#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h4h h ALA 6 N 0.00 0.23 -0.43 6.98 0.00 -2.05 -2.39 119.26 121.59 3h4h h ALA 6 Ca 0.00 0.08 -0.11 0.00 0.00 0.00 0.00 54.91 54.87 3h4h h ALA 6 Cb 0.00 0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 3h4h h ALA 6 CO 0.00 -0.42 -0.17 0.00 0.00 0.00 0.00 179.25 178.65 3h4h h ALA 7 N 1.23 0.60 0.04 0.00 0.00 -2.05 -1.95 119.26 117.13 3h4h h ALA 7 Ca 0.13 -0.36 0.02 0.00 0.00 0.00 0.00 54.91 54.69 3h4h h ALA 7 Cb 0.17 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 3h4h h ALA 7 CO -0.22 0.55 -0.17 0.93 0.00 0.00 0.00 179.25 180.34 3h4h h GLU 8 N 0.70 -0.29 -0.23 0.00 5.08 -1.95 0.14 114.58 118.04 3h4h h GLU 8 Ca 0.10 0.02 0.02 0.00 -1.00 0.00 0.00 59.36 58.50 3h4h h GLU 8 Cb 0.73 0.06 -0.02 0.00 0.50 0.00 0.00 28.75 30.03 3h4h h GLU 8 CO 0.06 -0.19 0.09 0.82 -1.00 0.00 0.00 179.01 178.78 3h4h h ILE 9 N -0.30 0.96 -0.92 3.13 2.04 -1.45 -2.82 117.51 118.14 3h4h h ILE 9 Ca 0.04 -0.07 0.12 0.00 1.00 0.00 0.00 64.86 65.95 3h4h h ILE 9 Cb 0.35 0.74 -0.07 0.00 -0.74 0.00 0.00 36.82 37.09 3h4h h ILE 9 CO -0.14 0.04 0.59 0.00 0.00 0.00 0.00 178.15 178.64 3h4h h ALA 10 N 1.14 1.66 -0.00 1.87 0.00 -0.81 -2.39 119.26 120.72 3h4h h ALA 10 Ca 0.10 0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.02 3h4h h ALA 10 Cb 0.06 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.66 3h4h h ALA 10 CO -0.09 0.13 -0.11 0.00 0.00 0.00 0.00 179.25 179.17 3h4h n ALA 11 N -2.40 2.70 -1.76 0.00 0.00 0.43 -4.92 120.51 114.56 3h4h n ALA 11 Ca 0.17 -0.21 -0.37 0.00 0.00 0.00 0.00 53.44 53.04 3h4h n ALA 11 Cb 0.37 -1.37 0.02 0.00 0.00 0.00 0.00 19.45 18.46 3h4h n ALA 11 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3h4h s LEU 12 N -2.71 3.80 0.38 0.00 1.43 -0.90 -4.96 118.68 115.72 3h4h s LEU 12 Ca 0.22 2.40 -0.27 0.00 -1.03 0.00 0.00 54.13 55.45 3h4h s LEU 12 Cb 0.19 -4.44 -0.09 0.00 0.03 0.00 0.00 46.19 41.88 3h4h s LEU 12 CO 0.52 -1.35 1.32 -2.16 0.23 0.00 0.00 176.35 174.90 3h4h s PRO 13 N -3.08 4.13 -0.08 1.29 0.04 -1.26 -4.81 135.00 131.23 3h4h s PRO 13 Ca 0.72 2.21 -0.02 0.00 0.04 0.00 0.00 61.00 63.94 3h4h s PRO 13 Cb -0.31 -2.89 -0.03 0.00 0.04 0.00 0.00 34.50 31.31 3h4h s PRO 13 CO 0.35 -0.38 0.03 1.03 0.04 0.00 0.00 177.00 178.07 3h4h s ARG 14 N -2.06 3.05 -0.12 4.56 3.00 -1.26 -0.56 118.95 125.55 3h4h s ARG 14 Ca 0.54 -0.38 -0.04 0.00 0.00 0.00 0.00 55.73 55.85 3h4h s ARG 14 Cb -0.39 -2.85 0.06 0.00 0.00 0.00 0.00 34.95 31.76 3h4h s ARG 14 CO 0.51 0.71 0.17 -1.14 0.00 0.00 0.00 175.30 175.55 3h4h s GLN 15 N -1.00 0.07 0.23 3.54 0.74 0.20 -4.95 119.66 118.50 3h4h s GLN 15 Ca 0.15 0.43 -0.30 0.00 0.05 0.00 0.00 55.36 55.68 3h4h s GLN 15 Cb -0.11 -0.62 -0.09 0.00 1.10 0.00 0.00 33.01 33.29 3h4h s GLN 15 CO 0.04 -0.42 0.95 0.15 -0.55 0.00 0.00 175.29 175.46 3h4h s LYS 16 N 2.29 4.84 -0.05 1.67 1.02 -1.26 -0.35 119.74 127.90 3h4h s LYS 16 Ca 0.04 1.50 0.05 0.00 0.02 0.00 0.00 55.97 57.57 3h4h s LYS 16 Cb -0.13 -3.28 -0.00 0.00 -0.52 0.00 0.00 37.83 33.89 3h4h s LYS 16 CO -0.07 0.49 -0.19 0.08 -0.92 0.00 0.00 175.35 174.73 3h4h s VAL 17 N -1.10 1.60 -0.12 3.17 1.01 -0.43 -4.90 120.40 119.63 3h4h s VAL 17 Ca 0.42 -0.80 -0.25 0.00 0.00 0.00 0.00 61.98 61.34 3h4h s VAL 17 Cb -0.26 -1.37 -0.02 0.00 0.00 0.00 0.00 36.38 34.72 3h4h s VAL 17 CO 0.32 0.45 0.80 -1.61 0.00 0.00 0.00 175.10 175.07 3h4h s GLU 18 N 0.05 4.37 0.58 2.72 2.02 -1.26 -4.69 118.70 122.49 3h4h s GLU 18 Ca -0.05 1.01 -0.16 0.00 0.02 0.00 0.00 54.97 55.79 3h4h s GLU 18 Cb -0.13 -3.52 -0.05 0.00 0.10 0.00 0.00 34.13 30.54 3h4h s GLU 18 CO 0.03 -0.16 1.03 -0.51 0.02 0.00 0.00 175.26 175.67 3h4h s LEU 19 N 1.56 3.51 0.10 1.80 1.43 -1.26 -4.66 118.68 121.16 3h4h s LEU 19 Ca 0.39 1.71 0.07 0.00 -1.03 0.00 0.00 54.13 55.28 3h4h s LEU 19 Cb -0.17 -4.52 -0.03 0.00 0.03 0.00 0.00 46.19 41.49 3h4h s LEU 19 CO 0.16 -0.99 -0.18 0.68 0.23 0.00 0.00 176.35 176.25 3h4h s VAL 20 N -2.57 1.53 0.27 -1.59 -7.23 -1.26 -4.97 120.40 104.59 3h4h s VAL 20 Ca 0.61 -1.53 -0.29 0.00 -1.81 0.00 0.00 61.98 58.96 3h4h s VAL 20 Cb -0.14 -1.45 -0.09 0.00 0.56 0.00 0.00 36.38 35.26 3h4h s VAL 20 CO 0.37 -0.16 1.10 -1.81 -0.31 0.00 0.00 175.10 174.29 3h4h s ASP 21 N -1.97 7.27 0.71 4.85 1.01 -1.26 -4.60 116.67 122.67 3h4h s ASP 21 Ca 0.05 2.26 -0.16 0.00 0.71 0.00 0.00 52.55 55.41 3h4h s ASP 21 Cb -0.09 -2.63 0.01 0.00 1.01 0.00 0.00 42.92 41.22 3h4h s ASP 21 CO 0.04 -0.15 1.12 -2.65 0.21 0.00 0.00 175.17 173.74 3h4h n PRO 22 N 1.25 0.67 -0.06 8.23 -0.02 -1.26 -2.14 135.00 141.67 3h4h n PRO 22 Ca -0.01 0.29 0.10 0.00 -2.02 0.00 0.00 63.50 61.86 3h4h n PRO 22 Cb 0.45 -2.36 0.41 0.00 -0.02 0.00 0.00 33.50 31.98 3h4h n PRO 22 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 3h4h n PRO 23 N -2.08 1.55 -1.67 0.52 -0.04 -1.26 -5.04 135.00 126.98 3h4h n PRO 23 Ca 0.14 -0.83 -0.30 0.00 -0.04 0.00 0.00 63.50 62.47 3h4h n PRO 23 Cb 0.49 -1.37 0.06 0.00 -0.04 0.00 0.00 33.50 32.64 3h4h n PRO 23 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 3h4h s PHE 24 N -1.84 3.14 0.00 0.54 0.40 -0.91 -0.53 117.98 118.79 3h4h s PHE 24 Ca 0.31 1.24 0.04 0.00 -0.60 0.00 0.00 56.93 57.92 3h4h s PHE 24 Cb 0.16 -2.97 -0.01 0.00 0.51 0.00 0.00 43.02 40.71 3h4h s PHE 24 CO 0.25 -1.31 -0.13 0.08 0.70 0.00 0.00 175.22 174.80 3h4h s VAL 25 N -3.16 1.04 1.05 -0.44 1.01 -1.26 -4.57 120.40 114.06 3h4h s VAL 25 Ca 0.58 -0.66 -0.12 0.00 0.00 0.00 0.00 61.98 61.79 3h4h s VAL 25 Cb -0.13 -0.88 0.22 0.00 0.00 0.00 0.00 36.38 35.59 3h4h s VAL 25 CO 0.54 0.22 1.07 -1.38 0.00 0.00 0.00 175.10 175.55 3h4h s HIS 26 N -0.43 1.61 0.15 5.22 -3.43 -1.26 -4.91 115.29 112.23 3h4h s HIS 26 Ca 0.04 1.33 -0.32 0.00 -0.80 0.00 0.00 55.06 55.31 3h4h s HIS 26 Cb -0.06 -3.18 -0.12 0.00 -1.43 0.00 0.00 32.58 27.80 3h4h s HIS 26 CO -0.00 -3.33 1.74 0.00 -2.00 0.00 0.00 174.74 171.15 3h4h n ALA 27 N -4.55 2.20 -3.58 -1.38 0.00 -1.26 -4.99 120.51 106.94 3h4h n ALA 27 Ca 0.06 0.37 -0.09 0.00 0.00 0.00 0.00 53.44 53.78 3h4h n ALA 27 Cb 0.54 -2.51 -0.03 0.00 0.00 0.00 0.00 19.45 17.45 3h4h n ALA 27 CO 0.00 0.00 0.00 -3.38 0.00 0.00 0.00 177.50 174.12 3h4h s HIS 28 N 1.84 -0.19 -0.01 0.00 -3.43 -1.26 -5.03 115.29 107.21 3h4h s HIS 28 Ca 0.79 -0.18 0.05 0.00 -0.80 0.00 0.00 55.06 54.92 3h4h s HIS 28 Cb -0.54 0.56 -0.03 0.00 -1.43 0.00 0.00 32.58 31.14 3h4h s HIS 28 CO 0.36 -1.07 -0.15 -1.54 -2.00 0.00 0.00 174.74 170.35 3h4h s SER 29 N -2.88 4.03 0.01 7.38 1.04 -1.26 -5.04 113.70 116.98 3h4h s SER 29 Ca 0.10 -0.27 -0.23 0.00 0.48 0.00 0.00 55.95 56.03 3h4h s SER 29 Cb -0.03 -0.80 -0.17 0.00 0.10 0.00 0.00 66.02 65.12 3h4h s SER 29 CO 0.01 0.30 1.33 1.56 0.98 0.00 0.00 173.24 177.42 3h4h h GLN 30 N 4.94 0.17 -6.39 4.02 4.20 -1.97 -3.42 115.11 116.66 3h4h h GLN 30 Ca -0.47 -0.08 -0.54 0.00 0.06 0.00 0.00 58.65 57.62 3h4h h GLN 30 Cb 1.15 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.90 3h4h h GLN 30 CO 0.50 0.58 0.22 0.08 -0.67 0.00 0.00 178.83 179.54 3h4h s VAL 31 N -4.37 4.63 0.14 -0.54 1.01 -1.26 -3.41 120.40 116.59 3h4h s VAL 31 Ca -0.15 1.76 -0.31 0.00 0.00 0.00 0.00 61.98 63.28 3h4h s VAL 31 Cb 0.04 -4.17 -0.08 0.00 0.00 0.00 0.00 36.38 32.16 3h4h s VAL 31 CO 0.71 0.37 1.40 0.00 0.00 0.00 0.00 175.10 177.57 3h4h s ALA 32 N -0.15 3.60 -0.88 5.51 0.00 0.18 -4.93 121.76 125.09 3h4h s ALA 32 Ca 0.40 1.15 -0.23 0.00 0.00 0.00 0.00 51.96 53.29 3h4h s ALA 32 Cb -0.22 -3.54 0.07 0.00 0.00 0.00 0.00 23.12 19.44 3h4h s ALA 32 CO 0.25 -0.62 1.25 -1.21 0.00 0.00 0.00 175.76 175.43 3h4h s GLU 33 N 0.85 3.44 3.09 0.00 2.02 -1.26 -4.88 118.70 121.95 3h4h s GLU 33 Ca 0.64 -1.08 0.00 0.00 0.02 0.00 0.00 54.97 54.55 3h4h s GLU 33 Cb -0.38 -4.83 0.00 0.00 0.10 0.00 0.00 34.13 29.02 3h4h s GLU 33 CO 0.32 -2.02 0.00 0.41 0.02 0.00 0.00 175.26 173.99 3h4h n GLY 34 N 5.98 0.36 2.27 -1.39 0.00 -1.26 -4.94 105.19 106.21 3h4h n GLY 34 Ca 0.19 -1.10 -0.13 0.00 0.00 0.00 0.00 46.02 44.98 3h4h n GLY 34 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3h4h n GLY 35 N 0.00 1.13 3.68 -0.02 0.00 -1.26 -5.05 105.19 103.67 3h4h n GLY 35 Ca 0.00 -2.06 -0.42 0.00 0.00 0.00 0.00 46.02 43.54 3h4h n GLY 35 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3h4h n PRO 36 N -1.96 1.89 -4.23 1.61 -0.02 -1.26 -5.01 135.00 126.02 3h4h n PRO 36 Ca 0.10 0.67 -0.18 0.00 -2.02 0.00 0.00 63.50 62.06 3h4h n PRO 36 Cb 0.35 -2.28 -0.11 0.00 -0.02 0.00 0.00 33.50 31.43 3h4h n PRO 36 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 3h4h s LYS 37 N -2.02 0.98 -0.46 -0.52 1.02 -1.26 -4.44 119.74 113.05 3h4h s LYS 37 Ca 0.59 -1.17 -0.19 0.00 0.02 0.00 0.00 55.97 55.21 3h4h s LYS 37 Cb -0.55 -0.90 0.03 0.00 -0.52 0.00 0.00 37.83 35.89 3h4h s LYS 37 CO 0.60 0.18 0.57 0.08 -0.92 0.00 0.00 175.35 175.86 3h4h s VAL 38 N -1.91 4.92 -0.27 3.17 1.01 0.27 -0.56 120.40 127.03 3h4h s VAL 38 Ca 0.06 -0.23 -0.14 0.00 0.00 0.00 0.00 61.98 61.68 3h4h s VAL 38 Cb -0.06 -4.19 -0.04 0.00 0.00 0.00 0.00 36.38 32.09 3h4h s VAL 38 CO 0.03 -0.61 0.34 -0.69 0.00 0.00 0.00 175.10 174.16 3h4h s VAL 39 N 2.55 5.21 -0.18 2.92 1.01 0.75 -0.63 120.40 132.03 3h4h s VAL 39 Ca 0.17 0.50 -0.06 0.00 0.00 0.00 0.00 61.98 62.58 3h4h s VAL 39 Cb -0.17 -3.66 -0.04 0.00 0.00 0.00 0.00 36.38 32.51 3h4h s VAL 39 CO 0.15 0.19 0.04 -1.61 0.00 0.00 0.00 175.10 173.86 3h4h s GLU 40 N 1.94 3.86 0.13 2.72 2.02 0.53 -0.58 118.70 129.32 3h4h s GLU 40 Ca 0.14 -0.40 0.07 0.00 0.02 0.00 0.00 54.97 54.79 3h4h s GLU 40 Cb -0.16 -3.14 -0.04 0.00 0.10 0.00 0.00 34.13 30.89 3h4h s GLU 40 CO 0.10 0.22 -0.17 -0.06 0.02 0.00 0.00 175.26 175.37 3h4h s PHE 41 N 0.48 1.61 -0.04 1.61 0.40 -0.56 -1.32 117.98 120.17 3h4h s PHE 41 Ca 0.01 -0.49 0.02 0.00 -0.60 0.00 0.00 56.93 55.88 3h4h s PHE 41 Cb -0.13 -0.84 0.01 0.00 0.51 0.00 0.00 43.02 42.57 3h4h s PHE 41 CO 0.01 0.21 -0.10 0.99 0.70 0.00 0.00 175.22 177.04 3h4h s THR 42 N -1.82 0.88 -0.03 0.64 2.01 -1.26 -0.57 115.64 115.49 3h4h s THR 42 Ca 0.10 -0.38 0.02 0.00 0.31 0.00 0.00 61.69 61.74 3h4h s THR 42 Cb -0.07 -0.80 0.01 0.00 0.01 0.00 0.00 72.50 71.65 3h4h s THR 42 CO 0.04 0.28 -0.07 -0.04 -0.69 0.00 0.00 174.62 174.15 3h4h s MET 43 N 0.43 0.90 -0.16 4.92 -1.94 -0.46 -4.91 119.30 118.07 3h4h s MET 43 Ca -0.08 -0.20 -0.11 0.00 -1.71 0.00 0.00 55.69 53.59 3h4h s MET 43 Cb -0.12 -0.85 -0.05 0.00 2.01 0.00 0.00 34.83 35.82 3h4h s MET 43 CO 0.01 0.01 0.19 0.08 -0.01 0.00 0.00 175.02 175.31 3h4h s VAL 44 N 0.54 5.38 0.01 -6.03 1.01 -1.26 -0.82 120.40 119.24 3h4h s VAL 44 Ca -0.08 0.33 -0.25 0.00 0.00 0.00 0.00 61.98 61.98 3h4h s VAL 44 Cb -0.11 -3.52 -0.05 0.00 0.00 0.00 0.00 36.38 32.70 3h4h s VAL 44 CO 0.01 0.46 0.77 -0.63 0.00 0.00 0.00 175.10 175.71 3h4h s ILE 45 N 0.08 4.82 -0.20 2.22 1.01 -0.10 -0.81 121.20 128.22 3h4h s ILE 45 Ca 0.12 1.63 0.01 0.00 0.00 0.00 0.00 60.65 62.42 3h4h s ILE 45 Cb -0.12 -4.12 0.03 0.00 0.01 0.00 0.00 42.46 38.26 3h4h s ILE 45 CO 0.02 0.32 -0.17 -1.61 0.00 0.00 0.00 174.94 173.49 3h4h s GLU 46 N 0.25 2.70 -0.13 2.79 2.02 -0.00 -4.45 118.70 121.87 3h4h s GLU 46 Ca 0.40 -0.93 -0.25 0.00 0.02 0.00 0.00 54.97 54.21 3h4h s GLU 46 Cb -0.20 -2.60 -0.02 0.00 0.10 0.00 0.00 34.13 31.41 3h4h s GLU 46 CO 0.22 -0.31 0.79 -1.21 0.02 0.00 0.00 175.26 174.78 3h4h s GLU 47 N 1.27 4.35 -0.02 1.61 2.02 -1.26 -0.56 118.70 126.10 3h4h s GLU 47 Ca 0.01 0.98 -0.29 0.00 0.02 0.00 0.00 54.97 55.70 3h4h s GLU 47 Cb -0.15 -3.53 0.09 0.00 0.10 0.00 0.00 34.13 30.64 3h4h s GLU 47 CO -0.11 -0.19 0.77 -1.59 0.02 0.00 0.00 175.26 174.16 3h4h s LYS 48 N 1.67 0.97 0.01 1.61 -2.85 -0.35 -4.99 119.74 115.80 3h4h s LYS 48 Ca 0.38 -0.02 -0.30 0.00 -1.00 0.00 0.00 55.97 55.03 3h4h s LYS 48 Cb -0.17 0.45 -0.05 0.00 -2.06 0.00 0.00 37.83 36.00 3h4h s LYS 48 CO 0.15 -0.35 1.21 0.15 0.10 0.00 0.00 175.35 176.60 3h4h s LYS 49 N -2.08 4.39 0.15 1.78 1.02 -1.26 -0.28 119.74 123.46 3h4h s LYS 49 Ca -0.04 1.74 0.09 0.00 0.02 0.00 0.00 55.97 57.79 3h4h s LYS 49 Cb -0.00 -3.45 -0.04 0.00 -0.52 0.00 0.00 37.83 33.82 3h4h s LYS 49 CO -0.00 -0.35 -0.22 0.96 -0.92 0.00 0.00 175.35 174.82 3h4h s ILE 50 N 1.61 1.97 -0.23 2.17 -4.36 0.13 -4.91 121.20 117.58 3h4h s ILE 50 Ca 0.58 -1.80 -0.12 0.00 -0.26 0.00 0.00 60.65 59.05 3h4h s ILE 50 Cb -0.27 -1.84 -0.05 0.00 1.25 0.00 0.00 42.46 41.55 3h4h s ILE 50 CO 0.26 -0.13 0.21 -0.69 0.24 0.00 0.00 174.94 174.83 3h4h s VAL 51 N -1.54 5.33 -0.86 8.37 1.01 -1.26 -0.92 120.40 130.53 3h4h s VAL 51 Ca 0.14 0.30 0.11 0.00 0.00 0.00 0.00 61.98 62.53 3h4h s VAL 51 Cb -0.08 -3.55 -0.04 0.00 0.00 0.00 0.00 36.38 32.71 3h4h s VAL 51 CO 0.06 0.33 0.61 2.30 0.00 0.00 0.00 175.10 178.40 3h4h n ILE 52 N 4.22 0.00 -4.09 2.22 -5.35 0.16 -4.81 119.36 111.71 3h4h n ILE 52 Ca -0.14 -0.33 -0.14 0.00 -0.27 0.00 0.00 62.75 61.87 3h4h n ILE 52 Cb 0.52 1.09 -0.05 0.00 -1.74 0.00 0.00 39.64 39.46 3h4h n ILE 52 CO 0.00 0.00 0.00 1.51 -1.76 0.00 0.00 176.55 176.30 3h4h s ASP 53 N -1.66 0.79 0.00 7.28 3.84 -1.26 -0.92 116.67 124.74 3h4h s ASP 53 Ca 0.08 -1.43 0.12 0.00 -0.00 0.00 0.00 52.55 51.31 3h4h s ASP 53 Cb 0.09 0.64 0.50 0.00 -1.38 0.00 0.00 42.92 42.77 3h4h s ASP 53 CO 0.34 -1.25 1.35 -0.90 -0.00 0.00 0.00 175.17 174.71 3h4h n ASP 54 N -1.24 0.82 -0.77 2.11 5.68 -1.26 -2.93 116.55 118.95 3h4h n ASP 54 Ca 0.01 -1.80 0.12 0.00 -0.50 0.00 0.00 54.79 52.62 3h4h n ASP 54 Cb 0.62 -0.08 0.31 0.00 -1.14 0.00 0.00 41.12 40.83 3h4h n ASP 54 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3h4h n ALA 55 N -0.14 2.49 -1.00 2.12 0.00 -1.26 -4.95 120.51 117.77 3h4h n ALA 55 Ca 0.10 -0.67 -0.00 0.00 0.00 0.00 0.00 53.44 52.87 3h4h n ALA 55 Cb 0.16 -1.00 -0.00 0.00 0.00 0.00 0.00 19.45 18.61 3h4h n ALA 55 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3h4h n GLY 56 N 1.28 0.42 3.73 0.00 0.00 -1.15 -5.00 105.19 104.46 3h4h n GLY 56 Ca 0.17 -0.81 -0.42 0.00 0.00 0.00 0.00 46.02 44.97 3h4h n GLY 56 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3h4h s THR 57 N -2.00 2.46 -0.04 2.61 2.01 -1.26 -4.86 115.64 114.55 3h4h s THR 57 Ca 0.00 0.34 0.01 0.00 0.31 0.00 0.00 61.69 62.35 3h4h s THR 57 Cb 0.00 -3.22 -0.03 0.00 0.01 0.00 0.00 72.50 69.26 3h4h s THR 57 CO 0.00 0.03 -0.04 -0.70 -0.69 0.00 0.00 174.62 173.22 3h4h s GLU 58 N 0.73 2.75 0.01 4.92 2.12 -1.26 -0.66 118.70 127.31 3h4h s GLU 58 Ca 0.68 -0.58 0.05 0.00 0.36 0.00 0.00 54.97 55.49 3h4h s GLU 58 Cb -0.45 -2.62 -0.02 0.00 0.26 0.00 0.00 34.13 31.30 3h4h s GLU 58 CO 0.35 0.65 -0.15 0.08 -0.54 0.00 0.00 175.26 175.65 3h4h s VAL 59 N -0.93 1.16 -0.88 3.70 1.01 -0.09 -4.94 120.40 119.43 3h4h s VAL 59 Ca 0.15 -0.81 -0.25 0.00 0.00 0.00 0.00 61.98 61.08 3h4h s VAL 59 Cb -0.11 -1.01 0.03 0.00 0.00 0.00 0.00 36.38 35.29 3h4h s VAL 59 CO 0.05 0.19 1.46 -1.00 0.00 0.00 0.00 175.10 175.80 3h4h s HIS 60 N -0.57 2.31 0.55 5.22 3.76 -1.26 -0.70 115.29 124.60 3h4h s HIS 60 Ca 0.04 -0.29 -0.18 0.00 -0.15 0.00 0.00 55.06 54.48 3h4h s HIS 60 Cb -0.07 -4.57 -0.05 0.00 1.11 0.00 0.00 32.58 29.00 3h4h s HIS 60 CO 0.00 -2.00 1.07 0.00 -0.85 0.00 0.00 174.74 172.97 3h4h s ALA 61 N 6.03 2.74 -0.30 -1.40 0.00 0.61 -4.85 121.76 124.60 3h4h s ALA 61 Ca 0.46 0.59 0.02 0.00 0.00 0.00 0.00 51.96 53.03 3h4h s ALA 61 Cb -0.05 -3.28 0.08 0.00 0.00 0.00 0.00 23.12 19.88 3h4h s ALA 61 CO 0.02 -0.69 0.00 -1.64 0.00 0.00 0.00 175.76 173.46 3h4h s MET 62 N -3.60 1.54 -0.22 0.00 -1.94 -0.49 -1.22 119.30 113.37 3h4h s MET 62 Ca 0.67 -1.45 0.02 0.00 -1.71 0.00 0.00 55.69 53.22 3h4h s MET 62 Cb -0.19 -2.82 0.05 0.00 2.01 0.00 0.00 34.83 33.88 3h4h s MET 62 CO 0.29 -0.80 -0.12 0.00 -0.01 0.00 0.00 175.02 174.39 3h4h s ALA 63 N 1.16 2.24 0.06 3.03 0.00 0.27 -2.44 121.76 126.09 3h4h s ALA 63 Ca 0.03 -1.41 -0.32 0.00 0.00 0.00 0.00 51.96 50.26 3h4h s ALA 63 Cb -0.19 -1.38 -0.11 0.00 0.00 0.00 0.00 23.12 21.44 3h4h s ALA 63 CO -0.10 -0.91 1.88 1.19 0.00 0.00 0.00 175.76 177.82 3h4h n PHE 64 N 4.59 2.51 -1.39 0.00 3.72 -1.25 -0.82 117.46 124.81 3h4h n PHE 64 Ca -0.15 -0.17 -0.13 0.00 -0.05 0.00 0.00 57.45 56.94 3h4h n PHE 64 Cb 0.45 -2.73 -0.06 0.00 -0.94 0.00 0.00 39.48 36.20 3h4h n PHE 64 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 176.76 175.00 3h4h n ASN 65 N 6.31 -5.14 0.00 4.37 5.15 0.01 -2.60 115.26 123.36 3h4h n ASN 65 Ca 0.20 0.33 0.00 0.00 -0.60 0.00 0.00 54.58 54.51 3h4h n ASN 65 Cb 0.36 -3.81 0.00 0.00 -0.53 0.00 0.00 39.78 35.80 3h4h n ASN 65 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3h4h n GLY 66 N -0.64 0.74 3.35 8.20 0.00 -0.83 -4.96 105.19 111.06 3h4h n GLY 66 Ca -0.13 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.65 3h4h n GLY 66 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3h4h s THR 67 N -2.95 1.97 -0.25 2.61 -4.23 -1.07 -4.95 115.64 106.77 3h4h s THR 67 Ca 0.00 -1.88 0.02 0.00 -1.18 0.00 0.00 61.69 58.65 3h4h s THR 67 Cb 0.00 -1.88 0.05 0.00 1.34 0.00 0.00 72.50 72.01 3h4h s THR 67 CO 0.00 -0.20 -0.11 -0.69 -0.54 0.00 0.00 174.62 173.08 3h4h s VAL 68 N -1.76 2.26 0.88 2.29 1.01 -1.26 -2.96 120.40 120.87 3h4h s VAL 68 Ca 0.16 -1.49 -0.12 0.00 0.00 0.00 0.00 61.98 60.52 3h4h s VAL 68 Cb -0.07 -2.27 0.12 0.00 0.00 0.00 0.00 36.38 34.16 3h4h s VAL 68 CO 0.07 0.05 1.13 -2.16 0.00 0.00 0.00 175.10 174.19 3h4h s PRO 69 N 1.15 1.37 0.97 2.72 0.04 -1.26 -2.17 135.00 137.82 3h4h s PRO 69 Ca -0.06 0.39 -0.11 0.00 0.04 0.00 0.00 61.00 61.25 3h4h s PRO 69 Cb -0.19 -1.86 0.17 0.00 0.04 0.00 0.00 34.50 32.67 3h4h s PRO 69 CO -0.06 -2.06 1.09 0.20 0.04 0.00 0.00 177.00 176.22 3h4h s GLY 70 N -3.98 1.63 0.67 0.56 0.00 0.16 -4.73 107.32 101.62 3h4h s GLY 70 Ca 0.63 0.17 -0.14 0.00 0.00 0.00 0.00 44.72 45.38 3h4h s GLY 70 CO 0.54 0.68 1.10 2.56 0.00 0.00 0.00 173.10 177.98 3h4h s PRO 71 N -4.71 2.79 -0.08 2.90 0.04 -1.26 -4.40 135.00 130.29 3h4h s PRO 71 Ca 0.66 1.33 -0.30 0.00 0.04 0.00 0.00 61.00 62.73 3h4h s PRO 71 Cb -0.21 -1.95 -0.03 0.00 0.04 0.00 0.00 34.50 32.35 3h4h s PRO 71 CO 0.59 -1.25 1.16 -1.17 0.04 0.00 0.00 177.00 176.37 3h4h s LEU 72 N -4.99 4.26 -0.14 -3.56 2.96 -1.26 -4.28 118.68 111.68 3h4h s LEU 72 Ca 0.66 1.74 -0.08 0.00 -0.22 0.00 0.00 54.13 56.23 3h4h s LEU 72 Cb -0.19 -3.56 -0.04 0.00 0.50 0.00 0.00 46.19 42.90 3h4h s LEU 72 CO 0.43 -0.57 0.15 -0.04 -1.32 0.00 0.00 176.35 175.00 3h4h s MET 73 N 2.27 3.65 -0.12 1.98 -1.94 -1.14 -4.58 119.30 119.43 3h4h s MET 73 Ca 0.54 -0.14 0.02 0.00 -1.71 0.00 0.00 55.69 54.40 3h4h s MET 73 Cb -0.23 -3.25 0.01 0.00 2.01 0.00 0.00 34.83 33.37 3h4h s MET 73 CO 0.20 0.65 -0.18 0.08 -0.01 0.00 0.00 175.02 175.76 3h4h s VAL 74 N -0.66 1.70 0.32 -6.03 1.01 -1.26 -0.53 120.40 114.95 3h4h s VAL 74 Ca 0.13 -0.77 0.06 0.00 0.00 0.00 0.00 61.98 61.40 3h4h s VAL 74 Cb -0.12 -1.53 -0.03 0.00 0.00 0.00 0.00 36.38 34.70 3h4h s VAL 74 CO 0.03 0.48 0.24 0.68 0.00 0.00 0.00 175.10 176.53 3h4h s VAL 75 N 0.89 0.05 0.24 2.92 -7.23 -0.40 -4.99 120.40 111.88 3h4h s VAL 75 Ca -0.08 -2.00 0.09 0.00 -1.81 0.00 0.00 61.98 58.18 3h4h s VAL 75 Cb -0.15 -2.49 -0.04 0.00 0.56 0.00 0.00 36.38 34.26 3h4h s VAL 75 CO -0.01 0.00 -0.02 -1.00 -0.31 0.00 0.00 175.10 173.76 3h4h s HIS 76 N -3.53 2.71 0.19 2.82 3.76 -1.26 -0.81 115.29 119.17 3h4h s HIS 76 Ca 0.39 -0.21 -0.33 0.00 -0.15 0.00 0.00 55.06 54.77 3h4h s HIS 76 Cb 0.03 -1.24 -0.15 0.00 1.11 0.00 0.00 32.58 32.34 3h4h s HIS 76 CO 0.24 0.59 1.34 0.94 -0.85 0.00 0.00 174.74 177.00 3h4h n GLN 77 N -0.63 1.66 -0.87 1.40 7.27 0.09 -1.14 117.38 125.16 3h4h n GLN 77 Ca -0.08 0.59 0.00 0.00 0.07 0.00 0.00 57.00 57.59 3h4h n GLN 77 Cb 0.58 -2.21 0.00 0.00 2.41 0.00 0.00 30.24 31.02 3h4h n GLN 77 CO 0.00 0.00 0.00 -0.25 0.07 0.00 0.00 177.06 176.88 3h4h n ASP 78 N 2.33 -1.89 -4.65 1.69 10.43 0.71 -4.73 116.55 120.44 3h4h n ASP 78 Ca 0.14 0.00 -0.29 0.00 2.57 0.00 0.00 54.79 57.21 3h4h n ASP 78 Cb 0.27 -1.49 0.18 0.00 1.84 0.00 0.00 41.12 41.92 3h4h n ASP 78 CO 0.00 0.00 0.00 -1.81 -1.07 0.00 0.00 177.20 174.32 3h4h s ASP 79 N -2.30 2.65 -0.10 -2.24 -0.00 -0.29 -4.63 116.67 109.75 3h4h s ASP 79 Ca 0.00 1.46 -0.02 0.00 -0.00 0.00 0.00 52.55 53.99 3h4h s ASP 79 Cb 0.00 -2.13 -0.03 0.00 -0.00 0.00 0.00 42.92 40.75 3h4h s ASP 79 CO 0.00 -3.15 -0.01 -0.31 -0.00 0.00 0.00 175.17 171.69 3h4h s TYR 80 N -2.82 3.10 -0.25 4.23 1.51 0.28 -1.11 117.35 122.29 3h4h s TYR 80 Ca 0.65 0.07 -0.11 0.00 -1.01 0.00 0.00 57.07 56.67 3h4h s TYR 80 Cb -0.20 -1.82 -0.05 0.00 -0.11 0.00 0.00 41.96 39.78 3h4h s TYR 80 CO 0.59 0.34 0.20 -1.17 -1.11 0.00 0.00 175.55 174.40 3h4h s LEU 81 N -0.59 4.08 -0.32 -1.29 0.20 -0.16 -0.18 118.68 120.41 3h4h s LEU 81 Ca 0.10 0.11 0.03 0.00 0.69 0.00 0.00 54.13 55.06 3h4h s LEU 81 Cb -0.12 -2.16 0.09 0.00 -0.43 0.00 0.00 46.19 43.57 3h4h s LEU 81 CO 0.02 -0.00 0.02 -0.70 -0.29 0.00 0.00 176.35 175.40 3h4h s GLU 82 N 1.40 1.73 -0.26 1.98 2.12 0.26 -1.45 118.70 124.48 3h4h s GLU 82 Ca 0.09 -1.73 -0.11 0.00 0.36 0.00 0.00 54.97 53.57 3h4h s GLU 82 Cb -0.15 -3.16 -0.05 0.00 0.26 0.00 0.00 34.13 31.03 3h4h s GLU 82 CO 0.07 -0.85 0.21 -1.17 -0.54 0.00 0.00 175.26 172.98 3h4h s LEU 83 N 0.98 4.06 -0.26 2.70 2.96 0.12 -1.49 118.68 127.76 3h4h s LEU 83 Ca 0.05 0.09 -0.22 0.00 -0.22 0.00 0.00 54.13 53.84 3h4h s LEU 83 Cb -0.20 -2.16 -0.01 0.00 0.50 0.00 0.00 46.19 44.32 3h4h s LEU 83 CO -0.07 -0.02 0.70 -0.89 -1.32 0.00 0.00 176.35 174.75 3h4h s THR 84 N 1.51 4.92 -0.14 3.68 2.01 0.26 -1.11 115.64 126.77 3h4h s THR 84 Ca 0.09 1.25 -0.01 0.00 0.31 0.00 0.00 61.69 63.33 3h4h s THR 84 Cb -0.15 -4.01 -0.02 0.00 0.01 0.00 0.00 72.50 68.33 3h4h s THR 84 CO 0.08 -0.04 -0.11 -0.22 -0.69 0.00 0.00 174.62 173.65 3h4h s LEU 85 N 2.65 2.81 -0.10 4.42 2.96 0.21 -1.35 118.68 130.27 3h4h s LEU 85 Ca 0.29 -0.31 0.03 0.00 -0.22 0.00 0.00 54.13 53.93 3h4h s LEU 85 Cb -0.15 -1.65 0.01 0.00 0.50 0.00 0.00 46.19 44.90 3h4h s LEU 85 CO 0.09 0.15 -0.21 -0.63 -1.32 0.00 0.00 176.35 174.43 3h4h s ILE 86 N 0.47 1.84 -0.53 6.68 1.01 0.00 -1.21 121.20 129.46 3h4h s ILE 86 Ca -0.08 -0.88 -0.01 0.00 0.00 0.00 0.00 60.65 59.68 3h4h s ILE 86 Cb -0.15 -1.62 0.14 0.00 0.01 0.00 0.00 42.46 40.83 3h4h s ILE 86 CO 0.04 0.51 0.32 0.21 0.00 0.00 0.00 174.94 176.02 3h4h s ASN 87 N 0.58 5.04 0.78 3.58 2.47 -0.12 -0.92 114.94 126.36 3h4h s ASN 87 Ca -0.14 -2.62 -0.14 0.00 0.42 0.00 0.00 52.86 50.38 3h4h s ASN 87 Cb -0.17 -1.79 0.07 0.00 -1.45 0.00 0.00 41.25 37.91 3h4h s ASN 87 CO 0.04 -0.39 1.22 -2.84 -3.72 0.00 0.00 177.10 171.42 3h4h s PRO 88 N 0.28 1.78 0.50 0.43 0.02 -1.26 0.12 135.00 136.86 3h4h s PRO 88 Ca 0.14 1.82 0.33 0.00 0.02 0.00 0.00 61.00 63.31 3h4h s PRO 88 Cb -0.22 -1.79 1.63 0.00 0.02 0.00 0.00 34.50 34.15 3h4h s PRO 88 CO -0.03 -2.12 2.01 1.05 -0.33 0.00 0.00 177.00 177.57 3h4h h GLU 89 N -0.66 0.00 0.00 5.54 4.11 -1.91 -1.33 114.58 120.34 3h4h h GLU 89 Ca -0.47 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.96 3h4h h GLU 89 Cb 1.30 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.55 3h4h h GLU 89 CO 0.47 0.00 0.00 0.25 0.07 0.00 0.00 179.01 179.80 3h4h n THR 90 N -2.77 0.60 -1.93 -1.06 -2.24 -1.26 -4.74 114.28 100.88 3h4h n THR 90 Ca -0.01 -0.00 -0.30 0.00 -2.27 0.00 0.00 64.05 61.47 3h4h n THR 90 Cb 0.16 -0.80 0.05 0.00 -2.10 0.00 0.00 70.33 67.64 3h4h n THR 90 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 3h4h s ASN 91 N -3.93 5.38 -0.04 3.42 0.01 -0.50 -5.01 114.94 114.27 3h4h s ASN 91 Ca 0.09 1.07 0.10 0.00 -0.71 0.00 0.00 52.86 53.40 3h4h s ASN 91 Cb 0.12 -1.85 -0.15 0.00 0.41 0.00 0.00 41.25 39.78 3h4h s ASN 91 CO 0.48 -1.36 0.17 0.35 -1.51 0.00 0.00 177.10 175.22 3h4h n THR 92 N -3.00 0.20 -4.31 1.60 -2.24 -1.26 -4.73 114.28 100.54 3h4h n THR 92 Ca 0.07 -0.29 -0.27 0.00 -2.27 0.00 0.00 64.05 61.29 3h4h n THR 92 Cb 0.58 -0.04 -0.10 0.00 -2.10 0.00 0.00 70.33 68.67 3h4h n THR 92 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 3h4h s LEU 93 N -4.02 2.90 0.36 3.22 1.43 -1.26 -4.89 118.68 116.42 3h4h s LEU 93 Ca -0.04 -0.62 -0.25 0.00 -1.03 0.00 0.00 54.13 52.19 3h4h s LEU 93 Cb 0.06 -1.59 -0.09 0.00 0.03 0.00 0.00 46.19 44.59 3h4h s LEU 93 CO 0.42 0.11 1.03 -0.89 0.23 0.00 0.00 176.35 177.25 3h4h s THR 94 N -1.69 3.79 0.18 5.49 2.01 -1.26 -4.09 115.64 120.08 3h4h s THR 94 Ca 0.24 1.47 -0.01 0.00 0.31 0.00 0.00 61.69 63.71 3h4h s THR 94 Cb -0.09 -3.81 -0.04 0.00 0.01 0.00 0.00 72.50 68.57 3h4h s THR 94 CO 0.14 0.10 0.09 -1.00 -0.69 0.00 0.00 174.62 173.27 3h4h s HIS 95 N -1.56 1.10 0.00 4.92 0.09 -0.66 -4.88 115.29 114.30 3h4h s HIS 95 Ca 0.54 -1.29 0.00 0.00 -0.00 0.00 0.00 55.06 54.31 3h4h s HIS 95 Cb -0.23 -0.58 0.00 0.00 -0.00 0.00 0.00 32.58 31.77 3h4h s HIS 95 CO 0.29 -0.54 0.00 0.27 -0.00 0.00 0.00 174.74 174.76 3h4h n ASN 96 N -0.23 0.00 -3.77 1.40 6.94 -1.26 -0.72 115.26 117.62 3h4h n ASN 96 Ca -0.01 -0.89 -0.13 0.00 -0.02 0.00 0.00 54.58 53.52 3h4h n ASN 96 Cb 0.65 0.00 -0.14 0.00 -2.36 0.00 0.00 39.78 37.93 3h4h n ASN 96 CO 0.00 0.00 0.00 -0.51 -1.03 0.00 0.00 177.26 175.72 3h4h s ILE 97 N -2.85 -0.04 -0.28 1.53 2.07 -1.26 -4.21 121.20 116.17 3h4h s ILE 97 Ca 0.00 0.13 -0.03 0.00 -1.41 0.00 0.00 60.65 59.34 3h4h s ILE 97 Cb 0.00 -0.21 0.03 0.00 0.13 0.00 0.00 42.46 42.41 3h4h s ILE 97 CO 0.00 0.05 0.00 -0.62 -1.91 0.00 0.00 174.94 172.47 3h4h s ASP 98 N 0.85 4.73 -0.34 4.50 3.68 0.36 -1.22 116.67 129.23 3h4h s ASP 98 Ca -0.07 -0.93 -0.15 0.00 2.13 0.00 0.00 52.55 53.54 3h4h s ASP 98 Cb -0.09 -1.75 -0.01 0.00 -1.45 0.00 0.00 42.92 39.62 3h4h s ASP 98 CO -0.04 -0.19 0.35 -0.36 0.13 0.00 0.00 175.17 175.06 3h4h s PHE 99 N 1.36 3.21 -0.01 -5.34 0.40 0.00 -1.10 117.98 116.51 3h4h s PHE 99 Ca -0.00 -0.05 0.30 0.00 -0.60 0.00 0.00 56.93 56.57 3h4h s PHE 99 Cb -0.18 -2.65 1.47 0.00 0.51 0.00 0.00 43.02 42.17 3h4h s PHE 99 CO -0.01 -0.43 1.90 0.45 0.70 0.00 0.00 175.22 177.83 3h4h h HIS 100 N 8.47 0.00 0.00 0.36 3.86 -1.55 -1.81 115.15 124.48 3h4h h HIS 100 Ca -0.30 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.91 3h4h h HIS 100 Cb 1.14 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.61 3h4h h HIS 100 CO 0.69 0.00 0.00 0.00 0.86 0.00 0.00 177.93 179.48 3h4h h ALA 101 N 2.06 1.00 -2.32 2.45 0.00 -1.90 -3.47 119.26 117.08 3h4h h ALA 101 Ca 0.00 0.00 -0.49 0.00 0.00 0.00 0.00 54.91 54.42 3h4h h ALA 101 Cb 0.16 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.95 3h4h h ALA 101 CO 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 179.25 179.00 3h4h s ALA 102 N -3.31 3.75 -0.20 0.00 0.00 -0.68 -4.55 121.76 116.76 3h4h s ALA 102 Ca 0.06 -0.89 -0.01 0.00 0.00 0.00 0.00 51.96 51.13 3h4h s ALA 102 Cb 0.09 -2.06 0.01 0.00 0.00 0.00 0.00 23.12 21.16 3h4h s ALA 102 CO 0.57 0.15 -0.14 0.99 0.00 0.00 0.00 175.76 177.34 3h4h s THR 103 N -2.14 2.52 0.00 0.00 2.01 -1.26 -4.73 115.64 112.04 3h4h s THR 103 Ca 0.39 -0.84 0.00 0.00 0.31 0.00 0.00 61.69 61.55 3h4h s THR 103 Cb -0.10 -2.12 0.00 0.00 0.01 0.00 0.00 72.50 70.29 3h4h s THR 103 CO 0.33 0.46 0.00 0.61 -0.69 0.00 0.00 174.62 175.32 3h4h n GLY 104 N 4.67 3.15 4.03 4.40 0.00 -1.26 -4.96 105.19 115.21 3h4h n GLY 104 Ca -0.20 -1.90 -0.30 0.00 0.00 0.00 0.00 46.02 43.62 3h4h n GLY 104 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h4h n ALA 105 N -0.60 -1.61 -3.64 4.61 0.00 -1.26 -1.04 120.51 116.97 3h4h n ALA 105 Ca 0.00 -0.08 -0.24 0.00 0.00 0.00 0.00 53.44 53.12 3h4h n ALA 105 Cb 0.00 -2.78 0.07 0.00 0.00 0.00 0.00 19.45 16.74 3h4h n ALA 105 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3h4h n LEU 106 N -4.44 -3.32 -0.07 0.00 4.77 -1.26 -1.09 117.00 111.59 3h4h n LEU 106 Ca -0.11 -0.61 -0.01 0.00 -0.03 0.00 0.00 56.01 55.25 3h4h n LEU 106 Cb 0.59 -2.94 -0.00 0.00 -2.33 0.00 0.00 43.42 38.73 3h4h n LEU 106 CO 0.79 0.58 -0.01 0.61 -1.33 0.00 0.00 177.39 178.02 3h4h n GLY 107 N -1.82 0.45 0.00 -0.72 0.00 -0.20 -2.17 105.19 100.73 3h4h n GLY 107 Ca -0.04 -0.15 0.00 0.00 0.00 0.00 0.00 46.02 45.84 3h4h n GLY 107 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3h4h n GLY 108 N -2.05 1.97 0.36 -0.02 0.00 -0.25 -0.82 105.19 104.39 3h4h n GLY 108 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3h4h n GLY 108 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3h4h h GLY 109 N 0.00 1.22 2.00 -0.02 0.00 -0.35 -1.65 103.07 104.28 3h4h h GLY 109 Ca 0.00 -0.44 0.00 0.00 0.00 0.00 0.00 47.33 46.89 3h4h h GLY 109 CO 0.00 0.41 0.00 -1.33 0.00 0.00 0.00 176.54 175.62 3h4h h GLY 110 N 1.13 0.00 -0.57 4.60 0.00 -1.42 -3.08 103.07 103.73 3h4h h GLY 110 Ca 0.33 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.66 3h4h h GLY 110 CO -0.08 0.00 -0.25 1.04 0.00 0.00 0.00 176.54 177.25 3h4h n LEU 111 N -2.48 1.38 -0.18 3.11 4.77 -0.65 -4.69 117.00 118.26 3h4h n LEU 111 Ca 0.01 -0.77 0.08 0.00 -0.03 0.00 0.00 56.01 55.30 3h4h n LEU 111 Cb 0.22 0.00 0.11 0.00 -2.33 0.00 0.00 43.42 41.42 3h4h n LEU 111 CO 0.21 0.27 0.49 0.35 -1.33 0.00 0.00 177.39 177.38 3h4h n THR 112 N -0.19 1.46 -2.22 -5.08 -2.24 -1.03 -4.95 114.28 100.04 3h4h n THR 112 Ca 0.05 -1.77 -0.43 0.00 -2.27 0.00 0.00 64.05 59.63 3h4h n THR 112 Cb 0.26 -0.07 -0.02 0.00 -2.10 0.00 0.00 70.33 68.40 3h4h n THR 112 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 3h4h s GLU 113 N -2.22 3.59 -0.12 -0.78 2.56 -1.25 -4.19 118.70 116.29 3h4h s GLU 113 Ca 0.25 1.23 0.03 0.00 0.00 0.00 0.00 54.97 56.48 3h4h s GLU 113 Cb 0.22 -4.06 0.01 0.00 2.00 0.00 0.00 34.13 32.30 3h4h s GLU 113 CO 0.02 -1.54 -0.20 0.96 -0.56 0.00 0.00 175.26 173.94 3h4h s ILE 114 N 5.65 1.86 0.71 -3.70 -4.36 0.10 -4.97 121.20 116.49 3h4h s ILE 114 Ca 0.67 -0.87 -0.11 0.00 -0.26 0.00 0.00 60.65 60.08 3h4h s ILE 114 Cb -0.18 -1.64 0.02 0.00 1.25 0.00 0.00 42.46 41.90 3h4h s ILE 114 CO 0.31 0.51 1.08 0.20 0.24 0.00 0.00 174.94 177.28 3h4h s ASN 115 N 0.74 5.36 0.17 4.36 0.02 -1.26 -1.66 114.94 122.66 3h4h s ASN 115 Ca -0.10 1.32 -0.34 0.00 -1.02 0.00 0.00 52.86 52.72 3h4h s ASN 115 Cb -0.16 -2.17 -0.15 0.00 0.02 0.00 0.00 41.25 38.79 3h4h s ASN 115 CO 0.01 -1.42 1.36 -2.65 0.02 0.00 0.00 177.10 174.42 3h4h n PRO 116 N -3.08 1.60 -0.25 -0.60 -0.02 -1.26 -1.11 135.00 130.29 3h4h n PRO 116 Ca 0.07 0.57 0.00 0.00 -2.02 0.00 0.00 63.50 62.12 3h4h n PRO 116 Cb 0.56 -2.21 0.00 0.00 -0.02 0.00 0.00 33.50 31.83 3h4h n PRO 116 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3h4h n GLY 117 N 2.48 0.74 3.42 -1.23 0.00 0.32 -4.71 105.19 106.21 3h4h n GLY 117 Ca 0.15 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.94 3h4h n GLY 117 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3h4h s GLU 118 N -0.75 1.53 0.22 1.61 2.02 -0.27 -4.91 118.70 118.14 3h4h s GLU 118 Ca 0.00 -1.65 -0.00 0.00 0.02 0.00 0.00 54.97 53.34 3h4h s GLU 118 Cb 0.00 -1.58 -0.04 0.00 0.10 0.00 0.00 34.13 32.61 3h4h s GLU 118 CO 0.00 0.30 0.11 -1.59 0.02 0.00 0.00 175.26 174.10 3h4h s LYS 119 N -3.34 1.28 0.11 1.61 -2.85 -1.26 -0.94 119.74 114.35 3h4h s LYS 119 Ca 0.25 -1.68 -0.15 0.00 -1.00 0.00 0.00 55.97 53.39 3h4h s LYS 119 Cb -0.04 0.05 0.03 0.00 -2.06 0.00 0.00 37.83 35.80 3h4h s LYS 119 CO 0.11 -0.34 0.38 -0.08 0.10 0.00 0.00 175.35 175.52 3h4h s THR 120 N -3.99 0.08 -0.11 3.79 -1.32 -0.35 -5.00 115.64 108.74 3h4h s THR 120 Ca 0.38 -0.63 -0.00 0.00 -1.21 0.00 0.00 61.69 60.23 3h4h s THR 120 Cb 0.07 -1.16 0.02 0.00 -1.51 0.00 0.00 72.50 69.93 3h4h s THR 120 CO 0.12 -0.35 -0.07 -0.63 -2.21 0.00 0.00 174.62 171.48 3h4h s ILE 121 N -3.68 0.99 -0.10 5.08 1.01 -1.26 -0.62 121.20 122.62 3h4h s ILE 121 Ca 0.02 -0.28 0.00 0.00 0.00 0.00 0.00 60.65 60.40 3h4h s ILE 121 Cb 0.02 -1.01 -0.02 0.00 0.01 0.00 0.00 42.46 41.46 3h4h s ILE 121 CO -0.11 0.36 -0.10 -0.22 0.00 0.00 0.00 174.94 174.87 3h4h s LEU 122 N 1.64 2.92 -0.05 2.97 2.96 -0.27 -4.97 118.68 123.88 3h4h s LEU 122 Ca 0.03 -0.20 0.05 0.00 -0.22 0.00 0.00 54.13 53.80 3h4h s LEU 122 Cb -0.13 -1.65 -0.02 0.00 0.50 0.00 0.00 46.19 44.89 3h4h s LEU 122 CO -0.07 0.25 -0.19 -0.60 -1.32 0.00 0.00 176.35 174.42 3h4h s ARG 123 N -0.12 2.45 0.04 1.98 3.52 -1.26 -0.70 118.95 124.85 3h4h s ARG 123 Ca -0.00 -0.79 -0.03 0.00 -0.13 0.00 0.00 55.73 54.79 3h4h s ARG 123 Cb -0.13 -2.27 -0.02 0.00 -1.56 0.00 0.00 34.95 30.96 3h4h s ARG 123 CO 0.03 0.55 0.03 -0.59 -0.81 0.00 0.00 175.30 174.51 3h4h s PHE 124 N -0.56 0.31 -0.11 5.12 -0.12 -0.53 -5.00 117.98 117.09 3h4h s PHE 124 Ca 0.08 -0.67 -0.24 0.00 -0.05 0.00 0.00 56.93 56.05 3h4h s PHE 124 Cb -0.11 -0.22 -0.03 0.00 -0.63 0.00 0.00 43.02 42.03 3h4h s PHE 124 CO 0.01 -0.32 0.76 0.21 -0.05 0.00 0.00 175.22 175.83 3h4h s LYS 125 N -2.64 4.38 -1.27 1.99 2.20 -1.26 -0.99 119.74 122.14 3h4h s LYS 125 Ca -0.05 0.95 -0.15 0.00 -0.36 0.00 0.00 55.97 56.37 3h4h s LYS 125 Cb -0.01 -3.51 0.13 0.00 -1.51 0.00 0.00 37.83 32.93 3h4h s LYS 125 CO -0.05 -0.12 1.66 0.00 -0.36 0.00 0.00 175.35 176.49 3h4h n ALA 126 N 4.43 4.11 0.50 3.13 0.00 -0.26 -4.73 120.51 127.69 3h4h n ALA 126 Ca 0.01 -4.09 0.13 0.00 0.00 0.00 0.00 53.44 49.49 3h4h n ALA 126 Cb 0.50 -3.27 0.40 0.00 0.00 0.00 0.00 19.45 17.09 3h4h n ALA 126 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 3h4h h THR 127 N 4.78 0.00 -3.32 0.00 1.35 -1.85 0.20 112.91 114.07 3h4h h THR 127 Ca 0.39 -0.50 -0.57 0.00 -0.55 0.00 0.00 66.41 65.18 3h4h h THR 127 Cb 0.82 1.45 -0.34 0.00 -1.73 0.00 0.00 68.15 68.35 3h4h h THR 127 CO 1.42 0.00 -0.83 -0.54 -0.25 0.00 0.00 175.52 175.32 3h4h s LYS 128 N -3.19 2.09 0.12 4.72 1.02 -1.26 -4.74 119.74 118.50 3h4h s LYS 128 Ca 0.08 -0.52 -0.26 0.00 0.02 0.00 0.00 55.97 55.29 3h4h s LYS 128 Cb 0.10 -1.75 -0.07 0.00 -0.52 0.00 0.00 37.83 35.59 3h4h s LYS 128 CO 0.56 -0.02 0.79 -1.25 -0.92 0.00 0.00 175.35 174.51 3h4h s PRO 129 N 0.87 4.56 0.00 -1.68 0.04 -1.26 -4.80 135.00 132.73 3h4h s PRO 129 Ca -0.10 1.16 0.00 0.00 0.04 0.00 0.00 61.00 62.10 3h4h s PRO 129 Cb -0.15 -3.31 0.00 0.00 0.04 0.00 0.00 34.50 31.08 3h4h s PRO 129 CO 0.01 0.44 0.00 0.41 0.04 0.00 0.00 177.00 177.89 3h4h n GLY 130 N 1.94 -0.71 3.86 0.56 0.00 0.35 -1.94 105.19 109.24 3h4h n GLY 130 Ca -0.04 -1.38 -0.37 