#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h3f n ALA 2 N 0.00 -1.89 -0.01 0.00 0.00 -1.26 -4.73 120.51 112.62 3h3f n ALA 2 Ca 0.00 -0.55 -0.09 0.00 0.00 0.00 0.00 53.44 52.80 3h3f n ALA 2 Cb 0.00 -0.05 -0.14 0.00 0.00 0.00 0.00 19.45 19.26 3h3f n ALA 2 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 3h3f h LEU 3 N 0.00 0.03 -1.23 0.00 5.85 -2.02 -3.06 115.31 114.88 3h3f h LEU 3 Ca -0.14 -0.06 -0.08 0.00 0.84 0.00 0.00 57.88 58.44 3h3f h LEU 3 Cb 0.48 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.48 3h3f h LEU 3 CO 0.08 1.06 -0.32 0.50 -0.34 0.00 0.00 178.44 179.42 3h3f h LYS 4 N 0.01 0.11 0.00 1.25 3.64 -1.94 -2.70 116.57 116.94 3h3f h LYS 4 Ca -0.27 -0.04 -0.02 0.00 -1.27 0.00 0.00 60.65 59.05 3h3f h LYS 4 Cb 2.00 -0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 33.81 3h3f h LYS 4 CO 0.08 0.43 -1.19 -0.25 -2.27 0.00 0.00 179.45 176.25 3h3f n ASP 5 N -4.13 0.73 0.16 4.20 9.92 -1.25 -1.26 116.55 124.93 3h3f n ASP 5 Ca -0.02 0.29 0.01 0.00 -0.53 0.00 0.00 54.79 54.54 3h3f n ASP 5 Cb 0.39 0.63 0.27 0.00 -0.64 0.00 0.00 41.12 41.77 3h3f n ASP 5 CO 0.00 0.00 0.00 1.56 0.13 0.00 0.00 177.20 178.89 3h3f h GLN 6 N 0.00 0.00 0.00 -1.24 4.20 -1.38 -3.34 115.11 113.34 3h3f h GLN 6 Ca -0.02 0.00 -0.38 0.00 0.06 0.00 0.00 58.65 58.31 3h3f h GLN 6 Cb 1.07 0.00 -0.07 0.00 0.30 0.00 0.00 27.48 28.78 3h3f h GLN 6 CO 0.00 0.48 -2.43 -0.11 -0.67 0.00 0.00 178.83 176.11 3h3f n LEU 7 N -3.96 2.30 -4.00 1.46 7.94 -1.04 -4.94 117.00 114.75 3h3f n LEU 7 Ca -0.02 -0.11 -0.27 0.00 -1.11 0.00 0.00 56.01 54.51 3h3f n LEU 7 Cb 0.50 -0.58 -0.17 0.00 0.53 0.00 0.00 43.42 43.71 3h3f n LEU 7 CO 0.40 0.83 -0.47 -0.63 -1.11 0.00 0.00 177.39 176.41 3h3f s ILE 8 N -2.50 1.27 -0.26 1.96 1.01 -0.39 -5.10 121.20 117.19 3h3f s ILE 8 Ca -0.29 -0.49 -0.16 0.00 0.00 0.00 0.00 60.65 59.71 3h3f s ILE 8 Cb 0.08 -1.20 -0.03 0.00 0.01 0.00 0.00 42.46 41.32 3h3f s ILE 8 CO 0.64 0.40 0.44 -2.28 0.00 0.00 0.00 174.94 174.14 3h3f s HIS 9 N 1.17 3.26 -0.21 3.97 5.65 -1.26 -4.30 115.29 123.57 3h3f s HIS 9 Ca -0.04 0.52 -0.21 0.00 0.25 0.00 0.00 55.06 55.58 3h3f s HIS 9 Cb -0.14 -2.63 -0.02 0.00 -1.18 0.00 0.00 32.58 28.60 3h3f s HIS 9 CO -0.03 -0.24 0.65 1.21 -0.65 0.00 0.00 174.74 175.68 3h3f s ASN 10 N 1.56 6.68 0.00 9.88 2.47 -1.26 -4.92 114.94 129.35 3h3f s ASN 10 Ca 0.18 0.83 0.23 0.00 0.42 0.00 0.00 52.86 54.52 3h3f s ASN 10 Cb -0.16 -2.35 0.23 0.00 -1.45 0.00 0.00 41.25 37.52 3h3f s ASN 10 CO 0.09 -0.31 1.26 0.18 -3.72 0.00 0.00 177.10 174.61 3h3f n LEU 11 N 5.21 3.03 -3.70 3.21 4.77 -1.26 -5.00 117.00 123.26 3h3f n LEU 11 Ca -0.01 -1.11 -0.13 0.00 -0.03 0.00 0.00 56.01 54.73 3h3f n LEU 11 Cb 0.49 -0.05 -0.09 0.00 -2.33 0.00 0.00 43.42 41.44 3h3f n LEU 11 CO 0.44 0.55 0.17 -0.22 -1.33 0.00 0.00 177.39 177.00 3h3f s LEU 12 N -1.81 0.09 -0.21 2.23 2.96 -1.26 -5.14 118.68 115.52 3h3f s LEU 12 Ca 0.29 1.00 -0.16 0.00 -0.22 0.00 0.00 54.13 55.05 3h3f s LEU 12 Cb 0.20 1.70 -0.04 0.00 0.50 0.00 0.00 46.19 48.55 3h3f s LEU 12 CO 0.29 -0.17 0.40 -0.75 -1.32 0.00 0.00 176.35 174.80 3h3f s LYS 13 N 0.32 4.15 -0.74 1.98 2.20 -1.26 -5.03 119.74 121.36 3h3f s LYS 13 Ca -0.00 0.18 -0.15 0.00 -0.36 0.00 0.00 55.97 55.64 3h3f s LYS 13 Cb -0.04 -3.56 0.19 0.00 -1.51 0.00 0.00 37.83 32.91 3h3f s LYS 13 CO -0.00 -0.09 0.69 -2.00 -0.36 0.00 0.00 175.35 173.59 3h3f s GLU 14 N 1.46 3.41 -1.43 4.03 2.56 -1.26 -4.96 118.70 122.51 3h3f s GLU 14 Ca 0.18 -2.21 -0.11 0.00 0.00 0.00 0.00 54.97 52.83 3h3f s GLU 14 Cb -0.15 -4.39 0.06 0.00 2.00 0.00 0.00 34.13 31.65 3h3f s GLU 14 CO 0.08 -1.31 2.29 -0.85 -0.56 0.00 0.00 175.26 174.91 3h3f n GLU 15 N 4.43 3.40 -1.55 4.30 0.28 -1.26 -4.97 120.64 125.27 3h3f n GLU 15 Ca 0.05 -2.87 -0.46 0.00 -0.16 0.00 0.00 57.16 53.72 3h3f n GLU 15 Cb 0.45 -3.03 -0.05 0.00 1.43 0.00 0.00 31.44 30.24 3h3f n GLU 15 CO 0.00 0.00 0.00 1.58 -0.16 0.00 0.00 177.13 178.55 3h3f n HIS 16 N 4.57 1.87 -4.31 -1.84 -0.00 -1.26 -4.98 115.22 109.26 3h3f n HIS 16 Ca 0.55 0.02 -0.34 0.00 0.46 0.00 0.00 57.72 58.41 3h3f n HIS 16 Cb 0.34 -2.65 -0.11 0.00 -0.12 0.00 0.00 29.99 27.44 3h3f n HIS 16 CO 0.00 0.00 0.00 0.54 0.46 0.00 0.00 176.34 177.34 3h3f s VAL 17 N 7.61 4.10 0.28 3.57 0.11 -1.26 -5.11 120.40 129.71 3h3f s VAL 17 Ca 1.03 -0.28 -0.17 0.00 -2.93 0.00 0.00 61.98 59.63 3h3f s VAL 17 Cb -0.55 -2.81 -0.09 0.00 -1.53 0.00 0.00 36.38 31.40 3h3f s VAL 17 CO 0.41 0.49 0.74 -2.16 -3.33 0.00 0.00 175.10 171.25 3h3f s PRO 18 N 0.32 4.12 -0.18 1.54 0.04 -1.26 -4.99 135.00 134.59 3h3f s PRO 18 Ca -0.02 0.78 0.17 0.00 0.04 0.00 0.00 61.00 61.97 3h3f s PRO 18 Cb -0.14 -2.62 -0.24 0.00 0.04 0.00 0.00 34.50 31.54 3h3f s PRO 18 CO 0.02 0.25 0.09 1.04 0.04 0.00 0.00 177.00 178.44 3h3f n GLN 19 N 0.09 0.81 -3.07 4.56 1.13 -1.26 -4.66 117.38 114.99 3h3f n GLN 19 Ca 0.01 -0.02 -0.16 0.00 -1.94 0.00 0.00 57.00 54.89 3h3f n GLN 19 Cb 0.52 -1.50 -0.02 0.00 0.11 0.00 0.00 30.24 29.36 3h3f n GLN 19 CO 0.00 0.00 0.00 0.09 -1.44 0.00 0.00 177.06 175.71 3h3f n ASN 20 N -2.70 0.99 -4.87 1.08 3.02 -1.26 -4.94 115.26 106.58 3h3f n ASN 20 Ca -0.30 -2.94 -0.31 0.00 -0.03 0.00 0.00 54.58 50.99 3h3f n ASN 20 Cb 1.11 -0.60 -0.05 0.00 -0.61 0.00 0.00 39.78 39.63 3h3f n ASN 20 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 3h3f s LYS 21 N -2.59 3.83 0.00 3.52 2.20 -1.26 -1.76 119.74 123.68 3h3f s LYS 21 Ca 0.37 0.42 0.01 0.00 -0.36 0.00 0.00 55.97 56.42 3h3f s LYS 21 Cb 0.38 -2.50 -0.01 0.00 -1.51 0.00 0.00 37.83 34.19 3h3f s LYS 21 CO -0.05 0.14 -0.05 0.42 -0.36 0.00 0.00 175.35 175.45 3h3f s ILE 22 N -2.08 0.35 0.00 5.43 1.01 -0.39 -1.43 121.20 124.09 3h3f s ILE 22 Ca 0.50 -0.32 0.06 0.00 0.00 0.00 0.00 60.65 60.89 3h3f s ILE 22 Cb -0.11 -0.33 -0.03 0.00 0.01 0.00 0.00 42.46 42.01 3h3f s ILE 22 CO 0.24 0.01 -0.17 -0.89 0.00 0.00 0.00 174.94 174.13 3h3f s THR 23 N -0.31 2.81 -0.17 2.92 2.01 -0.68 -1.42 115.64 120.80 3h3f s THR 23 Ca -0.00 -1.01 0.00 0.00 0.31 0.00 0.00 61.69 60.99 3h3f s THR 23 Cb -0.03 -2.13 0.01 0.00 0.01 0.00 0.00 72.50 70.35 3h3f s THR 23 CO -0.00 0.45 -0.17 -0.69 -0.69 0.00 0.00 174.62 173.53 3h3f s VAL 24 N -0.82 2.43 -0.28 3.82 1.01 0.19 -1.96 120.40 124.79 3h3f s VAL 24 Ca 0.13 -0.83 -0.12 0.00 0.00 0.00 0.00 61.98 61.15 3h3f s VAL 24 Cb -0.10 -2.03 -0.04 0.00 0.00 0.00 0.00 36.38 34.21 3h3f s VAL 24 CO 0.03 0.52 0.25 -0.69 0.00 0.00 0.00 175.10 175.20 3h3f s VAL 25 N 1.04 5.27 0.00 2.92 1.01 0.21 -1.82 120.40 129.03 3h3f s VAL 25 Ca -0.01 0.25 0.00 0.00 0.00 0.00 0.00 61.98 62.21 3h3f s VAL 25 Cb -0.15 -3.59 0.00 0.00 0.00 0.00 0.00 36.38 32.64 3h3f s VAL 25 CO -0.05 0.20 0.00 0.61 0.00 0.00 0.00 175.10 175.86 3h3f n GLY 26 N 4.96 0.89 2.15 4.51 0.00 0.14 -0.44 105.19 117.40 3h3f n GLY 26 Ca -0.12 -1.19 -0.27 0.00 0.00 0.00 0.00 46.02 44.44 3h3f n GLY 26 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3h3f n VAL 27 N 2.69 2.82 -1.26 1.61 0.24 -1.26 -4.23 118.33 118.94 3h3f n VAL 27 Ca 0.00 -3.96 0.00 0.00 -2.04 0.00 0.00 64.34 58.34 3h3f n VAL 27 Cb 0.00 -1.16 0.00 0.00 -1.47 0.00 0.00 33.84 31.21 3h3f n VAL 27 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3h3f n GLY 28 N -0.74 -0.45 0.36 7.63 0.00 -1.26 -4.53 105.19 106.20 3h3f n GLY 28 Ca 0.49 -1.76 0.04 0.00 0.00 0.00 0.00 46.02 44.79 3h3f n GLY 28 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h3f h ALA 29 N -1.53 1.55 -0.17 4.61 0.00 -1.94 0.00 119.26 121.78 3h3f h ALA 29 Ca 0.00 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.85 3h3f h ALA 29 Cb 0.00 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 17.53 3h3f h ALA 29 CO 0.00 0.32 -0.05 0.28 0.00 0.00 0.00 179.25 179.80 3h3f h VAL 30 N 0.97 1.30 -0.16 0.00 2.07 -1.89 -2.61 116.25 115.93 3h3f h VAL 30 Ca 0.37 -1.05 -0.16 0.00 0.82 0.00 0.00 66.70 66.68 3h3f h VAL 30 Cb 0.20 1.64 -0.01 0.00 -1.52 0.00 0.00 31.29 31.61 3h3f h VAL 30 CO -0.14 0.31 -0.57 1.23 0.02 0.00 0.00 177.57 178.43 3h3f h GLY 31 N 0.03 0.55 2.00 2.17 0.00 -1.60 -1.54 103.07 104.68 3h3f h GLY 31 Ca 0.04 -0.65 0.00 0.00 0.00 0.00 0.00 47.33 46.72 3h3f h GLY 31 CO 0.02 0.59 0.00 1.03 0.00 0.00 0.00 176.54 178.18 3h3f n MET 32 N -3.94 0.14 -0.01 4.80 0.00 -0.06 -1.71 117.12 116.34 3h3f n MET 32 Ca -0.03 0.32 -0.07 0.00 0.00 0.00 0.00 57.70 57.92 3h3f n MET 32 Cb 0.61 -1.73 -0.13 0.00 0.00 0.00 0.00 33.22 31.97 3h3f n MET 32 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 3h3f n ALA 33 N -1.68 1.60 -0.09 3.04 0.00 -0.86 -2.95 120.51 119.57 3h3f n ALA 33 Ca 0.03 -0.71 -0.12 0.00 0.00 0.00 0.00 53.44 52.64 3h3f n ALA 33 Cb 0.25 -0.88 -0.05 0.00 0.00 0.00 0.00 19.45 18.78 3h3f n ALA 33 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3h3f h ALA 35 N 0.75 -0.32 -0.07 0.00 0.00 -1.44 0.15 119.26 118.33 3h3f h ALA 35 Ca 0.06 0.03 -0.15 0.00 0.00 0.00 0.00 54.91 54.85 3h3f h ALA 35 Cb 0.57 0.58 -0.01 0.00 0.00 0.00 0.00 17.79 18.93 3h3f h ALA 35 CO 0.03 -0.77 -0.63 0.97 0.00 0.00 0.00 179.25 178.85 3h3f h ILE 36 N -0.36 1.39 -0.27 0.00 6.09 -1.62 0.77 117.51 123.50 3h3f h ILE 36 Ca 0.10 -2.02 -0.09 0.00 -1.37 0.00 0.00 64.86 61.48 3h3f h ILE 36 Cb 0.52 2.03 -0.01 0.00 0.47 0.00 0.00 36.82 39.84 3h3f h ILE 36 CO -0.36 0.60 -0.17 0.28 -3.07 0.00 0.00 178.15 175.43 3h3f h SER 37 N 0.19 0.61 -0.43 2.19 0.02 -1.36 0.23 113.55 115.01 3h3f h SER 37 Ca -0.01 -0.43 0.04 0.00 -0.84 0.00 0.00 61.79 60.55 3h3f h SER 37 Cb 1.15 -0.17 -0.04 0.00 0.14 0.00 0.00 62.40 63.47 3h3f h SER 37 CO 0.10 0.91 0.19 0.40 -1.14 0.00 0.00 176.83 177.29 3h3f h ILE 38 N 0.32 0.93 -0.64 3.27 2.04 -0.61 -2.27 117.51 120.55 3h3f h ILE 38 Ca 0.06 -0.13 -0.01 0.00 1.00 0.00 0.00 64.86 65.78 3h3f h ILE 38 Cb 0.70 0.51 -0.03 0.00 -0.74 0.00 0.00 36.82 37.25 3h3f h ILE 38 CO 0.05 0.07 0.36 -0.07 0.00 0.00 0.00 178.15 178.56 3h3f h LEU 39 N 0.38 0.78 0.00 1.44 3.38 -0.65 -2.27 115.31 118.36 3h3f h LEU 39 Ca 0.19 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.11 3h3f h LEU 39 Cb 0.14 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.69 3h3f h LEU 39 CO -0.16 0.62 0.00 0.23 0.09 0.00 0.00 178.44 179.22 3h3f n MET 40 N -4.39 0.06 -0.15 1.13 2.81 0.80 -2.99 117.12 114.39 3h3f n MET 40 Ca 0.06 0.05 0.09 0.00 -1.81 0.00 0.00 57.70 56.09 3h3f n MET 40 Cb 0.09 -1.50 0.17 0.00 -0.71 0.00 0.00 33.22 31.27 3h3f n MET 40 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 3h3f n LYS 41 N -1.47 2.20 -3.75 0.03 5.02 -0.87 -4.98 118.16 114.35 3h3f n LYS 41 Ca 0.07 -2.03 -0.24 0.00 -2.02 0.00 0.00 58.31 54.10 3h3f n LYS 41 Cb 0.29 -1.41 0.02 0.00 -0.02 0.00 0.00 35.03 33.92 3h3f n LYS 41 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 3h3f n ASP 42 N 1.14 -1.71 -0.03 4.39 8.00 -1.13 -4.89 116.55 122.31 3h3f n ASP 42 Ca 0.15 -0.89 -0.11 0.00 0.71 0.00 0.00 54.79 54.65 3h3f n ASP 42 Cb 0.51 -3.74 -0.14 0.00 -0.02 0.00 0.00 41.12 37.73 3h3f n ASP 42 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 3h3f n LEU 43 N -4.25 1.03 -4.55 0.64 4.77 -1.23 -4.99 117.00 108.42 3h3f n LEU 43 Ca -0.27 0.32 -0.24 0.00 -0.03 0.00 0.00 56.01 55.79 3h3f n LEU 43 Cb 0.67 0.02 -0.09 0.00 -2.33 0.00 0.00 43.42 41.69 3h3f n LEU 