#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 1.92 0.25 0.00 0.00 -1.26 -4.86 121.76 117.81 3h3f s ALA 2 Ca 0.00 0.64 -0.03 0.00 0.00 0.00 0.00 51.96 52.57 3h3f s ALA 2 Cb 0.00 -3.42 0.50 0.00 0.00 0.00 0.00 23.12 20.21 3h3f s ALA 2 CO 0.00 -2.16 1.70 1.25 0.00 0.00 0.00 175.76 176.55 3h3f h LEU 3 N -1.03 0.15 -1.62 0.00 5.85 -2.04 -0.41 115.31 116.21 3h3f h LEU 3 Ca -0.45 0.14 -0.01 0.00 0.84 0.00 0.00 57.88 58.39 3h3f h LEU 3 Cb 1.27 0.15 -0.01 0.00 0.37 0.00 0.00 40.66 42.44 3h3f h LEU 3 CO 0.47 0.01 0.13 0.50 -0.34 0.00 0.00 178.44 179.21 3h3f h LYS 4 N 0.35 0.38 0.08 1.25 3.64 -1.97 -2.77 116.57 117.53 3h3f h LYS 4 Ca 0.44 -0.04 -0.25 0.00 -1.27 0.00 0.00 60.65 59.53 3h3f h LYS 4 Cb 0.74 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 32.48 3h3f h LYS 4 CO -0.48 0.30 -1.16 -0.44 -2.27 0.00 0.00 179.45 175.40 3h3f h ASP 5 N 0.38 0.28 0.48 4.20 3.45 -1.35 0.62 116.42 124.48 3h3f h ASP 5 Ca 0.10 -0.30 0.00 0.00 0.43 0.00 0.00 57.03 57.26 3h3f h ASP 5 Cb 0.06 -0.09 0.00 0.00 -0.56 0.00 0.00 39.33 38.73 3h3f h ASP 5 CO -0.01 1.23 0.00 0.00 -1.57 0.00 0.00 179.24 178.89 3h3f n GLN 6 N -3.47 0.16 -0.06 3.56 6.02 -0.87 -3.97 117.38 118.75 3h3f n GLN 6 Ca -0.06 0.47 -0.12 0.00 -0.01 0.00 0.00 57.00 57.29 3h3f n GLN 6 Cb 1.00 -1.85 -0.05 0.00 1.02 0.00 0.00 30.24 30.36 3h3f n GLN 6 CO 0.00 0.00 0.00 -0.11 -1.01 0.00 0.00 177.06 175.94 3h3f n LEU 7 N -2.15 1.26 -4.29 1.08 7.94 -1.00 -4.90 117.00 114.93 3h3f n LEU 7 Ca 0.01 0.11 -0.37 0.00 -1.11 0.00 0.00 56.01 54.65 3h3f n LEU 7 Cb 0.16 -0.37 -0.13 0.00 0.53 0.00 0.00 43.42 43.62 3h3f n LEU 7 CO 0.16 0.34 -0.28 -0.63 -1.11 0.00 0.00 177.39 175.87 3h3f s ILE 8 N -2.22 3.77 -0.37 1.96 1.09 0.18 -5.05 121.20 120.55 3h3f s ILE 8 Ca -0.17 -0.96 -0.26 0.00 -1.10 0.00 0.00 60.65 58.16 3h3f s ILE 8 Cb 0.06 -3.05 0.02 0.00 -1.06 0.00 0.00 42.46 38.43 3h3f s ILE 8 CO 0.22 -0.05 0.94 -2.28 -0.10 0.00 0.00 174.94 173.68 3h3f s HIS 9 N 1.43 3.06 0.68 3.97 2.46 -1.26 -4.62 115.29 121.02 3h3f s HIS 9 Ca 0.00 0.77 -0.11 0.00 0.47 0.00 0.00 55.06 56.19 3h3f s HIS 9 Cb -0.18 -3.70 -0.00 0.00 -0.13 0.00 0.00 32.58 28.57 3h3f s HIS 9 CO 0.02 -0.85 1.08 1.21 -2.47 0.00 0.00 174.74 173.72 3h3f s ASN 10 N 1.91 5.67 0.00 9.88 3.04 -1.26 -5.01 114.94 129.17 3h3f s ASN 10 Ca 0.39 1.23 0.00 0.00 0.04 0.00 0.00 52.86 54.52 3h3f s ASN 10 Cb -0.12 -2.10 0.00 0.00 -1.54 0.00 0.00 41.25 37.49 3h3f s ASN 10 CO 0.19 -1.21 0.00 0.18 -3.04 0.00 0.00 177.10 173.23 3h3f n LEU 11 N -2.94 0.00 -3.73 3.21 4.77 -1.26 -5.11 117.00 111.94 3h3f n LEU 11 Ca 0.07 0.00 -0.12 0.00 -0.03 0.00 0.00 56.01 55.92 3h3f n LEU 11 Cb 0.56 0.00 -0.13 0.00 -2.33 0.00 0.00 43.42 41.52 3h3f n LEU 11 CO 0.58 0.12 -0.13 -0.22 -1.33 0.00 0.00 177.39 176.41 3h3f s LEU 12 N 0.00 0.42 -0.06 2.23 2.96 -1.26 -5.13 118.68 117.84 3h3f s LEU 12 Ca 0.00 0.51 -0.29 0.00 -0.22 0.00 0.00 54.13 54.14 3h3f s LEU 12 Cb 0.00 0.72 -0.02 0.00 0.50 0.00 0.00 46.19 47.39 3h3f s LEU 12 CO 0.00 -0.17 0.95 -1.59 -1.32 0.00 0.00 176.35 174.22 3h3f s LYS 13 N 1.26 4.48 -0.47 1.98 0.00 -1.26 -4.98 119.74 120.75 3h3f s LYS 13 Ca -0.09 1.32 -0.22 0.00 0.00 0.00 0.00 55.97 56.98 3h3f s LYS 13 Cb -0.10 -3.50 0.03 0.00 0.00 0.00 0.00 37.83 34.26 3h3f s LYS 13 CO -0.08 -0.15 0.76 -1.21 0.00 0.00 0.00 175.35 174.66 3h3f s GLU 14 N 1.43 3.33 0.42 1.78 0.41 -1.26 -5.03 118.70 119.78 3h3f s GLU 14 Ca 0.48 -0.27 0.06 0.00 -0.41 0.00 0.00 54.97 54.83 3h3f s GLU 14 Cb -0.19 -3.97 -0.07 0.00 -1.78 0.00 0.00 34.13 28.11 3h3f s GLU 14 CO 0.22 -1.15 0.01 -1.83 -0.49 0.00 0.00 175.26 172.02 3h3f s GLU 15 N 3.20 1.97 -0.03 1.61 1.03 -1.26 -5.16 118.70 120.06 3h3f s GLU 15 Ca 0.27 -2.13 0.00 0.00 0.03 0.00 0.00 54.97 53.13 3h3f s GLU 15 Cb -0.13 -1.56 0.03 0.00 -0.80 0.00 0.00 34.13 31.66 3h3f s GLU 15 CO 0.20 -0.10 0.02 -1.01 -1.33 0.00 0.00 175.26 173.04 3h3f s HIS 16 N -2.78 0.17 -0.06 4.83 0.09 -1.26 -5.11 115.29 111.17 3h3f s HIS 16 Ca 0.31 0.07 0.02 0.00 -0.00 0.00 0.00 55.06 55.47 3h3f s HIS 16 Cb 0.09 -0.34 0.02 0.00 -0.00 0.00 0.00 32.58 32.34 3h3f s HIS 16 CO 0.16 -0.12 -0.10 0.54 -0.00 0.00 0.00 174.74 175.22 3h3f s VAL 17 N 1.14 0.99 0.14 -0.90 0.11 -1.26 -5.10 120.40 115.52 3h3f s VAL 17 Ca -0.08 -0.39 -0.28 0.00 -2.93 0.00 0.00 61.98 58.31 3h3f s VAL 17 Cb -0.13 -0.93 -0.07 0.00 -1.53 0.00 0.00 36.38 33.72 3h3f s VAL 17 CO -0.02 0.32 0.86 -2.16 -3.33 0.00 0.00 175.10 170.77 3h3f s PRO 18 N 0.77 4.66 -0.14 1.54 0.05 -1.26 -4.89 135.00 135.73 3h3f s PRO 18 Ca -0.13 1.30 0.14 0.00 0.05 0.00 0.00 61.00 62.36 3h3f s PRO 18 Cb -0.15 -3.32 -0.24 0.00 0.05 0.00 0.00 34.50 30.84 3h3f s PRO 18 CO 0.02 0.39 0.31 0.94 0.05 0.00 0.00 177.00 178.72 3h3f n GLN 19 N 2.19 0.67 -3.35 4.56 -0.06 -1.26 -4.68 117.38 115.45 3h3f n GLN 19 Ca -0.02 0.13 -0.26 0.00 -2.00 0.00 0.00 57.00 54.85 3h3f n GLN 19 Cb 0.49 -1.64 -0.09 0.00 -4.06 0.00 0.00 30.24 24.94 3h3f n GLN 19 CO 0.00 0.00 0.00 0.09 -0.20 0.00 0.00 177.06 176.95 3h3f n ASN 20 N -2.91 0.18 -4.73 1.69 4.13 -1.26 -4.94 115.26 107.41 3h3f n ASN 20 Ca -0.27 -2.59 -0.35 0.00 1.68 0.00 0.00 54.58 53.05 3h3f n ASN 20 Cb 1.11 -0.60 -0.08 0.00 -1.54 0.00 0.00 39.78 38.66 3h3f n ASN 20 CO 0.00 0.00 0.00 -0.75 0.28 0.00 0.00 177.26 176.79 3h3f