0.00 0.00 0.00 0.00 46.02 44.23 3h4h n GLY 130 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3h4h s VAL 131 N -1.92 5.35 -0.01 1.61 -7.23 0.83 0.43 120.40 119.46 3h4h s VAL 131 Ca 0.00 0.42 -0.02 0.00 -1.81 0.00 0.00 61.98 60.57 3h4h s VAL 131 Cb 0.00 -3.51 -0.00 0.00 0.56 0.00 0.00 36.38 33.43 3h4h s VAL 131 CO 0.00 0.59 0.04 -0.36 -0.31 0.00 0.00 175.10 175.07 3h4h s PHE 132 N -0.96 0.02 0.54 2.82 0.08 -0.01 -4.47 117.98 116.00 3h4h s PHE 132 Ca 0.18 -0.03 -0.19 0.00 0.12 0.00 0.00 56.93 57.00 3h4h s PHE 132 Cb -0.13 -0.03 -0.06 0.00 -0.57 0.00 0.00 43.02 42.22 3h4h s PHE 132 CO 0.07 -0.09 1.13 0.08 -0.10 0.00 0.00 175.22 176.31 3h4h s VAL 133 N -0.43 3.15 0.11 -0.44 1.01 -1.26 -0.60 120.40 121.93 3h4h s VAL 133 Ca -0.05 0.72 0.07 0.00 0.00 0.00 0.00 61.98 62.72 3h4h s VAL 133 Cb -0.03 -3.29 -0.04 0.00 0.00 0.00 0.00 36.38 33.02 3h4h s VAL 133 CO -0.00 -0.15 -0.17 -0.72 0.00 0.00 0.00 175.10 174.06 3h4h s TYR 134 N -1.76 1.52 0.11 5.22 -0.85 -0.64 -1.47 117.35 119.48 3h4h s TYR 134 Ca 0.73 -0.48 -0.24 0.00 -0.52 0.00 0.00 57.07 56.56 3h4h s TYR 134 Cb -0.24 -0.81 0.07 0.00 0.38 0.00 0.00 41.96 41.35 3h4h s TYR 134 CO 0.27 0.16 0.59 -3.38 -1.52 0.00 0.00 175.55 171.68 3h4h s HIS 135 N -1.63 -0.53 0.56 -3.49 -3.43 -0.26 -0.64 115.29 105.87 3h4h s HIS 135 Ca 0.06 0.47 -0.18 0.00 -0.80 0.00 0.00 55.06 54.61 3h4h s HIS 135 Cb -0.08 0.49 -0.05 0.00 -1.43 0.00 0.00 32.58 31.51 3h4h s HIS 135 CO 0.04 -0.77 1.08 0.00 -2.00 0.00 0.00 174.74 173.08 3h4h n ALA 137 N -1.58 -0.84 -2.23 0.00 0.00 -1.26 -4.44 120.51 110.16 3h4h n ALA 137 Ca 0.10 -1.66 -0.42 0.00 0.00 0.00 0.00 53.44 51.46 3h4h n ALA 137 Cb 0.52 -1.25 -0.03 0.00 0.00 0.00 0.00 19.45 18.69 3h4h n ALA 137 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 3h4h s PRO 138 N 0.36 4.46 -0.00 0.00 0.02 -1.26 -4.84 135.00 133.73 3h4h s PRO 138 Ca 0.31 1.84 -0.37 0.00 0.02 0.00 0.00 61.00 62.80 3h4h s PRO 138 Cb 0.24 -3.29 -0.16 0.00 0.02 0.00 0.00 34.50 31.31 3h4h s PRO 138 CO -0.20 -0.18 1.50 -2.30 -0.33 0.00 0.00 177.00 175.49 3h4h n PRO 139 N 3.26 1.34 -0.03 5.54 -0.02 -1.26 -1.04 135.00 142.79 3h4h n PRO 139 Ca 0.07 0.49 0.00 0.00 -2.02 0.00 0.00 63.50 62.03 3h4h n PRO 139 Cb 0.45 -2.17 0.00 0.00 -0.02 0.00 0.00 33.50 31.77 3h4h n PRO 139 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3h4h n GLY 140 N 3.15 1.26 2.19 -1.23 0.00 -1.26 -4.81 105.19 104.50 3h4h n GLY 140 Ca 0.20 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.24 3h4h n GLY 140 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 3h4h n MET 141 N -2.00 0.91 0.46 1.61 2.81 -0.20 -4.98 117.12 115.72 3h4h n MET 141 Ca 0.00 -2.79 -0.19 0.00 -1.81 0.00 0.00 57.70 52.91 3h4h n MET 141 Cb 0.00 -0.84 -0.09 0.00 -0.71 0.00 0.00 33.22 31.58 3h4h n MET 141 CO 0.00 0.00 0.00 0.28 1.51 0.00 0.00 175.97 177.76 3h4h h VAL 142 N 6.26 0.07 -0.21 2.03 2.07 -1.83 -2.93 116.25 121.71 3h4h h VAL 142 Ca -0.18 -0.08 -0.02 0.00 0.82 0.00 0.00 66.70 67.24 3h4h h VAL 142 Cb 1.57 0.08 -0.01 0.00 -1.52 0.00 0.00 31.29 31.41 3h4h h VAL 142 CO 0.14 0.00 0.06 1.55 0.02 0.00 0.00 177.57 179.34 3h4h h PRO 143 N -1.25 0.30 -0.81 1.57 0.13 -1.92 -2.35 132.00 127.67 3h4h h PRO 143 Ca -0.12 -0.03 -0.02 0.00 -0.87 0.00 0.00 66.00 64.95 3h4h h PRO 143 Cb 0.91 -0.06 -0.04 0.00 0.13 0.00 0.00 31.00 31.94 3h4h h PRO 143 CO 0.20 0.28 0.42 2.35 -0.23 0.00 0.00 178.00 181.01 3h4h h TRP 144 N 0.30 1.14 -0.29 1.56 7.01 -1.94 0.92 115.95 124.64 3h4h h TRP 144 Ca 0.07 -0.04 -0.13 0.00 2.11 0.00 0.00 58.89 60.91 3h4h h TRP 144 Cb 0.11 -0.36 -0.00 0.00 -2.10 0.00 0.00 29.16 26.81 3h4h h TRP 144 CO 0.00 0.81 -0.31 0.45 -2.79 0.00 0.00 178.44 176.59 3h4h h HIS 145 N 1.15 0.88 -0.10 2.65 3.86 -1.26 -2.17 115.15 120.17 3h4h h HIS 145 Ca 0.28 -0.27 -0.00 0.00 -1.16 0.00 0.00 60.37 59.22 3h4h h HIS 145 Cb 0.07 -0.18 -0.00 0.00 1.06 0.00 0.00 27.41 28.35 3h4h h HIS 145 CO 0.01 1.03 0.04 0.28 0.86 0.00 0.00 177.93 180.15 3h4h h VAL 146 N 0.48 1.13 0.00 2.45 2.07 -0.91 -2.35 116.25 119.13 3h4h h VAL 146 Ca 0.04 -0.38 0.00 0.00 0.82 0.00 0.00 66.70 67.18 3h4h h VAL 146 Cb 0.89 1.21 0.00 0.00 -1.52 0.00 0.00 31.29 31.87 3h4h h VAL 146 CO 0.08 0.11 0.00 1.33 0.02 0.00 0.00 177.57 179.11 3h4h n VAL 147 N -4.94 0.03 0.95 2.57 0.24 0.25 -1.54 118.33 115.89 3h4h n VAL 147 Ca -0.06 0.01 0.06 0.00 -2.04 0.00 0.00 64.34 62.31 3h4h n VAL 147 Cb 0.10 -0.52 0.18 0.00 -1.47 0.00 0.00 33.84 32.13 3h4h n VAL 147 CO 0.00 0.00 0.00 -1.20 -2.14 0.00 0.00 176.83 173.49 3h4h n SER 148 N -1.22 1.81 0.00 -1.34 7.64 -0.82 -4.60 113.62 115.09 3h4h n SER 148 Ca 0.16 -1.97 0.00 0.00 1.01 0.00 0.00 58.87 58.07 3h4h n SER 148 Cb 0.21 -0.22 0.00 0.00 -1.01 0.00 0.00 64.21 63.19 3h4h n SER 148 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3h4h n GLY 149 N 1.05 0.92 2.73 0.23 0.00 -0.59 -1.39 105.19 108.14 3h4h n GLY 149 Ca 0.12 -0.02 -0.42 0.00 0.00 0.00 0.00 46.02 45.70 3h4h n GLY 149 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 3h4h n MET 150 N -2.16 3.84 -3.52 1.61 0.00 -0.92 -4.54 117.12 111.44 3h4h n MET 150 Ca 0.00 -3.39 -0.13 0.00 0.00 0.00 0.00 57.70 54.18 3h4h n MET 150 Cb 0.00 -2.86 -0.04 0.00 0.00 0.00 0.00 33.22 30.32 3h4h n MET 150 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 175.97 176.51 3h4h s ASN 151 N 0.92 -0.49 0.00 6.12 2.20 -1.26 -1.03 114.94 121.39 3h4h s ASN 151 Ca 0.45 0.13 0.00 0.00 -0.94 0.00 0.00 52.86 52.50 3h4h s ASN 151 Cb 0.13 0.53 0.00 0.00 -2.00 0.00 0.00 41.25 39.91 3h4h s ASN 151 CO -0.03 -0.81 0.00 0.61 -2.94 0.00 0.00 177.10 173.93 3h4h n GLY 152 N 0.12 3.44 3.32 0.45 0.00 0.19 -0.67 105.19 112.05 3h4h n GLY 152 Ca -0.18 -0.63 -0.10 0.00 0.00 0.00 0.00 46.02 45.12 3h4h n GLY 152 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h4h s ALA 153 N -1.09 -0.42 0.23 4.61 0.00 -1.26 -1.62 121.76 122.21 3h4h s ALA 153 Ca 0.00 -0.51 0.07 0.00 0.00 0.00 0.00 51.96 51.52 3h4h s ALA 153 Cb 0.00 0.71 -0.05 0.00 0.00 0.00 0.00 23.12 23.78 3h4h s ALA 153 CO 0.00 -0.63 -0.11 0.96 0.00 0.00 0.00 175.76 175.99 3h4h s ILE 154 N -3.88 1.66 -0.10 0.00 -4.36 0.23 -2.88 121.20 111.86 3h4h s ILE 154 Ca 0.09 -2.17 0.02 0.00 -0.26 0.00 0.00 60.65 58.33 3h4h s ILE 154 Cb 0.03 -2.20 0.01 0.00 1.25 0.00 0.00 42.46 41.55 3h4h s ILE 154 CO -0.06 -0.48 -0.16 -0.32 0.24 0.00 0.00 174.94 174.15 3h4h s MET 155 N -3.69 2.29 -0.50 0.37 -2.45 0.31 -0.83 119.30 114.80 3h4h s MET 155 Ca 0.25 -0.60 -0.07 0.00 -1.25 0.00 0.00 55.69 54.02 3h4h s MET 155 Cb 0.01 -1.89 0.13 0.00 1.25 0.00 0.00 34.83 34.33 3h4h s MET 155 CO 0.09 -0.01 0.35 0.08 1.05 0.00 0.00 175.02 176.58 3h4h s VAL 156 N 0.83 4.02 0.42 10.11 1.01 0.17 -1.28 120.40 135.68 3h4h s VAL 156 Ca -0.10 -2.05 -0.23 0.00 0.00 0.00 0.00 61.98 59.60 3h4h s VAL 156 Cb -0.16 -3.65 -0.09 0.00 0.00 0.00 0.00 36.38 32.48 3h4h s VAL 156 CO 0.01 -0.79 1.04 -0.76 0.00 0.00 0.00 175.10 174.60 3h4h s LEU 157 N 1.04 4.07 0.72 3.92 1.43 0.01 -0.49 118.68 129.38 3h4h s LEU 157 Ca 0.09 1.99 -0.16 0.00 -1.03 0.00 0.00 54.13 55.02 3h4h s LEU 157 Cb -0.24 -4.28 0.03 0.00 0.03 0.00 0.00 46.19 41.74 3h4h s LEU 157 CO -0.02 -0.54 1.26 -2.84 0.23 0.00 0.00 176.35 174.43 3h4h s PRO 158 N -2.68 2.13 0.46 1.29 0.02 -1.26 -0.73 135.00 134.23 3h4h s PRO 158 Ca 0.60 1.93 0.12 0.00 0.02 0.00 0.00 61.00 63.67 3h4h s PRO 158 Cb -0.20 -1.81 1.06 0.00 0.02 0.00 0.00 34.50 33.57 3h4h s PRO 158 CO 0.25 -1.89 2.08 0.00 -0.33 0.00 0.00 177.00 177.12 3h4h h ARG 159 N -0.12 0.21 -0.29 5.54 3.08 -1.89 -0.19 114.38 120.72 3h4h h ARG 159 Ca -0.49 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 59.54 3h4h h ARG 159 Cb 1.32 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 31.33 3h4h h ARG 159 CO 0.50 0.17 0.00 0.39 -1.07 0.00 0.00 179.97 179.96 3h4h n GLU 160 N -4.48 1.79 -0.12 0.04 -0.58 -1.26 0.49 120.64 116.52 3h4h n GLU 160 Ca -0.01 -1.22 0.02 0.00 -0.42 0.00 0.00 57.16 55.53 3h4h n GLU 160 Cb 0.11 -1.32 -0.00 0.00 -0.57 0.00 0.00 31.44 29.66 3h4h n GLU 160 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3h4h n GLY 161 N 1.09 -2.05 3.79 0.62 0.00 -0.09 -4.72 105.19 103.84 3h4h n GLY 161 Ca 0.13 -1.41 -0.34 0.00 0.00 0.00 0.00 46.02 44.40 3h4h n GLY 161 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3h4h s LEU 162 N 0.00 3.81 0.03 0.99 1.43 -1.26 -4.46 118.68 119.22 3h4h s LEU 162 Ca 0.00 1.98 -0.02 0.00 -1.03 0.00 0.00 54.13 55.06 3h4h s LEU 162 Cb 0.00 -4.56 -0.02 0.00 0.03 0.00 0.00 46.19 41.64 3h4h s LEU 162 CO 0.00 -0.89 0.02 -1.00 0.23 0.00 0.00 176.35 174.71 3h4h s HIS 163 N -1.95 0.28 0.15 0.29 3.76 -1.26 -0.99 115.29 115.58 3h4h s HIS 163 Ca 0.68 -0.60 -0.02 0.00 -0.15 0.00 0.00 55.06 54.97 3h4h s HIS 163 Cb -0.18 -0.21 0.03 0.00 1.11 0.00 0.00 32.58 33.34 3h4h s HIS 163 CO 0.22 -0.29 0.21 -0.40 -0.85 0.00 0.00 174.74 173.63 3h4h n ASP 164 N 1.04 0.04 0.11 1.40 3.85 -0.01 -4.82 116.55 118.16 3h4h n ASP 164 Ca -0.20 -1.09 0.10 0.00 -0.71 0.00 0.00 54.79 52.89 3h4h n ASP 164 Cb 0.57 -0.16 0.45 0.00 -1.35 0.00 0.00 41.12 40.64 3h4h n ASP 164 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 3h4h n GLY 165 N 3.61 -1.13 0.86 6.12 0.00 -1.26 -1.97 105.19 111.42 3h4h n GLY 165 Ca 0.03 0.08 0.09 0.00 0.00 0.00 0.00 46.02 46.21 3h4h n GLY 165 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3h4h n LYS 166 N -2.08 2.17 -1.00 1.61 5.02 -1.26 -4.97 118.16 117.65 3h4h n LYS 166 Ca 0.02 -1.99 -0.00 0.00 -2.02 0.00 0.00 58.31 54.32 3h4h n LYS 166 Cb 0.18 -1.38 -0.00 0.00 -0.02 0.00 0.00 35.03 33.80 3h4h n LYS 166 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3h4h n GLY 167 N 1.04 0.47 3.71 0.72 0.00 -0.83 -5.02 105.19 105.29 3h4h n GLY 167 Ca 0.15 -0.17 -0.42 0.00 0.00 0.00 0.00 46.02 45.58 3h4h n GLY 167 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3h4h s LYS 168 N -0.42 4.54 0.19 1.61 -0.14 -1.26 -4.77 119.74 119.48 3h4h s LYS 168 Ca 0.00 1.53 -0.33 0.00 -1.36 0.00 0.00 55.97 55.82 3h4h s LYS 168 Cb 0.00 -3.41 -0.15 0.00 -1.68 0.00 0.00 37.83 32.59 3h4h s LYS 168 CO 0.00 -0.08 1.36 0.00 -0.76 0.00 0.00 175.35 175.87 3h4h n ALA 169 N 3.74 0.35 -3.80 5.17 0.00 -1.26 -0.83 120.51 123.89 3h4h n ALA 169 Ca 0.06 0.45 -0.34 0.00 0.00 0.00 0.00 53.44 53.61 3h4h n ALA 169 Cb 0.49 -2.19 -0.15 0.00 0.00 0.00 0.00 19.45 17.60 3h4h n ALA 169 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3h4h s LEU 170 N 0.45 3.12 -0.20 0.00 1.43 -0.16 -4.79 118.68 118.54 3h4h s LEU 170 Ca 0.74 -0.91 0.01 0.00 -1.03 0.00 0.00 54.13 52.94 3h4h s LEU 170 Cb -0.75 -1.63 0.03 0.00 0.03 0.00 0.00 46.19 43.86 3h4h s LEU 170 CO 0.48 -0.12 -0.18 -0.89 0.23 0.00 0.00 176.35 175.87 3h4h s THR 171 N 1.30 2.15 0.30 5.49 2.01 -1.26 -4.07 115.64 121.56 3h4h s THR 171 Ca -0.00 -1.03 -0.15 0.00 0.31 0.00 0.00 61.69 60.81 3h4h s THR 171 Cb -0.17 -1.97 -0.09 0.00 0.01 0.00 0.00 72.50 70.29 3h4h s THR 171 CO -0.05 0.44 0.71 -0.72 -0.69 0.00 0.00 174.62 174.31 3h4h s TYR 172 N 1.27 3.41 0.02 4.92 -0.85 -1.26 -4.84 117.35 120.02 3h4h s TYR 172 Ca 0.03 1.20 0.07 0.00 -0.52 0.00 0.00 57.07 57.85 3h4h s TYR 172 Cb -0.14 -2.52 -0.23 0.00 0.38 0.00 0.00 41.96 39.45 3h4h s TYR 172 CO -0.11 0.15 0.92 -0.44 -1.52 0.00 0.00 175.55 174.54 3h4h h ASP 173 N 2.45 0.09 -5.20 -0.18 3.32 -0.52 -3.48 116.42 112.88 3h4h h ASP 173 Ca -0.48 -0.13 -0.09 0.00 0.02 0.00 0.00 57.03 56.36 3h4h h ASP 173 Cb 1.18 -0.03 -0.13 0.00 0.22 0.00 0.00 39.33 40.57 3h4h h ASP 173 CO 0.66 1.11 -0.28 -1.59 -1.72 0.00 0.00 179.24 177.42 3h4h s LYS 174 N -2.64 1.10 -0.00 3.56 -2.85 -1.05 -5.01 119.74 112.84 3h4h s LYS 174 Ca -0.04 -1.05 0.02 0.00 -1.00 0.00 0.00 55.97 53.89 3h4h s LYS 174 Cb 0.08 0.39 -0.00 0.00 -2.06 0.00 0.00 37.83 36.24 3h4h s LYS 174 CO 0.83 -0.40 -0.05 -1.50 0.10 0.00 0.00 175.35 174.32 3h4h s ILE 175 N -3.92 0.42 0.09 3.79 2.07 -1.26 -1.43 121.20 120.96 3h4h s ILE 175 Ca 0.12 -0.26 0.07 0.00 -1.41 0.00 0.00 60.65 59.17 3h4h s ILE 175 Cb 0.03 -0.36 -0.03 0.00 0.13 0.00 0.00 42.46 42.23 3h4h s ILE 175 CO -0.04 0.10 -0.18 -0.31 -1.91 0.00 0.00 174.94 172.60 3h4h s TYR 176 N -0.17 1.54 -0.26 3.50 2.02 -0.33 -4.52 117.35 119.13 3h4h s TYR 176 Ca 0.02 -0.44 0.00 0.00 -0.37 0.00 0.00 57.07 56.28 3h4h s TYR 176 Cb -0.02 -0.85 0.05 0.00 -0.40 0.00 0.00 41.96 40.74 3h4h s TYR 176 CO -0.00 0.15 -0.08 -0.47 -1.57 0.00 0.00 175.55 173.58 3h4h s TYR 177 N -1.28 3.17 -0.42 2.71 5.04 0.31 -1.17 117.35 125.72 3h4h s TYR 177 Ca 0.03 -1.97 -0.15 0.00 -2.44 0.00 0.00 57.07 52.55 3h4h s TYR 177 Cb -0.10 -2.01 0.03 0.00 0.35 0.00 0.00 41.96 40.24 3h4h s TYR 177 CO 0.03 -0.82 0.32 0.08 -1.34 0.00 0.00 175.55 173.82 3h4h s VAL 178 N 1.21 5.24 -0.17 3.14 1.01 0.57 -4.16 120.40 127.24 3h4h s VAL 178 Ca -0.05 -0.74 -0.16 0.00 0.00 0.00 0.00 61.98 61.03 3h4h s VAL 178 Cb -0.18 -3.96 -0.04 0.00 0.00 0.00 0.00 36.38 32.20 3h4h s VAL 178 CO -0.05 -0.36 0.40 -0.83 0.00 0.00 0.00 175.10 174.27 3h4h s GLY 179 N 1.85 2.19 -0.18 4.51 0.00 -1.26 -2.07 107.32 112.36 3h4h s GLY 179 Ca 0.05 -0.41 -0.08 0.00 0.00 0.00 0.00 44.72 44.28 3h4h s GLY 179 CO 0.09 0.74 0.07 1.85 0.00 0.00 0.00 173.10 175.85 3h4h s GLU 180 N 0.96 3.96 -0.13 2.90 2.12 -0.44 -1.68 118.70 126.39 3h4h s GLU 180 Ca 0.21 -0.32 0.01 0.00 0.36 0.00 0.00 54.97 55.23 3h4h s GLU 180 Cb -0.14 -3.23 0.02 0.00 0.26 0.00 0.00 34.13 31.03 3h4h s GLU 180 CO 0.08 0.31 -0.15 -1.14 -0.54 0.00 0.00 175.26 173.82 3h4h s GLN 181 N 0.27 2.31 -0.20 4.30 2.00 0.94 -4.51 119.66 124.78 3h4h s GLN 181 Ca 0.04 -0.58 -0.23 0.00 -2.00 0.00 0.00 55.36 52.59 3h4h s GLN 181 Cb -0.12 -2.03 -0.02 0.00 0.80 0.00 0.00 33.01 31.64 3h4h s GLN 181 CO -0.00 -0.14 0.74 0.16 -0.50 0.00 0.00 175.29 175.54 3h4h s ASP 182 N 1.22 6.80 0.08 6.67 3.84 -1.26 -0.88 116.67 133.14 3h4h s ASP 182 Ca -0.01 0.98 0.06 0.00 -0.00 0.00 0.00 52.55 53.58 3h4h s ASP 182 Cb -0.14 -2.40 -0.04 0.00 -1.38 0.00 0.00 42.92 38.96 3h4h s ASP 182 CO -0.06 -0.36 -0.06 -0.36 -0.00 0.00 0.00 175.17 174.33 3h4h s PHE 183 N 2.17 2.85 -0.46 2.11 0.08 -0.14 -4.75 117.98 119.83 3h4h s PHE 183 Ca 0.33 -0.09 0.03 0.00 0.12 0.00 0.00 56.93 57.31 3h4h s PHE 183 Cb -0.16 -1.49 0.14 0.00 -0.57 0.00 0.00 43.02 40.93 3h4h s PHE 183 CO 0.11 0.44 0.25 0.71 -0.10 0.00 0.00 175.22 176.62 3h4h s TYR 184 N -1.22 2.29 -0.25 0.36 1.51 -1.26 -0.91 117.35 117.87 3h4h s TYR 184 Ca 0.22 -2.62 -0.10 0.00 -1.01 0.00 0.00 57.07 53.56 3h4h s TYR 184 Cb -0.11 -2.12 -0.04 0.00 -0.11 0.00 0.00 41.96 39.58 3h4h s TYR 184 CO 0.14 -0.77 0.14 0.08 -1.11 0.00 0.00 175.55 174.04 3h4h s VAL 185 N 0.16 4.99 0.55 0.71 1.01 -1.26 -4.79 120.40 121.77 3h4h s VAL 185 Ca 0.18 0.06 -0.21 0.00 0.00 0.00 0.00 61.98 62.00 3h4h s VAL 185 Cb -0.24 -3.35 -0.05 0.00 0.00 0.00 0.00 36.38 32.75 3h4h s VAL 185 CO -0.00 0.31 1.34 -2.84 0.00 0.00 0.00 175.10 173.91 3h4h s PRO 186 N 1.46 3.13 0.15 2.72 0.02 -1.26 -4.88 135.00 136.34 3h4h s PRO 186 Ca 0.07 2.18 0.10 0.00 0.02 0.00 0.00 61.00 63.37 3h4h s PRO 186 Cb -0.15 -2.22 -0.04 0.00 0.02 0.00 0.00 34.50 32.10 3h4h s PRO 186 CO 0.07 -1.19 -0.24 1.03 -0.33 0.00 0.00 177.00 176.35 3h4h s ARG 187 N -2.94 1.38 1.04 5.54 0.52 -1.26 -1.14 118.95 122.09 3h4h s ARG 187 Ca 0.72 -1.39 -0.17 0.00 -0.52 0.00 0.00 55.73 54.36 3h4h s ARG 187 Cb -0.39 -1.72 0.24 0.00 0.52 0.00 0.00 34.95 33.60 3h4h s ARG 187 CO 0.46 0.39 1.28 0.16 0.02 0.00 0.00 175.30 177.61 3h4h s ASP 188 N -2.35 2.38 0.21 0.23 1.47 0.17 -4.86 116.67 113.92 3h4h s ASP 188 Ca 0.16 0.29 0.20 0.00 1.18 0.00 0.00 52.55 54.38 3h4h s ASP 188 Cb -0.09 -0.33 0.89 0.00 -0.34 0.00 0.00 42.92 43.06 3h4h s ASP 188 CO 0.07 -3.19 1.61 -1.84 0.68 0.00 0.00 175.17 172.50 3h4h n GLU 189 N -4.08 0.14 0.00 2.11 0.28 -1.26 -1.60 120.64 116.23 3h4h n GLU 189 Ca 0.16 0.44 0.13 0.00 -0.16 0.00 0.00 57.16 57.73 3h4h n GLU 189 Cb 0.59 -1.80 0.39 0.00 1.43 0.00 0.00 31.44 32.05 3h4h n GLU 189 CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06 3h4h n ASN 190 N -2.07 1.96 0.00 -1.84 3.02 -1.26 -4.94 115.26 110.13 3h4h n ASN 190 Ca 0.02 -1.65 0.00 0.00 -0.03 0.00 0.00 54.58 52.92 3h4h n ASN 190 Cb 0.17 0.01 0.00 0.00 -0.61 0.00 0.00 39.78 39.34 3h4h n ASN 190 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3h4h n GLY 191 N 1.23 0.73 3.75 7.41 0.00 -0.62 -5.04 105.19 112.64 3h4h n GLY 191 Ca 0.17 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.80 3h4h n GLY 191 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3h4h s LYS 192 N -0.37 4.35 0.25 1.61 3.01 -1.26 -4.81 119.74 122.53 3h4h s LYS 192 Ca 0.00 0.75 -0.30 0.00 -1.01 0.00 0.00 55.97 55.40 3h4h s LYS 192 Cb 0.00 -3.38 -0.11 0.00 -1.01 0.00 0.00 37.83 33.33 3h4h s LYS 192 CO 0.00 0.28 1.57 0.71 0.51 0.00 0.00 175.35 178.42 3h4h s TYR 193 N 0.11 2.87 0.41 3.18 1.51 -1.26 -0.65 117.35 123.53 3h4h s TYR 193 Ca 0.32 0.76 -0.22 0.00 -1.01 0.00 0.00 57.07 56.92 3h4h s TYR 193 Cb -0.18 -4.00 -0.11 0.00 -0.11 0.00 0.00 41.96 37.56 3h4h s TYR 193 CO 0.17 -3.46 0.95 0.15 -1.11 0.00 0.00 175.55 172.25 3h4h s LYS 194 N -0.03 4.29 0.08 -0.62 1.02 -0.29 -4.86 119.74 119.33 3h4h s LYS 194 Ca 0.65 1.16 0.08 0.00 0.02 0.00 0.00 55.97 57.88 3h4h s LYS 194 Cb -0.46 -2.29 -0.04 0.00 -0.52 0.00 0.00 37.83 34.52 3h4h s LYS 194 CO 0.43 0.03 -0.20 0.15 -0.92 0.00 0.00 175.35 174.83 3h4h s LYS 195 N -2.98 1.88 0.10 1.68 1.02 -1.26 -4.79 119.74 115.38 3h4h s LYS 195 Ca 0.60 -1.10 0.05 0.00 0.02 0.00 0.00 55.97 55.54 3h4h s LYS 195 Cb -0.11 -2.11 -0.03 0.00 -0.52 0.00 0.00 37.83 35.05 3h4h s LYS 195 CO 0.15 0.51 -0.14 0.71 -0.92 0.00 0.00 175.35 175.66 3h4h s TYR 196 N -1.01 1.30 0.04 3.18 2.02 -1.26 -5.08 117.35 116.54 3h4h s TYR 196 Ca 0.16 -0.52 -0.20 0.00 -0.37 0.00 0.00 57.07 56.14 3h4h s TYR 196 Cb -0.10 -0.70 -0.16 0.00 -0.40 0.00 0.00 41.96 40.60 3h4h s TYR 196 CO 0.07 0.09 1.29 0.93 -1.57 0.00 0.00 175.55 176.36 3h4h h GLU 197 N 3.85 0.41 -5.12 -0.62 5.08 -2.01 -3.46 114.58 112.71 3h4h h GLU 197 Ca -0.40 -0.26 -0.35 0.00 -1.00 0.00 0.00 59.36 57.35 3h4h h GLU 197 Cb 1.19 0.03 -0.16 0.00 0.50 0.00 0.00 28.75 30.31 3h4h h GLU 197 CO 0.46 0.86 -0.73 0.00 -1.00 0.00 0.00 179.01 178.61 3h4h s ALA 198 N -4.03 1.37 0.18 3.43 0.00 -1.26 -5.07 121.76 116.39 3h4h s ALA 198 Ca -0.14 -1.36 -0.14 0.00 0.00 0.00 0.00 51.96 50.32 3h4h s ALA 198 Cb 0.05 0.01 0.18 0.00 0.00 0.00 0.00 23.12 23.36 3h4h s ALA 198 CO 0.78 -0.03 1.69 -1.35 0.00 0.00 0.00 175.76 176.84 3h4h h PRO 199 N 3.16 0.13 -0.47 0.00 0.11 -1.95 -2.25 132.00 130.73 3h4h h PRO 199 Ca -0.37 -0.01 0.10 0.00 0.11 0.00 0.00 66.00 65.83 3h4h h PRO 199 Cb 1.19 -0.03 -0.02 0.00 0.11 0.00 0.00 31.00 32.25 3h4h h PRO 199 CO 0.58 0.09 0.32 0.78 -0.21 0.00 0.00 178.00 179.56 3h4h h GLY 200 N 0.13 0.24 1.30 -0.55 0.00 -2.00 -2.18 103.07 100.01 3h4h h GLY 200 Ca 0.24 -0.07 0.10 0.00 0.00 0.00 0.00 47.33 47.60 3h4h h GLY 200 CO -0.39 0.04 0.26 -0.55 0.00 0.00 0.00 176.54 175.90 3h4h h ASP 201 N 0.17 0.05 0.11 0.19 3.45 -1.82 -2.05 116.42 116.51 3h4h h ASP 201 Ca 0.22 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.68 3h4h h ASP 201 Cb 0.65 -0.01 0.00 0.00 -0.56 0.00 0.00 39.33 39.41 3h4h h ASP 201 CO -0.03 0.03 -0.12 0.00 -1.57 0.00 0.00 179.24 177.54 3h4h n ALA 202 N -2.59 2.81 0.32 3.45 0.00 -0.82 -4.60 120.51 119.09 3h4h n ALA 202 Ca 0.06 -0.42 -0.17 0.00 0.00 0.00 0.00 53.44 52.90 3h4h n ALA 202 Cb 0.41 -1.16 -0.09 0.00 0.00 0.00 0.00 19.45 18.61 3h4h n ALA 202 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.50 176.58 3h4h h TYR 203 N 1.77 -1.04 -0.33 0.00 5.03 -1.46 -0.23 116.97 120.69 3h4h h TYR 203 Ca 0.00 -0.01 0.00 0.00 2.58 0.00 0.00 58.73 61.31 3h4h h TYR 203 Cb 0.50 0.38 -0.02 0.00 1.55 0.00 0.00 36.73 39.14 3h4h h TYR 203 CO 0.00 -0.58 0.22 1.49 -1.32 0.00 0.00 178.16 177.97 3h4h h GLU 204 N -0.92 0.44 -0.46 1.82 4.81 -1.81 -1.09 114.58 117.37 3h4h h GLU 204 Ca -0.07 -0.03 -0.06 0.00 -0.13 0.00 0.00 59.36 59.08 3h4h h GLU 204 Cb 0.76 -0.10 -0.02 0.00 0.63 0.00 0.00 28.75 30.02 3h4h h GLU 204 CO 0.04 0.29 0.04 -0.44 -0.73 0.00 0.00 179.01 178.20 3h4h h ASP 205 N 0.45 0.69 -0.20 1.04 3.45 -1.83 -2.40 116.42 117.63 3h4h h ASP 205 Ca 0.12 -0.15 -0.12 0.00 0.43 0.00 0.00 57.03 57.32 3h4h h ASP 205 Cb -0.05 -0.18 -0.00 0.00 -0.56 0.00 0.00 39.33 38.53 3h4h h ASP 205 CO -0.03 0.74 -0.32 0.74 -1.57 0.00 0.00 179.24 178.80 3h4h h THR 206 N 0.70 1.33 -0.75 0.35 2.02 -0.66 -2.92 112.91 112.97 3h4h h THR 206 Ca 0.14 -1.54 -0.01 0.00 0.77 0.00 0.00 66.41 65.77 3h4h h THR 206 Cb 0.38 1.83 -0.04 0.00 -1.74 0.00 0.00 68.15 68.59 3h4h h THR 206 CO 0.01 0.48 0.43 0.58 0.37 0.00 0.00 175.52 177.38 3h4h h VAL 207 N 0.25 1.22 -0.63 3.16 2.07 -1.06 0.11 116.25 121.37 3h4h h VAL 207 Ca 0.02 -0.53 0.06 0.00 0.82 0.00 0.00 66.70 67.07 3h4h h VAL 207 Cb 0.91 0.19 -0.05 0.00 -1.52 0.00 0.00 31.29 30.81 3h4h h VAL 207 CO 0.07 0.24 0.34 0.50 0.02 0.00 0.00 177.57 178.74 3h4h h LYS 208 N 1.05 0.61 -0.56 1.57 3.64 -1.39 -0.50 116.57 121.00 3h4h h LYS 208 Ca 0.27 -0.04 -0.08 0.00 -1.27 0.00 0.00 60.65 59.53 3h4h h LYS 208 Cb 0.00 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 31.67 3h4h h LYS 208 CO -0.05 0.40 0.02 0.28 -2.27 0.00 0.00 179.45 177.84 3h4h h VAL 209 N 0.63 1.26 -0.99 2.00 2.07 -1.13 -2.98 116.25 117.11 3h4h h VAL 209 Ca 0.28 -1.09 0.08 0.00 0.82 0.00 0.00 66.70 66.79 3h4h h VAL 209 Cb 0.18 0.87 -0.07 0.00 -1.52 0.00 0.00 31.29 30.75 3h4h h VAL 209 CO -0.18 0.39 0.64 0.24 0.02 0.00 0.00 177.57 178.68 3h4h h MET 210 N 0.85 1.09 0.00 1.57 2.86 0.11 -1.95 114.93 119.46 3h4h h MET 210 Ca 0.16 -0.07 0.00 0.00 -2.06 0.00 0.00 59.70 57.73 3h4h h MET 210 Cb 0.51 -0.25 0.00 0.00 0.06 0.00 0.00 31.60 31.93 3h4h h MET 210 CO 0.02 0.72 0.00 0.00 1.06 0.00 0.00 176.91 178.72 3h4h h ARG 211 N 1.12 0.00 0.00 1.72 3.08 -0.96 -0.34 114.38 119.00 3h4h h ARG 211 Ca 0.44 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.49 3h4h h ARG 211 Cb 0.24 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.29 3h4h h ARG 211 CO -0.19 0.00 0.00 0.25 -1.07 0.00 0.00 179.97 178.96 3h4h n THR 212 N -2.83 0.78 -1.73 2.04 -2.24 -0.73 -4.89 114.28 104.67 3h4h n THR 212 Ca -0.00 0.15 -0.16 0.00 -2.27 0.00 0.00 64.05 61.76 3h4h n THR 212 Cb 0.21 -0.98 -0.05 0.00 -2.10 0.00 0.00 70.33 67.40 3h4h n THR 212 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 3h4h n LEU 213 N -1.96 -1.28 -3.92 3.22 4.77 -0.14 -4.94 117.00 112.75 3h4h n LEU 213 Ca 0.03 0.32 -0.30 0.00 -0.03 0.00 0.00 56.01 56.03 3h4h n LEU 213 Cb 0.25 -2.39 -0.15 0.00 -2.33 0.00 0.00 43.42 38.79 3h4h n LEU 213 CO 0.20 -0.67 -0.37 -0.89 -1.33 0.00 0.00 177.39 174.33 3h4h s THR 214 N -2.50 1.64 0.53 -5.08 2.01 -1.26 -5.11 115.64 105.87 3h4h s THR 214 Ca 0.00 -1.64 -0.22 0.00 0.31 0.00 0.00 61.69 60.14 3h4h s THR 214 Cb 0.00 -2.07 -0.05 0.00 0.01 0.00 0.00 72.50 70.39 3h4h s THR 214 CO 0.00 -0.40 1.28 -2.84 -0.69 0.00 0.00 174.62 171.98 3h4h s PRO 215 N 1.28 3.29 0.25 4.92 0.02 -1.26 -4.92 135.00 138.57 3h4h s PRO 215 Ca 0.03 2.05 0.13 0.00 0.02 0.00 0.00 61.00 63.24 3h4h s PRO 215 Cb -0.19 -2.25 0.09 0.00 0.02 0.00 0.00 34.50 32.17 3h4h s PRO 215 CO -0.11 -1.02 1.45 1.79 -0.33 0.00 0.00 177.00 178.78 3h4h h THR 216 N 1.49 1.13 -3.44 0.99 1.35 -1.38 -3.46 112.91 109.58 3h4h h THR 216 Ca -0.50 -2.45 -0.17 0.00 -0.55 0.00 0.00 66.41 62.73 3h4h h THR 216 Cb 1.29 2.46 -0.24 0.00 -1.73 0.00 0.00 68.15 69.93 3h4h h THR 216 CO 0.58 0.62 -0.52 -1.00 -0.25 0.00 0.00 175.52 174.94 3h4h s HIS 217 N -3.01 -0.06 -0.18 4.73 3.76 -1.14 -4.89 115.29 114.50 3h4h s HIS 217 Ca 0.02 0.15 -0.02 0.00 -0.15 0.00 0.00 55.06 55.06 3h4h s HIS 217 Cb 0.09 0.00 0.05 0.00 1.11 0.00 0.00 32.58 33.84 3h4h s HIS 217 CO 0.76 -0.18 0.02 0.08 -0.85 0.00 0.00 174.74 174.57 3h4h s VAL 218 N -0.61 0.63 0.11 -0.90 1.01 -0.40 -0.97 120.40 119.26 3h4h s VAL 218 Ca -0.07 -0.52 0.04 0.00 0.00 0.00 0.00 61.98 61.43 3h4h s VAL 218 Cb -0.04 -1.04 -0.04 0.00 0.00 0.00 0.00 36.38 35.26 3h4h s VAL 218 CO 0.01 -0.11 -0.11 0.68 0.00 0.00 0.00 175.10 175.57 3h4h s VAL 219 N 1.82 1.06 -0.11 2.92 -7.23 -0.06 -0.80 120.40 118.01 3h4h s VAL 219 Ca -0.00 -1.69 -0.04 0.00 -1.81 0.00 0.00 61.98 58.44 3h4h s VAL 219 Cb -0.16 -1.44 -0.04 0.00 0.56 0.00 0.00 36.38 35.30 3h4h s VAL 219 CO -0.07 -0.54 0.05 -0.36 -0.31 0.00 0.00 175.10 173.86 3h4h s PHE 220 N -2.43 3.29 -1.39 2.82 0.08 -1.26 -0.04 117.98 119.05 3h4h s PHE 220 Ca 0.07 0.26 -0.08 0.00 0.12 0.00 0.00 56.93 57.30 3h4h s PHE 220 Cb -0.03 -1.86 0.05 0.00 -0.57 0.00 0.00 43.02 40.61 3h4h s PHE 220 CO 0.01 0.50 0.58 -1.71 -0.10 0.00 0.00 175.22 174.50 3h4h n ASN 221 N 2.27 -4.59 0.00 1.36 4.05 -0.67 -3.17 115.26 114.52 3h4h n ASN 221 Ca -0.19 -0.39 0.00 0.00 0.45 0.00 0.00 54.58 54.45 3h4h n ASN 221 Cb 0.54 -3.74 0.00 0.00 1.23 0.00 0.00 39.78 37.81 3h4h n ASN 221 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 3h4h n GLY 222 N -1.34 0.85 3.55 8.20 0.00 -0.92 -4.78 105.19 110.75 3h4h n GLY 222 Ca -0.04 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.85 3h4h n GLY 222 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h4h s ALA 223 N -3.38 -1.86 0.18 4.61 0.00 -1.19 -4.65 121.76 115.47 3h4h s ALA 223 Ca 0.00 1.44 -0.33 0.00 0.00 0.00 0.00 51.96 53.07 3h4h s ALA 223 Cb 0.00 -0.36 -0.14 0.00 0.00 0.00 0.00 23.12 22.62 3h4h s ALA 223 CO 0.00 -0.36 1.46 0.28 0.00 0.00 0.00 175.76 177.14 3h4h n VAL 224 N 0.73 0.40 -0.98 0.00 0.31 -0.10 -2.01 118.33 116.67 3h4h n VAL 224 Ca -0.14 -0.10 0.00 0.00 -0.01 0.00 0.00 64.34 64.09 3h4h n VAL 224 Cb 0.58 -1.38 0.00 0.00 -0.91 0.00 0.00 33.84 32.13 3h4h n VAL 224 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3h4h n GLY 225 N 2.76 0.37 0.30 2.92 0.00 -1.26 -4.84 105.19 105.44 3h4h n GLY 225 Ca 0.15 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.29 3h4h n GLY 225 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h4h h ALA 226 N 0.00 2.17 -0.29 4.61 0.00 -1.62 -2.72 119.26 121.41 3h4h h ALA 226 Ca 0.00 -0.01 -0.19 0.00 0.00 0.00 0.00 54.91 54.71 3h4h h ALA 226 Cb 0.30 0.01 -0.14 0.00 0.00 0.00 0.00 17.79 17.96 3h4h h ALA 226 CO 0.00 -0.22 -0.45 1.28 0.00 0.00 0.00 179.25 179.86 3h4h n LEU 227 N -4.48 3.70 -4.54 0.00 4.77 -1.26 -4.77 117.00 110.41 3h4h n LEU 227 Ca 0.02 -4.10 -0.25 0.00 -0.03 0.00 0.00 56.01 51.64 3h4h n LEU 227 Cb 0.27 -0.52 -0.10 0.00 -2.33 0.00 0.00 43.42 40.74 3h4h n LEU 227 CO 0.35 1.55 -0.26 0.42 -1.33 0.00 0.00 177.39 178.12 3h4h s THR 228 N -3.62 1.32 0.00 -5.08 -4.23 -1.03 -0.57 115.64 102.43 3h4h s THR 228 Ca 0.43 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.94 3h4h s THR 228 Cb 0.39 -2.72 0.00 0.00 1.34 0.00 0.00 72.50 71.51 3h4h s THR 228 CO -0.03 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.66 3h4h n GLY 229 N -0.86 3.23 0.00 3.99 0.00 -1.26 -1.82 105.19 108.48 3h4h n GLY 229 Ca -0.05 -0.15 0.08 0.00 0.00 0.00 0.00 46.02 45.89 3h4h n GLY 229 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3h4h n ASP 230 N 6.08 0.00 -0.67 1.61 10.43 -1.26 -2.39 116.55 130.35 3h4h n ASP 230 Ca 0.00 0.26 0.08 0.00 2.57 0.00 0.00 54.79 57.69 3h4h n ASP 230 Cb 0.00 -0.38 0.20 0.00 1.84 0.00 0.00 41.12 42.78 3h4h n ASP 230 CO 0.00 0.00 0.00 0.29 -1.07 0.00 0.00 177.20 176.42 3h4h n LYS 231 N -1.38 2.71 -1.85 -1.24 5.02 -0.75 -5.00 118.16 115.66 3h4h n LYS 231 Ca 0.06 -2.53 -0.38 0.00 -2.02 0.00 0.00 58.31 53.43 3h4h n LYS 231 Cb 0.16 -1.61 0.03 0.00 -0.02 0.00 0.00 35.03 33.59 3h4h n LYS 231 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3h4h s ALA 232 N -2.27 2.88 0.76 7.82 0.00 -1.01 -4.02 121.76 125.91 3h4h s ALA 232 Ca 0.34 1.29 -0.11 0.00 0.00 0.00 0.00 51.96 53.48 3h4h s ALA 232 Cb 0.26 -3.55 0.05 0.00 0.00 0.00 0.00 23.12 19.88 3h4h s ALA 232 CO 0.09 -1.26 1.09 -1.64 0.00 0.00 0.00 175.76 174.03 3h4h s MET 233 N -2.84 2.35 0.10 0.00 -1.94 -0.38 -4.80 119.30 111.80 3h4h s MET 233 Ca 0.70 1.12 0.04 0.00 -1.71 0.00 0.00 55.69 55.84 3h4h s MET 233 Cb -0.39 -1.91 -0.04 0.00 2.01 0.00 0.00 34.83 34.50 3h4h s MET 233 CO 0.47 -1.56 -0.11 0.95 -0.01 0.00 0.00 175.02 174.75 3h4h s THR 234 N -2.93 1.06 0.35 2.05 -4.23 -1.26 -0.48 115.64 110.20 3h4h s THR 234 Ca 0.61 -1.65 -0.16 0.00 -1.18 0.00 0.00 61.69 59.31 3h4h s THR 234 Cb -0.17 -1.40 0.04 0.00 1.34 0.00 0.00 72.50 72.31 3h4h s THR 234 CO 0.56 -0.51 0.73 0.00 -0.54 0.00 0.00 174.62 174.86 3h4h s ALA 235 N -2.32 -0.71 0.13 3.99 0.00 -0.90 -4.91 121.76 117.04 3h4h s ALA 235 Ca 0.06 -0.71 0.09 0.00 0.00 0.00 0.00 51.96 51.40 3h4h s ALA 235 Cb -0.04 0.78 -0.04 0.00 0.00 0.00 0.00 23.12 23.82 3h4h s ALA 235 CO 0.01 -0.98 -0.22 0.00 0.00 0.00 0.00 175.76 174.57 3h4h s ALA 236 N -2.85 2.04 0.17 0.00 0.00 -1.26 -1.17 121.76 118.68 3h4h s ALA 236 Ca 0.16 -1.37 -0.33 0.00 0.00 0.00 0.00 51.96 50.41 3h4h s ALA 236 Cb -0.05 -0.28 -0.16 0.00 0.00 0.00 0.00 23.12 22.64 3h4h s ALA 236 CO 0.11 0.39 1.21 0.28 0.00 0.00 0.00 175.76 177.75 3h4h n VAL 237 N 0.85 0.78 0.00 0.00 0.31 0.20 -0.99 118.33 119.47 3h4h n VAL 237 Ca -0.18 -0.19 0.00 0.00 -0.01 0.00 0.00 64.34 63.96 3h4h n VAL 237 Cb 0.54 -0.90 0.00 0.00 -0.91 0.00 0.00 33.84 32.57 3h4h n VAL 237 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3h4h n GLY 238 N 2.11 2.62 3.76 2.92 0.00 0.39 -4.99 105.19 112.00 3h4h n GLY 238 Ca 0.15 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.78 3h4h n GLY 238 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3h4h s GLU 239 N -0.61 4.80 -0.27 1.61 2.12 -0.17 -4.81 118.70 121.38 3h4h s GLU 239 Ca 0.00 1.44 -0.10 0.00 0.36 0.00 0.00 54.97 56.67 3h4h s GLU 239 Cb 0.00 -3.22 -0.04 0.00 0.26 0.00 0.00 34.13 31.12 3h4h s GLU 239 CO 0.00 0.50 0.16 0.15 -0.54 0.00 0.00 175.26 175.52 3h4h s LYS 240 N -1.28 3.88 -0.07 4.30 1.02 -1.26 -1.89 119.74 124.43 3h4h s LYS 240 Ca 0.42 -0.36 0.05 0.00 0.02 0.00 0.00 55.97 56.10 3h4h s LYS 240 Cb -0.25 -3.57 -0.01 0.00 -0.52 0.00 0.00 37.83 33.49 3h4h s LYS 240 CO 0.31 -0.17 -0.24 0.08 -0.92 0.00 0.00 175.35 174.40 3h4h s VAL 241 N 1.69 2.08 -0.21 3.17 1.01 0.38 0.31 120.40 128.83 3h4h s VAL 241 Ca 0.07 -1.04 -0.09 0.00 0.00 0.00 0.00 61.98 60.91 3h4h s VAL 241 Cb -0.16 -1.76 -0.04 0.00 0.00 0.00 0.00 36.38 34.42 3h4h s VAL 241 CO 0.09 0.57 0.11 -0.22 0.00 0.00 0.00 175.10 175.64 3h4h s LEU 242 N 0.00 3.96 -0.32 3.92 2.96 -0.51 -1.09 118.68 127.60 3h4h s LEU 242 Ca -0.09 0.10 -0.02 0.00 -0.22 0.00 0.00 54.13 53.91 3h4h s LEU 242 Cb -0.15 -2.03 0.06 0.00 0.50 0.00 0.00 46.19 44.57 3h4h s LEU 242 CO 0.05 0.13 0.04 -0.63 -1.32 0.00 0.00 176.35 174.62 3h4h s ILE 243 N 0.65 2.99 0.00 6.68 1.01 0.56 -1.18 121.20 131.92 3h4h s ILE 243 Ca 0.06 -1.57 -0.23 0.00 0.00 0.00 0.00 60.65 58.90 3h4h s ILE 243 Cb -0.13 -2.81 -0.05 0.00 0.01 0.00 0.00 42.46 39.48 3h4h s ILE 243 CO 0.01 -0.24 0.70 -0.69 0.00 0.00 0.00 174.94 174.72 3h4h s VAL 244 N 1.21 4.86 -0.03 2.92 1.01 -0.32 -0.99 120.40 129.06 3h4h s VAL 244 Ca -0.02 1.47 0.02 0.00 0.00 0.00 0.00 61.98 63.45 3h4h s VAL 244 Cb -0.20 -4.04 0.01 0.00 0.00 0.00 0.00 36.38 32.15 3h4h s VAL 244 CO -0.02 0.35 -0.07 -2.28 0.00 0.00 0.00 175.10 173.08 3h4h s HIS 245 N 0.13 0.83 0.12 5.22 2.46 -0.32 -0.31 115.29 123.42 3h4h s HIS 245 Ca 0.36 -0.22 0.05 0.00 0.47 0.00 0.00 55.06 55.72 3h4h s HIS 245 Cb -0.19 -0.65 -0.04 0.00 -0.13 0.00 0.00 32.58 31.57 3h4h s HIS 245 CO 0.20 -0.14 -0.12 -1.54 -2.47 0.00 0.00 174.74 170.67 3h4h s SER 246 N 0.53 1.83 -0.24 9.88 1.04 -0.88 -0.51 113.70 125.35 3h4h s SER 246 Ca -0.08 -0.86 -0.03 0.00 0.48 0.00 0.00 55.95 55.47 3h4h s SER 246 Cb -0.11 -0.04 0.13 0.00 0.10 0.00 0.00 66.02 66.09 3h4h s SER 246 CO 0.01 -0.22 0.34 -1.58 0.98 0.00 0.00 173.24 172.77 3h4h s GLN 247 N -2.96 0.31 0.43 4.02 -0.44 -0.78 -1.33 119.66 118.91 3h4h s GLN 247 Ca 0.10 0.39 0.27 0.00 -2.50 0.00 0.00 55.36 53.62 3h4h s GLN 247 Cb -0.03 -0.65 0.81 0.00 -1.64 0.00 0.00 33.01 31.50 3h4h s GLN 247 CO 0.02 -0.69 1.77 0.00 0.50 0.00 0.00 175.29 176.88 3h4h h ALA 248 N 8.22 1.00 0.00 1.58 0.00 -1.81 0.27 119.26 128.52 3h4h h ALA 248 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.73 3h4h h ALA 248 Cb 1.15 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.94 3h4h h ALA 248 CO 0.28 0.00 -0.61 -1.71 0.00 0.00 0.00 179.25 177.21 3h4h n ASN 249 N -2.90 3.03 -3.86 0.00 5.15 -1.26 -2.57 115.26 112.85 3h4h n ASN 249 Ca 0.03 0.00 -0.11 0.00 -0.60 0.00 0.00 54.58 53.89 3h4h n ASN 249 Cb 0.41 0.50 -0.11 0.00 -0.53 0.00 0.00 39.78 40.05 3h4h n ASN 249 CO 0.00 0.00 0.00 -0.60 1.40 0.00 0.00 177.26 178.06 3h4h s ARG 250 N -1.35 0.32 0.61 1.20 3.52 -1.26 -4.62 118.95 117.36 3h4h s ARG 250 Ca 0.00 -0.15 -0.19 0.00 -0.13 0.00 0.00 55.73 55.26 3h4h s ARG 250 Cb 0.00 0.14 -0.03 0.00 -1.56 0.00 0.00 34.95 33.50 3h4h s ARG 250 CO 0.00 -0.06 1.23 -0.25 -0.81 0.00 0.00 175.30 175.41 3h4h n ASP 251 N 2.18 1.91 -4.19 -2.12 10.43 -1.26 -3.52 116.55 119.97 3h4h n ASP 251 Ca -0.18 0.86 -0.12 0.00 2.57 0.00 0.00 54.79 57.92 3h4h n ASP 251 Cb 0.57 -1.52 -0.10 0.00 1.84 0.00 0.00 41.12 41.91 3h4h n ASP 251 CO 0.00 0.00 0.00 0.28 -1.07 0.00 0.00 177.20 176.41 3h4h s THR 252 N -1.39 0.16 -0.42 -3.53 -1.32 -0.17 -4.84 115.64 104.14 3h4h s THR 252 Ca 0.79 -1.96 0.05 0.00 -1.21 0.00 0.00 61.69 59.35 3h4h s THR 252 Cb -0.40 -2.28 0.18 0.00 -1.51 0.00 0.00 72.50 68.49 3h4h s THR 252 CO 0.44 -0.25 0.38 -2.11 -2.21 0.00 0.00 174.62 170.87 3h4h n ARG 253 N -0.21 0.25 -2.09 7.08 1.85 -1.26 -1.33 116.66 120.96 3h4h n ARG 253 Ca -0.02 -3.09 -0.37 0.00 -1.00 0.00 0.00 57.85 53.37 3h4h n ARG 253 Cb 0.65 -1.62 0.01 0.00 -1.05 0.00 0.00 32.46 30.45 3h4h n ARG 253 CO 0.00 0.00 0.00 -2.14 -0.01 0.00 0.00 177.63 175.48 3h4h s PRO 254 N 0.02 3.39 -0.11 2.89 0.02 -1.07 -0.50 135.00 139.65 3h4h s PRO 254 Ca 0.33 1.88 -0.06 0.00 0.02 0.00 0.00 61.00 63.17 3h4h s PRO 254 Cb 0.05 -2.22 0.04 0.00 0.02 0.00 0.00 34.50 32.39 3h4h s PRO 254 CO -0.18 -0.88 0.25 -1.58 -0.33 0.00 0.00 177.00 174.28 3h4h s HIS 255 N -1.52 -0.33 -0.51 6.54 2.46 0.92 -1.91 115.29 120.94 