#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h3f s ALA 2 N 0.00 2.09 0.13 0.00 0.00 -1.26 -4.90 121.76 117.82 3h3f s ALA 2 Ca 0.00 0.04 -0.18 0.00 0.00 0.00 0.00 51.96 51.82 3h3f s ALA 2 Cb 0.00 -3.20 -0.03 0.00 0.00 0.00 0.00 23.12 19.89 3h3f s ALA 2 CO 0.00 -1.87 1.75 1.25 0.00 0.00 0.00 175.76 176.89 3h3f h LEU 3 N -1.20 0.38 -0.60 0.00 5.85 -2.03 -2.52 115.31 115.19 3h3f h LEU 3 Ca -0.46 -0.06 0.10 0.00 0.84 0.00 0.00 57.88 58.29 3h3f h LEU 3 Cb 1.25 -0.10 -0.07 0.00 0.37 0.00 0.00 40.66 42.11 3h3f h LEU 3 CO 0.55 0.33 0.20 0.50 -0.34 0.00 0.00 178.44 179.68 3h3f h LYS 4 N 0.40 0.36 0.00 1.25 3.64 -1.95 -0.44 116.57 119.83 3h3f h LYS 4 Ca 0.11 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.47 3h3f h LYS 4 Cb 0.02 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 31.76 3h3f h LYS 4 CO -0.02 0.24 0.00 -0.25 -2.27 0.00 0.00 179.45 177.15 3h3f n ASP 5 N -5.02 0.56 0.12 4.20 10.43 -1.01 -0.61 116.55 125.22 3h3f n ASP 5 Ca 0.08 0.58 0.12 0.00 2.57 0.00 0.00 54.79 58.14 3h3f n ASP 5 Cb 0.28 -0.72 0.04 0.00 1.84 0.00 0.00 41.12 42.56 3h3f n ASP 5 CO 0.00 0.00 0.00 1.56 -1.07 0.00 0.00 177.20 177.69 3h3f h GLN 6 N 0.00 0.00 0.04 -1.24 4.20 -0.70 -3.40 115.11 114.02 3h3f h GLN 6 Ca 0.00 0.00 -0.37 0.00 0.06 0.00 0.00 58.65 58.34 3h3f h GLN 6 Cb 0.57 0.00 -0.05 0.00 0.30 0.00 0.00 27.48 28.30 3h3f h GLN 6 CO 0.00 0.00 -2.12 -0.11 -0.67 0.00 0.00 178.83 175.93 3h3f n LEU 7 N -2.71 2.51 -4.24 1.46 0.00 -0.69 -4.91 117.00 108.42 3h3f n LEU 7 Ca 0.01 0.16 -0.32 0.00 0.00 0.00 0.00 56.01 55.85 3h3f n LEU 7 Cb 0.54 -0.98 -0.16 0.00 0.00 0.00 0.00 43.42 42.82 3h3f n LEU 7 CO 0.39 0.74 -0.53 -0.63 0.00 0.00 0.00 177.39 177.36 3h3f s ILE 8 N -2.51 2.30 -0.32 1.96 1.01 0.22 -5.08 121.20 118.77 3h3f s ILE 8 Ca -0.30 -0.92 -0.12 0.00 0.00 0.00 0.00 60.65 59.31 3h3f s ILE 8 Cb 0.09 -1.92 -0.03 0.00 0.01 0.00 0.00 42.46 40.61 3h3f s ILE 8 CO 0.64 0.55 0.23 -2.28 0.00 0.00 0.00 174.94 174.07 3h3f s HIS 9 N 0.51 3.23 0.41 3.97 5.65 -1.26 -4.52 115.29 123.26 3h3f s HIS 9 Ca -0.13 -0.14 -0.24 0.00 0.25 0.00 0.00 55.06 54.80 3h3f s HIS 9 Cb -0.17 -2.45 -0.09 0.00 -1.18 0.00 0.00 32.58 28.69 3h3f s HIS 9 CO 0.05 -0.31 1.06 1.21 -0.65 0.00 0.00 174.74 176.10 3h3f s ASN 10 N 1.73 6.70 0.00 9.88 2.47 -1.26 -4.95 114.94 129.51 3h3f s ASN 10 Ca 0.06 2.06 0.00 0.00 0.42 0.00 0.00 52.86 55.40 3h3f s ASN 10 Cb -0.17 -2.59 0.00 0.00 -1.45 0.00 0.00 41.25 37.04 3h3f s ASN 10 CO 0.11 -0.53 0.00 0.18 -3.72 0.00 0.00 177.10 173.13 3h3f n LEU 11 N -0.13 0.00 -3.72 3.21 4.77 -1.26 -5.04 117.00 114.83 3h3f n LEU 11 Ca 0.05 0.00 -0.24 0.00 -0.03 0.00 0.00 56.01 55.80 3h3f n LEU 11 Cb 0.50 0.00 -0.17 0.00 -2.33 0.00 0.00 43.42 41.41 3h3f n LEU 11 CO 0.45 0.00 -0.36 -0.22 -1.33 0.00 0.00 177.39 175.93 3h3f s LEU 12 N -1.77 0.57 -0.30 2.23 2.96 -1.26 -5.08 118.68 116.03 3h3f s LEU 12 Ca 0.00 -0.25 -0.32 0.00 -0.22 0.00 0.00 54.13 53.34 3h3f s LEU 12 Cb 0.00 -0.38 -0.09 0.00 0.50 0.00 0.00 46.19 46.22 3h3f s LEU 12 CO 0.00 -0.24 2.21 2.29 -1.32 0.00 0.00 176.35 179.29 3h3f n LYS 13 N 5.18 1.44 -1.56 1.98 -0.00 -1.26 -4.91 118.16 119.02 3h3f n LYS 13 Ca -0.07 0.39 -0.35 0.00 -0.00 0.00 0.00 58.31 58.28 3h3f n LYS 13 Cb 0.49 -2.79 0.08 0.00 -0.00 0.00 0.00 35.03 32.81 3h3f n LYS 13 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.40 176.19 3h3f s GLU 14 N 6.32 2.33 -0.43 -1.58 8.01 -1.26 -4.99 118.70 127.09 3h3f s GLU 14 Ca 1.06 1.80 0.01 0.00 0.01 0.00 0.00 54.97 57.85 3h3f s GLU 14 Cb -0.63 -1.85 0.21 0.00 -4.31 0.00 0.00 34.13 27.55 3h3f s GLU 14 CO 0.43 -1.70 0.93 -0.85 0.01 0.00 0.00 175.26 174.08 3h3f n GLU 15 N -2.45 0.36 -2.95 1.61 0.00 -1.26 -5.15 120.64 110.80 3h3f n GLU 15 Ca 0.14 -1.41 -0.42 0.00 0.00 0.00 0.00 57.16 55.47 3h3f n GLU 15 Cb 0.50 -0.76 -0.05 0.00 0.00 0.00 0.00 31.44 31.13 3h3f n GLU 15 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.13 175.55 3h3f s HIS 16 N 0.82 3.23 -0.11 -1.84 2.46 -1.26 -5.03 115.29 113.56 3h3f s HIS 16 Ca 0.27 0.86 0.01 0.00 0.47 0.00 0.00 55.06 56.68 3h3f s HIS 16 Cb 0.09 -3.16 0.02 0.00 -0.13 0.00 0.00 32.58 29.40 3h3f s HIS 16 CO -0.10 -0.52 -0.14 0.54 -2.47 0.00 0.00 174.74 172.05 3h3f s VAL 17 N 2.90 1.45 0.22 0.89 0.11 -1.26 -5.12 120.40 119.58 3h3f s VAL 17 Ca 0.32 -0.60 -0.30 0.00 -2.93 0.00 0.00 61.98 58.47 3h3f s VAL 17 Cb -0.14 -1.34 -0.08 0.00 -1.53 0.00 0.00 36.38 33.28 3h3f s VAL 17 CO 0.11 0.43 0.95 -2.16 -3.33 0.00 0.00 175.10 171.10 3h3f s PRO 18 N 1.11 4.83 -0.23 1.54 0.04 -1.26 -5.01 135.00 136.02 3h3f s PRO 18 Ca -0.04 1.49 0.09 0.00 0.04 0.00 0.00 61.00 62.58 3h3f s PRO 18 Cb -0.14 -3.30 -0.20 0.00 0.04 0.00 0.00 34.50 30.90 3h3f s PRO 18 CO -0.03 0.46 -0.09 1.04 0.04 0.00 0.00 177.00 178.42 3h3f n GLN 19 N 1.72 0.69 -2.80 4.56 1.13 -1.26 -4.75 117.38 116.66 3h3f n GLN 19 Ca -0.01 0.07 -0.12 0.00 -1.94 0.00 0.00 57.00 55.01 3h3f n GLN 19 Cb 0.47 -1.51 0.01 0.00 0.11 0.00 0.00 30.24 29.33 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 -3.01 1.30 -4.76 1.08 3.02 -1.26 -4.95 115.26 106.68 3h3f n ASN 20 Ca -0.39 -2.80 -0.40 0.00 -0.03 0.00 0.00 54.58 50.96 3h3f n ASN 20 Cb 1.06 -0.55 -0.06 0.00 -0.61 0.00 0.00 39.78 39.62 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 -2.94 4.58 0.06 3.52 2.20 -1.26 -2.49 119.74 123.40 3h3f s LYS 21 Ca 0.31 1.17 0.09 0.00 -0.36 0.00 0.00 55.97 57.18 3h3f s LYS 21 Cb 0.43 -3.30 -0.03 0.00 -1.51 0.00 0.00 37.83 33.42 3h3f s LYS 21 CO 0.01 0.47 -0.25 0.42 -0.36 0.00 0.00 175.35 175.63 3h3f s ILE 22 N -0.77 2.26 -0.03 5.43 1.01 0.72 -1.48 121.20 128.34 3h3f s ILE 22 Ca 0.38 -1.41 0.06 0.00 0.00 0.00 0.00 60.65 59.67 3h3f s ILE 22 Cb -0.23 -1.91 -0.01 0.00 0.01 0.00 0.00 42.46 40.32 3h3f s ILE 22 CO 0.26 0.32 -0.21 -0.89 0.00 0.00 0.00 174.94 174.42 3h3f s THR 23 N -0.86 1.68 -0.20 2.92 2.01 -0.67 -0.96 115.64 119.57 3h3f s THR 23 Ca 0.12 -0.89 -0.02 0.00 0.31 0.00 0.00 61.69 61.21 3h3f s THR 23 Cb -0.10 -1.41 -0.00 0.00 0.01 0.00 0.00 72.50 71.00 3h3f s THR 23 CO 0.03 0.47 -0.10 -0.69 -0.69 0.00 0.00 174.62 173.65 3h3f s VAL 24 N -0.35 2.96 -0.36 3.82 1.01 0.10 -0.97 120.40 126.62 3h3f s VAL 24 Ca 0.04 -0.64 -0.10 0.00 0.00 0.00 0.00 61.98 61.28 3h3f s VAL 24 Cb -0.10 -2.31 0.03 0.00 0.00 0.00 0.00 36.38 34.00 3h3f s VAL 24 CO 0.00 0.47 0.18 -0.69 0.00 0.00 0.00 175.10 175.06 3h3f s VAL 25 N 1.28 4.41 0.00 2.92 1.01 0.17 -1.91 120.40 128.28 3h3f s VAL 25 Ca 0.03 -0.86 0.00 0.00 0.00 0.00 0.00 61.98 61.15 3h3f s VAL 25 Cb -0.14 -3.44 0.00 0.00 0.00 0.00 0.00 36.38 32.79 3h3f s VAL 25 CO -0.05 -0.19 0.00 0.61 0.00 0.00 0.00 175.10 175.47 3h3f n GLY 26 N 4.96 1.20 2.46 4.51 0.00 0.13 -1.07 105.19 117.38 3h3f n GLY 26 Ca -0.12 -0.82 -0.36 0.00 0.00 0.00 0.00 46.02 44.72 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 0.89 3.58 -0.46 1.61 0.24 -1.26 -3.60 118.33 119.33 3h3f n VAL 27 Ca 0.00 -3.32 0.00 0.00 -2.04 0.00 0.00 64.34 58.98 3h3f n VAL 27 Cb 0.00 -1.18 0.00 0.00 -1.47 0.00 0.00 33.84 31.19 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 -0.82 0.84 0.35 7.63 0.00 -1.26 -4.57 105.19 107.35 3h3f n GLY 28 Ca 0.60 -1.68 -0.05 0.00 0.00 0.00 0.00 46.02 44.89 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 -1.66 1.12 0.02 4.61 0.00 -1.94 -2.00 119.26 119.40 3h3f h ALA 29 Ca 0.00 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 54.74 3h3f h ALA 29 Cb 0.00 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 17.47 3h3f h ALA 29 CO 0.00 0.65 -0.01 0.28 0.00 0.00 0.00 179.25 180.18 3h3f h VAL 30 N 1.17 1.46 -0.89 0.00 2.07 -1.89 -3.01 116.25 115.15 3h3f h VAL 30 Ca 0.28 -1.88 0.22 0.00 0.82 0.00 0.00 66.70 66.13 3h3f h VAL 30 Cb 0.14 2.65 -0.12 0.00 -1.52 0.00 0.00 31.29 32.44 3h3f h VAL 30 CO -0.03 0.46 0.39 1.23 0.02 0.00 0.00 177.57 179.63 3h3f h GLY 31 N -0.90 1.52 2.00 2.17 0.00 -1.61 -1.09 103.07 105.16 3h3f h GLY 31 Ca -0.00 -0.16 -0.10 0.00 0.00 0.00 0.00 47.33 47.06 3h3f h GLY 31 CO 0.00 -0.27 -0.49 -0.33 0.00 0.00 0.00 176.54 175.46 3h3f h MET 32 N 0.39 0.00 0.19 4.80 0.00 -1.41 -1.74 114.93 117.15 3h3f h MET 32 Ca 0.56 0.00 -0.31 0.00 0.00 0.00 0.00 59.70 59.94 3h3f h MET 32 Cb 1.06 0.00 0.03 0.00 0.00 0.00 0.00 31.60 32.69 3h3f h MET 32 CO -0.53 0.49 -1.36 0.00 0.00 0.00 0.00 176.91 175.51 3h3f h ALA 33 N 1.51 -0.06 -0.75 6.32 0.00 -1.24 -1.88 119.26 123.17 3h3f h ALA 33 Ca -0.00 -0.83 0.11 0.00 0.00 0.00 0.00 54.91 54.18 3h3f h ALA 33 Cb 1.27 0.13 -0.08 0.00 0.00 0.00 0.00 17.79 19.10 3h3f h ALA 33 CO 0.06 0.74 0.37 0.00 0.00 0.00 0.00 179.25 180.43 3h3f h ALA 35 N 1.47 0.36 -0.45 0.00 0.00 -0.95 -0.95 119.26 118.75 3h3f h ALA 35 Ca 0.38 -0.23 -0.12 0.00 0.00 0.00 0.00 54.91 54.94 3h3f h ALA 35 Cb 0.44 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 3h3f h ALA 35 CO -0.30 0.11 -0.21 0.97 0.00 0.00 0.00 179.25 179.82 3h3f h ILE 36 N 0.26 1.27 -0.24 0.00 6.09 -1.38 -0.48 117.51 123.03 3h3f h ILE 36 Ca 0.08 -1.35 -0.03 0.00 -1.37 0.00 0.00 64.86 62.18 3h3f h ILE 36 Cb 0.43 1.15 -0.01 0.00 0.47 0.00 0.00 36.82 38.86 3h3f h ILE 36 CO 0.01 0.46 0.02 0.28 -3.07 0.00 0.00 178.15 175.86 3h3f h SER 37 N 0.78 0.40 -0.84 2.19 0.02 -1.17 -1.23 113.55 113.71 3h3f h SER 37 Ca 0.11 -0.28 0.01 0.00 -0.84 0.00 0.00 61.79 60.79 3h3f h SER 37 Cb 0.76 -0.11 -0.04 0.00 0.14 0.00 0.00 62.40 63.15 3h3f h SER 37 CO 0.06 0.58 0.55 0.40 -1.14 0.00 0.00 176.83 177.29 3h3f h ILE 38 N 0.21 1.20 0.00 3.27 2.04 -1.15 -0.93 117.51 122.14 3h3f h ILE 38 Ca 0.07 -0.38 -0.05 0.00 1.00 0.00 0.00 64.86 65.50 3h3f h ILE 38 Cb 0.36 -0.01 -0.01 0.00 -0.74 0.00 0.00 36.82 36.42 3h3f h ILE 38 CO 0.01 0.20 -0.25 -0.07 0.00 0.00 0.00 178.15 178.05 3h3f h LEU 39 N 1.12 0.00 0.00 1.44 3.38 -0.76 -2.96 115.31 117.52 3h3f h LEU 39 Ca 0.31 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.28 3h3f h LEU 39 Cb -0.10 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.65 3h3f h LEU 39 CO -0.07 0.25 -1.15 0.23 0.09 0.00 0.00 178.44 177.78 3h3f n MET 40 N -3.39 0.26 -0.49 1.13 2.81 -0.49 -3.12 117.12 113.84 3h3f n MET 40 Ca 0.00 -0.03 0.08 0.00 -1.81 0.00 0.00 57.70 55.94 3h3f n MET 40 Cb 0.45 -1.55 0.30 0.00 -0.71 0.00 0.00 33.22 31.71 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 -1.88 3.18 -3.85 0.03 5.02 -0.41 -4.96 118.16 115.29 3h3f n LYS 41 Ca 0.02 -2.37 -0.24 0.00 -2.02 0.00 0.00 58.31 53.70 3h3f n LYS 41 Cb 0.43 -1.75 -0.00 0.00 -0.02 0.00 0.00 35.03 33.68 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 0.96 -0.77 -0.01 4.39 9.92 -1.15 -4.90 116.55 125.00 3h3f n ASP 42 Ca 0.21 -0.94 0.10 0.00 -0.53 0.00 0.00 54.79 53.64 3h3f n ASP 42 Cb 0.73 -3.42 -0.15 0.00 -0.64 0.00 0.00 41.12 37.65 3h3f n ASP 42 CO 0.00 0.00 0.00 0.18 0.13 0.00 0.00 177.20 177.51 3h3f n LEU 43 N -4.35 0.38 -4.56 0.64 4.77 -1.16 -4.94 117.00 107.79 3h3f n LEU 43 Ca -0.30 -0.19 -0.30 0.00 -0.03 0.00 0.00 56.01 55.18 3h3f n LEU 43 Cb 0.68 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.67 3h3f n LEU 43 CO 0.72 0.10 -0.42 0.00 -1.33 0.00 