#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 1.17 -0.41 6.98 0.00 -2.05 -1.30 119.26 123.65 3h4h h ALA 6 Ca 0.00 -0.00 0.01 0.00 0.00 0.00 0.00 54.91 54.92 3h4h h ALA 6 Cb 0.00 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.55 3h4h h ALA 6 CO 0.00 0.25 0.26 0.00 0.00 0.00 0.00 179.25 179.76 3h4h h ALA 7 N 1.41 0.51 -0.64 0.00 0.00 -2.05 -0.04 119.26 118.44 3h4h h ALA 7 Ca 0.37 -0.02 -0.07 0.00 0.00 0.00 0.00 54.91 55.19 3h4h h ALA 7 Cb 0.18 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 3h4h h ALA 7 CO -0.18 -0.06 0.11 0.93 0.00 0.00 0.00 179.25 180.06 3h4h h GLU 8 N 0.52 1.05 -0.18 0.00 5.08 -1.88 -2.06 114.58 117.11 3h4h h GLU 8 Ca 0.15 -0.27 -0.02 0.00 -1.00 0.00 0.00 59.36 58.23 3h4h h GLU 8 Cb -0.03 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.08 3h4h h GLU 8 CO -0.05 0.95 0.04 0.82 -1.00 0.00 0.00 179.01 179.77 3h4h h ILE 9 N 0.99 1.21 -0.10 3.13 2.04 -1.02 -2.80 117.51 120.96 3h4h h ILE 9 Ca 0.20 -0.67 0.03 0.00 1.00 0.00 0.00 64.86 65.41 3h4h h ILE 9 Cb 0.41 1.32 -0.00 0.00 -0.74 0.00 0.00 36.82 37.80 3h4h h ILE 9 CO 0.01 0.21 0.14 0.00 0.00 0.00 0.00 178.15 178.50 3h4h h ALA 10 N 0.84 1.60 -0.00 1.87 0.00 -0.74 -1.14 119.26 121.70 3h4h h ALA 10 Ca 0.06 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.96 3h4h h ALA 10 Cb 0.28 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.08 3h4h h ALA 10 CO 0.00 -0.19 -0.52 0.00 0.00 0.00 0.00 179.25 178.54 3h4h n ALA 11 N -2.27 3.62 -1.70 0.00 0.00 -0.80 -4.94 120.51 114.43 3h4h n ALA 11 Ca -0.00 -0.38 -0.34 0.00 0.00 0.00 0.00 53.44 52.72 3h4h n ALA 11 Cb 0.24 -1.08 0.00 0.00 0.00 0.00 0.00 19.45 18.61 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 -2.94 3.63 0.35 0.00 1.43 -0.43 -4.98 118.68 115.73 3h4h s LEU 12 Ca 0.12 1.97 -0.29 0.00 -1.03 0.00 0.00 54.13 54.90 3h4h s LEU 12 Cb 0.18 -4.55 -0.11 0.00 0.03 0.00 0.00 46.19 41.73 3h4h s LEU 12 CO 0.70 -1.16 1.51 -2.65 0.23 0.00 0.00 176.35 174.98 3h4h n PRO 13 N -1.65 2.66 -3.79 1.29 -0.02 -1.26 -4.74 135.00 127.48 3h4h n PRO 13 Ca 0.10 0.94 -0.36 0.00 -2.02 0.00 0.00 63.50 62.16 3h4h n PRO 13 Cb 0.52 -2.68 -0.08 0.00 -0.02 0.00 0.00 33.50 31.25 3h4h n PRO 13 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 3h4h s ARG 14 N -1.58 3.96 -0.11 -0.52 3.00 -1.26 -1.07 118.95 121.38 3h4h s ARG 14 Ca 0.57 -0.20 0.03 0.00 0.00 0.00 0.00 55.73 56.12 3h4h s ARG 14 Cb -0.49 -3.34 0.01 0.00 0.00 0.00 0.00 34.95 31.13 3h4h s ARG 14 CO 0.59 0.44 -0.19 -1.14 0.00 0.00 0.00 175.30 175.00 3h4h s GLN 15 N -0.04 2.54 -0.34 3.54 0.74 -0.60 -4.98 119.66 120.52 3h4h s GLN 15 Ca 0.10 -0.69 -0.20 0.00 0.05 0.00 0.00 55.36 54.62 3h4h s GLN 15 Cb -0.11 -2.04 -0.00 0.00 1.10 0.00 0.00 33.01 31.96 3h4h s GLN 15 CO -0.00 0.03 0.61 0.15 -0.55 0.00 0.00 175.29 175.52 3h4h s LYS 16 N 0.71 3.72 -0.12 1.67 1.02 -1.26 0.06 119.74 125.54 3h4h s LYS 16 Ca -0.12 0.07 -0.05 0.00 0.02 0.00 0.00 55.97 55.89 3h4h s LYS 16 Cb -0.16 -3.79 -0.04 0.00 -0.52 0.00 0.00 37.83 33.32 3h4h s LYS 16 CO 0.02 -0.67 0.05 0.08 -0.92 0.00 0.00 175.35 173.90 3h4h s VAL 17 N 2.61 4.68 -0.26 3.17 1.01 -0.47 -4.96 120.40 126.19 3h4h s VAL 17 Ca 0.23 -0.09 -0.14 0.00 0.00 0.00 0.00 61.98 61.98 3h4h s VAL 17 Cb -0.15 -3.03 -0.04 0.00 0.00 0.00 0.00 36.38 33.16 3h4h s VAL 17 CO 0.14 0.56 0.33 -1.61 0.00 0.00 0.00 175.10 174.52 3h4h s GLU 18 N -0.51 4.04 0.33 2.72 8.01 -1.26 -4.64 118.70 127.38 3h4h s GLU 18 Ca 0.10 -0.02 -0.26 0.00 0.01 0.00 0.00 54.97 54.80 3h4h s GLU 18 Cb -0.12 -3.63 -0.10 0.00 -4.31 0.00 0.00 34.13 25.98 3h4h s GLU 18 CO 0.02 -0.19 0.94 -0.51 0.01 0.00 0.00 175.26 175.53 3h4h s LEU 19 N 1.80 4.32 0.24 1.80 1.43 -1.26 -4.76 118.68 122.25 3h4h s LEU 19 Ca 0.14 1.82 0.10 0.00 -1.03 0.00 0.00 54.13 55.15 3h4h s LEU 19 Cb -0.15 -4.03 -0.04 0.00 0.03 0.00 0.00 46.19 41.99 3h4h s LEU 19 CO 0.09 -0.08 -0.08 0.68 0.23 0.00 0.00 176.35 177.19 3h4h s VAL 20 N -1.65 3.13 0.18 -1.59 -7.23 -1.26 -5.02 120.40 106.96 3h4h s VAL 20 Ca 0.51 -1.94 -0.30 0.00 -1.81 0.00 0.00 61.98 58.43 3h4h s VAL 20 Cb -0.18 -2.62 -0.08 0.00 0.56 0.00 0.00 36.38 34.06 3h4h s VAL 20 CO 0.23 -0.29 1.01 -1.81 -0.31 0.00 0.00 175.10 173.93 3h4h s ASP 21 N -3.35 7.44 0.51 4.85 -0.00 -1.26 -4.65 116.67 120.21 3h4h s ASP 21 Ca 0.29 1.98 -0.21 0.00 -0.00 0.00 0.00 52.55 54.60 3h4h s ASP 21 Cb -0.07 -2.60 -0.08 0.00 -0.00 0.00 0.00 42.92 40.17 3h4h s ASP 21 CO 0.17 -0.06 0.94 -2.65 -0.00 0.00 0.00 175.17 173.57 3h4h n PRO 22 N 2.14 1.10 -0.14 8.23 -0.02 -1.26 -1.76 135.00 143.28 3h4h n PRO 22 Ca 0.01 0.40 0.06 0.00 -2.02 0.00 0.00 63.50 61.95 3h4h n PRO 22 Cb 0.47 -2.05 0.19 0.00 -0.02 0.00 0.00 33.50 32.09 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 -0.30 1.71 -2.06 0.52 -0.04 -1.26 -5.04 135.00 128.53 3h4h n PRO 23 Ca 0.11 -1.10 -0.31 0.00 -0.04 0.00 0.00 63.50 62.16 3h4h n PRO 23 Cb 0.43 -1.27 0.00 0.00 -0.04 0.00 0.00 33.50 32.62 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 -1.63 3.59 -0.02 0.54 0.40 -0.72 -0.63 117.98 119.53 3h4h s PHE 24 Ca 0.23 1.25 0.04 0.00 -0.60 0.00 0.00 56.93 57.86 3h4h s PHE 24 Cb 0.12 -2.68 -0.01 0.00 0.51 0.00 0.00 43.02 40.97 3h4h s PHE 24 CO 0.17 -0.58 -0.15 0.08 0.70 0.00 0.00 175.22 175.43 3h4h s VAL 25 N -3.03 1.20 0.80 -0.44 1.01 -1.26 -4.55 120.40 114.13 3h4h s VAL 25 Ca 0.55 -0.64 -0.13 0.00 0.00 0.00 0.00 61.98 61.75 3h4h s VAL 25 Cb -0.11 -1.01 0.08 0.00 0.00 0.00 0.00 36.38 35.35 3h4h s VAL 25 CO 0.49 0.34 1.20 -1.38 0.00 0.00 0.00 175.10 175.75 3h4h s HIS 26 N -0.27 1.85 0.32 5.22 -3.43 -1.26 -4.91 115.29 112.81 3h4h s HIS 26 Ca 0.04 1.66 -0.29 0.00 -0.80 0.00 0.00 55.06 55.68 3h4h s HIS 26 Cb -0.07 -3.47 -0.12 0.00 -1.43 0.00 0.00 32.58 27.49 3h4h s HIS 26 CO -0.00 -2.79 1.40 0.00 -2.00 0.00 0.00 174.74 171.35 3h4h n ALA 27 N -3.25 1.69 -3.65 -1.38 0.00 -1.26 -4.99 120.51 107.67 3h4h n ALA 27 Ca 0.13 0.37 -0.09 0.00 0.00 0.00 0.00 53.44 53.85 3h4h n ALA 27 Cb 0.51 -2.33 -0.02 0.00 0.00 0.00 0.00 19.45 17.61 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 -0.73 -0.27 -0.12 0.00 -3.43 -1.26 -5.04 115.29 104.43 3h4h s HIS 28 Ca 0.59 -0.10 -0.05 0.00 -0.80 0.00 0.00 55.06 54.70 3h4h s HIS 28 Cb -0.55 0.62 -0.04 0.00 -1.43 0.00 0.00 32.58 31.18 3h4h s HIS 28 CO 0.58 -1.08 0.07 0.45 -2.00 0.00 0.00 174.74 172.76 3h4h s SER 29 N -2.87 5.82 0.03 7.38 0.15 -1.26 -5.01 113.70 117.94 3h4h s SER 29 Ca 0.08 0.27 -0.20 0.00 0.70 0.00 0.00 55.95 56.80 3h4h s SER 29 Cb -0.04 -1.83 -0.17 0.00 -1.71 0.00 0.00 66.02 62.28 3h4h s SER 29 CO 0.00 0.35 1.27 1.56 1.20 0.00 0.00 173.24 177.62 3h4h h GLN 30 N 5.39 0.36 -6.02 5.44 4.20 -1.97 -3.42 115.11 119.09 3h4h h GLN 30 Ca -0.50 -0.23 -0.58 0.00 0.06 0.00 0.00 58.65 57.40 3h4h h GLN 30 Cb 1.20 0.03 -0.06 0.00 0.30 0.00 0.00 27.48 28.95 3h4h h GLN 30 CO 0.59 0.83 -0.09 0.08 -0.67 0.00 0.00 178.83 179.58 3h4h s VAL 31 N -3.99 4.96 0.24 -0.54 1.01 -1.26 -2.86 120.40 117.96 3h4h s VAL 31 Ca -0.14 1.09 -0.30 0.00 0.00 0.00 0.00 61.98 62.62 3h4h s VAL 31 Cb 0.05 -3.85 -0.10 0.00 0.00 0.00 0.00 36.38 32.47 3h4h s VAL 31 CO 0.77 0.46 1.47 0.00 0.00 0.00 0.00 175.10 177.79 3h4h s ALA 32 N -0.38 3.66 -0.64 5.51 0.00 0.21 -4.94 121.76 125.19 3h4h s ALA 32 Ca 0.28 1.35 -0.23 0.00 0.00 0.00 0.00 51.96 53.35 3h4h s ALA 32 Cb -0.17 -3.57 0.06 0.00 0.00 0.00 0.00 23.12 19.44 3h4h s ALA 32 CO 0.15 -0.76 0.97 -1.21 0.00 0.00 0.00 175.76 174.91 3h4h s GLU 33 N -0.14 3.16 0.68 0.00 2.02 -1.26 -4.94 118.70 118.21 3h4h s GLU 33 Ca 0.61 -0.68 0.00 0.00 0.02 0.00 0.00 54.97 54.92 3h4h s GLU 33 Cb -0.42 -4.19 0.00 0.00 0.10 0.00 0.00 34.13 29.62 3h4h s GLU 33 CO 0.42 -1.75 0.00 0.41 0.02 0.00 0.00 175.26 174.35 3h4h n GLY 34 N 5.28 -2.02 1.23 -1.39 0.00 -1.26 -4.93 105.19 102.11 3h4h n GLY 34 Ca -0.02 -1.39 -0.10 0.00 0.00 0.00 0.00 46.02 44.50 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 -0.79 -2.48 3.74 -0.02 0.00 -1.26 -4.96 105.19 99.42 3h4h n GLY 35 Ca 0.00 -1.48 -0.38 0.00 0.00 0.00 0.00 46.02 44.17 3h4h n GLY 35 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3h4h s PRO 36 N -3.88 2.82 0.14 1.61 0.02 -1.26 -5.02 135.00 129.42 3h4h s PRO 36 Ca 0.25 2.17 0.04 0.00 0.02 0.00 0.00 61.00 63.48 3h4h s PRO 36 Cb -0.02 -2.05 -0.04 0.00 0.02 0.00 0.00 34.50 32.41 3h4h s PRO 36 CO 0.19 -1.42 -0.09 0.15 -0.33 0.00 0.00 177.00 175.50 3h4h s LYS 37 N -3.15 1.03 -0.51 5.54 1.02 -1.26 -4.49 119.74 117.92 3h4h s LYS 37 Ca 0.77 -1.44 -0.17 0.00 0.02 0.00 0.00 55.97 55.16 3h4h s LYS 37 Cb -0.40 -0.54 0.08 0.00 -0.52 0.00 0.00 37.83 36.46 3h4h s LYS 37 CO 0.44 0.05 0.52 0.08 -0.92 0.00 0.00 175.35 175.53 3h4h s VAL 38 N -3.39 5.07 -0.24 3.17 1.01 -0.23 -0.19 120.40 125.60 3h4h s VAL 38 Ca 0.16 -0.97 -0.19 0.00 0.00 0.00 0.00 61.98 60.98 3h4h s VAL 38 Cb 0.03 -4.27 -0.03 0.00 0.00 0.00 0.00 36.38 32.12 3h4h s VAL 38 CO -0.00 -0.77 0.57 -0.69 0.00 0.00 0.00 175.10 174.20 3h4h s VAL 39 N 2.07 5.04 -0.18 2.92 1.01 0.11 -1.55 120.40 129.82 3h4h s VAL 39 Ca 0.08 1.01 -0.07 0.00 0.00 0.00 0.00 61.98 63.01 3h4h s VAL 39 Cb -0.24 -3.88 -0.04 0.00 0.00 0.00 0.00 36.38 32.23 3h4h s VAL 39 CO 0.07 0.09 0.04 -1.61 0.00 0.00 0.00 175.10 173.69 3h4h s GLU 40 N 2.18 3.90 0.08 2.72 2.02 0.11 -0.71 118.70 129.00 3h4h s GLU 40 Ca 0.24 -0.39 0.06 0.00 0.02 0.00 0.00 54.97 54.91 3h4h s GLU 40 Cb -0.16 -3.15 -0.03 0.00 0.10 0.00 0.00 34.13 30.89 3h4h s GLU 40 CO 0.09 0.25 -0.17 -0.06 0.02 0.00 0.00 175.26 175.40 3h4h s PHE 41 N 0.40 1.43 -0.02 1.61 0.40 -0.49 -1.36 117.98 119.95 3h4h s PHE 41 Ca 0.02 -0.45 0.03 0.00 -0.60 0.00 0.00 56.93 55.93 3h4h s PHE 41 Cb -0.13 -0.79 -0.00 0.00 0.51 0.00 0.00 43.02 42.61 3h4h s PHE 41 CO 0.01 0.11 -0.10 0.99 0.70 0.00 0.00 175.22 176.93 3h4h s THR 42 N -1.26 0.85 -0.02 0.64 2.01 -1.26 -0.57 115.64 116.03 3h4h s THR 42 Ca 0.01 -0.43 0.00 0.00 0.31 0.00 0.00 61.69 61.59 3h4h s THR 42 Cb -0.10 -0.73 0.02 0.00 0.01 0.00 0.00 72.50 71.70 3h4h s THR 42 CO 0.03 0.25 0.02 -0.04 -0.69 0.00 0.00 174.62 174.19 3h4h s MET 43 N -0.04 0.01 -0.13 4.92 -1.94 -0.60 -4.90 119.30 116.62 3h4h s MET 43 Ca 0.01 0.13 -0.08 0.00 -1.71 0.00 0.00 55.69 54.03 3h4h s MET 43 Cb -0.06 -0.22 -0.04 0.00 2.01 0.00 0.00 34.83 36.51 3h4h s MET 43 CO 0.00 -0.12 0.16 0.08 -0.01 0.00 0.00 175.02 175.13 3h4h s VAL 44 N 0.81 5.45 -0.02 -6.03 1.01 -1.26 -1.53 120.40 118.82 3h4h s VAL 44 Ca -0.07 0.26 -0.23 0.00 0.00 0.00 0.00 61.98 61.94 3h4h s VAL 44 Cb -0.10 -3.45 -0.04 0.00 0.00 0.00 0.00 36.38 32.79 3h4h s VAL 44 CO -0.02 0.57 0.70 -0.63 0.00 0.00 0.00 175.10 175.72 3h4h s ILE 45 N -0.64 4.93 -0.16 2.22 1.01 -0.15 -0.59 121.20 127.82 3h4h s ILE 45 Ca 0.14 1.46 0.00 0.00 0.00 0.00 0.00 60.65 62.26 3h4h s ILE 45 Cb -0.12 -4.04 0.03 0.00 0.01 0.00 0.00 42.46 38.33 3h4h s ILE 45 CO 0.03 0.31 -0.13 -1.61 0.00 0.00 0.00 174.94 173.55 3h4h s GLU 46 N 0.37 2.20 -0.32 2.79 0.41 0.05 -4.42 118.70 119.78 3h4h s GLU 46 Ca 0.37 -0.60 -0.23 0.00 -0.41 0.00 0.00 54.97 54.10 3h4h s GLU 46 Cb -0.19 -2.14 0.00 0.00 -1.78 0.00 0.00 34.13 