3h4h s HIS 255 Ca 0.70 0.78 -0.18 0.00 0.47 0.00 0.00 55.06 56.83 3h4h s HIS 255 Cb -0.31 0.07 0.07 0.00 -0.13 0.00 0.00 32.58 32.28 3h4h s HIS 255 CO 0.37 -0.22 0.58 -1.17 -2.47 0.00 0.00 174.74 171.83 3h4h s LEU 256 N 1.03 5.23 -0.30 8.88 2.96 -1.26 -0.70 118.68 134.51 3h4h s LEU 256 Ca -0.07 -1.12 -0.29 0.00 -0.22 0.00 0.00 54.13 52.43 3h4h s LEU 256 Cb -0.08 -2.36 -0.02 0.00 0.50 0.00 0.00 46.19 44.23 3h4h s LEU 256 CO -0.07 -0.88 1.64 -0.63 -1.32 0.00 0.00 176.35 175.09 3h4h s ILE 257 N 2.39 3.66 0.00 6.68 1.01 0.17 -1.14 121.20 133.97 3h4h s ILE 257 Ca 0.12 0.71 0.00 0.00 0.00 0.00 0.00 60.65 61.47 3h4h s ILE 257 Cb -0.22 -3.79 0.00 0.00 0.01 0.00 0.00 42.46 38.46 3h4h s ILE 257 CO 0.09 -0.43 0.00 0.61 0.00 0.00 0.00 174.94 175.21 3h4h n GLY 258 N 5.03 0.33 0.00 6.18 0.00 -1.26 -3.72 105.19 111.75 3h4h n GLY 258 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.22 3h4h n GLY 258 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3h4h n GLY 259 N -1.57 6.81 3.59 -0.02 0.00 -0.29 -4.98 105.19 108.72 3h4h n GLY 259 Ca 0.00 -1.80 -0.10 0.00 0.00 0.00 0.00 46.02 44.12 3h4h n GLY 259 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3h4h s HIS 260 N 0.43 0.46 -0.48 1.61 0.09 -1.26 -4.75 115.29 111.39 3h4h s HIS 260 Ca 0.00 -0.82 -0.15 0.00 -0.00 0.00 0.00 55.06 54.09 3h4h s HIS 260 Cb 0.00 0.20 0.09 0.00 -0.00 0.00 0.00 32.58 32.86 3h4h s HIS 260 CO 0.00 -1.06 0.40 0.20 -0.00 0.00 0.00 174.74 174.28 3h4h s GLY 261 N -3.06 2.05 0.17 -2.22 0.00 0.06 -4.73 107.32 99.59 3h4h s GLY 261 Ca 0.23 -2.23 -0.12 0.00 0.00 0.00 0.00 44.72 42.60 3h4h s GLY 261 CO 0.11 1.08 1.73 -0.55 0.00 0.00 0.00 173.10 175.47 3h4h h ASP 262 N 8.74 0.81 -3.41 1.64 3.32 -1.43 0.48 116.42 126.57 3h4h h ASP 262 Ca -0.28 -0.17 -0.49 0.00 0.02 0.00 0.00 57.03 56.11 3h4h h ASP 262 Cb 1.10 -0.21 -0.34 0.00 0.22 0.00 0.00 39.33 40.11 3h4h h ASP 262 CO 0.90 0.76 -0.80 -0.31 -1.72 0.00 0.00 179.24 178.07 3h4h s TYR 263 N -5.56 1.28 -0.12 4.55 1.51 -0.95 -1.94 117.35 116.12 3h4h s TYR 263 Ca -0.13 -0.47 -0.01 0.00 -1.01 0.00 0.00 57.07 55.45 3h4h s TYR 263 Cb 0.13 -0.98 0.03 0.00 -0.11 0.00 0.00 41.96 41.03 3h4h s TYR 263 CO 0.79 -0.27 -0.03 0.08 -1.11 0.00 0.00 175.55 175.01 3h4h s VAL 264 N 0.81 0.79 -1.07 0.71 1.01 0.12 -0.15 120.40 122.63 3h4h s VAL 264 Ca -0.12 -0.28 -0.19 0.00 0.00 0.00 0.00 61.98 61.39 3h4h s VAL 264 Cb -0.15 -0.95 0.11 0.00 0.00 0.00 0.00 36.38 35.38 3h4h s VAL 264 CO 0.02 0.21 1.37 0.26 0.00 0.00 0.00 175.10 176.97 3h4h s TRP 265 N 1.79 2.97 0.27 5.22 0.51 0.14 -0.56 118.94 129.28 3h4h s TRP 265 Ca 0.03 -1.42 0.14 0.00 -2.12 0.00 0.00 56.10 52.74 3h4h s TRP 265 Cb -0.14 -4.48 0.60 0.00 -0.81 0.00 0.00 33.47 28.64 3h4h s TRP 265 CO -0.07 -1.65 1.72 0.00 -0.51 0.00 0.00 176.95 176.44 3h4h h ALA 266 N 8.59 1.09 0.00 0.98 0.00 -1.89 0.60 119.26 128.63 3h4h h ALA 266 Ca 0.25 -0.42 0.00 0.00 0.00 0.00 0.00 54.91 54.74 3h4h h ALA 266 Cb 0.97 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.68 3h4h h ALA 266 CO 1.28 0.57 -0.14 0.25 0.00 0.00 0.00 179.25 181.22 3h4h n THR 267 N -3.78 0.15 -0.96 0.00 -2.24 -1.26 -4.56 114.28 101.62 3h4h n THR 267 Ca -0.01 -0.08 0.00 0.00 -2.27 0.00 0.00 64.05 61.69 3h4h n THR 267 Cb 0.51 -0.36 0.00 0.00 -2.10 0.00 0.00 70.33 68.39 3h4h n THR 267 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3h4h n GLY 268 N 1.45 0.96 3.51 3.38 0.00 0.17 -4.75 105.19 109.91 3h4h n GLY 268 Ca 0.06 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.73 3h4h n GLY 268 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3h4h s LYS 269 N -0.04 3.74 0.32 1.61 -0.14 -1.26 -0.12 119.74 123.85 3h4h s LYS 269 Ca 0.00 -0.46 0.26 0.00 -1.36 0.00 0.00 55.97 54.41 3h4h s LYS 269 Cb 0.00 -3.18 0.77 0.00 -1.68 0.00 0.00 37.83 33.74 3h4h s LYS 269 CO 0.00 0.04 1.74 0.74 -0.76 0.00 0.00 175.35 177.12 3h4h h PHE 270 N 7.43 0.00 -0.00 3.18 0.05 -1.76 -2.25 116.94 123.59 3h4h h PHE 270 Ca -0.36 0.00 0.00 0.00 3.82 0.00 0.00 57.97 61.43 3h4h h PHE 270 Cb 1.18 0.00 0.00 0.00 2.00 0.00 0.00 35.95 39.13 3h4h h PHE 270 CO 0.60 0.00 -0.14 0.09 -0.18 0.00 0.00 178.31 178.68 3h4h n ASN 271 N -2.57 0.31 -4.57 2.17 3.02 -1.26 -4.57 115.26 107.79 3h4h n ASN 271 Ca 0.04 -0.19 -0.41 0.00 -0.03 0.00 0.00 54.58 53.99 3h4h n ASN 271 Cb 0.41 -0.14 -0.08 0.00 -0.61 0.00 0.00 39.78 39.36 3h4h n ASN 271 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 3h4h s THR 272 N -2.72 5.01 0.41 3.41 2.01 -0.85 -5.05 115.64 117.86 3h4h s THR 272 Ca 0.21 0.44 -0.26 0.00 0.31 0.00 0.00 61.69 62.40 3h4h s THR 272 Cb 0.19 -3.95 -0.10 0.00 0.01 0.00 0.00 72.50 68.65 3h4h s THR 272 CO 0.53 -0.18 1.21 -2.65 -0.69 0.00 0.00 174.62 172.84 3h4h n PRO 273 N 5.74 1.81 -2.44 4.92 -0.02 -1.26 -4.83 135.00 138.93 3h4h n PRO 273 Ca -0.04 0.64 -0.36 0.00 -2.02 0.00 0.00 63.50 61.72 3h4h n PRO 273 Cb 0.49 -2.29 -0.03 0.00 -0.02 0.00 0.00 33.50 31.65 3h4h n PRO 273 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 3h4h s PRO 274 N -2.12 3.91 0.74 0.52 0.04 -1.26 -4.93 135.00 131.89 3h4h s PRO 274 Ca 0.61 1.56 -0.12 0.00 0.04 0.00 0.00 61.00 63.09 3h4h s PRO 274 Cb -0.53 -2.37 0.04 0.00 0.04 0.00 0.00 34.50 31.69 3h4h s PRO 274 CO 0.58 -0.38 1.11 -0.51 0.04 0.00 0.00 177.00 177.84 3h4h s ASP 275 N -1.61 4.58 0.15 6.66 1.01 0.28 -4.75 116.67 122.99 3h4h s ASP 275 Ca 0.63 1.93 0.06 0.00 0.71 0.00 0.00 52.55 55.87 3h4h s ASP 275 Cb -0.23 -2.54 -0.04 0.00 1.01 0.00 0.00 42.92 41.12 3h4h s ASP 275 CO 0.28 -1.98 -0.13 0.68 0.21 0.00 0.00 175.17 174.23 3h4h s VAL 276 N -2.66 1.35 -1.52 -1.27 -7.23 -1.26 0.16 120.40 107.97 3h4h s VAL 276 Ca 0.64 -1.92 -0.05 0.00 -1.81 0.00 0.00 61.98 58.84 3h4h s VAL 276 Cb -0.19 -1.73 0.02 0.00 0.56 0.00 0.00 36.38 35.04 3h4h s VAL 276 CO 0.51 -0.56 0.52 0.47 -0.31 0.00 0.00 175.10 175.73 3h4h n ASP 277 N 0.13 -5.63 -4.76 4.85 10.43 -0.82 -4.92 116.55 115.83 3h4h n ASP 277 Ca -0.12 -0.27 -0.40 0.00 2.57 0.00 0.00 54.79 56.57 3h4h n ASP 277 Cb 0.59 -4.58 -0.04 0.00 1.84 0.00 0.00 41.12 38.93 3h4h n ASP 277 CO 0.00 0.00 0.00 -1.10 -1.07 0.00 0.00 177.20 175.03 3h4h s GLN 278 N -5.68 4.54 -0.18 -1.24 -1.52 0.13 -4.82 119.66 110.88 3h4h s GLN 278 Ca 0.29 1.89 -0.18 0.00 -1.95 0.00 0.00 55.36 55.41 3h4h s GLN 278 Cb -0.13 -3.12 -0.14 0.00 -0.22 0.00 0.00 33.01 29.40 3h4h s GLN 278 CO 0.35 0.09 0.11 1.05 -0.25 0.00 0.00 175.29 176.64 3h4h h GLU 279 N 3.62 0.00 -3.35 2.91 4.11 -1.91 0.21 114.58 120.18 3h4h h GLU 279 Ca -0.47 0.00 -0.33 0.00 0.07 0.00 0.00 59.36 58.62 3h4h h GLU 279 Cb 1.22 0.00 -0.37 0.00 0.50 0.00 0.00 28.75 30.10 3h4h h GLU 279 CO 0.66 0.68 -0.72 0.99 0.07 0.00 0.00 179.01 180.70 3h4h s THR 280 N -2.30 -0.11 0.47 -1.06 2.01 -1.26 -4.33 115.64 109.05 3h4h s THR 280 Ca -0.24 0.35 0.08 0.00 0.31 0.00 0.00 61.69 62.19 3h4h s THR 280 Cb 0.04 -0.15 0.02 0.00 0.01 0.00 0.00 72.50 72.42 3h4h s THR 280 CO 0.47 0.14 0.49 -1.66 -0.69 0.00 0.00 174.62 173.37 3h4h s TRP 281 N 1.81 2.27 -0.07 4.92 -2.14 -0.80 -4.97 118.94 119.97 3h4h s TRP 281 Ca -0.00 -0.59 0.00 0.00 2.66 0.00 0.00 56.10 58.17 3h4h s TRP 281 Cb -0.12 -2.16 0.02 0.00 -3.10 0.00 0.00 33.47 28.11 3h4h s TRP 281 CO -0.03 -0.42 -0.06 0.12 -2.66 0.00 0.00 176.95 173.90 3h4h s PHE 282 N -2.55 1.01 -0.20 1.66 5.36 -1.26 -2.59 117.98 119.41 3h4h s PHE 282 Ca 0.49 -0.37 0.02 0.00 -0.96 0.00 0.00 56.93 56.10 3h4h s PHE 282 Cb -0.04 -0.89 0.03 0.00 -0.34 0.00 0.00 43.02 41.78 3h4h s PHE 282 CO 0.29 -0.30 -0.17 0.42 -1.46 0.00 0.00 175.22 174.00 3h4h s ILE 283 N 1.26 2.11 0.57 3.12 1.01 -0.44 -4.70 121.20 124.12 3h4h s ILE 283 Ca -0.05 -1.15 -0.17 0.00 0.00 0.00 0.00 60.65 59.28 3h4h s ILE 283 Cb -0.14 -1.99 -0.05 0.00 0.01 0.00 0.00 42.46 40.29 3h4h s ILE 283 CO -0.02 0.37 1.07 -2.16 0.00 0.00 0.00 174.94 174.20 3h4h s PRO 284 N 1.23 3.38 0.22 2.79 0.04 -1.26 -1.00 135.00 140.41 3h4h s PRO 284 Ca 0.01 1.34 -0.31 0.00 0.04 0.00 0.00 61.00 62.07 3h4h s PRO 284 Cb -0.15 -2.03 -0.14 0.00 0.04 0.00 0.00 34.50 32.21 3h4h s PRO 284 CO -0.10 -0.77 1.30 0.41 0.04 0.00 0.00 177.00 177.87 3h4h n GLY 285 N -0.54 0.47 1.35 0.56 0.00 -1.23 -1.68 105.19 104.12 3h4h n GLY 285 Ca 0.10 0.49 0.00 0.00 0.00 0.00 0.00 46.02 46.61 3h4h n GLY 285 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3h4h n GLY 286 N 2.01 0.59 3.22 -0.02 0.00 0.90 -4.75 105.19 107.14 3h4h n GLY 286 Ca 0.12 -0.66 -0.10 0.00 0.00 0.00 0.00 46.02 45.39 3h4h n GLY 286 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h4h s ALA 287 N -2.00 0.72 0.14 4.61 0.00 -0.68 -4.74 121.76 119.82 3h4h s ALA 287 Ca 0.00 -1.39 0.10 0.00 0.00 0.00 0.00 51.96 50.67 3h4h s ALA 287 Cb 0.00 1.00 -0.04 0.00 0.00 0.00 0.00 23.12 24.08 3h4h s ALA 287 CO 0.00 -0.56 -0.20 0.00 0.00 0.00 0.00 175.76 175.00 3h4h s ALA 288 N -4.06 2.61 0.30 0.00 0.00 -1.26 -1.87 121.76 117.48 3h4h s ALA 288 Ca 0.26 -1.43 0.03 0.00 0.00 0.00 0.00 51.96 50.81 3h4h s ALA 288 Cb 0.06 -0.55 -0.05 0.00 0.00 0.00 0.00 23.12 22.58 3h4h s ALA 288 CO 0.04 0.54 0.09 0.20 0.00 0.00 0.00 175.76 176.63 3h4h s GLY 289 N -2.27 1.96 -0.02 0.00 0.00 0.33 -3.30 107.32 104.02 3h4h s GLY 289 Ca 0.18 -1.90 -0.01 0.00 0.00 0.00 0.00 44.72 42.99 3h4h s GLY 289 CO 0.10 -1.71 0.04 0.00 0.00 0.00 0.00 173.10 171.53 3h4h s ALA 290 N -3.52 -0.01 -0.02 3.20 0.00 -1.00 -1.17 121.76 119.23 3h4h s ALA 290 Ca 0.36 0.23 0.08 0.00 0.00 0.00 0.00 51.96 52.63 3h4h s ALA 290 Cb 0.08 -0.17 -0.02 0.00 0.00 0.00 0.00 23.12 23.01 3h4h s ALA 290 CO 0.15 -0.07 -0.25 0.00 0.00 0.00 0.00 175.76 175.59 3h4h s ALA 291 N 0.59 2.21 -0.15 0.00 0.00 -0.16 -0.68 121.76 123.56 3h4h s ALA 291 Ca -0.05 -1.11 0.00 0.00 0.00 0.00 0.00 51.96 50.80 3h4h s ALA 291 Cb -0.07 -0.58 -0.00 0.00 0.00 0.00 0.00 23.12 22.47 3h4h s ALA 291 CO -0.02 0.53 -0.15 0.12 0.00 0.00 0.00 175.76 176.24 3h4h s PHE 292 N -0.63 2.78 0.00 0.00 2.19 0.79 -0.32 117.98 122.80 3h4h s PHE 292 Ca 0.10 -1.03 0.00 0.00 0.33 0.00 0.00 56.93 56.34 3h4h s PHE 292 Cb -0.10 -1.89 -0.01 0.00 -1.31 0.00 0.00 43.02 39.72 3h4h s PHE 292 CO -0.01 -0.47 -0.02 -0.47 1.83 0.00 0.00 175.22 176.09 3h4h s TYR 293 N 0.80 0.17 -0.32 10.12 5.04 -0.25 -1.16 117.35 131.76 3h4h s TYR 293 Ca -0.05 -0.13 -0.09 0.00 -2.44 0.00 0.00 57.07 54.36 3h4h s TYR 293 Cb -0.15 -0.11 0.01 0.00 0.35 0.00 0.00 41.96 42.05 3h4h s TYR 293 CO 0.00 -0.04 0.14 0.99 -1.34 0.00 0.00 175.55 175.31 3h4h s THR 294 N -0.33 4.36 0.26 4.34 2.01 -1.26 -0.47 115.64 124.54 3h4h s THR 294 Ca -0.03 -0.65 -0.30 0.00 0.31 0.00 0.00 61.69 61.02 3h4h s THR 294 Cb -0.03 -3.30 -0.11 0.00 0.01 0.00 0.00 72.50 69.08 3h4h s THR 294 CO -0.00 -0.02 1.52 -0.36 -0.69 0.00 0.00 174.62 175.07 3h4h s PHE 295 N 1.55 2.92 -0.01 4.92 0.40 -0.79 -4.88 117.98 122.09 3h4h s PHE 295 Ca 0.03 0.86 0.04 0.00 -0.60 0.00 0.00 56.93 57.27 3h4h s PHE 295 Cb -0.18 -3.94 -0.07 0.00 0.51 0.00 0.00 43.02 39.34 3h4h s PHE 295 CO 0.05 -3.17 0.09 1.04 0.70 0.00 0.00 175.22 173.94 3h4h n GLN 296 N 2.51 0.32 -4.31 0.44 1.13 -1.26 -0.46 117.38 115.75 3h4h n GLN 296 Ca 0.08 -0.04 -0.19 0.00 -1.94 0.00 0.00 57.00 54.92 3h4h n GLN 296 Cb 0.39 -1.11 -0.13 0.00 0.11 0.00 0.00 30.24 29.50 3h4h n GLN 296 CO 0.00 0.00 0.00 -0.65 -1.44 0.00 0.00 177.06 174.97 3h4h s GLN 297 N -2.30 0.82 0.78 -1.09 -1.52 -1.26 -4.60 119.66 110.49 3h4h s GLN 