0.00 177.39 176.46 3h3f s ALA 44 N -3.29 2.91 -1.60 -1.18 0.00 -1.26 -4.95 121.76 112.39 3h3f s ALA 44 Ca -0.02 -1.19 0.26 0.00 0.00 0.00 0.00 51.96 51.01 3h3f s ALA 44 Cb 0.15 -0.92 0.63 0.00 0.00 0.00 0.00 23.12 22.98 3h3f s ALA 44 CO 0.88 0.63 1.49 -0.40 0.00 0.00 0.00 175.76 178.35 3h3f n ASP 45 N 0.99 0.99 -3.68 0.00 5.68 -1.04 -4.62 116.55 114.86 3h3f n ASP 45 Ca -0.14 -0.81 -0.11 0.00 -0.50 0.00 0.00 54.79 53.24 3h3f n ASP 45 Cb 0.52 0.20 -0.09 0.00 -1.14 0.00 0.00 41.12 40.61 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 -2.61 0.52 -0.13 0.11 2.12 -1.25 -3.68 118.70 113.78 3h3f s GLU 46 Ca 0.21 0.87 0.03 0.00 0.36 0.00 0.00 54.97 56.43 3h3f s GLU 46 Cb 0.19 0.11 0.01 0.00 0.26 0.00 0.00 34.13 34.69 3h3f s GLU 46 CO 0.57 -0.13 -0.21 -1.17 -0.54 0.00 0.00 175.26 173.77 3h3f s LEU 47 N 1.12 2.05 -0.11 2.70 2.96 -0.73 -0.20 118.68 126.47 3h3f s LEU 47 Ca -0.07 -0.57 -0.01 0.00 -0.22 0.00 0.00 54.13 53.26 3h3f s LEU 47 Cb -0.06 -1.38 -0.03 0.00 0.50 0.00 0.00 46.19 45.22 3h3f s LEU 47 CO -0.10 0.09 -0.06 0.00 -1.32 0.00 0.00 176.35 174.96 3h3f s ALA 48 N 0.74 2.98 -0.12 5.97 0.00 -0.13 -0.77 121.76 130.43 3h3f s ALA 48 Ca -0.10 -0.85 0.01 0.00 0.00 0.00 0.00 51.96 51.02 3h3f s ALA 48 Cb -0.16 -1.38 -0.01 0.00 0.00 0.00 0.00 23.12 21.57 3h3f s ALA 48 CO 0.00 0.40 -0.15 -0.51 0.00 0.00 0.00 175.76 175.51 3h3f s LEU 49 N -0.24 2.62 0.12 0.00 1.43 -0.17 0.03 118.68 122.48 3h3f s LEU 49 Ca 0.04 -0.35 0.07 0.00 -1.03 0.00 0.00 54.13 52.86 3h3f s LEU 49 Cb -0.13 -1.57 -0.04 0.00 0.03 0.00 0.00 46.19 44.48 3h3f s LEU 49 CO 0.02 0.18 -0.17 0.54 0.23 0.00 0.00 176.35 177.16 3h3f s VAL 50 N 0.24 1.54 0.20 -1.59 0.11 -0.80 -1.35 120.40 118.75 3h3f s VAL 50 Ca -0.10 -1.69 -0.23 0.00 -2.93 0.00 0.00 61.98 57.03 3h3f s VAL 50 Cb -0.16 -1.58 0.05 0.00 -1.53 0.00 0.00 36.38 33.16 3h3f s VAL 50 CO 0.06 -0.28 0.85 -0.62 -3.33 0.00 0.00 175.10 171.77 3h3f s ASP 51 N -2.31 -0.23 0.00 3.54 -1.08 -1.26 0.17 116.67 115.51 3h3f s ASP 51 Ca 0.09 -0.46 0.23 0.00 -0.52 0.00 0.00 52.55 51.88 3h3f s ASP 51 Cb -0.07 0.59 0.09 0.00 -1.46 0.00 0.00 42.92 42.07 3h3f s ASP 51 CO 0.04 -1.08 1.13 1.33 0.52 0.00 0.00 175.17 177.11 3h3f n VAL 52 N -0.46 0.00 -3.04 1.11 0.24 -1.26 -4.44 118.33 110.48 3h3f n VAL 52 Ca -0.06 -0.04 -0.44 0.00 -2.04 0.00 0.00 64.34 61.76 3h3f n VAL 52 Cb 0.60 0.76 -0.04 0.00 -1.47 0.00 0.00 33.84 33.69 3h3f n VAL 52 CO 0.00 0.00 0.00 -0.04 -2.14 0.00 0.00 176.83 174.65 3h3f s MET 53 N -2.90 3.22 0.15 7.34 -1.94 -1.26 -4.97 119.30 118.93 3h3f s MET 53 Ca 0.11 -1.42 -0.24 0.00 -1.71 0.00 0.00 55.69 52.43 3h3f s MET 53 Cb 0.17 -4.41 0.01 0.00 2.01 0.00 0.00 34.83 32.61 3h3f s MET 53 CO 0.76 -1.63 1.61 0.93 -0.01 0.00 0.00 175.02 176.68 3h3f h GLU 54 N 9.07 -0.31 0.34 2.03 5.08 -2.00 0.04 114.58 128.84 3h3f h GLU 54 Ca -0.16 0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.20 3h3f h GLU 54 Cb 1.07 0.07 -0.00 0.00 0.50 0.00 0.00 28.75 30.38 3h3f h GLU 54 CO 1.09 -0.21 -0.23 -0.44 -1.00 0.00 0.00 179.01 178.22 3h3f h ASP 55 N -0.32 -0.60 -0.97 1.42 3.45 -1.99 -2.33 116.42 115.08 3h3f h ASP 55 Ca 0.13 0.04 0.22 0.00 0.43 0.00 0.00 57.03 57.84 3h3f h ASP 55 Cb 0.52 0.18 -0.18 0.00 -0.56 0.00 0.00 39.33 39.29 3h3f h ASP 55 CO -0.41 -0.35 -0.13 0.50 -1.57 0.00 0.00 179.24 177.28 3h3f h LYS 56 N -0.55 0.01 -0.25 3.56 1.63 -1.98 -1.29 116.57 117.70 3h3f h LYS 56 Ca -0.05 -0.00 0.03 0.00 -0.85 0.00 0.00 60.65 59.78 3h3f h LYS 56 Cb 0.44 -0.00 -0.03 0.00 -0.60 0.00 0.00 32.23 32.04 3h3f h LYS 56 CO 0.03 0.00 0.06 1.25 -3.45 0.00 0.00 179.45 177.35 3h3f h LEU 57 N 0.01 0.04 -0.77 5.20 5.85 -0.69 -1.67 115.31 123.27 3h3f h LEU 57 Ca 0.51 0.04 -0.09 0.00 0.84 0.00 0.00 57.88 59.18 3h3f h LEU 57 Cb 0.90 0.04 -0.01 0.00 0.37 0.00 0.00 40.66 41.96 3h3f h LEU 57 CO -0.96 0.05 -0.42 0.50 -0.34 0.00 0.00 178.44 177.27 3h3f h LYS 58 N 0.16 0.00 0.01 1.25 3.64 -0.75 -2.48 116.57 118.40 3h3f h LYS 58 Ca 0.11 0.00 -0.21 0.00 -1.27 0.00 0.00 60.65 59.28 3h3f h LYS 58 Cb 0.10 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 31.92 3h3f h LYS 58 CO -0.14 0.42 -0.92 0.78 -2.27 0.00 0.00 179.45 177.32 3h3f h GLY 59 N 2.29 0.30 0.88 5.01 0.00 -1.06 -1.84 103.07 108.64 3h3f h GLY 59 Ca -0.00 -0.55 -0.06 0.00 0.00 0.00 0.00 47.33 46.72 3h3f h GLY 59 CO 0.05 0.49 -0.03 0.83 0.00 0.00 0.00 176.54 177.88 3h3f h GLU 60 N 0.15 0.54 -0.26 4.80 4.39 -1.27 -1.58 114.58 121.35 3h3f h GLU 60 Ca -0.06 -0.19 -0.00 0.00 0.34 0.00 0.00 59.36 59.45 3h3f h GLU 60 Cb 1.56 -0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 30.16 3h3f h GLU 60 CO 0.15 0.71 0.16 1.98 -1.16 0.00 0.00 179.01 180.85 3h3f h MET 61 N 0.32 0.35 -0.19 2.33 4.05 -1.53 -2.01 114.93 118.24 3h3f h MET 61 Ca 0.08 -0.03 -0.04 0.00 -0.28 0.00 0.00 59.70 59.43 3h3f h MET 61 Cb 0.49 -0.07 -0.01 0.00 -0.80 0.00 0.00 31.60 31.20 3h3f h MET 61 CO 0.02 0.28 -0.04 0.52 0.23 0.00 0.00 176.91 177.92 3h3f h MET 62 N 0.33 0.29 -0.29 0.39 2.86 -1.29 -1.56 114.93 115.66 3h3f h MET 62 Ca 0.09 -0.05 -0.17 0.00 -2.06 0.00 0.00 59.70 57.52 3h3f h MET 62 Cb 0.02 -0.05 -0.00 0.00 0.06 0.00 0.00 31.60 31.63 3h3f h MET 62 CO -0.02 0.35 -0.47 0.22 1.06 0.00 0.00 176.91 178.06 3h3f h ASP 63 N 0.28 0.90 -0.26 1.22 -0.00 -0.75 -2.25 116.42 115.57 3h3f h ASP 63 Ca 0.06 -0.52 -0.00 0.00 -0.00 0.00 0.00 57.03 56.57 3h3f h ASP 63 Cb 0.26 -0.26 -0.01 0.00 -0.00 0.00 0.00 39.33 39.32 3h3f h ASP 63 CO 0.01 1.25 0.14 -0.07 -0.00 0.00 0.00 179.24 180.58 3h3f h LEU 64 N 0.59 0.32 -2.03 2.28 3.38 -1.19 -3.02 115.31 115.63 3h3f h LEU 64 Ca 0.02 -0.08 -0.01 0.00 0.09 0.00 0.00 57.88 57.91 3h3f h LEU 64 Cb 1.07 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 41.74 3h3f h LEU 64 CO 0.11 0.31 -0.04 1.56 0.09 0.00 0.00 178.44 180.46 3h3f h GLN 65 N 0.31 0.00 0.00 1.13 4.20 -0.98 -0.99 115.11 118.78 3h3f h GLN 65 Ca 0.09 0.00 -0.04 0.00 0.06 0.00 0.00 58.65 58.76 3h3f h GLN 65 Cb 0.05 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.83 3h3f h GLN 65 CO -0.02 0.04 -0.20 0.45 -0.67 0.00 0.00 178.83 178.44 3h3f h HIS 66 N 0.00 0.00 -0.33 2.96 3.86 -1.28 -2.76 115.15 117.60 3h3f h HIS 66 Ca -0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 3h3f h HIS 66 Cb 0.08 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.55 3h3f h HIS 66 CO 0.00 0.20 0.00 0.41 0.86 0.00 0.00 177.93 179.40 3h3f n GLY 67 N 0.81 0.80 0.26 2.45 0.00 -0.38 -4.45 105.19 104.67 3h3f n GLY 67 Ca 0.02 -0.38 0.12 0.00 0.00 0.00 0.00 46.02 45.78 3h3f n GLY 67 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 3h3f h SER 68 N 1.98 0.00 -0.54 1.61 0.87 -1.49 0.29 113.55 116.27 3h3f h SER 68 Ca 0.00 0.00 0.12 0.00 -1.23 0.00 0.00 61.79 60.68 3h3f h SER 68 Cb 0.55 0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 62.48 3h3f h SER 68 CO 0.03 0.14 0.37 0.25 -0.53 0.00 0.00 176.83 177.09 3h3f h LEU 69 N 0.00 0.19 -2.82 2.23 5.85 -1.84 -2.36 115.31 116.57 3h3f h LEU 69 Ca -0.00 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.72 3h3f h LEU 69 Cb 0.37 -0.03 0.00 0.00 0.37 0.00 0.00 40.66 41.36 3h3f h LEU 69 CO 0.02 0.11 0.00 0.49 -0.34 0.00 0.00 178.44 178.72 3h3f n PHE 70 N -4.44 1.13 -4.62 1.25 3.01 0.09 -4.94 117.46 108.94 3h3f n PHE 70 Ca 0.09 -0.52 -0.32 0.00 1.01 0.00 0.00 57.45 57.71 3h3f n PHE 70 Cb 0.46 -0.07 -0.07 0.00 -0.01 0.00 0.00 39.48 39.79 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 -1.23 2.40 -0.35 4.37 1.43 -0.89 -5.07 118.68 119.34 3h3f s LEU 71 Ca 0.50 -1.57 0.15 0.00 -1.03 0.00 0.00 54.13 52.18 3h3f s LEU 71 Cb 0.28 -0.82 0.45 0.00 0.03 0.00 0.00 46.19 46.12 3h3f s LEU 71 CO 0.31 -0.86 0.98 0.54 0.23 0.00 0.00 176.35 177.56 3h3f n ARG 72 N -1.32 1.69 -3.77 1.70 5.12 -1.26 -4.99 116.66 113.84 3h3f n ARG 72 Ca -0.16 -3.56 -0.29 0.00 -1.93 0.00 0.00 57.85 51.92 3h3f n ARG 72 Cb 0.67 -1.49 -0.16 0.00 -1.16 0.00 0.00 32.46 30.32 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 -3.69 0.83 -0.08 0.55 2.01 -1.26 -4.89 115.64 109.11 3h3f s THR 73 Ca 0.32 -1.01 0.27 0.00 0.31 0.00 0.00 61.69 61.58 3h3f s THR 73 Cb 0.44 -1.42 0.33 0.00 0.01 0.00 0.00 72.50 71.86 3h3f s THR 73 CO -0.02 -0.39 1.81 1.55 -0.69 0.00 0.00 174.62 176.88 3h3f h PRO 74 N 8.13 0.00 -3.98 4.92 0.13 -1.87 -3.43 132.00 135.91 3h3f h PRO 74 Ca -0.15 0.00 -0.54 0.00 -0.87 0.00 0.00 66.00 64.44 3h3f h PRO 74 Cb 1.07 0.00 -0.38 0.00 0.13 0.00 0.00 31.00 31.82 3h3f h PRO 74 CO 0.40 0.07 -0.78 0.21 -0.23 0.00 0.00 178.00 177.67 3h3f s LYS 75 N -3.48 1.17 -0.14 0.86 2.20 -1.24 -5.09 119.74 114.02 3h3f s LYS 75 Ca 0.03 -0.45 0.02 0.00 -0.36 0.00 0.00 55.97 55.21 3h3f s LYS 75 Cb 0.08 -1.94 0.01 0.00 -1.51 0.00 0.00 37.83 34.46 3h3f s LYS 75 CO 0.61 -0.47 -0.21 0.42 -0.36 0.00 0.00 175.35 175.34 3h3f s ILE 76 N 1.71 2.16 0.15 5.43 1.01 -1.26 -1.78 121.20 128.62 3h3f s ILE 76 Ca 0.00 -0.94 0.02 0.00 0.00 0.00 0.00 60.65 59.73 3h3f s ILE 76 Cb -0.16 -1.87 -0.04 0.00 0.01 0.00 0.00 42.46 40.40 3h3f s ILE 76 CO -0.07 0.54 -0.04 0.68 0.00 0.00 0.00 174.94 176.05 3h3f s VAL 77 N 0.81 0.81 0.20 2.92 -7.23 0.05 -5.00 120.40 112.96 3h3f s VAL 77 Ca -0.07 -1.99 -0.15 0.00 -1.81 0.00 0.00 61.98 57.96 3h3f s VAL 77 Cb -0.15 -1.95 0.01 0.00 0.56 0.00 0.00 36.38 34.85 3h3f s VAL 77 CO -0.02 -0.64 0.47 -0.94 -0.31 0.00 0.00 175.10 173.66 3h3f s SER 78 N -3.14 -0.17 -0.27 4.85 1.04 -1.26 -1.00 113.70 113.76 3h3f s SER 78 Ca 0.19 -0.64 -0.32 0.00 0.48 0.00 0.00 55.95 55.66 3h3f s SER 78 Cb 0.05 0.55 0.17 0.00 0.10 0.00 0.00 66.02 66.90 3h3f s SER 78 CO 0.01 -1.04 1.32 -0.83 0.98 0.00 0.00 173.24 173.68 3h3f s GLY 79 N -2.92 -0.05 0.37 7.32 0.00 -0.46 -4.93 107.32 106.66 3h3f s GLY 79 Ca 0.13 2.42 0.15 0.00 0.00 0.00 0.00 44.72 47.42 3h3f s GLY 79 CO -0.00 0.93 1.80 1.70 0.00 0.00 0.00 173.10 177.53 3h3f h LYS 80 N 2.07 0.00 -5.62 2.90 3.64 -1.87 -3.36 116.57 114.33 3h3f h LYS 80 Ca -0.08 0.00 -0.59 0.00 -1.27 0.00 0.00 60.65 58.71 3h3f h LYS 80 Cb 1.17 0.00 -0.09 0.00 -0.41 0.00 0.00 32.23 32.90 3h3f h LYS 80 CO 0.22 0.38 -0.26 0.34 -2.27 0.00 0.00 179.45 177.86 3h3f s ASP 81 N -6.74 6.54 0.00 4.20 3.68 -1.26 -4.81 116.67 118.28 3h3f s ASP 81 Ca -0.02 0.64 0.21 0.00 2.13 0.00 0.00 52.55 55.51 3h3f s ASP 81 Cb 0.13 -2.22 1.09 0.00 -1.45 0.00 0.00 42.92 40.48 3h3f s ASP 81 CO 0.71 0.10 1.65 -1.22 0.13 0.00 0.00 175.17 176.54 3h3f n TYR 82 N 3.38 0.00 0.31 -5.34 4.01 -1.26 -2.94 117.16 115.32 3h3f n TYR 82 Ca -0.11 0.00 0.10 0.00 -0.16 0.00 0.00 57.90 57.73 3h3f n TYR 82 Cb 0.52 -0.22 0.46 0.00 -0.31 0.00 0.00 39.34 39.79 3h3f n TYR 82 CO 0.00 0.00 0.00 -1.13 -0.46 0.00 0.00 176.86 175.27 3h3f n SER 83 N -1.22 0.50 0.00 7.72 3.41 -1.26 -0.54 113.62 122.23 3h3f n SER 83 Ca 0.11 0.66 0.13 0.00 -0.26 0.00 0.00 58.87 59.51 3h3f n SER 83 Cb 0.14 -0.75 0.69 0.00 -0.26 0.00 0.00 64.21 64.03 3h3f n SER 83 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 175.04 176.21 3h3f n VAL 84 N -2.09 0.11 0.64 -3.33 0.24 -1.15 -3.36 118.33 109.39 3h3f n VAL 84 Ca 0.01 0.03 0.07 0.00 -2.04 