.35 0.78 -0.14 1.04 3.45 -1.82 -2.46 116.42 117.62 3h4f h ASP 205 Ca 0.10 -0.09 -0.09 0.00 0.43 0.00 0.00 57.03 57.38 3h4f h ASP 205 Cb 0.25 -0.20 0.00 0.00 -0.56 0.00 0.00 39.33 38.82 3h4f h ASP 205 CO -0.00 0.69 -0.27 0.74 -1.57 0.00 0.00 179.24 178.82 3h4f h THR 206 N 0.86 1.36 -0.82 0.35 2.02 -0.45 -2.83 112.91 113.40 3h4f h THR 206 Ca 0.21 -1.53 0.09 0.00 0.77 0.00 0.00 66.41 65.95 3h4f h THR 206 Cb 0.13 2.00 -0.07 0.00 -1.74 0.00 0.00 68.15 68.47 3h4f h THR 206 CO -0.02 0.45 0.48 0.58 0.37 0.00 0.00 175.52 177.38 3h4f h VAL 207 N 0.04 0.93 -0.54 3.16 2.07 -1.14 0.21 116.25 120.98 3h4f h VAL 207 Ca 0.01 -0.28 0.05 0.00 0.82 0.00 0.00 66.70 67.30 3h4f h VAL 207 Cb 0.86 0.05 -0.05 0.00 -1.52 0.00 0.00 31.29 30.63 3h4f h VAL 207 CO 0.06 0.15 0.27 0.50 0.02 0.00 0.00 177.57 178.57 3h4f h LYS 208 N 0.81 0.50 -0.41 1.57 3.64 -1.38 -1.38 116.57 119.91 3h4f h LYS 208 Ca 0.39 -0.03 -0.04 0.00 -1.27 0.00 0.00 60.65 59.70 3h4f h LYS 208 Cb 0.33 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 32.02 3h4f h LYS 208 CO -0.23 0.33 0.10 0.28 -2.27 0.00 0.00 179.45 177.66 3h4f h VAL 209 N 0.52 1.23 -0.99 2.00 2.07 -1.05 -3.06 116.25 116.98 3h4f h VAL 209 Ca 0.24 -0.80 0.15 0.00 0.82 0.00 0.00 66.70 67.11 3h4f h VAL 209 Cb 0.16 0.96 -0.09 0.00 -1.52 0.00 0.00 31.29 30.81 3h4f h VAL 209 CO -0.17 0.28 0.62 0.24 0.02 0.00 0.00 177.57 178.55 3h4f h MET 210 N 0.53 0.83 0.00 1.57 2.86 -0.24 -2.55 114.93 117.93 3h4f h MET 210 Ca 0.13 -0.05 -0.00 0.00 -2.06 0.00 0.00 59.70 57.71 3h4f h MET 210 Cb 0.32 -0.19 -0.00 0.00 0.06 0.00 0.00 31.60 31.79 3h4f h MET 210 CO 0.00 0.55 -0.02 0.00 1.06 0.00 0.00 176.91 178.50 3h4f h ARG 211 N 0.85 0.00 0.00 1.72 3.08 -1.15 -1.22 114.38 117.66 3h4f h ARG 211 Ca 0.52 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.57 3h4f h ARG 211 Cb 0.69 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.74 3h4f h ARG 211 CO -0.29 0.02 0.00 0.25 -1.07 0.00 0.00 179.97 178.88 3h4f n THR 212 N -3.16 0.73 -1.85 2.04 -2.24 -0.96 -4.90 114.28 103.94 3h4f n THR 212 Ca -0.01 0.07 -0.20 0.00 -2.27 0.00 0.00 64.05 61.64 3h4f n THR 212 Cb 0.24 -0.95 -0.06 0.00 -2.10 0.00 0.00 70.33 67.46 3h4f n THR 212 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 3h4f n LEU 213 N -2.15 -1.61 -3.96 3.22 4.77 -0.46 -4.95 117.00 111.85 3h4f n LEU 213 Ca 0.03 0.34 -0.31 0.00 -0.03 0.00 0.00 56.01 56.05 3h4f n LEU 213 Cb 0.29 -2.83 -0.15 0.00 -2.33 0.00 0.00 43.42 38.40 3h4f n LEU 213 CO 0.23 -0.79 -0.36 -0.89 -1.33 0.00 0.00 177.39 174.24 3h4f s THR 214 N -2.82 1.88 0.57 -5.08 2.01 -1.26 -5.11 115.64 105.85 3h4f s THR 214 Ca 0.00 -1.89 -0.18 0.00 0.31 0.00 0.00 61.69 59.93 3h4f s THR 214 Cb 0.00 -2.30 -0.04 0.00 0.01 0.00 0.00 72.50 70.17 3h4f s THR 214 CO 0.00 -0.45 1.13 -2.16 -0.69 0.00 0.00 174.62 172.45 3h4f s PRO 215 N 1.14 3.19 0.21 4.92 0.04 -1.26 -4.89 135.00 138.35 3h4f s PRO 215 Ca 0.05 1.59 0.14 0.00 0.04 0.00 0.00 61.00 62.82 3h4f s PRO 215 Cb -0.19 -1.98 -0.02 0.00 0.04 0.00 0.00 34.50 32.35 3h4f s PRO 215 CO -0.10 -0.98 1.30 1.79 0.04 0.00 0.00 177.00 179.05 3h4f h THR 216 N 0.91 0.95 -3.21 1.26 1.35 -1.53 -3.46 112.91 109.16 3h4f h THR 216 Ca -0.49 -2.40 -0.18 0.00 -0.55 0.00 0.00 66.41 62.79 3h4f h THR 216 Cb 1.26 2.43 -0.27 0.00 -1.73 0.00 0.00 68.15 69.85 3h4f h THR 216 CO 0.56 0.54 -0.48 -1.00 -0.25 0.00 0.00 175.52 174.89 3h4f s HIS 217 N -2.91 -0.23 -0.23 4.73 3.76 -1.16 -4.90 115.29 114.35 3h4f s HIS 217 Ca 0.02 0.57 -0.01 0.00 -0.15 0.00 0.00 55.06 55.50 3h4f s HIS 217 Cb 0.08 0.07 0.07 0.00 1.11 0.00 0.00 32.58 33.91 3h4f s HIS 217 CO 0.77 -0.12 0.01 0.08 -0.85 0.00 0.00 174.74 174.62 3h4f s VAL 218 N 0.25 1.07 0.17 -0.90 1.01 -0.48 -1.45 120.40 120.07 3h4f s VAL 218 Ca -0.01 -1.03 0.08 0.00 0.00 0.00 0.00 61.98 61.02 3h4f s VAL 218 Cb -0.03 -1.51 -0.04 0.00 0.00 0.00 0.00 36.38 34.80 3h4f s VAL 218 CO -0.01 -0.24 -0.16 0.68 0.00 0.00 0.00 175.10 175.37 3h4f s VAL 219 N 1.59 1.70 -0.14 2.92 -7.23 0.06 -0.53 120.40 118.77 3h4f s VAL 219 Ca -0.01 -1.97 -0.07 0.00 -1.81 0.00 0.00 61.98 58.11 3h4f s VAL 219 Cb -0.18 -1.85 -0.04 0.00 0.56 0.00 0.00 36.38 34.87 3h4f s VAL 219 CO -0.10 -0.42 0.12 -0.36 -0.31 0.00 0.00 175.10 174.03 3h4f s PHE 220 N -2.35 3.50 -1.49 2.82 0.08 -1.26 -0.75 117.98 118.53 3h4f s PHE 220 Ca 0.16 0.43 -0.06 0.00 0.12 0.00 0.00 56.93 57.58 3h4f s PHE 220 Cb -0.04 -1.99 0.02 0.00 -0.57 0.00 0.00 43.02 40.44 3h4f s PHE 220 CO 0.06 0.57 0.60 -1.71 -0.10 0.00 0.00 175.22 174.64 3h4f n ASN 221 N 2.47 -5.58 0.00 1.36 4.05 -1.00 -3.20 115.26 113.36 3h4f n ASN 221 Ca -0.19 -0.32 0.00 0.00 0.45 0.00 0.00 54.58 54.53 3h4f n ASN 221 Cb 0.54 -4.52 0.00 0.00 1.23 0.00 0.00 39.78 37.03 3h4f n ASN 221 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 3h4f n GLY 222 N -1.46 1.43 3.51 8.20 0.00 -0.85 -4.79 105.19 111.24 3h4f n GLY 222 Ca -0.09 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.78 3h4f n GLY 222 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h4f s ALA 223 N -2.80 -1.76 0.12 4.61 0.00 -1.19 -4.66 121.76 116.08 3h4f s ALA 223 Ca 0.00 1.17 -0.34 0.00 0.00 0.00 0.00 51.96 52.79 3h4f s ALA 223 Cb 0.00 0.11 -0.13 0.00 0.00 0.00 0.00 23.12 23.09 3h4f s ALA 223 CO 0.00 -0.47 1.65 0.28 0.00 0.00 0.00 175.76 177.22 3h4f n VAL 224 N 0.52 0.11 -0.96 0.00 0.31 0.22 -2.25 118.33 116.29 3h4f n VAL 224 Ca -0.16 -0.02 0.00 0.00 -0.01 0.00 0.00 64.34 64.15 3h4f n VAL 224 Cb 0.59 -1.66 0.00 0.00 -0.91 0.00 0.00 33.84 31.86 3h4f n VAL 224 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3h4f n GLY 225 N 3.66 0.58 0.31 2.92 0.00 -1.26 -4.83 105.19 106.57 3h4f n GLY 225 Ca 0.18 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.34 3h4f n GLY 225 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h4f h ALA 226 N 0.00 2.10 -0.58 4.61 0.00 -1.65 -2.42 119.26 121.33 3h4f h ALA 226 Ca 0.00 -0.01 -0.40 0.00 0.00 0.00 0.00 54.91 54.50 3h4f h ALA 226 Cb 0.11 0.02 -0.28 0.00 0.00 0.00 0.00 17.79 17.64 3h4f h ALA 226 CO 0.00 -0.26 -0.42 1.28 0.00 0.00 0.00 179.25 179.85 3h4f n LEU 227 N -4.33 4.74 -4.51 0.00 4.77 -1.26 -4.76 117.00 111.65 3h4f n LEU 227 Ca 0.02 -4.37 -0.25 0.00 -0.03 0.00 0.00 56.01 51.38 3h4f n LEU 227 Cb 0.29 -0.51 -0.09 0.00 -2.33 0.00 0.00 43.42 40.79 3h4f n LEU 227 CO 0.34 1.76 -0.23 0.42 -1.33 0.00 0.00 177.39 178.34 3h4f s THR 228 N -4.14 0.93 0.00 -5.08 -4.23 -0.91 -0.68 115.64 101.52 3h4f s THR 228 Ca 0.49 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 59.00 3h4f s THR 228 Cb 0.42 -2.53 0.00 0.00 1.34 0.00 0.00 72.50 71.73 3h4f s THR 228 CO 0.01 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.70 3h4f n GLY 229 N -0.85 3.85 0.00 3.99 0.00 -1.26 -1.01 105.19 109.90 3h4f n GLY 229 Ca -0.06 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.11 3h4f n GLY 229 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3h4f n ASP 230 N 7.95 0.00 -0.39 1.61 10.43 -1.26 -2.63 116.55 132.26 3h4f n ASP 230 Ca 0.00 -1.04 0.08 0.00 2.57 0.00 0.00 54.79 56.40 3h4f n ASP 230 Cb 0.00 0.00 0.17 0.00 1.84 0.00 0.00 41.12 43.13 3h4f n ASP 230 CO 0.00 0.00 0.00 0.29 -1.07 0.00 0.00 177.20 176.42 3h4f n LYS 231 N -0.97 2.15 -1.73 -1.24 5.02 -0.18 -5.02 118.16 116.19 3h4f n LYS 231 Ca 0.22 -2.52 -0.41 0.00 -2.02 0.00 0.00 58.31 53.58 3h4f n LYS 231 Cb 0.10 -1.55 0.01 0.00 -0.02 0.00 0.00 35.03 33.57 3h4f n LYS 231 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3h4f n ALA 232 N -0.88 1.61 -1.42 7.82 0.00 -1.08 -3.88 120.51 122.69 3h4f n ALA 232 Ca 0.16 0.27 -0.31 0.00 0.00 0.00 0.00 53.44 53.55 3h4f n ALA 232 Cb 0.67 -2.32 0.07 0.00 0.00 0.00 0.00 19.45 17.87 3h4f n ALA 232 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 3h4f s MET 233 N -2.27 2.59 0.14 0.00 -1.94 -0.23 -4.80 119.30 112.79 3h4f s MET 233 Ca 0.60 1.06 0.07 0.00 -1.71 0.00 0.00 55.69 55.71 3h4f s MET 233 Cb -0.49 -1.94 -0.04 0.00 2.01 0.00 0.00 34.83 34.37 3h4f s MET 233 CO 0.58 -1.37 -0.15 0.95 -0.01 0.00 0.00 175.02 175.02 3h4f s THR 234 N -2.98 1.51 0.31 2.05 -4.23 -1.26 -0.35 115.64 110.70 3h4f s THR 234 Ca 0.60 -1.82 -0.18 0.00 -1.18 0.00 0.00 61.69 59.10 3h4f s THR 234 Cb -0.16 -1.67 0.03 0.00 1.34 0.00 0.00 72.50 72.04 3h4f s THR 234 CO 0.56 -0.40 0.72 0.00 -0.54 0.00 0.00 174.62 174.96 3h4f s ALA 235 N -2.18 -0.97 0.09 3.99 0.00 -0.81 -4.92 121.76 116.96 3h4f s ALA 235 Ca 0.12 -0.51 0.08 0.00 0.00 0.00 0.00 51.96 51.65 3h4f s ALA 235 Cb -0.05 0.81 -0.03 0.00 0.00 0.00 0.00 23.12 23.85 3h4f s ALA 235 CO 0.04 -1.01 -0.20 0.00 0.00 0.00 0.00 175.76 174.60 3h4f s ALA 236 N -3.39 1.72 0.15 0.00 0.00 -1.26 -1.30 121.76 117.67 3h4f s ALA 236 Ca 0.13 -1.18 -0.34 0.00 0.00 0.00 0.00 51.96 50.57 3h4f s ALA 236 Cb -0.05 -0.24 -0.16 0.00 0.00 0.00 0.00 23.12 22.67 3h4f s ALA 236 CO 0.09 0.34 1.29 0.28 0.00 0.00 0.00 175.76 177.76 3h4f n VAL 237 N 1.23 0.53 0.00 0.00 0.31 0.80 -1.15 118.33 120.04 3h4f n VAL 237 Ca -0.19 -0.13 0.00 0.00 -0.01 0.00 0.00 64.34 64.01 3h4f n VAL 237 Cb 0.54 -0.97 0.00 0.00 -0.91 0.00 0.00 33.84 32.50 3h4f n VAL 237 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3h4f n GLY 238 N 2.32 2.04 3.76 2.92 0.00 0.98 -4.97 105.19 112.24 3h4f n GLY 238 Ca 0.16 