297 Ca -0.02 -0.65 -0.10 0.00 -1.95 0.00 0.00 55.36 52.64 3h4h s GLN 297 Cb 0.03 -0.79 0.08 0.00 -0.22 0.00 0.00 33.01 32.11 3h4h s GLN 297 CO 0.18 0.20 1.13 -1.25 -0.25 0.00 0.00 175.29 175.30 3h4h s PRO 298 N -0.98 2.00 0.00 2.91 0.04 -1.26 -4.76 135.00 132.95 3h4h s PRO 298 Ca 0.00 -0.02 0.00 0.00 0.04 0.00 0.00 61.00 61.03 3h4h s PRO 298 Cb -0.07 -2.02 0.00 0.00 0.04 0.00 0.00 34.50 32.45 3h4h s PRO 298 CO 0.01 -1.51 0.00 0.41 0.04 0.00 0.00 177.00 175.95 3h4h n GLY 299 N -3.21 0.79 3.73 0.56 0.00 -0.16 -4.94 105.19 101.96 3h4h n GLY 299 Ca 0.08 -2.32 -0.39 0.00 0.00 0.00 0.00 46.02 43.40 3h4h n GLY 299 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3h4h s ILE 300 N -0.86 5.00 0.15 -0.61 -1.09 -1.26 -1.03 121.20 121.50 3h4h s ILE 300 Ca 0.00 1.31 0.09 0.00 -2.23 0.00 0.00 60.65 59.82 3h4h s ILE 300 Cb 0.00 -3.97 -0.04 0.00 -1.58 0.00 0.00 42.46 36.86 3h4h s ILE 300 CO 0.00 0.32 -0.13 -0.31 -1.23 0.00 0.00 174.94 173.60 3h4h s TYR 301 N 0.40 2.62 -0.05 3.97 1.51 -0.00 -4.97 117.35 120.82 3h4h s TYR 301 Ca 0.34 -0.22 -0.00 0.00 -1.01 0.00 0.00 57.07 56.17 3h4h s TYR 301 Cb -0.18 -1.33 -0.03 0.00 -0.11 0.00 0.00 41.96 40.31 3h4h s TYR 301 CO 0.17 0.46 0.01 0.00 -1.11 0.00 0.00 175.55 175.08 3h4h s ALA 302 N -1.44 3.32 -0.20 3.71 0.00 -1.24 -0.98 121.76 124.93 3h4h s ALA 302 Ca 0.22 -0.87 0.01 0.00 0.00 0.00 0.00 51.96 51.32 3h4h s ALA 302 Cb -0.10 -1.44 0.02 0.00 0.00 0.00 0.00 23.12 21.61 3h4h s ALA 302 CO 0.13 0.62 -0.17 -0.47 0.00 0.00 0.00 175.76 175.88 3h4h s TYR 303 N -0.99 2.86 0.09 0.00 5.04 0.12 0.46 117.35 124.93 3h4h s TYR 303 Ca 0.17 -1.64 0.02 0.00 -2.44 0.00 0.00 57.07 53.18 3h4h s TYR 303 Cb -0.11 -1.95 -0.04 0.00 0.35 0.00 0.00 41.96 40.21 3h4h s TYR 303 CO 0.06 -0.78 -0.07 0.14 -1.34 0.00 0.00 175.55 173.56 3h4h s VAL 304 N 1.29 0.69 -0.22 3.14 -7.23 0.12 0.08 120.40 118.27 3h4h s VAL 304 Ca 0.03 -1.87 -0.29 0.00 -1.81 0.00 0.00 61.98 58.04 3h4h s VAL 304 Cb -0.14 -1.60 -0.00 0.00 0.56 0.00 0.00 36.38 35.19 3h4h s VAL 304 CO -0.11 -0.83 1.22 0.21 -0.31 0.00 0.00 175.10 175.27 3h4h s ASN 305 N -2.93 6.91 -0.03 4.85 3.84 -0.89 -0.06 114.94 126.62 3h4h s ASN 305 Ca 0.10 1.47 0.02 0.00 0.21 0.00 0.00 52.86 54.65 3h4h s ASN 305 Cb 0.04 -2.54 0.10 0.00 -0.55 0.00 0.00 41.25 38.30 3h4h s ASN 305 CO -0.04 -0.83 0.65 1.57 -2.79 0.00 0.00 177.10 175.66 3h4h n HIS 306 N 6.82 0.25 -2.68 0.43 -0.00 0.35 -3.84 115.22 116.56 3h4h n HIS 306 Ca 0.14 -0.09 -0.42 0.00 -0.00 0.00 0.00 57.72 57.35 3h4h n HIS 306 Cb 0.46 -0.15 -0.03 0.00 -0.00 0.00 0.00 29.99 30.27 3h4h n HIS 306 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 176.34 177.55 3h4h s ASN 307 N -0.10 6.29 0.53 0.26 3.84 -1.26 -4.91 114.94 119.58 3h4h s ASN 307 Ca 0.06 -0.34 0.34 0.00 0.21 0.00 0.00 52.86 53.14 3h4h s ASN 307 Cb 0.05 -2.51 1.55 0.00 -0.55 0.00 0.00 41.25 39.79 3h4h s ASN 307 CO 0.02 -1.52 2.02 -0.07 -2.79 0.00 0.00 177.10 174.76 3h4h h LEU 308 N 11.94 0.00 -0.26 3.21 3.38 -1.99 0.13 115.31 131.72 3h4h h LEU 308 Ca -0.27 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.67 3h4h h LEU 308 Cb 1.06 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.80 3h4h h LEU 308 CO 1.19 0.00 0.05 0.40 0.09 0.00 0.00 178.44 180.17 3h4h h ILE 309 N 0.00 1.23 -0.49 1.22 2.04 -1.91 -3.19 117.51 116.41 3h4h h ILE 309 Ca 0.00 -0.76 -0.03 0.00 1.00 0.00 0.00 64.86 65.07 3h4h h ILE 309 Cb 0.35 1.23 -0.02 0.00 -0.74 0.00 0.00 36.82 37.63 3h4h h ILE 309 CO 0.00 0.24 0.18 -0.33 0.00 0.00 0.00 178.15 178.25 3h4h h GLU 310 N 0.24 0.74 0.00 2.37 5.08 -1.15 0.76 114.58 122.61 3h4h h GLU 310 Ca 0.08 -0.14 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 3h4h h GLU 310 Cb 0.32 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.45 3h4h h GLU 310 CO 0.00 0.67 0.00 0.00 -1.00 0.00 0.00 179.01 178.68 3h4h n ALA 311 N -2.34 1.10 0.00 3.43 0.00 -0.05 -1.36 120.51 121.29 3h4h n ALA 311 Ca 0.01 -0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.45 3h4h n ALA 311 Cb 0.16 -1.01 0.00 0.00 0.00 0.00 0.00 19.45 18.60 3h4h n ALA 311 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 3h4h n GLU 313 N -1.43 0.00 -0.00 0.00 -0.58 0.20 -1.94 120.64 116.89 3h4h n GLU 313 Ca 0.00 0.00 0.10 0.00 -0.42 0.00 0.00 57.16 56.84 3h4h n GLU 313 Cb 0.01 0.00 -0.14 0.00 -0.57 0.00 0.00 31.44 30.74 3h4h n GLU 313 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 3h4h n LEU 314 N -0.50 0.50 0.00 -4.62 4.77 -0.84 -5.02 117.00 111.29 3h4h n LEU 314 Ca 0.00 -0.26 0.00 0.00 -0.03 0.00 0.00 56.01 55.72 3h4h n LEU 314 Cb 0.00 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 3h4h n LEU 314 CO 0.00 0.13 0.00 0.61 -1.33 0.00 0.00 177.39 176.80 3h4h n GLY 315 N 1.40 1.14 2.75 -0.72 0.00 -0.46 -1.28 105.19 108.01 3h4h n GLY 315 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.61 3h4h n GLY 315 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h4h n ALA 316 N 0.00 5.86 -3.57 4.61 0.00 0.02 -4.10 120.51 123.34 3h4h n ALA 316 Ca 0.00 -4.43 -0.13 0.00 0.00 0.00 0.00 53.44 48.89 3h4h n ALA 316 Cb 0.00 -2.62 -0.13 0.00 0.00 0.00 0.00 19.45 16.69 3h4h n ALA 316 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3h4h s ALA 317 N -1.69 -0.43 0.38 0.00 0.00 -1.25 -2.11 121.76 116.66 3h4h s ALA 317 Ca 0.41 0.77 0.05 0.00 0.00 0.00 0.00 51.96 53.19 3h4h s ALA 317 Cb 0.13 -0.49 -0.06 0.00 0.00 0.00 0.00 23.12 22.69 3h4h s ALA 317 CO -0.02 -0.16 0.04 0.00 0.00 0.00 0.00 175.76 175.62 3h4h s ALA 318 N 0.95 2.84 0.13 0.00 0.00 0.11 -4.59 121.76 121.19 3h4h s ALA 318 Ca -0.07 -1.99 0.07 0.00 0.00 0.00 0.00 51.96 49.98 3h4h s ALA 318 Cb -0.09 0.43 -0.04 0.00 0.00 0.00 0.00 23.12 23.43 3h4h s ALA 318 CO -0.05 -0.22 -0.18 -1.01 0.00 0.00 0.00 175.76 174.30 3h4h s HIS 319 N -3.03 1.65 -0.04 0.00 3.76 0.26 0.13 115.29 118.01 3h4h s HIS 319 Ca 0.33 -0.48 0.05 0.00 -0.15 0.00 0.00 55.06 54.81 3h4h s HIS 319 Cb 0.08 -0.86 -0.02 0.00 1.11 0.00 0.00 32.58 32.89 3h4h s HIS 319 CO 0.16 0.22 -0.18 -0.06 -0.85 0.00 0.00 174.74 174.02 3h4h s PHE 320 N -1.74 2.58 -0.25 1.40 0.08 -0.15 -1.25 117.98 118.65 3h4h s PHE 320 Ca 0.10 -0.28 -0.04 0.00 0.12 0.00 0.00 56.93 56.83 3h4h s PHE 320 Cb -0.07 -1.59 0.01 0.00 -0.57 0.00 0.00 43.02 40.79 3h4h s PHE 320 CO 0.05 0.09 -0.02 0.15 -0.10 0.00 0.00 175.22 175.38 3h4h s LYS 321 N -0.64 3.09 -0.15 0.44 1.02 0.37 -0.82 119.74 123.04 3h4h s LYS 321 Ca 0.10 -0.82 0.01 0.00 0.02 0.00 0.00 55.97 55.27 3h4h s LYS 321 Cb -0.11 -3.08 0.00 0.00 -0.52 0.00 0.00 37.83 34.12 3h4h s LYS 321 CO 0.00 -0.34 -0.17 0.08 -0.92 0.00 0.00 175.35 174.00 3h4h s VAL 322 N 1.42 2.46 0.55 3.17 1.01 -0.20 -2.12 120.40 126.69 3h4h s VAL 322 Ca 0.03 -0.84 -0.04 0.00 0.00 0.00 0.00 61.98 61.13 3h4h s VAL 322 Cb -0.16 -2.03 0.00 0.00 0.00 0.00 0.00 36.38 34.20 3h4h s VAL 322 CO -0.02 0.52 0.83 0.42 0.00 0.00 0.00 175.10 176.85 3h4h s THR 323 N 0.85 3.86 -1.17 3.92 -4.23 -0.32 -0.99 115.64 117.56 3h4h s THR 323 Ca -0.05 -0.10 0.00 0.00 -1.18 0.00 0.00 61.69 60.36 3h4h s THR 323 Cb -0.15 -3.50 0.00 0.00 1.34 0.00 0.00 72.50 70.19 3h4h s THR 323 CO -0.01 -0.47 0.00 0.61 -0.54 0.00 0.00 174.62 174.21 3h4h n GLY 324 N -2.43 0.48 3.79 3.99 0.00 -1.26 -0.63 105.19 109.13 3h4h n GLY 324 Ca 0.03 -2.21 -0.36 0.00 0.00 0.00 0.00 46.02 43.48 3h4h n GLY 324 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3h4h s GLU 325 N -0.47 3.89 0.45 1.61 2.12 -1.26 -4.67 118.70 120.36 3h4h s GLU 325 Ca 0.00 -0.14 -0.25 0.00 0.36 0.00 0.00 54.97 54.93 3h4h s GLU 325 Cb 0.00 -3.32 -0.08 0.00 0.26 0.00 0.00 34.13 30.99 3h4h s GLU 325 CO 0.00 0.50 1.41 -0.46 -0.54 0.00 0.00 175.26 176.17 3h4h s TRP 326 N -0.23 2.49 -0.43 5.30 -0.11 -1.26 -4.50 118.94 120.19 3h4h s TRP 326 Ca 0.12 1.28 -0.03 0.00 1.22 0.00 0.00 56.10 58.69 3h4h s TRP 326 Cb -0.12 -3.89 0.12 0.00 -1.50 0.00 0.00 33.47 28.08 3h4h s TRP 326 CO 0.01 -2.85 0.23 1.21 -4.62 0.00 0.00 176.95 170.94 3h4h s ASN 327 N -0.54 5.26 0.27 5.86 3.84 -1.26 -4.96 114.94 123.41 3h4h s ASN 327 Ca 0.61 -2.12 0.25 0.00 0.21 0.00 0.00 52.86 51.81 3h4h s ASN 327 Cb -0.43 -1.84 0.96 0.00 -0.55 0.00 0.00 41.25 39.39 3h4h s ASN 327 CO 0.55 -0.53 1.74 0.44 -2.79 0.00 0.00 177.10 176.51 3h4h h ASP 328 N 7.95 0.00 -0.08 -4.21 5.19 -1.95 -2.61 116.42 120.71 3h4h h ASP 328 Ca -0.12 0.00 -0.03 0.00 -0.62 0.00 0.00 57.03 56.26 3h4h h ASP 328 Cb 1.04 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 40.55 3h4h h ASP 328 CO 0.71 0.00 -0.06 -0.78 -3.12 0.00 0.00 179.24 175.98 3h4h h ASP 329 N 0.00 0.20 -0.71 6.45 -0.00 -2.03 -3.29 116.42 117.04 3h4h h ASP 329 Ca 0.00 -0.45 -0.06 0.00 -0.00 0.00 0.00 57.03 56.52 3h4h h ASP 329 Cb 0.46 -0.06 -0.03 0.00 -0.00 0.00 0.00 39.33 39.71 3h4h h ASP 329 CO 0.00 0.61 0.22 -0.07 -0.00 0.00 0.00 179.24 180.00 3h4h h LEU 330 N -0.21 1.03 -7.09 2.28 3.38 -1.91 -3.44 115.31 109.35 3h4h h LEU 330 Ca 0.02 -0.21 -0.05 0.00 0.09 0.00 0.00 57.88 57.73 3h4h h LEU 330 Cb 0.55 -0.27 -0.22 0.00 0.09 0.00 0.00 40.66 40.80 3h4h h LEU 330 CO 0.02 0.97 -0.03 -0.32 0.09 0.00 0.00 178.44 179.16 3h4h s MET 331 N -5.42 0.67 -0.04 1.13 0.00 -1.06 -5.14 119.30 109.44 3h4h s MET 331 Ca -0.12 0.96 -0.10 0.00 0.00 0.00 0.00 55.69 56.42 3h4h s MET 331 Cb 0.15 0.23 0.02 0.00 0.00 0.00 0.00 34.83 35.22 3h4h s MET 331 CO 0.84 -0.12 0.23 -0.08 0.00 0.00 0.00 175.02 175.89 3h4h s THR 332 N 0.88 0.05 -0.73 10.11 -1.32 -1.26 -4.23 115.64 119.14 3h4h s THR 332 Ca -0.04 -0.38 -0.25 0.00 -1.21 0.00 0.00 61.69 59.80 3h4h s THR 332 Cb -0.05 -0.46 0.04 0.00 -1.51 0.00 0.00 72.50 70.53 3h4h s THR 332 CO -0.07 -0.21 1.19 -0.55 -2.21 0.00 0.00 174.62 172.77 3h4h s SER 333 N -0.83 6.19 0.08 8.08 0.15 -1.26 -4.88 113.70 121.23 3h4h s SER 333 Ca -0.09 -0.68 -0.16 0.00 0.70 0.00 0.00 55.95 55.72 3h4h s SER 333 Cb -0.05 -2.52 -0.10 0.00 -1.71 0.00 0.00 66.02 61.64 3h4h s SER 333 CO 0.02 -1.70 1.39 0.58 1.20 0.00 0.00 173.24 174.73 3h4h h VAL 334 N 6.04 1.32 -3.29 4.45 2.07 -2.02 -3.40 116.25 121.42 3h4h h VAL 334 Ca -0.25 -1.46 -0.51 0.00 0.82 0.00 0.00 66.70 65.29 3h4h h VAL 334 Cb 1.05 1.69 -0.39 0.00 -1.52 0.00 0.00 31.29 32.13 3h4h h VAL 334 CO 1.26 0.46 -0.77 -0.22 0.02 0.00 0.00 177.57 178.31 3h4h s LEU 335 N -8.96 1.16 0.55 2.57 2.96 -1.26 -5.14 118.68 110.56 3h4h s LEU 335 Ca -0.13 -0.63 -0.20 0.00 -0.22 0.00 0.00 54.13 52.95 3h4h s LEU 335 Cb 0.08 -0.63 -0.05 0.00 0.50 0.00 0.00 46.19 46.08 3h4h s LEU 335 CO 0.82 -0.26 1.20 0.00 -1.32 0.00 0.00 176.35 176.79 3h4h s ALA 336 N 1.83 2.69 -0.23 5.97 0.00 -1.26 -4.90 121.76 125.85 3h4h s ALA 336 Ca 0.01 0.99 -0.42 0.00 0.00 0.00 0.00 51.96 52.54 3h4h s ALA 336 Cb -0.16 -3.43 -0.19 0.00 0.00 0.00 0.00 23.12 19.34 3h4h s ALA 336 CO -0.07 -1.01 1.45 -2.30 0.00 0.00 0.00 175.76 173.83 3h4h n PRO 337 N -1.26 0.41 -3.51 0.00 -0.02 -1.26 -4.95 135.00 124.40 3h4h n PRO 337 Ca 0.12 0.15 -0.13 0.00 -2.02 0.00 0.00 63.50 61.62 3h4h n PRO 337 Cb 0.49 -1.71 -0.04 0.00 -0.02 0.00 0.00 33.50 32.22 3h4h n PRO 337 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 3h4h s SER 338 N 1.94 -0.49 0.00 2.55 1.04 -1.26 -5.29 113.70 112.19 3h4h s SER 338 Ca 0.97 0.32 0.06 0.00 0.48 0.00 0.00 55.95 57.77 3h4h s SER 338 Cb -1.27 0.45 0.35 0.00 0.10 0.00 0.00 66.02 65.65 3h4h s SER 338 CO 0.67 -0.62 0.82 0.61 0.98 0.00 0.00 173.24 175.70