#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2h1h s ARG 2 N 0.00 3.03 -0.03 2.12 6.06 -1.26 -1.53 118.95 127.35 2h1h s ARG 2 Ca 0.00 -0.66 0.04 0.00 -2.50 0.00 0.00 55.73 52.61 2h1h s ARG 2 Cb 0.00 -2.56 -0.00 0.00 0.06 0.00 0.00 34.95 32.44 2h1h s ARG 2 CO 0.00 0.41 -0.13 0.08 -2.50 0.00 0.00 175.30 173.15 2h1h s VAL 3 N -0.15 1.12 -0.21 7.11 1.01 -0.52 -0.58 120.40 128.17 2h1h s VAL 3 Ca -0.00 -0.56 -0.11 0.00 0.00 0.00 0.00 61.98 61.31 2h1h s VAL 3 Cb -0.13 -0.96 -0.05 0.00 0.00 0.00 0.00 36.38 35.23 2h1h s VAL 3 CO 0.03 0.33 0.16 -0.22 0.00 0.00 0.00 175.10 175.40 2h1h s LEU 4 N -0.01 4.17 -0.20 3.92 2.96 0.27 -1.14 118.68 128.66 2h1h s LEU 4 Ca -0.01 0.21 -0.08 0.00 -0.22 0.00 0.00 54.13 54.04 2h1h s LEU 4 Cb -0.09 -2.13 -0.04 0.00 0.50 0.00 0.00 46.19 44.43 2h1h s LEU 4 CO 0.01 0.12 0.07 -0.63 -1.32 0.00 0.00 176.35 174.60 2h1h s ILE 5 N 0.68 4.76 -0.42 6.68 1.01 0.99 -0.18 121.20 134.72 2h1h s ILE 5 Ca 0.09 -0.04 -0.06 0.00 0.00 0.00 0.00 60.65 60.64 2h1h s ILE 5 Cb -0.12 -3.17 0.10 0.00 0.01 0.00 0.00 42.46 39.28 2h1h s ILE 5 CO 0.01 0.43 0.24 -0.69 0.00 0.00 0.00 174.94 174.93 2h1h s VAL 6 N 0.67 3.71 -0.40 2.92 1.01 -0.24 -0.49 120.40 127.58 2h1h s VAL 6 Ca 0.04 -1.80 0.06 0.00 0.00 0.00 0.00 61.98 60.28 2h1h s VAL 6 Cb -0.13 -3.43 0.17 0.00 0.00 0.00 0.00 36.38 32.99 2h1h s VAL 6 CO 0.02 -0.63 0.53 -0.75 0.00 0.00 0.00 175.10 174.26 2h1h s LYS 7 N 1.27 0.76 -0.24 2.72 2.47 -1.14 -1.61 119.74 123.97 2h1h s LYS 7 Ca 0.05 -0.53 -0.09 0.00 -1.56 0.00 0.00 55.97 53.84 2h1h s LYS 7 Cb -0.24 -0.23 -0.17 0.00 -1.46 0.00 0.00 37.83 35.73 2h1h s LYS 7 CO -0.02 -1.20 -0.12 0.25 0.16 0.00 0.00 175.35 174.43 2h1h n THR 8 N 4.30 1.56 -4.01 3.43 -2.24 -1.23 -4.47 114.28 111.61 2h1h n THR 8 Ca 0.11 -0.42 -0.33 0.00 -2.27 0.00 0.00 64.05 61.14 2h1h n THR 8 Cb 0.52 -1.75 -0.06 0.00 -2.10 0.00 0.00 70.33 66.95 2h1h n THR 8 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 2h1h s SER 9 N -7.03 6.00 0.00 3.42 0.01 -1.26 -2.30 113.70 112.54 2h1h s SER 9 Ca -0.34 0.24 0.00 0.00 1.31 0.00 0.00 55.95 57.16 2h1h s SER 9 Cb 0.10 -1.80 0.00 0.00 0.21 0.00 0.00 66.02 64.53 2h1h s SER 9 CO 0.58 0.27 0.00 -0.24 0.41 0.00 0.00 173.24 174.26 2h1h n SER 10 N 1.09 -1.60 -0.20 2.44 2.88 -1.26 -4.37 113.62 112.60 2h1h n SER 10 Ca -0.12 0.00 -0.01 0.00 -1.33 0.00 0.00 58.87 57.41 2h1h n SER 10 Cb 0.53 -0.71 0.09 0.00 -0.75 0.00 0.00 64.21 63.37 2h1h n SER 10 CO 0.00 0.00 0.00 -0.03 -1.23 0.00 0.00 175.04 173.78 2h1h h MET 11 N 0.00 0.45 -0.07 -1.46 1.85 -1.95 -1.60 114.93 112.15 2h1h h MET 11 Ca 0.00 -0.03 0.02 0.00 -0.61 0.00 0.00 59.70 59.08 2h1h h MET 11 Cb 0.00 -0.10 -0.02 0.00 0.43 0.00 0.00 31.60 31.91 2h1h h MET 11 CO 0.00 0.30 -0.04 0.78 -0.40 0.00 0.00 176.91 177.55 2h1h h GLY 12 N 0.46 0.02 1.06 1.39 0.00 -1.89 -1.72 103.07 102.39 2h1h h GLY 12 Ca 0.29 0.05 0.07 0.00 0.00 0.00 0.00 47.33 47.74 2h1h h GLY 12 CO -0.25 -0.05 0.45 -0.55 0.00 0.00 0.00 176.54 176.13 2h1h h ASP 13 N -0.04 0.58 -0.10 0.19 3.32 -1.59 -1.28 116.42 117.50 2h1h h ASP 13 Ca 0.04 0.01 -0.03 0.00 0.02 0.00 0.00 57.03 57.07 2h1h h ASP 13 Cb 0.10 -0.12 -0.00 0.00 0.22 0.00 0.00 39.33 39.53 2h1h h ASP 13 CO -0.09 0.37 -0.05 0.58 -1.72 0.00 0.00 179.24 178.33 2h1h h VAL 14 N 0.66 1.32 -0.77 -1.35 2.07 -0.85 -3.17 116.25 114.15 2h1h h VAL 14 Ca 0.30 -1.06 0.09 0.00 0.82 0.00 0.00 66.70 66.85 2h1h h VAL 14 Cb 0.32 1.81 -0.07 0.00 -1.52 0.00 0.00 31.29 31.83 2h1h h VAL 14 CO -0.10 0.30 0.43 -0.07 0.02 0.00 0.00 177.57 178.15 2h1h h LEU 15 N -0.14 0.60 -0.62 2.57 3.38 -0.62 -1.63 115.31 118.84 2h1h h LEU 15 Ca 0.02 0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.04 2h1h h LEU 15 Cb 0.50 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.18 2h1h h LEU 15 CO 0.01 0.35 0.00 1.41 0.09 0.00 0.00 178.44 180.31 2h1h n HIS 16 N -4.78 0.47 0.06 1.13 8.25 -0.55 -2.16 115.22 117.65 2h1h n HIS 16 Ca 0.12 0.21 -0.03 0.00 -0.26 0.00 0.00 57.72 57.76 2h1h n HIS 16 Cb 0.26 -0.84 -0.08 0.00 1.12 0.00 0.00 29.99 30.45 2h1h n HIS 16 CO 0.00 0.00 0.00 1.15 0.64 0.00 0.00 176.34 178.13 2h1h h THR 17 N 0.00 1.11 -0.81 1.59 2.02 -1.29 -3.38 112.91 112.14 2h1h h THR 17 Ca 0.00 -2.71 0.20 0.00 0.77 0.00 0.00 66.41 64.67 2h1h h THR 17 Cb 0.17 2.51 -0.14 0.00 -1.74 0.00 0.00 68.15 68.96 2h1h h THR 17 CO 0.00 0.63 0.11 -0.07 0.37 0.00 0.00 175.52 176.56 2h1h h LEU 18 N 0.00 -0.18 -1.64 2.58 3.38 -1.49 -1.22 115.31 116.73 2h1h h LEU 18 Ca -0.09 0.19 0.00 0.00 0.09 0.00 0.00 57.88 58.08 2h1h h LEU 18 Cb 1.68 0.31 -0.02 0.00 0.09 0.00 0.00 40.66 42.72 2h1h h LEU 18 CO 0.09 -0.16 0.22 -0.65 0.09 0.00 0.00 178.44 178.02 2h1h h PRO 19 N 0.16 0.45 -0.11 1.13 0.11 -1.75 -2.20 132.00 129.78 2h1h h PRO 19 Ca 0.47 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.56 2h1h h PRO 19 Cb 0.89 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 31.89 2h1h h PRO 19 CO -0.66 0.31 0.07 0.00 -0.21 0.00 0.00 178.00 177.52 2h1h h ALA 20 N 1.77 0.14 -0.90 -0.75 0.00 -1.48 -1.27 119.26 116.77 2h1h h ALA 20 Ca 0.12 -0.01 0.10 0.00 0.00 0.00 0.00 54.91 55.12 2h1h h ALA 20 Cb -0.04 -0.05 -0.07 0.00 0.00 0.00 0.00 17.79 17.64 2h1h h ALA 20 CO -0.03 -0.37 0.58 -0.07 0.00 0.00 0.00 179.25 179.37 2h1h h LEU 21 N 0.15 0.82 -0.57 0.00 4.07 -1.40 -0.92 115.31 117.46 2h1h h LEU 21 Ca 0.04 0.02 -0.08 0.00 0.08 0.00 0.00 57.88 57.94 2h1h h LEU 21 Cb -0.01 -0.15 -0.02 0.00 1.08 0.00 0.00 40.66 41.56 2h1h h LEU 21 CO -0.01 0.48 0.04 0.74 -1.08 0.00 0.00 178.44 178.62 2h1h h THR 22 N 0.91 1.26 -0.23 0.22 2.02 -0.92 0.60 112.91 116.78 2h1h h THR 22 Ca 0.42 -1.06 0.01 0.00 0.77 0.00 0.00 66.41 66.54 2h1h h THR 22 Cb 0.40 0.82 -0.01 0.00 -1.74 0.00 0.00 68.15 67.61 2h1h h THR 22 CO -0.18 0.38 0.14 0.44 0.37 0.00 0.00 175.52 176.67 2h1h h ASP 23 N 0.87 0.23 -0.93 4.18 3.32 -0.19 -2.62 116.42 121.28 2h1h h ASP 23 Ca 0.17 -0.00 0.02 0.00 0.02 0.00 0.00 57.03 57.24 2h1h h ASP 23 Cb 0.49 -0.05 -0.05 0.00 0.22 0.00 0.00 39.33 39.94 2h1h h ASP 23 CO 0.02 0.17 0.61 0.00 -1.72 0.00 0.00 179.24 178.32 2h1h h ALA 24 N 1.09 1.37 -0.34 3.45 0.00 -0.84 -1.99 119.26 122.01 2h1h h ALA 24 Ca 0.09 -0.05 -0.10 0.00 0.00 0.00 0.00 54.91 54.84 2h1h h ALA 24 Cb -0.02 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.41 2h1h h ALA 24 CO -0.03 0.56 -0.20 0.37 0.00 0.00 0.00 179.25 179.95 2h1h h GLN 25 N 1.21 0.63 -0.08 0.00 4.15 -0.61 0.83 115.11 121.24 2h1h h GLN 25 Ca 0.35 -0.23 -0.22 0.00 0.77 0.00 0.00 58.65 59.33 2h1h h GLN 25 Cb -0.07 -0.04 0.01 0.00 0.21 0.00 0.00 27.48 27.59 2h1h h GLN 25 CO -0.09 0.79 -0.83 1.96 -1.93 0.00 0.00 178.83 178.73 2h1h h GLN 26 N 0.56 0.59 0.08 1.69 4.20 -1.13 -3.12 115.11 117.99 2h1h h GLN 26 Ca 0.09 -0.52 -0.29 0.00 0.06 0.00 0.00 58.65 57.99 2h1h h GLN 26 Cb 0.65 0.12 0.03 0.00 0.30 0.00 0.00 27.48 28.58 2h1h h GLN 26 CO 0.05 1.15 -1.16 0.00 -0.67 0.00 0.00 178.83 178.19 2h1h h ALA 27 N 0.69 0.03 -3.11 3.87 0.00 -1.25 -3.40 119.26 116.09 2h1h h ALA 27 Ca -0.06 -0.74 -0.62 0.00 0.00 0.00 0.00 54.91 53.48 2h1h h ALA 27 Cb 1.44 0.10 -0.41 0.00 0.00 0.00 0.00 17.79 18.91 2h1h h ALA 27 CO 0.16 0.67 -0.63 0.42 0.00 0.00 0.00 179.25 179.87 2h1h s ILE 28 N -3.08 2.54 0.56 0.00 1.01 0.27 -5.10 121.20 117.40 2h1h s ILE 28 Ca -0.10 -3.79 -0.19 0.00 0.00 0.00 0.00 60.65 56.57 2h1h s ILE 28 Cb 0.06 -2.70 -0.07 0.00 0.01 0.00 0.00 42.46 39.76 2h1h s ILE 28 CO 0.93 -0.96 0.83 -2.65 0.00 0.00 0.00 174.94 173.09 2h1h n PRO 29 N 2.45 0.85 -0.42 2.79 -0.02 -1.18 -1.46 135.00 138.02 2h1h n PRO 29 Ca 0.15 0.32 0.00 0.00 -2.02 0.00 0.00 63.50 61.96 2h1h n PRO 29 Cb 0.35 -1.99 0.00 0.00 -0.02 0.00 0.00 33.50 31.84 2h1h n PRO 29 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2h1h n GLY 30 N 1.43 1.38 3.75 -1.23 0.00 -1.26 -4.89 105.19 104.38 2h1h n GLY 30 Ca 0.12 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.73 2h1h n GLY 30 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2h1h s ILE 31 N -2.71 2.57 0.00 -0.61 2.07 -0.53 -4.41 121.20 117.58 2h1h s ILE 31 Ca 0.00 0.50 0.07 0.00 -1.41 0.00 0.00 60.65 59.81 2h1h s ILE 31 Cb 0.00 -3.32 -0.02 0.00 0.13 0.00 0.00 42.46 39.25 2h1h s ILE 31 CO 0.00 0.09 -0.22 -0.54 -1.91 0.00 0.00 174.94 172.36 2h1h s LYS 32 N -0.84 1.69 -0.05 3.50 -0.14 -0.58 -4.89 119.74 118.43 2h1h s LYS 32 Ca 0.57 -0.85 0.05 0.00 -1.36 0.00 0.00 55.97 54.37 2h1h s LYS 32 Cb -0.42 -1.69 -0.02 0.00 -1.68 0.00 0.00 37.83 34.01 2h1h s LYS 32 CO 0.47 0.45 -0.19 -0.06 -0.76 0.00 0.00 175.35 175.27 2h1h s PHE 33 N -0.61 2.59 0.10 3.18 0.40 0.74 -1.43 117.98 122.95 2h1h s PHE 33 Ca 0.09 -0.37 0.05 0.00 -0.60 0.00 0.00 56.93 56.09 2h1h s PHE 33 Cb -0.09 -1.62 -0.04 0.00 0.51 0.00 0.00 43.02 41.78 2h1h s PHE 33 CO 0.00 0.02 0.02 -0.51 0.70 0.00 0.00 175.22 175.45 2h1h s ASP 34 N -0.49 5.07 -0.06 1.36 1.11 -0.29 0.10 116.67 123.48 2h1h s ASP 34 Ca 0.06 -0.18 -0.03 0.00 0.18 0.00 0.00 52.55 52.58 2h1h s ASP 34 Cb -0.12 -1.22 0.04 0.00 1.07 0.00 0.00 42.92 42.69 2h1h s ASP 34 CO 0.01 0.16 0.10 0.86 1.18 0.00 0.00 175.17 177.48 2h1h s TRP 35 N -1.39 -0.02 -0.30 4.23 -0.11 -0.05 -0.01 118.94 121.28 2h1h s TRP 35 Ca 0.27 0.36 -0.26 0.00 1.22 0.00 0.00 56.10 57.69 2h1h s TRP 35 Cb -0.11 -0.41 0.01 0.00 -1.50 0.00 0.00 33.47 31.45 2h1h s TRP 35 CO 0.19 -0.24 0.89 0.08 -4.62 0.00 0.00 176.95 173.26 2h1h s VAL 36 N 2.21 4.70 0.03 5.86 1.01 0.35 -0.54 120.40 134.02 2h1h s VAL 36 Ca 0.04 1.42 -0.01 0.00 0.00 0.00 0.00 61.98 63.43 2h1h s VAL 36 Cb -0.12 -4.24 -0.02 0.00 0.00 0.00 0.00 36.38 31.99 2h1h s VAL 36 CO -0.04 -0.31 -0.01 0.54 0.00 0.00 0.00 175.10 175.28 2h1h s VAL 37 N 3.18 0.14 0.48 2.92 0.11 -1.02 -2.88 120.40 123.33 2h1h s VAL 37 Ca 0.37 -1.16 -0.23 0.00 -2.93 0.00 0.00 61.98 58.03 2h1h s VAL 37 Cb -0.14 -0.67 -0.08 0.00 -1.53 0.00 0.00 36.38 33.96 2h1h s VAL 37 CO 0.13 -0.64 1.17 -0.62 -3.33 0.00 0.00 175.10 171.81 2h1h n GLU 38 N 1.10 1.57 -0.34 1.54 -0.58 -0.97 -0.90 120.64 122.06 2h1h n GLU 38 Ca -0.21 0.57 0.06 0.00 -0.42 0.00 0.00 57.16 57.16 2h1h n GLU 38 Cb 0.57 -2.30 0.22 0.00 -0.57 0.00 0.00 31.44 29.35 2h1h n GLU 38 CO 0.00 0.00 0.00 1.05 -0.48 0.00 0.00 177.13 177.70 2h1h h GLU 39 N 1.56 0.91 -0.24 3.49 4.11 -1.54 -1.98 114.58 120.90 2h1h h GLU 39 Ca -0.48 -0.05 0.07 0.00 0.07 0.00 0.00 59.36 58.97 2h1h h GLU 39 Cb 1.32 -0.21 -0.01 0.00 0.50 0.00 0.00 28.75 30.35 2h1h h GLU 39 CO 0.57 0.60 0.22 0.78 0.07 0.00 0.00 179.01 181.25 2h1h h GLY 40 N 0.94 0.00 -0.81 1.06 0.00 -1.89 -2.55 103.07 99.82 2h1h h GLY 40 Ca 0.47 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.80 2h1h h GLY 40 CO -0.26 0.00 0.00 0.69 0.00 0.00 0.00 176.54 176.97 2h1h n PHE 41 N -4.07 0.38 -0.01 5.60 3.72 -0.77 -4.75 117.46 117.56 2h1h n PHE 41 Ca 0.03 -0.67 0.21 0.00 -0.05 0.00 0.00 57.45 56.97 2h1h n PHE 41 Cb 0.36 -0.12 0.70 0.00 -0.94 