0.00 0.00 64.34 62.41 3h3f n VAL 84 Cb 0.14 -0.62 0.03 0.00 -1.47 0.00 0.00 33.84 31.93 3h3f n VAL 84 CO 0.00 0.00 0.00 0.41 -2.14 0.00 0.00 176.83 175.10 3h3f n THR 85 N -1.14 0.00 -2.16 3.34 -1.04 0.30 -4.77 114.28 108.81 3h3f n THR 85 Ca 0.16 -0.43 -0.41 0.00 -2.04 0.00 0.00 64.05 61.32 3h3f n THR 85 Cb 0.14 1.25 -0.03 0.00 -1.82 0.00 0.00 70.33 69.88 3h3f n THR 85 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3h3f s ALA 86 N -1.51 3.56 -0.45 2.41 0.00 -1.21 -3.23 121.76 121.33 3h3f s ALA 86 Ca 0.15 1.17 -0.02 0.00 0.00 0.00 0.00 51.96 53.27 3h3f s ALA 86 Cb 0.12 -3.51 0.00 0.00 0.00 0.00 0.00 23.12 19.74 3h3f s ALA 86 CO 0.27 -0.60 0.20 0.09 0.00 0.00 0.00 175.76 175.73 3h3f n ASN 87 N 2.65 -2.93 -4.79 0.00 5.03 -1.01 -4.96 115.26 109.24 3h3f n ASN 87 Ca 0.07 -0.09 -0.38 0.00 0.87 0.00 0.00 54.58 55.04 3h3f n ASN 87 Cb 0.42 -1.81 -0.06 0.00 -1.02 0.00 0.00 39.78 37.31 3h3f n ASN 87 CO 0.00 0.00 0.00 -0.44 -1.83 0.00 0.00 177.26 174.99 3h3f s SER 88 N -2.94 7.26 0.20 6.41 0.01 -1.20 -4.63 113.70 118.81 3h3f s SER 88 Ca 0.10 1.59 0.06 0.00 1.31 0.00 0.00 55.95 59.01 3h3f s SER 88 Cb -0.04 -2.48 0.12 0.00 0.21 0.00 0.00 66.02 63.82 3h3f s SER 88 CO 0.12 0.11 1.47 0.11 0.41 0.00 0.00 173.24 175.46 3h3f h LYS 89 N 3.84 0.11 -3.21 12.44 1.79 -1.62 -3.40 116.57 126.52 3h3f h LYS 89 Ca -0.47 -0.11 -0.29 0.00 -2.18 0.00 0.00 60.65 57.60 3h3f h LYS 89 Cb 1.20 0.03 -0.35 0.00 -1.58 0.00 0.00 32.23 31.53 3h3f h LYS 89 CO 0.66 0.83 -0.65 -1.17 -1.08 0.00 0.00 179.45 178.03 3h3f s LEU 90 N -7.46 0.31 -0.16 2.94 2.96 -1.23 -2.09 118.68 113.95 3h3f s LEU 90 Ca -0.02 0.26 -0.02 0.00 -0.22 0.00 0.00 54.13 54.13 3h3f s LEU 90 Cb 0.11 0.20 -0.02 0.00 0.50 0.00 0.00 46.19 46.99 3h3f s LEU 90 CO 0.80 -0.21 -0.09 -0.69 -1.32 0.00 0.00 176.35 174.85 3h3f s VAL 91 N 1.82 3.32 -0.21 1.68 1.01 -0.36 -1.67 120.40 125.99 3h3f s VAL 91 Ca -0.02 -0.55 -0.04 0.00 0.00 0.00 0.00 61.98 61.37 3h3f s VAL 91 Cb -0.12 -2.44 -0.01 0.00 0.00 0.00 0.00 36.38 33.81 3h3f s VAL 91 CO -0.05 0.50 -0.04 -0.63 0.00 0.00 0.00 175.10 174.87 3h3f s ILE 92 N 0.61 3.45 -0.36 2.22 1.01 -0.14 -0.32 121.20 127.67 3h3f s ILE 92 Ca -0.05 -0.47 -0.13 0.00 0.00 0.00 0.00 60.65 60.00 3h3f s ILE 92 Cb -0.15 -2.56 0.00 0.00 0.01 0.00 0.00 42.46 39.76 3h3f s ILE 92 CO 0.03 0.43 0.24 -0.63 0.00 0.00 0.00 174.94 175.01 3h3f s ILE 93 N 1.33 5.08 -0.09 2.92 -1.09 0.11 0.42 121.20 129.87 3h3f s ILE 93 Ca 0.04 -0.48 0.12 0.00 -2.23 0.00 0.00 60.65 58.11 3h3f s ILE 93 Cb -0.14 -3.71 0.21 0.00 -1.58 0.00 0.00 42.46 37.24 3h3f s ILE 93 CO -0.02 -0.13 1.11 0.35 -1.23 0.00 0.00 174.94 175.02 3h3f n THR 94 N 5.09 1.20 -2.68 2.92 -2.24 -0.23 -0.50 114.28 117.84 3h3f n THR 94 Ca -0.12 -1.54 -0.39 0.00 -2.27 0.00 0.00 64.05 59.73 3h3f n THR 94 Cb 0.48 0.07 -0.06 0.00 -2.10 0.00 0.00 70.33 68.72 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 -1.82 3.31 0.00 6.98 0.00 -1.02 -4.57 121.76 124.64 3h3f s ALA 95 Ca 0.22 0.67 0.00 0.00 0.00 0.00 0.00 51.96 52.85 3h3f s ALA 95 Cb 0.20 -3.24 0.00 0.00 0.00 0.00 0.00 23.12 20.08 3h3f s ALA 95 CO 0.00 0.08 0.00 0.41 0.00 0.00 0.00 175.76 176.26 3h3f n GLY 96 N 1.14 0.57 3.75 0.00 0.00 -1.26 -4.72 105.19 104.67 3h3f n GLY 96 Ca -0.00 -2.19 -0.41 0.00 0.00 0.00 0.00 46.02 43.42 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 -1.73 3.45 0.50 4.61 0.00 -1.26 -5.06 121.76 122.27 3h3f s ALA 97 Ca 0.00 1.02 0.05 0.00 0.00 0.00 0.00 51.96 53.03 3h3f s ALA 97 Cb 0.00 -3.40 0.01 0.00 0.00 0.00 0.00 23.12 19.73 3h3f s ALA 97 CO 0.00 -0.37 0.28 -0.98 0.00 0.00 0.00 175.76 174.70 3h3f s ARG 98 N -1.10 2.26 0.21 0.00 1.70 -1.26 -4.59 118.95 116.18 3h3f s ARG 98 Ca 0.49 -2.03 -0.30 0.00 -0.47 0.00 0.00 55.73 53.42 3h3f s ARG 98 Cb -0.34 -1.99 -0.08 0.00 -0.57 0.00 0.00 34.95 31.96 3h3f s ARG 98 CO 0.43 -0.44 0.99 -0.65 -1.08 0.00 0.00 175.30 174.54 3h3f s GLN 99 N -4.12 4.76 0.74 3.89 -0.21 -1.26 -5.02 119.66 118.44 3h3f s GLN 99 Ca 0.31 1.56 -0.11 0.00 0.02 0.00 0.00 55.36 57.14 3h3f s GLN 99 Cb -0.00 -3.28 0.04 0.00 1.00 0.00 0.00 33.01 30.77 3h3f s GLN 99 CO 0.18 0.36 1.11 -0.65 -2.12 0.00 0.00 175.29 174.17 3h3f s GLN 100 N -0.91 2.44 0.05 2.91 -1.52 -1.26 -4.93 119.66 116.44 3h3f s GLN 100 Ca 0.44 0.22 -0.35 0.00 -1.95 0.00 0.00 55.36 53.71 3h3f s GLN 100 Cb -0.27 -2.03 -0.14 0.00 -0.22 0.00 0.00 33.01 30.36 3h3f s GLN 100 CO 0.33 -1.26 1.64 -1.91 -0.25 0.00 0.00 175.29 173.84 3h3f n GLU 101 N -3.09 1.94 0.00 2.91 2.13 -1.26 -1.49 120.64 121.78 3h3f n GLU 101 Ca 0.07 0.70 0.00 0.00 0.66 0.00 0.00 57.16 58.60 3h3f n GLU 101 Cb 0.59 -2.47 0.00 0.00 0.27 0.00 0.00 31.44 29.83 3h3f n GLU 101 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3h3f n GLY 102 N 3.61 1.80 3.77 8.31 0.00 -1.26 -5.04 105.19 116.38 3h3f n GLY 102 Ca 0.19 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.84 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 -0.96 4.19 0.48 1.61 2.12 -0.55 -5.06 118.70 120.52 3h3f s GLU 103 Ca 0.00 0.43 -0.23 0.00 0.36 0.00 0.00 54.97 55.53 3h3f s GLU 103 Cb 0.00 -3.35 -0.07 0.00 0.26 0.00 0.00 34.13 30.97 3h3f s GLU 103 CO 0.00 0.37 1.24 0.45 -0.54 0.00 0.00 175.26 176.79 3h3f s SER 104 N -0.07 5.93 0.62 -1.70 0.15 -1.26 -4.73 113.70 112.64 3h3f s SER 104 Ca 0.25 2.50 0.36 0.00 0.70 0.00 0.00 55.95 59.75 3h3f s SER 104 Cb -0.16 -2.62 2.06 0.00 -1.71 0.00 0.00 66.02 63.59 3h3f s SER 104 CO 0.11 -1.10 2.29 0.03 1.20 0.00 0.00 173.24 175.78 3h3f h ARG 105 N 1.98 0.00 0.00 5.44 3.08 -1.97 -2.22 114.38 120.69 3h3f h ARG 105 Ca -0.50 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 59.55 3h3f h ARG 105 Cb 1.26 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.31 3h3f h ARG 105 CO 0.60 0.01 -1.23 1.28 -1.07 0.00 0.00 179.97 179.56 3h3f n LEU 106 N -3.51 0.66 0.21 3.04 4.77 -1.26 -2.93 117.00 117.99 3h3f n LEU 106 Ca -0.03 0.26 0.15 0.00 -0.03 0.00 0.00 56.01 56.36 3h3f n LEU 106 Cb 0.09 -0.05 0.71 0.00 -2.33 0.00 0.00 43.42 41.84 3h3f n LEU 106 CO 0.24 -0.15 0.94 -1.13 -1.33 0.00 0.00 177.39 175.97 3h3f h ASN 107 N 0.00 0.00 0.27 -1.43 -0.73 -1.78 -2.55 115.58 109.36 3h3f h ASN 107 Ca -0.00 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.17 3h3f h ASN 107 Cb 1.00 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.59 3h3f h ASN 107 CO 0.00 0.00 -0.13 0.18 -0.37 0.00 0.00 177.43 177.11 3h3f n LEU 108 N -2.58 0.68 -0.20 0.34 4.77 -1.15 -4.53 117.00 114.33 3h3f n LEU 108 Ca -0.00 -0.11 -0.04 0.00 -0.03 0.00 0.00 56.01 55.83 3h3f n LEU 108 Cb 0.15 -0.14 0.06 0.00 -2.33 0.00 0.00 43.42 41.16 3h3f n LEU 108 CO 0.18 0.12 1.08 1.62 -1.33 0.00 0.00 177.39 179.06 3h3f h VAL 109 N 0.87 1.02 -0.15 4.08 3.04 -1.62 -3.00 116.25 120.50 3h3f h VAL 109 Ca 0.00 -0.22 -0.13 0.00 -1.01 0.00 0.00 66.70 65.34 3h3f h VAL 109 Cb 0.39 0.31 0.00 0.00 -2.01 0.00 0.00 31.29 29.98 3h3f h VAL 109 CO 0.00 0.12 -0.41 -0.61 -1.01 0.00 0.00 177.57 175.66 3h3f h GLN 110 N 0.66 0.54 -0.44 4.17 5.75 -1.83 0.49 115.11 124.44 3h3f h GLN 110 Ca 0.24 -0.38 0.07 0.00 -0.15 0.00 0.00 58.65 58.43 3h3f h GLN 110 Cb 0.08 0.06 -0.06 0.00 1.07 0.00 0.00 27.48 28.63 3h3f h GLN 110 CO -0.13 1.00 0.11 0.00 -2.65 0.00 0.00 178.83 177.16 3h3f h ARG 111 N 0.17 0.24 0.00 1.69 3.08 -1.89 -2.96 114.38 114.71 3h3f h ARG 111 Ca -0.01 -0.01 -0.15 0.00 0.07 0.00 0.00 59.98 59.88 3h3f h ARG 111 Cb 1.03 -0.05 -0.02 0.00 0.08 0.00 0.00 29.97 31.01 3h3f h ARG 111 CO 0.09 0.16 -0.71 -0.91 -1.07 0.00 0.00 179.97 177.53 3h3f h ASN 112 N 0.25 0.00 -0.39 7.04 -0.26 -1.32 -2.90 115.58 117.99 3h3f h ASN 112 Ca 0.21 0.00 0.03 0.00 -0.56 0.00 0.00 56.30 55.99 3h3f h ASN 112 Cb 0.26 0.00 -0.03 0.00 -1.06 0.00 0.00 38.32 37.48 3h3f h ASN 112 CO -0.26 0.71 0.19 0.58 -1.06 0.00 0.00 177.43 177.59 3h3f h VAL 113 N 0.00 0.96 -0.82 2.81 2.07 0.06 -0.72 116.25 120.62 3h3f h VAL 113 Ca -0.01 -0.13 0.16 0.00 0.82 0.00 0.00 66.70 67.54 3h3f h VAL 113 Cb 1.48 0.54 -0.06 0.00 -1.52 0.00 0.00 31.29 31.73 3h3f h VAL 113 CO 0.09 0.07 0.54 0.78 0.02 0.00 0.00 177.57 179.07 3h3f h ASN 114 N 0.39 0.45 0.32 0.57 -0.26 -1.49 -2.46 115.58 113.09 3h3f h ASN 114 Ca 0.17 0.03 -0.19 0.00 -0.56 0.00 0.00 56.30 55.75 3h3f h ASN 114 Cb 0.09 -0.06 -0.00 0.00 -1.06 0.00 0.00 38.32 37.29 3h3f h ASN 114 CO -0.13 0.22 -0.78 0.40 -1.06 0.00 0.00 177.43 176.08 3h3f h ILE 115 N 0.47 1.40 0.00 2.81 2.04 -0.98 -2.99 117.51 120.25 3h3f h ILE 115 Ca 0.41 -2.25 -0.09 0.00 1.00 0.00 0.00 64.86 63.94 3h3f h ILE 115 Cb 0.90 2.21 -0.01 0.00 -0.74 0.00 0.00 36.82 39.17 3h3f h ILE 115 CO -0.15 0.67 -0.41 -0.26 0.00 0.00 0.00 178.15 178.01 3h3f h PHE 116 N 0.24 0.00 0.00 1.37 -1.00 -0.83 -0.82 116.94 115.90 3h3f h PHE 116 Ca -0.04 0.00 -0.03 0.00 2.81 0.00 0.00 57.97 60.71 3h3f h PHE 116 Cb 1.37 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 40.93 3h3f h PHE 116 CO 0.04 0.41 -0.13 0.87 -1.61 0.00 0.00 178.31 177.89 3h3f h LYS 117 N 0.00 0.00 0.15 1.51 1.57 -1.30 -1.61 116.57 116.89 3h3f h LYS 117 Ca -0.00 0.00 -0.36 0.00 -1.87 0.00 0.00 60.65 58.42 3h3f h LYS 117 Cb 0.83 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.14 3h3f h LYS 117 CO 0.05 0.13 -1.90 0.35 -0.57 0.00 0.00 179.45 177.51 3h3f h PHE 118 N 0.00 0.58 0.00 -1.35 3.57 -1.39 -3.42 116.94 114.93 3h3f h PHE 118 Ca -0.00 -0.42 -0.00 0.00 3.53 0.00 0.00 57.97 61.07 3h3f h PHE 118 Cb 0.24 -0.02 0.00 0.00 2.79 0.00 0.00 35.95 38.95 3h3f h PHE 118 CO 0.00 1.75 -0.00 0.82 -2.23 0.00 0.00 178.31 178.65 3h3f h ILE 119 N 0.08 0.84 -0.18 1.41 2.04 -1.03 -3.37 117.51 117.30 3h3f h ILE 119 Ca -0.39 -1.63 0.04 0.00 1.00 0.00 0.00 64.86 63.88 3h3f h ILE 119 Cb 2.06 1.59 -0.04 0.00 -0.74 0.00 0.00 36.82 39.70 3h3f h ILE 119 CO 0.12 0.29 -0.05 0.40 0.00 0.00 0.00 178.15 178.91 3h3f h ILE 120 N -1.00 0.81 -0.55 -0.67 1.08 -1.55 -2.11 117.51 113.52 3h3f h ILE 120 Ca -0.00 0.00 0.16 0.00 -0.39 0.00 0.00 64.86 64.63 3h3f h ILE 120 Cb 0.47 0.81 -0.02 0.00 -3.07 0.00 0.00 36.82 35.01 3h3f h ILE 120 CO 0.00 0.00 0.40 -0.65 -0.69 0.00 0.00 178.15 177.21 3h3f h PRO 121 N -0.00 0.03 -0.07 2.37 0.11 -1.78 -1.91 132.00 130.76 3h3f h PRO 121 Ca 0.09 -0.00 -0.08 0.00 0.11 0.00 0.00 66.00 66.12 3h3f h PRO 121 Cb 0.14 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 31.24 3h3f h PRO 121 CO -0.19 0.02 -0.27 -0.91 -0.21 0.00 0.00 178.00 176.44 3h3f h ASN 122 N 0.03 0.35 -0.10 -2.05 2.35 -1.56 -3.12 115.58 111.49 3h3f h ASN 122 Ca 0.26 -0.64 0.04 0.00 -0.55 0.00 0.00 56.30 55.42 3h3f h ASN 122 Cb 1.01 -0.10 -0.06 0.00 0.05 0.00 0.00 38.32 39.22 3h3f h ASN 122 CO -0.01 0.93 -0.31 0.58 -1.65 0.00 0.00 177.43 176.97 3h3f h VAL 123 N -0.21 0.31 0.00 2.81 2.07 -1.00 -2.92 116.25 117.31 3h3f h VAL 123 Ca -0.01 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.51 3h3f h VAL 123 Cb 0.91 0.31 0.00 0.00 -1.52 0.00 0.00 31.29 30.99 3h3f h VAL 123 CO 0.06 0.00 0.00 1.33 0.02 0.00 0.00 177.57 178.98 3h3f n VAL 124 N -5.40 0.12 -0.02 2.57 0.24 -0.78 -0.29 118.33 114.77 3h3f n VAL 124 Ca -0.04 0.03 -0.19 0.00 -2.04 0.00 0.00 64.34 62.10 3h3f n VAL 124 Cb 0.32 -0.67 -0.13 0.00 -1.47 0.00 0.00 33.84 31.89 3h3f n VAL 124 CO 0.00 0.00 0.00 0.50 -2.14 0.00 0.00 176.83 175.19 3h3f h LYS 125 N 0.00 0.16 0.00 7.34 3.64 -1.45 -3.27 116.57 122.99 3h3f h LYS 125 Ca 0.00 -0.27 -0.20 0.00 -1.27 0.00 0.00 60.65 58.91 3h3f h LYS 125 Cb 0.08 0.10 -0.03 0.00 -0.41 0.00 0.00 32.23 31.97 3h3f h LYS 125 CO 0.00 1.13 -0.99 1.88 -2.27 0.00 0.00 179.45 179.20 3h3f h TYR 126 N -0.61 0.00 -2.53 1.91 -1.99 -1.32 -3.39 116.97 109.04 3h3f h TYR 126 Ca -0.19 0.00 -0.60 0.00 2.00 0.00 0.00 58.73 59.95 3h3f h TYR 126 Cb 1.46 0.00 -0.40 0.00 2.00 0.00 0.00 36.73 39.79 3h3f h TYR 126 CO 0.18 0.93 -0.78 0.43 -0.00 0.00 0.00 178.16 178.93 3h3f n SER 127 N -3.31 1.74 0.22 3.88 7.64 0.60 -2.40 113.62 122.00 3h3f n SER 127 Ca -0.01 -2.94 0.15 0.00 1.01 0.00 0.00 58.87 57.08 3h3f n SER 127 Cb 0.92 -0.66 0.71 0.00 -1.01 0.00 0.00 64.21 64.16 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 4.98 0.00 -0.32 1.43 0.14 -1.77 -3.09 132.00 133.37 3h3f h PRO 128 Ca 0.18 0.00 0.00 0.00 0.14 0.00 0.00 66.00 66.32 3h3f h PRO 128 Cb 0.80 0.00 0.00 0.00 0.14 0.00 0.00 31.00 31.94 3h3f h PRO 128 CO 0.60 0.00 0.00 0.72 0.14 0.00 0.00 178.00 179.46 3h3f n HIS 129 N -2.63 0.78 -2.36 1.56 8.25 -1.26 -5.03 115.22 114.53 3h3f n HIS 129 Ca -0.00 -0.70 -0.24 0.00 -0.26 0.00 0.00 57.72 56.51 3h3f n HIS 129 Cb 0.18 -0.19 0.07 0.00 1.12 0.00 0.00 29.99 31.17 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 -5.14 3.52 -0.19 0.00 3.01 -0.89 -4.95 119.74 115.10 3h3f s LYS 131 Ca 0.61 -0.27 -0.05 0.00 -1.01 0.00 0.00 55.97 55.24 3h3f s LYS 131 Cb -0.09 -3.10 -0.03 0.00 -1.01 0.00 0.00 37.83 33.59 3h3f s LYS 131 CO 0.43 0.58 0.01 -0.51 0.51 0.00 0.00 175.35 176.37 3h3f s LEU 132 N -0.49 3.38 -0.30 3.17 1.43 0.13 -1.22 118.68 124.79 3h3f s LEU 132 Ca 0.11 -0.13 -0.02 0.00 -1.03 0.00 0.00 54.13 53.05 3h3f s LEU 132 Cb -0.12 -1.85 0.04 0.00 0.03 0.00 0.00 46.19 44.29 3h3f s LEU 132 CO 0.02 0.10 0.00 -0.22 0.23 0.00 0.00 176.35 176.48 3h3f s LEU 133 N 0.79 3.82 -0.22 1.79 2.96 0.57 -0.79 118.68 127.60 3h3f s LEU 133 Ca 0.01 -1.16 -0.18 0.00 -0.22 0.00 0.00 54.13 52.58 3h3f s LEU 133 Cb -0.14 -1.73 -0.03 0.00 0.50 0.00 0.00 46.19 44.79 3h3f s LEU 133 CO 0.02 -0.24 0.49 -0.69 -1.32 0.00 0.00 176.35 174.61 3h3f s VAL 134 N 1.29 5.11 -0.13 1.68 1.01 0.45 -0.71 120.40 129.11 3h3f s VAL 134 Ca -0.04 0.88 0.09 0.00 0.00 0.00 0.00 61.98 62.91 3h3f s VAL 134 Cb -0.19 -3.81 -0.14 0.00 0.00 0.00 0.00 36.38 32.23 3h3f s VAL 134 CO -0.01 0.16 0.01 0.52 0.00 0.00 0.00 175.10 175.78 3h3f n VAL 135 N 4.71 0.87 -1.53 2.92 0.31 0.34 -1.93 118.33 124.03 3h3f n VAL 135 Ca -0.05 -0.49 -0.40 0.00 -0.01 0.00 0.00 64.34 63.38 3h3f n VAL 135 Cb 0.50 -0.75 0.02 0.00 -0.91 0.00 0.00 33.84 32.71 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 -2.57 0.04 -4.88 4.52 7.64 -1.05 -4.67 113.62 112.66 3h3f n SER 136 Ca -0.22 0.91 -0.32 0.00 1.01 0.00 0.00 58.87 60.25 3h3f n SER 136 Cb 0.89 -1.24 -0.05 0.00 -1.01 0.00 0.00 64.21 62.79 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 -0.96 6.61 -0.20 6.43 0.01 -1.26 -2.94 114.94 122.62 3h3f s ASN 137 Ca 0.66 0.88 -0.29 0.00 -0.71 0.00 0.00 52.86 53.40 3h3f s ASN 137 Cb -0.53 -2.21 -0.02 0.00 0.41 0.00 0.00 41.25 38.90 3h3f s ASN 137 CO 0.55 -0.06 1.45 -2.16 -1.51 0.00 0.00 177.10 175.37 3h3f s PRO 138 N -2.82 3.99 0.51 -0.60 0.04 -1.19 -4.64 135.00 130.30 3h3f s PRO 138 Ca 0.47 1.63 0.26 0.00 0.04 0.00 0.00 61.00 63.40 3h3f s PRO 138 Cb -0.11 -3.92 1.38 0.00 0.04 0.00 0.00 34.50 31.89 3h3f s PRO 138 CO 0.22 -1.03 2.05 -0.24 0.04 0.00 0.00 177.00 178.03 3h3f h VAL 139 N 5.85 0.61 0.13 -0.36 3.04 -1.80 -1.21 116.25 122.50 3h3f h VAL 139 Ca -0.31 -0.58 -0.22 0.00 -1.01 0.00 0.00 66.70 64.58 3h3f h VAL 139 Cb 1.13 1.37 0.02 0.00 -2.01 0.00 0.00 31.29 31.80 3h3f h VAL 139 CO 1.00 0.13 -0.93 0.44 -1.01 0.00 0.00 177.57 177.19 3h3f h ASP 140 N 0.00 0.59 -0.57 3.17 3.32 -1.89 -2.29 116.42 118.75 3h3f h ASP 140 Ca -0.00 -0.90 -0.09 0.00 0.02 0.00 0.00 57.03 56.06 3h3f h ASP 140 Cb 0.36 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 39.70 3h3f h ASP 140 CO 0.02 1.44 -0.01 0.40 -1.72 0.00 0.00 179.24 179.37 3h3f h ILE 141 N -0.16 1.27 0.00 0.35 1.08 -1.77 -2.68 117.51 115.59 3h3f h ILE 141 Ca -0.15 -1.14 0.00 0.00 -0.39 0.00 0.00 64.86 63.17 3h3f h ILE 141 Cb 1.70 0.87 0.00 0.00 -3.07 0.00 0.00 36.82 36.32 3h3f h ILE 141 CO 0.18 0.41 0.00 -0.07 -0.69 0.00 0.00 178.15 177.98 3h3f h LEU 142 N 0.89 0.00 0.06 1.44 3.38 -1.29 -0.15 115.31 119.64 3h3f h LEU 142 Ca 0.16 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.13 3h3f h LEU 142 Cb 0.56 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.31 3h3f h LEU 142 CO 0.03 0.00 -0.03 0.74 0.09 0.00 0.00 178.44 179.27 3h3f h THR 143 N 0.00 1.25 -0.90 0.22 2.02 -1.08 -1.25 112.91 113.16 3h3f h THR 143 Ca 0.00 -1.44 0.17 0.00 0.77 0.00 0.00 66.41 65.91 3h3f h THR 143 Cb 0.57 2.14 -0.10 0.00 -1.74 0.00 0.00 68.15 69.01 3h3f h THR 143 CO 0.00 0.34 0.47 0.22 0.37 0.00 0.00 175.52 176.92 3h3f h TYR 144 N -0.78 0.82 -0.58 3.16 3.20 -1.16 -1.42 116.97 120.21 3h3f h TYR 144 Ca -0.01 0.04 -0.06 0.00 3.14 0.00 0.00 58.73 61.84 3h3f h TYR 144 Cb 0.62 -0.23 -0.02 0.00 1.54 0.00 0.00 36.73 38.64 3h3f h TYR 144 CO 0.14 0.15 0.13 0.28 -1.64 0.00 0.00 178.16 177.22 3h3f h VAL 145 N 0.61 1.25 -0.95 1.81 2.07 -0.99 -1.64 116.25 118.41 3h3f h VAL 145 Ca 0.51 -0.91 0.04 0.00 0.82 0.00 0.00 66.70 67.16 3h3f h VAL 145 Cb 0.80 0.73 -0.06 0.00 -1.52 0.00 0.00 31.29 31.24 3h3f h VAL 145 CO -0.40 0.34 0.62 0.00 0.02 0.00 0.00 177.57 178.15 3h3f h ALA 146 N 1.02 1.40 -0.17 1.67 0.00 -0.55 -2.48 119.26 120.16 3h3f h ALA 146 Ca 0.18 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.99 3h3f h ALA 146 Cb 0.36 -0.33 -0.00 0.00 0.00 0.00 0.00 17.79 17.82 3h3f h ALA 146 CO 0.00 0.50 -0.11 2.35 0.00 0.00 0.00 179.25 181.99 3h3f h TRP 147 N 1.18 0.44 0.29 0.00 7.01 -1.09 -1.55 115.95 122.23 3h3f h TRP 147 Ca 0.38 -0.12 -0.01 0.00 2.11 0.00 0.00 58.89 61.25 3h3f h TRP 147 Cb 0.04 -0.10 0.00 0.00 -2.10 0.00 0.00 29.16 27.01 3h3f h TRP 147 CO -0.00 0.71 -0.14 0.87 -2.79 0.00 0.00 178.44 177.09 3h3f h LYS 148 N 0.04 -0.37 0.58 2.65 1.79 -1.32 -1.63 116.57 118.30 3h3f h LYS 148 Ca 0.03 0.03 -0.02 0.00 -2.18 0.00 0.00 60.65 58.51 3h3f h LYS 148 Cb 0.61 0.08 -0.00 0.00 -1.58 0.00 0.00 32.23 31.34 3h3f h LYS 148 CO 0.03 -0.20 -0.35 0.82 -1.08 0.00 0.00 179.45 178.68 3h3f h ILE 149 N -0.46 0.29 -0.69 1.86 2.04 -1.53 -3.18 117.51 115.84 3h3f h ILE 149 Ca -0.04 0.00 0.03 0.00 1.00 0.00 0.00 64.86 65.85 3h3f h ILE 149 Cb 0.35 0.29 -0.04 0.00 -0.74 0.00 0.00 36.82 36.68 3h3f h ILE 149 CO 0.06 0.00 0.45 0.77 0.00 0.00 0.00 178.15 179.44 3h3f h SER 150 N -0.87 0.73 -0.07 1.72 4.64 -1.34 -3.47 113.55 114.89 3h3f h SER 150 Ca -0.07 -0.01 -0.03 0.00 -0.47 0.00 0.00 61.79 61.21 3h3f h SER 150 Cb 0.71 -0.17 -0.01 0.00 -0.31 0.00 0.00 62.40 62.61 3h3f h SER 150 CO 0.07 0.51 -0.03 0.61 -0.87 0.00 0.00 176.83 177.13 3h3f n GLY 151 N -1.44 0.50 3.78 -0.77 0.00 -0.61 -5.02 105.19 101.63 3h3f n GLY 151 Ca 0.08 -0.26 -0.34 0.00 0.00 0.00 0.00 46.02 45.50 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 -1.89 2.77 0.76 1.61 2.99 -1.25 -5.02 117.98 117.95 3h3f s PHE 152 Ca 0.00 1.55 -0.14 0.00 0.00 0.00 0.00 56.93 58.34 3h3f s PHE 152 Cb 0.00 -3.18 0.06 0.00 0.00 0.00 0.00 43.02 39.90 3h3f s PHE 152 CO 0.00 -1.39 1.19 -1.25 -0.00 0.00 0.00 175.22 173.77 3h3f s PRO 153 N -3.56 1.98 0.59 0.24 0.04 -1.26 -4.92 135.00 128.11 3h3f s PRO 153 Ca 0.69 1.67 0.33 0.00 0.04 0.00 0.00 61.00 63.74 3h3f s PRO 153 Cb -0.21 -1.82 1.85 0.00 0.04 0.00 0.00 34.50 34.36 3h3f s PRO 153 CO 0.30 -1.94 2.22 1.57 0.04 0.00 0.00 177.00 179.19 3h3f h LYS 154 N -0.60 0.00 0.00 4.56 2.10 -1.95 -2.62 116.57 118.06 3h3f h LYS 154 Ca -0.47 0.00 -0.01 0.00 -2.00 0.00 0.00 60.65 58.17 3h3f h LYS 154 Cb 1.28 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.61 3h3f h LYS 154 CO 0.49 0.03 -0.05 -2.95 -2.00 0.00 0.00 179.45 174.97 3h3f h ASN 155 N 0.00 0.00 -0.64 7.07 -1.07 -1.88 -2.80 115.58 116.26 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 0.12 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 36.37 3h3f h ASN 155 CO 0.00 0.05 0.00 0.54 0.07 0.00 0.00 177.43 178.10 3h3f n ARG 156 N -3.56 2.70 -3.85 4.14 1.74 -0.99 -1.81 116.66 115.04 3h3f n ARG 156 Ca -0.02 -2.53 -0.28 0.00 -0.77 0.00 0.00 57.85 54.25 3h3f n ARG 156 Cb 0.16 -1.52 -0.16 0.00 -1.02 0.00 0.00 32.46 29.92 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 -1.06 0.95 -0.07 1.55 1.01 -1.06 -0.69 120.40 121.03 3h3f s VAL 157 Ca 0.44 -0.62 0.04 0.00 0.00 0.00 0.00 61.98 61.84 3h3f s VAL 157 Cb 0.23 -1.22 0.00 0.00 0.00 0.00 0.00 36.38 35.39 3h3f s VAL 157 CO 0.31 0.03 -0.18 -0.63 0.00 0.00 0.00 175.10 174.62 3h3f s ILE 158 N 1.69 1.56 -0.14 2.22 1.01 0.03 -4.82 121.20 122.75 3h3f s ILE 158 Ca -0.00 -0.75 -0.08 0.00 0.00 0.00 0.00 60.65 59.83 3h3f s ILE 158 Cb -0.16 -1.36 -0.04 0.00 0.01 0.00 0.00 42.46 40.91 3h3f s ILE 158 CO -0.07 0.45 0.13 -0.83 0.00 0.00 0.00 174.94 174.62 3h3f s GLY 159 N 0.34 2.12 0.43 6.18 0.00 -0.74 -0.41 107.32 115.24 3h3f s GLY 159 Ca -0.12 -0.66 0.30 0.00 0.00 0.00 0.00 44.72 44.24 3h3f s GLY 159 CO 0.05 -0.26 1.91 1.48 0.00 0.00 0.00 173.10 176.27 3h3f h SER 160 N 5.39 0.00 0.00 1.64 4.64 -1.71 -1.51 113.55 121.99 3h3f h SER 160 Ca -0.51 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.81 3h3f h SER 160 Cb 1.