30.02 3h4h s GLU 46 CO 0.19 -0.28 0.77 -1.21 -0.49 0.00 0.00 175.26 174.24 3h4h s GLU 47 N 1.48 3.90 0.05 1.61 2.02 -1.26 -0.49 118.70 126.01 3h4h s GLU 47 Ca 0.04 0.48 -0.10 0.00 0.02 0.00 0.00 54.97 55.40 3h4h s GLU 47 Cb -0.13 -3.75 0.01 0.00 0.10 0.00 0.00 34.13 30.35 3h4h s GLU 47 CO -0.10 -0.71 0.22 -1.59 0.02 0.00 0.00 175.26 173.10 3h4h s LYS 48 N 2.96 0.75 0.20 1.61 -2.85 -0.74 -4.97 119.74 116.69 3h4h s LYS 48 Ca 0.31 -0.66 -0.30 0.00 -1.00 0.00 0.00 55.97 54.33 3h4h s LYS 48 Cb -0.14 0.31 -0.09 0.00 -2.06 0.00 0.00 37.83 35.86 3h4h s LYS 48 CO 0.14 -0.23 1.32 0.15 0.10 0.00 0.00 175.35 176.83 3h4h s LYS 49 N -2.78 4.38 0.12 1.78 1.02 -1.26 -0.27 119.74 122.73 3h4h s LYS 49 Ca -0.03 2.06 0.11 0.00 0.02 0.00 0.00 55.97 58.13 3h4h s LYS 49 Cb -0.00 -3.19 -0.04 0.00 -0.52 0.00 0.00 37.83 34.08 3h4h s LYS 49 CO -0.05 -0.27 -0.26 0.96 -0.92 0.00 0.00 175.35 174.81 3h4h s ILE 50 N 0.14 2.20 -0.22 2.17 -4.36 0.22 -4.88 121.20 116.47 3h4h s ILE 50 Ca 0.57 -1.71 -0.08 0.00 -0.26 0.00 0.00 60.65 59.17 3h4h s ILE 50 Cb -0.37 -1.95 -0.04 0.00 1.25 0.00 0.00 42.46 41.36 3h4h s ILE 50 CO 0.38 0.10 0.09 -0.69 0.24 0.00 0.00 174.94 175.06 3h4h s VAL 51 N -1.05 4.75 -0.82 8.37 1.01 -1.26 -0.73 120.40 130.67 3h4h s VAL 51 Ca 0.13 -0.04 0.12 0.00 0.00 0.00 0.00 61.98 62.20 3h4h s VAL 51 Cb -0.10 -3.18 -0.08 0.00 0.00 0.00 0.00 36.38 33.02 3h4h s VAL 51 CO 0.06 0.39 0.61 2.30 0.00 0.00 0.00 175.10 178.45 3h4h n ILE 52 N 4.17 0.00 -4.03 2.22 -5.35 0.70 -4.83 119.36 112.24 3h4h n ILE 52 Ca -0.16 -0.27 -0.11 0.00 -0.27 0.00 0.00 62.75 61.94 3h4h n ILE 52 Cb 0.52 1.06 -0.05 0.00 -1.74 0.00 0.00 39.64 39.43 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 -1.95 0.17 0.14 7.28 3.84 -1.26 -1.19 116.67 123.71 3h4h s ASP 53 Ca 0.07 -1.12 0.21 0.00 -0.00 0.00 0.00 52.55 51.71 3h4h s ASP 53 Cb 0.10 0.59 0.86 0.00 -1.38 0.00 0.00 42.92 43.09 3h4h s ASP 53 CO 0.43 -1.17 1.65 -0.90 -0.00 0.00 0.00 175.17 175.19 3h4h n ASP 54 N -0.65 0.40 -0.11 2.11 5.68 -1.26 -2.26 116.55 120.46 3h4h n ASP 54 Ca -0.01 0.58 0.09 0.00 -0.50 0.00 0.00 54.79 54.95 3h4h n ASP 54 Cb 0.62 -0.67 0.47 0.00 -1.14 0.00 0.00 41.12 40.39 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 -1.66 2.58 -1.22 2.12 0.00 -1.26 -4.91 120.51 116.17 3h4h n ALA 55 Ca 0.03 -0.19 -0.03 0.00 0.00 0.00 0.00 53.44 53.26 3h4h n ALA 55 Cb 0.24 -1.23 -0.01 0.00 0.00 0.00 0.00 19.45 18.44 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 0.83 0.58 3.73 0.00 0.00 -0.96 -5.00 105.19 104.37 3h4h n GLY 56 Ca 0.13 -0.91 -0.42 0.00 0.00 0.00 0.00 46.02 44.83 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 -2.12 2.85 -0.03 2.61 2.01 -1.26 -4.90 115.64 114.80 3h4h s THR 57 Ca 0.00 0.68 0.01 0.00 0.31 0.00 0.00 61.69 62.69 3h4h s THR 57 Cb 0.00 -3.43 -0.03 0.00 0.01 0.00 0.00 72.50 69.04 3h4h s THR 57 CO 0.00 0.09 -0.03 -1.61 -0.69 0.00 0.00 174.62 172.38 3h4h s GLU 58 N 0.15 2.76 0.03 4.92 2.02 -1.26 -0.21 118.70 127.11 3h4h s GLU 58 Ca 0.61 -0.58 0.08 0.00 0.02 0.00 0.00 54.97 55.10 3h4h s GLU 58 Cb -0.40 -2.63 -0.02 0.00 0.10 0.00 0.00 34.13 31.17 3h4h s GLU 58 CO 0.38 0.65 -0.22 0.08 0.02 0.00 0.00 175.26 176.17 3h4h s VAL 59 N -0.95 1.76 -0.97 2.63 1.01 0.09 -4.96 120.40 119.00 3h4h s VAL 59 Ca 0.16 -1.18 -0.23 0.00 0.00 0.00 0.00 61.98 60.73 3h4h s VAL 59 Cb -0.11 -1.51 0.06 0.00 0.00 0.00 0.00 36.38 34.82 3h4h s VAL 59 CO 0.06 0.29 1.39 -1.00 0.00 0.00 0.00 175.10 175.83 3h4h s HIS 60 N -0.74 2.56 0.37 5.22 3.76 -1.26 -0.61 115.29 124.59 3h4h s HIS 60 Ca 0.08 -0.80 -0.26 0.00 -0.15 0.00 0.00 55.06 53.93 3h4h s HIS 60 Cb -0.09 -4.64 -0.09 0.00 1.11 0.00 0.00 32.58 28.87 3h4h s HIS 60 CO 0.01 -1.90 1.16 0.00 -0.85 0.00 0.00 174.74 173.16 3h4h s ALA 61 N 4.81 3.23 -0.35 -1.40 0.00 0.63 -4.84 121.76 123.84 3h4h s ALA 61 Ca 0.43 0.96 0.03 0.00 0.00 0.00 0.00 51.96 53.38 3h4h s ALA 61 Cb -0.02 -3.37 0.10 0.00 0.00 0.00 0.00 23.12 19.83 3h4h s ALA 61 CO -0.07 -0.44 0.07 -1.64 0.00 0.00 0.00 175.76 173.68 3h4h s MET 62 N -2.10 1.53 -0.21 0.00 -1.94 -0.45 -1.80 119.30 114.33 3h4h s MET 62 Ca 0.54 -1.89 0.00 0.00 -1.71 0.00 0.00 55.69 52.63 3h4h s MET 62 Cb -0.31 -3.25 0.02 0.00 2.01 0.00 0.00 34.83 33.31 3h4h s MET 62 CO 0.39 -0.95 -0.14 0.00 -0.01 0.00 0.00 175.02 174.31 3h4h s ALA 63 N 0.90 2.50 0.08 3.03 0.00 0.35 -2.28 121.76 126.34 3h4h s ALA 63 Ca 0.11 -1.35 -0.31 0.00 0.00 0.00 0.00 51.96 50.41 3h4h s ALA 63 Cb -0.19 -1.41 -0.09 0.00 0.00 0.00 0.00 23.12 21.42 3h4h s ALA 63 CO -0.08 -0.59 1.83 -0.06 0.00 0.00 0.00 175.76 176.86 3h4h s PHE 64 N 1.29 1.95 -1.70 0.00 0.08 -1.25 -0.77 117.98 117.58 3h4h s PHE 64 Ca 0.02 -0.07 0.00 0.00 0.12 0.00 0.00 56.93 57.00 3h4h s PHE 64 Cb -0.15 -4.15 0.00 0.00 -0.57 0.00 0.00 43.02 38.15 3h4h s PHE 64 CO -0.09 -4.83 0.00 -1.71 -0.10 0.00 0.00 175.22 168.49 3h4h n ASN 65 N 6.24 -5.20 0.00 1.36 5.15 0.25 -2.48 115.26 120.57 3h4h n ASN 65 Ca 0.18 0.40 0.00 0.00 -0.60 0.00 0.00 54.58 54.56 3h4h n ASN 65 Cb 0.40 -4.11 0.00 0.00 -0.53 0.00 0.00 39.78 35.53 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 0.48 3.37 8.20 0.00 -1.00 -4.94 105.19 110.66 3h4h n GLY 66 Ca -0.16 0.00 -0.21 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 -2.14 1.93 -0.20 2.61 -4.23 -1.04 -4.96 115.64 107.61 3h4h s THR 67 Ca 0.00 -2.14 0.01 0.00 -1.18 0.00 0.00 61.69 58.37 3h4h s THR 67 Cb 0.00 -2.03 0.05 0.00 1.34 0.00 0.00 72.50 71.86 3h4h s THR 67 CO 0.00 -0.44 -0.08 -0.69 -0.54 0.00 0.00 174.62 172.87 3h4h s VAL 68 N -2.51 1.52 0.97 2.29 1.01 -1.26 -3.01 120.40 119.40 3h4h s VAL 68 Ca 0.22 -1.01 -0.13 0.00 0.00 0.00 0.00 61.98 61.05 3h4h s VAL 68 Cb -0.04 -1.67 0.17 0.00 0.00 0.00 0.00 36.38 34.84 3h4h s VAL 68 CO 0.08 0.08 1.14 -2.16 0.00 0.00 0.00 175.10 174.24 3h4h s PRO 69 N 1.44 0.69 0.94 2.72 0.04 -1.26 -2.14 135.00 137.43 3h4h s PRO 69 Ca -0.02 0.23 -0.11 0.00 0.04 0.00 0.00 61.00 61.13 3h4h s PRO 69 Cb -0.17 -1.79 0.16 0.00 0.04 0.00 0.00 34.50 32.74 3h4h s PRO 69 CO -0.07 -2.49 1.10 0.20 0.04 0.00 0.00 177.00 175.77 3h4h s GLY 70 N -3.98 1.63 0.72 0.56 0.00 0.01 -4.74 107.32 101.52 3h4h s GLY 70 Ca 0.66 0.19 -0.13 0.00 0.00 0.00 0.00 44.72 45.43 3h4h s GLY 70 CO 0.54 0.68 1.11 2.56 0.00 0.00 0.00 173.10 177.99 3h4h s PRO 71 N -4.74 2.47 -0.09 2.90 0.04 -1.26 -4.43 135.00 129.89 3h4h s PRO 71 Ca 0.65 1.33 -0.30 0.00 0.04 0.00 0.00 61.00 62.73 3h4h s PRO 71 Cb -0.21 -1.91 -0.02 0.00 0.04 0.00 0.00 34.50 32.40 3h4h s PRO 71 CO 0.59 -1.50 1.05 -1.17 0.04 0.00 0.00 177.00 176.00 3h4h s LEU 72 N -5.37 4.26 -0.19 -3.56 2.96 -1.26 -4.29 118.68 111.24 3h4h s LEU 72 Ca 0.65 1.60 -0.09 0.00 -0.22 0.00 0.00 54.13 56.08 3h4h s LEU 72 Cb -0.20 -3.56 -0.05 0.00 0.50 0.00 0.00 46.19 42.89 3h4h s LEU 72 CO 0.48 -0.47 0.10 -0.04 -1.32 0.00 0.00 176.35 175.10 3h4h s MET 73 N 2.00 4.04 -0.17 1.98 -1.94 -1.15 -4.56 119.30 119.50 3h4h s MET 73 Ca 0.50 -0.27 0.01 0.00 -1.71 0.00 0.00 55.69 54.22 3h4h s MET 73 Cb -0.20 -3.31 0.01 0.00 2.01 0.00 0.00 34.83 33.34 3h4h s MET 73 CO 0.19 0.32 -0.19 0.08 -0.01 0.00 0.00 175.02 175.42 3h4h s VAL 74 N 0.27 2.23 0.33 -6.03 1.01 -1.26 0.15 120.40 117.10 3h4h s VAL 74 Ca 0.06 -0.90 0.04 0.00 0.00 0.00 0.00 61.98 61.19 3h4h s VAL 74 Cb -0.12 -1.93 -0.01 0.00 0.00 0.00 0.00 36.38 34.32 3h4h s VAL 74 CO -0.01 0.53 0.14 1.33 0.00 0.00 0.00 175.10 177.09 3h4h n VAL 75 N 4.43 0.00 -4.34 2.92 0.24 -0.34 -4.99 118.33 116.24 3h4h n VAL 75 Ca -0.20 -1.99 -0.23 0.00 -2.04 0.00 0.00 64.34 59.88 3h4h n VAL 75 Cb 0.51 0.75 -0.08 0.00 -1.47 0.00 0.00 33.84 33.55 3h4h n VAL 75 CO 0.00 0.00 0.00 -1.00 -2.14 0.00 0.00 176.83 173.69 3h4h s HIS 76 N -2.86 2.59 0.25 6.34 3.76 -1.26 -0.76 115.29 123.34 3h4h s HIS 76 Ca 0.19 -0.25 -0.31 0.00 -0.15 0.00 0.00 55.06 54.55 3h4h s HIS 76 Cb 0.01 -1.15 -0.14 0.00 1.11 0.00 0.00 32.58 32.42 3h4h s HIS 76 CO 0.14 0.64 1.33 0.94 -0.85 0.00 0.00 174.74 176.93 3h4h n GLN 77 N -0.78 1.87 -0.90 1.40 7.27 0.06 -1.41 117.38 124.89 3h4h n GLN 77 Ca -0.06 0.66 0.00 0.00 0.07 0.00 0.00 57.00 57.67 3h4h n GLN 77 Cb 0.59 -2.27 0.00 0.00 2.41 0.00 0.00 30.24 30.97 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 1.88 -2.31 -4.67 1.69 10.43 0.30 -4.75 116.55 119.12 3h4h n ASP 78 Ca 0.11 0.00 -0.29 0.00 2.57 0.00 0.00 54.79 57.18 3h4h n ASP 78 Cb 0.31 -1.49 0.18 0.00 1.84 0.00 0.00 41.12 41.96 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 -2.26 2.63 -0.11 -2.24 -0.00 -0.50 -4.63 116.67 109.56 3h4h s ASP 79 Ca 0.00 1.10 -0.00 0.00 -0.00 0.00 0.00 52.55 53.65 3h4h s ASP 79 Cb 0.00 -1.74 -0.02 0.00 -0.00 0.00 0.00 42.92 41.16 3h4h s ASP 79 CO 0.00 -3.12 -0.09 -0.31 -0.00 0.00 0.00 175.17 171.65 3h4h s TYR 80 N -3.02 2.88 -0.26 4.23 1.51 0.74 -1.71 117.35 121.71 3h4h s TYR 80 Ca 0.65 -0.30 -0.11 0.00 -1.01 0.00 0.00 57.07 56.31 3h4h s TYR 80 Cb -0.18 -1.81 -0.05 0.00 -0.11 0.00 0.00 41.96 39.82 3h4h s TYR 80 CO 0.57 0.04 0.17 -1.17 -1.11 0.00 0.00 175.55 174.05 3h4h s LEU 81 N -0.12 4.04 -0.30 -1.29 0.20 -0.24 0.08 118.68 121.05 3h4h s LEU 81 Ca 0.00 0.04 0.02 0.00 0.69 0.00 0.00 54.13 54.88 3h4h s LEU 81 Cb -0.13 -2.10 0.07 0.00 -0.43 0.00 0.00 46.19 43.59 3h4h s LEU 81 CO 0.03 0.01 -0.03 -0.70 -0.29 0.00 0.00 176.35 175.37 3h4h s GLU 82 N 1.42 2.11 -0.21 1.98 2.12 0.11 -1.55 118.70 124.68 3h4h s GLU 82 Ca 0.07 -1.47 -0.07 0.00 0.36 0.00 0.00 54.97 53.86 3h4h s GLU 82 Cb -0.15 -3.07 -0.04 0.00 0.26 0.00 0.00 34.13 31.13 3h4h s GLU 82 CO 0.08 -0.69 0.06 -1.17 -0.54 0.00 0.00 175.26 172.99 3h4h s LEU 83 N 1.10 3.64 -0.35 2.70 2.96 0.22 -1.40 118.68 127.55 3h4h s LEU 83 Ca -0.03 -0.04 -0.20 0.00 -0.22 0.00 0.00 54.13 53.64 3h4h s LEU 83 Cb -0.20 -1.94 -0.00 0.00 0.50 0.00 0.00 46.19 44.55 3h4h s LEU 83 CO -0.05 0.09 0.60 -0.89 -1.32 0.00 0.00 176.35 174.79 3h4h s THR 84 N 0.84 4.93 -0.19 3.68 2.01 0.26 -1.26 115.64 125.91 3h4h s THR 84 Ca 0.03 0.57 -0.04 0.00 0.31 0.00 0.00 61.69 62.56 3h4h s THR 84 Cb -0.14 -4.04 -0.02 0.00 0.01 0.00 0.00 72.50 68.32 3h4h s THR 84 CO 0.02 -0.26 -0.04 -0.22 -0.69 0.00 0.00 174.62 173.43 3h4h s LEU 85 N 2.62 3.01 -0.13 4.42 2.96 -0.04 -1.56 118.68 129.96 3h4h s LEU 85 Ca 0.23 -0.29 0.02 0.00 -0.22 0.00 0.00 54.13 53.86 3h4h s LEU 85 Cb -0.15 -1.75 -0.00 0.00 0.50 0.00 0.00 46.19 44.79 3h4h s LEU 85 CO 0.14 0.06 -0.19 -0.63 -1.32 0.00 0.00 176.35 174.41 3h4h s ILE 86 N 1.02 2.43 -0.45 6.68 1.01 -0.59 -1.32 121.20 129.98 3h4h s ILE 86 Ca 0.01 -0.87 -0.06 0.00 0.00 0.00 0.00 60.65 59.73 3h4h s ILE 86 Cb -0.15 -1.99 0.12 0.00 0.01 0.00 0.00 42.46 40.45 3h4h s ILE 86 CO 0.00 0.54 0.28 0.21 0.00 0.00 0.00 174.94 175.97 3h4h s ASN 87 N 0.61 5.46 0.84 3.58 2.47 -0.19 -0.98 114.94 126.72 3h4h s ASN 87 Ca -0.10 -2.02 -0.10 0.00 0.42 0.00 0.00 52.86 51.05 3h4h s ASN 87 Cb -0.16 -1.91 0.10 0.00 -1.45 0.00 0.00 41.25 37.83 3h4h s ASN 87 CO 0.03 -0.60 1.12 -2.84 -3.72 0.00 0.00 177.10 171.08 3h4h s PRO 88 N 1.18 1.67 0.53 0.43 0.02 -1.26 0.59 135.00 138.15 3h4h s PRO 88 Ca 0.08 1.33 0.34 0.00 0.02 0.00 0.00 61.00 