s LYS 21 N -0.62 3.90 0.00 3.52 2.20 -1.26 -1.36 119.74 126.12 3h3f s LYS 21 Ca 0.34 -0.24 0.05 0.00 -0.36 0.00 0.00 55.97 55.75 3h3f s LYS 21 Cb 0.09 -3.28 -0.03 0.00 -1.51 0.00 0.00 37.83 33.10 3h3f s LYS 21 CO -0.16 0.42 -0.13 0.42 -0.36 0.00 0.00 175.35 175.55 3h3f s ILE 22 N -0.02 3.16 -0.10 5.43 1.01 -0.77 -0.01 121.20 129.89 3h3f s ILE 22 Ca 0.08 -0.91 0.04 0.00 0.00 0.00 0.00 60.65 59.86 3h3f s ILE 22 Cb -0.12 -2.32 0.00 0.00 0.01 0.00 0.00 42.46 40.03 3h3f s ILE 22 CO 0.00 0.43 -0.24 -0.89 0.00 0.00 0.00 174.94 174.25 3h3f s THR 23 N -0.89 2.09 -0.24 2.92 2.01 -0.07 -1.12 115.64 120.33 3h3f s THR 23 Ca 0.15 -1.01 -0.09 0.00 0.31 0.00 0.00 61.69 61.05 3h3f s THR 23 Cb -0.11 -1.80 -0.04 0.00 0.01 0.00 0.00 72.50 70.56 3h3f s THR 23 CO 0.05 0.56 0.12 -0.69 -0.69 0.00 0.00 174.62 173.96 3h3f s VAL 24 N 0.38 4.94 -0.28 3.82 1.01 -0.20 0.12 120.40 130.19 3h3f s VAL 24 Ca -0.18 0.04 -0.10 0.00 0.00 0.00 0.00 61.98 61.73 3h3f s VAL 24 Cb -0.18 -3.30 -0.05 0.00 0.00 0.00 0.00 36.38 32.86 3h3f s VAL 24 CO 0.08 0.35 0.17 -0.69 0.00 0.00 0.00 175.10 175.01 3h3f s VAL 25 N 1.20 5.15 0.00 2.92 1.01 0.22 -2.16 120.40 128.75 3h3f s VAL 25 Ca 0.06 0.10 0.00 0.00 0.00 0.00 0.00 61.98 62.14 3h3f s VAL 25 Cb -0.14 -3.46 0.00 0.00 0.00 0.00 0.00 36.38 32.78 3h3f s VAL 25 CO 0.05 0.25 0.00 0.61 0.00 0.00 0.00 175.10 176.01 3h3f n GLY 26 N 5.04 -0.32 2.10 4.51 0.00 0.21 -0.85 105.19 115.88 3h3f n GLY 26 Ca -0.14 -0.92 -0.26 0.00 0.00 0.00 0.00 46.02 44.70 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 2.05 2.69 -0.04 1.61 0.24 -1.26 -3.90 118.33 119.73 3h3f n VAL 27 Ca 0.00 -4.08 0.00 0.00 -2.04 0.00 0.00 64.34 58.22 3h3f n VAL 27 Cb 0.00 -1.15 0.00 0.00 -1.47 0.00 0.00 33.84 31.22 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 -0.73 -0.28 0.22 7.63 0.00 -1.26 -4.55 105.19 106.22 3h3f n GLY 28 Ca 0.47 -1.60 -0.15 0.00 0.00 0.00 0.00 46.02 44.73 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 -1.98 -0.46 -0.26 4.61 0.00 -1.95 -0.53 119.26 118.69 3h3f h ALA 29 Ca 0.00 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 54.81 3h3f h ALA 29 Cb 0.00 0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 3h3f h ALA 29 CO 0.00 -0.76 0.15 0.28 0.00 0.00 0.00 179.25 178.92 3h3f h VAL 30 N -0.46 1.11 -0.91 0.00 2.07 -1.86 -1.52 116.25 114.67 3h3f h VAL 30 Ca -0.04 -0.26 -0.01 0.00 0.82 0.00 0.00 66.70 67.21 3h3f h VAL 30 Cb 0.37 0.80 -0.04 0.00 -1.52 0.00 0.00 31.29 30.90 3h3f h VAL 30 CO 0.05 0.10 0.54 1.23 0.02 0.00 0.00 177.57 179.51 3h3f h GLY 31 N 0.33 1.34 1.37 2.17 0.00 -1.62 -0.83 103.07 105.82 3h3f h GLY 31 Ca 0.09 -0.57 -0.16 0.00 0.00 0.00 0.00 47.33 46.69 3h3f h GLY 31 CO -0.02 0.55 -0.50 -0.33 0.00 0.00 0.00 176.54 176.25 3h3f h MET 32 N 1.27 0.67 -0.42 4.80 0.00 -1.06 -1.29 114.93 118.90 3h3f h MET 32 Ca 0.33 -0.40 -0.06 0.00 0.00 0.00 0.00 59.70 59.57 3h3f h MET 32 Cb -0.03 0.03 -0.02 0.00 0.00 0.00 0.00 31.60 31.58 3h3f h MET 32 CO -0.06 1.01 0.01 0.00 0.00 0.00 0.00 176.91 177.88 3h3f h ALA 33 N 0.92 1.23 -0.36 6.32 0.00 -0.80 -1.49 119.26 125.08 3h3f h ALA 33 Ca 0.02 -0.23 -0.08 0.00 0.00 0.00 0.00 54.91 54.62 3h3f h ALA 33 Cb 1.05 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.65 3h3f h ALA 33 CO 0.10 0.51 -0.09 0.00 0.00 0.00 0.00 179.25 179.78 3h3f h ALA 35 N 0.82 -0.22 -0.87 0.00 0.00 -0.92 -1.00 119.26 117.07 3h3f h ALA 35 Ca 0.09 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.97 3h3f h ALA 35 Cb 0.60 0.27 -0.04 0.00 0.00 0.00 0.00 17.79 18.62 3h3f h ALA 35 CO 0.04 -0.67 0.46 0.97 0.00 0.00 0.00 179.25 180.05 3h3f h ILE 36 N -0.29 1.26 -0.24 0.00 6.09 -1.31 -0.51 117.51 122.52 3h3f h ILE 36 Ca 0.04 -0.67 -0.15 0.00 -1.37 0.00 0.00 64.86 62.71 3h3f h ILE 36 Cb 0.34 0.10 -0.01 0.00 0.47 0.00 0.00 36.82 37.72 3h3f h ILE 36 CO -0.13 0.30 -0.46 0.28 -3.07 0.00 0.00 178.15 175.06 3h3f h SER 37 N 1.23 0.68 -0.51 2.19 0.02 -1.49 -1.24 113.55 114.42 3h3f h SER 37 Ca 0.30 -0.33 -0.04 0.00 -0.84 0.00 0.00 61.79 60.88 3h3f h SER 37 Cb 0.06 -0.19 -0.02 0.00 0.14 0.00 0.00 62.40 62.39 3h3f h SER 37 CO -0.05 1.04 0.15 0.40 -1.14 0.00 0.00 176.83 177.23 3h3f h ILE 38 N 0.50 1.23 -0.69 3.27 2.04 -0.79 -2.73 117.51 120.34 3h3f h ILE 38 Ca 0.03 -0.80 -0.06 0.00 1.00 0.00 0.00 64.86 65.03 3h3f h ILE 38 Cb 1.00 0.79 -0.03 0.00 -0.74 0.00 0.00 36.82 37.84 3h3f h ILE 38 CO 0.09 0.29 0.21 -0.07 0.00 0.00 0.00 178.15 178.68 3h3f h LEU 39 N 0.70 1.01 -0.35 1.44 3.38 -0.94 -2.54 115.31 118.01 3h3f h LEU 39 Ca 0.16 -0.21 0.00 0.00 0.09 0.00 0.00 57.88 57.92 3h3f h LEU 39 Cb 0.30 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.78 3h3f h LEU 39 CO -0.00 0.96 0.00 0.23 0.09 0.00 0.00 178.44 179.71 3h3f n MET 40 N -4.30 0.15 -0.08 1.13 2.81 -0.48 -2.37 117.12 113.98 3h3f n MET 40 Ca 0.05 0.31 0.09 0.00 -1.81 0.00 0.00 57.70 56.34 3h3f n MET 40 Cb 0.23 -1.75 0.12 0.00 -0.71 0.00 0.00 33.22 31.11 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 -2.03 1.87 -2.61 0.03 5.02 -1.00 -4.99 118.16 114.44 3h3f n LYS 41 Ca 0.04 -1.81 -0.21 0.00 -2.02 0.00 0.00 58.31 54.31 3h3f n LYS 41 Cb 0.27 -1.37 0.01 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 1.05 -5.94 0.12 4.39 8.00 -0.99 -4.90 116.55 118.27 3h3f n ASP 42 Ca 0.13 -0.11 0.13 0.00 0.71 0.00 0.00 54.79 55.64 3h3f n ASP 42 Cb 0.47 -4.88 0.43 0.00 -0.02 0.00 0.00 41.12 37.12 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 -3.32 0.81 -4.30 0.64 4.77 -1.17 -4.88 117.00 109.55 3h3f n LEU 43 Ca -0.20 0.61 -0.17 0.00 -0.03 0.00 0.00 56.01 56.23 3h3f n LEU 43 Cb 0.66 -0.39 -0.10 0.00 -2.33 0.00 0.00 43.42 41.26 3h3f n LEU 43 CO 0.35 -0.31 -0.43 0.00 -1.33 0.00 0.00 177.39 175.67 3h3f s ALA 44 N -3.18 1.73 -0.87 -1.18 0.00 -1.26 -4.94 121.76 112.06 3h3f s ALA 44 Ca 0.08 -1.55 0.10 0.00 0.00 0.00 0.00 51.96 50.59 3h3f s ALA 44 Cb 0.11 -0.03 -0.01 0.00 0.00 0.00 0.00 23.12 23.19 3h3f s ALA 44 CO 0.54 0.00 0.61 -0.40 0.00 0.00 0.00 175.76 176.51 3h3f n ASP 45 N -0.21 1.15 -3.73 0.00 5.68 -0.46 -4.72 116.55 114.26 3h3f n ASP 45 Ca -0.10 -1.08 -0.13 0.00 -0.50 0.00 0.00 54.79 52.99 3h3f n ASP 45 Cb 0.60 0.49 -0.13 0.00 -1.14 0.00 0.00 41.12 40.94 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 -1.36 0.17 -0.22 0.11 2.12 -1.24 -3.74 118.70 114.55 3h3f s GLU 46 Ca 0.08 0.49 -0.03 0.00 0.36 0.00 0.00 54.97 55.87 3h3f s GLU 46 Cb 0.08 -0.14 0.00 0.00 0.26 0.00 0.00 34.13 34.33 3h3f s GLU 46 CO 0.25 -0.17 -0.07 -1.17 -0.54 0.00 0.00 175.26 173.56 3h3f s LEU 47 N 1.29 2.79 0.11 2.70 2.96 -0.54 -1.86 118.68 126.13 3h3f s LEU 47 Ca -0.09 -0.49 0.04 0.00 -0.22 0.00 0.00 54.13 53.37 3h3f s LEU 47 Cb -0.11 -1.68 -0.04 0.00 0.50 0.00 0.00 46.19 44.86 3h3f s LEU 47 CO -0.08 -0.03 0.08 0.00 -1.32 0.00 0.00 176.35 175.01 3h3f s ALA 48 N 1.43 3.53 -0.06 5.97 0.00 -0.28 -1.76 121.76 130.59 3h3f s ALA 48 Ca 0.05 -1.08 0.01 0.00 0.00 0.00 0.00 51.96 50.93 3h3f s ALA 48 Cb -0.14 -1.38 0.02 0.00 0.00 0.00 0.00 23.12 21.62 3h3f s ALA 48 CO -0.05 0.67 -0.06 -0.51 0.00 0.00 0.00 175.76 175.81 3h3f s LEU 49 N -2.58 1.30 0.12 0.00 1.43 -0.61 -1.04 118.68 117.31 3h3f s LEU 49 Ca 0.29 -0.19 0.09 0.00 -1.03 0.00 0.00 54.13 53.29 3h3f s LEU 49 Cb -0.11 -0.60 -0.04 0.00 0.03 0.00 0.00 46.19 45.47 3h3f s LEU 49 CO 0.22 -0.06 -0.21 0.68 0.23 0.00 0.00 176.35 177.22 3h3f s VAL 50 N 1.08 1.79 -0.04 -1.59 -7.23 -0.92 -2.03 120.40 111.46 3h3f s VAL 50 Ca -0.08 -1.67 -0.29 0.00 -1.81 0.00 0.00 61.98 58.12 3h3f s VAL 50 Cb -0.14 -1.68 0.09 0.00 0.56 0.00 0.00 36.38 35.21 3h3f s VAL 50 CO -0.01 -0.12 0.77 -0.62 -0.31 0.00 0.00 175.10 174.81 3h3f s ASP 51 N -2.15 -0.55 0.46 4.85 -1.08 -1.25 -0.62 116.67 116.35 3h3f s ASP 51 Ca 0.10 0.48 0.30 0.00 -0.52 0.00 0.00 52.55 52.90 3h3f s ASP 51 Cb -0.09 0.47 1.12 0.00 -1.46 0.00 0.00 42.92 42.96 3h3f s ASP 51 CO 0.05 -0.59 1.87 -0.37 0.52 0.00 0.00 175.17 176.65 3h3f h VAL 52 N 2.66 0.00 -2.54 1.11 -1.51 -1.92 -3.39 116.25 110.66 3h3f h VAL 52 Ca -0.25 -0.53 -0.63 0.00 -1.23 0.00 0.00 66.70 64.06 3h3f h VAL 52 Cb 1.18 1.48 -0.14 0.00 -2.13 0.00 0.00 31.29 31.68 3h3f h VAL 52 CO 0.36 0.00 0.66 -0.04 -1.23 0.00 0.00 177.57 177.32 3h3f s MET 53 N -3.51 3.20 0.34 5.19 -1.94 -1.26 -4.92 119.30 116.41 3h3f s MET 53 Ca 0.03 -0.91 0.04 0.00 -1.71 0.00 0.00 55.69 53.14 3h3f s MET 53 Cb 0.09 -4.35 0.62 0.00 2.01 0.00 0.00 34.83 33.19 3h3f s MET 53 CO 0.54 -1.86 1.92 0.93 -0.01 0.00 0.00 175.02 176.54 3h3f h GLU 54 N 9.53 0.61 0.00 2.03 5.08 -2.00 -1.85 114.58 127.98 3h3f h GLU 54 Ca -0.21 -0.10 -0.04 0.00 -1.00 0.00 0.00 59.36 58.01 3h3f h GLU 54 Cb 1.06 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 30.20 3h3f h GLU 54 CO 1.19 0.55 -0.24 -0.44 -1.00 0.00 0.00 179.01 179.07 3h3f h ASP 55 N 0.60 0.00 -0.46 1.42 5.19 -1.96 -2.38 116.42 118.83 3h3f h ASP 55 Ca 0.14 -0.88 0.09 0.00 -0.62 0.00 0.00 57.03 55.76 3h3f h ASP 55 Cb 0.20 0.00 -0.09 0.00 0.18 0.00 0.00 39.33 39.62 3h3f h ASP 55 CO -0.01 1.08 -0.20 0.50 -3.12 0.00 0.00 179.24 177.49 3h3f h LYS 56 N -1.00 -0.10 -0.47 3.56 3.64 -1.98 0.68 116.57 120.89 3h3f h LYS 56 Ca -0.07 0.01 0.09 0.00 -1.27 0.00 0.00 60.65 59.41 3h3f h LYS 56 Cb 1.03 0.02 -0.08 0.00 -0.41 0.00 0.00 32.23 32.80 3h3f h LYS 56 CO -0.04 -0.07 0.01 1.25 -2.27 0.00 0.00 179.45 178.33 3h3f h LEU 57 N -0.11 -0.19 -0.36 5.20 5.85 -1.35 0.11 115.31 124.47 3h3f h LEU 57 Ca 0.22 0.11 -0.11 0.00 0.84 0.00 0.00 57.88 58.94 3h3f h LEU 57 Cb 0.45 0.19 -0.02 0.00 0.37 0.00 0.00 40.66 41.65 3h3f h LEU 57 CO -0.53 -0.06 -0.50 0.50 -0.34 0.00 0.00 178.44 177.51 3h3f h LYS 58 N 0.12 0.00 -0.26 1.25 3.64 -1.15 -2.53 116.57 117.65 3h3f h LYS 58 Ca 0.24 0.00 -0.13 0.00 -1.27 0.00 0.00 60.65 59.49 3h3f h LYS 58 Cb 0.35 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.16 3h3f h LYS 58 CO -0.39 0.50 -0.33 0.78 -2.27 0.00 0.00 179.45 177.75 3h3f h GLY 59 N 2.89 0.74 1.14 5.01 0.00 0.68 -3.03 103.07 110.51 3h3f h GLY 59 Ca -0.01 -0.80 -0.09 0.00 0.00 0.00 0.00 47.33 46.43 3h3f h GLY 59 CO 0.07 0.72 -0.00 0.83 0.00 0.00 0.00 176.54 178.16 3h3f h GLU 60 N 0.41 1.03 0.19 4.80 4.39 -0.82 -2.26 114.58 122.31 3h3f h GLU 60 Ca 0.03 -0.32 -0.01 0.00 0.34 0.00 0.00 59.36 59.41 3h3f h GLU 60 Cb 0.91 -0.10 -0.00 0.00 -0.10 0.00 0.00 28.75 29.46 3h3f h GLU 60 CO 0.08 1.01 -0.12 1.98 -1.16 0.00 0.00 179.01 180.80 3h3f h MET 61 N 0.94 -0.28 -0.70 2.33 4.05 -1.54 -1.70 114.93 118.03 3h3f h MET 61 Ca 0.17 0.02 0.08 0.00 -0.28 0.00 0.00 59.70 59.69 3h3f h MET 61 Cb 0.55 0.06 -0.07 0.00 -0.80 0.00 0.00 31.60 31.34 