43 CO 0.70 0.48 -0.41 0.00 -1.33 0.00 0.00 177.39 176.82 3h3f s ALA 44 N -2.58 2.93 -1.85 -1.18 0.00 -1.26 -4.95 121.76 112.87 3h3f s ALA 44 Ca -0.08 -1.73 0.18 0.00 0.00 0.00 0.00 51.96 50.33 3h3f s ALA 44 Cb 0.08 -0.53 0.38 0.00 0.00 0.00 0.00 23.12 23.04 3h3f s ALA 44 CO 0.81 0.30 1.30 -0.40 0.00 0.00 0.00 175.76 177.78 3h3f n ASP 45 N -0.61 3.18 -3.64 0.00 5.68 -0.72 -4.64 116.55 115.79 3h3f n ASP 45 Ca -0.07 -1.92 -0.07 0.00 -0.50 0.00 0.00 54.79 52.24 3h3f n ASP 45 Cb 0.59 -0.24 -0.07 0.00 -1.14 0.00 0.00 41.12 40.26 3h3f n ASP 45 CO 0.00 0.00 0.00 -0.70 -1.33 0.00 0.00 177.20 175.17 3h3f s GLU 46 N -1.21 0.43 -0.15 0.11 2.12 -1.26 -3.81 118.70 114.93 3h3f s GLU 46 Ca 0.32 0.55 0.00 0.00 0.36 0.00 0.00 54.97 56.20 3h3f s GLU 46 Cb 0.18 0.19 0.03 0.00 0.26 0.00 0.00 34.13 34.79 3h3f s GLU 46 CO 0.25 -0.06 -0.10 -1.17 -0.54 0.00 0.00 175.26 173.65 3h3f s LEU 47 N 0.43 1.61 -0.13 2.70 2.96 -0.74 -1.27 118.68 124.25 3h3f s LEU 47 Ca 0.01 -0.53 -0.06 0.00 -0.22 0.00 0.00 54.13 53.34 3h3f s LEU 47 Cb -0.05 -1.03 -0.04 0.00 0.50 0.00 0.00 46.19 45.57 3h3f s LEU 47 CO -0.09 -0.12 0.08 0.00 -1.32 0.00 0.00 176.35 174.90 3h3f s ALA 48 N 1.57 3.57 -0.08 5.97 0.00 -0.51 0.11 121.76 132.38 3h3f s ALA 48 Ca 0.03 -0.72 0.04 0.00 0.00 0.00 0.00 51.96 51.31 3h3f s ALA 48 Cb -0.14 -1.81 -0.01 0.00 0.00 0.00 0.00 23.12 21.16 3h3f s ALA 48 CO -0.09 0.48 -0.20 -0.51 0.00 0.00 0.00 175.76 175.45 3h3f s LEU 49 N -0.59 2.37 0.10 0.00 1.43 -0.42 0.56 118.68 122.13 3h3f s LEU 49 Ca 0.11 -0.41 0.05 0.00 -1.03 0.00 0.00 54.13 52.85 3h3f s LEU 49 Cb -0.12 -1.48 -0.03 0.00 0.03 0.00 0.00 46.19 44.59 3h3f s LEU 49 CO 0.02 0.23 -0.14 0.54 0.23 0.00 0.00 176.35 177.23 3h3f s VAL 50 N -0.03 1.20 -0.24 -1.59 0.11 -0.75 -2.49 120.40 116.61 3h3f s VAL 50 Ca -0.06 -1.55 -0.32 0.00 -2.93 0.00 0.00 61.98 57.12 3h3f s VAL 50 Cb -0.15 -1.33 0.16 0.00 -1.53 0.00 0.00 36.38 33.53 3h3f s VAL 50 CO 0.05 -0.36 1.26 -0.62 -3.33 0.00 0.00 175.10 172.09 3h3f s ASP 51 N -2.18 -0.12 0.33 3.54 -1.08 -1.25 -0.69 116.67 115.23 3h3f s ASP 51 Ca 0.04 0.09 0.23 0.00 -0.52 0.00 0.00 52.55 52.39 3h3f s ASP 51 Cb -0.07 0.11 0.25 0.00 -1.46 0.00 0.00 42.92 41.75 3h3f s ASP 51 CO 0.02 -0.14 1.42 -0.37 0.52 0.00 0.00 175.17 176.62 3h3f h VAL 52 N 2.12 0.00 -3.20 1.11 -1.51 -1.92 -3.39 116.25 109.46 3h3f h VAL 52 Ca -0.09 -0.95 -0.57 0.00 -1.23 0.00 0.00 66.70 63.86 3h3f h VAL 52 Cb 1.17 1.76 -0.09 0.00 -2.13 0.00 0.00 31.29 32.00 3h3f h VAL 52 CO 0.23 0.00 0.84 -0.04 -1.23 0.00 0.00 177.57 177.37 3h3f s MET 53 N -3.25 3.45 0.18 5.19 -1.94 -1.26 -4.91 119.30 116.76 3h3f s MET 53 Ca 0.05 0.08 -0.06 0.00 -1.71 0.00 0.00 55.69 54.05 3h3f s MET 53 Cb 0.07 -4.03 0.08 0.00 2.01 0.00 0.00 34.83 32.97 3h3f s MET 53 CO 0.71 -1.61 1.52 0.93 -0.01 0.00 0.00 175.02 176.55 3h3f h GLU 54 N 9.46 0.70 0.00 2.03 5.08 -2.00 -2.62 114.58 127.25 3h3f h GLU 54 Ca -0.25 -0.39 -0.12 0.00 -1.00 0.00 0.00 59.36 57.60 3h3f h GLU 54 Cb 1.06 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 30.32 3h3f h GLU 54 CO 1.15 1.01 -0.63 -0.44 -1.00 0.00 0.00 179.01 179.10 3h3f h ASP 55 N 0.57 0.00 -0.69 1.42 3.45 -1.98 -2.22 116.42 116.96 3h3f h ASP 55 Ca 0.04 -0.75 0.13 0.00 0.43 0.00 0.00 57.03 56.87 3h3f h ASP 55 Cb 1.00 0.00 -0.09 0.00 -0.56 0.00 0.00 39.33 39.68 3h3f h ASP 55 CO 0.09 1.24 0.24 0.50 -1.57 0.00 0.00 179.24 179.75 3h3f h LYS 56 N -1.00 0.38 -0.39 3.56 3.11 -1.99 0.37 116.57 120.61 3h3f h LYS 56 Ca -0.17 -0.02 -0.15 0.00 -2.81 0.00 0.00 60.65 57.49 3h3f h LYS 56 Cb 1.15 -0.09 -0.01 0.00 -1.00 0.00 0.00 32.23 32.28 3h3f h LYS 56 CO -0.11 0.25 -0.35 1.25 -2.81 0.00 0.00 179.45 177.68 3h3f h LEU 57 N 0.39 0.95 -0.39 5.20 5.85 -1.50 -1.10 115.31 124.72 3h3f h LEU 57 Ca 0.37 -0.42 -0.05 0.00 0.84 0.00 0.00 57.88 58.62 3h3f h LEU 57 Cb 0.54 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 41.29 3h3f h LEU 57 CO -0.39 1.20 0.06 0.50 -0.34 0.00 0.00 178.44 179.47 3h3f h LYS 58 N 0.74 0.64 -0.71 1.25 3.64 -0.67 -2.23 116.57 119.23 3h3f h LYS 58 Ca 0.07 -0.18 -0.02 0.00 -1.27 0.00 0.00 60.65 59.25 3h3f h LYS 58 Cb 0.93 -0.07 -0.03 0.00 -0.41 0.00 0.00 32.23 32.65 3h3f h LYS 58 CO 0.09 0.70 0.37 0.78 -2.27 0.00 0.00 179.45 179.12 3h3f h GLY 59 N 0.49 1.06 1.33 5.01 0.00 -0.07 -1.81 103.07 109.08 3h3f h GLY 59 Ca 0.12 -0.48 -0.13 0.00 0.00 0.00 0.00 47.33 46.83 3h3f h GLY 59 CO 0.01 0.46 -0.32 0.83 0.00 0.00 0.00 176.54 177.52 3h3f h GLU 60 N 1.00 0.75 0.20 4.80 4.39 -1.19 -1.12 114.58 123.40 3h3f h GLU 60 Ca 0.25 -0.35 -0.01 0.00 0.34 0.00 0.00 59.36 59.59 3h3f h GLU 60 Cb 0.05 -0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 28.69 3h3f h GLU 60 CO -0.04 0.97 -0.11 1.98 -1.16 0.00 0.00 179.01 180.64 3h3f h MET 61 N 0.63 -0.29 -0.46 2.33 4.05 -1.13 -2.02 114.93 118.04 3h3f h MET 61 Ca 0.07 0.02 -0.09 0.00 -0.28 0.00 0.00 59.70 59.41 3h3f h MET 61 Cb 0.85 0.06 -0.02 0.00 -0.80 0.00 0.00 31.60 31.70 3h3f h MET 61 CO 0.07 -0.19 -0.09 0.52 0.23 0.00 0.00 176.91 177.45 3h3f h MET 62 N -0.30 0.83 -0.75 0.39 2.86 -1.32 -0.75 114.93 115.89 3h3f h MET 62 Ca -0.02 -0.27 0.04 0.00 -2.06 0.00 0.00 59.70 57.39 3h3f h MET 62 Cb 0.24 -0.07 -0.05 0.00 0.06 0.00 0.00 31.60 31.78 3h3f h MET 62 CO 0.03 0.89 0.46 0.22 1.06 0.00 0.00 176.91 179.57 3h3f h ASP 63 N 0.75 0.74 0.10 1.22 -0.00 -1.08 0.52 116.42 118.67 3h3f h ASP 63 Ca 0.13 0.01 -0.00 0.00 -0.00 0.00 0.00 57.03 57.16 3h3f h ASP 63 Cb 0.58 -0.15 0.00 0.00 -0.00 0.00 0.00 39.33 39.76 3h3f h ASP 63 CO 0.04 0.50 -0.05 -0.07 -0.00 0.00 0.00 179.24 179.66 3h3f h LEU 64 N 0.88 -0.11 -1.10 2.28 3.38 -1.17 -3.18 115.31 116.28 3h3f h LEU 64 Ca 0.31 -0.25 0.14 0.00 0.09 0.00 0.00 57.88 58.17 3h3f h LEU 64 Cb 0.08 0.03 -0.08 0.00 0.09 0.00 0.00 40.66 40.77 3h3f h LEU 64 CO -0.14 0.20 0.61 1.56 0.09 0.00 0.00 178.44 180.76 3h3f h GLN 65 N -0.44 0.82 -0.09 1.13 4.20 -0.74 0.22 115.11 120.22 3h3f h GLN 65 Ca -0.01 -0.05 0.03 0.00 0.06 0.00 0.00 58.65 58.67 3h3f h GLN 65 Cb 0.36 -0.19 -0.00 0.00 0.30 0.00 0.00 27.48 27.95 3h3f h GLN 65 CO 0.02 0.55 0.13 0.45 -0.67 0.00 0.00 178.83 179.31 3h3f h HIS 66 N 0.85 0.00 -0.71 2.96 3.86 -0.88 -0.17 115.15 121.06 3h3f h HIS 66 Ca 0.50 0.00 -0.34 0.00 -1.16 0.00 0.00 60.37 59.37 3h3f h HIS 66 Cb 0.66 0.00 -0.20 0.00 1.06 0.00 0.00 27.41 28.93 3h3f h HIS 66 CO -0.00 0.00 0.43 0.41 0.86 0.00 0.00 177.93 179.62 3h3f n GLY 67 N -1.30 3.71 0.22 2.45 0.00 0.77 -4.68 105.19 106.37 3h3f n GLY 67 Ca -0.01 -0.81 -0.08 0.00 0.00 0.00 0.00 46.02 45.12 3h3f n GLY 67 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 3h3f h SER 68 N 1.11 0.65 -1.34 1.61 0.02 -1.09 -2.53 113.55 111.98 3h3f h SER 68 Ca 0.41 -0.16 0.43 0.00 -0.84 0.00 0.00 61.79 61.64 3h3f h SER 68 Cb 2.31 -0.17 -0.12 0.00 0.14 0.00 0.00 62.40 64.56 3h3f h SER 68 CO 0.78 0.63 0.87 0.25 -1.14 0.00 0.00 176.83 178.22 3h3f h LEU 69 N 0.63 0.23 -1.17 5.07 5.85 -1.84 0.64 115.31 124.72 3h3f h LEU 69 Ca 0.16 0.12 0.00 0.00 0.84 0.00 0.00 57.88 59.00 3h3f h LEU 69 Cb 0.17 0.11 0.00 0.00 0.37 0.00 0.00 40.66 41.31 3h3f h LEU 69 CO -0.02 -0.15 -0.24 0.49 -0.34 0.00 0.00 178.44 178.19 3h3f n PHE 70 N -4.63 0.00 -4.11 1.25 3.01 -0.96 -4.95 117.46 107.08 3h3f n PHE 70 Ca 0.36 0.00 -0.28 0.00 1.01 0.00 0.00 57.45 58.54 3h3f n PHE 70 Cb 1.42 -0.02 -0.02 0.00 -0.01 0.00 0.00 39.48 40.85 3h3f n PHE 70 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 3h3f s LEU 71 N -2.28 2.59 -0.25 4.37 1.43 0.21 -5.07 118.68 119.68 3h3f s LEU 71 Ca 0.25 -1.36 0.23 0.00 -1.03 0.00 0.00 54.13 52.22 3h3f s LEU 71 Cb 0.19 -1.07 0.51 0.00 0.03 0.00 0.00 46.19 45.85 3h3f s LEU 71 CO 0.45 -1.05 1.11 0.54 0.23 0.00 0.00 176.35 177.64 3h3f n ARG 72 N -1.64 1.68 -3.67 1.70 5.12 -1.26 -4.96 116.66 113.62 3h3f n ARG 72 Ca -0.06 -3.45 -0.29 0.00 -1.93 0.00 0.00 57.85 52.11 3h3f n ARG 72 Cb 0.65 -1.55 -0.15 0.00 -1.16 0.00 0.00 32.46 30.25 3h3f n ARG 72 CO 0.00 0.00 0.00 0.99 -1.93 0.00 0.00 177.63 176.69 3h3f s THR 73 N -3.65 0.52 0.17 0.55 2.01 -1.26 -4.92 115.64 109.07 3h3f s THR 73 Ca 0.28 -1.08 0.16 0.00 0.31 0.00 0.00 61.69 61.36 3h3f s THR 73 Cb 0.32 -1.36 0.08 0.00 0.01 0.00 0.00 72.50 71.55 3h3f s THR 73 CO -0.04 -0.63 1.67 1.55 -0.69 0.00 0.00 174.62 176.47 3h3f h PRO 74 N 8.21 0.00 -4.27 4.92 0.13 -1.88 -3.43 132.00 135.68 3h3f h PRO 74 Ca -0.16 0.00 -0.57 0.00 -0.87 0.00 0.00 66.00 64.40 3h3f h PRO 74 Cb 1.03 0.00 -0.38 0.00 0.13 0.00 0.00 31.00 31.78 3h3f h PRO 74 CO 0.44 0.46 -0.80 0.21 -0.23 0.00 0.00 178.00 178.09 3h3f s LYS 75 N -3.54 1.60 -0.16 0.86 2.20 -1.25 -5.09 119.74 114.36 3h3f s LYS 75 Ca 0.00 -0.61 -0.04 0.00 -0.36 0.00 0.00 55.97 54.97 3h3f s LYS 75 Cb 0.11 -2.12 -0.02 0.00 -1.51 0.00 0.00 37.83 34.29 3h3f s LYS 75 CO 0.71 -0.43 -0.04 0.42 -0.36 0.00 0.00 175.35 175.65 3h3f s ILE 76 N 1.57 3.78 0.24 5.43 1.01 -1.26 -1.79 121.20 130.17 3h3f s ILE 76 Ca 0.00 -0.39 0.06 0.00 0.00 0.00 0.00 60.65 60.32 3h3f s ILE 76 Cb -0.15 -2.66 -0.05 0.00 0.01 0.00 0.00 42.46 39.60 3h3f s ILE 76 CO -0.08 0.48 -0.06 0.68 0.00 0.00 0.00 174.94 175.96 3h3f s VAL 77 N 0.53 1.41 -0.02 2.92 -7.23 0.12 -4.97 120.40 113.16 3h3f s VAL 77 Ca -0.03 -2.10 -0.15 0.00 -1.81 0.00 0.00 61.98 57.88 3h3f s VAL 77 Cb -0.14 -2.28 0.03 0.00 0.56 0.00 0.00 36.38 34.54 3h3f s VAL 77 CO 0.03 -0.41 0.32 -0.94 -0.31 0.00 0.00 175.10 173.79 3h3f s SER 78 N -3.35 -0.21 -0.03 4.85 1.04 -1.26 -1.30 113.70 113.44 3h3f s SER 78 Ca 0.26 0.13 -0.31 0.00 0.48 0.00 0.00 55.95 56.52 3h3f s SER 78 Cb 0.03 0.33 0.12 0.00 0.10 0.00 0.00 66.02 66.61 3h3f s SER 78 CO 0.09 -0.44 1.32 -0.83 0.98 0.00 0.00 173.24 174.35 3h3f s GLY 79 N -1.28 -0.40 0.23 7.32 0.00 -1.04 -4.99 107.32 107.17 3h3f s GLY 79 Ca -0.13 0.67 0.12 0.00 0.00 0.00 0.00 44.72 45.38 3h3f s GLY 79 CO 0.04 0.74 1.46 1.70 0.00 0.00 0.00 173.10 177.05 3h3f h LYS 80 N 2.00 0.00 -5.73 2.90 3.64 -1.89 -3.33 116.57 114.17 3h3f h LYS 80 Ca -0.30 0.00 -0.58 0.00 -1.27 0.00 0.00 60.65 58.49 3h3f h LYS 80 Cb 1.20 0.00 -0.08 0.00 -0.41 0.00 0.00 32.23 32.93 3h3f h LYS 80 CO 0.29 0.69 -0.02 0.34 -2.27 0.00 0.00 179.45 178.49 3h3f s ASP 81 N -6.62 6.71 0.00 4.20 3.68 -1.26 -4.82 116.67 118.56 3h3f s ASP 81 Ca 0.01 0.85 0.25 0.00 2.13 0.00 0.00 52.55 55.80 3h3f s ASP 81 Cb 0.10 -2.32 1.41 0.00 -1.45 0.00 0.00 42.92 40.65 3h3f s ASP 81 CO 0.77 -0.13 1.86 -1.22 0.13 0.00 0.00 175.17 176.59 3h3f n TYR 82 N 4.27 0.00 -0.01 -5.34 4.02 -1.26 -2.44 117.16 116.39 3h3f n TYR 82 Ca -0.04 0.00 0.08 0.00 -0.01 0.00 0.00 57.90 57.93 3h3f n TYR 82 Cb 0.51 -0.13 0.49 0.00 -0.02 0.00 0.00 39.34 40.18 3h3f n TYR 82 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 176.86 176.51 3h3f h SER 83 N 0.00 0.37 0.00 7.72 4.64 -1.93 0.22 113.55 124.57 3h3f h SER 83 Ca 0.00 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3h3f h SER 83 Cb 0.11 -0.08 0.00 0.00 -0.31 0.00 0.00 62.40 62.12 3h3f h SER 83 CO 0.00 0.24 0.00 -0.37 -0.87 0.00 0.00 176.83 175.84 3h3f h VAL 84 N 0.42 0.00 -0.00 0.95 -1.51 -1.87 -1.86 116.25 112.37 3h3f h VAL 84 Ca 0.20 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.67 3h3f h VAL 84 Cb 0.25 0.53 0.00 0.00 -2.13 