0.00 0.00 39.48 39.48 2h1h n PHE 41 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2h1h h ALA 42 N 1.12 2.50 -0.57 4.37 0.00 -1.12 -2.51 119.26 123.05 2h1h h ALA 42 Ca 0.00 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 2h1h h ALA 42 Cb 0.88 0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.68 2h1h h ALA 42 CO 0.05 -0.68 0.34 1.96 0.00 0.00 0.00 179.25 180.92 2h1h h GLN 43 N 0.00 0.77 -0.43 0.00 4.20 -1.85 -3.34 115.11 114.46 2h1h h GLN 43 Ca 0.26 -0.07 0.05 0.00 0.06 0.00 0.00 58.65 58.95 2h1h h GLN 43 Cb 1.06 -0.16 -0.08 0.00 0.30 0.00 0.00 27.48 28.60 2h1h h GLN 43 CO -0.00 0.56 -0.53 0.82 -0.67 0.00 0.00 178.83 179.01 2h1h h ILE 44 N 0.76 0.00 -0.98 2.54 2.04 -1.84 -2.74 117.51 117.30 2h1h h ILE 44 Ca 0.20 0.00 0.21 0.00 1.00 0.00 0.00 64.86 66.27 2h1h h ILE 44 Cb -0.01 0.00 -0.09 0.00 -0.74 0.00 0.00 36.82 35.98 2h1h h ILE 44 CO -0.04 0.00 0.62 -0.65 0.00 0.00 0.00 178.15 178.08 2h1h h PRO 45 N -0.35 0.57 0.00 2.37 0.11 -1.76 -1.46 132.00 131.47 2h1h h PRO 45 Ca 0.07 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.15 2h1h h PRO 45 Cb 0.55 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 31.53 2h1h h PRO 45 CO -0.59 0.38 0.00 -1.13 -0.21 0.00 0.00 178.00 176.45 2h1h n SER 46 N -4.66 0.55 0.08 -2.05 3.41 -1.03 -1.90 113.62 108.02 2h1h n SER 46 Ca 0.22 0.69 0.12 0.00 -0.26 0.00 0.00 58.87 59.65 2h1h n SER 46 Cb 0.67 -0.79 0.46 0.00 -0.26 0.00 0.00 64.21 64.29 2h1h n SER 46 CO 0.00 0.00 0.00 0.79 -0.16 0.00 0.00 175.04 175.67 2h1h n TRP 47 N -2.18 0.60 -3.48 7.33 8.01 -0.55 -4.70 117.44 122.48 2h1h n TRP 47 Ca 0.00 0.20 -0.37 0.00 -1.31 0.00 0.00 57.50 56.02 2h1h n TRP 47 Cb 0.12 -0.83 -0.07 0.00 -2.01 0.00 0.00 31.31 28.53 2h1h n TRP 47 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 177.69 175.10 2h1h s HIS 48 N -3.14 3.52 0.64 -5.99 2.46 -0.80 -4.56 115.29 107.43 2h1h s HIS 48 Ca 0.09 0.74 0.36 0.00 0.47 0.00 0.00 55.06 56.72 2h1h s HIS 48 Cb 0.12 -2.38 2.00 0.00 -0.13 0.00 0.00 32.58 32.19 2h1h s HIS 48 CO 0.47 0.30 2.20 0.00 -2.47 0.00 0.00 174.74 175.24 2h1h h ALA 49 N 6.32 1.34 -0.01 1.58 0.00 -1.84 -2.14 119.26 124.51 2h1h h ALA 49 Ca -0.43 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.48 2h1h h ALA 49 Cb 1.18 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.97 2h1h h ALA 49 CO 0.73 -0.14 -0.34 0.00 0.00 0.00 0.00 179.25 179.49 2h1h n ALA 50 N -2.14 3.25 -2.15 0.00 0.00 -1.26 -4.89 120.51 113.32 2h1h n ALA 50 Ca -0.02 -0.45 -0.38 0.00 0.00 0.00 0.00 53.44 52.60 2h1h n ALA 50 Cb 0.20 -1.06 -0.06 0.00 0.00 0.00 0.00 19.45 18.53 2h1h n ALA 50 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2h1h s VAL 51 N -2.56 4.60 0.00 0.00 1.01 -0.81 -0.19 120.40 122.46 2h1h s VAL 51 Ca 0.22 1.35 0.00 0.00 0.00 0.00 0.00 61.98 63.55 2h1h s VAL 51 Cb 0.19 -3.95 0.00 0.00 0.00 0.00 0.00 36.38 32.62 2h1h s VAL 51 CO 0.56 0.45 0.00 -0.62 0.00 0.00 0.00 175.10 175.48 2h1h n GLU 52 N 1.39 0.00 -3.04 2.72 1.02 0.12 -4.88 120.64 117.97 2h1h n GLU 52 Ca -0.07 0.00 -0.41 0.00 -0.02 0.00 0.00 57.16 56.66 2h1h n GLU 52 Cb 0.50 0.00 -0.06 0.00 -0.02 0.00 0.00 31.44 31.87 2h1h n GLU 52 CO 0.00 0.00 0.00 0.50 1.18 0.00 0.00 177.13 178.81 2h1h s ARG 53 N 0.00 4.12 -0.16 3.49 6.06 -1.26 -4.97 118.95 126.24 2h1h s ARG 53 Ca 0.00 0.66 -0.14 0.00 -2.50 0.00 0.00 55.73 53.75 2h1h s ARG 53 Cb 0.00 -3.65 -0.05 0.00 0.06 0.00 0.00 34.95 31.31 2h1h s ARG 53 CO 0.00 -0.45 0.28 0.08 -2.50 0.00 0.00 175.30 172.71 2h1h s VAL 54 N 2.61 5.31 -0.51 7.11 1.01 -1.26 -0.87 120.40 133.80 2h1h s VAL 54 Ca 0.29 0.53 -0.03 0.00 0.00 0.00 0.00 61.98 62.77 2h1h s VAL 54 Cb -0.15 -3.62 0.13 0.00 0.00 0.00 0.00 36.38 32.74 2h1h s VAL 54 CO 0.08 0.39 0.31 -0.63 0.00 0.00 0.00 175.10 175.25 2h1h s ILE 55 N 0.49 3.47 0.31 2.22 1.01 0.30 -4.92 121.20 124.08 2h1h s ILE 55 Ca 0.16 -2.49 -0.30 0.00 0.00 0.00 0.00 60.65 58.02 2h1h s ILE 55 Cb -0.13 -3.32 -0.11 0.00 0.01 0.00 0.00 42.46 38.90 2h1h s ILE 55 CO 0.04 -0.78 1.58 -2.84 0.00 0.00 0.00 174.94 172.93 2h1h s PRO 56 N 0.56 4.11 0.16 2.79 0.02 -1.26 -2.42 135.00 138.96 2h1h s PRO 56 Ca 0.12 2.59 0.08 0.00 0.02 0.00 0.00 61.00 63.82 2h1h s PRO 56 Cb -0.22 -3.01 -0.04 0.00 0.02 0.00 0.00 34.50 31.25 2h1h s PRO 56 CO -0.04 -0.62 -0.18 0.54 -0.33 0.00 0.00 177.00 176.37 2h1h s VAL 57 N -0.25 1.79 -0.29 3.83 0.11 -0.08 -4.88 120.40 120.62 2h1h s VAL 57 Ca 0.61 -1.89 0.20 0.00 -2.93 0.00 0.00 61.98 57.97 2h1h s VAL 57 Cb -0.48 -1.81 0.49 0.00 -1.53 0.00 0.00 36.38 33.05 2h1h s VAL 57 CO 0.52 -0.31 1.05 0.00 -3.33 0.00 0.00 175.10 173.03 2h1h n ALA 58 N 0.35 3.07 -0.24 1.54 0.00 -1.26 -1.28 120.51 122.70 2h1h n ALA 58 Ca -0.14 -2.98 0.04 0.00 0.00 0.00 0.00 53.44 50.36 2h1h n ALA 58 Cb 0.57 -0.88 0.15 0.00 0.00 0.00 0.00 19.45 19.29 2h1h n ALA 58 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 2h1h h ILE 59 N 4.33 0.45 0.10 0.00 2.04 -1.98 -0.01 117.51 122.46 2h1h h ILE 59 Ca -0.09 -0.06 0.01 0.00 1.00 0.00 0.00 64.86 65.71 2h1h h ILE 59 Cb 1.23 0.27 -0.01 0.00 -0.74 0.00 0.00 36.82 37.57 2h1h h ILE 59 CO 0.35 0.03 -0.12 -0.09 0.00 0.00 0.00 178.15 178.32 2h1h h ARG 60 N 0.17 -0.25 -0.86 2.37 2.43 -2.02 -2.70 114.38 113.53 2h1h h ARG 60 Ca 0.38 0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.56 2h1h h ARG 60 Cb 0.65 0.06 -0.04 0.00 -0.42 0.00 0.00 29.97 30.22 2h1h h ARG 60 CO -0.56 -0.16 0.48 -0.09 -1.51 0.00 0.00 179.97 178.13 2h1h h ARG 61 N -0.25 1.18 0.00 0.20 2.43 -1.77 -2.91 114.38 113.26 2h1h h ARG 61 Ca 0.01 -0.13 -0.03 0.00 -0.81 0.00 0.00 59.98 59.02 2h1h h ARG 61 Cb 0.25 -0.24 -0.00 0.00 -0.42 0.00 0.00 29.97 29.56 2h1h h ARG 61 CO -0.04 0.85 -0.16 -1.49 -1.51 0.00 0.00 179.97 177.62 2h1h h TRP 62 N 1.19 0.00 0.00 2.20 6.55 -0.76 -2.92 115.95 122.21 2h1h h TRP 62 Ca 0.30 0.00 0.00 0.00 0.95 0.00 0.00 58.89 60.14 2h1h h TRP 62 Cb 0.01 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 28.31 2h1h h TRP 62 CO 0.01 0.16 0.00 0.54 -1.05 0.00 0.00 178.44 178.10 2h1h n ARG 63 N -3.94 0.00 0.00 0.49 5.12 -1.04 -0.18 116.66 117.11 2h1h n ARG 63 Ca -0.02 0.43 0.16 0.00 -1.93 0.00 0.00 57.85 56.49 2h1h n ARG 63 Cb 0.25 -1.50 0.92 0.00 -1.16 0.00 0.00 32.46 30.97 2h1h n ARG 63 CO 0.00 0.00 0.00 1.63 -1.93 0.00 0.00 177.63 177.33 2h1h n LYS 64 N -1.48 0.97 0.18 5.56 5.02 -1.10 -4.55 118.16 122.76 2h1h n LYS 64 Ca 0.01 -0.03 0.00 0.00 -2.02 0.00 0.00 58.31 56.26 2h1h n LYS 64 Cb 0.03 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.54 2h1h n LYS 64 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2h1h n ALA 65 N -0.99 0.50 0.00 7.82 0.00 -0.77 -5.04 120.51 122.03 2h1h n ALA 65 Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.67 2h1h n ALA 65 Cb 0.13 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.58 2h1h n ALA 65 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 177.50 179.37 2h1h n TRP 66 N -3.27 0.00 0.75 0.00 -0.00 0.75 -3.77 117.44 111.90 2h1h n TRP 66 Ca 0.00 0.00 0.09 0.00 -0.00 0.00 0.00 57.50 57.59 2h1h n TRP 66 Cb 0.00 0.00 0.06 0.00 -0.00 0.00 0.00 31.31 31.37 2h1h n TRP 66 CO 0.00 0.00 0.00 1.19 -0.00 0.00 0.00 177.69 178.88 2h1h n PHE 67 N 0.00 0.00 -0.65 5.87 3.01 -1.26 -3.58 117.46 120.84 2h1h n PHE 67 Ca 0.00 0.00 -0.30 0.00 1.01 0.00 0.00 57.45 58.16 2h1h n PHE 67 Cb 0.00 0.00 0.26 0.00 -0.01 0.00 0.00 39.48 39.73 2h1h n PHE 67 CO 0.00 0.00 0.00 -1.54 1.01 0.00 0.00 176.76 176.23 2h1h s SER 68 N -1.63 -0.06 -0.01 4.37 1.04 -1.25 -4.76 113.70 111.40 2h1h s SER 68 Ca 0.19 0.88 -0.23 0.00 0.48 0.00 0.00 55.95 57.27 2h1h s SER 68 Cb 0.15 -1.27 -0.16 0.00 0.10 0.00 0.00 66.02 64.84 2h1h s SER 68 CO 0.28 -4.75 1.09 0.00 0.98 0.00 0.00 173.24 170.84 2h1h h ALA 69 N -3.01 -0.40 0.90 5.32 0.00 -1.97 -2.41 119.26 117.69 2h1h h ALA 69 Ca -0.47 -0.19 -0.04 0.00 0.00 0.00 0.00 54.91 54.20 2h1h h ALA 69 Cb 1.33 0.16 0.01 0.00 0.00 0.00 0.00 17.79 19.28 2h1h h ALA 69 CO 0.34 -0.51 -0.43 -1.00 0.00 0.00 0.00 179.25 177.65 2h1h h PRO 70 N -0.84 -1.17 -0.95 0.00 0.13 -1.98 -1.16 132.00 126.04 2h1h h PRO 70 Ca -0.04 0.08 0.15 0.00 -0.87 0.00 0.00 66.00 65.32 2h1h h PRO 70 Cb 0.52 0.26 -0.10 0.00 0.13 0.00 0.00 31.00 31.82 2h1h h PRO 70 CO 0.07 -0.78 0.55 0.82 -0.23 0.00 0.00 178.00 178.43 2h1h h ILE 71 N -1.26 0.78 -0.24 -3.56 1.08 -1.89 0.39 117.51 112.81 2h1h h ILE 71 Ca -0.12 -0.27 -0.04 0.00 -0.39 0.00 0.00 64.86 64.04 2h1h h ILE 71 Cb 0.93 -0.07 -0.01 0.00 -3.07 0.00 0.00 36.82 34.59 2h1h h ILE 71 CO 0.20 0.14 -0.01 0.50 -0.69 0.00 0.00 178.15 178.29 2h1h h LYS 72 N 0.78 0.35 0.14 2.37 3.64 -1.36 -2.54 116.57 119.96 2h1h h LYS 72 Ca 0.51 -0.06 -0.29 0.00 -1.27 0.00 0.00 60.65 59.54 2h1h h LYS 72 Cb 0.68 -0.06 0.02 0.00 -0.41 0.00 0.00 32.23 32.46 2h1h h LYS 72 CO -0.34 0.40 -1.26 0.00 -2.27 0.00 0.00 179.45 175.98 2h1h h ALA 73 N 1.65 0.05 -0.55 5.00 0.00 0.96 -2.96 119.26 123.42 2h1h h ALA 73 Ca 0.08 -0.84 -0.04 0.00 0.00 0.00 0.00 54.91 54.11 2h1h h ALA 73 Cb 0.26 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 2h1h h ALA 73 CO 0.01 0.84 0.20 0.93 0.00 0.00 0.00 179.25 181.22 2h1h h GLU 74 N 0.15 0.84 -0.41 0.00 5.08 -0.69 -1.67 114.58 117.88 2h1h h GLU 74 Ca -0.17 -0.17 0.03 0.00 -1.00 0.00 0.00 59.36 58.06 2h1h h GLU 74 Cb 1.96 -0.13 -0.03 0.00 0.50 0.00 0.00 28.75 31.04 2h1h h GLU 74 CO 0.22 0.75 0.20 0.00 -1.00 0.00 0.00 179.01 179.19 2h1h h ARG 75 N 0.76 0.40 -0.39 2.33 3.08 -1.54 0.53 114.38 119.55 2h1h h ARG 75 Ca 0.18 -0.02 0.04 0.00 0.07 0.00 0.00 59.98 60.25 2h1h h ARG 75 Cb 0.24 -0.09 -0.04 0.00 0.08 0.00 0.00 29.97 30.16 2h1h h ARG 75 CO -0.01 0.26 0.15 -0.22 -1.07 0.00 0.00 179.97 179.08 2h1h h LYS 76 N 0.41 0.31 -0.43 0.04 1.63 -1.31 -0.52 116.57 116.70 2h1h h LYS 76 Ca 0.18 -0.02 -0.03 0.00 -0.85 0.00 0.00 60.65 59.93 2h1h h LYS 76 Cb 0.08 -0.07 -0.02 0.00 -0.60 0.00 0.00 32.23 31.63 2h1h h LYS 76 CO -0.12 0.20 0.17 0.00 -3.45 0.00 0.00 179.45 176.25 2h1h h ALA 77 N 1.24 0.56 -0.53 5.00 0.00 -0.39 -2.47 119.26 122.66 2h1h h ALA 77 Ca 0.18 -0.15 0.04 0.00 0.00 0.00 0.00 54.91 54.98 2h1h h ALA 77 Cb 0.15 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.73 2h1h h ALA 77 CO -0.17 0.16 0.29 0.35 0.00 0.00 0.00 179.25 179.88 2h1h h PHE 78 N 0.55 0.53 -0.66 0.00 3.57 0.45 -0.91 116.94 120.47 2h1h h PHE 78 Ca 0.14 0.02 0.02 0.00 3.53 0.00 0.00 57.97 61.69 2h1h h PHE 78 Cb 0.20 -0.16 -0.04 0.00 2.79 0.00 0.00 35.95 38.74 2h1h h PHE 78 CO 0.00 0.27 0.43 0.00 -2.23 0.00 0.00 178.31 176.79 2h1h h ARG 79 N 0.56 0.80 -0.32 1.11 3.08 -0.86 0.88 114.38 119.63 2h1h h ARG 79 Ca 0.23 -0.05 -0.16 0.00 0.07 0.00 0.00 59.98 60.07 2h1h h ARG 79 Cb 0.10 -0.18 -0.01 0.00 0.08 0.00 0.00 29.97 29.97 2h1h h ARG 79 CO -0.14 0.53 -0.44 0.93 -1.07 0.00 0.00 179.97 179.78 2h1h h GLU 80 N 0.82 0.82 -0.36 0.04 5.08 -0.93 -0.47 114.58 119.58 2h1h h GLU 80 Ca 0.25 -0.45 -0.14 0.00 -1.00 0.00 0.00 59.36 58.02 2h1h h GLU 80 Cb 0.01 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.27 2h1h h GLU 80 CO -0.07 1.09 -0.34 0.00 -1.00 0.00 0.00 179.01 178.69 2h1h h ALA 81 N 0.84 0.71 -0.33 3.43 0.00 0.13 -2.61 119.26 121.44 2h1h h ALA 81 Ca 0.04 -0.43 -0.03 0.00 0.00 0.00 0.00 54.91 54.49 2h1h h ALA 81 Cb 1.02 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.67 2h1h h ALA 81 CO 0.10 0.66 0.09 1.25 0.00 0.00 0.00 179.25 181.35 2h1h h LEU 82 N 0.68 0.48 -1.84 0.00 5.85 0.93 -3.03 115.31 118.38 2h1h h LEU 82 Ca 0.07 -0.22 0.00 0.00 0.84 0.00 0.00 57.88 58.57 2h1h h LEU 82 Cb 0.90 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 41.80 2h1h h LEU 82 CO 0.08 0.58 0.00 0.00 -0.34 0.00 0.00 178.44 178.76 2h1h n GLN 83 N -4.65 2.36 0.20 1.25 6.02 -0.20 -4.32 117.38 118.04 2h1h n GLN 83 Ca -0.02 -1.15 0.06 0.00 -0.01 0.00 0.00 57.00 55.88 2h1h n GLN 83 Cb 0.18 -1.72 0.43 0.00 1.02 0.00 0.00 30.24 30.14 2h1h n GLN 83 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2h1h h ALA 84 N 2.84 1.21 -2.23 -1.58 0.00 -1.34 -3.45 119.26 114.71 2h1h h ALA 84 Ca 0.00 -0.29 -0.42 0.00 0.00 0.00 0.00 54.91 54.20 2h1h h ALA 84 Cb 0.97 -0.05 -0.14 0.00 0.00 0.00 0.00 17.79 18.57 2h1h h ALA 84 CO 0.16 0.41 -0.73 0.15 0.00 0.00 0.00 179.25 179.24 2h1h s LYS 85 N -3.97 1.26 -0.45 0.00 1.02 -1.26 -5.11 119.74 111.23 2h1h s LYS 85 Ca -0.02 -1.55 -0.10 0.00 0.02 0.00 0.00 55.97 54.32 2h1h s LYS 85 Cb 0.13 -0.99 0.10 0.00 -0.52 0.00 0.00 37.83 36.55 2h1h s LYS 85 CO 0.68 0.16 0.31 -0.80 -0.92 0.00 0.00 175.35 174.78 2h1h s ASN 86 N -3.27 5.73 0.43 2.83 0.01 -1.26 -4.32 114.94 115.09 2h1h s ASN 86 Ca 0.21 -1.65 -0.17 0.00 -0.71 0.00 0.00 52.86 50.53 2h1h s ASN 86 Cb 0.00 -2.02 -0.09 0.00 0.41 0.00 0.00 41.25 39.55 2h1h s ASN 86 CO 0.05 -0.62 0.89 -0.31 -1.51 0.00 0.00 177.10 175.60 2h1h s TYR 87 N 1.43 3.38 -0.56 2.20 2.02 -0.78 -4.95 117.35 120.09 2h1h s TYR 87 Ca 0.04 1.42 0.26 0.00 -0.37 0.00 0.00 57.07 58.42 2h1h s TYR 87 Cb -0.25 -2.72 0.85 0.00 -0.40 0.00 0.00 41.96 39.45 2h1h s TYR 87 CO 0.01 -0.13 1.76 -0.44 -1.57 0.00 0.00 175.55 175.18 2h1h h ASP 88 N 1.64 0.00 -2.90 2.29 3.32 -1.16 -3.38 116.42 116.22 2h1h h ASP 88 Ca -0.48 0.00 0.08 0.00 0.02 0.00 0.00 57.03 56.65 2h1h h ASP 88 Cb 1.18 0.00 -0.26 0.00 0.22 0.00 0.00 39.33 40.47 2h1h h ASP 88 CO 0.62 0.00 0.40 0.00 -1.72 0.00 0.00 179.24 178.54 2h1h s ALA 89 N -3.22 -2.09 -0.22 3.45 0.00 -1.21 -4.49 121.76 113.97 2h1h s ALA 89 Ca 0.08 2.05 -0.04 0.00 0.00 0.00 0.00 51.96 54.05 2h1h s ALA 89 Cb 0.10 -1.55 -0.00 0.00 0.00 0.00 0.00 23.12 21.67 2h1h s ALA 89 CO 0.54 -0.29 -0.04 0.08 0.00 0.00 0.00 175.76 176.04 2h1h s VAL 90 N 0.79 3.31 -0.32 0.00 1.01 0.30 -0.57 120.40 124.92 2h1h s VAL 90 Ca -0.03 -0.57 -0.03 0.00 0.00 0.00 0.00 61.98 61.35 2h1h s VAL 90 Cb -0.04 -2.53 0.05 0.00 0.00 0.00 0.00 36.38 33.86 2h1h s VAL 90 CO -0.11 0.39 0.04 -0.63 0.00 0.00 0.00 175.10 174.79 2h1h s ILE 91 N 1.46 3.23 -0.58 2.22 1.01 0.75 0.82 121.20 130.11 2h1h s ILE 91 Ca 0.05 -1.34 -0.22 0.00 0.00 0.00 0.00 60.65 59.13 2h1h s ILE 91 Cb -0.15 -2.86 0.06 0.00 0.01 0.00 0.00 42.46 39.52 2h1h s ILE 91 CO -0.04 -0.15 0.87 -0.62 0.00 0.00 0.00 174.94 175.00 2h1h s ASP 92 N 1.32 6.26 0.00 3.58 -1.08 0.12 -1.08 116.67 125.79 2h1h s ASP 92 Ca -0.04 -0.70 0.21 0.00 -0.52 0.00 0.00 52.55 51.50 2h1h s ASP 92 Cb -0.20 -2.40 0.53 0.00 -1.46 0.00 0.00 42.92 39.39 2h1h s ASP 92 CO -0.00 -1.22 1.45 0.00 0.52 0.00 0.00 175.17 175.92 2h1h n ALA 93 N 7.22 2.43 -0.08 3.66 0.00 -0.63 -4.29 120.51 128.82 2h1h n ALA 93 Ca -0.02 -0.93 -0.23 0.00 0.00 0.00 0.00 53.44 52.26 2h1h n ALA 93 Cb 0.46 -0.94 -0.12 0.00 0.00 0.00 0.00 19.45 18.85 2h1h n ALA 93 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 2h1h n GLN 94 N 1.21 0.65 -2.81 0.00 7.27 -1.20 -4.97 117.38 117.53 2h1h n GLN 94 Ca 0.19 0.33 -0.17 0.00 0.07 0.00 0.00 57.00 57.42 2h1h n GLN 94 Cb 0.52 -1.64 0.03 0.00 2.41 0.00 0.00 30.24 31.56 2h1h n GLN 94 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 2h1h n GLY 95 N 1.74 -0.26 3.46 1.69 0.00 -1.26 -4.55 105.19 106.00 2h1h n GLY 95 Ca -0.39 -0.08 -0.32 0.00 0.00 0.00 0.00 46.02 45.23 2h1h n GLY 95 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2h1h s LEU 96 N -5.28 2.64 0.18 0.99 1.43 -1.26 -1.70 118.68 115.68 2h1h s LEU 96 Ca 0.22 -0.33 -0.13 0.00 -1.03 0.00 0.00 54.13 52.86 2h1h s LEU 96 Cb -0.10 -1.54 0.15 0.00 0.03 0.00 0.00 46.19 44.74 2h1h s LEU 96 CO 0.27 0.30 1.77 0.58 0.23 0.00 0.00 176.35 179.50 2h1h h VAL 97 N 4.12 0.91 0.19 -1.59 2.07 -1.94 -0.52 116.25 119.50 2h1h h VAL 97 Ca -0.47 -0.15 0.01 0.00 0.82 0.00 0.00 66.70 66.91 2h1h h VAL 97 Cb 1.15 0.42 -0.04 0.00 -1.52 0.00 0.00 31.29 31.30 2h1h h VAL 97 CO 0.49 0.08 -0.42 0.50 0.02 0.00 0.00 177.57 178.24 2h1h h LYS 98 N 0.45 -0.68 0.00 1.57 3.64 -1.99 0.53 116.57 120.09 2h1h h LYS 98 Ca 0.23 0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.66 2h1h h LYS 98 Cb 0.18 0.15 0.00 0.00 -0.41 0.00 0.00 32.23 32.16 2h1h h LYS 98 CO -0.19 -0.45 0.00 0.66 -2.27 0.00 0.00 179.45 177.20 2h1h h SER 99 N -0.71 0.00 0.02 4.20 4.64 -1.95 -0.07 113.55 119.68 2h1h h SER 99 Ca 0.01 0.00 -0.27 0.00 -0.47 0.00 0.00 61.79 61.05 2h1h h SER 99 Cb 0.70 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.81 2h1h h SER 99 CO -0.20 0.00 -1.07 0.00 -0.87 0.00 0.00 176.83 174.69 2h1h h ALA 100 N 2.02 0.12 0.18 5.18 0.00 -0.60 -0.84 119.26 125.31 2h1h h ALA 100 Ca 0.00 -0.71 -0.30 0.00 0.00 0.00 0.00 54.91 53.90 2h1h h ALA 100 Cb 0.72 0.06 0.02 0.00 0.00 0.00 0.00 17.79 18.59 2h1h h ALA 100 CO 0.00 0.69 -1.37 0.00 0.00 0.00 0.00 179.25 178.57 2h1h h ALA 101 N 0.39 0.02 0.00 0.00 0.00 -0.81 -0.48 119.26 118.37 2h1h h ALA 101 Ca -0.14 -0.90 0.00 0.00 0.00 0.00 0.00 54.91 53.87 2h1h h ALA 101 Cb 1.72 0.11 0.00 0.00 0.00 0.00 0.00 17.79 19.62 2h1h h ALA 101 CO 0.21 0.89 -0.63 -0.07 0.00 0.00 0.00 179.25 179.65 2h1h h LEU 102 N 0.10 0.00 0.00 0.00 3.38 -1.11 -3.42 115.31 114.25 2h1h h LEU 102 Ca -0.19 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.74 2h1h h LEU 102 Cb 2.05 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.80 2h1h h LEU 102 CO 0.23 0.02 0.00 0.52 0.09 0.00 0.00 178.44 179.29 2h1h n VAL 103 N -2.69 0.00 -0.23 1.22 0.31 -0.34 -4.76 118.33 111.83 2h1h n VAL 103 Ca 0.02 0.00 0.19 0.00 -0.01 0.00 0.00 64.34 64.54 2h1h n VAL 103 Cb 0.52 -0.45 0.52 0.00 -0.91 0.00 0.00 33.84 33.53 2h1h n VAL 103 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2h1h h THR 104 N 0.00 0.68 0.00 2.52 1.03 -1.54 0.88 112.91 116.47 2h1h h THR 104 Ca 0.00 -0.13 -0.02 0.00 -0.01 0.00 0.00 66.41 66.25 2h1h h THR 104 Cb 0.00 0.26 -0.00 0.00 -1.07 0.00 0.00 68.15 67.34 2h1h h THR 104 CO 0.00 0.07 -0.11 -0.09 -0.01 0.00 0.00 175.52 175.37 2h1h h ARG 105 N 0.38 0.00 0.00 0.00 2.43 -1.33 -2.95 114.38 112.91 2h1h h ARG 105 Ca 0.46 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.63 2h1h h ARG 105 Cb 1.19 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.74 2h1h h ARG 105 CO -0.17 0.11 -1.21 1.28 -1.51 0.00 0.00 179.97 178.48 2h1h n LEU 106 N -3.45 0.62 -4.79 3.80 4.32 0.27 -4.97 117.00 112.80 2h1h n LEU 106 Ca -0.01 -0.20 -0.32 0.00 -0.02 0.00 0.00 56.01 55.46 2h1h n LEU 106 Cb 0.27 -0.04 0.06 0.00 -1.62 0.00 0.00 43.42 42.09 2h1h n LEU 106 CO 0.29 0.12 0.71 0.00 -1.22 0.00 0.00 177.39 177.29 2h1h s ALA 107 N -3.18 2.48 -0.22 -1.18 0.00 -0.98 -4.75 121.76 113.92 2h1h s ALA 107 Ca 0.03 0.28 -0.15 0.00 0.00 0.00 0.00 51.96 52.12 2h1h s ALA 107 Cb 0.15 -3.25 -0.04 0.00 0.00 0.00 0.00 23.12 19.98 2h1h s ALA 107 CO 0.85 -1.40 0.35 -1.01 0.00 0.00 0.00 175.76 174.55 2h1h s HIS 108 N -2.79 3.34 0.00 0.00 3.76 -1.26 -4.97 115.29 113.36 2h1h s HIS 108 Ca 0.62 0.51 0.00 0.00 -0.15 0.00 0.00 55.06 56.03 2h1h s HIS 108 Cb -0.17 -2.49 0.00 0.00 1.11 0.00 0.00 32.58 31.03 2h1h s HIS 108 CO 0.51 -0.04 0.00 0.41 -0.85 0.00 0.00 174.74 174.77 2h1h n GLY 109 N 4.14 3.47 3.64 -2.22 0.00 -1.26 -1.87 105.19 111.09 2h1h n GLY 109 Ca -0.09 -1.77 -0.42 0.00 0.00 0.00 0.00 46.02 43.73 2h1h n GLY 109 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2h1h s VAL 110 N -2.15 3.39 -0.16 1.61 1.01 -1.26 -4.70 120.40 118.14 2h1h s VAL 110 Ca 0.00 0.46 -0.24 0.00 0.00 0.00 0.00 61.98 62.19 2h1h s VAL 110 Cb 0.00 -3.36 -0.02 0.00 0.00 0.00 0.00 36.38 33.00 2h1h s VAL 110 CO 0.00 -0.12 0.79 -0.54 0.00 0.00 0.00 175.10 175.23 2h1h s LYS 111 N 4.71 4.30 -0.06 2.72 1.02 -1.26 -0.54 119.74 130.63 2h1h s LYS 111 Ca 0.81 0.94 0.03 0.00 0.02 0.00 0.00 55.97 57.77 2h1h s LYS 111 Cb -0.33 -3.56 -0.03 0.00 -0.52 0.00 0.00 37.83 33.40 2h1h s LYS 111 CO 0.33 -0.27 -0.13 -1.01 -0.92 0.00 0.00 175.35 173.35 2h1h s HIS 112 N 1.96 2.74 0.20 3.18 3.76 0.24 -0.63 115.29 126.75 2h1h s HIS 112 Ca 0.37 -0.19 -0.22 0.00 -0.15 0.00 0.00 55.06 54.87 2h1h s HIS 112 Cb -0.17 -1.66 0.07 0.00 1.11 0.00 0.00 32.58 31.93 2h1h s HIS 112 CO 0.13 0.16 0.98 0.20 -0.85 0.00 0.00 174.74 175.36 2h1h s GLY 113 N -0.62 0.03 0.46 -2.22 0.00 -0.92 0.13 107.32 104.18 2h1h s GLY 113 Ca 0.09 -0.24 -0.20 0.00 0.00 0.00 0.00 44.72 44.37 2h1h s GLY 113 CO 0.01 1.30 0.98 1.06 0.00 0.00 0.00 173.10 176.45 2h1h s MET 114 N -2.55 4.04 1.09 2.90 -1.94 -1.26 -0.80 119.30 120.79 2h1h s MET 114 Ca 0.18 1.18 -0.18 0.00 -1.71 0.00 0.00 55.69 55.15 2h1h s MET 114 Cb -0.03 -2.15 0.26 0.00 2.01 0.00 0.00 34.83 34.93 2h1h s MET 114 CO 0.05 -0.20 1.25 0.16 -0.01 0.00 0.00 175.02 176.27 2h1h s ASP 115 N -2.24 1.93 0.25 3.03 1.47 0.06 -4.33 116.67 116.83 2h1h s ASP 115 Ca 0.63 0.32 -0.03 0.00 1.18 0.00 0.00 52.55 54.65 2h1h s ASP 115 Cb -0.11 -0.36 0.44 0.00 -0.34 0.00 0.00 42.92 42.54 2h1h s ASP 115 CO 0.18 -3.47 1.79 -0.25 0.68 0.00 0.00 175.17 174.09 2h1h h TRP 116 N -2.15 0.80 0.00 2.11 2.91 -1.91 -0.59 115.95 117.12 2h1h h TRP 116 Ca -0.44 0.03 -0.02 0.00 1.13 0.00 0.00 58.89 59.59 2h1h h TRP 116 Cb 1.24 -0.24 -0.00 0.00 -0.51 0.00 0.00 29.16 29.65 2h1h h TRP 116 CO -1.92 0.28 -0.11 1.96 -1.03 0.00 0.00 178.44 177.62 2h1h h GLN 117 N 0.72 0.00 0.00 2.65 7.50 -1.92 -3.37 115.11 120.69 2h1h h GLN 117 Ca 0.41 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.56 2h1h h GLN 117 Cb 0.46 0.00 0.00 0.00 0.05 0.00 0.00 27.48 27.99 2h1h h GLN 117 CO -0.29 0.11 -0.74 0.25 -1.50 0.00 0.00 178.83 176.66 2h1h n THR 118 N -3.22 0.00 -1.84 -0.54 -2.24 -0.88 -4.96 114.28 100.60 2h1h n THR 118 Ca 0.01 -0.19 -0.38 0.00 -2.27 0.00 0.00 64.05 61.22 2h1h n THR 118 Cb 0.39 0.65 0.04 0.00 -2.10 0.00 0.00 70.33 69.31 2h1h n THR 118 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2h1h s ALA 119 N -1.80 2.72 0.41 6.98 0.00 -0.28 -4.88 121.76 124.90 2h1h s ALA 119 Ca -0.00 1.25 0.08 0.00 0.00 0.00 0.00 51.96 53.29 2h1h s ALA 119 Cb 0.01 -3.54 0.88 0.00 0.00 0.00 0.00 23.12 