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.78 3h4f n GLY 238 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3h4f s GLU 239 N -0.55 4.62 -0.24 1.61 2.02 -0.30 -4.84 118.70 121.02 3h4f s GLU 239 Ca 0.00 1.67 -0.09 0.00 0.02 0.00 0.00 54.97 56.58 3h4f s GLU 239 Cb 0.00 -3.10 -0.04 0.00 0.10 0.00 0.00 34.13 31.09 3h4f s GLU 239 CO 0.00 0.24 0.11 0.15 0.02 0.00 0.00 175.26 175.78 3h4f s LYS 240 N -1.56 3.85 -0.09 1.61 1.02 -1.26 -2.08 119.74 121.24 3h4f s LYS 240 Ca 0.46 -0.38 0.04 0.00 0.02 0.00 0.00 55.97 56.11 3h4f s LYS 240 Cb -0.29 -3.42 -0.00 0.00 -0.52 0.00 0.00 37.83 33.61 3h4f s LYS 240 CO 0.36 -0.06 -0.23 0.08 -0.92 0.00 0.00 175.35 174.59 3h4f s VAL 241 N 1.31 1.97 -0.16 3.17 1.01 0.31 0.59 120.40 128.60 3h4f s VAL 241 Ca 0.06 -0.98 -0.15 0.00 0.00 0.00 0.00 61.98 60.90 3h4f s VAL 241 Cb -0.15 -1.70 -0.04 0.00 0.00 0.00 0.00 36.38 34.49 3h4f s VAL 241 CO 0.05 0.54 0.36 -0.22 0.00 0.00 0.00 175.10 175.83 3h4f s LEU 242 N 0.24 4.23 -0.32 3.92 2.96 -0.36 -1.25 118.68 128.10 3h4f s LEU 242 Ca -0.15 0.58 -0.03 0.00 -0.22 0.00 0.00 54.13 54.32 3h4f s LEU 242 Cb -0.17 -2.48 0.06 0.00 0.50 0.00 0.00 46.19 44.10 3h4f s LEU 242 CO 0.07 0.03 0.04 -0.63 -1.32 0.00 0.00 176.35 174.55 3h4f s ILE 243 N 0.71 3.15 0.07 6.68 1.01 0.13 -1.37 121.20 131.59 3h4f s ILE 243 Ca 0.19 -1.44 -0.21 0.00 0.00 0.00 0.00 60.65 59.19 3h4f s ILE 243 Cb -0.14 -2.86 -0.06 0.00 0.01 0.00 0.00 42.46 39.41 3h4f s ILE 243 CO 0.06 -0.20 0.64 -0.69 0.00 0.00 0.00 174.94 174.75 3h4f s VAL 244 N 1.26 4.70 -0.02 2.92 1.01 -0.25 -0.99 120.40 129.03 3h4f s VAL 244 Ca -0.03 1.37 0.00 0.00 0.00 0.00 0.00 61.98 63.33 3h4f s VAL 244 Cb -0.20 -3.98 0.02 0.00 0.00 0.00 0.00 36.38 32.22 3h4f s VAL 244 CO -0.01 0.49 0.02 -2.28 0.00 0.00 0.00 175.10 173.32 3h4f s HIS 245 N -0.78 0.08 0.10 5.22 2.46 -0.49 -0.36 115.29 121.52 3h4f s HIS 245 Ca 0.32 0.08 0.05 0.00 0.47 0.00 0.00 55.06 55.98 3h4f s HIS 245 Cb -0.20 -0.22 -0.03 0.00 -0.13 0.00 0.00 32.58 31.99 3h4f s HIS 245 CO 0.21 -0.08 -0.13 -1.54 -2.47 0.00 0.00 174.74 170.73 3h4f s SER 246 N 0.84 1.72 -0.21 9.88 1.04 -0.89 -0.71 113.70 125.37 3h4f s SER 246 Ca -0.07 -0.73 -0.04 0.00 0.48 0.00 0.00 55.95 55.59 3h4f s SER 246 Cb -0.10 -0.04 0.10 0.00 0.10 0.00 0.00 66.02 66.08 3h4f s SER 246 CO -0.02 -0.15 0.27 -1.58 0.98 0.00 0.00 173.24 172.74 3h4f s GLN 247 N -2.33 0.24 0.24 4.02 -0.44 -0.81 -0.85 119.66 119.72 3h4f s GLN 247 Ca 0.04 0.33 0.25 0.00 -2.50 0.00 0.00 55.36 53.48 3h4f s GLN 247 Cb -0.06 -0.94 0.65 0.00 -1.64 0.00 0.00 33.01 31.01 3h4f s GLN 247 CO 0.02 -0.64 1.67 0.00 0.50 0.00 0.00 175.29 176.84 3h4f h ALA 248 N 8.27 0.94 0.00 1.58 0.00 -1.81 0.32 119.26 128.56 3h4f h ALA 248 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.73 3h4f h ALA 248 Cb 1.15 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.94 3h4f h ALA 248 CO 0.27 0.00 -0.58 -1.71 0.00 0.00 0.00 179.25 177.23 3h4f n ASN 249 N -2.40 2.91 -3.74 0.00 5.15 -1.26 -2.90 115.26 113.01 3h4f n ASN 249 Ca 0.05 0.00 -0.13 0.00 -0.60 0.00 0.00 54.58 53.90 3h4f n ASN 249 Cb 0.45 0.51 -0.10 0.00 -0.53 0.00 0.00 39.78 40.11 3h4f n ASN 249 CO 0.00 0.00 0.00 -0.60 1.40 0.00 0.00 177.26 178.06 3h4f s ARG 250 N -1.27 0.50 0.56 1.20 3.52 -1.26 -4.63 118.95 117.57 3h4f s ARG 250 Ca 0.00 0.37 -0.20 0.00 -0.13 0.00 0.00 55.73 55.77 3h4f s ARG 250 Cb 0.00 0.24 -0.05 0.00 -1.56 0.00 0.00 34.95 33.57 3h4f s ARG 250 CO 0.00 -0.08 1.10 -0.25 -0.81 0.00 0.00 175.30 175.26 3h4f n ASP 251 N 2.51 1.47 -4.16 -2.12 10.43 -1.26 -3.61 116.55 119.80 3h4f n ASP 251 Ca -0.15 0.89 -0.11 0.00 2.57 0.00 0.00 54.79 57.99 3h4f n ASP 251 Cb 0.57 -1.45 -0.10 0.00 1.84 0.00 0.00 41.12 41.99 3h4f n ASP 251 CO 0.00 0.00 0.00 0.28 -1.07 0.00 0.00 177.20 176.41 3h4f s THR 252 N -1.41 0.05 -0.41 -3.53 -1.32 -0.33 -4.84 115.64 103.85 3h4f s THR 252 Ca 0.73 -1.93 0.04 0.00 -1.21 0.00 0.00 61.69 59.33 3h4f s THR 252 Cb -0.44 -2.25 0.18 0.00 -1.51 0.00 0.00 72.50 68.48 3h4f s THR 252 CO 0.49 -0.23 0.36 -2.11 -2.21 0.00 0.00 174.62 170.92 3h4f n ARG 253 N -0.19 0.26 -1.85 7.08 1.85 -1.26 -1.45 116.66 121.10 3h4f n ARG 253 Ca -0.02 -3.19 -0.40 0.00 -1.00 0.00 0.00 57.85 53.24 3h4f n ARG 253 Cb 0.65 -1.62 0.01 0.00 -1.05 0.00 0.00 32.46 30.44 3h4f n ARG 253 CO 0.00 0.00 0.00 -2.14 -0.01 0.00 0.00 177.63 175.48 3h4f s PRO 254 N -0.10 3.88 -0.08 2.89 0.02 -1.13 -0.85 135.00 139.64 3h4f s PRO 254 Ca 0.33 2.41 -0.03 0.00 0.02 0.00 0.00 61.00 63.73 3h4f s PRO 254 Cb 0.06 -2.78 0.04 0.00 0.02 0.00 0.00 34.50 31.84 3h4f s PRO 254 CO -0.19 -0.66 0.17 -1.58 -0.33 0.00 