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 3h3f h SER 160 CO 0.62 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 177.19 3h3f n GLY 161 N -0.94 2.00 1.57 -0.77 0.00 -1.26 -2.14 105.19 103.65 3h3f n GLY 161 Ca -0.01 -0.03 0.02 0.00 0.00 0.00 0.00 46.02 46.00 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 2.63 0.80 0.19 0.00 -1.24 -0.77 0.22 115.58 117.41 3h3f h ASN 163 Ca 0.06 -0.26 -0.23 0.00 0.71 0.00 0.00 56.30 56.58 3h3f h ASN 163 Cb 1.69 -0.21 0.01 0.00 0.73 0.00 0.00 38.32 40.54 3h3f h ASN 163 CO 0.42 0.85 -0.93 0.25 -1.29 0.00 0.00 177.43 176.74 3h3f h LEU 164 N 0.72 0.67 -0.35 0.34 5.85 -1.77 -2.34 115.31 118.43 3h3f h LEU 164 Ca 0.15 -0.51 0.05 0.00 0.84 0.00 0.00 57.88 58.41 3h3f h LEU 164 Cb 0.39 -0.20 -0.04 0.00 0.37 0.00 0.00 40.66 41.17 3h3f h LEU 164 CO 0.01 1.31 0.10 0.44 -0.34 0.00 0.00 178.44 179.95 3h3f h ASP 165 N 0.31 0.08 -0.20 1.25 5.19 -1.77 -0.95 116.42 120.33 3h3f h ASP 165 Ca -0.08 0.05 -0.05 0.00 -0.62 0.00 0.00 57.03 56.33 3h3f h ASP 165 Cb 1.56 0.05 -0.02 0.00 0.18 0.00 0.00 39.33 41.10 3h3f h ASP 165 CO 0.17 0.08 -0.01 0.28 -3.12 0.00 0.00 179.24 176.64 3h3f h SER 166 N 0.23 0.45 0.95 6.45 0.02 -0.90 -1.87 113.55 118.87 3h3f h SER 166 Ca 0.16 -0.08 -0.17 0.00 -0.84 0.00 0.00 61.79 60.86 3h3f h SER 166 Cb 0.16 -0.12 -0.02 0.00 0.14 0.00 0.00 62.40 62.56 3h3f h SER 166 CO -0.19 0.52 -0.82 0.00 -1.14 0.00 0.00 176.83 175.20 3h3f h ALA 167 N 1.54 0.57 -0.47 3.77 0.00 -0.95 -2.48 119.26 121.24 3h3f h ALA 167 Ca 0.10 -0.75 -0.08 0.00 0.00 0.00 0.00 54.91 54.18 3h3f h ALA 167 Cb 0.32 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 3h3f h ALA 167 CO 0.01 1.03 -0.03 0.00 0.00 0.00 0.00 179.25 180.26 3h3f h ARG 168 N 0.00 0.85 0.22 0.00 3.08 -0.82 -2.78 114.38 114.94 3h3f h ARG 168 Ca -0.01 -0.29 -0.00 0.00 0.07 0.00 0.00 59.98 59.75 3h3f h ARG 168 Cb 1.52 -0.07 -0.02 0.00 0.08 0.00 0.00 29.97 31.48 3h3f h ARG 168 CO 0.11 0.91 -0.27 0.35 -1.07 0.00 0.00 179.97 180.00 3h3f h PHE 169 N 0.70 -0.77 -1.31 3.04 -0.00 -1.30 -1.12 116.94 116.18 3h3f h PHE 169 Ca 0.13 0.01 0.44 0.00 -0.00 0.00 0.00 57.97 58.55 3h3f h PHE 169 Cb 0.55 0.31 -0.13 0.00 -0.00 0.00 0.00 35.95 36.67 3h3f h PHE 169 CO 0.04 -0.35 0.84 0.00 -0.00 0.00 0.00 178.31 178.85 3h3f h ARG 170 N -0.51 0.08 -0.24 1.11 3.08 -1.53 -0.69 114.38 115.68 3h3f h ARG 170 Ca -0.03 -0.00 -0.17 0.00 0.07 0.00 0.00 59.98 59.85 3h3f h ARG 170 Cb 0.45 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.49 3h3f h ARG 170 CO -0.06 0.05 -0.50 -0.92 -1.07 0.00 0.00 179.97 177.47 3h3f h TYR 171 N 0.08 0.97 -0.03 3.04 3.20 -1.10 -2.28 116.97 120.85 3h3f h TYR 171 Ca 0.83 -0.36 -0.22 0.00 3.14 0.00 0.00 58.73 62.12 3h3f h TYR 171 Cb 2.58 -0.18 0.00 0.00 1.54 0.00 0.00 36.73 40.68 3h3f h TYR 171 CO -0.01 1.16 -0.89 -0.07 -1.64 0.00 0.00 178.16 176.71 3h3f h LEU 172 N 0.51 0.57 0.32 2.82 3.38 -0.06 -1.94 115.31 120.92 3h3f h LEU 172 Ca 0.01 -0.44 -0.00 0.00 0.09 0.00 0.00 57.88 57.54 3h3f h LEU 172 Cb 1.11 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 41.65 3h3f h LEU 172 CO 0.11 1.22 -0.51 -0.03 0.09 0.00 0.00 178.44 179.32 3h3f h MET 173 N 0.27 -0.85 -0.94 1.13 4.05 -1.26 -1.69 114.93 115.64 3h3f h MET 173 Ca -0.07 0.06 0.04 0.00 -0.28 0.00 0.00 59.70 59.44 3h3f h MET 173 Cb 1.52 0.19 -0.05 0.00 -0.80 0.00 0.00 31.60 32.45 3h3f h MET 173 CO 0.16 -0.57 0.62 0.78 0.23 0.00 0.00 176.91 178.13 3h3f h GLY 174 N -0.88 1.36 0.80 1.39 0.00 -1.42 0.68 103.07 105.01 3h3f h GLY 174 Ca -0.04 -0.47 0.04 0.00 0.00 0.00 0.00 47.33 46.86 3h3f h GLY 174 CO -0.16 0.40 0.40 -2.09 0.00 0.00 0.00 176.54 175.08 3h3f h GLU 175 N 1.19 0.74 -0.07 4.80 4.81 -1.30 0.40 114.58 125.14 3h3f h GLU 175 Ca 0.38 -0.04 -0.16 0.00 -0.13 0.00 0.00 59.36 59.40 3h3f h GLU 175 Cb 0.01 -0.17 -0.01 0.00 0.63 0.00 0.00 28.75 29.22 3h3f h GLU 175 CO -0.11 0.49 -0.67 0.00 -0.73 0.00 0.00 179.01 177.99 3h3f h ARG 176 N 0.76 0.31 -0.00 1.92 3.08 -0.13 -3.18 114.38 117.14 3h3f h ARG 176 Ca 0.28 -0.24 0.00 0.00 0.07 0.00 0.00 59.98 60.09 3h3f h ARG 176 Cb 0.08 0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.17 3h3f h ARG 176 CO -0.13 0.87 -0.40 1.28 -1.07 0.00 0.00 179.97 180.52 3h3f n LEU 177 N -3.85 0.52 -2.05 3.04 4.32 0.22 -4.98 117.00 114.23 3h3f n LEU 177 Ca -0.03 0.01 -0.14 0.00 -0.02 0.00 0.00 56.01 55.83 3h3f n LEU 177 Cb 0.66 -0.25 0.03 0.00 -1.62 0.00 0.00 43.42 42.24 3h3f n LEU 177 CO 0.46 0.12 0.01 0.61 -1.22 0.00 0.00 177.39 177.37 3h3f n GLY 178 N 1.47 -0.08 3.04 -0.72 0.00 0.13 -5.03 105.19 104.00 3h3f n GLY 178 Ca 0.07 -0.19 -0.10 0.00 0.00 0.00 0.00 46.02 45.80 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 -2.96 0.09 0.37 1.61 1.01 -0.60 -5.02 120.40 114.89 3h3f s VAL 179 Ca 0.21 -0.72 -0.28 0.00 0.00 0.00 0.00 61.98 61.18 3h3f s VAL 179 Cb -0.09 -0.33 -0.11 0.00 0.00 0.00 0.00 36.38 35.85 3h3f s VAL 179 CO 0.26 -0.40 1.49 -2.28 0.00 0.00 0.00 175.10 174.17 3h3f s HIS 180 N -1.28 2.62 0.41 5.22 5.65 -1.26 -4.19 115.29 122.45 3h3f s HIS 180 Ca -0.14 1.14 0.23 0.00 0.25 0.00 0.00 55.06 56.54 3h3f s HIS 180 Cb -0.08 -4.01 1.24 0.00 -1.18 0.00 0.00 32.58 28.55 3h3f s HIS 180 CO 0.00 -2.99 1.70 0.00 -0.65 0.00 0.00 174.74 172.80 3h3f h ALA 181 N 3.19 2.41 -0.31 1.58 0.00 -1.90 0.64 119.26 124.88 3h3f h ALA 181 Ca -0.50 0.10 0.09 0.00 0.00 0.00 0.00 54.91 54.59 3h3f h ALA 181 Cb 1.24 0.12 -0.01 0.00 0.00 0.00 0.00 17.79 19.13 3h3f h ALA 181 CO 0.66 -0.93 0.38 -0.07 0.00 0.00 0.00 179.25 179.28 3h3f h LEU 182 N 0.26 0.00 -0.90 0.00 4.07 -1.90 -2.23 115.31 114.60 3h3f h LEU 182 Ca 0.70 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.66 3h3f h LEU 182 Cb 1.97 0.00 0.00 0.00 1.08 0.00 0.00 40.66 43.71 3h3f h LEU 182 CO -0.38 0.00 -0.25 -1.20 -1.08 0.00 0.00 178.44 175.53 3h3f n SER 183 N -3.62 1.53 -4.63 -0.43 7.64 0.22 -4.90 113.62 109.43 3h3f n SER 183 Ca 0.05 -1.26 -0.36 0.00 1.01 0.00 0.00 58.87 58.30 3h3f n SER 183 Cb 0.52 0.42 -0.10 0.00 -1.01 0.00 0.00 64.21 64.04 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 1.01 3.02 0.00 0.00 0.09 -0.52 -4.80 115.29 114.09 3h3f s HIS 185 Ca 0.07 -0.02 0.00 0.00 -0.00 0.00 0.00 55.06 55.11 3h3f s HIS 185 Cb -0.14 -1.54 0.00 0.00 -0.00 0.00 0.00 32.58 30.91 3h3f s HIS 185 CO 0.04 0.49 0.00 0.41 -0.00 0.00 0.00 174.74 175.68 3h3f n GLY 186 N 0.46 3.71 3.27 -2.22 0.00 -1.26 -2.32 105.19 106.83 3h3f n GLY 186 Ca -0.10 -0.49 -0.28 0.00 0.00 0.00 0.00 46.02 45.15 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 -1.74 2.02 -0.09 1.61 0.52 -1.26 -4.81 118.94 115.18 3h3f s TRP 187 Ca 0.00 -0.39 0.02 0.00 0.02 0.00 0.00 56.10 55.75 3h3f s TRP 187 Cb 0.00 -1.26 -0.02 0.00 -1.15 0.00 0.00 33.47 31.04 3h3f s TRP 187 CO 0.00 0.03 -0.14 0.42 0.02 0.00 0.00 176.95 177.29 3h3f s ILE 188 N -0.66 3.06 0.12 2.03 -1.09 -1.26 -1.53 121.20 121.86 3h3f s ILE 188 Ca 0.09 -0.69 -0.00 0.00 -2.23 0.00 0.00 60.65 57.81 3h3f s ILE 188 Cb -0.09 -2.24 -0.04 0.00 -1.58 0.00 0.00 42.46 38.51 3h3f s ILE 188 CO 0.00 0.56 0.02 -0.76 -1.23 0.00 0.00 174.94 173.53 3h3f s LEU 189 N -0.18 2.02 0.00 2.97 1.02 -0.88 -4.76 118.68 118.87 3h3f s LEU 189 Ca -0.00 -1.15 0.00 0.00 0.02 0.00 0.00 54.13 53.00 3h3f s LEU 189 Cb -0.13 0.20 0.00 0.00 0.02 0.00 0.00 46.19 46.28 3h3f s LEU 189 CO 0.03 -0.66 0.00 0.61 0.02 0.00 0.00 176.35 176.35 3h3f n GLY 190 N -0.07 0.96 3.72 -3.19 0.00 -0.61 0.62 105.19 106.63 3h3f n GLY 190 Ca -0.08 -1.47 -0.42 0.00 0.00 0.00 0.00 46.02 44.05 3h3f n GLY 190 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3h3f s GLU 191 N 0.00 4.56 -0.86 1.61 2.12 -1.26 -1.57 118.70 123.30 3h3f s GLU 191 Ca 0.00 1.62 -0.25 0.00 0.36 0.00 0.00 54.97 56.70 3h3f s GLU 191 Cb 0.00 -3.36 -0.10 0.00 0.26 0.00 0.00 34.13 30.94 3h3f s GLU 191 CO 0.00 -0.02 2.17 -1.58 -0.54 0.00 0.00 175.26 175.29 3h3f s HIS 192 N 0.46 1.48 -0.31 5.30 5.65 -1.26 -3.07 115.29 123.53 3h3f s HIS 192 Ca 0.52 1.32 0.00 0.00 0.25 0.00 0.00 55.06 57.15 3h3f s HIS 192 Cb -0.26 -3.74 0.00 0.00 -1.18 0.00 0.00 32.58 27.40 3h3f s HIS 192 CO 0.31 -1.62 0.00 0.41 -0.65 0.00 0.00 174.74 173.19 3h3f n GLY 193 N 6.80 0.17 0.34 1.59 0.00 -1.26 -4.90 105.19 107.93 3h3f n GLY 193 Ca 0.43 -1.03 0.20 0.00 0.00 0.00 0.00 46.02 45.62 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 0.00 -0.21 1.61 3.45 -1.88 -2.43 116.42 116.96 3h3f h ASP 194 Ca 0.00 0.00 -0.16 0.00 0.43 0.00 0.00 57.03 57.30 3h3f h ASP 194 Cb 0.00 0.00 -0.14 0.00 -0.56 0.00 0.00 39.33 38.63 3h3f h ASP 194 CO 0.00 0.00 -0.62 -1.54 -1.57 0.00 0.00 179.24 175.51 3h3f n SER 195 N -3.09 2.54 -4.79 6.45 3.41 -1.26 -5.03 113.62 111.85 3h3f n SER 195 Ca -0.02 -3.74 -0.34 0.00 -0.26 0.00 0.00 58.87 54.51 3h3f n SER 195 Cb 0.17 -0.47 -0.00 0.00 -0.26 0.00 0.00 64.21 63.65 3h3f n SER 195 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 3h3f s SER 196 N -3.29 5.84 -0.23 4.04 1.04 -0.92 -4.01 113.70 116.17 3h3f s SER 196 Ca 0.41 1.99 -0.05 0.00 0.48 0.00 0.00 55.95 58.78 3h3f s SER 196 Cb 0.38 -2.56 -0.01 0.00 0.10 0.00 0.00 66.02 63.93 3h3f s SER 196 CO -0.04 -1.13 -0.01 -0.69 0.98 0.00 0.00 173.24 172.35 3h3f s VAL 197 N -2.08 3.61 -0.06 5.02 1.01 0.20 -4.91 120.40 123.20 3h3f s VAL 197 Ca 0.68 -0.45 -0.30 0.00 0.00 0.00 0.00 61.98 61.92 3h3f s VAL 197 Cb -0.19 -2.68 -0.02 0.00 0.00 0.00 0.00 36.38 33.49 3h3f s VAL 197 CO 0.29 0.37 1.08 -2.16 0.00 0.00 0.00 175.10 174.69 3h3f s PRO 198 N 1.51 4.42 -1.21 2.72 0.04 -1.26 -2.06 135.00 139.15 3h3f s PRO 198 Ca 0.06 1.52 -0.11 0.00 0.04 0.00 0.00 61.00 62.50 3h3f s PRO 198 Cb -0.15 -3.52 0.20 0.00 0.04 0.00 0.00 34.50 31.07 3h3f s PRO 198 CO -0.01 -0.33 1.50 0.28 0.04 0.00 0.00 177.00 178.49 3h3f n VAL 199 N 4.45 4.41 0.12 -0.36 0.31 -0.58 -4.79 118.33 121.90 3h3f n VAL 199 Ca 0.09 -4.84 0.17 0.00 -0.01 0.00 0.00 64.34 59.75 3h3f n VAL 199 Cb 0.48 -2.43 0.72 0.00 -0.91 0.00 0.00 33.84 31.71 3h3f n VAL 199 CO 0.00 0.00 0.00 -0.50 -1.32 0.00 0.00 176.83 175.01 3h3f h TRP 200 N 6.57 0.00 -0.03 3.52 4.06 -1.92 -1.97 115.95 126.17 3h3f h TRP 200 Ca 0.31 0.00 -0.04 0.00 2.06 0.00 0.00 58.89 61.22 3h3f h TRP 200 Cb 0.79 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.94 3h3f h TRP 200 CO 1.08 0.00 -0.17 0.66 -3.56 0.00 0.00 178.44 176.44 3h3f h SER 201 N 0.00 0.05 -0.59 -3.49 4.64 -1.95 -3.18 113.55 109.02 3h3f h SER 201 Ca 0.14 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.46 3h3f h SER 201 Cb 0.63 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 62.71 3h3f h SER 201 CO -0.00 0.23 0.00 0.61 -0.87 0.00 0.00 176.83 176.79 3h3f n GLY 202 N -0.97 2.57 3.71 -0.77 0.00 -0.74 -4.85 105.19 104.13 3h3f n GLY 202 Ca -0.02 -0.64 -0.42 0.00 0.00 0.00 0.00 46.02 44.94 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 -1.01 4.32 0.18 1.61 -1.94 -1.20 -4.51 119.30 116.74 3h3f s MET 203 Ca 0.39 2.02 -0.17 0.00 -1.71 0.00 0.00 55.69 56.22 3h3f s MET 203 Cb 0.21 -3.36 0.03 0.00 2.01 0.00 0.00 34.83 33.71 3h3f s MET 203 CO 0.27 -0.46 0.49 0.54 -0.01 0.00 0.00 175.02 175.85 3h3f s ASN 204 N 1.36 -0.27 -0.14 3.03 4.22 -0.98 -2.06 114.94 120.10 3h3f s ASN 204 Ca 0.64 -0.42 0.01 0.00 -2.14 0.00 0.00 52.86 50.95 3h3f s ASN 204 Cb -0.34 0.55 0.00 0.00 1.28 0.00 0.00 41.25 42.74 3h3f s ASN 204 CO 0.29 -1.00 -0.18 -0.69 -2.04 0.00 0.00 177.10 173.49 3h3f s VAL 205 N -3.85 2.46 -1.43 3.54 1.01 -1.19 -1.43 120.40 119.50 3h3f s VAL 205 Ca 0.07 -0.85 -0.08 0.00 0.00 0.00 0.00 61.98 61.13 3h3f s VAL 205 Cb -0.00 -2.01 0.01 0.00 0.00 0.00 0.00 36.38 34.37 3h3f s VAL 205 CO -0.06 0.53 1.00 0.00 0.00 0.00 0.00 175.10 176.57 3h3f n ALA 206 N 3.96 -1.20 0.00 5.51 0.00 -1.26 -0.80 120.51 126.72 3h3f n ALA 206 Ca -0.19 0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.62 3h3f n ALA 206 Cb 0.52 -5.00 0.00 0.00 0.00 0.00 0.00 19.45 14.97 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 -1.85 2.35 3.57 0.00 0.00 -1.26 -4.98 105.19 103.02 3h3f n GLY 207 Ca -0.03 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.56 3h3f n GLY 207 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3h3f s VAL 208 N -2.45 4.66 0.20 1.61 0.11 0.02 -5.01 120.40 119.55 3h3f s VAL 208 Ca 0.00 0.79 -0.31 0.00 -2.93 0.00 0.00 61.98 59.52 3h3f s VAL 208 Cb 0.00 -4.28 -0.11 0.00 -1.53 0.00 0.00 36.38 30.47 3h3f s VAL 208 CO 0.00 -0.56 1.59 -0.55 -3.33 0.00 0.00 175.10 172.25 3h3f s SER 209 N 1.97 6.52 0.04 3.54 0.15 -1.26 -3.19 113.70 121.47 3h3f s SER 209 Ca 