3h3f h MET 61 CO 0.03 -0.19 0.36 0.52 0.23 0.00 0.00 176.91 177.86 3h3f h MET 62 N -0.29 0.60 0.10 0.39 2.86 -1.60 0.40 114.93 117.40 3h3f h MET 62 Ca -0.02 -0.04 0.01 0.00 -2.06 0.00 0.00 59.70 57.60 3h3f h MET 62 Cb 0.25 -0.14 -0.02 0.00 0.06 0.00 0.00 31.60 31.75 3h3f h MET 62 CO 0.02 0.40 -0.16 0.22 1.06 0.00 0.00 176.91 178.45 3h3f h ASP 63 N 0.62 -0.43 0.17 1.22 -0.00 -1.29 -0.43 116.42 116.28 3h3f h ASP 63 Ca 0.34 0.05 -0.01 0.00 -0.00 0.00 0.00 57.03 57.41 3h3f h ASP 63 Cb 0.32 0.16 0.00 0.00 -0.00 0.00 0.00 39.33 39.82 3h3f h ASP 63 CO -0.25 -0.23 -0.08 -0.07 -0.00 0.00 0.00 179.24 178.61 3h3f h LEU 64 N -0.32 -0.20 -0.99 2.28 3.38 -1.20 -2.74 115.31 115.53 3h3f h LEU 64 Ca 0.02 0.01 0.19 0.00 0.09 0.00 0.00 57.88 58.19 3h3f h LEU 64 Cb 0.33 0.05 -0.11 0.00 0.09 0.00 0.00 40.66 41.02 3h3f h LEU 64 CO -0.08 -0.14 0.59 1.56 0.09 0.00 0.00 178.44 180.46 3h3f h GLN 65 N -0.23 0.71 0.00 1.13 4.20 0.04 0.62 115.11 121.58 3h3f h GLN 65 Ca -0.02 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.64 3h3f h GLN 65 Cb 0.18 -0.16 0.00 0.00 0.30 0.00 0.00 27.48 27.80 3h3f h GLN 65 CO 0.04 0.47 0.00 0.72 -0.67 0.00 0.00 178.83 179.39 3h3f n HIS 66 N -4.79 0.73 -0.48 2.96 8.25 -0.19 -1.97 115.22 119.73 3h3f n HIS 66 Ca 0.23 0.34 0.05 0.00 -0.26 0.00 0.00 57.72 58.08 3h3f n HIS 66 Cb 0.58 -1.04 0.32 0.00 1.12 0.00 0.00 29.99 30.97 3h3f n HIS 66 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3h3f n GLY 67 N -0.72 2.66 0.21 -1.41 0.00 0.21 -4.56 105.19 101.58 3h3f n GLY 67 Ca 0.00 -0.72 -0.06 0.00 0.00 0.00 0.00 46.02 45.24 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 3.14 0.50 -1.03 1.61 0.02 -1.50 -1.25 113.55 115.03 3h3f h SER 68 Ca 0.00 -0.23 0.40 0.00 -0.84 0.00 0.00 61.79 61.12 3h3f h SER 68 Cb 1.66 -0.14 -0.17 0.00 0.14 0.00 0.00 62.40 63.89 3h3f h SER 68 CO 0.39 0.87 0.58 0.25 -1.14 0.00 0.00 176.83 177.77 3h3f h LEU 69 N 0.38 0.36 -1.61 5.07 5.85 -1.84 -1.70 115.31 121.82 3h3f h LEU 69 Ca 0.03 0.23 0.00 0.00 0.84 0.00 0.00 57.88 58.98 3h3f h LEU 69 Cb 0.92 0.23 0.00 0.00 0.37 0.00 0.00 40.66 42.18 3h3f h LEU 69 CO 0.08 -0.35 0.00 0.49 -0.34 0.00 0.00 178.44 178.32 3h3f n PHE 70 N -5.16 0.14 -4.20 1.25 3.01 -0.48 -4.95 117.46 107.07 3h3f n PHE 70 Ca 0.37 -0.07 -0.27 0.00 1.01 0.00 0.00 57.45 58.49 3h3f n PHE 70 Cb 1.24 0.00 -0.06 0.00 -0.01 0.00 0.00 39.48 40.65 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 -1.82 2.84 -0.40 4.37 1.43 -0.64 -5.07 118.68 119.39 3h3f s LEU 71 Ca 0.34 -1.24 0.10 0.00 -1.03 0.00 0.00 54.13 52.29 3h3f s LEU 71 Cb 0.20 -1.23 0.43 0.00 0.03 0.00 0.00 46.19 45.63 3h3f s LEU 71 CO 0.31 -0.75 1.03 0.54 0.23 0.00 0.00 176.35 177.71 3h3f n ARG 72 N -1.38 2.54 -3.87 1.70 5.12 -1.26 -4.96 116.66 114.55 3h3f n ARG 72 Ca -0.05 -4.05 -0.30 0.00 -1.93 0.00 0.00 57.85 51.52 3h3f n ARG 72 Cb 0.65 -1.88 -0.15 0.00 -1.16 0.00 0.00 32.46 29.92 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 -4.54 1.47 -1.54 0.55 2.01 -1.26 -4.92 115.64 107.41 3h3f s THR 73 Ca 0.40 -1.68 0.27 0.00 0.31 0.00 0.00 61.69 60.99 3h3f s THR 73 Cb 0.41 -2.03 0.53 0.00 0.01 0.00 0.00 72.50 71.42 3h3f s THR 73 CO -0.10 -0.54 1.92 -0.81 -0.69 0.00 0.00 174.62 174.40 3h3f n PRO 74 N 4.61 0.47 -3.69 4.92 -0.04 -1.25 -4.73 135.00 135.30 3h3f n PRO 74 Ca -0.02 0.03 -0.13 0.00 -0.04 0.00 0.00 63.50 63.34 3h3f n PRO 74 Cb 0.42 -1.50 -0.13 0.00 -0.04 0.00 0.00 33.50 32.25 3h3f n PRO 74 CO 0.00 0.00 0.00 0.21 -0.04 0.00 0.00 175.50 175.67 3h3f s LYS 75 N -2.46 0.18 -0.08 0.54 2.20 -1.25 -5.09 119.74 113.79 3h3f s LYS 75 Ca 0.28 0.66 -0.01 0.00 -0.36 0.00 0.00 55.97 56.54 3h3f s LYS 75 Cb 0.18 -0.07 0.03 0.00 -1.51 0.00 0.00 37.83 36.45 3h3f s LYS 75 CO 0.39 -0.23 -0.04 0.42 -0.36 0.00 0.00 175.35 175.53 3h3f s ILE 76 N 1.89 0.66 0.09 5.43 1.01 -1.26 -1.47 121.20 127.56 3h3f s ILE 76 Ca -0.04 -0.08 0.02 0.00 0.00 0.00 0.00 60.65 60.55 3h3f s ILE 76 Cb -0.11 -0.74 -0.04 0.00 0.01 0.00 0.00 42.46 41.58 3h3f s ILE 76 CO -0.09 0.30 -0.07 0.68 0.00 0.00 0.00 174.94 175.76 3h3f s VAL 77 N 1.68 0.70 0.14 2.92 -7.23 -0.72 -4.99 120.40 112.90 3h3f s VAL 77 Ca 0.02 -1.85 -0.19 0.00 -1.81 0.00 0.00 61.98 58.15 3h3f s VAL 77 Cb -0.13 -1.58 0.05 0.00 0.56 0.00 0.00 36.38 35.28 3h3f s VAL 77 CO -0.05 -0.81 0.48 -0.94 -0.31 0.00 0.00 175.10 173.46 3h3f s SER 78 N -2.89 -0.35 -0.24 4.85 1.04 -1.26 -1.57 113.70 113.28 3h3f s SER 78 Ca 0.10 -0.22 -0.37 0.00 0.48 0.00 0.00 55.95 55.93 3h3f s SER 78 Cb 0.03 0.52 0.15 0.00 0.10 0.00 0.00 66.02 66.83 3h3f s SER 78 CO -0.04 -0.91 1.36 -0.83 0.98 0.00 0.00 173.24 173.80 3h3f s GLY 79 N -2.79 -0.26 0.07 7.32 0.00 -0.86 -4.97 107.32 105.84 3h3f s GLY 79 Ca 0.03 1.72 0.01 0.00 0.00 0.00 0.00 44.72 46.48 3h3f s GLY 79 CO -0.12 0.55 1.12 1.70 0.00 0.00 0.00 173.10 176.35 3h3f h LYS 80 N 2.00 0.16 -6.44 2.90 3.64 -1.88 -3.32 116.57 113.63 3h3f h LYS 80 Ca -0.08 -0.27 -0.54 0.00 -1.27 0.00 0.00 60.65 58.50 3h3f h LYS 80 Cb 1.14 0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 33.05 3h3f h LYS 80 CO 0.21 1.08 0.50 0.34 -2.27 0.00 0.00 179.45 179.31 3h3f s ASP 81 N -6.90 7.18 0.00 4.20 3.68 -1.26 -4.85 116.67 118.72 3h3f s ASP 81 Ca -0.03 1.87 0.18 0.00 2.13 0.00 0.00 52.55 56.69 3h3f s ASP 81 Cb 0.08 -2.57 