62.77 3h4h s PRO 88 Cb -0.24 -1.82 1.59 0.00 0.02 0.00 0.00 34.50 34.05 3h4h s PRO 88 CO -0.03 -2.11 2.03 1.05 -0.33 0.00 0.00 177.00 177.62 3h4h h GLU 89 N -1.48 0.00 0.00 5.54 4.11 -1.92 -2.58 114.58 118.26 3h4h h GLU 89 Ca -0.44 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.99 3h4h h GLU 89 Cb 1.25 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.50 3h4h h GLU 89 CO 0.47 0.00 0.00 1.79 0.07 0.00 0.00 179.01 181.34 3h4h h THR 90 N 0.00 0.00 -4.14 -1.06 1.35 -1.96 -3.45 112.91 103.65 3h4h h THR 90 Ca 0.00 -0.45 -0.49 0.00 -0.55 0.00 0.00 66.41 64.91 3h4h h THR 90 Cb 0.32 1.35 0.06 0.00 -1.73 0.00 0.00 68.15 68.16 3h4h h THR 90 CO 0.00 0.00 0.32 0.20 -0.25 0.00 0.00 175.52 175.79 3h4h s ASN 91 N -5.07 5.78 -0.00 5.36 0.01 -0.97 -4.98 114.94 115.07 3h4h s ASN 91 Ca 0.04 1.08 0.02 0.00 -0.71 0.00 0.00 52.86 53.29 3h4h s ASN 91 Cb 0.09 -2.05 -0.03 0.00 0.41 0.00 0.00 41.25 39.67 3h4h s ASN 91 CO 0.51 -1.06 0.10 0.35 -1.51 0.00 0.00 177.10 175.49 3h4h n THR 92 N -2.75 0.00 -4.44 1.60 -2.24 -1.26 -4.78 114.28 100.41 3h4h n THR 92 Ca 0.05 -0.41 -0.25 0.00 -2.27 0.00 0.00 64.05 61.17 3h4h n THR 92 Cb 0.56 0.95 -0.11 0.00 -2.10 0.00 0.00 70.33 69.64 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 -2.20 2.55 0.30 3.22 1.43 -1.26 -4.94 118.68 117.77 3h4h s LEU 93 Ca 0.01 -0.94 -0.24 0.00 -1.03 0.00 0.00 54.13 51.94 3h4h s LEU 93 Cb 0.02 -1.16 -0.09 0.00 0.03 0.00 0.00 46.19 44.98 3h4h s LEU 93 CO 0.10 0.08 0.87 -0.89 0.23 0.00 0.00 176.35 176.74 3h4h s THR 94 N -2.11 4.34 0.14 5.49 2.01 -1.26 -4.11 115.64 120.15 3h4h s THR 94 Ca 0.26 1.62 -0.03 0.00 0.31 0.00 0.00 61.69 63.85 3h4h s THR 94 Cb -0.06 -3.93 -0.03 0.00 0.01 0.00 0.00 72.50 68.48 3h4h s THR 94 CO 0.13 0.13 0.11 -1.00 -0.69 0.00 0.00 174.62 173.30 3h4h s HIS 95 N -1.62 0.79 0.00 4.92 0.09 -0.79 -4.87 115.29 113.81 3h4h s HIS 95 Ca 0.49 -1.15 0.00 0.00 -0.00 0.00 0.00 55.06 54.40 3h4h s HIS 95 Cb -0.17 -0.40 0.00 0.00 -0.00 0.00 0.00 32.58 32.01 3h4h s HIS 95 CO 0.22 -0.58 0.00 0.27 -0.00 0.00 0.00 174.74 174.66 3h4h n ASN 96 N -0.14 0.00 -3.73 1.40 6.94 -1.26 -0.60 115.26 117.87 3h4h n ASN 96 Ca -0.05 -0.63 -0.12 0.00 -0.02 0.00 0.00 54.58 53.76 3h4h n ASN 96 Cb 0.64 0.00 -0.12 0.00 -2.36 0.00 0.00 39.78 37.94 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 -2.81 -0.03 -0.27 1.53 2.07 -1.26 -4.12 121.20 116.31 3h4h s ILE 97 Ca 0.00 0.10 -0.02 0.00 -1.41 0.00 0.00 60.65 59.32 3h4h s ILE 97 Cb 0.00 -0.46 0.03 0.00 0.13 0.00 0.00 42.46 42.16 3h4h s ILE 97 CO 0.00 0.04 -0.03 -0.62 -1.91 0.00 0.00 174.94 172.42 3h4h s ASP 98 N 1.06 4.57 -0.25 4.50 3.68 0.41 -1.02 116.67 129.61 3h4h s ASP 98 Ca -0.07 -1.01 -0.17 0.00 2.13 0.00 0.00 52.55 53.43 3h4h s ASP 98 Cb -0.08 -1.69 -0.03 0.00 -1.45 0.00 0.00 42.92 39.67 3h4h s ASP 98 CO -0.08 -0.18 0.46 -0.36 0.13 0.00 0.00 175.17 175.14 3h4h s PHE 99 N 1.31 3.28 -0.37 -5.34 0.40 0.62 -1.34 117.98 116.54 3h4h s PHE 99 Ca -0.02 0.57 0.24 0.00 -0.60 0.00 0.00 56.93 57.13 3h4h s PHE 99 Cb -0.18 -2.65 1.06 0.00 0.51 0.00 0.00 43.02 41.76 3h4h s PHE 99 CO -0.03 -0.23 1.73 0.45 0.70 0.00 0.00 175.22 177.84 3h4h h HIS 100 N 7.96 0.00 0.00 0.36 3.86 -1.44 -2.28 115.15 123.62 3h4h h HIS 100 Ca -0.31 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.90 3h4h h HIS 100 Cb 1.15 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.62 3h4h h HIS 100 CO 0.75 0.00 0.00 0.00 0.86 0.00 0.00 177.93 179.54 3h4h h ALA 101 N 2.19 1.00 -2.20 2.45 0.00 -1.89 -3.47 119.26 117.34 3h4h h ALA 101 Ca 0.00 0.00 -0.47 0.00 0.00 0.00 0.00 54.91 54.44 3h4h h ALA 101 Cb 0.29 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.08 3h4h h ALA 101 CO 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 179.25 178.95 3h4h s ALA 102 N -3.33 3.81 -0.23 0.00 0.00 -0.86 -4.54 121.76 116.63 3h4h s ALA 102 Ca 0.06 -1.07 0.02 0.00 0.00 0.00 0.00 51.96 50.97 3h4h s ALA 102 Cb 0.07 -1.93 0.05 0.00 0.00 0.00 0.00 23.12 21.31 3h4h s ALA 102 CO 0.61 0.08 -0.11 0.99 0.00 0.00 0.00 175.76 177.34 3h4h s THR 103 N -2.17 1.88 0.00 0.00 2.01 -1.26 -4.65 115.64 111.45 3h4h s THR 103 Ca 0.38 -1.28 0.00 0.00 0.31 0.00 0.00 61.69 61.09 3h4h s THR 103 Cb -0.09 -1.97 0.00 0.00 0.01 0.00 0.00 72.50 70.45 3h4h s THR 103 CO 0.33 0.09 0.00 0.61 -0.69 0.00 0.00 174.62 174.96 3h4h n GLY 104 N 4.57 3.15 4.04 4.40 0.00 -1.26 -4.96 105.19 115.14 3h4h n GLY 104 Ca -0.15 -1.91 -0.27 0.00 0.00 0.00 0.00 46.02 43.69 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 -1.95 -3.81 4.61 0.00 -1.26 -0.93 120.51 116.57 3h4h n ALA 105 Ca 0.00 -0.28 -0.26 0.00 0.00 0.00 0.00 53.44 52.91 3h4h n ALA 105 Cb 0.00 -1.50 0.03 0.00 0.00 0.00 0.00 19.45 17.98 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 -4.43 -2.82 0.00 0.00 4.77 -1.26 -1.38 117.00 111.87 3h4h n LEU 106 Ca -0.28 -0.80 0.00 0.00 -0.03 0.00 0.00 56.01 54.89 3h4h n LEU 106 Cb 0.67 -2.61 0.00 0.00 -2.33 0.00 0.00 43.42 39.16 3h4h n LEU 106 CO 0.78 0.44 0.00 0.61 -1.33 0.00 0.00 177.39 177.89 3h4h n GLY 107 N -1.65 0.37 0.00 -0.72 0.00 -0.11 -1.97 105.19 101.10 3h4h n GLY 107 Ca -0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.89 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 -1.65 2.13 0.31 -0.02 0.00 -0.58 -0.27 105.19 105.10 3h4h n GLY 108 Ca 0.00 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.09 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 1.41 2.00 -0.02 0.00 -0.42 -1.44 103.07 104.61 3h4h h GLY 109 Ca 0.00 -0.28 -0.01 0.00 0.00 0.00 0.00 47.33 47.04 3h4h h GLY 109 CO 0.00 0.00 -0.03 -1.33 0.00 0.00 0.00 176.54 175.19 3h4h h GLY 110 N 0.68 0.00 -0.85 4.60 0.00 -1.45 -3.10 103.07 102.96 3h4h h GLY 110 Ca 0.46 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.79 3h4h h GLY 110 CO -0.34 0.00 -0.07 1.04 0.00 0.00 0.00 176.54 177.18 3h4h n LEU 111 N -3.19 1.82 -0.15 3.11 4.77 -0.57 -4.65 117.00 118.14 3h4h n LEU 111 Ca -0.01 -0.94 0.06 0.00 -0.03 0.00 0.00 56.01 55.09 3h4h n LEU 111 Cb 0.21 0.00 0.08 0.00 -2.33 0.00 0.00 43.42 41.38 3h4h n LEU 111 CO 0.25 0.34 0.47 0.35 -1.33 0.00 0.00 177.39 177.48 3h4h n THR 112 N 0.43 1.25 -2.10 -5.08 -2.24 -1.03 -4.95 114.28 100.56 3h4h n THR 112 Ca 0.06 -1.48 -0.43 0.00 -2.27 0.00 0.00 64.05 59.94 3h4h n THR 112 Cb 0.29 0.09 -0.03 0.00 -2.10 0.00 0.00 70.33 68.58 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 -1.83 3.34 -0.12 -0.78 2.56 -1.25 -4.21 118.70 116.41 3h4h s GLU 113 Ca 0.19 1.21 0.02 0.00 0.00 0.00 0.00 54.97 56.39 3h4h s GLU 113 Cb 0.16 -4.17 0.01 0.00 2.00 0.00 0.00 34.13 32.14 3h4h s GLU 113 CO 0.02 -1.86 -0.19 0.96 -0.56 0.00 0.00 175.26 173.64 3h4h s ILE 114 N 6.67 1.75 0.80 -3.70 -4.36 0.23 -4.97 121.20 117.61 3h4h s ILE 114 Ca 0.73 -0.80 -0.12 0.00 -0.26 0.00 0.00 60.65 60.21 3h4h s ILE 114 Cb -0.19 -1.56 0.07 0.00 1.25 0.00 0.00 42.46 42.03 3h4h s ILE 114 CO 0.32 0.49 1.10 0.20 0.24 0.00 0.00 174.94 177.29 3h4h s ASN 115 N 0.83 4.51 0.30 4.36 0.02 -1.26 -1.89 114.94 121.81 3h4h s ASN 115 Ca -0.09 1.23 -0.30 0.00 -1.02 0.00 0.00 52.86 52.69 3h4h s ASN 115 Cb -0.16 -1.95 -0.11 0.00 0.02 0.00 0.00 41.25 39.06 3h4h s ASN 115 CO -0.00 -1.95 1.53 -2.84 0.02 0.00 0.00 177.10 173.86 3h4h s PRO 116 N -5.21 4.16 0.00 -0.60 0.02 -1.26 -0.98 135.00 131.13 3h4h s PRO 116 Ca 0.61 2.50 0.00 0.00 0.02 0.00 0.00 61.00 64.12 3h4h s PRO 116 Cb -0.14 -3.04 0.00 0.00 0.02 0.00 0.00 34.50 31.35 3h4h s PRO 116 CO 0.54 -0.55 0.00 0.41 -0.33 0.00 0.00 177.00 177.07 3h4h n GLY 117 N 1.82 0.87 3.74 0.52 0.00 0.20 -4.73 105.19 107.61 3h4h n GLY 117 Ca 0.06 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.86 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 -0.67 2.62 0.09 1.61 2.02 -0.15 -4.93 118.70 119.29 3h4h s GLU 118 Ca 0.00 -1.22 -0.05 0.00 0.02 0.00 0.00 54.97 53.72 3h4h s GLU 118 Cb 0.00 -2.37 -0.02 0.00 0.10 0.00 0.00 34.13 31.84 3h4h s GLU 118 CO 0.00 0.39 0.12 -1.59 0.02 0.00 0.00 175.26 174.19 3h4h s LYS 119 N -3.73 0.81 0.05 1.61 -2.85 -1.26 -1.03 119.74 113.35 3h4h s LYS 119 Ca 0.32 -1.11 -0.11 0.00 -1.00 0.00 0.00 55.97 54.06 3h4h s LYS 119 Cb -0.07 0.29 0.01 0.00 -2.06 0.00 0.00 37.83 36.00 3h4h s LYS 119 CO 0.22 -0.23 0.25 -0.08 0.10 0.00 0.00 175.35 175.61 3h4h s THR 120 N -3.91 0.10 -0.17 3.79 -1.32 -0.44 -5.00 115.64 108.69 3h4h s THR 120 Ca 0.09 -0.84 0.00 0.00 -1.21 0.00 0.00 61.69 59.72 3h4h s THR 120 Cb 0.06 -1.01 0.04 0.00 -1.51 0.00 0.00 72.50 70.07 3h4h s THR 120 CO -0.08 -0.47 -0.09 -0.63 -2.21 0.00 0.00 174.62 171.15 3h4h s ILE 121 N -2.87 1.36 -0.09 5.08 1.01 -1.26 -0.86 121.20 123.58 3h4h s ILE 121 Ca -0.03 -0.74 -0.01 0.00 0.00 0.00 0.00 60.65 59.87 3h4h s ILE 121 Cb 0.00 -1.45 -0.03 0.00 0.01 0.00 0.00 42.46 40.99 3h4h s ILE 121 CO -0.05 0.21 -0.04 -0.22 0.00 0.00 0.00 174.94 174.84 3h4h s LEU 122 N 1.53 3.34 -0.06 2.97 2.96 -0.39 -4.96 118.68 124.07 3h4h s LEU 122 Ca 0.01 0.02 0.04 0.00 -0.22 0.00 0.00 54.13 53.98 3h4h s LEU 122 Cb -0.15 -1.76 0.00 0.00 0.50 0.00 0.00 46.19 44.79 3h4h s LEU 122 CO -0.08 0.33 -0.18 -0.60 -1.32 0.00 0.00 176.35 174.50 3h4h s ARG 123 N -0.61 2.11 0.06 1.98 3.52 -1.26 -0.61 118.95 124.13 3h4h s ARG 123 Ca 0.10 -0.63 0.02 0.00 -0.13 0.00 0.00 55.73 55.08 3h4h s ARG 123 Cb -0.12 -1.72 -0.03 0.00 -1.56 0.00 0.00 34.95 31.52 3h4h s ARG 123 CO 0.02 0.17 -0.07 -0.59 -0.81 0.00 0.00 175.30 174.02 3h4h s PHE 124 N 0.29 0.71 -0.19 5.12 -0.12 -0.60 -5.00 117.98 118.20 3h4h s PHE 124 Ca -0.11 -0.71 -0.24 0.00 -0.05 0.00 0.00 56.93 55.82 3h4h s PHE 124 Cb -0.15 -0.43 -0.01 0.00 -0.63 0.00 0.00 43.02 41.80 3h4h s PHE 124 CO 0.04 -0.14 0.80 0.21 -0.05 0.00 0.00 175.22 176.08 3h4h s LYS 125 N -2.63 4.26 -1.30 1.99 2.20 -1.26 -1.08 119.74 121.92 3h4h s LYS 125 Ca -0.01 0.94 -0.16 0.00 -0.36 0.00 0.00 55.97 56.38 3h4h s LYS 125 Cb -0.03 -3.59 0.10 0.00 -1.51 0.00 0.00 37.83 32.80 3h4h s LYS 125 CO -0.03 -0.35 1.74 0.00 -0.36 0.00 0.00 175.35 176.35 3h4h n ALA 126 N 5.35 3.98 0.43 3.13 0.00 -0.70 -4.76 120.51 127.95 3h4h n ALA 126 Ca 0.04 -3.98 0.13 0.00 0.00 0.00 0.00 53.44 49.63 3h4h n ALA 126 Cb 0.49 -3.43 0.29 0.00 0.00 0.00 0.00 19.45 16.79 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 5.05 0.00 -3.30 0.00 1.35 -1.86 0.86 112.91 115.01 3h4h h THR 127 Ca 0.43 -0.72 -0.68 0.00 -0.55 0.00 0.00 66.41 64.89 3h4h h THR 127 Cb 0.83 1.71 -0.33 0.00 -1.73 0.00 0.00 68.15 68.62 3h4h h THR 127 CO 1.47 0.00 -0.88 -0.54 -0.25 0.00 0.00 175.52 175.33 3h4h s LYS 128 N -3.16 3.04 0.13 4.72 1.02 -1.26 -4.74 119.74 119.49 3h4h s LYS 128 Ca 0.09 -0.87 -0.29 0.00 0.02 0.00 0.00 55.97 54.92 3h4h s LYS 128 Cb 0.09 -2.34 -0.07 0.00 -0.52 0.00 0.00 37.83 34.99 3h4h s LYS 128 CO 0.64 0.12 0.91 -1.25 -0.92 0.00 0.00 175.35 174.85 3h4h s PRO 129 N 0.48 4.69 0.00 -1.68 0.04 -1.26 -4.79 135.00 132.48 3h4h s PRO 129 Ca -0.15 1.38 0.00 0.00 0.04 0.00 0.00 61.00 62.26 3h4h s PRO 129 Cb -0.17 -3.35 0.00 0.00 0.04 0.00 0.00 34.50 31.02 3h4h s PRO 129 CO 0.06 0.31 0.00 0.41 0.04 0.00 0.00 177.00 177.82 3h4h n GLY 130 N 2.07 -0.16 3.80 