0.00 0.00 31.29 29.94 3h3f h VAL 84 CO -0.05 0.00 -0.39 0.41 -1.23 0.00 0.00 177.57 176.31 3h3f n THR 85 N -2.34 0.00 -1.66 7.19 -1.04 0.77 -4.84 114.28 112.36 3h3f n THR 85 Ca -0.02 -0.06 -0.45 0.00 -2.04 0.00 0.00 64.05 61.49 3h3f n THR 85 Cb 0.04 0.32 -0.02 0.00 -1.82 0.00 0.00 70.33 68.84 3h3f n THR 85 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3h3f n ALA 86 N -1.11 0.88 -2.15 2.41 0.00 -0.70 -3.26 120.51 116.59 3h3f n ALA 86 Ca 0.09 0.41 -0.06 0.00 0.00 0.00 0.00 53.44 53.87 3h3f n ALA 86 Cb 0.34 -2.23 -0.00 0.00 0.00 0.00 0.00 19.45 17.55 3h3f n ALA 86 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3h3f n ASN 87 N 1.90 -2.54 -4.82 0.00 4.13 -1.01 -4.95 115.26 107.97 3h3f n ASN 87 Ca 0.11 -0.01 -0.34 0.00 1.68 0.00 0.00 54.58 56.02 3h3f n ASN 87 Cb 0.31 -1.86 -0.06 0.00 -1.54 0.00 0.00 39.78 36.63 3h3f n ASN 87 CO 0.00 0.00 0.00 -0.44 0.28 0.00 0.00 177.26 177.10 3h3f s SER 88 N -2.73 6.96 0.17 6.41 0.01 -1.20 -4.52 113.70 118.80 3h3f s SER 88 Ca 0.01 1.50 0.15 0.00 1.31 0.00 0.00 55.95 58.92 3h3f s SER 88 Cb -0.00 -2.46 -0.04 0.00 0.21 0.00 0.00 66.02 63.73 3h3f s SER 88 CO 0.01 -0.18 1.16 0.11 0.41 0.00 0.00 173.24 174.75 3h3f h LYS 89 N 2.54 0.00 -3.14 12.44 1.57 -1.61 -3.37 116.57 125.01 3h3f h LYS 89 Ca -0.48 0.00 -0.20 0.00 -1.87 0.00 0.00 60.65 58.10 3h3f h LYS 89 Cb 1.18 0.00 -0.29 0.00 0.08 0.00 0.00 32.23 33.20 3h3f h LYS 89 CO 0.64 0.43 -0.51 -1.17 -0.57 0.00 0.00 179.45 178.28 3h3f s LEU 90 N -6.17 0.72 -0.08 2.94 2.96 -1.25 -2.16 118.68 115.63 3h3f s LEU 90 Ca 0.01 0.44 0.02 0.00 -0.22 0.00 0.00 54.13 54.37 3h3f s LEU 90 Cb 0.08 0.64 0.02 0.00 0.50 0.00 0.00 46.19 47.43 3h3f s LEU 90 CO 0.78 -0.13 -0.12 -0.69 -1.32 0.00 0.00 176.35 174.86 3h3f s VAL 91 N 0.91 1.21 -0.19 1.68 1.01 0.87 -1.69 120.40 124.21 3h3f s VAL 91 Ca -0.07 -0.49 -0.00 0.00 0.00 0.00 0.00 61.98 61.42 3h3f s VAL 91 Cb -0.08 -1.13 0.01 0.00 0.00 0.00 0.00 36.38 35.18 3h3f s VAL 91 CO -0.05 0.38 -0.16 -0.63 0.00 0.00 0.00 175.10 174.64 3h3f s ILE 92 N 0.92 2.44 -0.26 2.22 1.01 -0.83 0.23 121.20 126.93 3h3f s ILE 92 Ca -0.09 -0.81 -0.09 0.00 0.00 0.00 0.00 60.65 59.65 3h3f s ILE 92 Cb -0.15 -2.05 -0.04 0.00 0.01 0.00 0.00 42.46 40.23 3h3f s ILE 92 CO 0.00 0.51 0.14 -0.63 0.00 0.00 0.00 174.94 174.96 3h3f s ILE 93 N 1.28 4.94 -0.07 2.92 -1.09 -0.63 0.65 121.20 129.21 3h3f s ILE 93 Ca 0.04 0.04 0.10 0.00 -2.23 0.00 0.00 60.65 58.60 3h3f s ILE 93 Cb -0.14 -3.33 0.15 0.00 -1.58 0.00 0.00 42.46 37.57 3h3f s ILE 93 CO -0.09 0.30 1.06 0.35 -1.23 0.00 0.00 174.94 175.34 3h3f n THR 94 N 4.84 1.05 -3.94 2.92 -2.24 0.42 -0.96 114.28 116.36 3h3f n THR 94 Ca -0.15 -1.25 -0.28 0.00 -2.27 0.00 0.00 64.05 60.10 3h3f n THR 94 Cb 0.52 0.12 -0.03 0.00 -2.10 0.00 0.00 70.33 68.84 3h3f n THR 94 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3h3f s ALA 95 N -1.58 3.98 0.00 6.98 0.00 -1.11 -4.75 121.76 125.29 3h3f s ALA 95 Ca 0.17 -0.97 0.00 0.00 0.00 0.00 0.00 51.96 51.16 3h3f s ALA 95 Cb 0.15 -1.80 0.00 0.00 0.00 0.00 0.00 23.12 21.47 3h3f s ALA 95 CO 0.02 0.64 0.00 0.41 0.00 0.00 0.00 175.76 176.82 3h3f n GLY 96 N -0.27 -1.16 3.79 0.00 0.00 -1.26 -4.73 105.19 101.56 3h3f n GLY 96 Ca -0.06 -1.00 -0.39 0.00 0.00 0.00 0.00 46.02 44.57 3h3f n GLY 96 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h3f s ALA 97 N -1.89 3.54 0.80 4.61 0.00 -1.26 -5.02 121.76 122.53 3h3f s ALA 97 Ca 0.00 0.07 -0.15 0.00 0.00 0.00 0.00 51.96 51.88 3h3f s ALA 97 Cb 0.00 -2.71 0.00 0.00 0.00 0.00 0.00 23.12 20.42 3h3f s ALA 97 CO 0.00 0.30 0.62 -2.13 0.00 0.00 0.00 175.76 174.56 3h3f n ARG 98 N 2.08 0.14 -3.16 0.00 3.00 -1.26 -4.87 116.66 112.59 3h3f n ARG 98 Ca -0.09 0.10 -0.39 0.00 -0.00 0.00 0.00 57.85 57.47 3h3f n ARG 98 Cb 0.51 -1.96 -0.06 0.00 0.00 0.00 0.00 32.46 30.95 3h3f n ARG 98 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.63 176.49 3h3f s GLN 99 N -3.24 4.35 -0.51 -0.14 0.74 -1.26 -5.03 119.66 114.57 3h3f s GLN 99 Ca 0.65 0.87 0.00 0.00 0.05 0.00 0.00 55.36 56.93 3h3f s GLN 99 Cb -0.30 -3.28 0.13 0.00 1.10 0.00 0.00 33.01 30.66 3h3f s GLN 99 CO 0.59 0.52 0.28 -1.14 -0.55 0.00 0.00 175.29 174.99 3h3f s GLN 100 N -0.78 2.10 0.71 1.67 -0.44 -1.26 -5.07 119.66 116.58 3h3f s GLN 100 Ca 0.32 -2.32 -0.16 0.00 -2.50 0.00 0.00 55.36 50.69 3h3f s GLN 100 Cb -0.20 -3.49 0.01 0.00 -1.64 0.00 0.00 33.01 27.69 3h3f s GLN 100 CO 0.21 -1.10 1.11 0.39 0.50 0.00 0.00 175.29 176.40 3h3f n GLU 101 N 3.70 0.66 -2.61 1.67 -0.58 -1.26 -2.41 120.64 119.80 3h3f n GLU 101 Ca 0.04 0.28 -0.12 0.00 -0.42 0.00 0.00 57.16 56.95 3h3f n GLU 101 Cb 0.37 -2.36 -0.00 0.00 -0.57 0.00 0.00 31.44 28.88 3h3f n GLU 101 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3h3f n GLY 102 N 0.95 -0.50 3.08 0.62 0.00 -1.26 -4.93 105.19 103.15 3h3f n GLY 102 Ca 0.14 0.01 -0.28 0.00 0.00 0.00 0.00 46.02 45.89 3h3f n GLY 102 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3h3f s GLU 103 N -5.19 2.27 0.06 1.61 2.56 -1.01 -5.12 118.70 113.88 3h3f s GLU 103 Ca 0.07 -0.59 -0.13 0.00 0.00 0.00 0.00 54.97 54.31 3h3f s GLU 103 Cb -0.04 -1.86 -0.08 0.00 2.00 0.00 0.00 34.13 34.16 3h3f s GLU 103 CO 0.08 0.01 0.29 0.45 -0.56 0.00 0.00 175.26 175.54 3h3f n SER 104 N 3.96 -0.38 -1.78 -1.70 2.88 -1.26 -4.74 113.62 110.59 3h3f n SER 104 Ca -0.20 0.49 -0.09 0.00 -1.33 0.00 0.00 58.87 57.74 3h3f n SER 104 Cb 0.52 -0.40 -0.03 0.00 -0.75 0.00 0.00 64.21 63.55 3h3f n SER 104 CO 0.00 0.00 0.00 -1.14 -1.23 0.00 0.00 175.04 172.67 3h3f n ARG 105 N 0.49 1.52 0.00 -1.46 0.00 -1.26 -2.51 116.66 113.43 3h3f n ARG 105 Ca 0.08 -0.80 0.00 0.00 -0.00 0.00 0.00 57.85 57.13 3h3f n ARG 105 Cb 0.09 -1.44 0.00 0.00 0.00 0.00 0.00 32.46 31.10 3h3f n ARG 105 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.63 177.52 3h3f n LEU 106 N 1.32 0.00 -0.04 6.15 0.00 -1.26 -4.54 117.00 118.63 3h3f n LEU 106 Ca 0.20 0.00 -0.14 0.00 0.00 0.00 0.00 56.01 56.07 3h3f n LEU 106 Cb 0.60 0.00 -0.08 0.00 0.00 0.00 0.00 43.42 43.94 3h3f n LEU 106 CO 0.15 0.00 0.55 -1.13 0.00 0.00 0.00 177.39 176.96 3h3f h ASN 107 N 0.00 0.34 0.02 1.96 -0.73 -1.82 -3.17 115.58 112.19 3h3f h ASN 107 Ca 0.00 -0.54 0.01 0.00 1.87 0.00 0.00 56.30 57.64 3h3f h ASN 107 Cb 0.00 -0.10 -0.02 0.00 0.27 0.00 0.00 38.32 38.47 3h3f h ASN 107 CO 0.00 0.82 -0.25 0.25 -0.37 0.00 0.00 177.43 177.88 3h3f h LEU 108 N -0.12 -0.76 -0.27 0.34 5.85 -1.78 0.28 115.31 118.84 3h3f h LEU 108 Ca 0.01 0.08 0.03 0.00 0.84 0.00 0.00 57.88 58.84 3h3f h LEU 108 Cb 0.75 0.29 -0.05 0.00 0.37 0.00 0.00 40.66 42.01 3h3f h LEU 108 CO 0.04 -0.25 -0.33 0.58 -0.34 0.00 0.00 178.44 178.14 3h3f h VAL 109 N -0.33 0.00 0.00 1.05 2.07 -1.80 -1.05 116.25 116.19 3h3f h VAL 109 Ca 0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 3h3f h VAL 109 Cb 0.35 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.12 3h3f h VAL 109 CO -0.15 0.00 0.44 -0.61 0.02 0.00 0.00 177.57 177.27 3h3f h GLN 110 N -0.21 0.00 0.04 1.57 5.75 -1.38 1.25 115.11 122.12 3h3f h GLN 110 Ca 0.05 0.00 -0.00 0.00 -0.15 0.00 0.00 58.65 58.55 3h3f h GLN 110 Cb 0.34 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.89 3h3f h GLN 110 CO -0.37 0.00 -0.02 -0.09 -2.65 0.00 0.00 178.83 175.70 3h3f h ARG 111 N 0.00 -0.05 -0.74 1.69 9.65 0.33 -3.21 114.38 122.06 3h3f h ARG 111 Ca 0.00 0.00 0.11 0.00 -1.10 0.00 0.00 59.98 59.00 3h3f h ARG 111 Cb 0.88 0.01 -0.05 0.00 -1.39 0.00 0.00 29.97 29.42 3h3f h ARG 111 CO 0.00 0.50 0.49 -0.91 2.80 0.00 0.00 179.97 182.85 3h3f h ASN 112 N -0.96 0.51 -0.72 -3.80 2.35 0.19 1.51 115.58 114.66 3h3f h ASN 112 Ca -0.00 0.02 0.20 0.00 -0.55 0.00 0.00 56.30 55.96 3h3f h ASN 112 Cb 0.57 -0.09 -0.03 0.00 0.05 0.00 0.00 38.32 38.82 3h3f h ASN 112 CO 0.01 0.29 0.51 0.58 -1.65 0.00 0.00 177.43 177.17 3h3f h VAL 113 N 0.56 0.67 0.00 2.81 2.07 -0.28 0.15 116.25 122.23 3h3f h VAL 113 Ca 0.35 -0.03 -0.20 0.00 0.82 0.00 0.00 66.70 67.64 3h3f h VAL 113 Cb 0.59 0.58 -0.03 0.00 -1.52 0.00 0.00 31.29 30.90 3h3f h VAL 113 CO -0.12 0.02 -1.08 0.78 0.02 0.00 0.00 177.57 177.18 3h3f h ASN 114 N 0.09 0.00 -0.10 0.57 4.21 0.21 0.29 115.58 120.85 3h3f h ASN 114 Ca 0.35 0.00 -0.12 0.00 1.21 0.00 0.00 56.30 57.74 3h3f h ASN 114 Cb 1.26 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.46 3h3f h ASN 114 CO -0.03 0.86 -0.41 0.40 -1.29 0.00 0.00 177.43 176.95 3h3f h ILE 115 N 0.00 1.38 -0.61 2.81 1.08 -0.78 -3.29 117.51 118.09 3h3f h ILE 115 Ca -0.08 -1.75 -0.08 0.00 -0.39 0.00 0.00 64.86 62.57 3h3f h ILE 115 Cb 1.72 2.20 -0.02 0.00 -3.07 0.00 0.00 36.82 37.64 3h3f h ILE 115 CO 0.10 0.52 0.07 -0.26 -0.69 0.00 0.00 178.15 177.89 3h3f h PHE 116 N 0.03 1.08 0.00 1.37 -1.00 -0.56 -0.34 116.94 117.52 3h3f h PHE 116 Ca -0.02 -0.15 0.00 0.00 2.81 0.00 0.00 57.97 60.61 3h3f h PHE 116 Cb 1.05 -0.30 0.00 0.00 3.61 0.00 0.00 35.95 40.31 3h3f h PHE 116 CO 0.12 0.93 0.05 0.87 -1.61 0.00 0.00 178.31 178.66 3h3f h LYS 117 N 0.95 0.00 0.02 1.51 1.57 -0.49 0.49 116.57 120.62 3h3f h LYS 117 Ca 0.19 0.00 -0.36 0.00 -1.87 0.00 0.00 60.65 58.60 3h3f h LYS 117 Cb 0.45 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.71 3h3f h LYS 117 CO 0.02 0.00 -2.03 0.34 -0.57 0.00 0.00 179.45 177.21 3h3f n PHE 118 N -2.71 0.54 0.19 -1.35 7.35 -0.93 -4.57 117.46 115.97 3h3f n PHE 118 Ca -0.02 0.19 -0.14 0.00 -0.76 0.00 0.00 57.45 56.71 3h3f n PHE 118 Cb 0.10 -1.06 -0.07 0.00 0.35 0.00 0.00 39.48 38.80 3h3f n PHE 118 CO 0.00 0.00 0.00 0.82 -0.76 0.00 0.00 176.76 176.82 3h3f h ILE 119 N -0.68 0.48 -0.03 -2.13 2.04 -0.32 -3.16 117.51 113.71 3h3f h ILE 119 Ca -0.53 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.33 3h3f h ILE 119 Cb 1.62 0.48 -0.00 0.00 -0.74 0.00 0.00 36.82 38.19 3h3f h ILE 119 CO -0.22 0.00 -0.01 0.40 0.00 0.00 0.00 178.15 178.32 3h3f h ILE 120 N -0.55 1.30 -0.62 -0.67 1.08 -1.18 -0.05 117.51 116.83 3h3f h ILE 120 Ca -0.02 -0.92 0.17 0.00 -0.39 0.00 0.00 64.86 63.70 3h3f h ILE 120 Cb 0.49 1.87 -0.03 0.00 -3.07 0.00 0.00 36.82 36.08 3h3f h ILE 120 CO -0.03 0.25 0.44 -0.65 -0.69 0.00 0.00 178.15 177.47 3h3f h PRO 121 N -0.31 0.08 0.22 2.37 0.11 -1.75 -1.36 132.00 131.35 3h3f h PRO 121 Ca 0.01 -0.00 -0.29 0.00 0.11 0.00 0.00 66.00 65.82 3h3f h PRO 121 Cb 0.40 -0.02 0.03 0.00 0.11 0.00 0.00 31.00 31.53 3h3f h PRO 121 CO 0.00 0.05 -1.29 -0.91 -0.21 0.00 0.00 178.00 175.65 3h3f h ASN 122 N 0.08 0.75 -0.45 -2.05 -0.26 -1.29 -2.51 115.58 109.85 3h3f h ASN 122 Ca 0.30 -0.93 -0.02 0.00 -0.56 0.00 0.00 56.30 55.09 3h3f h ASN 122 Cb 1.06 -0.24 -0.02 0.00 -1.06 0.00 0.00 38.32 38.06 3h3f h ASN 122 CO -0.03 1.62 0.21 -0.37 -1.06 0.00 0.00 177.43 177.81 3h3f h VAL 123 N -0.00 1.18 0.00 2.81 -1.51 -0.52 -2.52 116.25 115.69 3h3f h VAL 123 Ca -0.22 -0.53 0.00 0.00 -1.23 0.00 0.00 66.70 64.72 3h3f h VAL 123 Cb 2.02 0.70 0.00 0.00 -2.13 0.00 0.00 31.29 31.88 3h3f h VAL 123 CO 0.24 0.20 0.00 -0.37 -1.23 0.00 0.00 177.57 176.42 3h3f h VAL 124 N 0.59 0.00 -0.07 7.19 -1.51 -1.33 -0.05 116.25 121.07 3h3f h VAL 124 Ca 0.15 -0.38 -0.23 0.00 -1.23 0.00 0.00 66.70 65.01 3h3f h VAL 124 Cb 0.13 1.24 0.01 0.00 -2.13 0.00 0.00 31.29 30.54 3h3f h VAL 124 CO -0.02 0.00 -0.88 0.50 -1.23 