0.32 2.73 0.10 0.00 0.70 0.00 0.00 55.95 59.81 3h3f s SER 209 Cb -0.12 -2.60 -0.21 0.00 -1.71 0.00 0.00 66.02 61.37 3h3f s SER 209 CO 0.20 -0.86 0.96 -0.07 1.20 0.00 0.00 173.24 174.67 3h3f h LEU 210 N 6.32 0.00 -0.21 3.45 4.07 -1.74 -3.22 115.31 123.98 3h3f h LEU 210 Ca -0.44 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.52 3h3f h LEU 210 Cb 1.21 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.95 3h3f h LEU 210 CO 0.89 0.98 0.00 0.50 -1.08 0.00 0.00 178.44 179.73 3h3f h LYS 211 N 0.00 0.00 -0.00 1.13 3.64 -1.81 -2.65 116.57 116.88 3h3f h LYS 211 Ca -0.15 0.00 -0.18 0.00 -1.27 0.00 0.00 60.65 59.05 3h3f h LYS 211 Cb 1.88 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 33.68 3h3f h LYS 211 CO 0.10 0.00 -0.82 1.15 -2.27 0.00 0.00 179.45 177.61 3h3f h THR 212 N 0.00 1.52 0.00 1.00 2.02 -1.94 -2.16 112.91 113.35 3h3f h THR 212 Ca 0.00 -2.62 -0.03 0.00 0.77 0.00 0.00 66.41 64.53 3h3f h THR 212 Cb 0.89 2.44 -0.01 0.00 -1.74 0.00 0.00 68.15 69.73 3h3f h THR 212 CO 0.00 0.76 -0.38 0.25 0.37 0.00 0.00 175.52 176.52 3h3f h LEU 213 N 0.06 0.00 -5.33 2.58 5.85 -1.54 -3.42 115.31 113.52 3h3f h LEU 213 Ca -0.03 0.00 -0.06 0.00 0.84 0.00 0.00 57.88 58.64 3h3f h LEU 213 Cb 1.43 0.00 -0.17 0.00 0.37 0.00 0.00 40.66 42.29 3h3f h LEU 213 CO 0.12 0.14 -0.37 -2.28 -0.34 0.00 0.00 178.44 175.71 3h3f s HIS 214 N -3.17 -1.27 0.58 1.25 2.46 -1.01 -5.07 115.29 109.06 3h3f s HIS 214 Ca 0.04 -0.16 0.35 0.00 0.47 0.00 0.00 55.06 55.76 3h3f s HIS 214 Cb 0.07 0.24 1.97 0.00 -0.13 0.00 0.00 32.58 34.73 3h3f s HIS 214 CO 0.72 -0.94 2.26 -1.35 -2.47 0.00 0.00 174.74 172.96 3h3f h PRO 215 N 5.52 0.00 -0.43 2.88 0.11 -1.64 -2.10 132.00 136.34 3h3f h PRO 215 Ca 0.03 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.14 3h3f h PRO 215 Cb 1.16 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.27 3h3f h PRO 215 CO 0.01 0.02 0.00 -0.85 -0.21 0.00 0.00 178.00 176.96 3h3f n GLU 216 N -3.54 2.00 -1.38 1.05 0.00 -1.26 -4.89 120.64 112.61 3h3f n GLU 216 Ca -0.03 -1.55 -0.60 0.00 0.00 0.00 0.00 57.16 54.98 3h3f n GLU 216 Cb 0.11 -1.34 -0.11 0.00 0.00 0.00 0.00 31.44 30.10 3h3f n GLU 216 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.13 177.02 3h3f n LEU 217 N 0.76 0.89 0.00 -1.84 7.94 -0.79 -2.57 117.00 121.39 3h3f n LEU 217 Ca 0.14 0.84 0.00 0.00 -1.11 0.00 0.00 56.01 55.89 3h3f n LEU 217 Cb 0.36 -0.85 0.00 0.00 0.53 0.00 0.00 43.42 43.46 3h3f n LEU 217 CO 0.10 -0.76 0.00 0.61 -1.11 0.00 0.00 177.39 176.23 3h3f n GLY 218 N 5.85 0.73 3.80 -3.96 0.00 -1.26 -5.00 105.19 105.35 3h3f n GLY 218 Ca 0.44 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 46.22 3h3f n GLY 218 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3h3f s THR 219 N -2.27 2.45 0.16 2.61 -4.23 -1.06 -4.86 115.64 108.43 3h3f s THR 219 Ca 0.00 -1.55 -0.04 0.00 -1.18 0.00 0.00 61.69 58.92 3h3f s THR 219 Cb 0.00 -3.00 -0.12 0.00 1.34 0.00 0.00 72.50 70.72 3h3f s THR 219 CO 0.00 0.00 1.39 0.44 -0.54 0.00 0.00 174.62 175.91 3h3f h ASP 220 N 1.26 0.60 -0.28 3.99 3.32 -1.98 -3.33 116.42 120.00 3h3f h ASP 220 Ca -0.42 -0.40 -0.48 0.00 0.02 0.00 0.00 57.03 55.74 3h3f h ASP 220 Cb 1.26 -0.18 -0.05 0.00 0.22 0.00 0.00 39.33 40.58 3h3f h ASP 220 CO 0.65 1.16 1.71 0.00 -1.72 0.00 0.00 179.24 181.04 3h3f n ALA 221 N -2.54 6.91 -3.82 3.45 0.00 -1.26 -4.85 120.51 118.40 3h3f n ALA 221 Ca -0.05 -2.93 -0.34 0.00 0.00 0.00 0.00 53.44 50.12 3h3f n ALA 221 Cb 0.73 -2.77 -0.15 0.00 0.00 0.00 0.00 19.45 17.26 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 1.65 4.06 0.43 0.00 2.15 -1.25 -4.99 116.67 118.72 3h3f s ASP 222 Ca 0.65 -0.83 0.27 0.00 0.43 0.00 0.00 52.55 53.07 3h3f s ASP 222 Cb 0.26 -1.62 1.33 0.00 -0.30 0.00 0.00 42.92 42.59 3h3f s ASP 222 CO -0.06 -0.09 1.67 0.07 -0.17 0.00 0.00 175.17 176.58 3h3f h LYS 223 N 7.98 0.17 -0.34 4.34 -0.00 -1.94 0.24 116.57 127.02 3h3f h LYS 223 Ca -0.35 -0.01 -0.03 0.00 -0.00 0.00 0.00 60.65 60.26 3h3f h LYS 223 Cb 1.11 -0.04 -0.02 0.00 -0.00 0.00 0.00 32.23 33.29 3h3f h LYS 223 CO 0.58 0.11 0.01 -0.85 -0.00 0.00 0.00 179.45 179.31 3h3f n GLU 224 N -4.67 3.18 -3.96 0.07 0.28 -1.26 -5.00 120.64 109.28 3h3f n GLU 224 Ca 0.33 -2.94 -0.35 0.00 -0.16 0.00 0.00 57.16 54.05 3h3f n GLU 224 Cb 1.26 -1.93 -0.00 0.00 1.43 0.00 0.00 31.44 32.20 3h3f n GLU 224 CO 0.00 0.00 0.00 1.04 -0.16 0.00 0.00 177.13 178.01 3h3f n GLN 225 N -0.37 -1.41 0.22 3.44 6.02 0.85 -4.88 117.38 121.25 3h3f n GLN 225 Ca 0.25 0.27 0.09 0.00 -0.01 0.00 0.00 57.00 57.60 3h3f n GLN 225 Cb 0.98 -3.66 0.45 0.00 1.02 0.00 0.00 30.24 29.03 3h3f n GLN 225 CO 0.00 0.00 0.00 -1.49 -1.01 0.00 0.00 177.06 174.56 3h3f h TRP 226 N -2.09 0.00 0.00 1.08 4.06 -1.88 -2.52 115.95 114.60 3h3f h TRP 226 Ca -0.67 0.00 -0.02 0.00 2.06 0.00 0.00 58.89 60.26 3h3f h TRP 226 Cb 1.38 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 29.54 3h3f h TRP 226 CO 0.41 0.26 -0.08 -0.22 -3.56 0.00 0.00 178.44 175.25 3h3f h LYS 227 N 0.00 0.00 0.00 0.49 3.64 -1.89 -2.22 116.57 116.59 3h3f h LYS 227 Ca -0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 3h3f h LYS 227 Cb 0.75 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.57 3h3f h LYS 227 CO 0.03 0.08 0.00 1.04 -2.27 0.00 0.00 179.45 178.33 3h3f n GLN 228 N -4.09 0.74 0.04 1.90 1.13 -0.95 -2.04 117.38 114.10 3h3f n GLN 228 Ca -0.03 0.00 -0.12 0.00 -1.94 0.00 0.00 57.00 54.91 3h3f n GLN 228 Cb 0.16 -1.44 -0.14 0.00 0.11 0.00 0.00 30.24 28.93 3h3f n GLN 228 CO 0.00 0.00 0.00 0.28 -1.44 0.00 0.00 177.06 175.90 3h3f h VAL 229 N 0.00 1.21 0.00 5.09 2.07 -1.57 0.19 116.25 123.24 3h3f h VAL 229 Ca 0.00 -2.92 0.00 0.00 0.82 0.00 0.00 66.70 64.60 3h3f h VAL 229 Cb 0.00 2.69 0.00 0.00 -1.52 0.00 0.00 31.29 32.46 3h3f h VAL 229 CO 0.00 0.78 -0.52 -0.74 0.02 0.00 0.00 177.57 177.11 3h3f h HIS 230 N 0.03 0.00 0.04 1.57 -0.00 -1.64 -2.34 115.15 112.81 3h3f h HIS 230 Ca -0.20 0.00 -0.00 0.00 -0.00 0.00 0.00 60.37 60.17 3h3f h HIS 230 Cb 1.95 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 29.36 3h3f h HIS 230 CO 0.03 0.00 -0.02 -0.22 -0.00 0.00 0.00 177.93 177.72 3h3f h LYS 231 N 0.00 -0.05 -0.75 5.26 1.63 -1.42 -2.82 116.57 118.42 3h3f h LYS 231 Ca 0.00 0.00 0.06 0.00 -0.85 0.00 0.00 60.65 59.87 3h3f h LYS 231 Cb 0.92 0.01 -0.05 0.00 -0.60 0.00 0.00 32.23 32.51 3h3f h LYS 231 CO 0.00 0.39 0.49 1.96 -3.45 0.00 0.00 179.45 178.84 3h3f h GLN 232 N -0.51 0.76 0.75 1.90 4.20 -0.66 -2.23 115.11 119.32 3h3f h GLN 232 Ca -0.01 -0.05 -0.04 0.00 0.06 0.00 0.00 58.65 58.62 3h3f h GLN 232 Cb 0.47 -0.17 0.01 0.00 0.30 0.00 0.00 27.48 28.08 3h3f h GLN 232 CO 0.01 0.51 -0.36 0.28 -0.67 0.00 0.00 178.83 178.60 3h3f h VAL 233 N 0.79 0.02 -0.71 -0.54 2.07 -1.33 -1.99 116.25 114.57 3h3f h VAL 233 Ca 0.32 -0.26 0.16 0.00 0.82 0.00 0.00 66.70 67.74 3h3f h VAL 233 Cb 0.25 0.03 -0.04 0.00 -1.52 0.00 0.00 31.29 30.01 3h3f h VAL 233 CO -0.11 0.00 0.48 1.62 0.02 0.00 0.00 177.57 179.59 3h3f h VAL 234 N -1.26 0.76 0.00 2.57 3.04 -1.41 -0.45 116.25 119.49 3h3f h VAL 234 Ca -0.10 -0.09 0.00 0.00 -1.01 0.00 0.00 66.70 65.50 3h3f h VAL 234 Cb 0.77 0.46 0.00 0.00 -2.01 0.00 0.00 31.29 30.52 3h3f h VAL 234 CO 0.17 0.05 -0.02 0.47 -1.01 0.00 0.00 177.57 177.22 3h3f n ASP 235 N -4.44 0.15 -0.21 3.17 8.00 -0.85 -4.30 116.55 118.07 3h3f n ASP 235 Ca 0.14 0.48 -0.06 0.00 0.71 0.00 0.00 54.79 56.06 3h3f n ASP 235 Cb 0.59 -0.51 -0.01 0.00 -0.02 0.00 0.00 41.12 41.17 3h3f n ASP 235 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 3h3f h SER 236 N 0.00 -1.28 -0.55 -2.24 0.02 -0.28 0.03 113.55 109.25 3h3f h SER 236 Ca 0.00 0.24 -0.01 0.00 -0.84 0.00 0.00 61.79 61.18 3h3f h SER 236 Cb 0.54 0.62 -0.03 0.00 0.14 0.00 0.00 62.40 63.67 3h3f h SER 236 CO 0.00 -0.31 0.32 0.00 -1.14 0.00 0.00 176.83 175.69 3h3f h ALA 237 N 0.90 0.71 -0.26 3.77 0.00 -1.78 -1.64 119.26 120.95 3h3f h ALA 237 Ca 0.22 -0.08 -0.14 0.00 0.00 0.00 0.00 54.91 54.90 3h3f h ALA 237 Cb 0.56 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 3h3f h ALA 237 CO -0.70 0.21 -0.42 -0.92 0.00 0.00 0.00 179.25 177.42 3h3f h TYR 238 N 0.74 0.77 0.04 0.00 3.20 -1.68 -0.28 116.97 119.76 3h3f h TYR 238 Ca 0.20 -0.23 -0.00 0.00 3.14 0.00 0.00 58.73 61.83 3h3f h TYR 238 Cb 0.02 -0.16 0.00 0.00 1.54 0.00 0.00 36.73 38.13 3h3f h TYR 238 CO -0.02 0.95 -0.02 0.93 -1.64 0.00 0.00 178.16 178.37 3h3f h GLU 239 N 0.52 -0.05 -0.06 1.82 4.39 -0.76 -1.33 114.58 119.10 3h3f h GLU 239 Ca 0.04 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.74 3h3f h GLU 239 Cb 0.95 0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 29.61 3h3f h GLU 239 CO 0.09 0.33 0.03 0.28 -1.16 0.00 0.00 179.01 178.58 3h3f h VAL 240 N -0.44 1.14 -0.72 3.13 2.07 -1.27 -0.61 116.25 119.54 3h3f h VAL 240 Ca -0.01 -0.40 0.15 0.00 0.82 0.00 0.00 66.70 67.26 3h3f h VAL 240 Cb 0.41 1.29 -0.10 0.00 -1.52 0.00 0.00 31.29 31.36 3h3f h VAL 240 CO 0.01 0.11 0.20 0.40 0.02 0.00 0.00 177.57 178.31 3h3f h ILE 241 N -0.05 0.57 -0.46 4.57 2.04 -1.15 0.46 117.51 123.49 3h3f h ILE 241 Ca 0.02 -0.10 -0.02 0.00 1.00 0.00 0.00 64.86 65.76 3h3f h ILE 241 Cb 0.16 0.23 -0.02 0.00 -0.74 0.00 0.00 36.82 36.45 3h3f h ILE 241 CO -0.00 0.06 0.22 0.50 0.00 0.00 0.00 178.15 178.92 3h3f h LYS 242 N 0.31 0.64 0.00 2.37 3.64 -0.31 0.12 116.57 123.34 3h3f h LYS 242 Ca 0.40 -0.07 -0.04 0.00 -1.27 0.00 0.00 60.65 59.66 3h3f h LYS 242 Cb 0.65 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 32.34 3h3f h LYS 242 CO -0.47 0.50 -0.24 -0.07 -2.27 0.00 0.00 179.45 176.90 3h3f h LEU 243 N 0.64 0.00 -0.95 5.20 3.38 0.55 -3.41 115.31 120.73 3h3f h LEU 243 Ca 0.16 -0.89 0.00 0.00 0.09 0.00 0.00 57.88 57.24 3h3f h LEU 243 Cb 0.07 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.82 3h3f h LEU 243 CO -0.02 1.09 -0.03 2.29 0.09 0.00 0.00 178.44 181.85 3h3f n LYS 244 N -4.58 0.73 0.00 1.13 2.85 0.14 -5.03 118.16 113.41 3h3f n LYS 244 Ca -0.14 -0.61 0.00 0.00 -1.05 0.00 0.00 58.31 56.51 3h3f n LYS 244 Cb 0.51 -1.01 0.00 0.00 -0.65 0.00 0.00 35.03 33.89 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 0.39 2.71 3.82 2.58 0.00 0.43 -4.98 105.19 110.15 3h3f n GLY 245 Ca 0.02 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.03 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 -2.70 -0.00 0.09 1.61 1.13 -1.26 -4.79 117.35 111.43 3h3f s TYR 246 Ca 0.00 -0.27 0.09 0.00 -1.41 0.00 0.00 57.07 55.48 3h3f s TYR 246 Cb 0.00 0.63 -0.03 0.00 -1.10 0.00 0.00 41.96 41.46 3h3f s TYR 246 CO 0.00 -0.67 -0.24 0.95 -2.51 0.00 0.00 175.55 173.09 3h3f s THR 247 N -2.45 1.96 0.39 -3.49 -4.23 -1.26 -4.23 115.64 102.33 3h3f s THR 247 Ca 0.19 -1.52 0.00 0.00 -1.18 0.00 0.00 61.69 59.18 3h3f s THR 247 Cb -0.00 -1.73 0.00 0.00 1.34 0.00 0.00 72.50 72.10 3h3f s THR 247 CO 0.02 0.12 0.00 0.35 -0.54 0.00 0.00 174.62 174.57 3h3f n THR 248 N 1.30 0.00 -0.12 3.99 -2.24 -1.26 -4.65 114.28 111.31 3h3f n THR 248 Ca -0.18 0.00 -0.05 0.00 -2.27 0.00 0.00 64.05 61.55 3h3f n THR 248 Cb 0.53 -0.27 0.02 0.00 -2.10 0.00 0.00 70.33 68.52 