0.56 0.00 0.23 -2.03 105.19 109.66 3h4h n GLY 130 Ca 0.00 -1.33 -0.38 0.00 0.00 0.00 0.00 46.02 44.31 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 -1.93 5.14 -0.01 1.61 -7.23 0.13 0.10 120.40 118.21 3h4h s VAL 131 Ca 0.00 0.76 0.00 0.00 -1.81 0.00 0.00 61.98 60.93 3h4h s VAL 131 Cb 0.00 -3.69 0.01 0.00 0.56 0.00 0.00 36.38 33.26 3h4h s VAL 131 CO 0.00 0.51 0.01 -0.36 -0.31 0.00 0.00 175.10 174.94 3h4h s PHE 132 N -0.53 0.03 0.50 2.82 0.08 -0.27 -4.46 117.98 116.15 3h4h s PHE 132 Ca 0.22 0.03 -0.22 0.00 0.12 0.00 0.00 56.93 57.08 3h4h s PHE 132 Cb -0.15 -0.08 -0.06 0.00 -0.57 0.00 0.00 43.02 42.15 3h4h s PHE 132 CO 0.10 -0.03 1.22 0.08 -0.10 0.00 0.00 175.22 176.50 3h4h s VAL 133 N 0.30 2.77 0.08 -0.44 1.01 -1.26 -0.66 120.40 122.20 3h4h s VAL 133 Ca -0.03 0.56 0.07 0.00 0.00 0.00 0.00 61.98 62.58 3h4h s VAL 133 Cb -0.04 -3.28 -0.03 0.00 0.00 0.00 0.00 36.38 33.04 3h4h s VAL 133 CO -0.01 -0.02 -0.17 -0.72 0.00 0.00 0.00 175.10 174.17 3h4h s TYR 134 N -1.49 1.49 0.16 5.22 -0.85 -0.62 -1.17 117.35 120.08 3h4h s TYR 134 Ca 0.68 -0.43 -0.23 0.00 -0.52 0.00 0.00 57.07 56.57 3h4h s TYR 134 Cb -0.32 -0.83 0.07 0.00 0.38 0.00 0.00 41.96 41.26 3h4h s TYR 134 CO 0.38 0.12 0.60 -3.38 -1.52 0.00 0.00 175.55 171.75 3h4h s HIS 135 N -1.18 -0.53 0.51 -3.49 -3.43 -0.45 -0.70 115.29 106.02 3h4h s HIS 135 Ca 0.02 0.31 -0.21 0.00 -0.80 0.00 0.00 55.06 54.39 3h4h s HIS 135 Cb -0.10 0.56 -0.07 0.00 -1.43 0.00 0.00 32.58 31.55 3h4h s HIS 135 CO 0.03 -0.86 1.12 0.00 -2.00 0.00 0.00 174.74 173.04 3h4h n ALA 137 N -1.02 -0.82 -2.01 0.00 0.00 -1.26 -4.52 120.51 110.88 3h4h n ALA 137 Ca 0.10 -1.66 -0.41 0.00 0.00 0.00 0.00 53.44 51.48 3h4h n ALA 137 Cb 0.50 -1.28 -0.04 0.00 0.00 0.00 0.00 19.45 18.64 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 0.46 4.56 -0.05 0.00 0.02 -1.26 -4.85 135.00 133.89 3h4h s PRO 138 Ca 0.32 1.79 -0.39 0.00 0.02 0.00 0.00 61.00 62.74 3h4h s PRO 138 Cb 0.16 -3.25 -0.18 0.00 0.02 0.00 0.00 34.50 31.25 3h4h s PRO 138 CO -0.18 0.03 1.36 -2.30 -0.33 0.00 0.00 177.00 175.58 3h4h n PRO 139 N 2.23 0.74 0.00 5.54 -0.02 -1.26 -0.72 135.00 141.51 3h4h n PRO 139 Ca 0.03 0.27 0.00 0.00 -2.02 0.00 0.00 63.50 61.78 3h4h n PRO 139 Cb 0.45 -1.87 0.00 0.00 -0.02 0.00 0.00 33.50 32.07 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 2.65 2.74 0.72 -1.23 0.00 -1.26 -4.80 105.19 104.00 3h4h n GLY 140 Ca 0.21 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.28 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 0.72 0.40 1.61 2.81 0.10 -4.96 117.12 115.79 3h4h n MET 141 Ca 0.00 -2.27 -0.16 0.00 -1.81 0.00 0.00 57.70 53.46 3h4h n MET 141 Cb 0.00 -0.89 -0.08 0.00 -0.71 0.00 0.00 33.22 31.54 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 3.80 0.06 -0.33 2.03 2.07 -1.84 -2.85 116.25 119.19 3h4h h VAL 142 Ca -0.06 -0.22 -0.02 0.00 0.82 0.00 0.00 66.70 67.21 3h4h h VAL 142 Cb 1.34 0.08 -0.02 0.00 -1.52 0.00 0.00 31.29 31.18 3h4h h VAL 142 CO 0.03 0.01 0.11 1.55 0.02 0.00 0.00 177.57 179.29 3h4h h PRO 143 N -1.23 0.47 -0.59 1.57 0.13 -1.93 -2.48 132.00 127.94 3h4h h PRO 143 Ca -0.10 -0.06 0.02 0.00 -0.87 0.00 0.00 66.00 64.99 3h4h h PRO 143 Cb 0.80 -0.09 -0.04 0.00 0.13 0.00 0.00 31.00 31.80 3h4h h PRO 143 CO 0.17 0.41 0.37 2.35 -0.23 0.00 0.00 178.00 181.07 3h4h h TRP 144 N 0.47 0.68 -0.38 1.56 7.01 -1.93 0.62 115.95 123.99 3h4h h TRP 144 Ca 0.12 0.02 -0.11 0.00 2.11 0.00 0.00 58.89 61.02 3h4h h TRP 144 Cb 0.13 -0.22 -0.01 0.00 -2.10 0.00 0.00 29.16 26.96 3h4h h TRP 144 CO 0.00 0.40 -0.21 0.45 -2.79 0.00 0.00 178.44 176.29 3h4h h HIS 145 N 0.72 0.94 -0.35 2.65 3.86 -1.26 -2.58 115.15 119.13 3h4h h HIS 145 Ca 0.24 -0.24 -0.02 0.00 -1.16 0.00 0.00 60.37 59.19 3h4h h HIS 145 Cb 0.01 -0.21 -0.02 0.00 1.06 0.00 0.00 27.41 28.25 3h4h h HIS 145 CO -0.05 1.00 0.15 0.28 0.86 0.00 0.00 177.93 180.17 3h4h h VAL 146 N 0.61 1.18 -0.02 2.45 2.07 -0.99 -2.11 116.25 119.44 3h4h h VAL 146 Ca 0.08 -0.53 0.00 0.00 0.82 0.00 0.00 66.70 67.07 3h4h h VAL 146 Cb 0.76 0.88 0.00 0.00 -1.52 0.00 0.00 31.29 31.42 3h4h h VAL 146 CO 0.06 0.19 0.00 1.33 0.02 0.00 0.00 177.57 179.17 3h4h n VAL 147 N -4.71 0.02 -0.03 2.57 0.24 0.17 -1.99 118.33 114.60 3h4h n VAL 147 Ca -0.01 -0.08 0.09 0.00 -2.04 0.00 0.00 64.34 62.30 3h4h n VAL 147 Cb 0.13 -0.19 0.28 0.00 -1.47 0.00 0.00 33.84 32.58 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 -0.62 3.53 0.00 -1.34 7.64 -0.92 -4.64 113.62 117.27 3h4h n SER 148 Ca 0.20 -2.15 0.00 0.00 1.01 0.00 0.00 58.87 57.93 3h4h n SER 148 Cb 0.16 -0.45 0.00 0.00 -1.01 0.00 0.00 64.21 62.91 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 1.26 0.78 2.68 0.23 0.00 -0.84 -1.35 105.19 107.96 3h4h n GLY 149 Ca 0.20 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.81 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 -2.00 3.58 -3.49 1.61 0.00 -0.84 -4.57 117.12 111.40 3h4h n MET 150 Ca 0.00 -3.07 -0.14 0.00 0.00 0.00 0.00 57.70 54.48 3h4h n MET 150 Cb 0.00 -2.96 -0.04 0.00 0.00 0.00 0.00 33.22 30.22 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 1.61 -0.56 0.00 6.12 2.20 -1.26 -1.65 114.94 121.40 3h4h s ASN 151 Ca 0.48 0.26 0.00 0.00 -0.94 0.00 0.00 52.86 52.66 3h4h s ASN 151 Cb 0.14 0.55 0.00 0.00 -2.00 0.00 0.00 41.25 39.94 3h4h s ASN 151 CO -0.05 -0.80 0.00 0.61 -2.94 0.00 0.00 177.10 173.92 3h4h n GLY 152 N 0.20 3.99 3.45 0.45 0.00 0.12 -0.81 105.19 112.59 3h4h n GLY 152 Ca -0.18 -0.48 -0.10 0.00 0.00 0.00 0.00 46.02 45.25 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 -1.23 -1.18 0.21 4.61 0.00 -1.26 -1.59 121.76 121.33 3h4h s ALA 153 Ca 0.00 0.07 0.08 0.00 0.00 0.00 0.00 51.96 52.10 3h4h s ALA 153 Cb 0.00 0.82 -0.05 0.00 0.00 0.00 0.00 23.12 23.89 3h4h s ALA 153 CO 0.00 -0.76 -0.14 0.96 0.00 0.00 0.00 175.76 175.82 3h4h s ILE 154 N -3.81 1.77 -0.12 0.00 -4.36 0.17 -2.92 121.20 111.92 3h4h s ILE 154 Ca 0.05 -2.22 0.03 0.00 -0.26 0.00 0.00 60.65 58.25 3h4h s ILE 154 Cb -0.00 -2.08 0.01 0.00 1.25 0.00 0.00 42.46 41.63 3h4h s ILE 154 CO -0.08 -0.57 -0.21 -0.32 0.24 0.00 0.00 174.94 173.99 3h4h s MET 155 N -3.64 2.85 -0.43 0.37 -2.45 0.12 -1.12 119.30 115.00 3h4h s MET 155 Ca 0.23 -0.80 -0.06 0.00 -1.25 0.00 0.00 55.69 53.81 3h4h s MET 155 Cb -0.01 -2.26 0.11 0.00 1.25 0.00 0.00 34.83 33.93 3h4h s MET 155 CO 0.07 0.05 0.27 0.08 1.05 0.00 0.00 175.02 176.54 3h4h s VAL 156 N 0.67 3.79 0.36 10.11 1.01 0.11 -1.20 120.40 135.25 3h4h s VAL 156 Ca -0.11 -1.85 -0.25 0.00 0.00 0.00 0.00 61.98 59.76 3h4h s VAL 156 Cb -0.16 -3.51 -0.09 0.00 0.00 0.00 0.00 36.38 32.62 3h4h s VAL 156 CO 0.02 -0.69 1.02 -0.76 0.00 0.00 0.00 175.10 174.69 3h4h s LEU 157 N 1.27 4.27 0.32 3.92 1.43 0.06 -0.60 118.68 129.35 3h4h s LEU 157 Ca 0.06 2.00 -0.29 0.00 -1.03 0.00 0.00 54.13 54.86 3h4h s LEU 157 Cb -0.24 -4.05 -0.12 0.00 0.03 0.00 0.00 46.19 41.81 3h4h s LEU 157 CO -0.02 -0.29 1.50 -2.65 0.23 0.00 0.00 176.35 175.12 3h4h n PRO 158 N 0.33 2.54 -0.32 1.29 -0.02 -1.26 -0.76 135.00 136.79 3h4h n PRO 158 Ca 0.03 0.90 0.34 0.00 -2.02 0.00 0.00 63.50 62.75 3h4h n PRO 158 Cb 0.49 -2.62 0.74 0.00 -0.02 0.00 0.00 33.50 32.09 3h4h n PRO 158 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3h4h h ARG 159 N 3.82 0.02 -0.73 -0.52 3.08 -1.87 0.11 114.38 118.30 3h4h h ARG 159 Ca -0.48 -0.00 -0.08 0.00 0.07 0.00 0.00 59.98 59.49 3h4h h ARG 159 Cb 1.24 -0.01 -0.05 0.00 0.08 0.00 0.00 29.97 31.24 3h4h h ARG 159 CO 0.72 0.02 0.10 0.39 -1.07 0.00 0.00 179.97 180.12 3h4h n GLU 160 N -4.21 3.77 0.00 0.04 -0.58 -1.26 0.66 120.64 119.07 3h4h n GLU 160 Ca 0.25 -2.54 0.00 0.00 -0.42 0.00 0.00 57.16 54.45 3h4h n GLU 160 Cb 1.22 -2.10 0.00 0.00 -0.57 0.00 0.00 31.44 29.99 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 0.25 -1.57 3.83 0.62 0.00 0.39 -4.78 105.19 103.94 3h4h n GLY 161 Ca 0.28 -1.26 -0.34 0.00 0.00 0.00 0.00 46.02 44.69 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 4.16 0.18 0.99 1.43 -1.25 -4.34 118.68 119.84 3h4h s LEU 162 Ca 0.00 1.44 0.03 0.00 -1.03 0.00 0.00 54.13 54.57 3h4h s LEU 162 Cb 0.00 -3.99 -0.05 0.00 0.03 0.00 0.00 46.19 42.18 3h4h s LEU 162 CO 0.00 -0.14 -0.02 -1.00 0.23 0.00 0.00 176.35 175.42 3h4h s HIS 163 N -1.83 1.28 0.00 0.29 3.76 -1.26 -0.44 115.29 117.09 3h4h s HIS 163 Ca 0.51 -0.95 0.00 0.00 -0.15 0.00 0.00 55.06 54.47 3h4h s HIS 163 Cb -0.13 -0.72 0.00 0.00 1.11 0.00 0.00 32.58 32.84 3h4h s HIS 163 CO 0.18 -0.12 0.00 -0.40 -0.85 0.00 0.00 174.74 173.55 3h4h n ASP 164 N -0.26 0.00 0.14 1.40 5.68 0.44 -4.79 116.55 119.16 3h4h n ASP 164 Ca -0.07 -0.99 0.10 0.00 -0.50 0.00 0.00 54.79 53.32 3h4h n ASP 164 Cb 0.63 0.00 0.50 0.00 -1.14 0.00 0.00 41.12 41.11 3h4h n ASP 164 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3h4h n GLY 165 N 5.00 -0.85 0.41 6.12 0.00 -1.26 -2.26 105.19 112.36 3h4h n GLY 165 Ca 0.00 0.16 0.07 0.00 0.00 0.00 0.00 46.02 46.26 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 -2.15 1.41 -0.90 1.61 4.01 -1.26 -4.97 118.16 115.91 3h4h n LYS 166 Ca -0.01 -2.96 0.00 0.00 -0.51 0.00 0.00 58.31 54.83 3h4h n LYS 166 Cb 0.05 -1.52 0.00 0.00 -0.51 0.00 0.00 35.03 33.05 3h4h n LYS 166 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 3h4h n GLY 167 N -1.19 0.16 3.73 0.72 0.00 -0.96 -4.96 105.19 102.68 3h4h n GLY 167 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.78 3h4h n GLY 167 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3h4h s LYS 168 N -1.30 4.35 0.35 1.61 2.20 -1.26 -4.78 119.74 120.92 3h4h s LYS 168 Ca 0.00 2.06 -0.28 0.00 -0.36 0.00 0.00 55.97 57.39 3h4h s LYS 168 Cb 0.00 -3.22 -0.11 0.00 -1.51 0.00 0.00 37.83 32.99 3h4h s LYS 168 CO 0.00 -0.34 1.42 0.00 -0.36 0.00 0.00 175.35 176.06 3h4h s ALA 169 N 0.61 3.55 -0.20 3.13 0.00 -1.26 -0.42 121.76 127.16 3h4h s ALA 169 Ca 0.60 1.45 0.01 0.00 0.00 0.00 0.00 51.96 54.02 3h4h s ALA 169 Cb -0.37 -3.56 0.05 0.00 0.00 0.00 0.00 23.12 19.24 3h4h s ALA 169 CO 0.34 -0.88 -0.09 -0.51 0.00 0.00 0.00 175.76 174.61 3h4h s LEU 170 N -1.92 2.31 -0.18 0.00 1.43 0.41 -4.77 118.68 115.95 3h4h s LEU 170 Ca 0.51 -0.93 0.01 0.00 -1.03 0.00 0.00 54.13 52.69 3h4h s LEU 170 Cb -0.44 -1.21 0.02 0.00 0.03 0.00 0.00 46.19 44.59 3h4h s LEU 170 CO 0.58 -0.16 -0.19 -0.89 0.23 0.00 0.00 176.35 175.93 3h4h s THR 171 N 1.40 2.16 0.29 5.49 2.01 -1.26 -3.83 115.64 121.91 3h4h s THR 171 Ca -0.02 -0.91 -0.11 0.00 0.31 0.00 0.00 61.69 60.96 3h4h s THR 171 Cb -0.17 -1.92 -0.08 0.00 0.01 0.00 0.00 72.50 70.35 3h4h s THR 171 CO -0.08 0.53 0.65 -0.72 -0.69 0.00 0.00 174.62 174.31 3h4h s TYR 172 N 1.30 3.41 -0.06 4.92 -0.85 -1.26 -4.84 117.35 119.97 3h4h s TYR 172 Ca 0.05 1.01 0.14 0.00 -0.52 0.00 0.00 57.07 57.75 3h4h s TYR 172 Cb -0.13 -2.38 -0.21 0.00 0.38 0.00 0.00 41.96 39.62 3h4h s TYR 172 CO -0.12 0.14 0.67 -0.25 -1.52 0.00 0.00 175.55 174.47 3h4h n ASP 173 N -0.45 0.84 -3.93 -0.18 8.00 0.16 -4.96 116.55 116.04 3h4h n ASP 173 Ca 0.02 0.39 -0.10 0.00 0.71 0.00 0.00 54.79 55.81 3h4h n ASP 173 Cb 0.53 0.03 -0.10 0.00 -0.02 0.00 0.00 41.12 41.55 3h4h