1.02 0.00 -1.45 0.00 0.00 42.92 39.99 3h3f s ASP 81 CO 0.85 -0.40 1.47 -1.22 0.13 0.00 0.00 175.17 176.00 3h3f n TYR 82 N 4.02 0.00 0.10 -5.34 4.02 -1.26 -2.89 117.16 115.80 3h3f n TYR 82 Ca 0.08 0.00 0.03 0.00 -0.01 0.00 0.00 57.90 58.00 3h3f n TYR 82 Cb 0.48 -0.07 0.43 0.00 -0.02 0.00 0.00 39.34 40.17 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 0.27 0.00 7.72 4.64 -1.92 0.20 113.55 124.45 3h3f h SER 83 Ca 0.00 -0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.29 3h3f h SER 83 Cb 0.04 -0.07 0.00 0.00 -0.31 0.00 0.00 62.40 62.06 3h3f h SER 83 CO 0.00 0.33 0.00 -0.37 -0.87 0.00 0.00 176.83 175.92 3h3f h VAL 84 N 0.29 0.00 -0.00 0.95 -1.51 -1.91 -2.12 116.25 111.95 3h3f h VAL 84 Ca 0.07 -0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.54 3h3f h VAL 84 Cb 0.20 0.78 0.00 0.00 -2.13 0.00 0.00 31.29 30.14 3h3f h VAL 84 CO 0.00 0.00 -0.32 0.41 -1.23 0.00 0.00 177.57 176.43 3h3f n THR 85 N -2.73 0.00 -2.04 7.19 -1.04 0.68 -4.84 114.28 111.51 3h3f n THR 85 Ca -0.02 -0.05 -0.39 0.00 -2.04 0.00 0.00 64.05 61.55 3h3f n THR 85 Cb 0.05 0.19 0.00 0.00 -1.82 0.00 0.00 70.33 68.76 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 -2.76 3.13 -1.33 2.41 0.00 -0.80 -3.19 121.76 119.21 3h3f s ALA 86 Ca 0.18 1.20 -0.09 0.00 0.00 0.00 0.00 51.96 53.25 3h3f s ALA 86 Cb 0.19 -3.48 0.01 0.00 0.00 0.00 0.00 23.12 19.83 3h3f s ALA 86 CO 0.60 -0.89 1.13 0.09 0.00 0.00 0.00 175.76 176.68 3h3f n ASN 87 N -0.19 -6.28 -4.81 0.00 5.03 -0.71 -4.96 115.26 103.34 3h3f n ASN 87 Ca 0.05 -0.51 -0.34 0.00 0.87 0.00 0.00 54.58 54.65 3h3f n ASN 87 Cb 0.45 -4.91 -0.07 0.00 -1.02 0.00 0.00 39.78 34.22 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 -3.28 7.02 0.13 6.41 0.01 -1.19 -4.62 113.70 118.17 3h3f s SER 88 Ca 0.56 1.71 0.08 0.00 1.31 0.00 0.00 55.95 59.61 3h3f s SER 88 Cb -0.25 -2.54 -0.17 0.00 0.21 0.00 0.00 66.02 63.27 3h3f s SER 88 CO 0.69 -0.30 1.27 0.11 0.41 0.00 0.00 173.24 175.43 3h3f h LYS 89 N 2.18 0.00 -3.66 12.44 1.79 -0.79 -3.39 116.57 125.13 3h3f h LYS 89 Ca -0.49 0.00 -0.28 0.00 -2.18 0.00 0.00 60.65 57.70 3h3f h LYS 89 Cb 1.18 0.00 -0.32 0.00 -1.58 0.00 0.00 32.23 31.52 3h3f h LYS 89 CO 0.62 0.90 -0.73 -1.17 -1.08 0.00 0.00 179.45 177.99 3h3f s LEU 90 N -6.64 1.45 -0.14 2.94 2.96 -1.12 -1.44 118.68 116.69 3h3f s LEU 90 Ca 0.01 0.01 0.01 0.00 -0.22 0.00 0.00 54.13 53.94 3h3f s LEU 90 Cb 0.10 -0.08 0.02 0.00 0.50 0.00 0.00 46.19 46.72 3h3f s LEU 90 CO 0.81 -0.07 -0.17 -0.69 -1.32 0.00 0.00 176.35 174.91 3h3f s VAL 91 N 0.64 1.68 -0.21 1.68 1.01 -0.85 -0.89 120.40 123.46 3h3f s VAL 91 Ca -0.06 -0.73 -0.07 0.00 0.00 0.00 0.00 61.98 61.13 3h3f s VAL 91 Cb -0.08 -1.53 -0.03 0.00 0.00 0.00 0.00 36.38 34.73 3h3f s VAL 91 CO -0.02 0.48 0.05 -0.63 0.00 0.00 0.00 175.10 174.98 3h3f s ILE 92 N 1.16 4.39 -0.34 2.22 1.01 0.12 -0.89 121.20 128.87 3h3f s ILE 92 Ca -0.01 -0.16 -0.13 0.00 0.00 0.00 0.00 60.65 60.35 3h3f s ILE 92 Cb -0.14 -3.01 -0.01 0.00 0.01 0.00 0.00 42.46 39.31 3h3f s ILE 92 CO -0.06 0.41 0.23 -0.63 0.00 0.00 0.00 174.94 174.89 3h3f s ILE 93 N 0.99 5.21 -0.10 2.92 -1.09 -0.18 0.73 121.20 129.67 3h3f s ILE 93 Ca 0.03 -0.27 0.09 0.00 -2.23 0.00 0.00 60.65 58.28 3h3f s ILE 93 Cb -0.14 -3.69 0.16 0.00 -1.58 0.00 0.00 42.46 37.21 3h3f s ILE 93 CO 0.03 -0.02 1.09 0.35 -1.23 0.00 0.00 174.94 175.16 3h3f n THR 94 N 5.10 1.43 -2.37 2.92 -2.24 -0.03 -0.56 114.28 118.52 3h3f n THR 94 Ca -0.13 -1.58 -0.39 0.00 -2.27 0.00 0.00 64.05 59.68 3h3f n THR 94 Cb 0.49 0.15 -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 -1.88 3.32 0.00 6.98 0.00 -1.04 -4.71 121.76 124.43 3h3f s ALA 95 Ca 0.16 0.96 0.00 0.00 0.00 0.00 0.00 51.96 53.08 3h3f s ALA 95 Cb 0.14 -3.36 0.00 0.00 0.00 0.00 0.00 23.12 19.90 3h3f s ALA 95 CO 0.02 -0.35 0.00 0.41 0.00 0.00 0.00 175.76 175.84 3h3f n GLY 96 N 0.88 1.25 3.75 0.00 0.00 -1.26 -4.73 105.19 105.08 3h3f n GLY 96 Ca 0.01 -1.93 -0.35 0.00 0.00 0.00 0.00 46.02 43.75 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 -1.10 2.36 0.28 4.61 0.00 -1.26 -5.07 121.76 121.58 3h3f s ALA 97 Ca 0.00 0.85 0.06 0.00 0.00 0.00 0.00 51.96 52.88 3h3f s ALA 97 Cb 0.00 -3.43 -0.06 0.00 0.00 0.00 0.00 23.12 19.63 3h3f s ALA 97 CO 0.00 -1.46 -0.05 -0.98 0.00 0.00 0.00 175.76 173.27 3h3f s ARG 98 N -3.72 1.55 0.28 0.00 1.70 -1.26 -4.72 118.95 112.77 3h3f s ARG 98 Ca 0.74 -1.79 -0.30 0.00 -0.47 0.00 0.00 55.73 53.91 3h3f s ARG 98 Cb -0.28 -1.12 -0.12 0.00 -0.57 0.00 0.00 34.95 32.86 3h3f s ARG 98 CO 0.39 0.02 1.52 1.04 -1.08 0.00 0.00 175.30 177.20 3h3f n GLN 99 N -0.58 2.46 -2.11 3.89 6.02 -1.26 -5.03 117.38 120.78 3h3f n GLN 99 Ca -0.05 0.88 -0.29 0.00 -0.01 0.00 0.00 57.00 57.52 3h3f n GLN 99 Cb 0.63 -2.61 0.03 0.00 1.02 0.00 0.00 30.24 29.31 3h3f n GLN 99 CO 0.00 0.00 0.00 -1.14 -1.01 0.00 0.00 177.06 174.91 3h3f s GLN 100 N -0.56 3.16 -0.12 -1.09 0.74 -1.26 -4.97 119.66 115.57 3h3f s GLN 100 Ca 0.65 0.39 -0.30 0.00 0.05 0.00 0.00 55.36 56.14 3h3f s GLN 100 Cb -0.55 -2.15 -0.08 0.00 1.10 0.00 0.00 33.01 31.33 3h3f s GLN 100 CO 0.50 -0.72 2.08 -1.91 -0.55 0.00 0.00 175.29 174.69 3h3f n GLU 101 N -2.73 2.24 0.00 1.67 2.13 -1.26 -1.51 120.64 121.18 3h3f n GLU 101 Ca 0.05 0.74 0.00 0.00 0.66 0.00 0.00 57.16 58.61 3h3f n GLU 101 