0.00 0.00 177.57 175.94 3h3f h LYS 125 N 0.00 0.63 0.03 5.19 3.64 -1.00 -2.65 116.57 122.42 3h3f h LYS 125 Ca 0.00 -0.59 -0.30 0.00 -1.27 0.00 0.00 60.65 58.49 3h3f h LYS 125 Cb 0.47 0.15 -0.04 0.00 -0.41 0.00 0.00 32.23 32.39 3h3f h LYS 125 CO 0.00 1.20 -1.66 1.88 -2.27 0.00 0.00 179.45 178.60 3h3f h TYR 126 N 0.40 0.11 -2.39 1.91 -1.99 -1.33 -3.40 116.97 110.27 3h3f h TYR 126 Ca -0.08 -0.08 -0.62 0.00 2.00 0.00 0.00 58.73 59.95 3h3f h TYR 126 Cb 1.51 -0.00 -0.41 0.00 2.00 0.00 0.00 36.73 39.83 3h3f h TYR 126 CO 0.08 1.15 -0.50 0.43 -0.00 0.00 0.00 178.16 179.32 3h3f n SER 127 N -3.18 3.82 -0.26 3.88 7.64 -0.07 -2.40 113.62 123.07 3h3f n SER 127 Ca -0.17 -3.41 0.16 0.00 1.01 0.00 0.00 58.87 56.46 3h3f n SER 127 Cb 1.04 -0.73 0.45 0.00 -1.01 0.00 0.00 64.21 63.96 3h3f n SER 127 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 3h3f h PRO 128 N 4.46 0.52 -0.41 1.43 0.13 -1.70 -2.33 132.00 134.11 3h3f h PRO 128 Ca 0.19 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 65.29 3h3f h PRO 128 Cb 0.67 -0.12 0.00 0.00 0.13 0.00 0.00 31.00 31.69 3h3f h PRO 128 CO 0.85 0.34 0.00 0.72 -0.23 0.00 0.00 178.00 179.68 3h3f n HIS 129 N -4.55 0.54 -1.62 1.56 8.25 -1.26 -4.95 115.22 113.18 3h3f n HIS 129 Ca 0.19 -0.27 -0.27 0.00 -0.26 0.00 0.00 57.72 57.11 3h3f n HIS 129 Cb 0.60 0.00 0.20 0.00 1.12 0.00 0.00 29.99 31.90 3h3f n HIS 129 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3h3f s LYS 131 N -5.54 1.15 -0.11 0.00 2.47 -0.92 -4.97 119.74 111.83 3h3f s LYS 131 Ca 0.67 -0.35 -0.02 0.00 -1.56 0.00 0.00 55.97 54.71 3h3f s LYS 131 Cb -0.03 -1.04 -0.03 0.00 -1.46 0.00 0.00 37.83 35.27 3h3f s LYS 131 CO 0.48 0.11 -0.01 -0.51 0.16 0.00 0.00 175.35 175.58 3h3f s LEU 132 N 0.27 3.49 -0.23 5.43 1.43 -0.89 -0.09 118.68 128.09 3h3f s LEU 132 Ca -0.05 0.06 0.02 0.00 -1.03 0.00 0.00 54.13 53.13 3h3f s LEU 132 Cb -0.10 -1.81 0.05 0.00 0.03 0.00 0.00 46.19 44.36 3h3f s LEU 132 CO 0.01 0.32 -0.13 -0.22 0.23 0.00 0.00 176.35 176.56 3h3f s LEU 133 N -0.52 2.90 -0.18 1.79 0.20 0.14 -1.34 118.68 121.67 3h3f s LEU 133 Ca 0.09 -1.12 -0.19 0.00 0.69 0.00 0.00 54.13 53.59 3h3f s LEU 133 Cb -0.12 -1.47 -0.03 0.00 -0.43 0.00 0.00 46.19 44.14 3h3f s LEU 133 CO 0.02 -0.14 0.55 -0.69 -0.29 0.00 0.00 176.35 175.81 3h3f s VAL 134 N 1.20 5.09 -0.05 1.68 1.01 0.14 -1.61 120.40 127.87 3h3f s VAL 134 Ca -0.04 1.05 0.03 0.00 0.00 0.00 0.00 61.98 63.02 3h3f s VAL 134 Cb -0.18 -3.88 -0.05 0.00 0.00 0.00 0.00 36.38 32.27 3h3f s VAL 134 CO -0.08 0.19 -0.00 0.52 0.00 0.00 0.00 175.10 175.73 3h3f n VAL 135 N 4.41 0.33 -1.42 2.92 0.31 -0.14 -1.34 118.33 123.41 3h3f n VAL 135 Ca -0.04 -0.19 -0.44 0.00 -0.01 0.00 0.00 64.34 63.67 3h3f n VAL 135 Cb 0.50 -0.83 -0.01 0.00 -0.91 0.00 0.00 33.84 32.59 3h3f n VAL 135 CO 0.00 0.00 0.00 -1.20 -1.32 0.00 0.00 176.83 174.31 3h3f n SER 136 N -2.30 -1.18 -4.92 4.52 7.64 -1.07 -4.73 113.62 111.57 3h3f n SER 136 Ca -0.09 0.98 -0.31 0.00 1.01 0.00 0.00 58.87 60.47 3h3f n SER 136 Cb 0.65 -1.03 -0.04 0.00 -1.01 0.00 0.00 64.21 62.77 3h3f n SER 136 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 3h3f s ASN 137 N -0.93 6.37 -0.28 6.43 0.01 -1.26 -3.18 114.94 122.10 3h3f s ASN 137 Ca 0.62 0.30 -0.29 0.00 -0.71 0.00 0.00 52.86 52.78 3h3f s ASN 137 Cb -0.72 -1.97 -0.01 0.00 0.41 0.00 0.00 41.25 38.96 3h3f s ASN 137 CO 0.59 0.15 1.52 -2.16 -1.51 0.00 0.00 177.10 175.70 3h3f s PRO 138 N -2.55 3.74 0.26 -0.60 0.04 -1.26 -4.97 135.00 129.66 3h3f s PRO 138 Ca 0.36 1.41 -0.03 0.00 0.04 0.00 0.00 61.00 62.77 3h3f s PRO 138 Cb -0.13 -4.01 0.31 0.00 0.04 0.00 0.00 34.50 30.71 3h3f s PRO 138 CO 0.28 -1.36 1.80 -0.24 0.04 0.00 0.00 177.00 177.52 3h3f h VAL 139 N 6.22 1.24 -0.15 -0.36 3.04 -1.84 -1.52 116.25 122.89 3h3f h VAL 139 Ca -0.31 -0.86 -0.20 0.00 -1.01 0.00 0.00 66.70 64.32 3h3f h VAL 139 Cb 1.13 0.60 0.01 0.00 -2.01 0.00 0.00 31.29 31.03 3h3f h VAL 139 CO 1.03 0.32 -0.70 0.44 -1.01 0.00 0.00 177.57 177.65 3h3f h ASP 140 N 0.90 0.87 -0.52 3.17 3.32 -1.87 -0.06 116.42 122.23 3h3f h ASP 140 Ca 0.20 -0.63 -0.04 0.00 0.02 0.00 0.00 57.03 56.57 3h3f h ASP 140 Cb 0.31 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.58 3h3f h ASP 140 CO -0.00 1.36 0.16 0.40 -1.72 0.00 0.00 179.24 179.43 3h3f h ILE 141 N 0.45 1.23 0.00 0.35 2.04 -1.83 -2.20 117.51 117.55 3h3f h ILE 141 Ca -0.05 -0.80 -0.06 0.00 1.00 0.00 0.00 64.86 64.95 3h3f h ILE 141 Cb 1.34 0.76 -0.01 0.00 -0.74 0.00 0.00 36.82 38.17 3h3f h ILE 141 CO 0.15 0.29 -0.31 -0.07 0.00 0.00 0.00 178.15 178.21 3h3f h LEU 142 N 0.72 0.00 -0.32 1.44 3.38 -1.22 0.06 115.31 119.37 3h3f h LEU 142 Ca 0.17 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 58.00 3h3f h LEU 142 Cb 0.29 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.03 3h3f h LEU 142 CO -0.00 0.31 -0.33 0.74 0.09 0.00 0.00 178.44 179.25 3h3f h THR 143 N 0.00 1.29 -0.32 0.22 2.02 -0.85 -2.25 112.91 113.02 3h3f h THR 143 Ca -0.00 -1.50 0.05 0.00 0.77 0.00 0.00 66.41 65.73 3h3f h THR 143 Cb 1.02 1.53 -0.04 0.00 -1.74 0.00 0.00 68.15 68.92 3h3f h THR 143 CO 0.04 0.49 0.06 0.22 0.37 0.00 0.00 175.52 176.70 3h3f h TYR 144 N 0.55 0.10 -0.75 3.16 3.20 -0.73 -0.54 116.97 121.95 3h3f h TYR 144 Ca 0.05 0.02 0.05 0.00 3.14 0.00 0.00 58.73 61.98 3h3f h TYR 144 Cb 0.91 0.00 -0.04 0.00 1.54 0.00 0.00 36.73 39.14 3h3f h TYR 144 CO 0.07 0.01 0.49 0.28 -1.64 0.00 0.00 178.16 177.38 3h3f h VAL 145 N 0.17 1.08 -0.13 1.81 2.07 -0.83 -0.46 116.25 119.96 3h3f h VAL 145 Ca 0.15 -0.30 -0.20 0.00 0.82 0.00 0.00 66.70 67.17 3h3f h VAL 145 Cb 0.17 0.13 0.00 0.00 -1.52 0.00 0.00 31.29 30.08 3h3f h VAL 145 CO -0.20 0.16 -0.74 0.00 0.02 0.00 0.00 177.57 176.80 3h3f h ALA 146 N 1.57 0.44 0.51 1.67 0.00 -1.04 0.24 119.26 122.66 3h3f h ALA 146 Ca 0.31 -0.60 -0.03 0.00 0.00 0.00 0.00 54.91 54.60 3h3f h ALA 146 Cb 0.12 -0.04 0.01 0.00 0.00 0.00 0.00 17.79 17.88 3h3f h ALA 146 CO -0.10 0.72 -0.25 2.35 0.00 0.00 0.00 179.25 181.97 3h3f h TRP 147 N 0.44 -0.64 -0.32 0.00 7.01 -0.60 -1.93 115.95 119.90 3h3f h TRP 147 Ca -0.04 -0.02 0.06 0.00 2.11 0.00 0.00 58.89 61.01 3h3f h TRP 147 Cb 1.35 0.21 -0.08 0.00 -2.10 0.00 0.00 29.16 28.54 3h3f h TRP 147 CO 0.07 -0.36 -0.42 0.87 -2.79 0.00 0.00 178.44 175.80 3h3f h LYS 148 N -0.77 -0.36 -0.49 2.65 1.79 -1.02 -1.19 116.57 117.19 3h3f h LYS 148 Ca -0.07 0.02 -0.12 0.00 -2.18 0.00 0.00 60.65 58.30 3h3f h LYS 148 Cb 0.57 0.08 -0.01 0.00 -1.58 0.00 0.00 32.23 31.28 3h3f h LYS 148 CO 0.12 -0.24 -0.19 0.82 -1.08 0.00 0.00 179.45 178.88 3h3f h ILE 149 N -0.37 1.27 0.00 1.86 2.04 -0.96 -2.92 117.51 118.43 3h3f h ILE 149 Ca 0.12 -1.34 -0.13 0.00 1.00 0.00 0.00 64.86 64.50 3h3f h ILE 149 Cb 0.59 1.09 -0.02 0.00 -0.74 0.00 0.00 36.82 37.74 3h3f h ILE 149 CO -0.52 0.46 -0.63 0.77 0.00 0.00 0.00 178.15 178.23 3h3f h SER 150 N 0.85 0.00 -0.01 1.72 4.64 -1.18 -3.45 113.55 116.11 3h3f h SER 150 Ca 0.12 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.43 3h3f h SER 150 Cb 0.75 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.84 3h3f h SER 150 CO 0.06 0.63 -0.00 0.61 -0.87 0.00 0.00 176.83 177.26 3h3f n GLY 151 N 0.40 0.27 3.77 -0.77 0.00 -0.46 -5.02 105.19 103.37 3h3f n GLY 151 Ca -0.01 -0.01 -0.34 0.00 0.00 0.00 0.00 46.02 45.66 3h3f n GLY 151 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3h3f s PHE 152 N -1.51 2.61 0.90 1.61 2.99 -1.24 -5.00 117.98 118.34 3h3f s PHE 152 Ca 0.00 1.55 -0.11 0.00 0.00 0.00 0.00 56.93 58.37 3h3f s PHE 152 Cb 0.00 -3.26 0.13 0.00 0.00 0.00 0.00 43.02 39.90 3h3f s PHE 152 CO 0.00 -1.70 1.10 -1.25 -0.00 0.00 0.00 175.22 173.36 3h3f s PRO 153 N -3.65 1.17 0.49 0.24 0.04 -1.26 -4.88 135.00 127.15 3h3f s PRO 153 Ca 0.71 1.07 0.27 0.00 0.04 0.00 0.00 61.00 63.09 3h3f s PRO 153 Cb -0.23 -1.78 1.17 0.00 0.04 0.00 0.00 34.50 33.70 3h3f s PRO 153 CO 0.34 -2.37 1.93 1.57 0.04 0.00 0.00 177.00 178.51 3h3f h LYS 154 N -1.66 0.00 0.00 4.56 2.10 -1.94 -2.67 116.57 116.96 3h3f h LYS 154 Ca -0.48 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.17 3h3f h LYS 154 Cb 1.27 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.60 3h3f h LYS 154 CO 0.50 0.15 0.00 -2.95 -2.00 0.00 0.00 179.45 175.15 3h3f h ASN 155 N 0.00 0.00 -0.56 7.07 -1.07 -1.89 -3.08 115.58 116.05 3h3f h ASN 155 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 56.30 56.37 3h3f h ASN 155 Cb 0.59 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 36.84 3h3f h ASN 155 CO 0.02 0.00 0.00 0.54 0.07 0.00 0.00 177.43 178.06 3h3f n ARG 156 N -2.81 3.52 -3.79 4.14 1.74 -1.01 0.26 116.66 118.72 3h3f n ARG 156 Ca 0.01 -2.77 -0.26 0.00 -0.77 0.00 0.00 57.85 54.06 3h3f n ARG 156 Cb 0.27 -1.80 -0.17 0.00 -1.02 0.00 0.00 32.46 29.74 3h3f n ARG 156 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 3h3f s VAL 157 N -1.86 0.62 -0.04 1.55 1.01 -1.17 -2.10 120.40 118.42 3h3f s VAL 157 Ca 0.46 -0.31 0.06 0.00 0.00 0.00 0.00 61.98 62.19 3h3f s VAL 157 Cb 0.30 -0.91 -0.01 0.00 0.00 0.00 0.00 36.38 35.76 3h3f s VAL 157 CO 0.21 0.06 -0.22 -0.63 0.00 0.00 0.00 175.10 174.53 3h3f s ILE 158 N 1.84 1.76 -0.09 2.22 1.01 -0.45 -4.78 121.20 122.71 3h3f s ILE 158 Ca 0.02 -0.92 -0.05 0.00 0.00 0.00 0.00 60.65 59.70 3h3f s ILE 158 Cb -0.15 -1.49 -0.04 0.00 0.01 0.00 0.00 42.46 40.80 3h3f s ILE 158 CO -0.07 0.50 0.10 -0.83 0.00 0.00 0.00 174.94 174.64 3h3f s GLY 159 N -0.23 2.06 0.49 6.18 0.00 -0.54 0.28 107.32 115.56 3h3f s GLY 159 Ca 0.01 -0.71 0.16 0.00 0.00 0.00 0.00 44.72 44.17 3h3f s GLY 159 CO 0.02 -0.48 2.08 1.48 0.00 0.00 0.00 173.10 176.19 3h3f h SER 160 N 4.89 0.13 0.00 1.64 4.64 -1.53 -1.28 113.55 122.04 3h3f h SER 160 Ca -0.53 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.79 3h3f h SER 160 Cb 1.21 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 63.27 3h3f h SER 160 CO 0.58 0.09 0.00 0.61 -0.87 0.00 0.00 176.83 177.24 3h3f n GLY 161 N -1.55 3.31 1.66 -0.77 0.00 -1.26 -1.70 105.19 104.88 3h3f n GLY 161 Ca 0.03 -0.12 -0.05 0.00 0.00 0.00 0.00 46.02 45.88 3h3f n GLY 161 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h3f h ASN 163 N 1.86 0.21 -0.01 0.00 -1.24 -0.79 -2.53 115.58 113.08 3h3f h ASN 163 Ca 0.20 -0.11 -0.25 0.00 0.71 0.00 0.00 56.30 56.86 3h3f h ASN 163 Cb 1.90 -0.05 0.02 0.00 0.73 0.00 0.00 38.32 40.91 3h3f h ASN 163 CO 0.55 0.26 -0.93 0.25 -1.29 0.00 0.00 177.43 176.27 3h3f h LEU 164 N 0.14 0.88 -1.26 0.34 5.85 -1.80 -2.91 115.31 116.56 3h3f h LEU 164 Ca 0.06 -0.66 0.19 0.00 0.84 0.00 0.00 57.88 58.31 3h3f h LEU 164 Cb 0.11 -0.27 -0.08 0.00 0.37 0.00 0.00 40.66 40.79 3h3f h LEU 164 CO -0.01 1.46 0.61 0.44 -0.34 0.00 0.00 178.44 180.60 3h3f h ASP 165 N 0.43 0.61 0.91 1.25 5.19 -1.81 -1.19 116.42 121.82 3h3f h ASP 165 Ca -0.10 0.07 -0.20 0.00 -0.62 0.00 0.00 57.03 56.18 3h3f h ASP 165 Cb 1.58 -0.05 -0.03 0.00 0.18 0.00 0.00 39.33 41.01 3h3f h ASP 165 CO 0.18 0.24 -0.95 0.28 -3.12 0.00 0.00 179.24 175.87 3h3f h SER 166 N 0.60 0.03 -0.43 6.45 0.02 -1.36 -0.95 113.55 117.92 3h3f h SER 166 Ca 0.52 -0.03 -0.07 0.00 -0.84 0.00 0.00 61.79 61.37 3h3f h SER 166 Cb 1.01 -0.01 -0.02 0.00 0.14 0.00 0.00 62.40 63.52 3h3f h SER 166 CO -0.27 0.96 0.01 0.00 -1.14 