n ASP 173 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 3h4h s LYS 174 N -2.66 0.41 -0.02 -1.24 1.02 -0.96 -5.01 119.74 111.28 3h4h s LYS 174 Ca -0.04 -0.52 0.02 0.00 0.02 0.00 0.00 55.97 55.44 3h4h s LYS 174 Cb 0.08 0.16 0.01 0.00 -0.52 0.00 0.00 37.83 37.56 3h4h s LYS 174 CO 0.82 -0.09 -0.06 -1.50 -0.92 0.00 0.00 175.35 173.60 3h4h s ILE 175 N -1.50 0.57 0.06 2.17 2.07 -1.26 -1.14 121.20 122.18 3h4h s ILE 175 Ca -0.15 -0.25 0.05 0.00 -1.41 0.00 0.00 60.65 58.90 3h4h s ILE 175 Cb -0.08 -0.53 -0.03 0.00 0.13 0.00 0.00 42.46 41.95 3h4h s ILE 175 CO 0.00 0.19 -0.15 -0.31 -1.91 0.00 0.00 174.94 172.76 3h4h s TYR 176 N 0.24 1.29 -0.24 3.50 2.02 -0.46 -4.48 117.35 119.22 3h4h s TYR 176 Ca -0.03 -0.41 0.02 0.00 -0.37 0.00 0.00 57.07 56.28 3h4h s TYR 176 Cb -0.08 -0.74 0.05 0.00 -0.40 0.00 0.00 41.96 40.79 3h4h s TYR 176 CO 0.00 0.06 -0.13 -0.47 -1.57 0.00 0.00 175.55 173.44 3h4h s TYR 177 N -1.08 3.11 -0.30 2.71 5.04 0.20 -0.31 117.35 126.72 3h4h s TYR 177 Ca 0.00 -2.09 -0.09 0.00 -2.44 0.00 0.00 57.07 52.45 3h4h s TYR 177 Cb -0.09 -1.93 -0.01 0.00 0.35 0.00 0.00 41.96 40.27 3h4h s TYR 177 CO 0.02 -0.85 0.13 0.08 -1.34 0.00 0.00 175.55 173.59 3h4h s VAL 178 N 1.17 4.54 -0.26 3.14 1.01 0.17 -4.23 120.40 125.93 3h4h s VAL 178 Ca -0.04 -0.37 -0.11 0.00 0.00 0.00 0.00 61.98 61.46 3h4h s VAL 178 Cb -0.18 -3.28 -0.05 0.00 0.00 0.00 0.00 36.38 32.88 3h4h s VAL 178 CO -0.07 0.12 0.17 -0.83 0.00 0.00 0.00 175.10 174.49 3h4h s GLY 179 N 1.61 1.94 -0.16 4.51 0.00 -1.26 -1.83 107.32 112.13 3h4h s GLY 179 Ca 0.05 -1.02 -0.07 0.00 0.00 0.00 0.00 44.72 43.68 3h4h s GLY 179 CO 0.06 0.55 0.08 1.85 0.00 0.00 0.00 173.10 175.64 3h4h s GLU 180 N 1.50 3.80 -0.12 2.90 2.12 -0.51 -1.62 118.70 126.77 3h4h s GLU 180 Ca 0.07 -0.29 0.00 0.00 0.36 0.00 0.00 54.97 55.12 3h4h s GLU 180 Cb -0.15 -3.20 0.02 0.00 0.26 0.00 0.00 34.13 31.06 3h4h s GLU 180 CO 0.08 0.42 -0.11 -1.14 -0.54 0.00 0.00 175.26 173.98 3h4h s GLN 181 N -0.04 1.84 -0.17 4.30 2.00 0.66 -4.50 119.66 123.74 3h4h s GLN 181 Ca 0.07 -0.39 -0.23 0.00 -2.00 0.00 0.00 55.36 52.82 3h4h s GLN 181 Cb -0.12 -1.75 -0.02 0.00 0.80 0.00 0.00 33.01 31.92 3h4h s GLN 181 CO 0.01 -0.21 0.72 0.16 -0.50 0.00 0.00 175.29 175.46 3h4h s ASP 182 N 1.48 6.82 0.05 6.67 3.84 -1.26 -0.95 116.67 133.31 3h4h s ASP 182 Ca 0.02 1.00 0.05 0.00 -0.00 0.00 0.00 52.55 53.63 3h4h s ASP 182 Cb -0.13 -2.40 -0.04 0.00 -1.38 0.00 0.00 42.92 38.98 3h4h s ASP 182 CO -0.07 -0.31 -0.10 -0.36 -0.00 0.00 0.00 175.17 174.33 3h4h s PHE 183 N 1.90 2.77 -0.49 2.11 0.08 -0.07 -4.76 117.98 119.52 3h4h s PHE 183 Ca 0.33 -0.13 0.03 0.00 0.12 0.00 0.00 56.93 57.28 3h4h s PHE 183 Cb -0.16 -1.51 0.14 0.00 -0.57 0.00 0.00 43.02 40.91 3h4h s PHE 183 CO 0.12 0.37 0.28 0.71 -0.10 0.00 0.00 175.22 176.60 3h4h s TYR 184 N -1.06 2.33 -0.28 0.36 1.51 -1.26 -0.96 117.35 117.99 3h4h s TYR 184 Ca 0.18 -2.67 -0.12 0.00 -1.01 0.00 0.00 57.07 53.46 3h4h s TYR 184 Cb -0.11 -2.09 -0.05 0.00 -0.11 0.00 0.00 41.96 39.61 3h4h s TYR 184 CO 0.09 -0.75 0.22 0.08 -1.11 0.00 0.00 175.55 174.09 3h4h s VAL 185 N -0.01 5.29 0.66 0.71 1.01 -1.26 -4.78 120.40 122.02 3h4h s VAL 185 Ca 0.20 0.24 -0.17 0.00 0.00 0.00 0.00 61.98 62.24 3h4h s VAL 185 Cb -0.20 -3.56 0.00 0.00 0.00 0.00 0.00 36.38 32.62 3h4h s VAL 185 CO -0.03 0.24 1.27 -2.84 0.00 0.00 0.00 175.10 173.73 3h4h s PRO 186 N 1.78 2.47 0.14 2.72 0.02 -1.26 -4.87 135.00 135.99 3h4h s PRO 186 Ca 0.08 1.98 0.09 0.00 0.02 0.00 0.00 61.00 63.18 3h4h s PRO 186 Cb -0.16 -1.85 -0.04 0.00 0.02 0.00 0.00 34.50 32.48 3h4h s PRO 186 CO 0.10 -1.64 -0.22 1.03 -0.33 0.00 0.00 177.00 175.95 3h4h s ARG 187 N -3.50 1.29 0.24 5.54 0.52 -1.26 -0.72 118.95 121.06 3h4h s ARG 187 Ca 0.80 -1.34 -0.03 0.00 -0.52 0.00 0.00 55.73 54.65 3h4h s ARG 187 Cb -0.35 -1.54 0.05 0.00 0.52 0.00 0.00 34.95 33.63 3h4h s ARG 187 CO 0.41 0.34 0.33 -0.40 0.02 0.00 0.00 175.30 175.99 3h4h n ASP 188 N 0.65 0.13 0.00 0.23 5.68 0.10 -4.85 116.55 118.50 3h4h n ASP 188 Ca -0.16 -1.18 0.05 0.00 -0.50 0.00 0.00 54.79 52.99 3h4h n ASP 188 Cb 0.55 -0.24 0.22 0.00 -1.14 0.00 0.00 41.12 40.50 3h4h n ASP 188 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 3h4h n GLU 189 N -1.67 0.01 -0.13 0.11 -0.58 -1.26 -1.97 120.64 115.14 3h4h n GLU 189 Ca 0.04 0.32 0.05 0.00 -0.42 0.00 0.00 57.16 57.15 3h4h n GLU 189 Cb 0.16 -1.50 0.12 0.00 -0.57 0.00 0.00 31.44 29.64 3h4h n GLU 189 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 3h4h n ASN 190 N -1.49 2.67 0.00 1.62 5.03 -1.26 -4.97 115.26 116.86 3h4h n ASN 190 Ca 0.03 -1.94 0.00 0.00 0.87 0.00 0.00 54.58 53.54 3h4h n ASN 190 Cb 0.11 -0.17 0.00 0.00 -1.02 0.00 0.00 39.78 38.70 3h4h n ASN 190 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 3h4h n GLY 191 N 0.36 0.54 3.75 7.41 0.00 -0.83 -5.04 105.19 111.38 3h4h n GLY 191 Ca 0.09 -0.07 -0.40 0.00 0.00 0.00 0.00 46.02 45.65 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 -0.23 4.45 0.31 1.61 1.02 -1.26 -4.80 119.74 120.85 3h4h s LYS 192 Ca 0.00 0.98 -0.29 0.00 0.02 0.00 0.00 55.97 56.68 3h4h s LYS 192 Cb 0.00 -3.35 -0.11 0.00 -0.52 0.00 0.00 37.83 33.85 3h4h s LYS 192 CO 0.00 0.32 1.50 0.71 -0.92 0.00 0.00 175.35 176.96 3h4h s TYR 193 N -0.14 2.80 0.26 3.18 1.51 -1.26 0.03 117.35 123.73 3h4h s TYR 193 Ca 0.36 1.01 -0.14 0.00 -1.01 0.00 0.00 57.07 57.29 3h4h s TYR 193 Cb -0.20 -3.96 -0.08 0.00 -0.11 0.00 0.00 41.96 37.61 3h4h s TYR 193 CO 0.22 -3.03 0.66 0.15 -1.11 0.00 0.00 175.55 172.43 3h4h s LYS 194 N -1.03 3.98 0.09 -0.62 1.02 0.10 -4.83 119.74 118.44 3h4h s LYS 194 Ca 0.58 0.56 0.06 0.00 0.02 0.00 0.00 55.97 57.19 3h4h s LYS 194 Cb -0.45 -2.63 -0.04 0.00 -0.52 0.00 0.00 37.83 34.19 3h4h s LYS 194 CO 0.51 0.28 -0.08 0.15 -0.92 0.00 0.00 175.35 175.30 3h4h s LYS 195 N -2.65 2.27 0.07 1.68 1.02 -1.26 -4.73 119.74 116.13 3h4h s LYS 195 Ca 0.48 -0.95 0.01 0.00 0.02 0.00 0.00 55.97 55.54 3h4h s LYS 195 Cb -0.12 -2.38 -0.04 0.00 -0.52 0.00 0.00 37.83 34.78 3h4h s LYS 195 CO 0.19 0.53 -0.06 0.71 -0.92 0.00 0.00 175.35 175.80 3h4h s TYR 196 N -1.20 0.68 -1.33 3.18 2.02 -1.26 -5.07 117.35 114.38 3h4h s TYR 196 Ca 0.22 -0.83 0.13 0.00 -0.37 0.00 0.00 57.07 56.22 3h4h s TYR 196 Cb -0.11 -0.43 0.29 0.00 -0.40 0.00 0.00 41.96 41.31 3h4h s TYR 196 CO 0.14 -0.20 1.19 0.39 -1.57 0.00 0.00 175.55 175.50 3h4h n GLU 197 N 0.46 2.23 -3.70 -0.62 -0.58 -1.26 -4.92 120.64 112.26 3h4h n GLU 197 Ca -0.16 -1.91 -0.14 0.00 -0.42 0.00 0.00 57.16 54.53 3h4h n GLU 197 Cb 0.59 -1.31 -0.08 0.00 -0.57 0.00 0.00 31.44 30.07 3h4h n GLU 197 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3h4h s ALA 198 N -1.05 -1.11 0.31 0.62 0.00 -1.26 -5.06 121.76 114.21 3h4h s ALA 198 Ca 0.25 0.88 -0.01 0.00 0.00 0.00 0.00 51.96 53.08 3h4h s ALA 198 Cb 0.14 -0.24 0.49 0.00 0.00 0.00 0.00 23.12 23.51 3h4h s ALA 198 CO 0.19 -0.27 1.95 -1.35 0.00 0.00 0.00 175.76 176.28 3h4h h PRO 199 N 4.26 1.03 -0.10 0.00 0.11 -1.96 -2.39 132.00 132.96 3h4h h PRO 199 Ca -0.28 -0.06 -0.04 0.00 0.11 0.00 0.00 66.00 65.73 3h4h h PRO 199 Cb 1.17 -0.23 -0.01 0.00 0.11 0.00 0.00 31.00 32.04 3h4h h PRO 199 CO 0.33 0.68 -0.11 0.78 -0.21 0.00 0.00 178.00 179.47 3h4h h GLY 200 N 1.06 0.15 2.00 -0.55 0.00 -2.00 -2.73 103.07 101.01 3h4h h GLY 200 Ca 0.33 -0.09 -0.02 0.00 0.00 0.00 0.00 47.33 47.55 3h4h h GLY 200 CO -0.09 0.08 -0.12 -0.55 0.00 0.00 0.00 176.54 175.86 3h4h h ASP 201 N 0.14 0.00 0.79 0.19 5.19 -1.84 -2.66 116.42 118.22 3h4h h ASP 201 Ca 0.03 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.44 3h4h h ASP 201 Cb 0.29 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.80 3h4h h ASP 201 CO 0.02 0.12 -0.49 0.00 -3.12 0.00 0.00 179.24 175.76 3h4h n ALA 202 N -2.38 3.04 0.19 3.45 0.00 -1.03 -4.63 120.51 119.16 3h4h n ALA 202 Ca -0.02 -0.26 -0.14 0.00 0.00 0.00 0.00 53.44 53.02 3h4h n ALA 202 Cb 0.21 -1.20 -0.08 0.00 0.00 0.00 0.00 19.45 18.38 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 0.00 -1.18 -0.44 0.00 5.03 -1.54 -0.42 116.97 118.42 3h4h h TYR 203 Ca 0.00 0.02 0.07 0.00 2.58 0.00 0.00 58.73 61.39 3h4h h TYR 203 Cb 0.64 0.47 -0.06 0.00 1.55 0.00 0.00 36.73 39.34 3h4h h TYR 203 CO 0.00 -0.53 0.11 0.93 -1.32 0.00 0.00 178.16 177.35 3h4h h GLU 204 N -0.75 0.25 -0.77 1.82 5.08 -1.82 -0.38 114.58 118.01 3h4h h GLU 204 Ca -0.04 -0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.30 3h4h h GLU 204 Cb 0.68 -0.06 -0.04 0.00 0.50 0.00 0.00 28.75 29.84 3h4h h GLU 204 CO -0.11 0.16 0.44 -0.44 -1.00 0.00 0.00 179.01 178.07 3h4h h ASP 205 N 0.26 0.94 -0.59 1.42 3.45 -1.82 -2.58 116.42 117.49 3h4h h ASP 205 Ca 0.22 -0.08 -0.07 0.00 0.43 0.00 0.00 57.03 57.53 3h4h h ASP 205 Cb 0.25 -0.24 -0.02 0.00 -0.56 0.00 0.00 39.33 38.76 3h4h h ASP 205 CO -0.26 0.74 0.11 0.74 -1.57 0.00 0.00 179.24 179.00 3h4h h THR 206 N 1.05 1.26 -0.91 0.35 2.02 -0.44 -2.99 112.91 113.26 3h4h h THR 206 Ca 0.27 -0.97 0.02 0.00 0.77 0.00 0.00 66.41 66.50 3h4h h THR 206 Cb -0.01 0.73 -0.05 0.00 -1.74 0.00 0.00 68.15 67.09 3h4h h THR 206 CO -0.05 0.36 0.60 0.58 0.37 0.00 0.00 175.52 177.38 3h4h h VAL 207 N 0.88 1.21 -0.47 3.16 2.07 -0.70 0.16 116.25 122.55 3h4h h VAL 207 Ca 0.18 -0.41 0.00 0.00 0.82 0.00 0.00 66.70 67.29 3h4h h VAL 207 Cb 0.40 -0.10 -0.02 0.00 -1.52 0.00 0.00 31.29 30.05 3h4h h VAL 207 CO 0.01 0.22 0.30 0.50 0.02 0.00 0.00 177.57 178.62 3h4h h LYS 208 N 1.20 0.64 -0.39 1.57 3.64 -1.45 -1.48 116.57 120.31 3h4h h LYS 208 Ca 0.34 -0.05 -0.05 0.00 -1.27 0.00 0.00 60.65 59.62 3h4h h LYS 208 Cb -0.10 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 31.57 3h4h h LYS 208 CO -0.08 0.45 0.05 0.28 -2.27 0.00 0.00 179.45 177.88 3h4h h VAL 209 N 0.64 1.24 -0.93 2.00 2.07 -1.19 -3.08 116.25 117.00 3h4h h VAL 209 Ca 0.17 -0.89 0.14 0.00 0.82 0.00 0.00 66.70 66.94 3h4h h VAL 209 Cb -0.03 1.07 -0.09 0.00 -1.52 0.00 0.00 31.29 30.72 3h4h h VAL 209 CO -0.03 0.30 0.55 0.24 0.02 0.00 0.00 177.57 178.64 3h4h h MET 210 N 0.49 0.79 0.00 1.57 2.86 -0.47 -1.80 114.93 118.38 3h4h h MET 210 Ca 0.12 -0.05 0.00 0.00 -2.06 0.00 0.00 59.70 57.71 3h4h h MET 210 Cb 0.39 -0.18 0.00 0.00 0.06 0.00 0.00 31.60 31.87 3h4h h MET 210 CO 0.01 0.53 0.00 0.00 1.06 0.00 0.00 176.91 178.51 3h4h h ARG 211 N 0.82 0.00 0.00 1.72 3.08 -1.18 -0.91 114.38 117.91 3h4h h ARG 211 Ca 0.49 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.54 3h4h h ARG 211 Cb 0.58 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.63 3h4h h ARG 211 CO -0.31 0.00 0.00 0.25 -1.07 0.00 0.00 179.97 178.84 3h4h n THR 212 N -2.69 0.71 -1.51 2.04 -2.24 -0.67 -4.91 114.28 105.01 3h4h n THR 212 Ca 0.00 0.07 -0.18 0.00 -2.27 0.00 0.00 64.05 61.68 3h4h n THR 212 Cb 0.19 -0.92 -0.08 0.00 -2.10 0.00 0.00 70.33 67.43 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 -2.06 -1.26 -3.98 3.22 4.77 -0.35 -4.94 117.00 112.40 3h4h n LEU 213 Ca 0.04 0.44 -0.31 0.00 -0.03 0.00 0.00 56.01 56.15 3h4h n LEU 213 Cb 0.28 -2.55 -0.15 0.00 -2.33 0.00 0.00 43.42 38.68 3h4h n LEU 213 CO 0.22 -0.95 -0.32 -0.89 -1.33 0.00 0.00 