0.00 177.00 174.42 3h4f s HIS 255 N -1.18 -0.21 -0.63 6.54 2.46 0.14 -2.04 115.29 120.37 3h4f s HIS 255 Ca 0.57 0.58 -0.21 0.00 0.47 0.00 0.00 55.06 56.48 3h4f s HIS 255 Cb -0.43 -0.09 0.09 0.00 -0.13 0.00 0.00 32.58 32.02 3h4f s HIS 255 CO 0.57 -0.20 0.83 -1.17 -2.47 0.00 0.00 174.74 172.30 3h4f s LEU 256 N 1.44 4.93 -0.18 8.88 2.96 -1.26 -0.57 118.68 134.88 3h4f s LEU 256 Ca -0.07 -1.25 -0.29 0.00 -0.22 0.00 0.00 54.13 52.30 3h4f s LEU 256 Cb -0.11 -2.36 -0.04 0.00 0.50 0.00 0.00 46.19 44.18 3h4f s LEU 256 CO -0.06 -1.26 1.78 -0.63 -1.32 0.00 0.00 176.35 174.85 3h4f s ILE 257 N 3.31 3.47 0.00 6.68 1.01 0.19 -1.05 121.20 134.80 3h4f s ILE 257 Ca 0.17 0.53 0.00 0.00 0.00 0.00 0.00 60.65 61.35 3h4f s ILE 257 Cb -0.20 -3.48 0.00 0.00 0.01 0.00 0.00 42.46 38.79 3h4f s ILE 257 CO 0.08 -0.20 0.00 0.61 0.00 0.00 0.00 174.94 175.43 3h4f n GLY 258 N 4.83 1.56 0.00 6.18 0.00 -1.26 -3.29 105.19 113.22 3h4f n GLY 258 Ca 0.21 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.23 3h4f n GLY 258 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3h4f n GLY 259 N -1.94 6.82 3.40 -0.02 0.00 -0.22 -4.99 105.19 108.25 3h4f n GLY 259 Ca 0.00 -1.79 -0.13 0.00 0.00 0.00 0.00 46.02 44.10 3h4f n GLY 259 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3h4f s HIS 260 N 0.23 0.97 -0.56 1.61 0.09 -1.26 -4.73 115.29 111.64 3h4f s HIS 260 Ca 0.00 -1.20 -0.13 0.00 -0.00 0.00 0.00 55.06 53.74 3h4f s HIS 260 Cb 0.00 -0.23 0.14 0.00 -0.00 0.00 0.00 32.58 32.49 3h4f s HIS 260 CO 0.00 -0.90 0.48 0.20 -0.00 0.00 0.00 174.74 174.52 3h4f s GLY 261 N -3.16 2.17 0.12 -2.22 0.00 -0.44 -4.72 107.32 99.07 3h4f s GLY 261 Ca 0.32 -2.69 -0.20 0.00 0.00 0.00 0.00 44.72 42.15 3h4f s GLY 261 CO 0.15 1.17 1.75 -0.55 0.00 0.00 0.00 173.10 175.62 3h4f h ASP 262 N 8.49 0.06 -3.28 1.64 3.32 -1.48 -0.30 116.42 124.87 3h4f h ASP 262 Ca -0.20 0.02 -0.56 0.00 0.02 0.00 0.00 57.03 56.31 3h4f h ASP 262 Cb 1.07 0.01 -0.35 0.00 0.22 0.00 0.00 39.33 40.29 3h4f h ASP 262 CO 0.92 0.06 -0.82 -0.31 -1.72 0.00 0.00 179.24 177.36 3h4f s TYR 263 N -6.18 1.77 -0.16 4.55 1.51 -0.94 -2.09 117.35 115.81 3h4f s TYR 263 Ca -0.13 -0.82 0.00 0.00 -1.01 0.00 0.00 57.07 55.11 3h4f s TYR 263 Cb 0.09 -1.31 0.03 0.00 -0.11 0.00 0.00 41.96 40.65 3h4f s TYR 263 CO 0.68 -0.45 -0.10 0.08 -1.11 0.00 0.00 175.55 174.66 3h4f s VAL 264 N 1.07 1.37 -1.18 0.71 1.01 0.99 0.10 120.40 124.46 3h4f s VAL 264 Ca -0.06 -0.67 -0.16 0.00 0.00 0.00 0.00 61.98 61.09 3h4f s VAL 264 Cb -0.15 -1.42 0.13 0.00 0.00 0.00 0.00 36.38 34.95 3h4f s VAL 264 CO -0.02 0.28 1.48 0.26 0.00 0.00 0.00 175.10 177.10 3h4f s TRP 265 N 1.54 3.20 0.36 5.22 0.51 -0.24 0.00 118.94 129.52 3h4f s TRP 265 Ca 0.02 -1.82 0.03 0.00 -2.12 0.00 0.00 56.10 52.21 3h4f s TRP 265 Cb -0.14 -4.45 0.67 0.00 -0.81 0.00 0.00 33.47 28.73 3h4f s TRP 265 CO -0.09 -1.55 2.02 0.00 -0.51 0.00 0.00 176.95 176.82 3h4f h ALA 266 N 7.66 1.57 0.00 0.98 0.00 -1.89 0.28 119.26 127.87 3h4f h ALA 266 Ca 0.32 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.19 3h4f h ALA 266 Cb 0.90 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.45 3h4f h ALA 266 CO 1.30 0.40 0.00 0.25 0.00 0.00 0.00 179.25 181.19 3h4f n THR 267 N -4.45 0.06 -0.98 0.00 -2.24 -1.26 -4.45 114.28 100.97 3h4f n THR 267 Ca 0.06 0.02 0.00 0.00 -2.27 0.00 0.00 64.05 61.86 3h4f n THR 267 Cb 0.04 -0.53 0.00 0.00 -2.10 0.00 0.00 70.33 67.74 3h4f n THR 267 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3h4f n GLY 268 N 1.38 0.73 3.43 3.38 0.00 0.05 -4.75 105.19 109.41 3h4f n GLY 268 Ca 0.07 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.74 3h4f n GLY 268 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3h4f s LYS 269 N -0.11 3.61 0.44 1.61 -0.14 -1.26 -0.54 119.74 123.35 3h4f s LYS 269 Ca 0.00 -0.52 0.25 0.00 -1.36 0.00 0.00 55.97 54.34 3h4f s LYS 269 Cb 0.00 -3.14 0.73 0.00 -1.68 0.00 0.00 37.83 33.74 3h4f s LYS 269 CO 0.00 -0.06 1.74 0.74 -0.76 0.00 0.00 175.35 177.01 3h4f h PHE 270 N 7.75 0.00 0.00 3.18 0.05 -1.84 -2.28 116.94 123.80 3h4f h PHE 270 Ca -0.37 0.00 0.00 0.00 3.82 0.00 0.00 57.97 61.42 3h4f h PHE 270 Cb 1.17 0.00 0.00 0.00 2.00 0.00 0.00 35.95 39.12 3h4f h PHE 270 CO 0.61 0.15 0.00 0.09 -0.18 0.00 0.00 178.31 178.98 3h4f n ASN 271 N -3.21 0.16 -4.63 2.17 3.02 -1.26 -4.59 115.26 106.92 3h4f n ASN 271 Ca 0.02 0.52 -0.39 0.00 -0.03 0.00 0.00 54.58 54.70 3h4f n ASN 271 Cb 0.48 -0.56 -0.08 0.00 -0.61 0.00 0.00 39.78 39.00 3h4f n ASN 271 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 3h4f s THR 272 N -3.03 5.16 0.41 3.41 2.01 -0.86 -5.05 115.64 