0.00 0.00 176.83 176.39 3h3f h ALA 167 N 1.03 0.58 -0.96 3.77 0.00 -1.20 -0.98 119.26 121.50 3h3f h ALA 167 Ca -0.02 -0.26 0.03 0.00 0.00 0.00 0.00 54.91 54.66 3h3f h ALA 167 Cb 1.67 -0.16 -0.05 0.00 0.00 0.00 0.00 17.79 19.25 3h3f h ALA 167 CO 0.13 0.36 0.63 0.00 0.00 0.00 0.00 179.25 180.37 3h3f h ARG 168 N 0.60 1.20 -0.24 0.00 3.08 -1.14 -0.45 114.38 117.44 3h3f h ARG 168 Ca 0.12 -0.07 -0.06 0.00 0.07 0.00 0.00 59.98 60.04 3h3f h ARG 168 Cb 0.48 -0.27 -0.01 0.00 0.08 0.00 0.00 29.97 30.25 3h3f h ARG 168 CO 0.02 0.80 -0.08 0.35 -1.07 0.00 0.00 179.97 179.99 3h3f h PHE 169 N 1.24 0.53 -0.45 3.04 3.04 -0.61 -2.49 116.94 121.25 3h3f h PHE 169 Ca 0.38 -0.12 -0.10 0.00 3.98 0.00 0.00 57.97 62.11 3h3f h PHE 169 Cb -0.03 -0.13 -0.02 0.00 2.56 0.00 0.00 35.95 38.33 3h3f h PHE 169 CO -0.00 0.71 -0.12 0.00 -2.02 0.00 0.00 178.31 176.88 3h3f h ARG 170 N 0.20 0.82 -0.41 1.11 3.08 -0.93 -0.05 114.38 118.21 3h3f h ARG 170 Ca 0.06 -0.28 0.09 0.00 0.07 0.00 0.00 59.98 59.91 3h3f h ARG 170 Cb 0.55 -0.06 -0.09 0.00 0.08 0.00 0.00 29.97 30.45 3h3f h ARG 170 CO 0.03 0.90 -0.21 -0.92 -1.07 0.00 0.00 179.97 178.70 3h3f h TYR 171 N 0.74 -0.53 -0.06 3.04 3.20 -1.05 -0.50 116.97 121.79 3h3f h TYR 171 Ca 0.12 0.05 -0.21 0.00 3.14 0.00 0.00 58.73 61.83 3h3f h TYR 171 Cb 0.62 0.30 0.00 0.00 1.54 0.00 0.00 36.73 39.19 3h3f h TYR 171 CO 0.03 -0.29 -0.81 -0.07 -1.64 0.00 0.00 178.16 175.38 3h3f h LEU 172 N -0.13 0.58 0.41 2.82 3.38 -1.15 -2.11 115.31 119.10 3h3f h LEU 172 Ca 0.20 -0.41 -0.01 0.00 0.09 0.00 0.00 57.88 57.75 3h3f h LEU 172 Cb 0.44 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.00 3h3f h LEU 172 CO -0.50 1.18 -0.33 -0.03 0.09 0.00 0.00 178.44 178.85 3h3f h MET 173 N 0.31 -0.71 -0.86 1.13 4.05 -1.00 -1.57 114.93 116.28 3h3f h MET 173 Ca -0.05 0.05 0.10 0.00 -0.28 0.00 0.00 59.70 59.52 3h3f h MET 173 Cb 1.42 0.16 -0.06 0.00 -0.80 0.00 0.00 31.60 32.32 3h3f h MET 173 CO 0.14 -0.47 0.56 0.78 0.23 0.00 0.00 176.91 178.15 3h3f h GLY 174 N -0.74 1.19 1.10 1.39 0.00 -0.98 -1.91 103.07 103.12 3h3f h GLY 174 Ca -0.04 -0.33 -0.11 0.00 0.00 0.00 0.00 47.33 46.86 3h3f h GLY 174 CO -0.01 0.18 -0.04 -2.09 0.00 0.00 0.00 176.54 174.57 3h3f h GLU 175 N 0.80 1.07 0.00 4.80 4.57 -1.28 1.70 114.58 126.23 3h3f h GLU 175 Ca 0.40 -0.36 0.00 0.00 -1.18 0.00 0.00 59.36 58.22 3h3f h GLU 175 Cb 0.47 -0.09 0.00 0.00 -0.16 0.00 0.00 28.75 28.98 3h3f h GLU 175 CO -0.17 1.06 0.00 0.00 -1.18 0.00 0.00 179.01 178.72 3h3f h ARG 176 N 0.96 0.00 0.00 1.92 3.08 -0.53 -3.31 114.38 116.50 3h3f h ARG 176 Ca 0.16 0.00 -0.06 0.00 0.07 0.00 0.00 59.98 60.15 3h3f h ARG 176 Cb 0.61 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.65 3h3f h ARG 176 CO 0.04 0.00 -1.46 1.28 -1.07 0.00 0.00 179.97 178.76 3h3f n LEU 177 N -2.77 0.00 -0.05 3.04 4.32 -0.59 -5.03 117.00 115.92 3h3f n LEU 177 Ca 0.02 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 56.01 3h3f n LEU 177 Cb 0.32 0.08 0.00 0.00 -1.62 0.00 0.00 43.42 42.20 3h3f n LEU 177 CO 0.26 0.08 0.00 0.61 -1.22 0.00 0.00 177.39 177.12 3h3f n GLY 178 N 2.23 1.01 2.95 -0.72 0.00 0.56 -5.06 105.19 106.17 3h3f n GLY 178 Ca -0.06 -0.51 -0.10 0.00 0.00 0.00 0.00 46.02 45.34 3h3f n GLY 178 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3h3f s VAL 179 N -2.11 0.07 0.33 1.61 1.01 -0.36 -5.03 120.40 115.93 3h3f s VAL 179 Ca 0.00 -0.61 -0.26 0.00 0.00 0.00 0.00 61.98 61.11 3h3f s VAL 179 Cb 0.00 -0.18 -0.13 0.00 0.00 0.00 0.00 36.38 36.07 3h3f s VAL 179 CO 0.00 -0.33 0.91 1.57 0.00 0.00 0.00 175.10 177.24 3h3f n HIS 180 N 2.08 0.87 0.30 5.22 -0.00 -1.26 -4.21 115.22 118.21 3h3f n HIS 180 Ca -0.20 0.67 0.19 0.00 -0.00 0.00 0.00 57.72 58.38 3h3f n HIS 180 Cb 0.57 -2.19 1.01 0.00 -0.00 0.00 0.00 29.99 29.38 3h3f n HIS 180 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 3h3f h ALA 181 N 1.64 1.36 0.00 1.57 0.00 -1.90 0.74 119.26 122.66 3h3f h ALA 181 Ca -0.40 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.50 3h3f h ALA 181 Cb 1.35 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.15 3h3f h ALA 181 CO 0.58 -0.10 -0.04 1.25 0.00 0.00 0.00 179.25 180.95 3h3f h LEU 182 N 0.00 0.00 -0.70 0.00 5.85 -1.90 -2.63 115.31 115.93 3h3f h LEU 182 Ca 0.02 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.74 3h3f h LEU 182 Cb 0.17 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.20 3h3f h LEU 182 CO -0.00 0.04 -0.36 -1.20 -0.34 0.00 0.00 178.44 176.58 3h3f n SER 183 N -4.23 1.36 -4.86 1.25 7.64 0.24 -4.92 113.62 110.11 3h3f n SER 183 Ca -0.03 -1.18 -0.37 0.00 1.01 0.00 0.00 58.87 58.30 3h3f n SER 183 Cb 0.12 0.56 -0.06 0.00 -1.01 0.00 0.00 64.21 63.82 3h3f n SER 183 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3h3f s HIS 185 N -1.08 2.01 0.00 0.00 0.09 0.04 -4.90 115.29 111.44 3h3f s HIS 185 Ca 0.21 -0.40 0.00 0.00 -0.00 0.00 0.00 55.06 54.87 3h3f s HIS 185 Cb -0.14 -1.11 0.00 0.00 -0.00 0.00 0.00 32.58 31.32 3h3f s HIS 185 CO 0.10 0.23 0.00 0.41 -0.00 0.00 0.00 174.74 175.48 3h3f n GLY 186 N 1.16 1.91 3.22 -2.22 0.00 -1.26 -1.73 105.19 106.27 3h3f n GLY 186 Ca -0.19 0.16 -0.29 0.00 0.00 0.00 0.00 46.02 45.70 3h3f n GLY 186 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3h3f s TRP 187 N -0.31 2.10 -0.19 1.61 0.52 -1.26 -4.85 118.94 116.56 3h3f s TRP 187 Ca 0.00 -0.58 0.01 0.00 0.02 0.00 0.00 56.10 55.55 3h3f s TRP 187 Cb 0.00 -1.38 0.03 0.00 -1.15 0.00 0.00 33.47 30.96 3h3f s TRP 187 CO 0.00 -0.17 -0.18 0.42 0.02 0.00 0.00 176.95 177.04 3h3f s ILE 188 N -0.15 2.04 0.41 2.03 1.01 -1.26 0.46 121.20 125.74 3h3f s ILE 188 Ca -0.02 -1.01 0.07 0.00 0.00 0.00 0.00 60.65 59.70 3h3f s ILE 188 Cb -0.12 -1.89 -0.06 0.00 0.01 0.00 0.00 42.46 40.40 3h3f s ILE 188 CO 0.02 0.46 0.11 -0.76 0.00 0.00 0.00 174.94 174.77 3h3f s LEU 189 N 1.28 3.02 0.00 2.97 1.02 -0.42 -4.75 118.68 121.80 3h3f s LEU 189 Ca 0.03 -1.19 0.00 0.00 0.02 0.00 0.00 54.13 52.99 3h3f s LEU 189 Cb -0.14 -1.23 0.00 0.00 0.02 0.00 0.00 46.19 44.84 3h3f s LEU 189 CO -0.12 -0.50 0.00 0.61 0.02 0.00 0.00 176.35 176.36 3h3f n GLY 190 N -1.13 0.93 3.67 -3.19 0.00 -0.26 0.04 105.19 105.25 3h3f n GLY 190 Ca -0.03 -1.44 -0.42 0.00 0.00 0.00 0.00 46.02 44.13 3h3f n GLY 190 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3h3f s GLU 191 N 0.00 4.34 0.18 1.61 2.02 -1.26 -0.89 118.70 124.70 3h3f s GLU 191 Ca 0.00 1.24 -0.33 0.00 0.02 0.00 0.00 54.97 55.90 3h3f s GLU 191 Cb 0.00 -3.58 -0.14 0.00 0.10 0.00 0.00 34.13 30.51 3h3f s GLU 191 CO 0.00 -0.39 1.40 1.58 0.02 0.00 0.00 175.26 177.87 3h3f n HIS 192 N 5.38 1.94 0.00 1.61 -0.00 -1.26 -2.95 115.22 119.93 3h3f n HIS 192 Ca 0.08 0.46 0.00 0.00 -0.00 0.00 0.00 57.72 58.26 3h3f n HIS 192 Cb 0.48 -2.43 0.00 0.00 -0.00 0.00 0.00 29.99 28.04 3h3f n HIS 192 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 3h3f n GLY 193 N 2.55 0.29 0.43 1.57 0.00 -1.26 -4.65 105.19 104.12 3h3f n GLY 193 Ca 0.15 -1.84 0.24 0.00 0.00 0.00 0.00 46.02 44.57 3h3f n GLY 193 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3h3f h ASP 194 N 0.00 0.20 -0.68 1.61 5.19 -1.89 -2.78 116.42 118.07 3h3f h ASP 194 Ca 0.00 0.02 0.00 0.00 -0.62 0.00 0.00 57.03 56.43 3h3f h ASP 194 Cb 0.00 -0.01 0.00 0.00 0.18 0.00 0.00 39.33 39.50 3h3f h ASP 194 CO 0.00 0.07 0.00 -1.20 -3.12 0.00 0.00 179.24 174.99 3h3f n SER 195 N -4.40 4.07 -4.76 6.45 7.64 -1.26 -5.01 113.62 116.36 3h3f n SER 195 Ca 0.19 -2.15 -0.31 0.00 1.01 0.00 0.00 58.87 57.62 3h3f n SER 195 Cb 0.85 -0.51 0.10 0.00 -1.01 0.00 0.00 64.21 63.64 3h3f n SER 195 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 3h3f s SER 196 N -0.96 4.27 -0.30 6.43 1.04 -1.05 -4.45 113.70 118.68 3h3f s SER 196 Ca 0.48 1.73 -0.02 0.00 0.48 0.00 0.00 55.95 58.61 3h3f s SER 196 Cb 0.27 -2.43 0.05 0.00 0.10 0.00 0.00 66.02 64.01 3h3f s SER 196 CO 0.29 -2.17 0.01 -0.69 0.98 0.00 0.00 173.24 171.66 3h3f s VAL 197 N -2.92 3.10 -0.30 5.02 1.01 0.11 -4.93 120.40 121.48 3h3f s VAL 197 Ca 0.62 -1.32 -0.29 0.00 0.00 0.00 0.00 61.98 60.98 3h3f s VAL 197 Cb -0.17 -2.76 -0.01 0.00 0.00 0.00 0.00 36.38 33.43 3h3f s VAL 197 CO 0.56 -0.10 1.61 -2.16 0.00 0.00 0.00 175.10 175.01 3h3f s PRO 198 N 1.28 3.61 -0.99 2.72 0.04 -1.26 -1.31 135.00 139.09 3h3f s PRO 198 Ca -0.04 1.39 -0.23 0.00 0.04 0.00 0.00 61.00 62.16 3h3f s PRO 198 Cb -0.20 -4.07 0.03 0.00 0.04 0.00 0.00 34.50 30.30 3h3f s PRO 198 CO -0.01 -1.52 1.57 0.08 0.04 0.00 0.00 177.00 177.16 3h3f s VAL 199 N 5.73 3.80 0.48 -0.36 1.01 0.17 -4.82 120.40 126.42 3h3f s VAL 199 Ca 0.71 -0.65 0.23 0.00 0.00 0.00 0.00 61.98 62.26 3h3f s VAL 199 Cb -0.21 -4.79 0.41 0.00 0.00 0.00 0.00 36.38 31.78 3h3f s VAL 199 CO 0.31 -1.69 1.91 -0.50 0.00 0.00 0.00 175.10 175.14 3h3f h TRP 200 N 10.18 0.25 -0.01 5.22 4.06 -1.92 -2.59 115.95 131.15 3h3f h TRP 200 Ca 0.17 0.01 -0.16 0.00 2.06 0.00 0.00 58.89 60.97 3h3f h TRP 200 Cb 1.01 -0.08 -0.02 0.00 -1.00 0.00 0.00 29.16 29.07 3h3f h TRP 200 CO 1.26 0.08 -0.73 0.66 -3.56 0.00 0.00 178.44 176.15 3h3f h SER 201 N 0.20 0.10 0.24 -3.49 4.64 -1.96 -3.10 113.55 110.18 3h3f h SER 201 Ca 0.38 -0.07 0.00 0.00 -0.47 0.00 0.00 61.79 61.63 3h3f h SER 201 Cb 1.20 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 63.26 3h3f h SER 201 CO -0.07 0.79 -0.01 0.61 -0.87 0.00 0.00 176.83 177.28 3h3f n GLY 202 N 0.55 -1.09 3.67 -0.77 0.00 -0.98 -4.85 105.19 101.72 3h3f n GLY 202 Ca -0.02 -0.19 -0.43 0.00 0.00 0.00 0.00 46.02 45.39 3h3f n GLY 202 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3h3f s MET 203 N -2.25 4.29 0.16 1.61 -1.94 -1.17 -4.32 119.30 115.68 3h3f s MET 203 Ca 0.39 1.43 -0.13 0.00 -1.71 0.00 0.00 55.69 55.67 3h3f s MET 203 Cb 0.21 -3.64 0.01 0.00 2.01 0.00 0.00 34.83 33.42 3h3f s MET 203 CO 0.41 -0.59 0.38 0.54 -0.01 0.00 0.00 175.02 175.76 3h3f s ASN 204 N 1.32 -0.10 -0.13 3.03 4.22 -0.71 -1.54 114.94 121.03 3h3f s ASN 204 Ca 0.47 -0.62 0.02 0.00 -2.14 0.00 0.00 52.86 50.59 3h3f s ASN 204 Cb -0.17 0.49 0.01 0.00 1.28 0.00 0.00 41.25 42.86 3h3f s ASN 204 CO 0.10 -0.93 -0.20 -0.69 -2.04 0.00 0.00 177.10 173.33 3h3f s VAL 205 N -3.90 1.89 -1.46 3.54 1.01 -1.24 -0.78 120.40 119.47 3h3f s VAL 205 Ca 0.11 -0.88 -0.11 0.00 0.00 0.00 0.00 61.98 61.09 3h3f s VAL 205 Cb 0.02 -1.68 0.05 0.00 0.00 0.00 0.00 36.38 34.76 3h3f s VAL 205 CO -0.04 0.52 1.02 0.00 0.00 0.00 0.00 175.10 176.60 3h3f n ALA 206 N 4.04 -1.25 -0.58 5.51 0.00 -1.26 -1.89 120.51 125.07 3h3f n ALA 206 Ca -0.20 0.29 0.00 0.00 0.00 0.00 0.00 53.44 53.53 3h3f n ALA 206 Cb 0.52 -4.81 0.00 0.00 0.00 0.00 0.00 19.45 15.15 3h3f n ALA 206 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3h3f n GLY 207 N -1.79 1.50 3.41 0.00 0.00 -1.26 -4.97 105.19 102.08 3h3f n GLY 207 Ca 0.02 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.60 3h3f n GLY 207 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3h3f s VAL 208 N -3.25 4.67 -0.06 1.61 -7.23 -0.79 -5.03 120.40 110.31 3h3f s VAL 208 Ca 0.00 -0.68 -0.39 0.00 -1.81 0.00 0.00 61.98 59.11 3h3f s VAL 208 Cb 0.00 -4.52 -0.17 0.00 0.56 0.00 0.00 36.38 32.25 3h3f s VAL 208 CO 0.00 -1.17 1.44 -0.24 -0.31 0.00 0.00 175.10 174.82 3h3f n SER 209 N 6.75 1.65 0.10 