20.48 2h1h s ALA 119 CO 0.09 -1.34 2.03 -0.09 0.00 0.00 0.00 175.76 176.45 2h1h h ARG 120 N 1.27 0.53 -3.71 0.00 2.43 -1.79 -3.29 114.38 109.82 2h1h h ARG 120 Ca -0.51 -0.03 -0.61 0.00 -0.81 0.00 0.00 59.98 58.02 2h1h h ARG 120 Cb 1.30 -0.12 -0.40 0.00 -0.42 0.00 0.00 29.97 30.33 2h1h h ARG 120 CO 0.56 0.35 -0.74 -1.21 -1.51 0.00 0.00 179.97 177.43 2h1h s GLU 121 N -5.49 1.02 0.24 0.20 2.02 -0.69 -5.04 118.70 110.96 2h1h s GLU 121 Ca -0.08 -1.46 0.05 0.00 0.02 0.00 0.00 54.97 53.50 2h1h s GLU 121 Cb 0.18 -2.36 0.67 0.00 0.10 0.00 0.00 34.13 32.72 2h1h s GLU 121 CO 0.74 -1.01 1.17 -2.30 0.02 0.00 0.00 175.26 173.88 2h1h n PRO 122 N 4.44 -0.06 0.28 0.39 -0.02 -1.24 -0.58 135.00 138.21 2h1h n PRO 122 Ca 0.01 1.09 0.16 0.00 -2.02 0.00 0.00 63.50 62.75 2h1h n PRO 122 Cb 0.40 -1.78 0.91 0.00 -0.02 0.00 0.00 33.50 33.01 2h1h n PRO 122 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 2h1h h LEU 123 N 0.00 0.00 -2.30 2.45 3.38 -1.94 -1.71 115.31 115.19 2h1h h LEU 123 Ca 0.49 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.45 2h1h h LEU 123 Cb 1.10 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.85 2h1h h LEU 123 CO -0.67 0.00 -0.04 0.00 0.09 0.00 0.00 178.44 177.82 2h1h h ALA 124 N 1.93 1.43 0.00 1.53 0.00 -1.13 -1.71 119.26 121.30 2h1h h ALA 124 Ca 0.02 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 2h1h h ALA 124 Cb 0.13 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.92 2h1h h ALA 124 CO -0.00 0.05 -0.05 0.66 0.00 0.00 0.00 179.25 179.91 2h1h h SER 125 N 0.00 0.00 0.52 0.00 4.64 -1.49 -2.00 113.55 115.23 2h1h h SER 125 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2h1h h SER 125 Cb 0.11 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.20 2h1h h SER 125 CO 0.01 0.05 0.00 0.18 -0.87 0.00 0.00 176.83 176.20 2h1h n LEU 126 N -3.32 0.28 -0.89 5.97 4.77 -0.64 -2.41 117.00 120.76 2h1h n LEU 126 Ca -0.01 0.58 0.12 0.00 -0.03 0.00 0.00 56.01 56.67 2h1h n LEU 126 Cb 0.22 -0.55 0.21 0.00 -2.33 0.00 0.00 43.42 40.97 2h1h n LEU 126 CO 0.27 -0.43 0.69 0.49 -1.33 0.00 0.00 177.39 177.08 2h1h n PHE 127 N -1.82 0.11 -4.06 -1.77 3.01 -0.75 -4.98 117.46 107.20 2h1h n PHE 127 Ca 0.02 -0.05 -0.25 0.00 1.01 0.00 0.00 57.45 58.18 2h1h n PHE 127 Cb 0.17 0.00 -0.04 0.00 -0.01 0.00 0.00 39.48 39.60 2h1h n PHE 127 CO 0.00 0.00 0.00 0.71 1.01 0.00 0.00 176.76 178.48 2h1h s TYR 128 N -1.89 3.22 -0.13 1.38 2.02 -1.01 -4.70 117.35 116.24 2h1h s TYR 128 Ca 0.32 -0.02 -0.13 0.00 -0.37 0.00 0.00 57.07 56.87 2h1h s TYR 128 Cb 0.21 -1.51 -0.25 0.00 -0.40 0.00 0.00 41.96 40.00 2h1h s TYR 128 CO 0.31 0.51 0.41 -0.91 -1.57 0.00 0.00 175.55 174.30 2h1h h ASN 129 N 2.02 0.33 -3.65 2.29 2.35 -1.20 -3.44 115.58 114.28 2h1h h ASN 129 Ca -0.48 -0.83 -0.68 0.00 -0.55 0.00 0.00 56.30 53.75 2h1h h ASN 129 Cb 1.21 -0.11 -0.30 0.00 0.05 0.00 0.00 38.32 39.18 2h1h h ASN 129 CO 0.63 1.71 -0.66 -0.13 -1.65 0.00 0.00 177.43 177.33 2h1h s ARG 130 N -2.50 2.73 -0.13 0.81 1.81 -0.06 -5.01 118.95 116.60 2h1h s ARG 130 Ca -0.23 -1.08 -0.13 0.00 -1.72 0.00 0.00 55.73 52.57 2h1h s ARG 130 Cb 0.06 -3.28 -0.05 0.00 -0.45 0.00 0.00 34.95 31.23 2h1h s ARG 130 CO 0.74 -0.55 0.29 0.15 -0.68 0.00 0.00 175.30 175.25 2h1h s LYS 131 N 1.37 4.11 -0.01 3.54 3.01 -1.26 -2.17 119.74 128.34 2h1h s LYS 131 Ca -0.01 0.12 0.08 0.00 -1.01 0.00 0.00 55.97 55.15 2h1h s LYS 131 Cb -0.18 -3.37 -0.02 0.00 -1.01 0.00 0.00 37.83 33.25 2h1h s LYS 131 CO 0.00 0.37 -0.26 -1.01 0.51 0.00 0.00 175.35 174.97 2h1h s HIS 132 N 0.07 2.29 -0.47 3.18 3.76 0.02 -4.78 115.29 119.35 2h1h s HIS 132 Ca 0.17 -0.43 -0.21 0.00 -0.15 0.00 0.00 55.06 54.45 2h1h s HIS 132 Cb -0.13 -1.45 0.04 0.00 1.11 0.00 0.00 32.58 32.14 2h1h s HIS 132 CO 0.05 -0.01 0.67 -1.58 -0.85 0.00 0.00 174.74 173.02 2h1h s HIS 133 N -0.64 3.03 -0.34 1.40 2.46 -1.26 -0.76 115.29 119.19 2h1h s HIS 133 Ca 0.10 -0.21 -0.02 0.00 0.47 0.00 0.00 55.06 55.40 2h1h s HIS 133 Cb -0.10 -3.47 0.07 0.00 -0.13 0.00 0.00 32.58 28.95 2h1h s HIS 133 CO -0.00 -0.97 0.07 0.42 -2.47 0.00 0.00 174.74 171.78 2h1h s ILE 134 N 2.87 3.06 0.13 0.89 -1.09 -1.26 -5.04 121.20 120.75 2h1h s ILE 134 Ca 0.21 -1.64 -0.34 0.00 -2.23 0.00 0.00 60.65 56.65 2h1h s ILE 134 Cb -0.16 -2.89 -0.17 0.00 -1.58 0.00 0.00 42.46 37.67 2h1h s ILE 134 CO 0.17 -0.31 1.12 0.00 -1.23 0.00 0.00 174.94 174.68 2h1h n ALA 135 N 4.60 -1.55 -0.02 9.38 0.00 -1.26 -4.75 120.51 126.92 2h1h n ALA 135 Ca -0.09 0.50 -0.09 0.00 0.00 0.00 0.00 53.44 53.76 2h1h n ALA 135 Cb 0.43 -1.95 0.07 0.00 0.00 0.00 0.00 19.45 18.00 2h1h n ALA 135 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 2h1h h LYS 136 N 3.30 0.61 -2.40 0.00 1.57 -1.93 -3.37 116.57 114.35 2h1h h LYS 136 Ca -0.44 -0.34 -0.39 0.00 -1.87 0.00 0.00 60.65 57.61 2h1h h LYS 136 Cb 1.37 0.02 -0.03 0.00 0.08 0.00 0.00 32.23 33.67 2h1h h LYS 136 CO 0.69 0.95 1.35 0.94 -0.57 0.00 0.00 179.45 182.81 2h1h n GLN 137 N -4.00 2.71 -4.17 3.15 7.27 -1.26 -4.80 117.38 116.28 2h1h n GLN 137 Ca -0.02 -1.52 -0.10 0.00 0.07 0.00 0.00 57.00 55.42 2h1h n GLN 137 Cb 0.56 -2.33 -0.10 0.00 2.41 0.00 0.00 30.24 30.78 2h1h n GLN 137 CO 0.00 0.00 0.00 -0.65 0.07 0.00 0.00 177.06 176.48 2h1h s GLN 138 N 1.40 0.90 0.48 3.69 -0.21 -1.26 -5.12 119.66 119.54 2h1h s GLN 138 Ca 0.68 -1.40 -0.23 0.00 0.02 0.00 0.00 55.36 54.42 2h1h s GLN 138 Cb 0.26 -0.01 -0.07 0.00 1.00 0.00 0.00 33.01 34.20 2h1h s GLN 138 CO -0.03 -0.14 1.24 -1.58 -2.12 0.00 0.00 175.29 172.66 2h1h s HIS 139 N -3.82 2.70 0.31 0.91 5.65 -1.26 -4.76 115.29 115.02 2h1h s HIS 139 Ca 0.18 1.47 0.04 0.00 0.25 0.00 0.00 55.06 57.01 2h1h s HIS 139 Cb 0.07 -3.54 0.81 0.00 -1.18 0.00 0.00 32.58 28.73 2h1h s HIS 139 CO -0.01 -1.99 1.60 0.00 -0.65 0.00 0.00 174.74 173.69 2h1h h ALA 140 N 1.98 1.33 -0.55 1.58 0.00 -1.96 0.17 119.26 121.82 2h1h h ALA 140 Ca -0.50 0.29 0.05 0.00 0.00 0.00 0.00 54.91 54.76 2h1h h ALA 140 Cb 1.26 0.46 -0.05 0.00 0.00 0.00 0.00 17.79 19.47 2h1h h ALA 140 CO 0.60 -0.59 0.27 0.28 0.00 0.00 0.00 179.25 179.81 2h1h h VAL 141 N 0.07 0.93 -0.29 0.00 2.07 -1.90 -1.53 116.25 115.61 2h1h h VAL 141 Ca 0.61 -0.18 -0.16 0.00 0.82 0.00 0.00 66.70 67.80 2h1h h VAL 141 Cb 1.32 0.37 -0.01 0.00 -1.52 0.00 0.00 31.29 31.45 2h1h h VAL 141 CO -0.81 0.09 -0.45 -0.33 0.02 0.00 0.00 177.57 176.09 2h1h h GLU 142 N 0.52 0.74 -0.62 1.57 4.39 -1.04 -2.30 114.58 117.84 2h1h h GLU 142 Ca 0.25 -0.42 -0.01 0.00 0.34 0.00 0.00 59.36 59.52 2h1h h GLU 142 Cb 0.17 0.03 -0.03 0.00 -0.10 0.00 0.00 28.75 28.82 2h1h h GLU 142 CO -0.18 1.04 0.33 0.00 -1.16 0.00 0.00 179.01 179.04 2h1h h ARG 143 N 0.59 0.87 -0.56 2.33 3.08 -0.93 -1.60 114.38 118.16 2h1h h ARG 143 Ca 0.04 -0.11 -0.09 0.00 0.07 0.00 0.00 59.98 59.89 2h1h h ARG 143 Cb 1.01 -0.17 -0.02 0.00 0.08 0.00 0.00 29.97 30.88 2h1h h ARG 143 CO 0.10 0.67 -0.01 1.15 -1.07 0.00 0.00 179.97 180.81 2h1h h THR 144 N 0.84 1.26 -0.72 2.04 2.02 -1.23 -0.95 112.91 116.18 2h1h h THR 144 Ca 0.22 -1.12 -0.07 0.00 0.77 0.00 0.00 66.41 66.21 2h1h h THR 144 Cb 0.06 0.83 -0.03 0.00 -1.74 0.00 0.00 68.15 67.27 2h1h h THR 144 CO -0.03 0.40 0.18 0.03 0.37 0.00 0.00 175.52 176.46 2h1h h ARG 145 N 0.90 1.15 -0.48 6.66 3.08 -1.08 -0.77 114.38 123.83 2h1h h ARG 145 Ca 0.16 -0.28 -0.05 0.00 0.07 0.00 0.00 59.98 59.89 2h1h h ARG 145 Cb 0.53 -0.15 -0.02 0.00 0.08 0.00 0.00 29.97 30.41 2h1h h ARG 145 CO 0.03 1.01 0.12 1.49 -1.07 0.00 0.00 179.97 181.55 2h1h h GLU 146 N 1.09 0.77 -0.66 0.04 4.81 -1.08 -0.09 114.58 119.46 2h1h h GLU 146 Ca 0.23 -0.18 0.02 0.00 -0.13 0.00 0.00 59.36 59.29 2h1h h GLU 146 Cb 0.38 -0.10 -0.04 0.00 0.63 0.00 0.00 28.75 29.62 2h1h h GLU 146 CO 0.00 0.75 0.41 1.25 -0.73 0.00 0.00 179.01 180.70 2h1h h LEU 147 N 0.65 0.69 -0.27 1.64 5.85 -0.79 -0.02 115.31 123.06 2h1h h LEU 147 Ca 0.15 -0.00 -0.05 0.00 0.84 0.00 0.00 57.88 58.82 2h1h h LEU 147 Cb 0.33 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.19 2h1h h LEU 147 CO 0.00 0.48 -0.01 -0.26 -0.34 0.00 0.00 178.44 178.31 2h1h h PHE 148 N 0.82 0.53 0.13 1.25 -1.00 -0.79 -0.08 116.94 117.80 2h1h h PHE 148 Ca 0.26 -0.10 0.00 0.00 2.81 0.00 0.00 57.97 60.94 2h1h h PHE 148 Cb -0.01 -0.14 -0.01 0.00 3.61 0.00 0.00 35.95 39.41 2h1h h PHE 148 CO -0.04 0.65 -0.10 0.00 -1.61 0.00 0.00 178.31 177.20 2h1h h ALA 149 N 0.81 -0.22 0.00 2.45 0.00 -0.76 0.12 119.26 121.65 2h1h h ALA 149 Ca 0.07 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.90 2h1h h ALA 149 Cb 0.44 0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 2h1h h ALA 149 CO 0.02 -0.64 -0.22 0.87 0.00 0.00 0.00 179.25 179.28 2h1h h LYS 150 N -0.24 0.00 0.03 0.00 1.57 -0.97 -0.47 116.57 116.48 2h1h h LYS 150 Ca -0.00 0.00 -0.23 0.00 -1.87 0.00 0.00 60.65 58.55 2h1h h LYS 150 Cb 0.22 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.51 2h1h h LYS 150 CO -0.01 0.22 -1.07 0.77 -0.57 0.00 0.00 179.45 178.78 2h1h h SER 151 N 0.00 0.08 -0.10 0.86 0.02 -0.58 -3.35 113.55 110.48 2h1h h SER 151 Ca -0.00 -0.09 0.00 0.00 -0.84 0.00 0.00 61.79 60.86 2h1h h SER 151 Cb 0.39 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 62.90 2h1h h SER 151 CO 0.03 1.07 0.00 0.18 -1.14 0.00 0.00 176.83 176.97 2h1h n LEU 152 N -3.38 2.75 -1.36 5.07 4.77 0.37 -5.01 117.00 120.20 2h1h n LEU 152 Ca -0.02 -1.13 -0.06 0.00 -0.03 0.00 0.00 56.01 54.77 2h1h n LEU 152 Cb 0.96 -0.05 0.02 0.00 -2.33 0.00 0.00 43.42 42.02 2h1h n LEU 152 CO 0.48 0.51 0.06 0.61 -1.33 0.00 0.00 177.39 177.72 2h1h n GLY 153 N 1.12 0.51 3.09 -0.72 0.00 -0.24 -5.04 105.19 103.91 2h1h n GLY 153 Ca 0.12 -0.42 -0.08 0.00 0.00 0.00 0.00 46.02 45.64 2h1h n GLY 153 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2h1h s TYR 154 N -3.09 0.32 0.07 1.61 -0.85 -0.88 -5.06 117.35 109.47 2h1h s TYR 154 Ca 0.13 -0.71 -0.30 0.00 -0.52 0.00 0.00 57.07 55.67 2h1h s TYR 154 Cb -0.06 -0.23 -0.05 0.00 0.38 0.00 0.00 41.96 42.00 2h1h s TYR 154 CO 0.19 -0.35 0.97 0.45 -1.52 0.00 0.00 175.55 175.30 2h1h s SER 155 N -2.33 7.44 0.12 -0.18 0.15 -1.26 -4.23 113.70 113.41 2h1h s SER 155 Ca -0.02 1.76 -0.31 0.00 0.70 0.00 0.00 55.95 58.07 2h1h s SER 155 Cb 0.01 -2.58 -0.08 0.00 -1.71 0.00 0.00 66.02 61.65 2h1h s SER 155 CO -0.06 -0.15 1.43 -0.75 1.20 0.00 0.00 173.24 174.91 2h1h s LYS 156 N 0.37 4.29 0.72 5.44 2.20 -1.26 -4.98 119.74 126.53 2h1h s LYS 156 Ca 0.49 2.13 -0.15 0.00 -0.36 0.00 0.00 55.97 58.08 2h1h s LYS 156 Cb -0.23 -3.26 0.04 0.00 -1.51 0.00 0.00 37.83 32.87 2h1h s LYS 156 CO 0.29 -0.49 1.22 -2.14 -0.36 0.00 0.00 175.35 173.88 2h1h s PRO 157 N 1.23 2.16 0.13 4.03 0.02 -1.26 -4.94 135.00 136.36 2h1h s PRO 157 Ca 0.66 1.81 0.24 0.00 0.02 0.00 0.00 61.00 63.73 2h1h s PRO 157 Cb -0.38 -1.83 0.33 0.00 0.02 0.00 0.00 34.50 32.64 2h1h s PRO 157 CO 0.30 -1.83 1.31 1.96 -0.33 0.00 0.00 177.00 178.41 2h1h h GLN 158 N -0.21 0.00 -7.23 5.54 1.08 -2.07 -3.47 115.11 108.75 2h1h h GLN 158 Ca -0.48 0.00 -0.48 0.00 -1.45 0.00 0.00 58.65 56.24 2h1h h GLN 158 Cb 1.30 0.00 0.19 0.00 -0.05 0.00 0.00 27.48 28.92 2h1h h GLN 158 CO 0.50 0.00 0.14 0.95 -0.95 0.00 0.00 178.83 179.47 2h1h s THR 159 N -3.18 2.19 0.34 -0.54 -4.23 -1.26 -4.94 115.64 104.02 2h1h s THR 159 Ca 0.06 0.06 -0.28 0.00 -1.18 0.00 0.00 61.69 60.35 2h1h s THR 159 Cb 0.13 -2.21 -0.10 0.00 1.34 0.00 0.00 72.50 71.66 2h1h s THR 159 CO 0.72 -0.08 1.30 -1.10 -0.54 0.00 0.00 174.62 174.92 2h1h s GLN 160 N -4.64 4.33 0.19 3.99 -1.52 -1.26 -4.93 119.66 115.82 2h1h s GLN 160 Ca 0.67 2.19 -0.33 0.00 -1.95 0.00 0.00 55.36 55.94 2h1h s GLN 160 Cb -0.23 -3.04 -0.13 0.00 -0.22 0.00 0.00 33.01 29.40 2h1h s GLN 160 CO 0.61 -0.20 1.67 0.41 -0.25 0.00 0.00 175.29 177.52 2h1h n GLY 161 N 0.79 1.38 3.19 3.09 0.00 -1.26 -4.95 105.19 107.43 2h1h n GLY 161 Ca 0.00 0.64 -0.35 0.00 0.00 0.00 0.00 46.02 46.31 2h1h n GLY 161 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2h1h s ASP 162 N 1.12 4.64 0.43 1.61 -1.08 -1.26 -4.98 116.67 117.15 2h1h s ASP 162 Ca 0.77 -1.08 0.10 0.00 -0.52 0.00 0.00 52.55 51.82 2h1h s ASP 162 Cb -0.57 -1.69 0.92 0.00 -1.46 0.00 0.00 42.92 40.12 2h1h s ASP 162 CO 0.35 -0.20 2.03 1.88 0.52 0.00 0.00 175.17 179.75 2h1h h TYR 163 N 8.01 0.31 -6.22 -5.34 0.05 -1.87 -3.36 116.97 108.55 2h1h h TYR 163 Ca -0.26 -0.01 -0.46 0.00 0.05 0.00 0.00 58.73 58.05 2h1h h TYR 163 Cb 1.08 -0.10 -0.00 0.00 1.01 0.00 0.00 36.73 38.72 2h1h h TYR 163 CO 0.60 0.27 -0.74 0.00 -1.05 0.00 0.00 178.16 177.23 2h1h n ALA 164 N -2.50 -1.30 0.25 3.88 0.00 -1.26 -4.52 120.51 115.07 2h1h n ALA 164 Ca 0.00 0.23 0.04 0.00 0.00 0.00 0.00 53.44 53.71 2h1h n ALA 164 Cb 0.14 -4.67 -0.05 0.00 0.00 0.00 0.00 19.45 14.87 2h1h n ALA 164 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.50 177.94 2h1h n ILE 165 N -4.75 0.00 0.23 0.00 -5.35 -1.26 -4.52 119.36 103.71 2h1h n ILE 165 Ca 0.03 -0.28 0.07 0.00 -0.27 0.00 0.00 62.75 62.30 2h1h n ILE 165 Cb 0.53 0.81 0.54 0.00 -1.74 0.00 0.00 39.64 39.78 2h1h n ILE 165 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2h1h h ALA 166 N 0.96 1.50 0.00 -1.28 0.00 -1.89 -1.96 119.26 116.58 2h1h h ALA 166 Ca 0.00 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.72 2h1h h ALA 166 Cb 0.22 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 17.98 2h1h h ALA 166 CO 0.00 0.26 -0.04 -0.56 0.00 0.00 0.00 179.25 178.91 2h1h h GLN 167 N 0.00 0.00 0.00 0.00 -0.00 -1.92 -1.01 115.11 112.19 2h1h h GLN 167 Ca -0.00 0.00 -0.02 0.00 -0.00 0.00 0.00 58.65 58.62 2h1h h GLN 167 Cb 0.40 0.00 -0.00 0.00 -0.00 0.00 0.00 27.48 27.88 2h1h h GLN 167 CO 0.03 0.04 -0.12 1.25 -0.00 0.00 0.00 178.83 180.03 2h1h h HIS 168 N 0.00 0.00 -0.01 0.06 2.76 -1.59 -3.24 115.15 113.13 2h1h h HIS 168 Ca -0.00 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.17 2h1h h HIS 168 Cb 0.26 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.22 2h1h h HIS 168 CO 0.00 0.12 -0.24 1.19 -1.30 0.00 0.00 177.93 177.70 2h1h n PHE 169 N -3.19 0.00 0.48 5.26 3.72 -0.43 -4.72 117.46 118.58 2h1h n PHE 169 Ca 0.02 0.00 -0.19 0.00 -0.05 0.00 0.00 57.45 57.23 2h1h n PHE 169 Cb 0.46 0.00 -0.09 0.00 -0.94 0.00 0.00 39.48 38.91 2h1h n PHE 169 CO 0.00 0.00 0.00 1.25 -0.05 0.00 0.00 176.76 177.96 2h1h h LEU 170 N 1.25 -1.03 -1.19 4.37 5.85 -1.45 -1.97 115.31 121.14 2h1h h LEU 170 Ca 0.00 0.04 0.39 0.00 0.84 0.00 0.00 57.88 59.14 2h1h h LEU 170 Cb 0.39 0.27 -0.14 0.00 0.37 0.00 0.00 40.66 41.54 2h1h h LEU 170 CO 0.00 -0.72 0.69 0.00 -0.34 0.00 0.00 178.44 178.06 2h1h h THR 171 N -1.25 0.18 -0.65 1.05 1.03 -1.85 -1.27 112.91 110.15 2h1h h THR 171 Ca -0.12 -0.06 -0.44 0.00 -0.01 0.00 0.00 66.41 65.78 2h1h h THR 171 Cb 0.94 0.00 -0.29 0.00 -1.07 0.00 0.00 68.15 67.73 2h1h h THR 171 CO 0.21 0.03 -0.28 -0.46 -0.01 0.00 0.00 175.52 175.01 2h1h n ASN 172 N -4.92 4.61 -4.75 0.00 6.94 -1.13 -5.06 115.26 110.96 2h1h n ASN 172 Ca 0.35 -3.78 -0.36 0.00 -0.02 0.00 0.00 54.58 50.77 2h1h n ASN 172 Cb 1.23 -0.56 0.05 0.00 -2.36 0.00 0.00 39.78 38.14 2h1h n ASN 172 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 2h1h s LEU 173 N -3.53 3.62 0.46 -4.53 1.43 -0.48 -4.93 118.68 110.71 2h1h s LEU 173 Ca 0.51 2.43 -0.24 0.00 -1.03 0.00 0.00 54.13 55.80 2h1h s LEU 173 Cb 0.43 -4.60 -0.07 0.00 0.03 0.00 0.00 46.19 41.97 2h1h s LEU 173 CO 0.01 -1.73 1.35 -2.16 0.23 0.00 0.00 176.35 174.05 2h1h s PRO 174 N -3.40 3.64 0.36 1.29 0.04 -1.26 -4.90 135.00 130.77 2h1h s PRO 174 Ca 0.78 2.23 0.05 0.00 0.04 0.00 0.00 61.00 64.10 2h1h s PRO 174 Cb -0.32 -2.56 0.72 0.00 0.04 0.00 0.00 34.50 32.38 2h1h s PRO 174 CO 0.35 -0.79 1.96 1.79 0.04 0.00 0.00 177.00 180.36 2h1h h THR 175 N 2.10 1.04 -0.37 1.26 1.35 -2.00 -1.61 112.91 114.68 2h1h h THR 175 Ca -0.50 -0.27 -0.09 0.00 -0.55 0.00 0.00 66.41 65.00 2h1h h THR 175 Cb 1.27 0.19 -0.05 0.00 -1.73 0.00 0.00 68.15 67.82 2h1h h THR 175 CO 0.60 0.14 0.12 -0.90 -0.25 0.00 0.00 175.52 175.23 2h1h n ASP 176 N -4.47 3.44 -4.61 5.36 3.85 -1.26 -4.97 116.55 113.89 2h1h n ASP 176 Ca 0.10 -2.60 -0.43 0.00 -0.71 0.00 0.00 54.79 51.15 2h1h n ASP 176 Cb 0.20 -0.62 -0.00 0.00 -1.35 0.00 0.00 41.12 39.34 2h1h n ASP 176 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 2h1h n ALA 177 N 0.09 0.21 0.00 2.12 0.00 -0.61 -1.77 120.51 120.55 2h1h n ALA 177 Ca 0.20 0.30 0.00 0.00 0.00 0.00 0.00 53.44 53.94 2h1h n ALA 177 Cb 0.87 -2.08 0.00 0.00 0.00 0.00 0.00 19.45 18.24 2h1h n ALA 177 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2h1h n GLY 178 N 1.14 3.00 1.15 0.00 0.00 0.38 -4.80 105.19 106.07 2h1h n GLY 178 Ca 0.09 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.17 2h1h n GLY 178 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2h1h n GLU 179 N -2.00 2.80 -3.85 1.61 0.28 -0.73 -4.56 120.64 114.19 2h1h n GLU 179 Ca 0.00 -1.96 -0.10 0.00 -0.16 0.00 0.00 57.16 54.94 2h1h n GLU 179 Cb 0.00 -1.66 -0.06 0.00 1.43 0.00 0.00 31.44 31.15 2h1h n GLU 179 CO 0.00 0.00 0.00 1.52 -0.16 0.00 0.00 177.13 178.49 2h1h s TYR 180 N -1.69 0.16 0.24 -1.84 -0.85 -1.26 -2.86 117.35 109.24 2h1h s TYR 180 Ca 0.35 -0.52 0.12 0.00 -0.52 0.00 0.00 57.07 56.50 2h1h s TYR 180 Cb 0.22 0.10 -0.05 0.00 0.38 0.00 0.00 41.96 42.61 2h1h s TYR 180 CO 0.18 -0.75 -0.21 0.00 -1.52 0.00 0.00 175.55 173.25 2h1h s ALA 181 N -3.91 2.68 -0.04 9.51 0.00 0.04 -0.82 121.76 129.22 2h1h s ALA 181 Ca 0.12 -1.76 0.07 0.00 0.00 0.00 0.00 51.96 50.38 2h1h s ALA 181 Cb 0.02 -0.32 -0.02 0.00 0.00 0.00 0.00 23.12 22.81 2h1h s ALA 181 CO -0.04 0.35 -0.25 0.08 0.00 0.00 0.00 175.76 175.90 2h1h s VAL 182 N -2.13 2.11 -0.29 0.00 1.01 -1.06 -1.38 120.40 118.67 2h1h s VAL 182 Ca 0.26 -1.07 -0.01 0.00 0.00 0.00 0.00 61.98 61.16 2h1h s VAL 182 Cb -0.06 -1.75 0.05 0.00 0.00 0.00 0.00 36.38 34.62 2h1h s VAL 182 CO 0.13 0.58 -0.03 -0.36 0.00 0.00 0.00 175.10 175.42 2h1h s PHE 183 N -0.38 3.24 -0.75 5.22 0.40 -1.07 -1.86 117.98 122.79 2h1h s PHE 183 Ca 0.03 -1.91 -0.19 0.00 -0.60 0.00 0.00 56.93 54.26 2h1h s PHE 183 Cb -0.12 -2.07 0.11 0.00 0.51 0.00 0.00 43.02 41.45 2h1h s PHE 183 CO 0.02 -0.81 0.93 -0.51 0.70 0.00 0.00 175.22 175.55 2h1h s LEU 184 N 1.24 5.10 0.00 -0.37 1.43 0.24 -4.28 118.68 122.04 2h1h s LEU 184 Ca -0.05 -1.62 0.22 0.00 -1.03 0.00 0.00 54.13 51.65 2h1h s LEU 184 Cb -0.19 -2.36 -0.04 0.00 0.03 0.00 0.00 46.19 43.63 2h1h s LEU 184 CO -0.02 -1.15 1.01 0.00 0.23 0.00 0.00 176.35 176.42 2h1h n HIS 185 N 6.61 0.03 -3.28 0.29 1.44 -1.26 -1.67 115.22 117.39 2h1h n HIS 185 Ca 0.06 0.01 -0.38 0.00 -2.01 0.00 0.00 57.72 55.39 2h1h n HIS 185 Cb 0.46 -0.14 -0.06 0.00 0.12 0.00 0.00 29.99 30.37 2h1h n HIS 185 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2h1h s ALA 186 N -3.06 3.48 0.30 1.59 0.00 -1.26 -4.78 121.76 118.03 2h1h s ALA 186 Ca 0.07 -0.11 -0.09 0.00 0.00 0.00 0.00 51.96 51.83 2h1h s ALA 186 Cb 0.16 -2.68 0.04 0.00 0.00 0.00 0.00 23.12 20.63 2h1h s ALA 186 CO 0.83 0.05 0.55 -2.37 0.00 0.00 0.00 175.76 174.82 2h1h n THR 187 N 3.38 0.00 0.00 0.00 5.66 -1.26 -4.84 114.28 117.22 2h1h n THR 187 Ca -0.07 -0.93 0.00 0.00 -3.05 0.00 0.00 64.05 60.00 2h1h n THR 187 Cb 0.52 0.79 0.00 0.00 -1.55 0.00 0.00 70.33 70.09 2h1h n THR 187 CO 0.00 0.00 0.00 0.41 -3.05 0.00 0.00 175.07 172.43 2h1h n THR 188 N -0.42 0.00 -2.49 1.09 -1.04 -1.26 -4.98 114.28 105.18 2h1h n THR 188 Ca -0.05 0.43 -0.37 0.00 -2.04 0.00 0.00 64.05 62.02 2h1h n THR 188 Cb 0.46 -1.37 -0.04 0.00 -1.82 0.00 0.00 70.33 67.56 2h1h n THR 188 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2h1h s ARG 189 N -0.85 4.20 0.24 -2.82 1.70 -1.26 -4.95 118.95 115.20 2h1h s ARG 189 Ca 0.00 1.60 -0.05 0.00 -0.47 0.00 0.00 55.73 56.81 2h1h s ARG 189 Cb 0.00 -2.64 0.45 0.00 -0.57 0.00 0.00 34.95 32.19 2h1h s ARG 189 CO 0.00 -0.13 1.70 -0.44 -1.08 0.00 0.00 175.30 175.35 2h1h h ASP 190 N 2.68 0.11 0.30 -2.89 3.32 -1.98 -1.59 116.42 116.36 2h1h h ASP 190 Ca -0.48 0.13 0.00 0.00 0.02 0.00 0.00 57.03 56.70 2h1h h ASP 190 Cb 1.22 0.15 0.00 0.00 0.22 0.00 0.00 39.33 40.92 2h1h h ASP 190 CO 0.63 0.01 0.00 -0.90 -1.72 0.00 0.00 179.24 177.26 2h1h n ASP 191 N -5.10 0.00 0.02 6.45 5.75 -1.26 -1.84 116.55 120.57 2h1h n ASP 191 Ca 0.14 0.35 0.11 0.00 -0.01 0.00 0.00 54.79 55.38 2h1h n ASP 191 Cb 0.44 -0.41 0.03 0.00 -1.03 0.00 0.00 41.12 40.15 2h1h n ASP 191 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 2h1h n LYS 192 N -1.41 0.19 -2.72 0.11 5.02 -0.60 -4.36 118.16 114.39 2h1h n LYS 192 Ca 0.04 -0.01 -0.33 0.00 -2.02 0.00 0.00 58.31 55.98 2h1h n LYS 192 Cb 0.11 -1.56 -0.06 0.00 -0.02 0.00 0.00 35.03 33.50 2h1h n LYS 192 CO 0.00 0.00 0.00 -1.01 -0.52 0.00 0.00 177.40 175.87 2h1h s HIS 193 N -3.13 3.21 -0.25 2.13 3.76 -0.77 -4.58 115.29 115.66 2h1h s HIS 193 Ca 0.06 1.60 -0.09 0.00 -0.15 0.00 0.00 55.06 56.48 2h1h s HIS 193 Cb 0.15 -2.93 -0.04 0.00 1.11 0.00 0.00 32.58 30.88 2h1h s HIS 193 CO 0.80 -0.35 0.12 -0.46 -0.85 0.00 0.00 174.74 174.00 2h1h s TRP 194 N -2.09 3.17 0.23 1.40 -0.00 -1.26 -4.74 118.94 115.65 2h1h s TRP 194 Ca 0.63 -0.13 -0.27 0.00 -0.00 0.00 0.00 56.10 56.34 2h1h s TRP 194 Cb -0.12 -2.28 -0.16 0.00 -0.00 0.00 0.00 33.47 30.91 2h1h s TRP 194 CO 0.16 -0.21 0.52 -2.30 -0.00 0.00 0.00 176.95 175.12 2h1h n PRO 195 N 4.80 0.13 -0.27 5.86 -0.02 -1.26 -4.71 135.00 139.53 2h1h n PRO 195 Ca -0.15 0.05 0.11 0.00 -2.02 0.00 0.00 63.50 61.49 2h1h n PRO 195 Cb 0.52 -1.09 0.36 0.00 -0.02 0.00 0.00 33.50 33.28 2h1h n PRO 195 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 2h1h h GLU 196 N 1.01 0.70 -0.84 -0.52 5.08 -1.99 -0.87 114.58 117.15 2h1h h GLU 196 Ca -0.30 -0.04 0.03 0.00 -1.00 0.00 0.00 59.36 58.05 2h1h h GLU 196 Cb 1.43 -0.16 -0.05 0.00 0.50 0.00 0.00 28.75 30.48 2h1h h GLU 196 CO 0.56 0.46 0.55 1.05 -1.00 0.00 0.00 179.01 180.64 2h1h h GLU 197 N 0.72 1.02 