117.70 3h4f s THR 272 Ca 0.12 0.68 -0.27 0.00 0.31 0.00 0.00 61.69 62.54 3h4f s THR 272 Cb 0.17 -3.73 -0.10 0.00 0.01 0.00 0.00 72.50 68.85 3h4f s THR 272 CO 0.51 0.18 1.44 -2.65 -0.69 0.00 0.00 174.62 173.41 3h4f n PRO 273 N 5.05 2.40 -2.36 4.92 -0.02 -1.26 -4.84 135.00 138.89 3h4f n PRO 273 Ca -0.08 0.85 -0.37 0.00 -2.02 0.00 0.00 63.50 61.88 3h4f n PRO 273 Cb 0.51 -2.62 -0.02 0.00 -0.02 0.00 0.00 33.50 31.35 3h4f n PRO 273 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 3h4f s PRO 274 N -2.27 3.96 0.70 0.52 0.04 -1.26 -4.92 135.00 131.78 3h4f s PRO 274 Ca 0.58 1.70 -0.13 0.00 0.04 0.00 0.00 61.00 63.19 3h4f s PRO 274 Cb -0.47 -2.52 0.02 0.00 0.04 0.00 0.00 34.50 31.57 3h4f s PRO 274 CO 0.60 -0.36 1.09 -0.51 0.04 0.00 0.00 177.00 177.87 3h4f s ASP 275 N -1.37 4.96 0.19 6.66 1.01 0.10 -4.76 116.67 123.46 3h4f s ASP 275 Ca 0.60 1.87 0.08 0.00 0.71 0.00 0.00 52.55 55.81 3h4f s ASP 275 Cb -0.27 -2.53 -0.05 0.00 1.01 0.00 0.00 42.92 41.08 3h4f s ASP 275 CO 0.33 -1.73 -0.15 0.68 0.21 0.00 0.00 175.17 174.51 3h4f s VAL 276 N -2.65 1.74 -1.55 -1.27 -7.23 -1.26 -0.01 120.40 108.17 3h4f s VAL 276 Ca 0.63 -2.12 -0.02 0.00 -1.81 0.00 0.00 61.98 58.65 3h4f s VAL 276 Cb -0.18 -1.97 0.01 0.00 0.56 0.00 0.00 36.38 34.80 3h4f s VAL 276 CO 0.48 -0.53 0.26 0.47 -0.31 0.00 0.00 175.10 175.48 3h4f n ASP 277 N -0.19 -5.47 -4.74 4.85 10.43 -0.89 -4.91 116.55 115.63 3h4f n ASP 277 Ca -0.09 -0.11 -0.41 0.00 2.57 0.00 0.00 54.79 56.74 3h4f n ASP 277 Cb 0.59 -4.51 -0.03 0.00 1.84 0.00 0.00 41.12 39.01 3h4f n ASP 277 CO 0.00 0.00 0.00 -1.10 -1.07 0.00 0.00 177.20 175.03 3h4f s GLN 278 N -5.36 4.47 -0.16 -1.24 -1.52 -0.13 -4.85 119.66 110.85 3h4f s GLN 278 Ca 0.14 1.94 -0.20 0.00 -1.95 0.00 0.00 55.36 55.29 3h4f s GLN 278 Cb -0.07 -3.22 -0.17 0.00 -0.22 0.00 0.00 33.01 29.33 3h4f s GLN 278 CO 0.18 -0.12 0.34 1.05 -0.25 0.00 0.00 175.29 176.49 3h4f h GLU 279 N 5.08 0.00 -3.40 2.91 4.11 -1.91 -1.16 114.58 120.22 3h4f h GLU 279 Ca -0.45 0.00 -0.29 0.00 0.07 0.00 0.00 59.36 58.69 3h4f h GLU 279 Cb 1.21 0.00 -0.34 0.00 0.50 0.00 0.00 28.75 30.12 3h4f h GLU 279 CO 0.74 0.76 -0.69 0.99 0.07 0.00 0.00 179.01 180.88 3h4f s THR 280 N -2.20 -0.07 0.48 -1.06 2.01 -1.26 -4.41 115.64 109.12 3h4f s THR 280 Ca -0.20 0.24 0.07 0.00 0.31 0.00 0.00 61.69 62.11 3h4f s THR 280 Cb 0.02 -0.14 0.01 0.00 0.01 0.00 0.00 72.50 72.39 3h4f s THR 280 CO 0.51 0.10 0.42 -1.66 -0.69 0.00 0.00 174.62 173.30 3h4f s TRP 281 N 1.30 2.20 -0.05 4.92 -2.14 -0.87 -4.99 118.94 119.31 3h4f s TRP 281 Ca -0.07 -0.64 0.01 0.00 2.66 0.00 0.00 56.10 58.06 3h4f s TRP 281 Cb -0.12 -2.08 0.02 0.00 -3.10 0.00 0.00 33.47 28.19 3h4f s TRP 281 CO -0.04 -0.33 -0.06 0.12 -2.66 0.00 0.00 176.95 173.98 3h4f s PHE 282 N -2.60 0.97 -0.19 1.66 5.36 -1.26 -2.83 117.98 119.08 3h4f s PHE 282 Ca 0.44 -0.32 0.01 0.00 -0.96 0.00 0.00 56.93 56.10 3h4f s PHE 282 Cb -0.03 -0.81 0.03 0.00 -0.34 0.00 0.00 43.02 41.88 3h4f s PHE 282 CO 0.26 -0.24 -0.15 0.42 -1.46 0.00 0.00 175.22 174.06 3h4f s ILE 283 N 0.94 1.85 0.59 3.12 1.01 -0.53 -4.72 121.20 123.45 3h4f s ILE 283 Ca -0.10 -0.96 -0.17 0.00 0.00 0.00 0.00 60.65 59.42 3h4f s ILE 283 Cb -0.15 -1.77 -0.04 0.00 0.01 0.00 0.00 42.46 40.51 3h4f s ILE 283 CO 0.00 0.36 1.08 -2.16 0.00 0.00 0.00 174.94 174.23 3h4f s PRO 284 N 1.34 3.26 0.11 2.79 0.04 -1.26 -1.19 135.00 140.09 3h4f s PRO 284 Ca 0.02 1.34 -0.36 0.00 0.04 0.00 0.00 61.00 62.04 3h4f s PRO 284 Cb -0.15 -2.02 -0.16 0.00 0.04 0.00 0.00 34.50 32.22 3h4f s PRO 284 CO -0.10 -0.87 1.44 0.41 0.04 0.00 0.00 177.00 177.91 3h4f n GLY 285 N -0.58 0.74 0.61 0.56 0.00 -1.24 -2.50 105.19 102.77 3h4f n GLY 285 Ca 0.10 0.69 0.00 0.00 0.00 0.00 0.00 46.02 46.80 3h4f n GLY 285 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3h4f n GLY 286 N 2.90 0.82 3.28 -0.02 0.00 0.11 -4.71 105.19 107.57 3h4f n GLY 286 Ca 0.18 -0.33 -0.09 0.00 0.00 0.00 0.00 46.02 45.77 3h4f n GLY 286 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h4f s ALA 287 N -2.00 0.10 0.17 4.61 0.00 -0.99 -4.77 121.76 118.88 3h4f s ALA 287 Ca 0.00 -0.93 0.08 0.00 0.00 0.00 0.00 51.96 51.11 3h4f s ALA 287 Cb 0.00 0.78 -0.04 0.00 0.00 0.00 0.00 23.12 23.86 3h4f s ALA 287 CO 0.00 -0.59 -0.07 0.00 0.00 0.00 0.00 175.76 175.10 3h4f s ALA 288 N -3.96 3.02 0.25 0.00 0.00 -1.26 -1.93 121.76 117.88 3h4f s ALA 288 Ca 0.16 -1.42 0.02 0.00 0.00 0.00 0.00 51.96 50.71 3h4f s ALA 288 Cb 0.04 -0.82 -0.05 0.00 0.00 0.00 0.00 23.12 22.29 3h4f s ALA 288 CO -0.02 0.48 0.08 0.20 0.00 0.00 0.00 175.76 176.50 3h4f s GLY 289 N -2.82 1.67 -0.05 0.00 0.00 0.11 -3.04 107.32 103.19 3h4f s GLY 289 Ca 0.25 -1.84 -0.04 0.00 0.00 0.00 0.00 44.72 43.10 3h4f s GLY 289 CO 0.16 -1.60 0.13 0.00 0.00 0.00 0.00 173.10 171.79 3h4f s ALA 290 N -3.70 -0.28 -0.01 3.20 0.00 -0.94 -1.40 121.76 118.62 3h4f s ALA 290 Ca 0.35 0.47 0.07 0.00 0.00 0.00 0.00 51.96 52.85 3h4f s ALA 290 Cb 0.08 -0.30 -0.02 0.00 0.00 0.00 0.00 23.12 22.88 3h4f s ALA 290 CO 0.12 -0.10 -0.22 0.00 0.00 0.00 0.00 175.76 175.57 3h4f s ALA 291 N 0.51 1.81 -0.16 0.00 0.00 -0.16 -1.08 121.76 122.68 3h4f s ALA 291 Ca -0.04 -0.94 -0.01 0.00 0.00 0.00 0.00 51.96 50.97 3h4f s ALA 291 Cb -0.05 -0.46 -0.01 0.00 0.00 0.00 0.00 23.12 22.60 3h4f s ALA 291 CO -0.02 0.44 -0.12 0.12 0.00 0.00 0.00 175.76 176.18 3h4f s PHE 292 N -0.52 2.84 -0.00 0.00 2.19 0.11 0.21 117.98 122.82 3h4f s PHE 292 Ca 0.08 -0.83 0.00 0.00 0.33 0.00 0.00 56.93 56.52 3h4f s PHE 292 Cb -0.08 -1.92 0.00 0.00 -1.31 0.00 0.00 43.02 39.71 3h4f s PHE 292 CO -0.01 -0.36 -0.00 -0.47 1.83 0.00 0.00 175.22 176.21 3h4f s TYR 293 N 0.74 0.05 -0.34 10.12 5.04 -0.38 -1.28 117.35 131.30 3h4f s TYR 293 Ca -0.05 0.01 -0.12 0.00 -2.44 0.00 0.00 57.07 54.47 3h4f s TYR 293 Cb -0.15 -0.07 -0.00 0.00 0.35 0.00 0.00 41.96 42.09 3h4f s TYR 293 CO 0.01 -0.02 0.21 0.99 -1.34 0.00 0.00 175.55 175.41 3h4f s THR 294 N 0.16 4.96 0.21 4.34 2.01 -1.26 -0.53 115.64 125.53 3h4f s THR 294 Ca -0.01 -0.42 -0.30 0.00 0.31 0.00 0.00 61.69 61.26 3h4f s THR 294 Cb -0.02 -3.59 -0.09 0.00 0.01 0.00 0.00 72.50 68.80 3h4f s THR 294 CO -0.00 -0.05 1.41 -0.36 -0.69 0.00 0.00 174.62 174.93 3h4f s PHE 295 N 1.66 3.12 -0.04 4.92 0.40 -0.88 -4.89 117.98 122.26 3h4f s PHE 295 Ca 0.05 1.04 0.01 0.00 -0.60 0.00 0.00 56.93 57.43 3h4f s PHE 295 Cb -0.18 -3.75 -0.01 0.00 0.51 0.00 0.00 43.02 39.59 3h4f s PHE 295 CO 0.08 -2.48 0.04 1.04 0.70 0.00 0.00 175.22 174.60 3h4f n GLN 296 N 2.73 5.44 -4.17 0.44 1.13 -1.26 -0.02 117.38 121.68 3h4f n GLN 296 Ca 0.08 -0.00 -0.16 0.00 -1.94 0.00 0.00 57.00 54.98 3h4f n GLN 296 Cb 0.41 -0.63 -0.14 0.00 0.11 0.00 0.00 30.24 29.99 3h4f n GLN 296 CO 0.00 0.00 0.00 -0.65 -1.44 0.00 0.00 177.06 174.97 3h4f s GLN 297 N -1.27 0.48 0.86 -1.09 -1.52 -1.26 -4.61 119.66 111.25 3h4f s GLN 297 Ca 0.00 -0.30 -0.12 0.00 -1.95 0.00 0.00 55.36 52.99 3h4f s GLN 297 Cb 0.01 -0.43 0.11 0.00 -0.22 0.00 0.00 33.01 32.48 3h4f s GLN 297 CO 0.04 0.11 1.16 -1.25 -0.25 0.00 0.00 175.29 175.10 3h4f s PRO 298 N -0.37 1.53 0.00 2.91 0.04 -1.26 -4.77 135.00 133.08 3h4f s PRO 298 Ca 0.00 0.21 0.00 0.00 0.04 0.00 0.00 61.00 61.25 3h4f s PRO 298 Cb -0.03 -1.89 0.00 0.00 0.04 0.00 0.00 34.50 32.61 3h4f s PRO 298 CO -0.00 -1.91 0.00 0.41 0.04 0.00 0.00 177.00 175.53 3h4f n GLY 299 N -2.73 -0.67 3.76 0.56 0.00 0.57 -4.93 105.19 101.75 3h4f n GLY 299 Ca 0.07 -2.22 -0.39 0.00 0.00 0.00 0.00 46.02 43.48 3h4f n GLY 299 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 3h4f s ILE 300 N -0.18 4.78 0.15 -0.61 2.07 -1.26 -1.28 121.20 124.87 3h4f s ILE 300 Ca 0.00 1.45 0.09 0.00 -1.41 0.00 0.00 60.65 60.78 3h4f s ILE 300 Cb 0.00 -4.03 -0.04 0.00 0.13 0.00 0.00 42.46 38.52 3h4f s ILE 300 CO 0.00 0.41 -0.16 -0.31 -1.91 0.00 0.00 174.94 172.97 3h4f s TYR 301 N -0.24 2.54 -0.18 3.50 1.51 0.32 -4.97 117.35 119.83 3h4f s TYR 301 Ca 0.35 -0.26 -0.03 0.00 -1.01 0.00 0.00 57.07 56.11 3h4f s TYR 301 Cb -0.20 -1.30 -0.02 0.00 -0.11 0.00 0.00 41.96 40.33 3h4f s TYR 301 CO 0.20 0.44 -0.06 0.00 -1.11 0.00 0.00 175.55 175.03 3h4f s ALA 302 N -1.38 2.84 -0.25 3.71 0.00 -1.21 -1.47 121.76 124.00 3h4f s ALA 302 Ca 0.20 -0.97 -0.08 0.00 0.00 0.00 0.00 51.96 51.11 3h4f s ALA 302 Cb -0.10 -1.54 -0.03 0.00 0.00 0.00 0.00 23.12 21.45 3h4f s ALA 302 CO 0.12 -0.03 0.09 -0.47 0.00 0.00 0.00 175.76 175.46 3h4f s TYR 303 N 0.81 3.10 0.11 0.00 5.04 0.08 0.53 117.35 127.01 3h4f s TYR 303 Ca -0.02 -0.35 0.02 0.00 -2.44 0.00 0.00 57.07 54.28 3h4f s TYR 303 Cb -0.15 -2.26 -0.04 0.00 0.35 0.00 0.00 41.96 39.86 3h4f s TYR 303 CO 0.02 -0.33 -0.06 0.14 -1.34 0.00 0.00 175.55 173.97 3h4f s VAL 304 N 1.64 0.72 -0.19 3.14 -7.23 0.26 0.06 120.40 118.79 3h4f s VAL 304 Ca 0.06 -1.95 -0.29 0.00 -1.81 0.00 0.00 61.98 58.00 3h4f s VAL 304 Cb -0.15 -1.72 -0.01 0.00 0.56 0.00 0.00 36.38 35.06 3h4f s VAL 304 CO 0.05 -0.84 1.22 0.21 -0.31 0.00 0.00 175.10 175.42 3h4f s ASN 305 N -3.06 6.96 -0.07 4.85 3.84 -0.93 0.28 114.94 126.81 3h4f s ASN 305 Ca 0.13 1.58 0.04 0.00 0.21 0.00 0.00 52.86 54.82 3h4f s ASN 305 Cb 0.05 -2.54 0.24 0.00 -0.55 0.00 0.00 41.25 38.45 3h4f s ASN 305 CO -0.04 -0.77 0.87 1.57 -2.79 0.00 0.00 177.10 175.94 3h4f n HIS 306 N 6.63 0.61 -2.55 0.43 -0.00 -0.03 -3.80 115.22 116.51 3h4f n HIS 306 Ca 0.14 -0.21 -0.42 0.00 -0.00 0.00 0.00 57.72 57.22 3h4f n HIS 306 Cb 0.45 -0.22 -0.02 0.00 -0.00 0.00 0.00 29.99 30.20 3h4f n HIS 306 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 176.34 177.55 3h4f s ASN 307 N -0.24 6.39 0.51 0.26 3.84 -1.26 -4.90 114.94 119.55 3h4f s ASN 307 Ca 0.16 0.10 0.34 0.00 0.21 0.00 0.00 52.86 53.67 3h4f s ASN 307 Cb 0.12 -2.55 1.62 0.00 -0.55 0.00 0.00 41.25 39.89 3h4f s ASN 307 CO 0.05 -1.53 2.02 -0.07 -2.79 0.00 0.00 177.10 174.78 3h4f h LEU 308 N 12.13 0.00 -0.08 3.21 3.38 -1.99 0.09 115.31 132.05 3h4f h LEU 308 Ca -0.25 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.60 3h4f h LEU 308 Cb 1.06 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.82 3h4f h LEU 308 CO 1.19 0.00 -0.40 0.40 0.09 0.00 0.00 178.44 179.72 3h4f h ILE 309 N 0.00 1.40 -0.64 1.22 2.04 -1.90 0.37 117.51 120.00 3h4f h ILE 309 Ca 0.00 -1.78 -0.04 0.00 1.00 0.00 0.00 64.86 64.04 3h4f h ILE 309 Cb 0.27 2.29 -0.03 0.00 -0.74 0.00 0.00 36.82 38.61 3h4f h ILE 309 CO 0.00 0.52 0.24 -0.33 0.00 0.00 0.00 178.15 178.58 3h4f h GLU 310 N -0.05 0.97 0.57 2.37 5.08 -1.45 0.32 114.58 122.39 3h4f h GLU 310 Ca -0.03 -0.18 -0.03 0.00 -1.00 0.00 0.00 59.36 58.12 3h4f h GLU 310 Cb 1.05 -0.15 0.01 0.00 0.50 0.00 0.00 28.75 30.16 3h4f h GLU 310 CO 0.08 0.82 -0.27 0.00 -1.00 0.00 0.00 179.01 178.64 3h4f h ALA 311 N 1.10 -0.77 0.00 3.43 0.00 -1.06 -0.81 119.26 121.14 3h4f h ALA 311 Ca 0.21 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.95 3h4f h ALA 311 Cb 0.23 0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.31 3h4f h ALA 311 CO -0.01 -0.92 -0.95 1.19 0.00 0.00 0.00 179.25 178.56 3h4f n PHE 312 N -5.41 0.00 -0.11 0.00 3.01 0.12 -1.89 117.46 113.18 3h4f n PHE 312 Ca -0.13 0.00 -0.13 0.00 1.01 0.00 0.00 57.45 58.20 3h4f n PHE 312 Cb 0.32 -0.09 -0.13 0.00 -0.01 0.00 0.00 39.48 39.57 3h4f n PHE 312 CO 0.00 0.00 0.00 0.39 1.01 0.00 0.00 176.76 178.16 3h4f n GLU 313 N -1.52 0.76 0.00 -1.08 -0.58 0.10 -4.74 120.64 113.58 3h4f n GLU 313 Ca 0.01 0.07 0.08 0.00 -0.42 0.00 0.00 57.16 56.91 3h4f n GLU 313 Cb 0.27 -1.48 -0.06 0.00 -0.57 0.00 0.00 31.44 29.60 3h4f n GLU 313 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 3h4f n LEU 314 N -2.97 1.18 0.00 -4.62 4.77 -0.64 -5.00 117.00 109.72 3h4f n LEU 314 Ca -0.37 -0.60 0.00 0.00 -0.03 0.00 0.00 56.01 55.01 3h4f n LEU 314 Cb 1.02 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 42.11 3h4f n LEU 314 CO 0.31 0.25 0.00 0.61 -1.33 0.00 0.00 177.39 177.23 3h4f n GLY 315 N 1.34 0.83 2.40 -0.72 0.00 -0.71 -1.38 105.19 106.94 3h4f n GLY 315 Ca 0.05 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.70 3h4f n GLY 315 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h4f n ALA 316 N -0.78 7.01 -3.69 4.61 0.00 0.31 -4.22 120.51 123.76 3h4f n ALA 316 Ca 0.00 -3.68 -0.18 0.00 0.00 0.00 0.00 53.44 49.59 3h4f n ALA 316 Cb 0.00 -2.88 -0.16 0.00 0.00 0.00 0.00 19.45 16.40 3h4f n ALA 316 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3h4f s ALA 317 N -0.01 0.41 0.37 0.00 0.00 -1.24 -2.20 121.76 119.10 3h4f s ALA 317 Ca 0.60 0.11 0.07 0.00 0.00 0.00 0.00 51.96 52.74 3h4f s ALA 317 Cb 0.21 -0.35 -0.07 0.00 0.00 0.00 0.00 23.12 22.91 3h4f s ALA 317 CO -0.09 -0.06 0.00 0.00 0.00 0.00 0.00 175.76 175.61 3h4f s ALA 318 N 0.99 2.86 0.14 0.00 0.00 0.11 -4.59 121.76 121.28 3h4f s ALA 318 Ca -0.10 -2.18 0.09 0.00 0.00 0.00 0.00 51.96 49.77 3h4f s ALA 318 Cb -0.14 0.26 -0.04 0.00 0.00 0.00 0.00 23.12 23.21 3h4f s ALA 318 CO -0.01 -0.13 -0.21 -1.01 0.00 0.00 0.00 175.76 174.39 3h4f s HIS 319 N -2.87 1.92 -0.07 0.00 3.76 0.14 -0.74 115.29 117.43 3h4f s HIS 319 Ca 0.35 -0.42 0.05 0.00 -0.15 0.00 0.00 55.06 54.88 3h4f s HIS 319 Cb 0.08 -1.01 -0.01 0.00 1.11 0.00 0.00 32.58 32.75 3h4f s HIS 319 CO 0.17 0.30 -0.22 -0.06 -0.85 0.00 0.00 174.74 174.08 3h4f s PHE 320 N -1.51 2.54 -0.23 1.40 0.08 -0.54 -1.07 117.98 118.65 3h4f s PHE 320 Ca 0.12 -0.64 -0.05 0.00 0.12 0.00 0.00 56.93 56.47 3h4f s PHE 320 Cb -0.08 -1.64 -0.02 0.00 -0.57 0.00 0.00 43.02 40.70 3h4f s PHE 320 CO 0.06 -0.16 0.01 0.21 -0.10 0.00 0.00 175.22 175.23 3h4f s LYS 321 N -0.15 3.52 -0.09 0.44 2.36 0.53 -0.52 119.74 125.83 3h4f s LYS 321 Ca -0.03 -0.55 0.03 0.00 -2.55 0.00 0.00 55.97 52.87 3h4f s LYS 321 Cb -0.14 -3.15 0.01 0.00 -1.05 0.00 0.00 37.83 33.50 3h4f s LYS 321 CO 0.04 -0.16 -0.18 0.08 1.55 0.00 0.00 175.35 176.67 3h4f s VAL 322 N 1.47 1.63 0.36 4.02 1.01 -0.40 -1.93 120.40 126.55 3h4f s VAL 322 Ca 0.05 -0.76 0.01 0.00 0.00 0.00 0.00 