Cb 0.56 -2.99 0.00 0.00 0.27 0.00 0.00 31.44 29.28 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 5.18 1.69 3.77 8.31 0.00 -1.26 -5.07 105.19 117.81 3h3f n GLY 102 Ca 0.26 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.88 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 -0.06 4.10 0.51 1.61 2.12 -0.57 -5.02 118.70 121.39 3h3f s GLU 103 Ca 0.00 2.21 -0.15 0.00 0.36 0.00 0.00 54.97 57.38 3h3f s GLU 103 Cb 0.00 -2.87 -0.07 0.00 0.26 0.00 0.00 34.13 31.45 3h3f s GLU 103 CO 0.00 -0.40 0.96 -1.54 -0.54 0.00 0.00 175.26 173.73 3h3f s SER 104 N -0.61 6.58 0.42 -1.70 1.04 -1.26 -4.81 113.70 113.35 3h3f s SER 104 Ca 0.54 1.50 0.11 0.00 0.48 0.00 0.00 55.95 58.58 3h3f s SER 104 Cb -0.39 -2.48 0.94 0.00 0.10 0.00 0.00 66.02 64.19 3h3f s SER 104 CO 0.51 -0.58 2.01 0.03 0.98 0.00 0.00 173.24 176.19 3h3f h ARG 105 N 0.88 0.48 -0.11 4.02 3.08 -1.99 -3.14 114.38 117.60 3h3f h ARG 105 Ca -0.47 -0.03 -0.05 0.00 0.07 0.00 0.00 59.98 59.50 3h3f h ARG 105 Cb 1.19 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 31.12 3h3f h ARG 105 CO 0.62 0.32 -0.17 -0.07 -1.07 0.00 0.00 179.97 179.60 3h3f h LEU 106 N 0.50 0.18 -1.27 3.04 4.07 -1.95 -1.83 115.31 118.04 3h3f h LEU 106 Ca 0.23 -0.04 0.00 0.00 0.08 0.00 0.00 57.88 58.16 3h3f h LEU 106 Cb 0.29 -0.05 0.00 0.00 1.08 0.00 0.00 40.66 41.99 3h3f h LEU 106 CO -0.06 0.36 0.03 -3.20 -1.08 0.00 0.00 178.44 174.49 3h3f n ASN 107 N -4.26 0.50 0.03 -0.43 4.05 -1.19 -1.96 115.26 112.01 3h3f n ASN 107 Ca -0.01 0.72 0.13 0.00 0.45 0.00 0.00 54.58 55.87 3h3f n ASN 107 Cb 0.29 -0.78 0.46 0.00 1.23 0.00 0.00 39.78 40.98 3h3f n ASN 107 CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 177.26 174.39 3h3f n LEU 108 N -2.18 0.36 -0.17 1.20 4.77 -0.69 -4.48 117.00 115.81 3h3f n LEU 108 Ca -0.01 0.42 -0.10 0.00 -0.03 0.00 0.00 56.01 56.29 3h3f n LEU 108 Cb 0.06 -0.38 0.00 0.00 -2.33 0.00 0.00 43.42 40.77 3h3f n LEU 108 CO 0.08 -0.03 0.81 1.62 -1.33 0.00 0.00 177.39 178.55 3h3f h VAL 109 N 0.00 1.26 -0.10 4.08 3.04 -1.55 -2.77 116.25 120.21 3h3f h VAL 109 Ca 0.00 -1.05 -0.18 0.00 -1.01 0.00 0.00 66.70 64.46 3h3f h VAL 109 Cb 0.59 0.95 -0.01 0.00 -2.01 0.00 0.00 31.29 30.81 3h3f h VAL 109 CO 0.00 0.37 -0.69 -0.61 -1.01 0.00 0.00 177.57 175.63 3h3f h GLN 110 N 0.74 0.43 -0.47 4.17 5.75 -1.83 -1.82 115.11 122.08 3h3f h GLN 110 Ca 0.14 -0.33 -0.05 0.00 -0.15 0.00 0.00 58.65 58.26 3h3f h GLN 110 Cb 0.49 0.06 -0.02 0.00 1.07 0.00 0.00 27.48 29.08 3h3f h GLN 110 CO 0.02 0.96 0.08 0.00 -2.65 0.00 0.00 178.83 177.24 3h3f h ARG 111 N 0.30 0.72 0.00 1.69 3.08 -1.82 -3.01 114.38 115.35 3h3f h ARG 111 Ca -0.02 -0.15 0.00 0.00 0.07 0.00 0.00 59.98 59.88 3h3f h ARG 111 Cb 1.25 -0.11 0.00 0.00 0.08 0.00 0.00 29.97 31.19 3h3f h ARG 111 CO 0.12 0.68 -1.54 0.09 -1.07 0.00 0.00 179.97 178.25 3h3f n ASN 112 N -4.28 0.37 -0.09 7.04 5.03 -1.06 -3.03 115.26 119.24 3h3f n ASN 112 Ca 0.03 0.01 -0.11 0.00 0.87 0.00 0.00 54.58 55.38 3h3f n ASN 112 Cb 0.23 1.35 -0.04 0.00 -1.02 0.00 0.00 39.78 40.31 3h3f n ASN 112 CO 0.00 0.00 0.00 0.58 -1.83 0.00 0.00 177.26 176.01 3h3f h VAL 113 N 0.00 1.25 -0.60 2.41 2.07 -1.32 -2.08 116.25 117.97 3h3f h VAL 113 Ca 0.00 -0.88 0.10 0.00 0.82 0.00 0.00 66.70 66.73 3h3f h VAL 113 Cb 0.94 1.31 -0.07 0.00 -1.52 0.00 0.00 31.29 31.95 3h3f h VAL 113 CO 0.00 0.28 0.21 0.78 0.02 0.00 0.00 177.57 178.86 3h3f h ASN 114 N 0.25 0.19 -0.25 0.57 2.35 -1.59 -1.37 115.58 115.72 3h3f h ASN 114 Ca 0.08 0.08 0.05 0.00 -0.55 0.00 0.00 56.30 55.96 3h3f h ASN 114 Cb 0.40 0.07 -0.05 0.00 0.05 0.00 0.00 38.32 38.80 3h3f h ASN 114 CO 0.01 0.11 -0.04 0.40 -1.65 0.00 0.00 177.43 176.26 3h3f h ILE 115 N 0.38 0.77 -0.86 2.81 2.04 -1.53 -3.07 117.51 118.05 3h3f h ILE 115 Ca 0.31 -0.01 0.02 0.00 1.00 0.00 0.00 64.86 66.18 3h3f h ILE 115 Cb 0.39 0.74 -0.05 0.00 -0.74 0.00 0.00 36.82 37.17 3h3f h ILE 115 CO -0.32 0.00 0.56 -0.26 0.00 0.00 0.00 178.15 178.14 3h3f h PHE 116 N 0.03 1.05 -1.02 1.37 -1.00 -0.63 0.86 116.94 117.60 3h3f h PHE 116 Ca 0.12 0.03 0.35 0.00 2.81 0.00 0.00 57.97 61.28 3h3f h PHE 116 Cb 0.18 -0.35 -0.15 0.00 3.61 0.00 0.00 35.95 39.23 3h3f h PHE 116 CO -0.24 0.63 0.58 0.87 -1.61 0.00 0.00 178.31 178.54 3h3f h LYS 117 N 1.11 0.23 0.08 1.51 1.57 -1.19 -1.92 116.57 117.97 3h3f h LYS 117 Ca 0.33 -0.01 -0.30 0.00 -1.87 0.00 0.00 60.65 58.79 3h3f h LYS 117 Cb -0.05 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.19 3h3f h LYS 117 CO -0.10 0.15 -1.61 0.74 -0.57 0.00 0.00 179.45 178.07 3h3f h PHE 118 N 0.24 0.32 0.00 -1.35 0.04 -0.78 -3.40 116.94 112.01 3h3f h PHE 118 Ca 0.76 -0.23 -0.06 0.00 2.80 0.00 0.00 57.97 61.24 3h3f h PHE 118 Cb 1.85 -0.01 -0.01 0.00 2.20 0.00 0.00 35.95 39.98 3h3f h PHE 118 CO -0.01 1.33 -0.33 0.82 -0.60 0.00 0.00 178.31 179.52 3h3f h ILE 119 N 0.05 1.45 -0.48 -0.55 2.04 -1.00 -3.34 117.51 115.69 3h3f h ILE 119 Ca -0.26 -2.22 0.04 0.00 1.00 0.00 0.00 64.86 63.42 3h3f h ILE 119 Cb 2.00 2.87 -0.04 0.00 -0.74 0.00 0.00 36.82 40.91 3h3f h ILE 119 CO 0.13 0.49 0.23 0.40 0.00 0.00 0.00 178.15 179.40 3h3f h ILE 120 N -1.00 0.94 -0.45 -0.67 1.08 -1.60 0.41 117.51 116.23 3h3f h ILE 120 Ca -0.09 -0.15 0.08 0.00 -0.39 0.00 0.00 64.86 64.31 3h3f h ILE 120 Cb 1.02 0.45 -0.02 0.00 -3.07 0.00 0.00 