177.39 174.13 3h4h s THR 214 N -2.49 2.15 0.45 -5.08 2.01 -1.26 -5.10 115.64 106.32 3h4h s THR 214 Ca 0.00 -2.34 -0.25 0.00 0.31 0.00 0.00 61.69 59.41 3h4h s THR 214 Cb 0.00 -2.59 -0.08 0.00 0.01 0.00 0.00 72.50 69.84 3h4h s THR 214 CO 0.00 -0.63 1.38 -2.16 -0.69 0.00 0.00 174.62 172.52 3h4h s PRO 215 N 0.86 3.71 0.31 4.92 0.04 -1.26 -4.91 135.00 138.67 3h4h s PRO 215 Ca 0.11 2.30 0.17 0.00 0.04 0.00 0.00 61.00 63.63 3h4h s PRO 215 Cb -0.20 -2.63 0.22 0.00 0.04 0.00 0.00 34.50 31.93 3h4h s PRO 215 CO -0.09 -0.76 1.52 1.79 0.04 0.00 0.00 177.00 179.50 3h4h h THR 216 N 2.24 0.80 -3.23 1.26 1.35 -1.40 -3.46 112.91 110.47 3h4h h THR 216 Ca -0.50 -1.99 -0.15 0.00 -0.55 0.00 0.00 66.41 63.21 3h4h h THR 216 Cb 1.26 2.29 -0.23 0.00 -1.73 0.00 0.00 68.15 69.74 3h4h h THR 216 CO 0.61 0.43 -0.43 -1.00 -0.25 0.00 0.00 175.52 174.89 3h4h s HIS 217 N -3.10 -0.17 -0.14 4.73 3.76 -1.12 -4.89 115.29 114.36 3h4h s HIS 217 Ca 0.03 0.38 -0.02 0.00 -0.15 0.00 0.00 55.06 55.30 3h4h s HIS 217 Cb 0.08 0.05 0.05 0.00 1.11 0.00 0.00 32.58 33.87 3h4h s HIS 217 CO 0.73 -0.21 0.02 0.08 -0.85 0.00 0.00 174.74 174.51 3h4h s VAL 218 N -0.49 0.47 0.15 -0.90 1.01 -0.41 -0.89 120.40 119.33 3h4h s VAL 218 Ca -0.06 -0.28 0.05 0.00 0.00 0.00 0.00 61.98 61.69 3h4h s VAL 218 Cb -0.04 -0.83 -0.04 0.00 0.00 0.00 0.00 36.38 35.47 3h4h s VAL 218 CO 0.01 -0.02 -0.12 0.68 0.00 0.00 0.00 175.10 175.66 3h4h s VAL 219 N 1.90 1.31 -0.07 2.92 -7.23 -0.13 -0.54 120.40 118.57 3h4h s VAL 219 Ca 0.02 -1.94 -0.03 0.00 -1.81 0.00 0.00 61.98 58.21 3h4h s VAL 219 Cb -0.15 -1.74 -0.04 0.00 0.56 0.00 0.00 36.38 35.01 3h4h s VAL 219 CO -0.07 -0.60 0.08 -0.36 -0.31 0.00 0.00 175.10 173.85 3h4h s PHE 220 N -2.80 3.37 -1.56 2.82 0.08 -1.26 -0.24 117.98 118.38 3h4h s PHE 220 Ca 0.14 0.32 -0.15 0.00 0.12 0.00 0.00 56.93 57.37 3h4h s PHE 220 Cb -0.01 -1.83 0.11 0.00 -0.57 0.00 0.00 43.02 40.72 3h4h s PHE 220 CO 0.02 0.60 0.86 -1.71 -0.10 0.00 0.00 175.22 174.89 3h4h n ASN 221 N 1.76 -4.27 0.00 1.36 4.05 -0.64 -2.84 115.26 114.68 3h4h n ASN 221 Ca -0.17 -0.80 0.00 0.00 0.45 0.00 0.00 54.58 54.06 3h4h n ASN 221 Cb 0.54 -3.44 0.00 0.00 1.23 0.00 0.00 39.78 38.10 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 -1.53 1.45 3.51 8.20 0.00 -0.91 -4.81 105.19 111.10 3h4h n GLY 222 Ca 0.05 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.96 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 -3.68 -1.81 0.17 4.61 0.00 -1.13 -4.68 121.76 115.23 3h4h s ALA 223 Ca 0.00 1.12 -0.34 0.00 0.00 0.00 0.00 51.96 52.74 3h4h s ALA 223 Cb 0.00 0.16 -0.14 0.00 0.00 0.00 0.00 23.12 23.15 3h4h s ALA 223 CO 0.00 -0.57 1.58 0.28 0.00 0.00 0.00 175.76 177.05 3h4h n VAL 224 N 0.11 0.04 -0.96 0.00 0.31 -0.34 -2.15 118.33 115.35 3h4h n VAL 224 Ca -0.12 -0.01 0.00 0.00 -0.01 0.00 0.00 64.34 64.21 3h4h n VAL 224 Cb 0.61 -1.57 0.00 0.00 -0.91 0.00 0.00 33.84 31.97 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 3.40 0.81 0.29 2.92 0.00 -1.26 -4.86 105.19 106.48 3h4h n GLY 225 Ca 0.17 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.33 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 1.57 0.00 4.61 0.00 -1.66 -2.30 119.26 121.48 3h4h h ALA 226 Ca 0.00 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 3h4h h ALA 226 Cb 0.02 -0.00 -0.05 0.00 0.00 0.00 0.00 17.79 17.76 3h4h h ALA 226 CO 0.00 0.02 -0.45 1.28 0.00 0.00 0.00 179.25 180.10 3h4h n LEU 227 N -3.92 2.22 0.00 0.00 4.77 -1.26 -4.75 117.00 114.05 3h4h n LEU 227 Ca -0.03 -3.26 -0.19 0.00 -0.03 0.00 0.00 56.01 52.50 3h4h n LEU 227 Cb 0.10 -0.40 -0.04 0.00 -2.33 0.00 0.00 43.42 40.75 3h4h n LEU 227 CO 0.29 1.04 -0.12 0.35 -1.33 0.00 0.00 177.39 177.61 3h4h n THR 228 N -0.91 0.00 0.00 -5.08 -2.24 -0.87 -0.28 114.28 104.91 3h4h n THR 228 Ca 0.15 -1.43 0.00 0.00 -2.27 0.00 0.00 64.05 60.51 3h4h n THR 228 Cb 0.74 0.22 0.00 0.00 -2.10 0.00 0.00 70.33 69.19 3h4h n THR 228 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3h4h n GLY 229 N 1.30 3.08 0.30 3.38 0.00 -1.26 -1.12 105.19 110.86 3h4h n GLY 229 Ca -0.11 0.10 0.14 0.00 0.00 0.00 0.00 46.02 46.15 3h4h n GLY 229 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 3h4h h ASP 230 N 0.00 0.00 -0.58 1.61 2.03 -1.95 -2.48 116.42 115.05 3h4h h ASP 230 Ca 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 3h4h h ASP 230 Cb 0.00 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.50 3h4h h ASP 230 CO 0.00 0.00 0.00 0.29 -1.03 0.00 0.00 179.24 178.50 3h4h n LYS 231 N -3.95 4.07 -1.66 4.15 5.02 -0.28 -4.95 118.16 120.57 3h4h n LYS 231 Ca -0.02 -2.82 -0.40 0.00 -2.02 0.00 0.00 58.31 53.04 3h4h n LYS 231 Cb 0.12 -2.03 0.02 0.00 -0.02 0.00 0.00 35.03 33.13 3h4h n LYS 231 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3h4h n ALA 232 N 0.86 0.78 -1.71 7.82 0.00 -0.94 -4.27 120.51 123.04 3h4h n ALA 232 Ca 0.25 0.21 -0.34 0.00 0.00 0.00 0.00 53.44 53.56 3h4h n ALA 232 Cb 0.98 -2.19 -0.00 0.00 0.00 0.00 0.00 19.45 18.24 3h4h n ALA 232 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 3h4h s MET 233 N -2.27 3.40 0.11 0.00 -1.94 -0.56 -4.80 119.30 113.23 3h4h s MET 233 Ca 0.65 1.38 0.09 0.00 -1.71 0.00 0.00 55.69 56.10 3h4h s MET 233 Cb -0.50 -2.03 -0.04 0.00 2.01 0.00 0.00 34.83 34.27 3h4h s MET 233 CO 0.55 -0.76 -0.23 0.95 -0.01 0.00 0.00 175.02 175.52 3h4h s THR 234 N -2.12 1.87 0.35 2.05 -4.23 -1.26 -0.24 115.64 112.05 3h4h s THR 234 Ca 0.68 -1.59 -0.12 0.00 -1.18 0.00 0.00 61.69 59.47 3h4h s THR 234 Cb -0.19 -1.68 0.03 0.00 1.34 0.00 0.00 72.50 72.00 3h4h s THR 234 CO 0.30 -0.01 0.65 0.00 -0.54 0.00 0.00 174.62 175.02 3h4h s ALA 235 N -1.12 -0.29 0.11 3.99 0.00 -0.97 -4.94 121.76 118.55 3h4h s ALA 235 Ca 0.09 -0.95 0.05 0.00 0.00 0.00 0.00 51.96 51.15 3h4h s ALA 235 Cb -0.10 0.88 -0.04 0.00 0.00 0.00 0.00 23.12 23.87 3h4h s ALA 235 CO 0.05 -0.92 -0.12 0.00 0.00 0.00 0.00 175.76 174.76 3h4h s ALA 236 N -2.90 1.33 0.18 0.00 0.00 -1.26 -1.50 121.76 117.61 3h4h s ALA 236 Ca 0.20 -1.24 -0.33 0.00 0.00 0.00 0.00 51.96 50.59 3h4h s ALA 236 Cb -0.03 -0.03 -0.15 0.00 0.00 0.00 0.00 23.12 22.91 3h4h s ALA 236 CO 0.13 0.05 1.33 0.28 0.00 0.00 0.00 175.76 177.55 3h4h n VAL 237 N 0.56 0.68 0.00 0.00 0.31 0.25 -1.49 118.33 118.63 3h4h n VAL 237 Ca -0.16 -0.17 0.00 0.00 -0.01 0.00 0.00 64.34 64.00 3h4h n VAL 237 Cb 0.57 -1.15 0.00 0.00 -0.91 0.00 0.00 33.84 32.35 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 2.31 2.14 3.76 2.92 0.00 0.11 -4.98 105.19 111.45 3h4h n GLY 238 Ca 0.14 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.77 3h4h n GLY 238 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3h4h s GLU 239 N -0.71 4.74 -0.23 1.61 2.02 -0.56 -4.81 118.70 120.76 3h4h s GLU 239 Ca 0.00 1.49 -0.14 0.00 0.02 0.00 0.00 54.97 56.34 3h4h s GLU 239 Cb 0.00 -3.13 -0.04 0.00 0.10 0.00 0.00 34.13 31.06 3h4h s GLU 239 CO 0.00 0.40 0.31 0.15 0.02 0.00 0.00 175.26 176.14 3h4h s LYS 240 N -1.46 4.11 -0.07 1.61 1.02 -1.26 -1.76 119.74 121.92 3h4h s LYS 240 Ca 0.44 0.00 0.03 0.00 0.02 0.00 0.00 55.97 56.47 3h4h s LYS 240 Cb -0.25 -3.56 0.00 0.00 -0.52 0.00 0.00 37.83 33.51 3h4h s LYS 240 CO 0.31 -0.05 -0.18 0.08 -0.92 0.00 0.00 175.35 174.59 3h4h s VAL 241 N 1.37 1.56 -0.23 3.17 1.01 0.10 0.40 120.40 127.77 3h4h s VAL 241 Ca 0.14 -0.74 -0.11 0.00 0.00 0.00 0.00 61.98 61.28 3h4h s VAL 241 Cb -0.15 -1.37 -0.05 0.00 0.00 0.00 0.00 36.38 34.82 3h4h s VAL 241 CO 0.07 0.45 0.16 -0.22 0.00 0.00 0.00 175.10 175.56 3h4h s LEU 242 N 0.41 4.13 -0.30 3.92 2.96 -0.29 -0.76 118.68 128.75 3h4h s LEU 242 Ca -0.14 0.13 -0.05 0.00 -0.22 0.00 0.00 54.13 53.85 3h4h s LEU 242 Cb -0.16 -2.11 0.03 0.00 0.50 0.00 0.00 46.19 44.45 3h4h s LEU 242 CO 0.05 0.08 0.05 -0.63 -1.32 0.00 0.00 176.35 174.58 3h4h s ILE 243 N 0.97 3.51 -0.06 6.68 1.01 0.15 -1.36 121.20 132.11 3h4h s ILE 243 Ca 0.08 -1.03 -0.16 0.00 0.00 0.00 0.00 60.65 59.54 3h4h s ILE 243 Cb -0.13 -2.90 -0.05 0.00 0.01 0.00 0.00 42.46 39.38 3h4h s ILE 243 CO 0.04 -0.02 0.41 -0.69 0.00 0.00 0.00 174.94 174.68 3h4h s VAL 244 N 1.39 5.11 -0.02 2.92 1.01 0.57 -1.29 120.40 130.09 3h4h s VAL 244 Ca -0.01 0.83 0.01 0.00 0.00 0.00 0.00 61.98 62.81 3h4h s VAL 244 Cb -0.18 -3.73 0.02 0.00 0.00 0.00 0.00 36.38 32.48 3h4h s VAL 244 CO 0.01 0.48 -0.01 -2.28 0.00 0.00 0.00 175.10 173.30 3h4h s HIS 245 N -0.38 0.29 0.12 5.22 2.46 -0.59 0.41 115.29 122.82 3h4h s HIS 245 Ca 0.23 -0.02 0.05 0.00 0.47 0.00 0.00 55.06 55.79 3h4h s HIS 245 Cb -0.16 -0.32 -0.04 0.00 -0.13 0.00 0.00 32.58 31.93 3h4h s HIS 245 CO 0.11 -0.08 -0.11 -1.54 -2.47 0.00 0.00 174.74 170.65 3h4h s SER 246 N 0.62 1.73 -0.25 9.88 1.04 -0.76 -0.73 113.70 125.24 3h4h s SER 246 Ca -0.06 -0.89 -0.04 0.00 0.48 0.00 0.00 55.95 55.44 3h4h s SER 246 Cb -0.09 -0.02 0.13 0.00 0.10 0.00 0.00 66.02 66.14 3h4h s SER 246 CO -0.01 -0.26 0.44 -1.58 0.98 0.00 0.00 173.24 172.81 3h4h s GLN 247 N -3.15 0.39 0.27 4.02 -0.44 -0.86 -1.42 119.66 118.47 3h4h s GLN 247 Ca 0.11 0.77 0.25 0.00 -2.50 0.00 0.00 55.36 53.99 3h4h s GLN 247 Cb -0.01 -0.05 0.63 0.00 -1.64 0.00 0.00 33.01 31.94 3h4h s GLN 247 CO 0.01 -0.53 1.69 0.00 0.50 0.00 0.00 175.29 176.95 3h4h h ALA 248 N 8.14 0.97 0.00 1.58 0.00 -1.82 0.18 119.26 128.30 3h4h h ALA 248 Ca -0.19 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.72 3h4h h ALA 248 Cb 1.14 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.93 3h4h h ALA 248 CO 0.23 0.00 -0.48 -1.71 0.00 0.00 0.00 179.25 177.29 3h4h n ASN 249 N -2.51 2.41 -3.72 0.00 5.15 -1.26 -2.71 115.26 112.62 3h4h n ASN 249 Ca 0.05 -0.02 -0.14 0.00 -0.60 0.00 0.00 54.58 53.87 3h4h n ASN 249 Cb 0.46 0.53 -0.09 0.00 -0.53 0.00 0.00 39.78 40.16 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 -1.01 0.65 0.67 1.20 3.52 -1.26 -4.69 118.95 118.03 3h4h s ARG 250 Ca 0.00 0.17 -0.17 0.00 -0.13 0.00 0.00 55.73 55.60 3h4h s ARG 250 Cb 0.00 0.30 0.01 0.00 -1.56 0.00 0.00 34.95 33.70 3h4h s ARG 250 CO 0.00 -0.15 1.24 -0.51 -0.81 0.00 0.00 175.30 175.07 3h4h s ASP 251 N -0.70 4.52 0.15 -2.12 -0.00 -1.26 -3.33 116.67 113.93 3h4h s ASP 251 Ca -0.08 2.47 -0.05 0.00 -0.00 0.00 0.00 52.55 54.89 3h4h s ASP 251 Cb -0.04 -2.60 -0.02 0.00 -0.00 0.00 0.00 42.92 40.26 3h4h s ASP 251 CO 0.04 -2.05 0.18 0.28 -0.00 0.00 0.00 175.17 173.62 3h4h s THR 252 N -1.68 0.08 -0.40 -1.27 -1.32 -0.44 -4.83 115.64 105.79 3h4h s THR 252 Ca 0.78 -1.64 0.03 0.00 -1.21 0.00 0.00 61.69 59.66 3h4h s THR 252 Cb -0.33 -1.95 0.17 0.00 -1.51 0.00 0.00 72.50 68.88 3h4h s THR 252 CO 0.41 -0.37 0.34 0.00 -2.21 0.00 0.00 174.62 172.79 3h4h s ARG 253 N -4.01 0.84 0.51 7.08 1.70 -1.26 -1.15 118.95 122.66 3h4h s ARG 253 Ca 0.21 -1.88 -0.21 0.00 -0.47 0.00 0.00 55.73 53.37 3h4h s ARG 253 Cb 0.05 -1.30 -0.06 0.00 -0.57 0.00 0.00 34.95 33.07 3h4h s ARG 253 CO 0.01 -1.35 1.21 -2.14 -1.08 0.00 0.00 175.30 171.95 3h4h s PRO 254 N 0.32 3.44 -0.09 3.89 0.02 -1.04 -0.67 135.00 140.87 3h4h s PRO 254 Ca 0.30 1.85 -0.05 0.00 0.02 0.00 0.00 61.00 63.12 3h4h s PRO 254 Cb -0.02 -2.24 0.04 0.00 0.02 0.00 0.00 34.50 32.31 