61.98 61.29 3h4f s VAL 322 Cb -0.15 -1.44 -0.03 0.00 0.00 0.00 0.00 36.38 34.77 3h4f s VAL 322 CO 0.00 0.46 0.56 0.42 0.00 0.00 0.00 175.10 176.55 3h4f s THR 323 N 0.60 4.87 -1.77 3.92 -4.23 -0.42 -0.31 115.64 118.30 3h4f s THR 323 Ca -0.15 -0.50 0.00 0.00 -1.18 0.00 0.00 61.69 59.86 3h4f s THR 323 Cb -0.17 -3.78 0.00 0.00 1.34 0.00 0.00 72.50 69.90 3h4f s THR 323 CO 0.05 -0.50 0.00 0.61 -0.54 0.00 0.00 174.62 174.24 3h4f n GLY 324 N -1.83 0.50 3.71 3.99 0.00 -1.26 -0.14 105.19 110.16 3h4f n GLY 324 Ca -0.04 -2.17 -0.35 0.00 0.00 0.00 0.00 46.02 43.46 3h4f n GLY 324 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3h4f s GLU 325 N -0.71 3.71 0.39 1.61 8.01 -1.26 -4.66 118.70 125.78 3h4f s GLU 325 Ca 0.00 -0.29 -0.28 0.00 0.01 0.00 0.00 54.97 54.42 3h4f s GLU 325 Cb 0.00 -3.16 -0.11 0.00 -4.31 0.00 0.00 34.13 26.55 3h4f s GLU 325 CO 0.00 0.47 1.47 1.87 0.01 0.00 0.00 175.26 179.09 3h4f n TRP 326 N 2.92 2.93 -3.75 1.61 -0.00 -1.26 -4.55 117.44 115.35 3h4f n TRP 326 Ca -0.18 0.45 -0.37 0.00 -0.00 0.00 0.00 57.50 57.40 3h4f n TRP 326 Cb 0.53 -2.52 -0.11 0.00 -0.00 0.00 0.00 31.31 29.21 3h4f n TRP 326 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 177.69 178.90 3h4f s ASN 327 N -0.18 5.31 0.46 5.87 3.84 -1.26 -4.97 114.94 124.01 3h4f s ASN 327 Ca 0.54 -1.87 0.26 0.00 0.21 0.00 0.00 52.86 52.01 3h4f s ASN 327 Cb -0.48 -1.85 0.85 0.00 -0.55 0.00 0.00 41.25 39.22 3h4f s ASN 327 CO 0.63 -0.53 1.79 0.44 -2.79 0.00 0.00 177.10 176.65 3h4f h ASP 328 N 8.13 0.00 0.28 -4.21 5.19 -1.95 -2.57 116.42 121.29 3h4f h ASP 328 Ca -0.16 0.00 -0.01 0.00 -0.62 0.00 0.00 57.03 56.24 3h4f h ASP 328 Cb 1.06 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 40.57 3h4f h ASP 328 CO 0.70 0.12 -0.15 -0.78 -3.12 0.00 0.00 179.24 176.01 3h4f h ASP 329 N 0.00 -0.37 -0.73 6.45 -0.00 -2.01 -3.08 116.42 116.67 3h4f h ASP 329 Ca -0.00 0.02 0.02 0.00 -0.00 0.00 0.00 57.03 57.07 3h4f h ASP 329 Cb 0.79 0.10 -0.04 0.00 -0.00 0.00 0.00 39.33 40.18 3h4f h ASP 329 CO 0.02 -0.25 0.47 -0.07 -0.00 0.00 0.00 179.24 179.41 3h4f h LEU 330 N -0.41 0.80 -7.07 2.28 3.38 -1.95 -3.44 115.31 108.90 3h4f h LEU 330 Ca -0.03 -0.01 -0.04 0.00 0.09 0.00 0.00 57.88 57.88 3h4f h LEU 330 Cb 0.32 -0.19 -0.22 0.00 0.09 0.00 0.00 40.66 40.67 3h4f h LEU 330 CO 0.05 0.57 -0.00 -0.32 0.09 0.00 0.00 178.44 178.82 3h4f s MET 331 N -6.13 0.70 -0.06 1.13 0.00 -0.98 -5.14 119.30 108.83 3h4f s MET 331 Ca -0.13 0.99 -0.09 0.00 0.00 0.00 0.00 55.69 56.46 3h4f s MET 331 Cb 0.15 0.25 0.02 0.00 0.00 0.00 0.00 34.83 35.25 3h4f s MET 331 CO 0.77 -0.12 0.22 -0.08 0.00 0.00 0.00 175.02 175.82 3h4f s THR 332 N 0.86 0.03 -0.54 10.11 -1.32 -1.23 -3.90 115.64 119.65 3h4f s THR 332 Ca -0.04 -0.22 -0.24 0.00 -1.21 0.00 0.00 61.69 59.97 3h4f s THR 332 Cb -0.05 -0.39 0.04 0.00 -1.51 0.00 0.00 72.50 70.59 3h4f s THR 332 CO -0.07 -0.12 0.95 -0.55 -2.21 0.00 0.00 174.62 172.61 3h4f s SER 333 N -0.42 6.37 0.06 8.08 0.15 -1.26 -4.90 113.70 121.78 3h4f s SER 333 Ca -0.05 -0.26 -0.15 0.00 0.70 0.00 0.00 55.95 56.18 3h4f s SER 333 Cb -0.03 -2.44 -0.24 0.00 -1.71 0.00 0.00 66.02 61.60 3h4f s SER 333 CO 0.01 -1.21 1.16 0.58 1.20 0.00 0.00 173.24 174.99 3h4f h VAL 334 N 6.03 1.31 -3.30 4.45 2.07 -2.01 -3.42 116.25 121.37 3h4f h VAL 334 Ca -0.26 -2.23 -0.41 0.00 0.82 0.00 0.00 66.70 64.62 3h4f h VAL 334 Cb 1.07 2.45 -0.38 0.00 -1.52 0.00 0.00 31.29 32.92 3h4f h VAL 334 CO 1.08 0.68 -0.76 -0.22 0.02 0.00 0.00 177.57 178.37 3h4f s LEU 335 N -8.14 0.62 0.46 2.57 2.96 -1.26 -5.15 118.68 110.74 3h4f s LEU 335 Ca -0.11 -0.05 -0.21 0.00 -0.22 0.00 0.00 54.13 53.54 3h4f s LEU 335 Cb 0.06 -0.37 -0.09 0.00 0.50 0.00 0.00 46.19 46.29 3h4f s LEU 335 CO 0.90 -0.18 1.01 0.00 -1.32 0.00 0.00 176.35 176.76 3h4f s ALA 336 N 1.84 2.94 -0.29 5.97 0.00 -1.26 -4.90 121.76 126.05 3h4f s ALA 336 Ca 0.02 0.56 -0.26 0.00 0.00 0.00 0.00 51.96 52.28 3h4f s ALA 336 Cb -0.12 -3.23 -0.11 0.00 0.00 0.00 0.00 23.12 19.66 3h4f s ALA 336 CO -0.04 -0.17 1.13 -2.30 0.00 0.00 0.00 175.76 174.38 3h4f n PRO 337 N -0.78 0.00 -3.71 0.00 -0.02 -1.26 -4.92 135.00 124.31 3h4f n PRO 337 Ca 0.08 0.00 -0.14 0.00 -2.02 0.00 0.00 63.50 61.43 3h4f n PRO 337 Cb 0.53 -0.87 -0.09 0.00 -0.02 0.00 0.00 33.50 33.04 3h4f n PRO 337 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 3h4f s SER 338 N 2.86 -0.43 0.00 2.55 1.04 -1.26 -5.30 113.70 113.17 3h4f s SER 338 Ca 0.67 0.71 0.00 0.00 0.48 0.00 0.00 55.95 57.81 3h4f s SER 338 Cb -0.87 0.76 0.00 0.00 0.10 0.00 0.00 66.02 66.00 3h4f s SER 338 CO 0.42 -0.26 0.35 0.61 0.98 0.00 0.00 173.24 175.34