36.82 35.20 3h3f h ILE 120 CO -0.05 0.08 0.31 -0.65 -0.69 0.00 0.00 178.15 177.14 3h3f h PRO 121 N 0.45 0.25 0.02 2.37 0.11 -1.77 -1.39 132.00 132.05 3h3f h PRO 121 Ca 0.21 -0.02 -0.21 0.00 0.11 0.00 0.00 66.00 66.09 3h3f h PRO 121 Cb 0.14 -0.06 -0.02 0.00 0.11 0.00 0.00 31.00 31.17 3h3f h PRO 121 CO -0.16 0.17 -1.00 -0.91 -0.21 0.00 0.00 178.00 175.89 3h3f h ASN 122 N 0.26 0.10 0.31 -2.05 2.35 -1.17 -2.73 115.58 112.65 3h3f h ASN 122 Ca 0.20 -0.10 -0.02 0.00 -0.55 0.00 0.00 56.30 55.84 3h3f h ASN 122 Cb 0.47 -0.03 0.00 0.00 0.05 0.00 0.00 38.32 38.81 3h3f h ASN 122 CO -0.04 1.03 -0.15 -0.37 -1.65 0.00 0.00 177.43 176.25 3h3f h VAL 123 N 0.02 0.05 0.00 2.81 -1.51 -0.55 -3.05 116.25 114.02 3h3f h VAL 123 Ca -0.03 -0.72 0.00 0.00 -1.23 0.00 0.00 66.70 64.72 3h3f h VAL 123 Cb 1.72 0.09 0.00 0.00 -2.13 0.00 0.00 31.29 30.97 3h3f h VAL 123 CO 0.14 0.01 0.21 -0.37 -1.23 0.00 0.00 177.57 176.34 3h3f h VAL 124 N -1.10 0.00 0.01 7.19 -1.51 -1.40 -0.58 116.25 118.87 3h3f h VAL 124 Ca -0.04 0.00 -0.25 0.00 -1.23 0.00 0.00 66.70 65.18 3h3f h VAL 124 Cb 0.34 0.46 -0.03 0.00 -2.13 0.00 0.00 31.29 29.93 3h3f h VAL 124 CO 0.07 0.00 -1.30 0.50 -1.23 0.00 0.00 177.57 175.61 3h3f h LYS 125 N 0.00 0.02 0.00 5.19 3.64 -1.49 -2.70 116.57 121.23 3h3f h LYS 125 Ca 0.00 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 3h3f h LYS 125 Cb 0.43 0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.26 3h3f h LYS 125 CO 0.00 0.83 -1.69 0.66 -2.27 0.00 0.00 179.45 176.98 3h3f n TYR 126 N -3.25 0.12 -3.20 1.91 4.02 -0.63 -4.65 117.16 111.48 3h3f n TYR 126 Ca -0.07 0.03 -0.22 0.00 -0.01 0.00 0.00 57.90 57.63 3h3f n TYR 126 Cb 0.99 -0.48 -0.06 0.00 -0.02 0.00 0.00 39.34 39.78 3h3f n TYR 126 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 176.86 176.28 3h3f n SER 127 N -2.18 0.79 0.11 7.72 7.64 -0.32 -1.74 113.62 125.64 3h3f n SER 127 Ca -0.02 -2.88 0.20 0.00 1.01 0.00 0.00 58.87 57.17 3h3f n SER 127 Cb 0.53 -0.63 0.68 0.00 -1.01 0.00 0.00 64.21 63.78 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 3.64 0.00 -0.25 1.43 0.13 -1.70 -1.31 132.00 133.94 3h3f h PRO 128 Ca 0.09 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.20 3h3f h PRO 128 Cb 0.88 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.00 3h3f h PRO 128 CO 0.51 0.00 -0.00 0.72 -0.23 0.00 0.00 178.00 179.00 3h3f n HIS 129 N -3.41 0.89 -2.16 1.56 8.25 -1.26 -5.04 115.22 114.04 3h3f n HIS 129 Ca 0.07 -0.97 -0.27 0.00 -0.26 0.00 0.00 57.72 56.30 3h3f n HIS 129 Cb 0.72 -0.32 0.11 0.00 1.12 0.00 0.00 29.99 31.62 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 -5.45 3.80 -0.18 0.00 3.01 -0.52 -4.97 119.74 115.43 3h3f s LYS 131 Ca 0.65 0.28 -0.06 0.00 -1.01 0.00 0.00 55.97 55.83 3h3f s LYS 131 Cb -0.08 -3.20 -0.03 0.00 -1.01 0.00 0.00 37.83 33.50 3h3f s LYS 131 CO 0.47 0.71 0.03 -0.51 0.51 0.00 0.00 175.35 176.56 3h3f s LEU 132 N -1.10 3.55 -0.20 3.17 1.43 0.15 -2.01 118.68 123.67 3h3f s LEU 132 Ca 0.22 -0.04 -0.04 0.00 -1.03 0.00 0.00 54.13 53.25 3h3f s LEU 132 Cb -0.16 -1.89 -0.01 0.00 0.03 0.00 0.00 46.19 44.16 3h3f s LEU 132 CO 0.11 0.14 -0.04 -0.22 0.23 0.00 0.00 176.35 176.57 3h3f s LEU 133 N 0.54 2.97 -0.22 1.79 0.20 -0.07 -0.99 118.68 122.90 3h3f s LEU 133 Ca 0.01 -0.33 -0.09 0.00 0.69 0.00 0.00 54.13 54.41 3h3f s LEU 133 Cb -0.13 -1.74 -0.05 0.00 -0.43 0.00 0.00 46.19 43.84 3h3f s LEU 133 CO 0.02 0.03 0.12 -0.69 -0.29 0.00 0.00 176.35 175.54 3h3f s VAL 134 N 1.16 5.16 -0.03 1.68 1.01 0.69 -1.01 120.40 129.06 3h3f s VAL 134 Ca 0.02 0.11 0.01 0.00 0.00 0.00 0.00 61.98 62.12 3h3f s VAL 134 Cb -0.14 -3.38 -0.03 0.00 0.00 0.00 0.00 36.38 32.83 3h3f s VAL 134 CO -0.01 0.40 -0.01 0.52 0.00 0.00 0.00 175.10 176.00 3h3f n VAL 135 N 3.95 0.19 -1.49 2.92 0.31 0.27 -2.16 118.33 122.32 3h3f n VAL 135 Ca -0.16 -0.09 -0.42 0.00 -0.01 0.00 0.00 64.34 63.66 3h3f n VAL 135 Cb 0.52 -0.76 0.01 0.00 -0.91 0.00 0.00 33.84 32.70 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 -2.37 -0.33 -4.94 4.52 7.64 -1.19 -4.68 113.62 112.26 3h3f n SER 136 Ca -0.05 0.95 -0.25 0.00 1.01 0.00 0.00 58.87 60.53 3h3f n SER 136 Cb 0.57 -1.17 -0.03 0.00 -1.01 0.00 0.00 64.21 62.58 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 -0.90 6.35 -0.12 6.43 0.01 -1.26 -3.18 114.94 122.27 3h3f s ASN 137 Ca 0.63 0.25 -0.29 0.00 -0.71 0.00 0.00 52.86 52.74 3h3f s ASN 137 Cb -0.61 -1.94 -0.04 0.00 0.41 0.00 0.00 41.25 39.07 3h3f s ASN 137 CO 0.58 -0.03 1.55 -2.16 -1.51 0.00 0.00 177.10 175.52 3h3f s PRO 138 N -3.50 4.11 0.23 -0.60 0.04 -1.23 -4.70 135.00 129.35 3h3f s PRO 138 Ca 0.36 1.94 -0.03 0.00 0.04 0.00 0.00 61.00 63.31 3h3f s PRO 138 Cb -0.10 -3.94 0.25 0.00 0.04 0.00 0.00 34.50 30.74 3h3f s PRO 138 CO 0.29 -0.91 1.68 -0.24 0.04 0.00 0.00 177.00 177.86 3h3f h VAL 139 N 5.68 1.26 -0.15 -0.36 3.04 -1.82 -0.37 116.25 123.53 3h3f h VAL 139 Ca -0.35 -1.21 -0.01 0.00 -1.01 0.00 0.00 66.70 64.13 3h3f h VAL 139 Cb 1.15 1.09 -0.01 0.00 -2.01 0.00 0.00 31.29 31.51 3h3f h VAL 139 CO 0.97 0.41 0.07 0.44 -1.01 0.00 0.00 177.57 178.45 3h3f h ASP 140 N 0.69 0.20 -0.24 3.17 3.32 -1.87 0.31 116.42 122.00 3h3f h ASP 140 Ca 0.11 -0.12 -0.02 0.00 0.02 0.00 0.00 57.03 57.02 3h3f h ASP 140 Cb 0.62 -0.05 -0.01 0.00 0.22 0.00 0.00 39.33 