4.85 2.88 -1.26 -3.69 113.62 124.89 3h3f n SER 209 Ca -0.07 1.11 -0.19 0.00 -1.33 0.00 0.00 58.87 58.40 3h3f n SER 209 Cb 0.44 -1.13 -0.12 0.00 -0.75 0.00 0.00 64.21 62.65 3h3f n SER 209 CO 0.00 0.00 0.00 -0.07 -1.23 0.00 0.00 175.04 173.74 3h3f h LEU 210 N 5.18 0.64 -1.97 2.46 4.07 -1.60 -2.79 115.31 121.31 3h3f h LEU 210 Ca -0.48 -0.62 0.33 0.00 0.08 0.00 0.00 57.88 57.20 3h3f h LEU 210 Cb 1.34 -0.20 -0.05 0.00 1.08 0.00 0.00 40.66 42.83 3h3f h LEU 210 CO 0.83 1.45 0.83 0.50 -1.08 0.00 0.00 178.44 180.97 3h3f h LYS 211 N 0.18 0.02 0.06 1.13 1.63 -1.77 0.49 116.57 118.30 3h3f h LYS 211 Ca -0.16 -0.00 -0.36 0.00 -0.85 0.00 0.00 60.65 59.28 3h3f h LYS 211 Cb 1.90 -0.00 -0.04 0.00 -0.60 0.00 0.00 32.23 33.49 3h3f h LYS 211 CO 0.22 0.01 -2.16 2.41 -3.45 0.00 0.00 179.45 176.48 3h3f n THR 212 N -4.21 1.63 -0.04 1.00 -1.04 -1.17 -1.81 114.28 108.64 3h3f n THR 212 Ca 0.25 -0.66 -0.10 0.00 -2.04 0.00 0.00 64.05 61.50 3h3f n THR 212 Cb 1.21 -1.43 -0.04 0.00 -1.82 0.00 0.00 70.33 68.25 3h3f n THR 212 CO 0.00 0.00 0.00 0.25 -0.64 0.00 0.00 175.07 174.68 3h3f h LEU 213 N 0.03 0.22 -6.30 -4.42 5.85 -1.35 -3.39 115.31 105.95 3h3f h LEU 213 Ca -0.47 -0.01 -0.59 0.00 0.84 0.00 0.00 57.88 57.66 3h3f h LEU 213 Cb 2.01 -0.05 -0.40 0.00 0.37 0.00 0.00 40.66 42.59 3h3f h LEU 213 CO 0.02 0.16 -0.90 1.57 -0.34 0.00 0.00 178.44 178.96 3h3f n HIS 214 N -4.96 0.73 1.02 1.25 -0.00 0.15 -5.00 115.22 108.41 3h3f n HIS 214 Ca -0.03 -3.70 0.08 0.00 -0.00 0.00 0.00 57.72 54.06 3h3f n HIS 214 Cb 0.03 -0.24 0.49 0.00 -0.00 0.00 0.00 29.99 30.26 3h3f n HIS 214 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 176.34 175.99 3h3f n PRO 215 N 1.81 0.50 0.00 1.57 -0.04 -0.75 -1.25 135.00 136.84 3h3f n PRO 215 Ca 0.25 0.01 0.14 0.00 -0.04 0.00 0.00 63.50 63.86 3h3f n PRO 215 Cb 0.47 -1.50 0.67 0.00 -0.04 0.00 0.00 33.50 33.09 3h3f n PRO 215 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 3h3f n GLU 216 N -1.01 0.52 -1.26 0.54 0.28 -1.26 -4.94 120.64 113.50 3h3f n GLU 216 Ca 0.12 -0.11 -0.45 0.00 -0.16 0.00 0.00 57.16 56.57 3h3f n GLU 216 Cb 0.06 -1.50 -0.04 0.00 1.43 0.00 0.00 31.44 31.39 3h3f n GLU 216 CO 0.00 0.00 0.00 -0.11 -0.16 0.00 0.00 177.13 176.86 3h3f n LEU 217 N -1.15 -0.79 -0.43 -1.84 7.94 -0.38 -2.21 117.00 118.14 3h3f n LEU 217 Ca 0.14 1.00 -0.06 0.00 -1.11 0.00 0.00 56.01 55.98 3h3f n LEU 217 Cb 0.26 -0.83 -0.02 0.00 0.53 0.00 0.00 43.42 43.36 3h3f n LEU 217 CO 0.24 -2.36 -0.05 0.61 -1.11 0.00 0.00 177.39 174.71 3h3f n GLY 218 N 1.64 0.70 3.94 -3.96 0.00 -1.26 -4.97 105.19 101.27 3h3f n GLY 218 Ca 0.16 -0.18 -0.25 0.00 0.00 0.00 0.00 46.02 45.76 3h3f n GLY 218 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3h3f s THR 219 N -1.85 4.41 0.02 2.61 2.01 -0.94 -4.72 115.64 117.18 3h3f s THR 219 Ca 0.00 -0.27 -0.25 0.00 0.31 0.00 0.00 61.69 61.48 3h3f s THR 219 Cb 0.00 -3.65 -0.17 0.00 0.01 0.00 0.00 72.50 68.69 3h3f s THR 219 CO 0.00 -0.52 1.37 0.44 -0.69 0.00 0.00 174.62 175.22 3h3f h ASP 220 N 0.37 -0.19 -1.08 3.53 3.45 -1.93 -3.24 116.42 117.32 3h3f h ASP 220 Ca -0.47 -0.22 -0.74 0.00 0.43 0.00 0.00 57.03 56.03 3h3f h ASP 220 Cb 1.23 0.05 -0.11 0.00 -0.56 0.00 0.00 39.33 39.94 3h3f h ASP 220 CO 0.60 0.13 2.49 0.00 -1.57 0.00 0.00 179.24 180.88 3h3f n ALA 221 N -2.35 6.67 -3.67 3.45 0.00 -1.26 -4.69 120.51 118.66 3h3f n ALA 221 Ca -0.09 -4.07 -0.36 0.00 0.00 0.00 0.00 53.44 48.92 3h3f n ALA 221 Cb 0.21 -2.86 -0.07 0.00 0.00 0.00 0.00 19.45 16.74 3h3f n ALA 221 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 3h3f s ASP 222 N 0.60 5.80 0.33 0.00 2.15 -1.22 -4.95 116.67 119.37 3h3f s ASP 222 Ca 0.53 -3.59 0.17 0.00 0.43 0.00 0.00 52.55 50.09 3h3f s ASP 222 Cb 0.17 -1.88 1.15 0.00 -0.30 0.00 0.00 42.92 42.06 3h3f s ASP 222 CO -0.08 -0.21 1.42 2.29 -0.17 0.00 0.00 175.17 178.42 3h3f n LYS 223 N 2.50 -0.06 -2.89 4.34 0.00 -1.26 -1.93 118.16 118.87 3h3f n LYS 223 Ca 0.19 1.26 -0.43 0.00 -0.00 0.00 0.00 58.31 59.33 3h3f n LYS 223 Cb 0.37 -2.22 -0.05 0.00 -0.00 0.00 0.00 35.03 33.13 3h3f n LYS 223 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.40 175.40 3h3f s GLU 224 N -5.43 3.36 -0.44 -1.58 2.56 -1.26 -5.00 118.70 110.91 3h3f s GLU 224 Ca -0.09 -0.21 -0.06 0.00 0.00 0.00 0.00 54.97 54.62 3h3f s GLU 224 Cb 0.30 -4.01 0.11 0.00 2.00 0.00 0.00 34.13 32.53 3h3f s GLU 224 CO 0.70 -1.34 0.27 1.14 -0.56 0.00 0.00 175.26 175.47 3h3f s GLN 225 N 3.67 2.24 0.00 4.30 -2.07 -0.81 -4.77 119.66 122.21 3h3f s GLN 225 Ca 0.30 -1.78 0.27 0.00 -1.82 0.00 0.00 55.36 52.33 3h3f s GLN 225 Cb -0.13 -3.74 0.85 0.00 -1.09 0.00 0.00 33.01 28.91 3h3f s GLN 225 CO 0.21 -1.12 1.64 0.91 -1.32 0.00 0.00 175.29 175.60 3h3f n TRP 226 N 4.75 0.00 0.03 9.60 7.02 -1.26 -3.27 117.44 134.30 3h3f n TRP 226 Ca -0.05 0.00 -0.02 0.00 -1.02 0.00 0.00 57.50 56.40 3h3f n TRP 226 Cb 0.41 -0.26 0.23 0.00 -2.42 0.00 0.00 31.31 29.27 3h3f n TRP 226 CO 0.00 0.00 0.00 0.87 -2.02 0.00 0.00 177.69 176.54 3h3f h LYS 227 N 0.35 0.43 -0.02 -0.99 1.57 -1.84 -1.80 116.57 114.27 3h3f h LYS 227 Ca 0.00 -0.16 0.00 0.00 -1.87 0.00 0.00 60.65 58.63 3h3f h LYS 227 Cb 0.47 -0.03 -0.00 0.00 0.08 0.00 0.00 32.23 32.75 3h3f h LYS 227 CO 0.00 0.65 -0.01 1.04 -0.57 0.00 0.00 179.45 180.56 3h3f n GLN 228 N -4.13 -0.01 -0.25 3.15 3.00 -1.20 0.26 117.38 118.20 3h3f n GLN 228 Ca -0.00 0.69 0.00 0.00 -0.01 0.00 0.00 57.00 57.68 3h3f n GLN 228 Cb 0.39 -1.03 0.07 0.00 0.00 0.00 0.00 30.24 29.67 3h3f n GLN 228 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.06 177.34 3h3f h VAL 229 N 0.00 0.24 -0.43 5.09 2.07 -1.53 0.44 116.25 122.13 3h3f h VAL 229 Ca 0.00 0.00 -0.11 0.00 0.82 0.00 0.00 66.70 67.41 3h3f h VAL 229 Cb 0.01 0.24 -0.02 0.00 -1.52 0.00 0.00 31.29 30.01 3h3f h VAL 229 CO -0.02 0.00 -0.19 -0.74 0.02 0.00 0.00 177.57 176.64 3h3f h HIS 230 N -0.02 0.94 0.16 1.57 -0.00 -1.03 0.05 115.15 116.81 3h3f h HIS 230 Ca 0.34 -0.20 -0.01 0.00 -0.00 0.00 0.00 60.37 60.50 3h3f h HIS 230 Cb 0.54 -0.23 0.00 0.00 -0.00 0.00 0.00 27.41 27.73 3h3f h HIS 230 CO -0.60 0.95 -0.08 -0.22 -0.00 0.00 0.00 177.93 177.97 3h3f h LYS 231 N 0.73 -0.22 -0.79 5.26 1.63 0.18 0.18 116.57 123.55 3h3f h LYS 231 Ca 0.11 0.01 0.18 0.00 -0.85 0.00 0.00 60.65 60.11 3h3f h LYS 231 Cb 0.71 0.05 -0.13 0.00 -0.60 0.00 0.00 32.23 32.25 3h3f h LYS 231 CO 0.05 -0.15 0.05 1.96 -3.45 0.00 0.00 179.45 177.91 3h3f h GLN 232 N -0.23 0.12 0.01 1.90 4.20 0.12 0.44 115.11 121.66 3h3f h GLN 232 Ca -0.02 -0.01 -0.00 0.00 0.06 0.00 0.00 58.65 58.68 3h3f h GLN 232 Cb 0.18 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 27.93 3h3f h GLN 232 CO 0.03 0.08 -0.00 0.28 -0.67 0.00 0.00 178.83 178.55 3h3f h VAL 233 N 0.12 1.02 -0.47 -0.54 2.07 -0.41 -1.95 116.25 116.10 3h3f h VAL 233 Ca 0.44 -0.08 -0.10 0.00 0.82 0.00 0.00 66.70 67.78 3h3f h VAL 233 Cb 0.80 1.08 -0.02 0.00 -1.52 0.00 0.00 31.29 31.63 3h3f h VAL 233 CO -0.67 0.02 -0.12 -0.37 0.02 0.00 0.00 177.57 176.45 3h3f h VAL 234 N -0.04 1.26 0.00 2.57 -1.51 -0.01 -2.30 116.25 116.22 3h3f h VAL 234 Ca -0.00 -1.21 0.00 0.00 -1.23 0.00 0.00 66.70 64.26 3h3f h VAL 234 Cb 0.04 1.03 0.00 0.00 -2.13 0.00 0.00 31.29 30.23 3h3f h VAL 234 CO 0.00 0.42 0.00 0.47 -1.23 0.00 0.00 177.57 177.23 3h3f n ASP 235 N -4.15 0.00 -0.02 4.19 9.92 0.14 -4.28 116.55 122.35 3h3f n ASP 235 Ca 0.01 -0.45 -0.12 0.00 -0.53 0.00 0.00 54.79 53.70 3h3f n ASP 235 Cb 0.38 0.00 -0.08 0.00 -0.64 0.00 0.00 41.12 40.78 3h3f n ASP 235 CO 0.00 0.00 0.00 -1.28 0.13 0.00 0.00 177.20 176.05 3h3f h SER 236 N 0.00 0.10 1.22 -2.24 0.87 -0.75 -2.70 113.55 110.05 3h3f h SER 236 Ca 0.00 -0.34 0.00 0.00 -1.23 0.00 0.00 61.79 60.22 3h3f h SER 236 Cb 0.00 -0.03 0.00 0.00 -0.44 0.00 0.00 62.40 61.93 3h3f h SER 236 CO 0.00 0.41 -0.46 0.00 -0.53 0.00 0.00 176.83 176.25 3h3f h ALA 237 N 0.69 0.73 -0.53 6.23 0.00 -1.80 -2.81 119.26 121.77 3h3f h ALA 237 Ca 0.01 0.00 -0.11 0.00 0.00 0.00 0.00 54.91 54.81 3h3f h ALA 237 Cb 0.36 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 3h3f h ALA 237 CO 0.00 0.00 -0.10 -0.92 0.00 0.00 0.00 179.25 178.23 3h3f h TYR 238 N 0.00 1.13 -0.02 0.00 5.03 -1.81 0.55 116.97 121.86 3h3f h TYR 238 Ca 0.00 -0.23 -0.01 0.00 2.58 0.00 0.00 58.73 61.07 3h3f h TYR 238 Cb 0.84 -0.28 -0.00 0.00 1.55 0.00 0.00 36.73 38.84 3h3f h TYR 238 CO 0.00 1.05 -0.02 1.49 -1.32 0.00 0.00 178.16 179.36 3h3f h GLU 239 N 0.88 0.05 -0.24 1.82 4.57 -1.44 0.46 114.58 120.67 3h3f h GLU 239 Ca 0.14 -0.02 0.00 0.00 -1.18 0.00 0.00 59.36 58.30 3h3f h GLU 239 Cb 0.67 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.25 3h3f h GLU 239 CO 0.05 0.52 0.16 0.28 -1.18 0.00 0.00 179.01 178.83 3h3f h VAL 240 N -0.43 1.07 -0.24 0.32 2.07 -1.56 -1.56 116.25 115.94 3h3f h VAL 240 Ca 0.00 -0.16 0.05 0.00 0.82 0.00 0.00 66.70 67.42 3h3f h VAL 240 Cb 0.51 0.74 -0.05 0.00 -1.52 0.00 0.00 31.29 30.97 3h3f h VAL 240 CO 0.00 0.07 -0.07 0.40 0.02 0.00 0.00 177.57 177.99 3h3f h ILE 241 N 0.32 0.73 -1.05 4.57 2.04 -0.81 0.22 117.51 123.52 3h3f h ILE 241 Ca 0.09 0.00 0.28 0.00 1.00 0.00 0.00 64.86 66.23 3h3f h ILE 241 Cb -0.02 0.73 -0.08 0.00 -0.74 0.00 0.00 36.82 36.71 3h3f h ILE 241 CO -0.02 0.00 0.70 0.50 0.00 0.00 0.00 178.15 179.33 3h3f h LYS 242 N -0.02 0.28 0.09 2.37 3.64 0.26 0.14 116.57 123.34 3h3f h LYS 242 Ca 0.12 -0.02 -0.37 0.00 -1.27 0.00 0.00 60.65 59.12 3h3f h LYS 242 Cb 0.20 -0.06 -0.03 0.00 -0.41 0.00 0.00 32.23 31.93 3h3f h LYS 242 CO -0.26 0.19 -2.08 1.28 -2.27 0.00 0.00 179.45 176.30 3h3f n LEU 243 N -4.51 2.68 -0.29 5.20 4.77 -0.11 -4.58 117.00 120.15 3h3f n LEU 243 Ca 0.25 0.15 0.03 0.00 -0.03 0.00 0.00 56.01 56.41 3h3f n LEU 243 Cb 0.95 -1.07 0.04 0.00 -2.33 0.00 0.00 43.42 41.01 3h3f n LEU 243 CO 0.29 0.85 0.40 2.29 -1.33 0.00 0.00 177.39 179.89 3h3f n LYS 244 N -3.48 0.48 0.00 3.23 2.85 0.58 -5.01 118.16 116.82 3h3f n LYS 244 Ca -0.35 -1.07 0.00 0.00 -1.05 0.00 0.00 58.31 55.84 3h3f n LYS 244 Cb 1.02 -1.14 0.00 0.00 -0.65 0.00 0.00 35.03 34.27 3h3f n LYS 244 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 3h3f n GLY 245 N 0.33 2.98 3.83 2.58 0.00 0.49 -4.98 105.19 110.42 3h3f n GLY 245 Ca 0.05 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.00 3h3f n GLY 245 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3h3f s TYR 246 N -2.53 -0.00 0.04 1.61 -0.85 -1.26 -4.91 117.35 109.45 3h3f s TYR 246 Ca 0.00 -0.54 0.08 0.00 -0.52 0.00 0.00 57.07 56.09 3h3f s TYR 246 Cb 0.00 0.76 -0.03 0.00 0.38 0.00 0.00 41.96 43.08 3h3f s TYR 246 CO 0.00 -1.31 -0.22 0.95 -1.52 0.00 0.00 175.55 173.46 3h3f s THR 247 N -2.85 1.76 0.27 -3.49 -4.23 -1.26 -4.35 115.64 101.49 3h3f s THR 247 Ca 0.15 -1.24 0.00 0.00 -1.18 0.00 0.00 61.69 59.42 3h3f s THR 247 Cb -0.05 -1.52 0.00 0.00 1.34 0.00 0.00 72.50 72.27 3h3f s THR 247 CO 0.08 0.23 0.00 0.35 -0.54 0.00 0.00 174.62 174.75 3h3f n THR 248 N 1.83 0.00 -0.03 3.99 -2.24 -1.26 -4.62 114.28 111.95 3h3f n THR 248 Ca -0.17 0.00 -0.09 0.00 -2.27 0.00 0.00 64.05 61.52 3h3f n THR 248 Cb 0.53 -0.40 -0.02 0.00 -2.10 0.00 0.00 70.33 68.34 3h3f n THR 248 CO 0.00 0.00 0.00 -0.50 -0.57 0.00 0.00 175.07 174.00 3h3f h TRP 249 N 0.00 -0.48 -0.64 4.78 