0.12 2.33 4.11 -1.99 -0.50 114.58 120.40 2h1h h GLU 197 Ca 0.44 -0.06 -0.28 0.00 0.07 0.00 0.00 59.36 59.54 2h1h h GLU 197 Cb 0.67 -0.23 0.01 0.00 0.50 0.00 0.00 28.75 29.70 2h1h h GLU 197 CO -0.20 0.67 -1.22 0.45 0.07 0.00 0.00 179.01 178.78 2h1h h HIS 198 N 1.05 0.62 -0.78 2.06 3.86 -1.51 -2.13 115.15 118.32 2h1h h HIS 198 Ca 0.33 -0.43 -0.04 0.00 -1.16 0.00 0.00 60.37 59.07 2h1h h HIS 198 Cb 0.02 -0.04 -0.04 0.00 1.06 0.00 0.00 27.41 28.42 2h1h h HIS 198 CO -0.00 1.31 0.32 -1.49 0.86 0.00 0.00 177.93 178.93 2h1h h TRP 199 N 0.13 1.18 -0.45 2.45 4.06 -1.06 -1.21 115.95 121.04 2h1h h TRP 199 Ca -0.15 -0.08 -0.07 0.00 2.06 0.00 0.00 58.89 60.65 2h1h h TRP 199 Cb 1.93 -0.35 -0.02 0.00 -1.00 0.00 0.00 29.16 29.72 2h1h h TRP 199 CO 0.08 0.88 -0.01 -0.09 -3.56 0.00 0.00 178.44 175.74 2h1h h ARG 200 N 1.13 0.79 -0.57 0.49 2.43 -1.07 -0.95 114.38 116.64 2h1h h ARG 200 Ca 0.26 -0.26 -0.09 0.00 -0.81 0.00 0.00 59.98 59.09 2h1h h ARG 200 Cb 0.20 -0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 29.65 2h1h h ARG 200 CO -0.02 0.86 -0.00 1.49 -1.51 0.00 0.00 179.97 180.78 2h1h h GLU 201 N 0.63 0.98 -0.36 0.20 4.57 -1.12 0.66 114.58 120.14 2h1h h GLU 201 Ca 0.13 -0.29 -0.02 0.00 -1.18 0.00 0.00 59.36 57.99 2h1h h GLU 201 Cb 0.51 -0.10 -0.02 0.00 -0.16 0.00 0.00 28.75 28.98 2h1h h GLU 201 CO 0.02 0.96 0.13 1.25 -1.18 0.00 0.00 179.01 180.20 2h1h h LEU 202 N 0.90 0.51 -0.43 1.64 5.85 -1.04 0.28 115.31 123.02 2h1h h LEU 202 Ca 0.16 -0.18 0.02 0.00 0.84 0.00 0.00 57.88 58.72 2h1h h LEU 202 Cb 0.52 -0.13 -0.03 0.00 0.37 0.00 0.00 40.66 41.39 2h1h h LEU 202 CO 0.03 0.56 0.24 0.40 -0.34 0.00 0.00 178.44 179.33 2h1h h ILE 203 N 0.43 1.02 -0.56 4.05 2.04 -0.97 -2.10 117.51 121.43 2h1h h ILE 203 Ca 0.12 -0.17 -0.02 0.00 1.00 0.00 0.00 64.86 65.79 2h1h h ILE 203 Cb 0.22 0.49 -0.03 0.00 -0.74 0.00 0.00 36.82 36.76 2h1h h ILE 203 CO -0.01 0.09 0.26 1.23 0.00 0.00 0.00 178.15 179.72 2h1h h GLY 204 N 0.49 0.84 2.00 5.37 0.00 -0.18 -1.61 103.07 109.97 2h1h h GLY 204 Ca 0.18 -0.39 0.00 0.00 0.00 0.00 0.00 47.33 47.12 2h1h h GLY 204 CO -0.10 0.37 0.00 1.41 0.00 0.00 0.00 176.54 178.23 2h1h h LEU 205 N 0.78 0.00 -2.40 3.11 3.38 0.24 -2.29 115.31 118.13 2h1h h LEU 205 Ca 0.19 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.16 2h1h h LEU 205 Cb 0.09 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.84 2h1h h LEU 205 CO -0.02 0.00 0.00 0.18 0.09 0.00 0.00 178.44 178.69 2h1h n LEU 206 N -2.64 2.97 -0.21 1.67 4.77 -0.62 -4.67 117.00 118.27 2h1h n LEU 206 Ca -0.00 -1.64 0.01 0.00 -0.03 0.00 0.00 56.01 54.35 2h1h n LEU 206 Cb 0.18 -0.21 0.12 0.00 -2.33 0.00 0.00 43.42 41.17 2h1h n LEU 206 CO 0.20 0.68 0.93 0.00 -1.33 0.00 0.00 177.39 177.87 2h1h h ALA 207 N 2.99 0.76 -0.00 -1.18 0.00 -1.19 -2.72 119.26 117.91 2h1h h ALA 207 Ca 0.00 0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.04 2h1h h ALA 207 Cb 0.77 0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.73 2h1h h ALA 207 CO 0.00 -0.29 -0.39 -0.40 0.00 0.00 0.00 179.25 178.17 2h1h n ASP 208 N -5.11 0.51 -0.07 0.00 5.68 -1.26 -4.11 116.55 112.18 2h1h n ASP 208 Ca 0.10 -0.26 0.09 0.00 -0.50 0.00 0.00 54.79 54.21 2h1h n ASP 208 Cb 0.34 0.13 0.46 0.00 -1.14 0.00 0.00 41.12 40.91 2h1h n ASP 208 CO 0.00 0.00 0.00 0.77 -1.33 0.00 0.00 177.20 176.64 2h1h h SER 209 N 0.18 0.44 0.00 -1.12 4.64 -1.80 -3.45 113.55 112.44 2h1h h SER 209 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2h1h h SER 209 Cb 0.49 -0.09 0.00 0.00 -0.31 0.00 0.00 62.40 62.49 2h1h h SER 209 CO 0.00 0.28 0.00 0.61 -0.87 0.00 0.00 176.83 176.85 2h1h n GLY 210 N -1.50 0.72 3.85 -0.77 0.00 -1.26 -5.08 105.19 101.16 2h1h n GLY 210 Ca 0.08 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.78 2h1h n GLY 210 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2h1h s ILE 211 N -2.00 4.65 0.15 -0.61 2.07 -1.26 -5.04 121.20 119.15 2h1h s ILE 211 Ca 0.00 0.96 0.06 0.00 -1.41 0.00 0.00 60.65 60.26 2h1h s ILE 211 Cb 0.00 -3.68 -0.04 0.00 0.13 0.00 0.00 42.46 38.88 2h1h s ILE 211 CO 0.00 -0.43 0.02 -0.13 -1.91 0.00 0.00 174.94 172.49 2h1h s ARG 212 N -3.55 2.52 -0.03 3.50 0.52 -1.14 -4.89 118.95 115.88 2h1h s ARG 212 Ca 0.55 -0.99 0.02 0.00 -0.52 0.00 0.00 55.73 54.80 2h1h s ARG 212 Cb -0.10 -2.46 0.01 0.00 0.52 0.00 0.00 34.95 32.92 2h1h s ARG 212 CO 0.25 0.49 -0.08 0.42 0.02 0.00 0.00 175.30 176.40 2h1h s ILE 213 N -1.59 0.71 -0.09 1.52 1.01 -0.30 -0.78 121.20 121.68 2h1h s ILE 213 Ca 0.27 -0.29 0.02 0.00 0.00 0.00 0.00 60.65 60.65 2h1h s ILE 213 Cb -0.10 -0.66 -0.02 0.00 0.01 0.00 0.00 42.46 41.69 2h1h s ILE 213 CO 0.19 0.24 -0.14 -0.54 0.00 0.00 0.00 174.94 174.69 2h1h s LYS 214 N 0.40 2.90 -0.27 2.79 1.02 -0.48 -0.23 119.74 125.88 2h1h s LYS 214 Ca -0.06 -0.70 -0.03 0.00 0.02 0.00 0.00 55.97 55.21 2h1h s LYS 214 Cb -0.10 -2.49 0.03 0.00 -0.52 0.00 0.00 37.83 34.75 2h1h s LYS 214 CO 0.01 0.43 -0.02 -0.51 -0.92 0.00 0.00 175.35 174.34 2h1h s LEU 215 N -0.23 3.50 0.64 3.17 1.43 -0.06 -2.59 118.68 124.55 2h1h s LEU 215 Ca 0.01 -0.95 -0.05 0.00 -1.03 0.00 0.00 54.13 52.12 2h1h s LEU 215 Cb -0.13 -1.72 0.04 0.00 0.03 0.00 0.00 46.19 44.41 2h1h s LEU 215 CO 0.03 -0.18 0.93 -2.16 0.23 0.00 0.00 176.35 175.20 2h1h s PRO 216 N 1.34 2.43 -0.08 1.29 0.04 -1.26 -1.29 135.00 137.46 2h1h s PRO 216 Ca -0.01 -0.33 -0.30 0.00 0.04 0.00 0.00 61.00 60.40 2h1h s PRO 216 Cb -0.18 -2.27 0.10 0.00 0.04 0.00 0.00 34.50 32.20 2h1h s PRO 216 CO -0.02 -1.00 0.87 1.67 0.04 0.00 0.00 177.00 178.56 2h1h s TRP 217 N -3.07 -0.46 -0.14 0.56 1.48 -1.26 -4.79 118.94 111.25 2h1h s TRP 217 Ca 0.58 0.67 -0.10 0.00 -1.06 0.00 0.00 56.10 56.19 2h1h s TRP 217 Cb -0.11 0.46 -0.06 0.00 -1.16 0.00 0.00 33.47 32.60 2h1h s TRP 217 CO 0.43 -0.48 -0.23 0.41 -4.06 0.00 0.00 176.95 173.02 2h1h n GLY 218 N 0.53 -0.31 3.90 3.67 0.00 -1.26 -4.72 105.19 106.99 2h1h n GLY 218 Ca -0.13 -0.13 -0.25 0.00 0.00 0.00 0.00 46.02 45.51 2h1h n GLY 218 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2h1h s ALA 219 N -2.42 3.82 0.41 4.61 0.00 -1.26 -5.02 121.76 121.91 2h1h s ALA 219 Ca -0.23 -1.14 0.17 0.00 0.00 0.00 0.00 51.96 50.76 2h1h s ALA 219 Cb 0.07 -1.62 1.06 0.00 0.00 0.00 0.00 23.12 22.63 2h1h s ALA 219 CO 0.30 0.47 1.85 -1.35 0.00 0.00 0.00 175.76 177.03 2h1h h PRO 220 N 2.06 0.42 0.00 0.00 0.11 -2.00 0.20 132.00 132.79 2h1h h PRO 220 Ca -0.49 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.60 2h1h h PRO 220 Cb 1.20 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.22 2h1h h PRO 220 CO 0.66 0.28 0.00 1.12 -0.21 0.00 0.00 178.00 179.84 2h1h h HIS 221 N 0.43 0.00 0.00 0.65 2.07 -1.99 -1.75 115.15 114.56 2h1h h HIS 221 Ca 0.48 0.00 -0.16 0.00 -2.85 0.00 0.00 60.37 57.84 2h1h h HIS 221 Cb 1.16 0.00 -0.02 0.00 2.57 0.00 0.00 27.41 31.12 2h1h h HIS 221 CO -0.00 0.00 -0.92 0.93 -3.07 0.00 0.00 177.93 174.86 2h1h h GLU 222 N 0.00 0.00 -0.10 5.12 5.08 -1.01 -2.75 114.58 120.92 2h1h h GLU 222 Ca 0.00 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.28 2h1h h GLU 222 Cb 0.58 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.83 2h1h h GLU 222 CO 0.00 0.60 -0.27 1.49 -1.00 0.00 0.00 179.01 179.83 2h1h h GLU 223 N 0.00 0.36 -0.57 2.33 4.81 -0.95 -0.25 114.58 120.31 2h1h h GLU 223 Ca -0.06 -0.25 0.02 0.00 -0.13 0.00 0.00 59.36 58.93 2h1h h GLU 223 Cb 1.59 0.04 -0.03 0.00 0.63 0.00 0.00 28.75 30.98 2h1h h GLU 223 CO 0.08 0.87 0.38 0.93 -0.73 0.00 0.00 179.01 180.53 2h1h h GLU 224 N -0.09 0.71 -0.29 1.92 4.39 -1.39 0.14 114.58 119.97 2h1h h GLU 224 Ca -0.01 -0.04 -0.19 0.00 0.34 0.00 0.00 59.36 59.47 2h1h h GLU 224 Cb 0.88 -0.16 0.00 0.00 -0.10 0.00 0.00 28.75 29.37 2h1h h GLU 224 CO 0.06 0.47 -0.55 -0.09 -1.16 0.00 0.00 179.01 177.74 2h1h h ARG 225 N 0.73 0.89 -0.50 2.33 2.43 -1.39 -2.13 114.38 116.74 2h1h h ARG 225 Ca 0.22 -0.56 0.01 0.00 -0.81 0.00 0.00 59.98 58.84 2h1h h ARG 225 Cb -0.02 0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 29.56 2h1h h ARG 225 CO -0.05 1.20 0.32 0.00 -1.51 0.00 0.00 179.97 179.93 2h1h h ALA 226 N 0.69 0.64 -0.48 2.80 0.00 0.56 0.77 119.26 124.24 2h1h h ALA 226 Ca 0.01 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2h1h h ALA 226 Cb 1.16 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.75 2h1h h ALA 226 CO 0.12 0.05 0.31 0.87 0.00 0.00 0.00 179.25 180.59 2h1h h LYS 227 N 0.64 0.63 -0.70 0.00 1.57 -0.74 0.50 116.57 118.48 2h1h h LYS 227 Ca 0.19 -0.04 -0.00 0.00 -1.87 0.00 0.00 60.65 58.93 2h1h h LYS 227 Cb -0.04 -0.14 -0.03 0.00 0.08 0.00 0.00 32.23 32.10 2h1h h LYS 227 CO -0.06 0.43 0.44 0.00 -0.57 0.00 0.00 179.45 179.69 2h1h h ARG 228 N 0.64 0.94 -0.22 3.15 3.08 -0.80 0.30 114.38 121.48 2h1h h ARG 228 Ca 0.17 -0.08 -0.04 0.00 0.07 0.00 0.00 59.98 60.10 2h1h h ARG 228 Cb -0.05 -0.20 -0.01 0.00 0.08 0.00 0.00 29.97 29.78 2h1h h ARG 228 CO -0.04 0.66 -0.06 -0.07 -1.07 0.00 0.00 179.97 179.40 2h1h h LEU 229 N 0.95 0.31 0.00 3.04 3.38 -0.30 -2.94 115.31 119.75 2h1h h LEU 229 Ca 0.25 -0.05 -0.04 0.00 0.09 0.00 0.00 57.88 58.13 2h1h h LEU 229 Cb -0.06 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.61 2h1h h LEU 229 CO -0.05 0.41 -0.69 0.00 0.09 0.00 0.00 178.44 178.20 2h1h h ALA 230 N 1.63 0.70 -1.97 1.53 0.00 0.33 -3.46 119.26 118.02 2h1h h ALA 230 Ca 0.07 -0.21 -0.63 0.00 0.00 0.00 0.00 54.91 54.14 2h1h h ALA 230 Cb 0.31 0.03 0.06 0.00 0.00 0.00 0.00 17.79 18.19 2h1h h ALA 230 CO 0.01 0.25 0.62 -1.91 0.00 0.00 0.00 179.25 178.22 2h1h n GLU 231 N -2.93 1.63 -0.97 0.00 2.13 0.92 -1.43 120.64 120.00 2h1h n GLU 231 Ca -0.00 0.59 0.00 0.00 0.66 0.00 0.00 57.16 58.41 2h1h n GLU 231 Cb 0.62 -2.29 0.00 0.00 0.27 0.00 0.00 31.44 30.04 2h1h n GLU 231 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2h1h n GLY 232 N 2.94 0.60 2.88 8.31 0.00 -1.26 -4.98 105.19 113.69 2h1h n GLY 232 Ca 0.18 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.89 2h1h n GLY 232 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2h1h s PHE 233 N -2.54 2.83 -0.00 1.61 2.99 -0.51 -4.98 117.98 117.38 2h1h s PHE 233 Ca 0.00 -2.70 0.31 0.00 0.00 0.00 0.00 56.93 54.54 2h1h s PHE 233 Cb 0.00 -2.45 1.46 0.00 0.00 0.00 0.00 43.02 42.03 2h1h s PHE 233 CO 0.00 -0.84 1.92 0.00 -0.00 0.00 0.00 175.22 176.31 2h1h h ALA 234 N 7.17 1.00 -0.01 5.36 0.00 -1.94 -2.22 119.26 128.63 2h1h h ALA 234 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.85 2h1h h ALA 234 Cb 0.96 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.75 2h1h h ALA 234 CO 0.55 0.00 -0.04 2.48 0.00 0.00 0.00 179.25 182.25 2h1h n TYR 235 N -2.66 0.00 -4.73 0.00 0.18 -1.26 -4.80 117.16 103.88 2h1h n TYR 235 Ca -0.00 0.00 -0.33 0.00 1.88 0.00 0.00 57.90 59.44 2h1h n TYR 235 Cb 0.17 -0.05 -0.13 0.00 -0.38 0.00 0.00 39.34 38.95 2h1h n TYR 235 CO 0.00 0.00 0.00 0.08 -2.08 0.00 0.00 176.86 174.86 2h1h s VAL 236 N -2.14 