3h4h s PRO 254 CO -0.15 -0.84 0.22 -1.58 -0.33 0.00 0.00 177.00 174.32 3h4h s HIS 255 N -1.54 -0.28 -0.45 6.54 2.46 -0.13 -1.34 115.29 120.54 3h4h s HIS 255 Ca 0.69 0.70 -0.19 0.00 0.47 0.00 0.00 55.06 56.73 3h4h s HIS 255 Cb -0.31 0.02 0.03 0.00 -0.13 0.00 0.00 32.58 32.20 3h4h s HIS 255 CO 0.36 -0.21 0.54 -1.17 -2.47 0.00 0.00 174.74 171.79 3h4h s LEU 256 N 1.15 4.84 -0.19 8.88 2.96 -1.26 -0.98 118.68 134.08 3h4h s LEU 256 Ca -0.09 -0.69 -0.29 0.00 -0.22 0.00 0.00 54.13 52.84 3h4h s LEU 256 Cb -0.10 -2.48 -0.01 0.00 0.50 0.00 0.00 46.19 44.10 3h4h s LEU 256 CO -0.07 -0.72 1.32 -0.63 -1.32 0.00 0.00 176.35 174.93 3h4h s ILE 257 N 2.41 4.18 0.00 6.68 1.01 0.15 -1.53 121.20 134.10 3h4h s ILE 257 Ca 0.15 1.40 0.00 0.00 0.00 0.00 0.00 60.65 62.20 3h4h s ILE 257 Cb -0.17 -3.98 0.00 0.00 0.01 0.00 0.00 42.46 38.32 3h4h s ILE 257 CO 0.14 -0.20 0.00 0.61 0.00 0.00 0.00 174.94 175.49 3h4h n GLY 258 N 3.84 1.18 0.00 6.18 0.00 -1.26 -3.61 105.19 111.51 3h4h n GLY 258 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.17 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 -2.00 6.76 3.47 -0.02 0.00 -0.58 -5.01 105.19 107.81 3h4h n GLY 259 Ca 0.00 -1.80 -0.11 0.00 0.00 0.00 0.00 46.02 44.11 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 0.18 0.76 -0.53 1.61 0.09 -1.26 -4.74 115.29 111.40 3h4h s HIS 260 Ca 0.00 -1.05 -0.16 0.00 -0.00 0.00 0.00 55.06 53.85 3h4h s HIS 260 Cb 0.00 -0.06 0.13 0.00 -0.00 0.00 0.00 32.58 32.64 3h4h s HIS 260 CO 0.00 -0.96 0.49 0.20 -0.00 0.00 0.00 174.74 174.47 3h4h s GLY 261 N -3.12 2.09 0.15 -2.22 0.00 -0.17 -4.74 107.32 99.31 3h4h s GLY 261 Ca 0.29 -2.51 -0.16 0.00 0.00 0.00 0.00 44.72 42.33 3h4h s GLY 261 CO 0.13 1.19 1.81 -0.55 0.00 0.00 0.00 173.10 175.69 3h4h h ASP 262 N 8.87 0.45 -3.48 1.64 3.32 -1.40 0.69 116.42 126.52 3h4h h ASP 262 Ca -0.30 -0.01 -0.53 0.00 0.02 0.00 0.00 57.03 56.21 3h4h h ASP 262 Cb 1.10 -0.11 -0.33 0.00 0.22 0.00 0.00 39.33 40.21 3h4h h ASP 262 CO 1.03 0.33 -0.82 -0.31 -1.72 0.00 0.00 179.24 177.74 3h4h s TYR 263 N -6.16 1.56 -0.16 4.55 1.51 -0.89 -1.90 117.35 115.86 3h4h s TYR 263 Ca -0.13 -0.56 -0.02 0.00 -1.01 0.00 0.00 57.07 55.35 3h4h s TYR 263 Cb 0.11 -1.12 0.05 0.00 -0.11 0.00 0.00 41.96 40.89 3h4h s TYR 263 CO 0.72 -0.27 -0.01 0.08 -1.11 0.00 0.00 175.55 174.97 3h4h s VAL 264 N 0.54 0.74 -1.18 0.71 1.01 0.15 -0.18 120.40 122.19 3h4h s VAL 264 Ca -0.13 -0.44 -0.19 0.00 0.00 0.00 0.00 61.98 61.21 3h4h s VAL 264 Cb -0.15 -1.03 0.08 0.00 0.00 0.00 0.00 36.38 35.28 3h4h s VAL 264 CO 0.04 0.03 1.58 0.26 0.00 0.00 0.00 175.10 177.01 3h4h s TRP 265 N 1.79 2.79 0.37 5.22 0.51 0.49 -0.93 118.94 129.17 3h4h s TRP 265 Ca 0.01 -1.41 0.12 0.00 -2.12 0.00 0.00 56.10 52.70 3h4h s TRP 265 Cb -0.15 -4.67 0.71 0.00 -0.81 0.00 0.00 33.47 28.55 3h4h s TRP 265 CO -0.07 -1.79 1.82 0.00 -0.51 0.00 0.00 176.95 176.40 3h4h h ALA 266 N 8.32 1.37 -0.00 0.98 0.00 -1.90 -0.51 119.26 127.53 3h4h h ALA 266 Ca 0.34 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3h4h h ALA 266 Cb 0.92 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.65 3h4h h ALA 266 CO 1.41 0.47 -0.08 0.25 0.00 0.00 0.00 179.25 181.30 3h4h n THR 267 N -4.10 0.00 -0.72 0.00 -2.24 -1.26 -4.54 114.28 101.41 3h4h n THR 267 Ca -0.02 -0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.76 3h4h n THR 267 Cb 0.41 -0.37 0.00 0.00 -2.10 0.00 0.00 70.33 68.26 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 1.47 1.29 3.46 3.38 0.00 -0.26 -4.73 105.19 109.81 3h4h n GLY 268 Ca 0.08 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.74 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 -0.10 3.66 0.35 1.61 -0.14 -1.26 0.22 119.74 124.08 3h4h s LYS 269 Ca 0.00 -0.49 0.27 0.00 -1.36 0.00 0.00 55.97 54.39 3h4h s LYS 269 Cb 0.00 -3.22 0.97 0.00 -1.68 0.00 0.00 37.83 33.91 3h4h s LYS 269 CO 0.00 -0.08 1.79 0.74 -0.76 0.00 0.00 175.35 177.04 3h4h h PHE 270 N 7.83 0.00 0.00 3.18 0.05 -1.78 -2.05 116.94 124.18 3h4h h PHE 270 Ca -0.37 0.00 0.00 0.00 3.82 0.00 0.00 57.97 61.42 3h4h h PHE 270 Cb 1.17 0.00 0.00 0.00 2.00 0.00 0.00 35.95 39.12 3h4h h PHE 270 CO 0.63 0.00 -0.28 0.09 -0.18 0.00 0.00 178.31 178.57 3h4h n ASN 271 N -2.59 0.29 -4.58 2.17 3.02 -1.26 -4.57 115.26 107.73 3h4h n ASN 271 Ca 0.03 0.08 -0.41 0.00 -0.03 0.00 0.00 54.58 54.25 3h4h n ASN 271 Cb 0.33 -0.08 -0.07 0.00 -0.61 0.00 0.00 39.78 39.35 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 -3.00 4.93 0.46 3.41 2.01 -0.77 -5.05 115.64 117.62 3h4h s THR 272 Ca 0.12 0.67 -0.24 0.00 0.31 0.00 0.00 61.69 62.56 3h4h s THR 272 Cb 0.18 -4.02 -0.09 0.00 0.01 0.00 0.00 72.50 68.58 3h4h s THR 272 CO 0.63 -0.22 1.13 -2.65 -0.69 0.00 0.00 174.62 172.82 3h4h n PRO 273 N 5.93 1.53 -2.62 4.92 -0.02 -1.26 -4.82 135.00 138.65 3h4h n PRO 273 Ca -0.02 0.55 -0.35 0.00 -2.02 0.00 0.00 63.50 61.66 3h4h n PRO 273 Cb 0.49 -2.24 -0.05 0.00 -0.02 0.00 0.00 33.50 31.68 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 -2.29 4.15 0.68 0.52 0.04 -1.26 -4.92 135.00 131.92 3h4h s PRO 274 Ca 0.65 1.39 -0.15 0.00 0.04 0.00 0.00 61.00 62.92 3h4h s PRO 274 Cb -0.50 -2.42 0.01 0.00 0.04 0.00 0.00 34.50 31.63 3h4h s PRO 274 CO 0.55 -0.13 1.15 -0.51 0.04 0.00 0.00 177.00 178.10 3h4h s ASP 275 N -1.77 4.81 0.17 6.66 1.01 -0.11 -4.73 116.67 122.71 3h4h s ASP 275 Ca 0.60 2.16 0.08 0.00 0.71 0.00 0.00 52.55 56.10 3h4h s ASP 275 Cb -0.18 -2.57 -0.04 0.00 1.01 0.00 0.00 42.92 41.14 3h4h s ASP 275 CO 0.23 -1.84 -0.18 0.68 0.21 0.00 0.00 175.17 174.27 3h4h s VAL 276 N -2.15 1.82 -1.44 -1.27 -7.23 -1.26 0.32 120.40 109.20 3h4h s VAL 276 Ca 0.70 -1.95 -0.03 0.00 -1.81 0.00 0.00 61.98 58.90 3h4h s VAL 276 Cb -0.24 -1.86 0.00 0.00 0.56 0.00 0.00 36.38 34.84 3h4h s VAL 276 CO 0.42 -0.34 0.39 0.47 -0.31 0.00 0.00 175.10 175.73 3h4h n ASP 277 N 0.23 -5.55 -4.76 4.85 10.43 -0.80 -4.92 116.55 116.03 3h4h n ASP 277 Ca -0.13 -0.19 -0.40 0.00 2.57 0.00 0.00 54.79 56.65 3h4h n ASP 277 Cb 0.57 -4.44 -0.03 0.00 1.84 0.00 0.00 41.12 39.06 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 -5.39 4.42 -0.22 -1.24 -1.52 0.21 -4.81 119.66 111.10 3h4h s GLN 278 Ca 0.19 1.88 -0.19 0.00 -1.95 0.00 0.00 55.36 55.30 3h4h s GLN 278 Cb -0.09 -3.01 -0.16 0.00 -0.22 0.00 0.00 33.01 29.53 3h4h s GLN 278 CO 0.24 -0.01 0.06 -0.85 -0.25 0.00 0.00 175.29 174.47 3h4h n GLU 279 N 0.78 0.56 -3.73 2.91 0.28 -1.26 -1.00 120.64 119.18 3h4h n GLU 279 Ca 0.01 0.50 -0.15 0.00 -0.16 0.00 0.00 57.16 57.35 3h4h n GLU 279 Cb 0.45 -1.68 -0.15 0.00 1.43 0.00 0.00 31.44 31.48 3h4h n GLU 279 CO 0.00 0.00 0.00 0.99 -0.16 0.00 0.00 177.13 177.96 3h4h s THR 280 N -2.40 -0.11 0.49 3.84 2.01 -1.26 -4.32 115.64 113.90 3h4h s THR 280 Ca -0.30 0.25 0.06 0.00 0.31 0.00 0.00 61.69 62.01 3h4h s THR 280 Cb 0.08 -0.21 0.01 0.00 0.01 0.00 0.00 72.50 72.39 3h4h s THR 280 CO 0.55 0.10 0.38 -1.66 -0.69 0.00 0.00 174.62 173.30 3h4h s TRP 281 N 1.50 2.04 -0.05 4.92 -2.14 -0.45 -4.96 118.94 119.81 3h4h s TRP 281 Ca -0.05 -0.71 0.02 0.00 2.66 0.00 0.00 56.10 58.01 3h4h s TRP 281 Cb -0.12 -2.00 0.02 0.00 -3.10 0.00 0.00 33.47 28.27 3h4h s TRP 281 CO -0.05 -0.31 -0.07 0.12 -2.66 0.00 0.00 176.95 173.98 3h4h s PHE 282 N -2.67 0.94 -0.18 1.66 5.36 -1.26 -2.50 117.98 119.33 3h4h s PHE 282 Ca 0.39 -0.29 0.00 0.00 -0.96 0.00 0.00 56.93 56.08 3h4h s PHE 282 Cb -0.02 -0.76 0.04 0.00 -0.34 0.00 0.00 43.02 41.94 3h4h s PHE 282 CO 0.24 -0.20 -0.09 0.42 -1.46 0.00 0.00 175.22 174.12 3h4h s ILE 283 N 0.77 1.48 0.55 3.12 1.01 -0.30 -4.72 121.20 123.10 3h4h s ILE 283 Ca -0.12 -0.86 -0.18 0.00 0.00 0.00 0.00 60.65 59.49 3h4h s ILE 283 Cb -0.14 -1.57 -0.05 0.00 0.01 0.00 0.00 42.46 40.71 3h4h s ILE 283 CO 0.01 0.18 1.07 -2.16 0.00 0.00 0.00 174.94 174.05 3h4h s PRO 284 N 1.48 3.43 0.22 2.79 0.04 -1.26 -1.32 135.00 140.37 3h4h s PRO 284 Ca -0.00 1.37 -0.32 0.00 0.04 0.00 0.00 61.00 62.09 3h4h s PRO 284 Cb -0.16 -2.04 -0.14 0.00 0.04 0.00 0.00 34.50 32.21 3h4h s PRO 284 CO -0.08 -0.74 1.36 0.41 0.04 0.00 0.00 177.00 177.99 3h4h n GLY 285 N -0.42 0.63 0.79 0.56 0.00 -1.21 -2.31 105.19 103.24 3h4h n GLY 285 Ca 0.10 0.51 0.00 0.00 0.00 0.00 0.00 46.02 46.63 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 2.19 0.76 3.36 -0.02 0.00 0.59 -4.70 105.19 107.36 3h4h n GLY 286 Ca 0.13 -0.42 -0.09 0.00 0.00 0.00 0.00 46.02 45.63 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 -0.22 0.20 4.61 0.00 -0.98 -4.75 121.76 118.63 3h4h s ALA 287 Ca 0.00 -0.72 0.10 0.00 0.00 0.00 0.00 51.96 51.35 3h4h s ALA 287 Cb 0.00 0.82 -0.04 0.00 0.00 0.00 0.00 23.12 23.90 3h4h s ALA 287 CO 0.00 -0.66 -0.17 0.00 0.00 0.00 0.00 175.76 174.93 3h4h s ALA 288 N -3.94 2.74 0.27 0.00 0.00 -1.26 -2.03 121.76 117.55 3h4h s ALA 288 Ca 0.14 -1.60 0.02 0.00 0.00 0.00 0.00 51.96 50.51 3h4h s ALA 288 Cb 0.03 -0.50 -0.05 0.00 0.00 0.00 0.00 23.12 22.60 3h4h s ALA 288 CO -0.02 0.42 0.11 0.20 0.00 0.00 0.00 175.76 176.47 3h4h s GLY 289 N -2.87 1.81 -0.09 0.00 0.00 0.09 -3.05 107.32 103.21 3h4h s GLY 289 Ca 0.24 -1.82 -0.07 0.00 0.00 0.00 0.00 44.72 43.06 3h4h s GLY 289 CO 0.13 -1.59 0.24 0.00 0.00 0.00 0.00 173.10 171.88 3h4h s ALA 290 N -3.74 -0.57 -0.05 3.20 0.00 -0.86 -1.55 121.76 118.19 3h4h s ALA 290 Ca 0.37 0.74 0.06 0.00 0.00 0.00 0.00 51.96 53.13 3h4h s ALA 290 Cb 0.07 -0.44 -0.01 0.00 0.00 0.00 0.00 23.12 22.74 3h4h s ALA 290 CO 0.14 -0.13 -0.23 0.00 0.00 0.00 0.00 175.76 175.54 3h4h s ALA 291 N 0.38 2.02 -0.16 0.00 0.00 -0.41 -0.38 121.76 123.21 3h4h s ALA 291 Ca -0.02 -0.97 -0.03 0.00 0.00 0.00 0.00 51.96 50.93 3h4h s ALA 291 Cb -0.04 -0.63 -0.02 0.00 0.00 0.00 0.00 23.12 22.43 3h4h s ALA 291 CO -0.02 0.39 -0.05 0.12 0.00 0.00 0.00 175.76 176.20 3h4h s PHE 292 N -0.14 2.97 -0.01 0.00 2.19 0.74 0.34 117.98 124.08 3h4h s PHE 292 Ca -0.03 -0.46 -0.02 0.00 0.33 0.00 0.00 56.93 56.75 3h4h s PHE 292 Cb -0.13 -1.97 -0.00 0.00 -1.31 0.00 0.00 43.02 39.61 3h4h s PHE 292 CO 0.03 -0.16 0.04 -0.47 1.83 0.00 0.00 175.22 176.49 3h4h s TYR 293 N 0.57 0.02 -0.31 10.12 5.04 0.06 -1.07 117.35 131.78 3h4h s TYR 293 Ca -0.04 -0.02 -0.09 0.00 -2.44 0.00 0.00 57.07 54.48 3h4h s TYR 293 Cb -0.15 -0.03 -0.00 0.00 0.35 0.00 0.00 41.96 42.13 3h4h s TYR 293 CO 0.03 -0.07 0.15 0.99 -1.34 0.00 0.00 175.55 175.30 3h4h s THR 294 N -0.35 4.55 0.28 4.34 2.01 -1.26 0.02 115.64 125.22 3h4h s THR 294 Ca -0.04 -0.46 -0.30 0.00 0.31 0.00 0.00 61.69 61.20 3h4h s THR 294 Cb -0.03 -3.33 -0.11 0.00 0.01 0.00 0.00 72.50 69.05 3h4h s THR 294 CO -0.00 0.06 1.48 -0.36 -0.69 0.00 0.00 174.62 175.11 3h4h s PHE 295 N 1.60 2.91 0.00 4.92 0.40 -0.72 -4.88 117.98 122.21 3h4h s PHE 295 Ca 0.04 0.98 0.00 0.00 -0.60 0.00 0.00 56.93 57.36 3h4h s PHE 295 Cb -0.17 -3.90 0.00 0.00 0.51 0.00 0.00 43.02 39.46 3h4h s PHE 295 CO 0.06 -2.93 0.00 1.04 0.70 0.00 0.00 175.22 174.09 3h4h n GLN 296 N 2.06 4.51 -4.33 0.44 6.02 -1.26 0.04 117.38 124.86 3h4h n GLN 296 Ca 0.06 0.00 -0.19 0.00 -0.01 0.00 0.00 57.00 56.87 3h4h n GLN 296 Cb 0.39 -0.60 -0.14 0.00 1.02 0.00 0.00 30.24 30.91 