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 -0.03 -0.46 4.78 4.06 -1.96 -2.41 115.95 119.93 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 0.07 -0.02 0.00 -1.00 0.00 0.00 29.16 28.22 3h3f h TRP 249 CO 0.00 -0.08 -0.05 0.00 -3.56 0.00 0.00 178.44 174.75 3h3f h ALA 250 N 1.34 0.62 -0.69 1.49 0.00 -1.99 -2.87 119.26 117.16 3h3f h ALA 250 Ca 0.19 -0.30 -0.02 0.00 0.00 0.00 0.00 54.91 54.78 3h3f h ALA 250 Cb 0.27 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 3h3f h ALA 250 CO -0.32 0.47 0.34 0.97 0.00 0.00 0.00 179.25 180.70 3h3f h ILE 251 N 0.69 1.23 0.07 0.00 6.09 -1.89 -1.85 117.51 121.84 3h3f h ILE 251 Ca 0.12 -0.63 0.01 0.00 -1.37 0.00 0.00 64.86 63.00 3h3f h ILE 251 Cb 0.57 0.37 -0.02 0.00 0.47 0.00 0.00 36.82 38.22 3h3f h ILE 251 CO 0.03 0.26 -0.13 1.23 -3.07 0.00 0.00 178.15 176.48 3h3f h GLY 252 N 0.95 -0.21 0.61 8.18 0.00 -1.23 0.71 103.07 112.09 3h3f h GLY 252 Ca 0.24 0.15 0.04 0.00 0.00 0.00 0.00 47.33 47.75 3h3f h GLY 252 CO -0.03 -0.13 -0.06 1.41 0.00 0.00 0.00 176.54 177.73 3h3f h LEU 253 N -0.25 -0.20 -0.88 3.11 3.38 -1.54 0.39 115.31 119.32 3h3f h LEU 253 Ca 0.02 0.06 0.07 0.00 0.09 0.00 0.00 57.88 58.12 3h3f h LEU 253 Cb 0.27 0.13 -0.06 0.00 0.09 0.00 0.00 40.66 41.08 3h3f h LEU 253 CO -0.08 -0.07 0.54 -1.28 0.09 0.00 0.00 178.44 177.64 3h3f h SER 254 N -0.02 0.85 -0.23 -0.43 0.87 -0.94 -1.25 113.55 112.40 3h3f h SER 254 Ca 0.09 0.02 -0.19 0.00 -1.23 0.00 0.00 61.79 60.48 3h3f h SER 254 Cb 0.15 -0.16 0.00 0.00 -0.44 0.00 0.00 62.40 61.96 3h3f h SER 254 CO -0.20 0.54 -0.58 0.58 -0.53 0.00 0.00 176.83 176.64 3h3f h VAL 255 N 0.98 1.28 0.00 2.23 2.07 0.15 -2.83 116.25 120.13 3h3f h VAL 255 Ca 0.39 -1.77 -0.04 0.00 0.82 0.00 0.00 66.70 66.09 3h3f h VAL 255 Cb 0.19 1.69 -0.01 0.00 -1.52 0.00 0.00 31.29 31.65 3h3f h VAL 255 CO -0.18 0.57 -0.21 0.00 0.02 0.00 0.00 177.57 177.77 3h3f h ALA 256 N 0.70 1.41 -0.16 1.67 0.00 0.03 0.01 119.26 122.93 3h3f h ALA 256 Ca 0.00 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 54.72 3h3f h ALA 256 Cb 1.19 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.93 3h3f h ALA 256 CO 0.13 0.27 0.09 0.22 0.00 0.00 0.00 179.25 179.95 3h3f h ASP 257 N 0.00 0.20 -0.23 0.00 3.58 -1.01 0.39 116.42 119.35 3h3f h ASP 257 Ca -0.00 -0.08 -0.18 0.00 0.42 0.00 0.00 57.03 57.19 3h3f h ASP 257 Cb 0.44 -0.05 -0.00 0.00 1.72 0.00 0.00 39.33 41.44 3h3f h ASP 257 CO 0.03 0.21 -0.56 -0.07 -2.88 0.00 0.00 179.24 175.98 3h3f h LEU 258 N 0.16 0.92 -0.39 2.28 3.38 -1.25 -2.57 115.31 117.84 3h3f h LEU 258 Ca 0.06 -0.50 0.06 0.00 0.09 0.00 0.00 57.88 57.59 3h3f h LEU 258 Cb 0.06 -0.27 -0.06 0.00 0.09 0.00 0.00 40.66 40.49 3h3f h LEU 258 CO -0.01 1.29 0.05 0.00 0.09 0.00 0.00 178.44 179.86 3h3f h ALA 259 N 0.73 0.39 -0.32 1.53 0.00 -0.84 -1.90 119.26 118.85 3h3f h ALA 259 Ca 0.01 0.09 0.07 0.00 0.00 0.00 0.00 54.91 55.08 3h3f h ALA 259 Cb 1.16 0.14 -0.08 0.00 0.00 0.00 0.00 17.79 19.01 3h3f h ALA 259 CO 0.12 -0.36 -0.24 1.49 0.00 0.00 0.00 179.25 180.26 3h3f h GLU 260 N 0.16 -0.20 -0.69 0.00 4.81 -0.72 -0.23 114.58 117.70 3h3f h GLU 260 Ca 0.19 0.01 0.14 0.00 -0.13 0.00 0.00 59.36 59.57 3h3f h GLU 260 Cb 0.24 0.05 -0.10 0.00 0.63 0.00 0.00 28.75 29.57 3h3f h GLU 260 CO -0.28 -0.14 0.18 0.77 -0.73 0.00 0.00 179.01 178.82 3h3f h SER 261 N -0.21 0.06 0.60 1.04 0.02 -1.15 -1.85 113.55 112.06 3h3f h SER 261 Ca 0.16 0.13 -0.03 0.00 -0.84 0.00 0.00 61.79 61.21 3h3f h SER 261 Cb 0.46 0.16 0.01 0.00 0.14 0.00 0.00 62.40 63.17 3h3f h SER 261 CO -0.44 0.01 -0.29 0.40 -1.14 0.00 0.00 176.83 175.37 3h3f h ILE 262 N 0.30 0.25 0.00 3.27 2.04 -0.92 0.17 117.51 122.62 3h3f h ILE 262 Ca 0.38 -0.33 -0.03 0.00 1.00 0.00 0.00 64.86 65.87 3h3f h ILE 262 Cb 0.60 0.34 -0.00 0.00 -0.74 0.00 0.00 36.82 37.01 3h3f h ILE 262 CO -0.45 0.03 -0.15 0.24 0.00 0.00 0.00 178.15 177.82 3h3f h MET 263 N -1.06 0.00 0.00 2.37 2.86 -1.06 -2.88 114.93 115.16 3h3f h MET 263 Ca -0.08 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.56 3h3f h MET 263 Cb 0.67 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.33 3h3f h MET 263 CO 0.13 0.15 -1.12 1.63 1.06 0.00 0.00 176.91 178.77 3h3f n LYS 264 N -3.68 1.39 -2.66 1.72 5.02 -0.70 -5.01 118.16 114.25 3h3f n LYS 264 Ca -0.02 -0.06 -0.08 0.00 -2.02 0.00 0.00 58.31 56.14 3h3f n LYS 264 Cb 0.27 -1.28 0.04 0.00 -0.02 0.00 0.00 35.03 34.05 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 -1.64 -2.03 -0.04 4.39 5.15 0.36 -4.94 115.26 116.51 3h3f n ASN 265 Ca 0.01 -0.29 -0.10 0.00 -0.60 0.00 0.00 54.58 53.60 3h3f n ASN 265 Cb 0.30 -2.63 0.04 0.00 -0.53 0.00 0.00 39.78 36.96 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 -0.87 0.75 -1.12 1.20 3.38 -1.02 -3.45 115.31 114.19 3h3f h LEU 266 Ca -0.27 -0.36 -0.21 0.00 0.09 0.00 0.00 57.88 57.13 3h3f h LEU 266 Cb 1.16 -0.21 0.08 0.00 0.09 0.00 0.00 40.66 41.77 3h3f h LEU 266 CO 0.23 1.09 -0.38 0.54 0.09 0.00 0.00 178.44 180.01 3h3f n ARG 267 N -4.02 -4.17 -2.27 1.13 1.74 -0.67 -5.03 116.66 103.37 3h3f n ARG 267 Ca -0.02 0.45 -0.28 0.00 -0.77 0.00 0.00 57.85 57.22 3h3f n ARG 267 Cb 0.56 -4.33 0.02 0.00 -1.02 0.00 0.00 32.46 27.69 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 -5.50 3.22 -0.27 5.56 0.52 -1.24 -4.66 118.95 116.58 3h3f s ARG 268 Ca 0.25 0.28 -0.12 0.00 -0.52 0.00 0.00 55.73 55.62 3h3f s ARG 268 Cb -0.11 -2.22 -0.05 0.00 0.52 0.00 0.00 34.95 33.09 3h3f s ARG 268 CO 0.40 -0.59 0.25 0.08 0.02 0.00 0.00 175.30 175.45 3h3f s VAL 269 N -3.02 5.27 0.17 3.52 1.01 -1.26 -1.38 120.40 124.72 3h3f s VAL 269 Ca 0.53 0.30 0.09 0.00 0.00 0.00 0.00 61.98 62.90 3h3f s VAL 269 Cb -0.11 -3.58 -0.04 0.00 0.00 0.00 0.00 36.38 32.65 3h3f s VAL 269 CO 0.48 0.23 -0.12 -1.00 0.00 0.00 0.00 175.10 174.69 3h3f s HIS 270 N 1.76 2.59 -0.94 5.22 0.09 -0.66 -4.81 115.29 118.55 3h3f s HIS 270 Ca 0.10 -0.24 -0.21 0.00 -0.00 0.00 0.00 55.06 54.71 3h3f s HIS 270 Cb -0.16 -1.28 0.09 0.00 -0.00 0.00 0.00 32.58 31.23 3h3f s HIS 270 CO 0.10 0.50 1.25 -1.25 -0.00 0.00 0.00 174.74 175.34 3h3f s PRO 271 N -2.73 3.54 0.37 8.40 0.04 -1.26 -0.33 135.00 143.03 3h3f s PRO 271 Ca 0.24 -1.37 0.05 0.00 0.04 0.00 0.00 61.00 59.95 3h3f s PRO 271 Cb -0.09 -5.02 -0.06 0.00 0.04 0.00 0.00 34.50 29.37 3h3f s PRO 271 CO 0.14 -1.97 0.04 0.96 0.04 0.00 0.00 177.00 176.21 3h3f s ILE 272 N 3.84 1.43 -0.34 0.56 -4.36 -0.80 -1.61 121.20 119.92 3h3f s ILE 272 Ca 0.37 -2.00 -0.15 0.00 -0.26 0.00 0.00 60.65 58.62 3h3f s ILE 272 Cb -0.04 -2.80 -0.01 0.00 1.25 0.00 0.00 42.46 40.86 3h3f s ILE 272 CO -0.07 0.00 0.33 -0.55 0.24 0.00 0.00 174.94 174.89 3h3f s SER 273 N -3.60 6.15 0.20 4.36 0.15 -0.57 -1.36 113.70 119.03 3h3f s SER 273 Ca 0.33 -0.29 -0.00 0.00 0.70 0.00 0.00 55.95 56.69 3h3f s SER 273 Cb 0.08 -2.18 -0.04 0.00 -1.71 0.00 0.00 66.02 62.17 3h3f s SER 273 CO 0.16 -0.31 0.09 0.28 1.20 0.00 0.00 173.24 174.66 3h3f s THR 274 N 1.94 0.22 -0.80 6.45 -1.32 -1.16 -1.79 115.64 119.17 3h3f s THR 274 Ca 0.10 -1.98 -0.25 0.00 -1.21 0.00 0.00 61.69 58.35 3h3f s THR 274 Cb -0.17 -2.40 0.04 0.00 -1.51 0.00 0.00 72.50 68.47 3h3f s THR 274 CO 0.11 -0.15 1.28 -0.32 -2.21 0.00 0.00 174.62 173.33 3h3f s MET 275 N -4.08 3.29 -0.39 7.08 1.75 -1.26 -1.38 119.30 124.30 3h3f s MET 275 Ca 0.34 -0.56 0.06 0.00 -1.25 0.00 0.00 55.69 54.28 3h3f s MET 275 Cb 0.07 -4.48 0.70 0.00 2.84 0.00 0.00 34.83 33.95 3h3f s MET 275 CO 0.09 -2.11 1.86 1.47 -0.65 0.00 0.00 175.02 175.68 3h3f n LEU 276 N 8.97 6.41 -4.74 4.11 -0.00 -1.14 -4.96 117.00 125.66 3h3f n LEU 276 Ca 0.10 -3.39 -0.42 0.00 -0.00 0.00 0.00 56.01 52.30 3h3f n LEU 276 Cb 0.49 -0.79 -0.02 0.00 -0.00 0.00 0.00 43.42 43.10 3h3f n LEU 276 CO 0.68 0.93 1.25 1.17 -0.00 0.00 0.00 177.39 181.42 3h3f n LYS 277 N -0.67 2.70 0.00 1.47 3.00 -1.26 -1.13 118.16 122.27 3h3f n LYS 277 Ca 0.51 0.96 0.00 0.00 -0.00 0.00 0.00 58.31 59.78 3h3f n LYS 277 Cb 1.53 -2.75 0.00 0.00 0.00 0.00 0.00 35.03 33.82 3h3f n LYS 277 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 3h3f n GLY 278 N 2.28 3.14 3.75 3.14 0.00 -0.09 -5.02 105.19 112.38 3h3f n GLY 278 Ca 0.09 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.87 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 3.58 -1.29 0.99 2.01 -0.28 -4.73 118.68 118.95 3h3f s LEU 279 Ca 0.00 -0.35 -0.04 0.00 0.01 0.00 0.00 54.13 53.75 3h3f s LEU 279 Cb 0.00 -2.14 0.00 0.00 0.01 0.00 0.00 46.19 44.07 3h3f s LEU 279 CO 0.00 0.01 0.47 -1.22 1.01 0.00 0.00 176.35 176.62 3h3f n TYR 280 N -0.80 -1.57 -3.23 0.29 4.02 -1.26 -3.16 117.16 111.45 3h3f n TYR 280 Ca -0.08 0.40 -0.16 0.00 -0.01 0.00 0.00 57.90 58.06 3h3f n TYR 280 Cb 0.57 -3.87 0.06 0.00 -0.02 0.00 0.00 39.34 36.08 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 -1.37 -0.11 2.95 2.72 0.00 -1.26 -4.86 105.19 103.26 3h3f n GLY 281 Ca -0.10 -0.03 -0.14 0.00 0.00 0.00 0.00 46.02 45.75 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 -3.23 -0.38 -0.24 -0.61 1.01 -1.19 -4.89 121.20 111.67 3h3f s ILE 282 Ca 0.34 0.24 0.02 0.00 0.00 0.00 0.00 60.65 61.25 3h3f s ILE 282 Cb -0.15 -0.45 0.04 0.00 0.01 0.00 0.00 42.46 41.90 3h3f s ILE 282 CO 0.51 0.08 0.79 0.29 0.00 0.00 0.00 174.94 176.62 3h3f n LYS 283 N 5.34 1.01 -4.08 2.79 4.76 -1.26 -0.91 118.16 125.81 3h3f n LYS 283 Ca -0.06 -1.09 -0.27 0.00 -2.87 0.00 0.00 58.31 54.02 3h3f n LYS 283 Cb 0.50 -1.05 -0.06 0.00 -1.84 0.00 0.00 35.03 32.58 3h3f n LYS 283 CO 0.00 0.00 0.00 -1.83 -1.37 0.00 0.00 177.40 174.20 3h3f s GLU 284 N -0.56 2.86 -0.95 1.97 1.03 -1.26 -4.84 118.70 116.95 3h3f s GLU 284 Ca 0.04 -0.83 -0.17 0.00 0.03 0.00 0.00 54.97 54.03 3h3f s GLU 284 Cb 0.02 -2.65 0.16 0.00 -0.80 0.00 0.00 34.13 30.86 3h3f s GLU 284 CO 0.03 0.51 1.09 0.16 -1.33 0.00 0.00 175.26 175.71 3h3f s ASP 285 N -2.88 6.74 0.20 0.83 3.84 -1.26 -4.21 116.67 119.92 3h3f s ASP 285 Ca 0.30 -2.35 0.11 0.00 -0.00 0.00 0.00 52.55 50.61 3h3f s ASP 285 Cb -0.11 -2.35 -0.04 0.00 -1.38 0.00 0.00 42.92 39.04 3h3f s ASP 285 CO 0.23 -0.90 -0.21 0.68 -0.00 0.00 0.00 175.17 174.97 3h3f s VAL 286 N 1.88 2.51 -0.10 2.11 -7.23 -1.26 -5.01 120.40 113.30 3h3f s VAL 286 Ca 0.31 -1.99 -0.11 0.00 -1.81 0.00 0.00 61.98 58.37 3h3f s VAL 286 Cb -0.06 -2.22 -0.05 0.00 0.56 0.00 0.00 36.38 34.62 3h3f s VAL 286 CO -0.08 -0.13 0.26 -0.36 -0.31 0.00 0.00 175.10 174.47 3h3f s PHE 287 N -1.73 3.58 0.05 2.82 2.99 -1.26 -2.88 117.98 121.55 3h3f s PHE 287 Ca 0.22 0.66 -0.26 0.00 0.00 0.00 0.00 56.93 57.56 3h3f s PHE 287 Cb -0.08 -2.17 0.06 0.00 0.00 0.00 0.00 43.02 40.84 3h3f s PHE 287 CO 0.11 0.54 0.61 -0.48 -0.00 0.00 0.00 175.22 176.00 3h3f s LEU 288 N -0.52 -0.46 0.11 -0.37 0.05 -0.48 -4.84 118.68 112.17 3h3f s LEU 288 Ca 0.17 0.32 -0.31 0.00 0.05 0.00 0.00 54.13 54.36 3h3f s LEU 288 Cb -0.14 2.44 -0.08 0.00 -2.05 0.00 0.00 46.19 46.36 3h3f s LEU 288 CO 0.06 -0.76 1.50 -0.44 -0.55 0.00 0.00 176.35 176.16 3h3f s SER 289 N -1.94 6.70 0.11 1.48 0.01 -0.61 -3.00 113.70 116.46 3h3f s SER 289 Ca -0.05 2.43 -0.11 0.00 1.31 0.00 0.00 55.95 59.52 3h3f s