4.06 -1.95 -0.53 115.95 121.19 3h3f h TRP 249 Ca 0.00 0.03 -0.09 0.00 2.06 0.00 0.00 58.89 60.89 3h3f h TRP 249 Cb 0.00 0.24 -0.02 0.00 -1.00 0.00 0.00 29.16 28.38 3h3f h TRP 249 CO 0.00 -0.26 0.05 0.00 -3.56 0.00 0.00 178.44 174.67 3h3f h ALA 250 N 0.87 0.86 -0.40 1.49 0.00 -1.98 -1.08 119.26 119.01 3h3f h ALA 250 Ca 0.12 -0.30 -0.00 0.00 0.00 0.00 0.00 54.91 54.73 3h3f h ALA 250 Cb 0.38 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 3h3f h ALA 250 CO -0.31 0.68 0.25 0.97 0.00 0.00 0.00 179.25 180.83 3h3f h ILE 251 N 1.02 1.12 -0.86 0.00 6.09 -1.86 -0.51 117.51 122.50 3h3f h ILE 251 Ca 0.19 -0.26 0.07 0.00 -1.37 0.00 0.00 64.86 63.48 3h3f h ILE 251 Cb 0.51 0.57 -0.06 0.00 0.47 0.00 0.00 36.82 38.32 3h3f h ILE 251 CO 0.02 0.12 0.53 1.23 -3.07 0.00 0.00 178.15 176.98 3h3f h GLY 252 N 0.53 1.30 1.08 8.18 0.00 -0.79 0.24 103.07 113.60 3h3f h GLY 252 Ca 0.14 -0.38 -0.12 0.00 0.00 0.00 0.00 47.33 46.98 3h3f h GLY 252 CO -0.03 0.25 -0.17 1.41 0.00 0.00 0.00 176.54 178.00 3h3f h LEU 253 N 0.95 0.97 -0.40 3.11 3.38 -1.12 -0.99 115.31 121.22 3h3f h LEU 253 Ca 0.38 -0.38 -0.03 0.00 0.09 0.00 0.00 57.88 57.94 3h3f h LEU 253 Cb 0.20 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.66 3h3f h LEU 253 CO -0.18 1.14 0.15 -1.28 0.09 0.00 0.00 178.44 178.35 3h3f h SER 254 N 0.80 0.57 -0.36 -0.43 0.87 -0.63 -2.64 113.55 111.72 3h3f h SER 254 Ca 0.11 -0.18 -0.14 0.00 -1.23 0.00 0.00 61.79 60.35 3h3f h SER 254 Cb 0.74 -0.15 -0.01 0.00 -0.44 0.00 0.00 62.40 62.55 3h3f h SER 254 CO 0.06 0.59 -0.31 0.58 -0.53 0.00 0.00 176.83 177.22 3h3f h VAL 255 N 0.51 1.27 0.00 2.23 2.07 -0.52 -2.66 116.25 119.16 3h3f h VAL 255 Ca 0.13 -1.47 0.00 0.00 0.82 0.00 0.00 66.70 66.18 3h3f h VAL 255 Cb 0.21 1.30 0.00 0.00 -1.52 0.00 0.00 31.29 31.28 3h3f h VAL 255 CO -0.01 0.49 0.00 0.00 0.02 0.00 0.00 177.57 178.08 3h3f h ALA 256 N 0.89 1.00 0.09 1.67 0.00 -1.11 -1.19 119.26 120.61 3h3f h ALA 256 Ca 0.08 0.00 -0.26 0.00 0.00 0.00 0.00 54.91 54.73 3h3f h ALA 256 Cb 0.88 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.66 3h3f h ALA 256 CO 0.08 0.00 -1.19 0.22 0.00 0.00 0.00 179.25 178.36 3h3f h ASP 257 N 0.00 0.29 -0.08 0.00 -0.00 -1.11 -2.57 116.42 112.94 3h3f h ASP 257 Ca 0.00 -0.32 -0.02 0.00 -0.00 0.00 0.00 57.03 56.70 3h3f h ASP 257 Cb 0.21 -0.09 -0.00 0.00 -0.00 0.00 0.00 39.33 39.45 3h3f h ASP 257 CO 0.00 1.25 -0.02 -0.07 -0.00 0.00 0.00 179.24 180.40 3h3f h LEU 258 N 0.05 0.16 -0.70 2.28 3.38 -1.23 -2.48 115.31 116.77 3h3f h LEU 258 Ca -0.10 -0.38 0.15 0.00 0.09 0.00 0.00 57.88 57.64 3h3f h LEU 258 Cb 1.91 -0.04 -0.10 0.00 0.09 0.00 0.00 40.66 42.52 3h3f h LEU 258 CO 0.18 0.50 0.16 0.00 0.09 0.00 0.00 178.44 179.37 3h3f h ALA 259 N 0.66 0.88 -0.32 1.53 0.00 -1.32 -1.20 119.26 119.49 3h3f h ALA 259 Ca 0.02 0.16 -0.00 0.00 0.00 0.00 0.00 54.91 55.09 3h3f h ALA 259 Cb 0.43 0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.42 3h3f h ALA 259 CO 0.01 -0.33 0.19 1.49 0.00 0.00 0.00 179.25 180.62 3h3f h GLU 260 N 0.27 0.44 -0.15 0.00 4.81 -1.33 0.98 114.58 119.60 3h3f h GLU 260 Ca 0.39 -0.04 0.05 0.00 -0.13 0.00 0.00 59.36 59.63 3h3f h GLU 260 Cb 0.64 -0.09 -0.06 0.00 0.63 0.00 0.00 28.75 29.86 3h3f h GLU 260 CO -0.48 0.33 -0.30 0.77 -0.73 0.00 0.00 179.01 178.61 3h3f h SER 261 N 0.42 -0.92 0.94 1.04 0.02 -0.80 -0.19 113.55 114.05 3h3f h SER 261 Ca 0.12 0.14 -0.04 0.00 -0.84 0.00 0.00 61.79 61.16 3h3f h SER 261 Cb 0.01 0.40 0.01 0.00 0.14 0.00 0.00 62.40 62.95 3h3f h SER 261 CO -0.02 -0.34 -0.49 0.40 -1.14 0.00 0.00 176.83 175.24 3h3f h ILE 262 N -0.36 0.01 -0.74 3.27 2.04 -0.92 0.23 117.51 121.04 3h3f h ILE 262 Ca 0.10 0.00 0.06 0.00 1.00 0.00 0.00 64.86 66.02 3h3f h ILE 262 Cb 0.52 0.01 -0.06 0.00 -0.74 0.00 0.00 36.82 36.55 3h3f h ILE 262 CO -0.35 0.00 0.43 0.24 0.00 0.00 0.00 178.15 178.47 3h3f h MET 263 N -1.31 0.77 -0.03 2.37 2.86 0.11 -2.59 114.93 117.11 3h3f h MET 263 Ca -0.13 -0.05 0.00 0.00 -2.06 0.00 0.00 59.70 57.47 3h3f h MET 263 Cb 1.02 -0.17 0.00 0.00 0.06 0.00 0.00 31.60 32.51 3h3f h MET 263 CO 0.19 0.51 0.00 1.63 1.06 0.00 0.00 176.91 180.29 3h3f n LYS 264 N -4.73 1.79 -2.97 1.72 5.02 -0.09 -4.93 118.16 113.97 3h3f n LYS 264 Ca 0.10 -1.14 -0.19 0.00 -2.02 0.00 0.00 58.31 55.06 3h3f n LYS 264 Cb 0.18 -1.47 0.04 0.00 -0.02 0.00 0.00 35.03 33.75 3h3f n LYS 264 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 3h3f n ASN 265 N 0.39 -5.43 -0.26 4.39 5.15 0.62 -4.95 115.26 115.17 3h3f n ASN 265 Ca 0.18 -0.27 -0.00 0.00 -0.60 0.00 0.00 54.58 53.89 3h3f n ASN 265 Cb 0.40 -4.23 0.12 0.00 -0.53 0.00 0.00 39.78 35.53 3h3f n ASN 265 CO 0.00 0.00 0.00 -0.07 1.40 0.00 0.00 177.26 178.59 3h3f h LEU 266 N -1.33 0.66 -1.28 1.20 3.38 -1.29 -3.42 115.31 113.22 3h3f h LEU 266 Ca -0.45 0.03 -0.25 0.00 0.09 0.00 0.00 57.88 57.30 3h3f h LEU 266 Cb 1.31 -0.11 0.11 0.00 0.09 0.00 0.00 40.66 42.05 3h3f h LEU 266 CO 0.47 0.42 -0.49 0.54 0.09 0.00 0.00 178.44 179.47 3h3f n ARG 267 N -4.72 -5.07 -3.27 1.13 1.74 0.07 -5.00 116.66 101.53 3h3f n ARG 267 Ca 0.10 0.58 -0.29 0.00 -0.77 0.00 0.00 57.85 57.46 3h3f n ARG 267 Cb 0.18 -4.82 -0.04 0.00 -1.02 0.00 0.00 32.46 26.77 3h3f n ARG 267 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 3h3f s ARG 268 N -5.47 3.69 -0.14 5.56 0.52 -1.22 -4.74 118.95 117.14 3h3f s ARG 268 Ca 0.23 0.13 -0.21 0.00 -0.52 0.00 0.00 55.73 55.36 3h3f s ARG 268 Cb -0.10 -2.61 -0.03 0.00 0.52 0.00 0.00 34.95 32.73 3h3f s ARG 268 CO 0.50 0.19 0.61 0.08 0.02 0.00 0.00 175.30 176.70 3h3f s VAL 269 N -2.08 5.07 0.05 3.52 1.01 -1.26 -1.81 120.40 124.91 3h3f s VAL 269 Ca 0.46 1.19 0.05 0.00 0.00 0.00 0.00 61.98 63.68 3h3f s VAL 269 Cb -0.11 -3.94 -0.02 0.00 0.00 0.00 0.00 36.38 32.31 3h3f s VAL 269 CO 0.28 0.20 -0.14 -1.00 0.00 0.00 0.00 175.10 174.45 3h3f s HIS 270 N 1.28 1.22 -1.01 5.22 0.09 -0.93 -4.87 115.29 116.29 3h3f s HIS 270 Ca 0.30 -0.39 -0.21 0.00 -0.00 0.00 0.00 55.06 54.77 3h3f s HIS 270 Cb -0.16 -0.71 0.09 0.00 -0.00 0.00 0.00 32.58 31.79 3h3f s HIS 270 CO 0.12 0.04 1.35 -1.25 -0.00 0.00 0.00 174.74 175.01 3h3f s PRO 271 N -1.33 3.64 0.41 8.40 0.04 -1.26 -0.97 135.00 143.92 3h3f s PRO 271 Ca 0.00 -1.47 0.03 0.00 0.04 0.00 0.00 61.00 59.61 3h3f s PRO 271 Cb -0.09 -5.20 -0.01 0.00 0.04 0.00 0.00 34.50 29.24 3h3f s PRO 271 CO 0.02 -2.04 0.11 0.44 0.04 0.00 0.00 177.00 175.57 3h3f n ILE 272 N 6.26 0.00 -3.78 0.56 -5.35 -0.96 -2.13 119.36 113.97 3h3f n ILE 272 Ca 0.31 -2.27 -0.36 0.00 -0.27 0.00 0.00 62.75 60.16 3h3f n ILE 272 Cb 0.50 0.73 -0.13 0.00 -1.74 0.00 0.00 39.64 39.00 3h3f n ILE 272 CO 0.00 0.00 0.00 -0.55 -1.76 0.00 0.00 176.55 174.24 3h3f s SER 273 N -3.45 5.01 0.05 7.28 0.15 -0.49 -1.21 113.70 121.05 3h3f s SER 273 Ca 0.15 -0.27 -0.02 0.00 0.70 0.00 0.00 55.95 56.51 3h3f s SER 273 Cb 0.01 -1.89 -0.03 0.00 -1.71 0.00 0.00 66.02 62.39 3h3f s SER 273 CO 0.11 -0.04 0.01 0.28 1.20 0.00 0.00 173.24 174.79 3h3f s THR 274 N 1.59 0.19 -0.23 6.45 -1.32 -0.80 -1.47 115.64 120.05 3h3f s THR 274 Ca 0.06 -1.59 -0.29 0.00 -1.21 0.00 0.00 61.69 58.66 3h3f s THR 274 Cb -0.15 -1.33 -0.02 0.00 -1.51 0.00 0.00 72.50 69.50 3h3f s THR 274 CO 0.02 -0.88 1.45 -0.32 -2.21 0.00 0.00 174.62 172.69 3h3f s MET 275 N -3.57 3.93 -0.25 7.08 1.75 -1.26 -1.99 119.30 124.99 3h3f s MET 275 Ca 0.04 1.55 0.14 0.00 -1.25 0.00 0.00 55.69 56.16 3h3f s MET 275 Cb 0.05 -3.94 0.47 0.00 2.84 0.00 0.00 34.83 34.25 3h3f s MET 275 CO -0.09 -1.11 1.17 1.47 -0.65 0.00 0.00 175.02 175.81 3h3f n LEU 276 N 7.79 3.34 -4.69 4.11 -0.00 -0.42 -4.98 117.00 122.15 3h3f n LEU 276 Ca 0.16 -3.92 -0.44 0.00 -0.00 0.00 0.00 56.01 51.82 3h3f n LEU 276 Cb 0.45 -0.11 -0.03 0.00 -0.00 0.00 0.00 43.42 43.74 3h3f n LEU 276 CO 0.63 1.57 1.18 1.17 -0.00 0.00 0.00 177.39 181.94 3h3f n LYS 277 N -0.64 2.30 0.00 1.47 4.81 -1.26 -2.26 118.16 122.59 3h3f n LYS 277 Ca 0.27 0.83 0.00 0.00 -0.87 0.00 0.00 58.31 58.53 3h3f n LYS 277 Cb 0.90 -2.58 0.00 0.00 0.02 0.00 0.00 35.03 33.37 3h3f n LYS 277 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3h3f n GLY 278 N 3.00 2.82 3.45 3.14 0.00 -0.46 -5.03 105.19 112.10 3h3f n GLY 278 Ca 0.14 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.93 3h3f n GLY 278 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3h3f s LEU 279 N 0.00 2.60 -1.62 0.99 1.43 -0.96 -4.73 118.68 116.38 3h3f s LEU 279 Ca 0.00 -1.08 0.00 0.00 -1.03 0.00 0.00 54.13 52.02 3h3f s LEU 279 Cb 0.00 -0.92 0.00 0.00 0.03 0.00 0.00 46.19 45.30 3h3f s LEU 279 CO 0.00 -0.11 0.00 -1.22 0.23 0.00 0.00 176.35 175.25 3h3f n TYR 280 N -0.59 -0.68 -3.72 0.29 4.02 -1.26 -1.77 117.16 113.45 3h3f n TYR 280 Ca -0.06 0.00 -0.25 0.00 -0.01 0.00 0.00 57.90 57.58 3h3f n TYR 280 Cb 0.61 -3.19 0.05 0.00 -0.02 0.00 0.00 39.34 36.79 3h3f n TYR 280 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3h3f n GLY 281 N -0.60 -0.46 3.35 2.72 0.00 -1.26 -4.85 105.19 104.09 3h3f n GLY 281 Ca -0.18 0.19 -0.36 0.00 0.00 0.00 0.00 46.02 45.67 3h3f n GLY 281 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3h3f s ILE 282 N -3.38 3.69 -0.66 -0.61 -1.09 -0.73 -4.92 121.20 113.51 3h3f s ILE 282 Ca 0.43 -0.44 0.22 0.00 -2.23 0.00 0.00 60.65 58.63 3h3f s ILE 282 Cb -0.21 -2.73 -0.23 0.00 -1.58 0.00 0.00 42.46 37.71 3h3f s ILE 282 CO 0.78 0.35 0.82 0.29 -1.23 0.00 0.00 174.94 175.95 3h3f n LYS 283 N 4.84 0.24 -3.10 2.79 5.02 -1.26 -1.36 118.16 125.33 3h3f n LYS 283 Ca -0.17 -0.06 -0.25 0.00 -2.02 0.00 0.00 58.31 55.81 3h3f n LYS 283 Cb 0.51 -1.52 -0.01 0.00 -0.02 0.00 0.00 35.03 33.99 3h3f n LYS 283 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 3h3f s GLU 284 N -3.18 3.50 -1.01 1.97 0.41 -1.26 -4.84 118.70 114.29 3h3f s GLU 284 Ca 0.03 -0.14 -0.23 0.00 -0.41 0.00 0.00 54.97 54.22 3h3f s GLU 284 Cb 0.15 -2.55 0.01 0.00 -1.78 0.00 0.00 34.13 29.96 3h3f s GLU 284 CO 0.87 0.01 1.66 -0.51 -0.49 0.00 0.00 175.26 176.79 3h3f s ASP 285 N -4.06 6.01 0.01 -0.19 -0.00 -1.26 -3.99 116.67 113.19 3h3f s ASP 285 Ca 0.43 -1.29 0.02 0.00 -0.00 0.00 0.00 52.55 51.71 3h3f s ASP 285 Cb -0.10 -2.57 -0.01 0.00 -0.00 0.00 0.00 42.92 40.24 3h3f s ASP 285 CO 0.39 -1.96 -0.07 -0.69 -0.00 0.00 0.00 175.17 172.85 3h3f s VAL 286 N 6.87 0.51 -0.32 -1.27 1.01 -1.26 -4.96 120.40 120.98 3h3f s VAL 286 Ca 0.56 -0.52 -0.16 0.00 0.00 0.00 0.00 61.98 61.85 3h3f s VAL 286 Cb -0.02 -0.48 -0.02 0.00 0.00 0.00 0.00 36.38 35.86 3h3f s VAL 286 CO -0.05 -0.02 0.42 -0.36 0.00 0.00 0.00 175.10 175.10 3h3f s PHE 287 N -0.52 3.21 0.17 5.22 0.08 -1.26 -1.30 117.98 123.58 3h3f s PHE 287 Ca -0.01 0.22 0.08 0.00 0.12 0.00 0.00 56.93 57.34 3h3f s PHE 287 Cb -0.05 -2.72 -0.04 0.00 -0.57 0.00 0.00 43.02 39.64 3h3f s PHE 287 CO 0.00 -0.39 -0.18 -0.51 -0.10 0.00 0.00 175.22 174.04 3h3f s LEU 288 N 2.17 2.45 -0.16 -0.37 1.43 -0.84 -4.79 118.68 118.57 3h3f s LEU 288 Ca 0.16 -0.88 -0.29 0.00 -1.03 0.00 0.00 54.13 52.08 3h3f s LEU 288 Cb -0.16 -0.82 -0.00 0.00 0.03 0.00 0.00 46.19 45.24 3h3f s LEU 288 CO 0.11 -0.05 1.06 -0.44 0.23 0.00 0.00 176.35 177.27 3h3f s SER 289 N -2.74 7.14 0.14 2.29 0.01 -0.07 -1.91 113.70 118.55 3h3f s SER 289 Ca 0.17 1.50 -0.02 0.00 1.31 0.00 0.00 55.95 