3.37 0.06 -3.48 1.01 -0.84 -1.15 120.40 117.23 2h1h s VAL 236 Ca 0.39 -0.59 0.06 0.00 0.00 0.00 0.00 61.98 61.83 2h1h s VAL 236 Cb 0.21 -2.37 -0.03 0.00 0.00 0.00 0.00 36.38 34.19 2h1h s VAL 236 CO 0.39 0.57 -0.16 -1.83 0.00 0.00 0.00 175.10 174.08 2h1h s GLU 237 N -0.49 0.95 -0.20 2.72 -1.05 0.68 -4.93 118.70 116.39 2h1h s GLU 237 Ca 0.07 -0.91 -0.17 0.00 -0.15 0.00 0.00 54.97 53.81 2h1h s GLU 237 Cb -0.12 -1.01 -0.04 0.00 -0.44 0.00 0.00 34.13 32.53 2h1h s GLU 237 CO 0.02 0.24 0.47 0.08 0.95 0.00 0.00 175.26 177.02 2h1h s VAL 238 N -1.05 5.14 0.55 1.83 1.01 -1.26 -0.88 120.40 125.74 2h1h s VAL 238 Ca 0.01 0.86 -0.19 0.00 0.00 0.00 0.00 61.98 62.66 2h1h s VAL 238 Cb -0.09 -3.80 -0.06 0.00 0.00 0.00 0.00 36.38 32.44 2h1h s VAL 238 CO 0.02 0.21 1.11 -0.76 0.00 0.00 0.00 175.10 175.68 2h1h s LEU 239 N 1.46 3.72 0.00 3.92 1.43 -0.42 -4.90 118.68 123.90 2h1h s LEU 239 Ca 0.22 2.10 -0.16 0.00 -1.03 0.00 0.00 54.13 55.26 2h1h s LEU 239 Cb -0.15 -4.57 0.23 0.00 0.03 0.00 0.00 46.19 41.72 2h1h s LEU 239 CO 0.09 -1.18 1.05 -0.81 0.23 0.00 0.00 176.35 175.73 2h1h n PRO 240 N -1.39 -1.98 -2.15 1.29 -0.04 -1.26 -4.83 135.00 124.65 2h1h n PRO 240 Ca 0.11 -1.64 -0.42 0.00 -0.04 0.00 0.00 63.50 61.51 2h1h n PRO 240 Cb 0.51 -1.29 -0.03 0.00 -0.04 0.00 0.00 33.50 32.65 2h1h n PRO 240 CO 0.00 0.00 0.00 0.21 -0.04 0.00 0.00 175.50 175.67 2h1h s LYS 241 N -5.32 4.32 0.04 0.54 2.20 -1.26 -4.85 119.74 115.41 2h1h s LYS 241 Ca 0.63 2.10 0.02 0.00 -0.36 0.00 0.00 55.97 58.36 2h1h s LYS 241 Cb -0.04 -3.23 -0.02 0.00 -1.51 0.00 0.00 37.83 33.02 2h1h s LYS 241 CO 0.46 -0.44 -0.08 -1.64 -0.36 0.00 0.00 175.35 173.29 2h1h s MET 242 N 0.98 0.54 1.09 4.03 -1.94 -1.26 -5.10 119.30 117.64 2h1h s MET 242 Ca 0.64 -0.77 -0.17 0.00 -1.71 0.00 0.00 55.69 53.69 2h1h s MET 242 Cb -0.37 -0.32 0.24 0.00 2.01 0.00 0.00 34.83 36.38 2h1h s MET 242 CO 0.31 0.06 1.16 -1.54 -0.01 0.00 0.00 175.02 175.00 2h1h s SER 243 N -1.58 1.90 0.46 3.03 1.04 -1.26 -4.74 113.70 112.55 2h1h s SER 243 Ca -0.09 0.62 0.17 0.00 0.48 0.00 0.00 55.95 57.13 2h1h s SER 243 Cb -0.10 -0.89 1.08 0.00 0.10 0.00 0.00 66.02 66.21 2h1h s SER 243 CO 0.01 -3.52 2.00 0.25 0.98 0.00 0.00 173.24 172.96 2h1h h LEU 244 N -2.17 0.00 0.02 2.42 5.85 -1.99 -1.79 115.31 117.65 2h1h h LEU 244 Ca -0.46 0.00 -0.24 0.00 0.84 0.00 0.00 57.88 58.02 2h1h h LEU 244 Cb 1.29 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.31 2h1h h LEU 244 CO 0.40 0.18 -1.09 -0.08 -0.34 0.00 0.00 178.44 177.51 2h1h h GLU 245 N 0.00 0.15 -0.21 1.25 4.81 -1.97 -2.82 114.58 115.79 2h1h h GLU 245 Ca -0.00 -0.24 -0.02 0.00 -0.13 0.00 0.00 59.36 58.97 2h1h h GLU 245 Cb 0.35 0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.81 2h1h h GLU 245 CO 0.02 1.09 0.05 0.78 -0.73 0.00 0.00 179.01 180.23 2h1h h GLY 246 N 2.21 0.36 2.00 1.92 0.00 -1.69 -2.13 103.07 105.75 2h1h h GLY 246 Ca -0.07 -0.22 -0.04 0.00 0.00 0.00 0.00 47.33 47.00 2h1h h GLY 246 CO 0.16 0.21 -0.19 -0.24 0.00 0.00 0.00 176.54 176.48 2h1h h VAL 247 N 0.15 0.58 -0.15 4.60 3.04 -1.45 -2.43 116.25 120.60 2h1h h VAL 247 Ca 0.07 -0.87 -0.16 0.00 -1.01 0.00 0.00 66.70 64.72 2h1h h VAL 247 Cb 0.27 1.57 -0.01 0.00 -2.01 0.00 0.00 31.29 31.12 2h1h h VAL 247 CO 0.00 0.18 -0.59 0.00 -1.01 0.00 0.00 177.57 176.15 2h1h h ALA 248 N 1.81 0.69 -0.61 3.17 0.00 -1.20 -1.60 119.26 121.52 2h1h h ALA 248 Ca -0.00 -0.53 -0.07 0.00 0.00 0.00 0.00 54.91 54.31 2h1h h ALA 248 Cb 0.56 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 2h1h h ALA 248 CO 0.02 0.70 0.12 -0.09 0.00 0.00 0.00 179.25 180.01 2h1h h ARG 249 N 0.37 0.99 -0.16 0.00 2.43 -0.91 0.18 114.38 117.28 2h1h h ARG 249 Ca -0.00 -0.25 -0.01 0.00 -0.81 0.00 0.00 59.98 58.90 2h1h h ARG 249 Cb 1.14 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 30.56 2h1h h ARG 249 CO 0.11 0.92 0.05 0.28 -1.51 0.00 0.00 179.97 179.82 2h1h h VAL 250 N 0.90 1.18 -0.74 0.20 2.07 -1.37 -2.57 116.25 115.92 2h1h h VAL 250 Ca 0.19 -0.56 0.04 0.00 0.82 0.00 0.00 66.70 67.19 2h1h h VAL 250 Cb 0.40 1.25 -0.05 0.00 -1.52 0.00 0.00 31.29 31.37 2h1h h VAL 250 CO 0.01 0.17 0.46 -0.07 0.02 0.00 0.00 177.57 178.16 2h1h h LEU 251 N 0.08 0.75 -2.01 2.57 3.38 -1.03 -1.70 115.31 117.34 2h1h h LEU 251 Ca 0.05 0.00 0.10 0.00 0.09 0.00 0.00 57.88 58.12 2h1h h LEU 251 Cb 0.22 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.80 2h1h h LEU 251 CO -0.00 0.51 0.24 0.00 0.09 0.00 0.00 178.44 179.28 2h1h h ALA 252 N 1.32 2.29 -0.66 1.53 0.00 -0.37 -1.54 119.26 121.85 2h1h h ALA 252 Ca 0.30 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.20 2h1h h ALA 252 Cb 0.05 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.86 2h1h h ALA 252 CO -0.12 -0.41 0.00 0.41 0.00 0.00 0.00 179.25 179.12 2h1h n GLY 253 N -1.59 2.43 3.77 0.00 0.00 -0.68 -4.96 105.19 104.16 2h1h n GLY 253 Ca 0.05 -0.75 -0.39 0.00 0.00 0.00 0.00 46.02 44.93 2h1h n GLY 253 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2h1h s ALA 254 N -1.05 3.44 0.12 4.61 0.00 -0.58 -0.47 121.76 127.83 2h1h s ALA 254 Ca 0.45 0.36 -0.14 0.00 0.00 0.00 0.00 51.96 52.63 2h1h s ALA 254 Cb 0.24 -2.96 -0.04 0.00 0.00 0.00 0.00 23.12 20.36 2h1h s ALA 254 CO 0.31 0.27 1.52 -0.22 0.00 0.00 0.00 175.76 177.64 2h1h h LYS 255 N 4.44 0.74 -3.21 0.00 1.63 -1.22 -3.45 116.57 115.50 2h1h h LYS 255 Ca -0.47 -0.29 0.01 0.00 -0.85 0.00 0.00 60.65 59.05 2h1h h LYS 255 Cb 1.21 -0.04 -0.08 0.00 -0.60 0.00 0.00 32.23 32.72 2h1h h LYS 255 CO 0.66 0.90 0.10 -0.59 -3.45 0.00 0.00 179.45 177.07 2h1h s PHE 256 N -4.75 -0.12 0.05 1.91 -0.12 -1.26 -4.31 117.98 109.38 2h1h s PHE 256 Ca -0.13 -0.25 0.03 0.00 -0.05 0.00 0.00 56.93 56.53 2h1h s PHE 256 Cb 0.10 0.50 -0.02 0.00 -0.63 0.00 0.00 43.02 42.96 2h1h s PHE 256 CO 0.81 -1.04 -0.09 0.08 -0.05 0.00 0.00 175.22 174.93 2h1h s VAL 257 N -3.90 0.66 -0.07 -2.49 1.01 -0.00 -2.55 120.40 113.05 2h1h s VAL 257 Ca 0.11 -1.10 0.04 0.00 0.00 0.00 0.00 61.98 61.03 2h1h s VAL 257 Cb -0.03 -0.70 0.00 0.00 0.00 0.00 0.00 36.38 35.66 2h1h s VAL 257 CO 0.01 -0.33 -0.19 -0.69 0.00 0.00 0.00 175.10 173.90 2h1h s VAL 258 N -1.31 1.66 0.16 2.92 1.01 -0.78 0.12 120.40 124.19 2h1h s VAL 258 Ca -0.08 -0.80 -0.17 0.00 0.00 0.00 0.00 61.98 60.93 2h1h s VAL 258 Cb -0.10 -1.45 0.03 0.00 0.00 0.00 0.00 36.38 34.87 2h1h s VAL 258 CO 0.01 0.47 0.46 -0.94 0.00 0.00 0.00 175.10 175.10 2h1h s SER 259 N 0.34 -0.25 0.63 3.32 1.04 0.19 -0.60 113.70 118.36 2h1h s SER 259 Ca -0.13 -0.41 -0.05 0.00 0.48 0.00 0.00 55.95 55.84 2h1h s SER 259 Cb -0.16 0.53 0.03 0.00 0.10 0.00 0.00 66.02 66.53 2h1h s SER 259 CO 0.06 -0.96 0.92 0.68 0.98 0.00 0.00 173.24 174.92 2h1h s VAL 260 N -3.84 2.92 -1.03 5.02 -7.23 -0.67 0.51 120.40 116.09 2h1h s VAL 260 Ca 0.07 -0.24 -0.23 0.00 -1.81 0.00 0.00 61.98 59.77 2h1h s VAL 260 Cb 0.00 -3.19 -0.01 0.00 0.56 0.00 0.00 36.38 33.74 2h1h s VAL 260 CO -0.07 -0.19 1.78 -0.62 -0.31 0.00 0.00 175.10 175.69 2h1h s ASP 261 N -4.41 5.70 0.19 4.85 2.15 -1.25 -4.73 116.67 119.17 2h1h s ASP 261 Ca 0.57 -1.25 -0.05 0.00 0.43 0.00 0.00 52.55 52.25 2h1h s ASP 261 Cb -0.11 -2.57 -0.03 0.00 -0.30 0.00 0.00 42.92 39.92 2h1h s ASP 261 CO 0.44 -2.28 0.23 0.28 -0.17 0.00 0.00 175.17 173.67 2h1h s THR 262 N 8.15 0.03 0.22 1.71 -1.32 -1.26 -4.96 115.64 118.21 2h1h s THR 262 Ca 0.61 -1.74 -0.09 0.00 -1.21 0.00 0.00 61.69 59.26 2h1h s THR 262 Cb -0.03 -2.25 0.21 0.00 -1.51 0.00 0.00 72.50 68.92 2h1h s THR 262 CO -0.00 -0.12 1.67 1.23 -2.21 0.00 0.00 174.62 175.19 2h1h h GLY 263 N 2.56 0.78 2.00 6.08 0.00 -1.92 0.55 103.07 113.12 2h1h h GLY 263 Ca -0.33 0.04 0.00 0.00 0.00 0.00 0.00 47.33 47.04 2h1h h GLY 263 CO 0.49 -0.19 0.00 1.41 0.00 0.00 0.00 176.54 178.24 2h1h h LEU 264 N 0.17 0.00 -0.02 3.11 4.07 -1.95 0.99 115.31 121.69 2h1h h LEU 264 Ca 0.35 0.00 -0.23 0.00 0.08 0.00 0.00 57.88 58.08 2h1h h LEU 264 Cb 0.58 0.00 0.02 0.00 1.08 0.00 0.00 40.66 42.33 2h1h h LEU 264 CO -0.51 0.00 -0.88 -1.28 -1.08 0.00 0.00 178.44 174.68 2h1h h SER 265 N 0.00 0.81 -0.07 -0.43 0.87 -1.17 -0.38 113.55 113.17 2h1h h SER 265 Ca 0.00 -0.73 -0.07 0.00 -1.23 0.00 0.00 61.79 59.76 2h1h h SER 265 Cb 0.08 -0.25 -0.01 0.00 -0.44 0.00 0.00 62.40 61.78 2h1h h SER 265 CO 0.00 1.43 -0.15 0.45 -0.53 0.00 0.00 176.83 178.03 2h1h h HIS 266 N 0.26 0.45 -0.53 2.24 3.86 -0.76 -1.22 115.15 119.45 2h1h h HIS 266 Ca -0.11 -0.07 -0.02 0.00 -1.16 0.00 0.00 60.37 59.02 2h1h h HIS 266 Cb 1.55 -0.12 -0.02 0.00 1.06 0.00 0.00 27.41 29.88 2h1h h HIS 266 CO 0.11 0.56 0.26 1.25 0.86 0.00 0.00 177.93 180.97 2h1h h LEU 267 N 0.39 0.69 -0.57 2.43 5.85 -0.73 0.20 115.31 123.57 2h1h h LEU 267 Ca 0.07 -0.13 0.02 0.00 0.84 0.00 0.00 57.88 58.69 2h1h h LEU 267 Cb 0.50 -0.18 -0.04 0.00 0.37 0.00 0.00 40.66 41.31 2h1h h LEU 267 CO 0.03 0.63 0.35 0.74 -0.34 0.00 0.00 178.44 179.85 2h1h h THR 268 N 0.71 1.08 -0.27 1.05 2.02 -0.15 -1.14 112.91 116.21 2h1h h THR 268 Ca 0.18 -0.24 -0.00 0.00 0.77 0.00 0.00 66.41 67.12 2h1h h THR 268 Cb 0.11 0.31 -0.01 0.00 -1.74 0.00 0.00 68.15 66.82 2h1h h THR 268 CO -0.02 0.13 0.16 0.00 0.37 0.00 0.00 175.52 176.15 2h1h h ALA 269 N 1.24 0.35 0.00 6.16 0.00 -0.64 -1.40 119.26 124.98 2h1h h ALA 269 Ca 0.23 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.08 2h1h h ALA 269 Cb 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.68 2h1h h ALA 269 CO -0.09 -0.13 0.04 0.00 0.00 0.00 0.00 179.25 179.06 2h1h h ALA 270 N 1.04 1.03 -0.33 0.00 0.00 0.28 0.13 119.26 121.42 2h1h h ALA 270 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.01 2h1h h ALA 270 Cb 0.04 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.83 2h1h h ALA 270 CO -0.02 -0.03 0.00 1.28 0.00 0.00 0.00 179.25 180.48 2h1h n LEU 271 N -2.71 3.16 -3.69 0.00 4.77 -0.52 -4.56 117.00 113.45 2h1h n LEU 271 Ca -0.02 -1.33 -0.27 0.00 -0.03 0.00 0.00 56.01 54.36 2h1h n LEU 271 Cb 0.09 -0.21 0.05 0.00 -2.33 0.00 0.00 43.42 41.02 2h1h n LEU 271 CO 0.15 0.67 0.17 -0.67 -1.33 0.00 0.00 177.39 176.37 2h1h n ASP 272 N 1.31 -5.67 -4.63 -1.43 2.03 0.45 -4.86 116.55 103.74 2h1h n ASP 272 Ca 0.19 -0.62 -0.35 0.00 0.52 0.00 0.00 54.79 54.53 2h1h n ASP 272 Cb 0.57 -4.49 -0.10 0.00 -0.72 0.00 0.00 41.12 36.37 2h1h n ASP 272 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 2h1h s ARG 273 N -6.40 3.78 0.17 -0.67 1.81 -1.07 -5.05 118.95 111.51 2h1h s ARG 273 Ca 0.60 -0.37 -0.33 0.00 -1.72 0.00 0.00 55.73 53.91 2h1h s ARG 273 Cb -0.28 -3.11 -0.15 0.00 -0.45 0.00 0.00 34.95 30.95 2h1h s ARG 273 CO 0.74 0.35 1.28 -2.30 -0.68 0.00 0.00 175.30 174.69 2h1h n PRO 274 N 3.27 1.40 -3.75 3.54 -0.02 -1.26 -4.58 135.00 133.60 2h1h n PRO 274 Ca -0.17 0.50 -0.14 0.00 -2.02 0.00 0.00 63.50 61.67 2h1h n PRO 274 Cb 0.53 -2.08 -0.15 0.00 -0.02 0.00 0.00 33.50 31.78 2h1h n PRO 274 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 2h1h s ASN 