SER 289 Cb -0.01 -2.58 0.01 0.00 0.21 0.00 0.00 66.02 63.65 3h3f s SER 289 CO -0.01 -0.76 0.27 0.54 0.41 0.00 0.00 173.24 173.69 3h3f s VAL 290 N 1.56 0.11 -0.05 3.43 0.11 -0.46 -1.57 120.40 123.53 3h3f s VAL 290 Ca 0.68 -0.99 -0.30 0.00 -2.93 0.00 0.00 61.98 58.45 3h3f s VAL 290 Cb -0.39 -1.32 -0.05 0.00 -1.53 0.00 0.00 36.38 33.10 3h3f s VAL 290 CO 0.30 -0.51 1.44 -2.84 -3.33 0.00 0.00 175.10 170.16 3h3f s PRO 291 N -3.85 4.24 -0.06 1.54 0.02 -1.26 -1.91 135.00 133.72 3h3f s PRO 291 Ca 0.05 1.96 0.04 0.00 0.02 0.00 0.00 61.00 63.07 3h3f s PRO 291 Cb 0.04 -3.73 -0.00 0.00 0.02 0.00 0.00 34.50 30.83 3h3f s PRO 291 CO -0.11 -0.68 -0.20 0.00 -0.33 0.00 0.00 177.00 175.69 3h3f s VAL 293 N 0.17 4.33 -0.20 0.00 1.01 -0.33 -1.65 120.40 123.73 3h3f s VAL 293 Ca -0.09 1.63 -0.02 0.00 0.00 0.00 0.00 61.98 63.50 3h3f s VAL 293 Cb -0.14 -4.05 0.00 0.00 0.00 0.00 0.00 36.38 32.19 3h3f s VAL 293 CO 0.04 -0.08 -0.12 -0.22 0.00 0.00 0.00 175.10 174.73 3h3f s LEU 294 N 2.87 2.54 0.00 3.92 2.96 -0.48 -1.17 118.68 129.32 3h3f s LEU 294 Ca 0.54 -0.51 0.00 0.00 -0.22 0.00 0.00 54.13 53.94 3h3f s LEU 294 Cb -0.22 -1.62 0.00 0.00 0.50 0.00 0.00 46.19 44.85 3h3f s LEU 294 CO 0.17 -0.01 0.00 0.61 -1.32 0.00 0.00 176.35 175.81 3h3f n GLY 295 N 4.68 4.71 0.20 7.98 0.00 -0.22 -1.67 105.19 120.87 3h3f n GLY 295 Ca -0.19 -1.18 0.13 0.00 0.00 0.00 0.00 46.02 44.78 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 -0.87 1.61 3.07 -1.78 -1.72 115.11 115.42 3h3f h GLN 296 Ca 0.00 0.00 -0.26 0.00 0.09 0.00 0.00 58.65 58.48 3h3f h GLN 296 Cb 0.00 0.00 -0.16 0.00 0.08 0.00 0.00 27.48 27.40 3h3f h GLN 296 CO 0.00 0.00 0.33 0.09 0.09 0.00 0.00 178.83 179.34 3h3f n ASN 297 N -2.86 4.12 0.00 0.06 5.03 -1.26 -5.01 115.26 115.34 3h3f n ASN 297 Ca 0.03 -3.10 0.00 0.00 0.87 0.00 0.00 54.58 52.38 3h3f n ASN 297 Cb 0.44 -0.73 0.00 0.00 -1.02 0.00 0.00 39.78 38.47 3h3f n ASN 297 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 3h3f n GLY 298 N -0.32 0.00 3.65 7.41 0.00 -0.65 -4.50 105.19 110.79 3h3f n GLY 298 Ca 0.39 -1.07 -0.43 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 4.72 -0.20 -0.61 1.01 -0.75 -1.05 121.20 124.32 3h3f s ILE 299 Ca 0.00 1.87 0.09 0.00 0.00 0.00 0.00 60.65 62.62 3h3f s ILE 299 Cb 0.00 -4.26 -0.13 0.00 0.01 0.00 0.00 42.46 38.08 3h3f s ILE 299 CO 0.00 -0.17 0.29 -1.54 0.00 0.00 0.00 174.94 173.53 3h3f n SER 300 N 6.26 1.75 -3.69 3.58 3.41 -0.32 -4.59 113.62 120.02 3h3f n SER 300 Ca 0.10 -0.32 -0.10 0.00 -0.26 0.00 0.00 58.87 58.28 3h3f n SER 300 Cb 0.46 1.24 -0.06 0.00 -0.26 0.00 0.00 64.21 65.60 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 -2.55 -0.15 0.03 4.04 1.11 -1.26 -5.00 116.67 112.89 3h3f s ASP 301 Ca -0.00 -0.34 0.06 0.00 0.18 0.00 0.00 52.55 52.44 3h3f s ASP 301 Cb 0.07 0.43 -0.02 0.00 1.07 0.00 0.00 42.92 44.46 3h3f s ASP 301 CO 0.39 -0.78 -0.17 -0.69 1.18 0.00 0.00 175.17 175.10 3h3f s VAL 302 N -3.55 1.32 -0.08 -1.27 1.01 -1.26 -1.19 120.40 115.38 3h3f s VAL 302 Ca 0.02 -1.01 -0.17 0.00 0.00 0.00 0.00 61.98 60.82 3h3f s VAL 302 Cb 0.02 -1.16 -0.05 0.00 0.00 0.00 0.00 36.38 35.19 3h3f s VAL 302 CO -0.10 0.13 0.44 -0.69 0.00 0.00 0.00 175.10 174.89 3h3f s VAL 303 N -0.75 5.13 -0.50 2.92 1.01 0.32 -4.97 120.40 123.56 3h3f s VAL 303 Ca 0.04 0.89 -0.23 0.00 0.00 0.00 0.00 61.98 62.68 3h3f s VAL 303 Cb -0.08 -3.77 0.04 0.00 0.00 0.00 0.00 36.38 32.57 3h3f s VAL 303 CO 0.01 0.41 0.85 -0.54 0.00 0.00 0.00 175.10 175.84 3h3f s LYS 304 N 0.05 3.35 0.11 2.72 3.01 -1.26 -4.50 119.74 123.21 3h3f s LYS 304 Ca 0.24 -0.24 -0.16 0.00 -1.01 0.00 0.00 55.97 54.80 3h3f s LYS 304 Cb -0.16 -4.01 -0.07 0.00 -1.01 0.00 0.00 37.83 32.59 3h3f s LYS 304 CO 0.11 -1.31 0.54 0.08 0.51 0.00 0.00 175.35 175.28 3h3f s VAL 305 N 3.57 4.83 -0.59 3.17 1.01 -1.26 -5.02 120.40 126.10 3h3f s VAL 305 Ca 0.29 0.98 -0.24 0.00 0.00 0.00 0.00 61.98 63.00 3h3f s VAL 305 Cb -0.13 -3.79 0.05 0.00 0.00 0.00 0.00 36.38 32.50 3h3f s VAL 305 CO 0.20 0.39 0.98 -0.89 0.00 0.00 0.00 175.10 175.78 3h3f s THR 306 N -1.30 4.31 0.09 3.92 2.01 -1.26 -5.02 115.64 118.39 3h3f s THR 306 Ca 0.33 0.18 0.02 0.00 0.31 0.00 0.00 61.69 62.53 3h3f s THR 306 Cb -0.17 -4.61 -0.04 0.00 0.01 0.00 0.00 72.50 67.70 3h3f s THR 306 CO 0.19 -1.25 0.17 -0.76 -0.69 0.00 0.00 174.62 172.27 3h3f s LEU 307 N 4.15 4.12 0.00 4.42 1.43 -1.26 -5.00 118.68 126.54 3h3f s LEU 307 Ca 0.29 0.13 -0.03 0.00 -1.03 0.00 0.00 54.13 53.49 3h3f s LEU 307 Cb -0.13 -2.75 0.05 0.00 0.03 0.00 0.00 46.19 43.39 3h3f s LEU 307 CO 0.17 0.15 0.17 0.35 0.23 0.00 0.00 176.35 177.42 3h3f n THR 308 N 0.19 0.00 -0.03 5.49 -2.24 -1.26 -4.61 114.28 111.82 3h3f n THR 308 Ca -0.07 -0.07 -0.12 0.00 -2.27 0.00 0.00 64.05 61.52 3h3f n THR 308 Cb 0.52 -0.93 -0.07 0.00 -2.10 0.00 0.00 70.33 67.75 3h3f n THR 308 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 3h3f h SER 309 N -1.40 0.18 0.35 3.42 4.64 -1.99 -0.49 113.55 118.26 3h3f h SER 309 Ca -0.07 -0.37 -0.02 0.00 -0.47 0.00 0.00 61.79 60.87 3h3f h SER 309 Cb 0.20 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 62.24 3h3f h SER 309 CO 0.04 0.51 -0.17 -0.08 -0.87 0.00 0.00 176.83 176.27 3h3f h GLU 310 N -0.15 -0.45 0.16 4.77 4.81 -1.97 0.63 114.58 122.38 3h3f h GLU 310 Ca 0.02 0.03 0.01 0.00 -0.13 0.00 0.00 59.36 59.30 3h3f h GLU 310 Cb 0.43 0.10 -0.04 0.00 0.63 0.00 0.00 28.75 29.87 3h3f h GLU 310 CO 0.01 -0.13 -0.46 0.93 -0.73 0.00 0.00 179.01 178.63 3h3f h GLU 311 N -0.83 -0.69 -0.85 1.92 5.08 -1.93 0.37 114.58 117.64 3h3f h GLU 311 Ca -0.05 0.05 0.22 0.00 -1.00 0.00 0.00 59.36 58.57 3h3f h GLU 311 Cb 0.53 0.16 -0.05 0.00 0.50 0.00 0.00 28.75 29.88 3h3f h GLU 311 CO 0.08 -0.46 0.58 1.49 -1.00 0.00 0.00 179.01 179.70 3h3f h GLU 312 N -0.72 0.21 0.51 2.33 4.81 -1.13 -2.41 114.58 118.18 3h3f h GLU 312 Ca 0.01 -0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 59.20 3h3f h GLU 312 Cb 0.72 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 30.06 3h3f h GLU 312 CO -0.23 0.14 -0.24 0.00 -0.73 0.00 0.00 179.01 177.94 3h3f h ALA 313 N 1.61 -0.68 -0.24 2.92 0.00 0.42 -3.30 119.26 119.99 3h3f h ALA 313 Ca 0.43 -0.19 0.06 0.00 0.00 0.00 0.00 54.91 55.21 3h3f h ALA 313 Cb 1.33 0.26 -0.06 0.00 0.00 0.00 0.00 17.79 19.32 3h3f h ALA 313 CO -0.10 -0.79 -0.17 0.45 0.00 0.00 0.00 179.25 178.64 3h3f h HIS 314 N -0.87 -0.44 -0.57 0.00 3.86 -0.46 -2.85 115.15 113.83 3h3f h HIS 314 Ca -0.07 0.03 0.06 0.00 -1.16 0.00 0.00 60.37 59.23 3h3f h HIS 314 Cb 0.59 0.23 -0.08 0.00 1.06 0.00 0.00 27.41 29.22 3h3f h HIS 314 CO -0.01 -0.25 -0.45 -0.07 0.86 0.00 0.00 177.93 178.02 3h3f h LEU 315 N -0.17 -1.58 -1.21 2.43 3.38 -1.61 1.52 115.31 118.07 3h3f h LEU 315 Ca 0.14 0.23 0.00 0.00 0.09 0.00 0.00 57.88 58.33 3h3f h LEU 315 Cb 0.37 0.68 0.00 0.00 0.09 0.00 0.00 40.66 41.80 3h3f h LEU 315 CO -0.34 -0.24 0.00 1.17 0.09 0.00 0.00 178.44 179.12 3h3f n LYS 316 N -4.76 0.16 -0.08 1.13 4.81 -1.09 0.27 118.16 118.60 3h3f n LYS 316 Ca -0.00 0.57 -0.13 0.00 -0.87 0.00 0.00 58.31 57.87 3h3f n LYS 316 Cb 0.23 -1.94 -0.09 0.00 0.02 0.00 0.00 35.03 33.25 3h3f n LYS 316 CO 0.00 0.00 0.00 -0.22 1.17 0.00 0.00 177.40 178.35 3h3f h LYS 317 N 0.00 0.00 -0.95 1.64 3.64 0.97 -2.44 116.57 119.44 3h3f h LYS 317 Ca 0.00 0.00 0.13 0.00 -1.27 0.00 0.00 60.65 59.51 3h3f h LYS 317 Cb 0.13 0.00 -0.14 0.00 -0.41 0.00 0.00 32.23 31.80 3h3f h LYS 317 CO 0.00 0.74 -0.45 1.03 -2.27 0.00 0.00 179.45 178.50 3h3f h SER 318 N -1.00 -1.64 0.00 4.20 0.87 0.26 0.11 113.55 116.35 3h3f h SER 318 Ca -0.11 0.31 0.00 0.00 -1.23 0.00 0.00 61.79 60.76 3h3f h SER 318 Cb 0.88 0.80 0.00 0.00 -0.44 0.00 0.00 62.40 63.65 3h3f h SER 318 CO -0.06 -0.28 0.04 0.00 -0.53 0.00 0.00 176.83 175.99 3h3f n ALA 319 N -3.37 0.98 -0.04 6.23 0.00 0.76 -3.05 120.51 122.01 3h3f n ALA 319 Ca 0.07 0.14 -0.03 0.00 0.00 0.00 0.00 53.44 53.63 3h3f n ALA 319 Cb 0.36 -1.17 -0.07 0.00 0.00 0.00 0.00 19.45 18.56 3h3f n ALA 319 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 3h3f n ASP 320 N -2.04 2.80 0.00 0.00 10.43 -0.08 -2.99 116.55 124.66 3h3f n ASP 320 Ca -0.01 0.00 0.00 0.00 2.57 0.00 0.00 54.79 57.35 3h3f n ASP 320 Cb 0.06 0.85 0.00 0.00 1.84 0.00 0.00 41.12 43.87 3h3f n ASP 320 CO 0.00 0.00 0.00 0.41 -1.07 0.00 0.00 177.20 176.54 3h3f n THR 321 N -2.24 0.00 -0.08 -3.53 -1.04 -0.55 0.12 114.28 106.96 3h3f n THR 321 Ca -0.12 1.36 0.18 0.00 -2.04 0.00 0.00 64.05 63.42 3h3f n THR 321 Cb 0.69 -1.83 0.59 0.00 -1.82 0.00 0.00 70.33 67.96 3h3f n THR 321 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 3h3f h LEU 322 N 0.00 0.21 0.65 -4.42 3.38 -1.73 -1.50 115.31 111.90 3h3f h LEU 322 Ca 0.00 0.01 -0.03 0.00 0.09 0.00 0.00 57.88 57.95 3h3f h LEU 322 Cb 0.00 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 40.72 3h3f h LEU 322 CO 0.00 0.11 -0.35 -0.25 0.09 0.00 0.00 178.44 178.04 3h3f h TRP 323 N 0.22 -0.93 0.00 1.13 -0.00 -1.20 -2.96 115.95 112.21 3h3f h TRP 323 Ca 0.31 -0.02 0.00 0.00 -0.00 0.00 0.00 58.89 59.19 3h3f h TRP 323 Cb 0.92 0.32 0.00 0.00 -0.00 0.00 0.00 29.16 30.40 3h3f h TRP 323 CO -0.00 -0.55 0.07 0.78 -0.00 0.00 0.00 178.44 178.75 3h3f h GLY 324 N -0.92 0.00 -2.72 2.65 0.00 0.75 0.56 103.07 103.39 3h3f h GLY 324 Ca -0.09 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.24 3h3f h GLY 324 CO 0.12 0.00 0.00 1.39 0.00 0.00 0.00 176.54 178.05 3h3f n ILE 325 N -2.52 1.19 0.01 2.60 5.41 -1.07 -4.71 119.36 120.27 3h3f n ILE 325 Ca -0.02 -1.05 0.00 0.00 1.00 0.00 0.00 62.75 62.68 3h3f n ILE 325 Cb 0.12 0.42 0.00 0.00 -0.71 0.00 0.00 39.64 39.46 3h3f n ILE 325 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3h3f n GLN 326 N 1.48 0.00 0.00 0.38 6.02 0.20 -4.69 117.38 120.77 3h3f n GLN 326 Ca 0.24 0.00 0.12 0.00 -0.01 0.00 0.00 57.00 57.35 3h3f n GLN 326 Cb 0.68 -0.49 0.60 0.00 1.02 0.00 0.00 30.24 32.05 3h3f n GLN 326 CO 0.00 0.00 0.00 0.36 -1.01 0.00 0.00 177.06 176.41 3h3f n LYS 327 N -3.09 0.29 -0.74 -1.09 0.00 -1.24 -3.29 118.16 109.00 3h3f n LYS 327 Ca 0.00 0.06 -0.11 0.00 -0.00 0.00 0.00 58.31 58.26 3h3f n LYS 327 Cb 0.39 -1.50 0.03 0.00 -0.00 0.00 0.00 35.03 33.95 3h3f n LYS 327 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.40 177.79 3h3f n GLU 328 N -1.33 1.53 -4.58 -1.58 -0.58 -1.26 -4.94 120.64 107.90 3h3f n GLU 328 Ca 0.11 -1.04 -0.24 0.00 -0.42 0.00 0.00 57.16 55.56 3h3f n GLU 328 Cb 0.21 -1.41 -0.16 0.00 -0.57 0.00 0.00 31.44 29.51 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 -1.21 1.68 -0.81 -4.62 1.02 -1.21 -5.08 118.68 108.46 3h3f s LEU 329 Ca 0.21 -0.29 -0.18 0.00 0.02 0.00 0.00 54.13 53.89 3h3f s LEU 329 Cb 0.16 -0.80 0.14 0.00 0.02 0.00 0.00 46.19 45.72 3h3f s LEU 329 CO -0.00 0.05 0.92 -1.10 0.02 0.00 0.00 176.35 176.24 3h3f s GLN 330 N 0.56 3.44 0.00 1.70 -0.21 -1.26 -5.15 119.66 118.74 3h3f s GLN 330 Ca -0.12 -1.79 0.00 0.00 0.02 0.00 0.00 55.36 53.46 3h3f s GLN 330 Cb -0.15 -4.60 0.00 0.00 1.00 0.00 0.00 33.01 29.27 3h3f s GLN 330 CO 0.03 -1.59 0.00 1.97 -2.12 0.00 0.00 175.29 173.58