58.91 3h3f s SER 289 Cb -0.05 -2.55 -0.04 0.00 0.21 0.00 0.00 66.02 63.59 3h3f s SER 289 CO 0.07 -0.59 0.08 -0.69 0.41 0.00 0.00 173.24 172.52 3h3f s VAL 290 N 2.70 0.09 -0.29 3.43 1.01 -0.35 -1.10 120.40 125.90 3h3f s VAL 290 Ca 0.47 -1.88 -0.29 0.00 0.00 0.00 0.00 61.98 60.29 3h3f s VAL 290 Cb -0.18 -2.05 0.01 0.00 0.00 0.00 0.00 36.38 34.16 3h3f s VAL 290 CO 0.13 -0.43 1.12 -2.84 0.00 0.00 0.00 175.10 173.08 3h3f s PRO 291 N -4.05 4.09 -0.07 2.72 0.02 -1.26 -2.26 135.00 134.19 3h3f s PRO 291 Ca 0.24 1.20 0.03 0.00 0.02 0.00 0.00 61.00 62.50 3h3f s PRO 291 Cb 0.07 -3.75 -0.02 0.00 0.02 0.00 0.00 34.50 30.82 3h3f s PRO 291 CO 0.02 -0.87 -0.16 0.00 -0.33 0.00 0.00 177.00 175.66 3h3f s VAL 293 N -0.41 4.80 -0.02 0.00 1.01 -0.77 -2.20 120.40 122.80 3h3f s VAL 293 Ca 0.05 1.89 0.06 0.00 0.00 0.00 0.00 61.98 63.98 3h3f s VAL 293 Cb -0.12 -4.25 -0.01 0.00 0.00 0.00 0.00 36.38 31.99 3h3f s VAL 293 CO 0.02 -0.02 -0.21 -0.22 0.00 0.00 0.00 175.10 174.67 3h3f s LEU 294 N 2.30 2.03 0.00 3.92 2.96 -0.75 -2.49 118.68 126.65 3h3f s LEU 294 Ca 0.44 -0.38 0.00 0.00 -0.22 0.00 0.00 54.13 53.97 3h3f s LEU 294 Cb -0.17 -1.07 0.00 0.00 0.50 0.00 0.00 46.19 45.45 3h3f s LEU 294 CO 0.14 0.25 0.00 0.61 -1.32 0.00 0.00 176.35 176.02 3h3f n GLY 295 N 2.62 2.17 0.21 7.98 0.00 -0.89 -0.75 105.19 116.53 3h3f n GLY 295 Ca -0.15 -0.74 0.15 0.00 0.00 0.00 0.00 46.02 45.28 3h3f n GLY 295 CO 0.00 0.00 0.00 0.06 0.00 0.00 0.00 173.32 173.38 3h3f h GLN 296 N 0.00 0.00 -0.60 1.61 3.07 -1.75 -2.27 115.11 115.17 3h3f h GLN 296 Ca 0.00 0.00 -0.24 0.00 0.09 0.00 0.00 58.65 58.50 3h3f h GLN 296 Cb 0.00 0.00 -0.14 0.00 0.08 0.00 0.00 27.48 27.42 3h3f h GLN 296 CO 0.00 0.00 0.21 0.09 0.09 0.00 0.00 178.83 179.22 3h3f n ASN 297 N -2.68 3.67 0.00 0.06 4.13 -1.26 -5.02 115.26 114.15 3h3f n ASN 297 Ca 0.01 -3.46 0.00 0.00 1.68 0.00 0.00 54.58 52.81 3h3f n ASN 297 Cb 0.25 -0.70 0.00 0.00 -1.54 0.00 0.00 39.78 37.78 3h3f n ASN 297 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3h3f n GLY 298 N -0.76 0.49 3.57 7.41 0.00 -0.85 -4.47 105.19 110.58 3h3f n GLY 298 Ca 0.40 -1.11 -0.40 0.00 0.00 0.00 0.00 46.02 44.91 3h3f n GLY 298 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3h3f s ILE 299 N 0.00 5.15 -0.61 -0.61 1.01 0.14 -2.10 121.20 124.19 3h3f s ILE 299 Ca 0.00 0.30 0.15 0.00 0.00 0.00 0.00 60.65 61.10 3h3f s ILE 299 Cb 0.00 -3.78 -0.17 0.00 0.01 0.00 0.00 42.46 38.52 3h3f s ILE 299 CO 0.00 0.00 0.59 -1.54 0.00 0.00 0.00 174.94 173.99 3h3f n SER 300 N 5.40 0.81 -3.84 3.58 3.41 -1.04 -4.41 113.62 117.54 3h3f n SER 300 Ca -0.08 -0.73 -0.09 0.00 -0.26 0.00 0.00 58.87 57.70 3h3f n SER 300 Cb 0.50 1.10 -0.04 0.00 -0.26 0.00 0.00 64.21 65.51 3h3f n SER 300 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 3h3f s ASP 301 N -2.60 -0.19 -0.01 4.04 1.11 -1.26 -5.02 116.67 112.74 3h3f s ASP 301 Ca 0.04 -0.64 0.01 0.00 0.18 0.00 0.00 52.55 52.14 3h3f s ASP 301 Cb 0.11 0.59 0.01 0.00 1.07 0.00 0.00 42.92 44.70 3h3f s ASP 301 CO 0.61 -1.10 -0.03 -0.69 1.18 0.00 0.00 175.17 175.14 3h3f s VAL 302 N -3.92 0.33 -0.09 -1.27 1.01 -1.26 -1.86 120.40 113.34 3h3f s VAL 302 Ca 0.13 -0.12 -0.26 0.00 0.00 0.00 0.00 61.98 61.74 3h3f s VAL 302 Cb -0.01 -0.32 -0.03 0.00 0.00 0.00 0.00 36.38 36.02 3h3f s VAL 302 CO 0.02 0.12 0.83 -0.69 0.00 0.00 0.00 175.10 175.38 3h3f s VAL 303 N 0.25 4.93 -0.55 2.92 1.01 0.98 -4.98 120.40 124.98 3h3f s VAL 303 Ca -0.02 1.69 -0.20 0.00 0.00 0.00 0.00 61.98 63.44 3h3f s VAL 303 Cb -0.06 -4.15 0.07 0.00 0.00 0.00 0.00 36.38 32.24 3h3f s VAL 303 CO -0.00 0.14 0.70 -0.54 0.00 0.00 0.00 175.10 175.40 3h3f s LYS 304 N 1.37 3.12 0.30 2.72 1.02 -1.26 -4.40 119.74 122.61 3h3f s LYS 304 Ca 0.42 -0.94 -0.13 0.00 0.02 0.00 0.00 55.97 55.34 3h3f s LYS 304 Cb -0.18 -4.15 -0.08 0.00 -0.52 0.00 0.00 37.83 32.90 3h3f s LYS 304 CO 0.18 -1.38 0.68 0.08 -0.92 0.00 0.00 175.35 173.99 3h3f s VAL 305 N 2.88 4.78 -0.48 3.17 1.01 -1.26 -5.02 120.40 125.48 3h3f s VAL 305 Ca 0.16 0.74 -0.22 0.00 0.00 0.00 0.00 61.98 62.66 3h3f s VAL 305 Cb -0.20 -3.63 0.04 0.00 0.00 0.00 0.00 36.38 32.59 3h3f s VAL 305 CO 0.11 -0.19 0.76 -0.89 0.00 0.00 0.00 175.10 174.89 3h3f s THR 306 N -1.97 4.67 0.24 3.92 2.01 -1.26 -5.03 115.64 118.22 3h3f s THR 306 Ca 0.51 0.13 -0.14 0.00 0.31 0.00 0.00 61.69 62.51 3h3f s THR 306 Cb -0.11 -4.35 -0.08 0.00 0.01 0.00 0.00 72.50 67.98 3h3f s THR 306 CO 0.20 -0.81 0.64 -0.76 -0.69 0.00 0.00 174.62 173.20 3h3f s LEU 307 N 3.21 4.19 0.78 4.42 1.43 -1.26 -5.04 118.68 126.41 3h3f s LEU 307 Ca 0.25 1.14 -0.12 0.00 -1.03 0.00 0.00 54.13 54.38 3h3f s LEU 307 Cb -0.14 -3.73 0.06 0.00 0.03 0.00 0.00 46.19 42.42 3h3f s LEU 307 CO 0.19 -0.07 1.12 0.42 0.23 0.00 0.00 176.35 178.24 3h3f s THR 308 N -1.77 2.87 -0.32 5.49 -4.23 -1.26 -4.82 115.64 111.60 3h3f s THR 308 Ca 0.47 0.32 0.27 0.00 -1.18 0.00 0.00 61.69 61.58 3h3f s THR 308 Cb -0.12 -2.72 0.33 0.00 1.34 0.00 0.00 72.50 71.32 3h3f s THR 308 CO 0.19 -0.33 1.79 0.77 -0.54 0.00 0.00 174.62 176.51 3h3f h SER 309 N -0.96 0.00 0.13 3.99 4.64 -1.99 -0.56 113.55 118.81 3h3f h SER 309 Ca -0.45 0.00 -0.23 0.00 -0.47 0.00 0.00 61.79 60.64 3h3f h SER 309 Cb 1.25 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 63.35 3h3f h SER 309 CO 0.49 0.00 -0.90 -0.33 -0.87 0.00 0.00 176.83 175.22 3h3f h GLU 310 N 0.00 0.57 -0.14 4.77 3.07 -2.00 -2.36 114.58 118.49 3h3f h GLU 310 Ca 0.00 -0.55 0.05 0.00 -0.50 0.00 0.00 59.36 58.36 3h3f h GLU 310 Cb 0.64 0.14 -0.06 0.00 -0.84 0.00 0.00 28.75 28.63 3h3f h GLU 310 CO 0.00 1.17 -0.29 0.93 -1.40 0.00 0.00 179.01 179.42 3h3f h GLU 311 N 0.35 -0.35 -0.77 2.33 5.08 -1.75 -2.32 114.58 117.14 3h3f h GLU 311 Ca -0.08 0.02 0.18 0.00 -1.00 0.00 0.00 59.36 58.49 3h3f h GLU 311 Cb 1.53 0.08 -0.12 0.00 0.50 0.00 0.00 28.75 30.73 3h3f h GLU 311 CO 0.17 -0.23 0.14 0.93 -1.00 0.00 0.00 179.01 179.01 3h3f h GLU 312 N -0.37 0.20 -0.41 2.33 5.08 -1.04 -2.62 114.58 117.76 3h3f h GLU 312 Ca 0.10 -0.01 -0.07 0.00 -1.00 0.00 0.00 59.36 58.38 3h3f h GLU 312 Cb 0.52 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.71 3h3f h GLU 312 CO -0.34 0.13 -0.03 0.00 -1.00 0.00 0.00 179.01 177.77 3h3f h ALA 313 N 1.68 0.56 -0.86 3.43 0.00 -1.21 0.29 119.26 123.15 3h3f h ALA 313 Ca 0.45 -0.28 0.16 0.00 0.00 0.00 0.00 54.91 55.24 3h3f h ALA 313 Cb 0.81 -0.15 -0.10 0.00 0.00 0.00 0.00 17.79 18.35 3h3f h ALA 313 CO -0.59 0.36 0.42 0.45 0.00 0.00 0.00 179.25 179.89 3h3f h HIS 314 N 0.57 0.72 -0.27 0.00 3.86 -1.05 0.47 115.15 119.46 3h3f h HIS 314 Ca 0.11 0.04 -0.18 0.00 -1.16 0.00 0.00 60.37 59.17 3h3f h HIS 314 Cb 0.52 -0.19 0.00 0.00 1.06 0.00 0.00 27.41 28.80 3h3f h HIS 314 CO 0.04 0.12 -0.55 1.25 0.86 0.00 0.00 177.93 179.65 3h3f h LEU 315 N 0.56 0.95 -0.27 2.43 5.85 -1.12 0.26 115.31 123.97 3h3f h LEU 315 Ca 0.48 -0.54 -0.09 0.00 0.84 0.00 0.00 57.88 58.57 3h3f h LEU 315 Cb 0.75 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 41.50 3h3f h LEU 315 CO -0.41 1.32 -0.19 0.50 -0.34 0.00 0.00 178.44 179.32 3h3f h LYS 316 N 0.62 0.60 0.00 1.25 3.11 0.00 -2.05 116.57 120.10 3h3f h LYS 316 Ca 0.01 -0.29 -0.10 0.00 -2.81 0.00 0.00 60.65 57.46 3h3f h LYS 316 Cb 1.17 -0.00 -0.01 0.00 -1.00 0.00 0.00 32.23 32.38 3h3f h LYS 316 CO 0.12 0.88 -0.46 1.57 -2.81 0.00 0.00 179.45 178.75 3h3f h LYS 317 N 0.33 0.00 -0.38 1.90 5.09 -0.00 0.35 116.57 123.86 3h3f h LYS 317 Ca 0.05 0.00 -0.00 0.00 0.09 0.00 0.00 60.65 60.79 3h3f h LYS 317 Cb 0.73 0.00 -0.02 0.00 0.10 0.00 0.00 32.23 33.04 3h3f h LYS 317 CO 0.05 0.46 0.23 0.77 -2.09 0.00 0.00 179.45 178.88 3h3f h SER 318 N 0.00 0.45 -0.12 7.07 0.02 -0.84 -2.66 113.55 117.48 3h3f h SER 318 Ca -0.00 -0.04 -0.14 0.00 -0.84 0.00 0.00 61.79 60.76 3h3f h SER 318 Cb 0.84 -0.11 -0.01 0.00 0.14 0.00 0.00 62.40 63.26 3h3f h SER 318 CO 0.06 0.36 -0.40 0.00 -1.14 0.00 0.00 176.83 175.71 3h3f h ALA 319 N 1.11 0.79 -0.97 3.77 0.00 -0.56 -2.05 119.26 121.35 3h3f h ALA 319 Ca 0.14 -0.44 0.13 0.00 0.00 0.00 0.00 54.91 54.74 3h3f h ALA 319 Cb -0.01 -0.11 -0.09 0.00 0.00 0.00 0.00 17.79 17.58 3h3f h ALA 319 CO -0.03 0.65 0.60 -0.44 0.00 0.00 0.00 179.25 180.03 3h3f h ASP 320 N 0.53 0.84 0.29 0.00 5.19 -0.87 -0.09 116.42 122.31 3h3f h ASP 320 Ca 0.04 0.06 -0.33 0.00 -0.62 0.00 0.00 57.03 56.18 3h3f h ASP 320 Cb 0.92 -0.10 -0.01 0.00 0.18 0.00 0.00 39.33 40.32 3h3f h ASP 320 CO 0.08 0.41 -1.74 0.71 -3.12 0.00 0.00 179.24 175.58 3h3f h THR 321 N 0.90 0.91 -0.28 0.35 1.35 -1.05 -2.48 112.91 112.61 3h3f h THR 321 Ca 0.50 -2.58 0.06 0.00 -0.55 0.00 0.00 66.41 63.84 3h3f h THR 321 Cb 0.58 2.66 -0.06 0.00 -1.73 0.00 0.00 68.15 69.60 3h3f h THR 321 CO -0.30 0.82 -0.08 -0.07 -0.25 0.00 0.00 175.52 175.64 3h3f h LEU 322 N 0.07 -0.30 -1.07 3.87 4.07 -1.29 -1.90 115.31 118.76 3h3f h LEU 322 Ca -0.33 0.09 -0.08 0.00 0.08 0.00 0.00 57.88 57.64 3h3f h LEU 322 Cb 2.05 0.19 -0.01 0.00 1.08 0.00 0.00 40.66 43.96 3h3f h LEU 322 CO 0.14 -0.11 -0.26 -0.25 -1.08 0.00 0.00 178.44 176.88 3h3f h TRP 323 N -0.02 0.38 0.00 1.13 2.91 -1.08 0.23 115.95 119.50 3h3f h TRP 323 Ca 0.14 -0.08 -0.01 0.00 1.13 0.00 0.00 58.89 60.07 3h3f h TRP 323 Cb 0.23 -0.10 -0.00 0.00 -0.51 0.00 0.00 29.16 28.78 3h3f h TRP 323 CO -0.28 0.58 -0.05 0.78 -1.03 0.00 0.00 178.44 178.43 3h3f h GLY 324 N 1.01 0.00 0.09 2.65 0.00 -0.91 0.64 103.07 106.55 3h3f h GLY 324 Ca 0.05 0.00 -0.22 0.00 0.00 0.00 0.00 47.33 47.16 3h3f h GLY 324 CO 0.04 0.00 -1.20 -2.22 0.00 0.00 0.00 176.54 173.16 3h3f h ILE 325 N 0.00 0.99 -0.70 2.60 2.04 -0.50 -3.35 117.51 118.59 3h3f h ILE 325 Ca -0.00 -2.23 0.02 0.00 1.00 0.00 0.00 64.86 63.65 3h3f h ILE 325 Cb 0.12 2.40 -0.04 0.00 -0.74 0.00 0.00 36.82 38.56 3h3f h ILE 325 CO 0.01 0.42 0.47 1.56 0.00 0.00 0.00 178.15 180.60 3h3f h GLN 326 N -0.86 0.89 0.00 2.37 4.20 -0.39 -0.76 115.11 120.56 3h3f h GLN 326 Ca -0.32 -0.05 0.00 0.00 0.06 0.00 0.00 58.65 58.34 3h3f h GLN 326 Cb 1.37 -0.20 0.00 0.00 0.30 0.00 0.00 27.48 28.95 3h3f h GLN 326 CO -0.15 0.59 0.00 0.36 -0.67 0.00 0.00 178.83 178.97 3h3f n LYS 327 N -4.44 0.17 -0.18 1.46 2.85 0.20 -2.08 118.16 116.14 3h3f n LYS 327 Ca 0.08 0.53 0.11 0.00 -1.05 0.00 0.00 58.31 57.97 3h3f n LYS 327 Cb 0.06 -1.92 0.20 0.00 -0.65 0.00 0.00 35.03 32.72 3h3f n LYS 327 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 3h3f n GLU 328 N -2.25 2.37 -3.23 -1.58 -0.58 -0.29 -4.98 120.64 110.09 3h3f n GLU 328 Ca 0.00 -2.18 -0.36 0.00 -0.42 0.00 0.00 57.16 54.21 3h3f n GLU 328 Cb 0.13 -1.46 -0.06 0.00 -0.57 0.00 0.00 31.44 29.48 3h3f n GLU 328 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 3h3f s LEU 329 N -1.36 4.35 -0.16 -4.62 1.02 -0.88 -5.08 118.68 111.95 3h3f s LEU 329 Ca 0.35 1.25 -0.05 0.00 0.02 0.00 0.00 54.13 55.69 3h3f s LEU 329 Cb 0.20 -3.41 -0.04 0.00 0.02 0.00 0.00 46.19 42.97 3h3f s LEU 329 CO 0.28 0.08 0.02 0.00 0.02 0.00 0.00 176.35 176.75 3h3f s GLN 330 N -1.93 3.76 0.00 1.70 -2.07 -1.26 -5.08 119.66 114.77 3h3f s GLN 330 Ca 0.40 -0.41 0.05 0.00 -1.82 0.00 0.00 55.36 53.58 3h3f s GLN 330 Cb -0.16 -3.06 0.04 0.00 -1.09 0.00 0.00 33.01 28.74 3h3f s GLN 330 CO 0.20 0.32 0.67 1.19 -1.32 0.00 0.00 175.29 176.34