275 N 0.22 -0.01 -0.34 2.55 3.04 -0.59 -0.82 114.94 119.00 2h1h s ASN 275 Ca 0.75 0.24 -0.05 0.00 0.04 0.00 0.00 52.86 53.83 2h1h s ASN 275 Cb -0.82 0.12 0.05 0.00 -1.54 0.00 0.00 41.25 39.06 2h1h s ASN 275 CO 0.49 -0.15 0.10 -0.63 -3.04 0.00 0.00 177.10 173.87 2h1h s ILE 276 N 1.22 3.57 -0.23 -5.21 1.09 0.12 -0.00 121.20 121.76 2h1h s ILE 276 Ca -0.08 -1.29 -0.09 0.00 -1.10 0.00 0.00 60.65 58.08 2h1h s ILE 276 Cb -0.12 -3.08 -0.05 0.00 -1.06 0.00 0.00 42.46 38.16 2h1h s ILE 276 CO -0.05 -0.23 0.13 -0.89 -0.10 0.00 0.00 174.94 173.80 2h1h s THR 277 N 1.34 5.10 -0.24 2.92 2.01 -0.84 0.53 115.64 126.46 2h1h s THR 277 Ca -0.01 0.09 -0.17 0.00 0.31 0.00 0.00 61.69 61.90 2h1h s THR 277 Cb -0.20 -3.37 -0.03 0.00 0.01 0.00 0.00 72.50 68.91 2h1h s THR 277 CO 0.01 0.36 0.48 0.68 -0.69 0.00 0.00 174.62 175.46 2h1h s VAL 278 N 1.06 5.11 0.10 3.82 -7.23 0.18 -2.12 120.40 121.32 2h1h s VAL 278 Ca 0.06 0.82 0.03 0.00 -1.81 0.00 0.00 61.98 61.09 2h1h s VAL 278 Cb -0.14 -3.80 -0.04 0.00 0.56 0.00 0.00 36.38 32.97 2h1h s VAL 278 CO 0.04 0.14 0.10 -0.31 -0.31 0.00 0.00 175.10 174.76 2h1h s TYR 279 N 2.01 3.20 0.00 2.82 1.51 -0.60 -3.91 117.35 122.39 2h1h s TYR 279 Ca 0.20 0.07 0.00 0.00 -1.01 0.00 0.00 57.07 56.33 2h1h s TYR 279 Cb -0.15 -1.61 0.00 0.00 -0.11 0.00 0.00 41.96 40.09 2h1h s TYR 279 CO 0.09 0.52 0.00 0.41 -1.11 0.00 0.00 175.55 175.47 2h1h n GLY 280 N 0.27 1.41 0.37 0.71 0.00 -1.26 -2.79 105.19 103.89 2h1h n GLY 280 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.94 2h1h n GLY 280 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2h1h n PRO 281 N 0.00 1.08 -3.93 1.61 -0.02 -1.11 -4.67 135.00 127.95 2h1h n PRO 281 Ca 0.00 -0.07 -0.31 0.00 -2.02 0.00 0.00 63.50 61.10 2h1h n PRO 281 Cb 0.00 -1.35 -0.04 0.00 -0.02 0.00 0.00 33.50 32.09 2h1h n PRO 281 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 2h1h s THR 282 N -1.35 5.36 -0.21 3.45 -4.23 -1.26 -5.10 115.64 112.29 2h1h s THR 282 Ca 0.01 -0.42 -0.07 0.00 -1.18 0.00 0.00 61.69 60.04 2h1h s THR 282 Cb 0.01 -3.62 -0.03 0.00 1.34 0.00 0.00 72.50 70.20 2h1h s THR 282 CO 0.01 0.13 0.06 -0.62 -0.54 0.00 0.00 174.62 173.65 2h1h s ASP 283 N -2.53 5.29 1.01 3.99 -1.08 -1.26 -4.98 116.67 117.11 2h1h s ASP 283 Ca 0.35 -0.09 -0.14 0.00 -0.52 0.00 0.00 52.55 52.15 2h1h s ASP 283 Cb -0.13 -1.93 0.19 0.00 -1.46 0.00 0.00 42.92 39.60 2h1h s ASP 283 CO 0.28 0.06 1.14 -2.84 0.52 0.00 0.00 175.17 174.33 2h1h s PRO 284 N 1.02 0.34 -0.05 4.34 0.02 -1.26 -5.20 135.00 134.21 2h1h s PRO 284 Ca 0.04 0.17 0.02 0.00 0.02 0.00 0.00 61.00 61.25 2h1h s PRO 284 Cb -0.14 -1.76 0.02 0.00 0.02 0.00 0.00 34.50 32.64 2h1h s PRO 284 CO 0.03 -2.72 -0.07 -0.47 -0.33 0.00 0.00 177.00 173.44 2h1h s TYR 290 N -3.21 0.97 0.24 6.54 5.04 -1.26 -5.16 117.35 120.50 2h1h s TYR 290 Ca 0.67 -0.30 0.00 0.00 -2.44 0.00 0.00 57.07 55.00 2h1h s TYR 290 Cb -0.13 -0.78 0.00 0.00 0.35 0.00 0.00 41.96 41.40 2h1h s TYR 290 CO 0.55 -0.21 0.00 0.41 -1.34 0.00 0.00 175.55 174.96 2h1h n GLY 291 N 3.91 -2.00 1.83 8.97 0.00 -1.26 -4.83 105.19 111.81 2h1h n GLY 291 Ca -0.24 -1.26 -0.25 0.00 0.00 0.00 0.00 46.02 44.27 2h1h n GLY 291 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2h1h n LYS 292 N -3.32 0.00 0.00 1.61 5.02 -1.26 -2.78 118.16 117.43 2h1h n LYS 292 Ca 0.01 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.30 2h1h n LYS 292 Cb 0.47 -0.54 0.00 0.00 -0.02 0.00 0.00 35.03 34.94 2h1h n LYS 292 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2h1h n ASN 293 N 1.18 0.00 -4.57 4.39 4.13 -1.26 -4.97 115.26 114.15 2h1h n ASN 293 Ca 0.08 0.00 -0.41 0.00 1.68 0.00 0.00 54.58 55.93 2h1h n ASN 293 Cb 0.17 0.00 -0.07 0.00 -1.54 0.00 0.00 39.78 38.35 2h1h n ASN 293 CO 0.00 0.00 0.00 -1.10 0.28 0.00 0.00 177.26 176.44 2h1h s GLN 294 N -0.25 3.72 -0.11 3.52 -1.52 -1.12 -1.54 119.66 122.37 2h1h s GLN 294 Ca 0.00 0.06 -0.01 0.00 -1.95 0.00 0.00 55.36 53.46 2h1h s GLN 294 Cb 0.00 -3.79 -0.03 0.00 -0.22 0.00 0.00 33.01 28.97 2h1h s GLN 294 CO 0.00 -0.67 -0.05 -1.64 -0.25 0.00 0.00 175.29 172.68 2h1h s MET 295 N 2.61 3.16 -0.30 2.91 -1.94 1.00 -4.96 119.30 121.78 2h1h s MET 295 Ca 0.23 -0.52 -0.12 0.00 -1.71 0.00 0.00 55.69 53.57 2h1h s MET 295 Cb -0.15 -2.75 -0.04 0.00 2.01 0.00 0.00 34.83 33.91 2h1h s MET 295 CO 0.14 0.49 0.22 0.08 -0.01 0.00 0.00 175.02 175.95 2h1h s VAL 296 N -0.34 5.29 -0.35 -6.03 1.01 -1.26 -1.98 120.40 116.74 2h1h s VAL 296 Ca 0.05 0.08 -0.02 0.00 0.00 0.00 0.00 61.98 62.10 2h1h s VAL 296 Cb -0.12 -3.61 0.08 0.00 0.00 0.00 0.00 36.38 32.73 2h1h s VAL 296 CO 0.02 0.15 0.10 0.00 0.00 0.00 0.00 175.10 175.38 2h1h s ARG 298 N 1.16 4.27 0.38 0.00 0.52 -1.26 -1.55 118.95 122.46 2h1h s ARG 298 Ca 0.03 0.78 -0.17 0.00 -0.52 0.00 0.00 55.73 55.85 2h1h s ARG 298 Cb -0.21 -3.27 -0.10 0.00 0.52 0.00 0.00 34.95 31.90 2h1h s ARG 298 CO -0.03 0.57 0.84 0.00 0.02 0.00 0.00 175.30 176.69 2h1h s ALA 299 N -0.89 3.19 0.13 2.13 0.00 -1.12 -4.95 121.76 120.25 2h1h s ALA 299 Ca 0.30 0.18 -0.31 0.00 0.00 0.00 0.00 51.96 52.13 2h1h s ALA 299 Cb -0.20 -2.94 -0.09 0.00 0.00 0.00 0.00 23.12 19.89 2h1h s ALA 299 CO 0.19 0.20 1.50 -2.14 0.00 0.00 0.00 175.76 175.51 2h1h s PRO 300 N -3.18 4.25 0.00 0.00 0.02 -1.26 -1.18 135.00 133.66 2h1h s PRO 300 Ca 0.57 2.24 0.00 0.00 0.02 0.00 0.00 61.00 63.83 2h1h s PRO 300 Cb -0.10 -3.25 0.00 0.00 0.02 0.00 0.00 34.50 31.17 2h1h s PRO 300 CO 0.17 -0.56 0.00 0.41 -0.33 0.00 0.00 177.00 176.70 2h1h n GLY 301 N 3.68 0.34 2.44 0.52 0.00 -1.26 -2.95 105.19 107.95 2h1h n GLY 301 Ca 0.13 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.00 2h1h n GLY 301 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2h1h n ASN 302 N -0.34 -4.83 -3.98 1.61 5.03 -0.32 -4.98 115.26 107.43 2h1h n ASN 302 Ca 0.00 0.37 -0.30 0.00 0.87 0.00 0.00 54.58 55.52 2h1h n ASN 302 Cb 0.17 -3.69 -0.16 0.00 -1.02 0.00 0.00 39.78 35.09 2h1h n ASN 302 CO 0.00 0.00 0.00 -1.83 -1.83 0.00 0.00 177.26 173.60 2h1h s GLU 303 N -3.33 1.96 0.61 3.52 -1.05 -1.15 -2.76 118.70 116.49 2h1h s GLU 303 Ca 0.00 -0.83 0.27 0.00 -0.15 0.00 0.00 54.97 54.26 2h1h s GLU 303 Cb 0.00 -2.39 1.24 0.00 -0.44 0.00 0.00 34.13 32.54 2h1h s GLU 303 CO 0.00 -0.44 1.66 -0.07 0.95 0.00 0.00 175.26 177.36 2h1h h LEU 304 N 7.98 0.00 -1.32 1.83 3.38 -1.82 0.80 115.31 126.17 2h1h h LEU 304 Ca -0.27 0.00 0.12 0.00 0.09 0.00 0.00 57.88 57.82 2h1h h LEU 304 Cb 1.10 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.78 2h1h h LEU 304 CO 0.47 0.00 0.55 0.28 0.09 0.00 0.00 178.44 179.83 2h1h h SER 305 N 0.00 0.65 0.02 -0.43 0.02 -1.94 -1.14 113.55 110.74 2h1h h SER 305 Ca 0.26 0.03 0.00 0.00 -0.84 0.00 0.00 61.79 61.24 2h1h h SER 305 Cb 1.72 -0.10 0.00 0.00 0.14 0.00 0.00 62.40 64.16 2h1h h SER 305 CO -0.00 0.36 -0.03 0.00 -1.14 0.00 0.00 176.83 176.02 2h1h n GLN 306 N -4.53 1.47 -2.98 3.45 6.02 0.28 -4.78 117.38 116.30 2h1h n GLN 306 Ca 0.15 -0.78 -0.44 0.00 -0.01 0.00 0.00 57.00 55.93 2h1h n GLN 306 Cb 0.40 -1.48 -0.04 0.00 1.02 0.00 0.00 30.24 30.14 2h1h n GLN 306 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 177.06 174.88 2h1h s LEU 307 N -2.06 4.75 0.83 1.08 2.96 -0.43 -4.60 118.68 121.21 2h1h s LEU 307 Ca 0.38 -1.03 -0.11 0.00 -0.22 0.00 0.00 54.13 53.14 2h1h s LEU 307 Cb 0.21 -2.44 0.09 0.00 0.50 0.00 0.00 46.19 44.55 2h1h s LEU 307 CO 0.36 -1.22 1.09 0.42 -1.32 0.00 0.00 176.35 175.68 2h1h s THR 308 N 3.39 3.00 0.10 3.68 -4.23 -1.26 -4.93 115.64 115.39 2h1h s THR 308 Ca 0.19 0.32 -0.15 0.00 -1.18 0.00 0.00 61.69 60.87 2h1h s THR 308 Cb -0.19 -2.86 -0.07 0.00 1.34 0.00 0.00 72.50 70.72 2h1h s THR 308 CO 0.10 -0.42 1.46 0.00 -0.54 0.00 0.00 174.62 175.22 2h1h h ALA 309 N -1.31 0.44 -0.29 3.99 0.00 -1.95 -2.42 119.26 117.73 2h1h h ALA 309 Ca -0.47 -0.35 0.06 0.00 0.00 0.00 0.00 54.91 54.16 2h1h h ALA 309 Cb 1.26 -0.11 -0.06 0.00 0.00 0.00 0.00 17.79 18.89 2h1h h ALA 309 CO 0.54 0.37 -0.10 -0.91 0.00 0.00 0.00 179.25 179.15 2h1h h ASN 310 N 0.43 -0.35 -0.97 0.00 2.35 -1.93 0.33 115.58 115.44 2h1h h ASN 310 Ca 0.07 0.10 0.06 0.00 -0.55 0.00 0.00 56.30 55.98 2h1h h ASN 310 Cb 0.71 0.21 -0.06 0.00 0.05 0.00 0.00 38.32 39.23 2h1h h ASN 310 CO 0.05 -0.13 0.63 0.00 -1.65 0.00 0.00 177.43 176.33 2h1h h ALA 311 N 1.22 1.44 -0.18 -0.83 0.00 -1.92 0.35 119.26 119.34 2h1h h ALA 311 Ca 0.14 -0.02 -0.12 0.00 0.00 0.00 0.00 54.91 54.91 2h1h h ALA 311 Cb 0.26 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 17.75 2h1h h ALA 311 CO -0.32 0.42 -0.37 0.28 0.00 0.00 0.00 179.25 179.26 2h1h h VAL 312 N 1.13 1.34 -0.25 0.00 2.07 -0.77 -1.56 116.25 118.20 2h1h h VAL 312 Ca 0.42 -1.61 0.00 0.00 0.82 0.00 0.00 66.70 66.33 2h1h h VAL 312 Cb 0.17 1.91 -0.01 0.00 -1.52 0.00 0.00 31.29 31.84 2h1h h VAL 312 CO -0.16 0.49 0.16 0.50 0.02 0.00 0.00 177.57 178.58 2h1h h LYS 313 N 0.23 0.34 -0.24 1.57 3.64 0.31 -0.18 116.57 122.24 2h1h h LYS 313 Ca 0.01 -0.02 0.03 0.00 -1.27 0.00 0.00 60.65 59.39 2h1h h LYS 313 Cb 0.97 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 32.70 2h1h h LYS 313 CO 0.08 0.24 0.16 0.37 -2.27 0.00 0.00 179.45 178.04 2h1h h GLN 314 N 0.33 0.21 -0.07 1.90 4.15 -0.32 -1.19 115.11 120.13 2h1h h GLN 314 Ca 0.09 -0.01 -0.01 0.00 0.77 0.00 0.00 58.65 59.49 2h1h h GLN 314 Cb -0.02 -0.05 -0.00 0.00 0.21 0.00 0.00 27.48 27.62 2h1h h GLN 314 CO -0.02 0.14 -0.00 0.35 -1.93 0.00 0.00 178.83 177.37 2h1h h PHE 315 N 0.21 0.13 -0.13 3.99 3.57 -0.12 -0.68 116.94 123.92 2h1h h PHE 315 Ca 0.10 -0.02 0.05 0.00 3.53 0.00 0.00 57.97 61.62 2h1h h PHE 315 Cb 0.14 -0.03 -0.06 0.00 2.79 0.00 0.00 35.95 38.79 2h1h h PHE 315 CO -0.00 0.40 -0.25 0.82 -2.23 0.00 0.00 178.31 177.05 2h1h h ILE 316 N -0.17 0.40 -0.34 1.41 2.04 0.10 -1.06 117.51 119.88 2h1h h ILE 316 Ca 0.02 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.87 2h1h h ILE 316 Cb 0.35 0.40 -0.02 0.00 -0.74 0.00 0.00 36.82 36.81 2h1h h ILE 316 CO 0.00 0.00 0.17 -0.33 0.00 0.00 0.00 178.15 178.00 2h1h h GLU 317 N -0.32 0.49 -0.37 2.37 5.08 -1.41 -2.41 114.58 118.00 2h1h h GLU 317 Ca 0.10 -0.07 0.11 0.00 -1.00 0.00 0.00 59.36 58.50 2h1h h GLU 317 Cb 0.47 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.62 2h1h h GLU 317 CO -0.31 0.43 0.34 1.49 -1.00 0.00 0.00 179.01 179.96 2h1h h GLU 318 N 0.42 0.00 -0.19 2.33 4.81 -0.59 -1.63 114.58 119.73 2h1h h GLU 318 Ca 0.12 0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 59.32 2h1h h GLU 318 Cb 0.10 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.46 2h1h h GLU 318 CO -0.02 0.00 -0.03 0.09 -0.73 0.00 0.00 179.01 178.32 2h1h n ASN 319 N -3.99 3.14 -0.82 1.04 3.02 -0.45 -5.07 115.26 112.12 2h1h n ASN 319 Ca 0.06 -3.19 0.13 0.00 -0.03 0.00 0.00 54.58 51.55 2h1h n ASN 319 Cb 0.51 -0.52 0.22 0.00 -0.61 0.00 0.00 39.78 39.38 2h1h n ASN 319 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64