3h4h n GLN 296 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 3h4h s GLN 297 N -1.18 0.80 0.78 -1.09 -1.52 -1.26 -4.55 119.66 111.65 3h4h s GLN 297 Ca 0.00 -0.58 -0.08 0.00 -1.95 0.00 0.00 55.36 52.75 3h4h s GLN 297 Cb 0.00 -0.77 0.11 0.00 -0.22 0.00 0.00 33.01 32.14 3h4h s GLN 297 CO 0.00 0.19 1.10 -1.25 -0.25 0.00 0.00 175.29 175.08 3h4h s PRO 298 N -0.81 1.66 0.00 2.91 0.04 -1.26 -4.74 135.00 132.79 3h4h s PRO 298 Ca 0.01 -0.47 0.00 0.00 0.04 0.00 0.00 61.00 60.58 3h4h s PRO 298 Cb -0.06 -2.11 0.00 0.00 0.04 0.00 0.00 34.50 32.37 3h4h s PRO 298 CO 0.00 -1.61 0.00 0.41 0.04 0.00 0.00 177.00 175.84 3h4h n GLY 299 N -3.15 -0.18 3.72 0.56 0.00 0.84 -4.92 105.19 102.07 3h4h n GLY 299 Ca 0.11 -2.26 -0.41 0.00 0.00 0.00 0.00 46.02 43.46 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 -0.18 4.71 0.03 -0.61 1.01 -1.26 -0.75 121.20 124.15 3h4h s ILE 300 Ca 0.00 2.02 0.08 0.00 0.00 0.00 0.00 60.65 62.75 3h4h s ILE 300 Cb 0.00 -4.30 -0.03 0.00 0.01 0.00 0.00 42.46 38.14 3h4h s ILE 300 CO 0.00 0.24 -0.24 -0.31 0.00 0.00 0.00 174.94 174.63 3h4h s TYR 301 N 0.51 2.39 -0.10 3.97 1.51 0.26 -4.98 117.35 120.91 3h4h s TYR 301 Ca 0.48 -0.37 -0.05 0.00 -1.01 0.00 0.00 57.07 56.12 3h4h s TYR 301 Cb -0.22 -1.44 -0.04 0.00 -0.11 0.00 0.00 41.96 40.16 3h4h s TYR 301 CO 0.28 0.13 0.11 0.00 -1.11 0.00 0.00 175.55 174.96 3h4h s ALA 302 N -0.79 3.73 -0.20 3.71 0.00 -1.24 -0.32 121.76 126.65 3h4h s ALA 302 Ca 0.12 -0.70 0.01 0.00 0.00 0.00 0.00 51.96 51.39 3h4h s ALA 302 Cb -0.10 -1.83 0.02 0.00 0.00 0.00 0.00 23.12 21.21 3h4h s ALA 302 CO 0.02 0.63 -0.17 -0.47 0.00 0.00 0.00 175.76 175.77 3h4h s TYR 303 N -1.03 2.87 0.10 0.00 5.04 0.87 0.30 117.35 125.51 3h4h s TYR 303 Ca 0.16 -1.69 0.03 0.00 -2.44 0.00 0.00 57.07 53.13 3h4h s TYR 303 Cb -0.12 -1.94 -0.04 0.00 0.35 0.00 0.00 41.96 40.21 3h4h s TYR 303 CO 0.05 -0.80 -0.08 0.14 -1.34 0.00 0.00 175.55 173.52 3h4h s VAL 304 N 1.28 0.86 -0.21 3.14 -7.23 -0.15 -0.40 120.40 117.68 3h4h s VAL 304 Ca 0.03 -1.81 -0.29 0.00 -1.81 0.00 0.00 61.98 58.10 3h4h s VAL 304 Cb -0.14 -1.54 -0.01 0.00 0.56 0.00 0.00 36.38 35.26 3h4h s VAL 304 CO -0.11 -0.71 1.25 0.21 -0.31 0.00 0.00 175.10 175.43 3h4h s ASN 305 N -2.77 6.88 -0.07 4.85 3.84 -0.88 -0.96 114.94 125.83 3h4h s ASN 305 Ca 0.09 1.53 0.03 0.00 0.21 0.00 0.00 52.86 54.72 3h4h s ASN 305 Cb 0.01 -2.54 0.21 0.00 -0.55 0.00 0.00 41.25 38.38 3h4h s ASN 305 CO -0.02 -0.84 0.87 1.57 -2.79 0.00 0.00 177.10 175.89 3h4h n HIS 306 N 6.87 0.58 -2.69 0.43 -0.00 0.16 -3.81 115.22 116.75 3h4h n HIS 306 Ca 0.14 -0.26 -0.42 0.00 -0.00 0.00 0.00 57.72 57.18 3h4h n HIS 306 Cb 0.45 -0.23 -0.03 0.00 -0.00 0.00 0.00 29.99 30.18 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 -0.14 6.34 0.52 0.26 3.84 -1.26 -4.91 114.94 119.58 3h4h s ASN 307 Ca 0.14 -0.25 0.31 0.00 0.21 0.00 0.00 52.86 53.28 3h4h s ASN 307 Cb 0.11 -2.50 1.24 0.00 -0.55 0.00 0.00 41.25 39.55 3h4h s ASN 307 CO 0.04 -1.45 1.94 -0.07 -2.79 0.00 0.00 177.10 174.77 3h4h h LEU 308 N 11.73 0.00 -0.25 3.21 3.38 -1.99 0.11 115.31 131.50 3h4h h LEU 308 Ca -0.26 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.69 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 1.17 0.06 0.10 0.40 0.09 0.00 0.00 178.44 180.25 3h4h h ILE 309 N 0.00 1.17 -0.72 1.22 2.04 -1.91 -3.15 117.51 116.16 3h4h h ILE 309 Ca -0.00 -0.51 -0.05 0.00 1.00 0.00 0.00 64.86 65.31 3h4h h ILE 309 Cb 0.57 1.04 -0.03 0.00 -0.74 0.00 0.00 36.82 37.66 3h4h h ILE 309 CO 0.01 0.17 0.26 -0.33 0.00 0.00 0.00 178.15 178.26 3h4h h GLU 310 N 0.25 1.10 0.00 2.37 5.08 -1.18 0.22 114.58 122.42 3h4h h GLU 310 Ca 0.08 -0.21 0.00 0.00 -1.00 0.00 0.00 59.36 58.23 3h4h h GLU 310 Cb 0.17 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.25 3h4h h GLU 310 CO -0.01 0.92 0.00 0.00 -1.00 0.00 0.00 179.01 178.92 3h4h n ALA 311 N -2.42 1.76 0.00 3.43 0.00 -0.13 -1.34 120.51 121.81 3h4h n ALA 311 Ca 0.06 -0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.44 3h4h n ALA 311 Cb 0.20 -1.20 0.00 0.00 0.00 0.00 0.00 19.45 18.44 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 -1.26 0.00 -0.00 0.00 -0.58 0.66 -2.06 120.64 117.41 3h4h n GLU 313 Ca 0.06 0.00 0.11 0.00 -0.42 0.00 0.00 57.16 56.91 3h4h n GLU 313 Cb 0.09 0.00 -0.13 0.00 -0.57 0.00 0.00 31.44 30.84 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 -0.18 0.53 0.00 -4.62 4.77 -0.54 -5.01 117.00 111.95 3h4h n LEU 314 Ca 0.00 -0.23 0.00 0.00 -0.03 0.00 0.00 56.01 55.75 3h4h n LEU 314 Cb 0.00 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.08 3h4h n LEU 314 CO 0.00 0.12 0.00 0.61 -1.33 0.00 0.00 177.39 176.79 3h4h n GLY 315 N 1.38 1.31 2.62 -0.72 0.00 -0.66 -1.28 105.19 107.83 3h4h n GLY 315 Ca 0.00 0.00 -0.41 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 -0.23 6.28 -3.33 4.61 0.00 0.30 -4.10 120.51 124.03 3h4h n ALA 316 Ca 0.00 -4.10 -0.13 0.00 0.00 0.00 0.00 53.44 49.20 3h4h n ALA 316 Cb 0.00 -2.96 -0.14 0.00 0.00 0.00 0.00 19.45 16.35 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 0.01 -0.10 0.32 0.00 0.00 -1.26 -2.07 121.76 118.67 3h4h s ALA 317 Ca 0.50 0.30 0.07 0.00 0.00 0.00 0.00 51.96 52.83 3h4h s ALA 317 Cb 0.15 -0.21 -0.06 0.00 0.00 0.00 0.00 23.12 23.00 3h4h s ALA 317 CO -0.05 -0.08 -0.04 0.00 0.00 0.00 0.00 175.76 175.60 3h4h s ALA 318 N 0.56 2.60 0.11 0.00 0.00 0.46 -4.59 121.76 120.90 3h4h s ALA 318 Ca -0.04 -2.03 0.09 0.00 0.00 0.00 0.00 51.96 49.98 3h4h s ALA 318 Cb -0.06 0.22 -0.04 0.00 0.00 0.00 0.00 23.12 23.24 3h4h s ALA 318 CO -0.02 -0.09 -0.21 -1.01 0.00 0.00 0.00 175.76 174.43 3h4h s HIS 319 N -2.93 2.46 -0.05 0.00 3.76 0.62 -0.09 115.29 119.06 3h4h s HIS 319 Ca 0.32 -0.30 0.04 0.00 -0.15 0.00 0.00 55.06 54.97 3h4h s HIS 319 Cb 0.05 -1.33 -0.02 0.00 1.11 0.00 0.00 32.58 32.39 3h4h s HIS 319 CO 0.14 0.35 -0.16 -0.06 -0.85 0.00 0.00 174.74 174.16 3h4h s PHE 320 N -1.08 2.65 -0.25 1.40 0.08 0.56 -1.50 117.98 119.85 3h4h s PHE 320 Ca 0.16 -0.23 -0.04 0.00 0.12 0.00 0.00 56.93 56.95 3h4h s PHE 320 Cb -0.10 -1.62 0.01 0.00 -0.57 0.00 0.00 43.02 40.73 3h4h s PHE 320 CO 0.08 0.13 -0.02 0.15 -0.10 0.00 0.00 175.22 175.46 3h4h s LYS 321 N -0.65 3.13 -0.15 0.44 1.02 0.67 -0.58 119.74 123.62 3h4h s LYS 321 Ca 0.10 -0.79 0.00 0.00 0.02 0.00 0.00 55.97 55.30 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 0.01 -0.32 -0.15 0.08 -0.92 0.00 0.00 175.35 174.05 3h4h s VAL 322 N 1.43 2.70 0.55 3.17 1.01 0.07 -2.28 120.40 127.06 3h4h s VAL 322 Ca 0.03 -0.76 -0.06 0.00 0.00 0.00 0.00 61.98 61.20 3h4h s VAL 322 Cb -0.16 -2.14 -0.01 0.00 0.00 0.00 0.00 36.38 34.08 3h4h s VAL 322 CO -0.02 0.52 0.86 0.42 0.00 0.00 0.00 175.10 176.87 3h4h s THR 323 N 0.77 4.06 -2.10 3.92 -4.23 -0.56 -0.11 115.64 117.39 3h4h s THR 323 Ca -0.06 0.06 0.00 0.00 -1.18 0.00 0.00 61.69 60.51 3h4h s THR 323 Cb -0.15 -3.58 0.00 0.00 1.34 0.00 0.00 72.50 70.10 3h4h s THR 323 CO 0.01 -0.59 0.00 0.61 -0.54 0.00 0.00 174.62 174.11 3h4h n GLY 324 N -2.48 0.62 3.81 3.99 0.00 -1.26 -0.58 105.19 109.29 3h4h n GLY 324 Ca 0.03 -2.15 -0.36 0.00 0.00 0.00 0.00 46.02 43.54 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 -0.87 3.82 0.31 1.61 2.12 -1.26 -4.70 118.70 119.73 3h4h s GLU 325 Ca 0.00 -0.09 -0.29 0.00 0.36 0.00 0.00 54.97 54.95 3h4h s GLU 325 Cb 0.00 -3.29 -0.11 0.00 0.26 0.00 0.00 34.13 30.99 3h4h s GLU 325 CO 0.00 0.55 1.45 -0.46 -0.54 0.00 0.00 175.26 176.26 3h4h s TRP 326 N -0.41 2.87 -0.50 5.30 -0.11 -1.26 -4.41 118.94 120.42 3h4h s TRP 326 Ca 0.14 1.10 -0.13 0.00 1.22 0.00 0.00 56.10 58.42 3h4h s TRP 326 Cb -0.12 -3.89 0.11 0.00 -1.50 0.00 0.00 33.47 28.07 3h4h s TRP 326 CO 0.03 -2.75 0.41 1.21 -4.62 0.00 0.00 176.95 171.23 3h4h s ASN 327 N 0.08 5.98 0.45 5.86 3.84 -1.26 -4.95 114.94 124.92 3h4h s ASN 327 Ca 0.56 -1.73 0.30 0.00 0.21 0.00 0.00 52.86 52.20 3h4h s ASN 327 Cb -0.44 -2.12 1.17 0.00 -0.55 0.00 0.00 41.25 39.31 3h4h s ASN 327 CO 0.51 -0.74 1.88 0.44 -2.79 0.00 0.00 177.10 176.39 3h4h h ASP 328 N 8.68 0.00 -0.22 -4.21 3.45 -1.95 -2.64 116.42 119.54 3h4h h ASP 328 Ca -0.26 0.00 -0.06 0.00 0.43 0.00 0.00 57.03 57.13 3h4h h ASP 328 Cb 1.09 0.00 -0.01 0.00 -0.56 0.00 0.00 39.33 39.86 3h4h h ASP 328 CO 0.93 0.00 -0.11 -0.78 -1.57 0.00 0.00 179.24 177.71 3h4h h ASP 329 N 0.00 0.48 -0.55 6.45 -0.00 -2.02 -3.23 116.42 117.56 3h4h h ASP 329 Ca 0.00 -0.41 -0.06 0.00 -0.00 0.00 0.00 57.03 56.55 3h4h h ASP 329 Cb 0.52 -0.13 -0.02 0.00 -0.00 0.00 0.00 39.33 39.69 3h4h h ASP 329 CO 0.00 0.79 0.09 -0.07 -0.00 0.00 0.00 179.24 180.05 3h4h h LEU 330 N 0.17 0.87 -7.02 2.28 3.38 -1.91 -3.45 115.31 109.63 3h4h h LEU 330 Ca 0.05 -0.26 -0.01 0.00 0.09 0.00 0.00 57.88 57.75 3h4h h LEU 330 Cb 0.61 -0.23 -0.21 0.00 0.09 0.00 0.00 40.66 40.92 3h4h h LEU 330 CO 0.03 0.91 0.04 -0.32 0.09 0.00 0.00 178.44 179.19 3h4h s MET 331 N -5.20 0.74 -0.05 1.13 0.00 -1.06 -5.14 119.30 109.70 3h4h s MET 331 Ca -0.12 1.10 -0.07 0.00 0.00 0.00 0.00 55.69 56.60 3h4h s MET 331 Cb 0.12 0.24 0.02 0.00 0.00 0.00 0.00 34.83 35.20 3h4h s MET 331 CO 0.82 -0.13 0.19 -0.08 0.00 0.00 0.00 175.02 175.81 3h4h s THR 332 N 1.11 0.02 -0.70 10.11 -1.32 -1.25 -4.17 115.64 119.44 3h4h s THR 332 Ca -0.06 -0.16 -0.26 0.00 -1.21 0.00 0.00 61.69 60.00 3h4h s THR 332 Cb -0.05 -0.32 0.04 0.00 -1.51 0.00 0.00 72.50 70.66 3h4h s THR 332 CO -0.11 -0.09 1.21 -0.55 -2.21 0.00 0.00 174.62 172.87 3h4h s SER 333 N -0.25 6.20 0.15 8.08 0.15 -1.26 -4.88 113.70 121.89 3h4h s SER 333 Ca -0.03 -0.49 -0.12 0.00 0.70 0.00 0.00 55.95 56.00 3h4h s SER 333 Cb -0.03 -2.53 0.03 0.00 -1.71 0.00 0.00 66.02 61.79 3h4h s SER 333 CO 0.01 -1.72 1.65 0.58 1.20 0.00 0.00 173.24 174.96 3h4h h VAL 334 N 6.03 1.25 -3.24 4.45 2.07 -2.01 -3.41 116.25 121.39 3h4h h VAL 334 Ca -0.28 -0.92 -0.45 0.00 0.82 0.00 0.00 66.70 65.87 3h4h h VAL 334 Cb 1.05 0.85 -0.39 0.00 -1.52 0.00 0.00 31.29 31.28 3h4h h VAL 334 CO 1.25 0.33 -0.76 -0.22 0.02 0.00 0.00 177.57 178.19 3h4h s LEU 335 N -9.54 0.66 0.65 2.57 2.96 -1.26 -5.14 118.68 109.57 3h4h s LEU 335 Ca -0.13 -0.33 -0.17 0.00 -0.22 0.00 0.00 54.13 53.28 3h4h s LEU 335 Cb 0.12 -0.42 -0.01 0.00 0.50 0.00 0.00 46.19 46.39 3h4h s LEU 335 CO 0.81 -0.25 1.18 0.00 -1.32 0.00 0.00 176.35 176.76 3h4h s ALA 336 N 1.99 2.40 -0.37 5.97 0.00 -1.26 -4.87 121.76 125.62 3h4h s ALA 336 Ca 0.03 0.84 -0.43 0.00 0.00 0.00 0.00 51.96 52.40 3h4h s ALA 336 Cb -0.14 -3.42 -0.18 0.00 0.00 0.00 0.00 23.12 19.38 3h4h s ALA 336 CO -0.06 -1.39 1.64 -2.30 0.00 0.00 0.00 175.76 173.65 3h4h n PRO 337 N -2.13 0.55 -3.66 0.00 -0.02 -1.26 -4.93 135.00 123.56 3h4h n PRO 337 Ca 0.13 0.20 -0.14 0.00 -2.02 0.00 0.00 63.50 61.67 3h4h n PRO 337 Cb 0.50 -1.79 -0.07 0.00 -0.02 0.00 0.00 33.50 32.13 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 3.08 -0.33 0.00 2.55 1.04 -1.26 -5.29 113.70 113.48 3h4h s SER 338 Ca 1.01 0.14 0.32 0.00 0.48 0.00 0.00 55.95 57.90 3h4h s SER 338 Cb -1.28 0.42 1.81 0.00 0.10 0.00 0.00 66.02 67.06 3h4h s SER 338 CO 0.73 -0.61 2.17 0.61 0.98 0.00 0.00 173.24 177.13