40.11 3h3f h ASP 140 CO 0.04 0.27 0.08 0.40 -1.72 0.00 0.00 179.24 178.31 3h3f h ILE 141 N 0.12 1.19 0.00 0.35 2.04 -1.82 -2.22 117.51 117.17 3h3f h ILE 141 Ca 0.05 -0.59 -0.03 0.00 1.00 0.00 0.00 64.86 65.29 3h3f h ILE 141 Cb 0.12 1.12 -0.00 0.00 -0.74 0.00 0.00 36.82 37.32 3h3f h ILE 141 CO -0.01 0.19 -0.13 -0.07 0.00 0.00 0.00 178.15 178.13 3h3f h LEU 142 N 0.23 0.00 -0.39 1.44 3.38 -1.00 -1.90 115.31 117.07 3h3f h LEU 142 Ca 0.08 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.89 3h3f h LEU 142 Cb 0.22 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.97 3h3f h LEU 142 CO -0.00 0.13 -0.39 0.74 0.09 0.00 0.00 178.44 179.01 3h3f h THR 143 N 0.00 1.27 -0.30 0.22 2.02 0.12 -2.02 112.91 114.22 3h3f h THR 143 Ca -0.00 -1.57 0.02 0.00 0.77 0.00 0.00 66.41 65.63 3h3f h THR 143 Cb 0.52 1.39 -0.02 0.00 -1.74 0.00 0.00 68.15 68.30 3h3f h THR 143 CO 0.02 0.53 0.15 0.22 0.37 0.00 0.00 175.52 176.81 3h3f h TYR 144 N 0.77 0.28 -0.22 3.16 3.20 -1.20 -1.45 116.97 121.51 3h3f h TYR 144 Ca 0.06 0.01 0.04 0.00 3.14 0.00 0.00 58.73 61.98 3h3f h TYR 144 Cb 0.99 -0.08 -0.03 0.00 1.54 0.00 0.00 36.73 39.14 3h3f h TYR 144 CO 0.06 0.16 0.00 0.28 -1.64 0.00 0.00 178.16 177.02 3h3f h VAL 145 N 0.32 0.85 -0.84 1.81 2.07 -1.20 0.04 116.25 119.31 3h3f h VAL 145 Ca 0.12 -0.03 0.14 0.00 0.82 0.00 0.00 66.70 67.76 3h3f h VAL 145 Cb 0.04 0.77 -0.09 0.00 -1.52 0.00 0.00 31.29 30.48 3h3f h VAL 145 CO -0.08 0.01 0.43 0.00 0.02 0.00 0.00 177.57 177.95 3h3f h ALA 146 N 1.19 1.26 0.07 1.67 0.00 -1.26 -1.36 119.26 120.82 3h3f h ALA 146 Ca 0.10 0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.10 3h3f h ALA 146 Cb 0.13 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 3h3f h ALA 146 CO -0.17 -0.09 -0.08 2.35 0.00 0.00 0.00 179.25 181.26 3h3f h TRP 147 N 0.62 -0.20 0.06 0.00 7.01 -0.49 -1.55 115.95 121.40 3h3f h TRP 147 Ca 0.46 0.00 -0.00 0.00 2.11 0.00 0.00 58.89 61.45 3h3f h TRP 147 Cb 0.63 0.08 0.00 0.00 -2.10 0.00 0.00 29.16 27.78 3h3f h TRP 147 CO -0.09 -0.12 -0.03 0.87 -2.79 0.00 0.00 178.44 176.27 3h3f h LYS 148 N -0.17 -0.08 -0.90 2.65 1.79 -0.80 -2.83 116.57 116.22 3h3f h LYS 148 Ca 0.01 0.01 0.10 0.00 -2.18 0.00 0.00 60.65 58.58 3h3f h LYS 148 Cb 0.17 0.02 -0.07 0.00 -1.58 0.00 0.00 32.23 30.78 3h3f h LYS 148 CO -0.03 0.33 0.58 0.82 -1.08 0.00 0.00 179.45 180.07 3h3f h ILE 149 N -0.52 0.97 0.09 1.86 2.04 -1.33 -3.23 117.51 117.39 3h3f h ILE 149 Ca -0.01 -0.31 -0.27 0.00 1.00 0.00 0.00 64.86 65.27 3h3f h ILE 149 Cb 0.45 -0.02 0.01 0.00 -0.74 0.00 0.00 36.82 36.53 3h3f h ILE 149 CO 0.01 0.17 -1.15 0.77 0.00 0.00 0.00 178.15 177.95 3h3f h SER 150 N 0.91 0.60 0.00 1.72 4.64 -1.25 -3.46 113.55 116.71 3h3f h SER 150 Ca 0.42 -0.56 0.00 0.00 -0.47 0.00 0.00 61.79 61.18 3h3f h SER 150 Cb 0.40 -0.19 0.00 0.00 -0.31 0.00 0.00 62.40 62.30 3h3f h SER 150 CO -0.18 1.39 0.00 0.61 -0.87 0.00 0.00 176.83 177.78 3h3f n GLY 151 N 1.29 1.96 3.61 -0.77 0.00 -1.07 -5.04 105.19 105.17 3h3f n GLY 151 Ca -0.10 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.52 3h3f n GLY 151 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3h3f n PHE 152 N -2.00 1.10 -1.36 1.61 0.99 -1.26 -4.96 117.46 111.58 3h3f n PHE 152 Ca 0.00 0.52 -0.33 0.00 -0.00 0.00 0.00 57.45 57.64 3h3f n PHE 152 Cb 0.00 -2.21 0.09 0.00 -1.00 0.00 0.00 39.48 36.36 3h3f n PHE 152 CO 0.00 0.00 0.00 -1.25 -0.00 0.00 0.00 176.76 175.51 3h3f s PRO 153 N -2.20 2.14 0.25 -1.08 0.04 -1.26 -4.93 135.00 127.96 3h3f s PRO 153 Ca 0.66 1.52 0.25 0.00 0.04 0.00 0.00 61.00 63.47 3h3f s PRO 153 Cb -0.51 -1.86 0.62 0.00 0.04 0.00 0.00 34.50 32.79 3h3f s PRO 153 CO 0.55 -1.78 1.65 1.57 0.04 0.00 0.00 177.00 179.03 3h3f h LYS 154 N -0.63 0.00 0.00 4.56 2.10 -1.93 -2.10 116.57 118.57 3h3f h LYS 154 Ca -0.46 0.00 -0.00 0.00 -2.00 0.00 0.00 60.65 58.19 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 0.00 -0.02 -2.95 -2.00 0.00 0.00 179.45 174.98 3h3f h ASN 155 N 0.00 0.00 -0.05 7.07 -1.07 -1.88 -3.15 115.58 116.50 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 0.80 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 37.05 3h3f h ASN 155 CO 0.00 0.02 0.00 0.54 0.07 0.00 0.00 177.43 178.06 3h3f n ARG 156 N -3.55 2.16 -3.94 4.14 1.74 -0.79 -1.45 116.66 114.97 3h3f n ARG 156 Ca -0.03 -1.68 -0.35 0.00 -0.77 0.00 0.00 57.85 55.02 3h3f n ARG 156 Cb 0.11 -1.47 -0.14 0.00 -1.02 0.00 0.00 32.46 29.94 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 -1.97 2.94 -0.09 1.55 1.01 -1.19 -0.67 120.40 121.97 3h3f s VAL 157 Ca 0.31 -1.14 0.04 0.00 0.00 0.00 0.00 61.98 61.19 3h3f s VAL 157 Cb 0.20 -2.56 0.00 0.00 0.00 0.00 0.00 36.38 34.02 3h3f s VAL 157 CO 0.31 0.09 -0.23 -0.63 0.00 0.00 0.00 175.10 174.64 3h3f s ILE 158 N 1.30 1.98 -0.07 2.22 1.01 -0.16 -4.81 121.20 122.68 3h3f s ILE 158 Ca -0.02 -0.98 -0.02 0.00 0.00 0.00 0.00 60.65 59.64 3h3f s ILE 158 Cb -0.18 -1.71 -0.04 0.00 0.01 0.00 0.00 42.46 40.55 3h3f s ILE 158 CO -0.03 0.54 0.03 -0.83 0.00 0.00 0.00 174.94 174.65 3h3f s GLY 159 N 0.33 1.92 0.36 6.18 0.00 -0.23 -0.23 107.32 115.65 3h3f s GLY 159 Ca -0.17 -0.81 0.07 0.00 0.00 0.00 0.00 44.72 43.81 3h3f s GLY 159 CO 0.08 -0.60 1.91 1.48 0.00 0.00 0.00 173.10 175.97 3h3f h SER 160 N 4.88 0.37 0.00 1.64 4.64 -1.75 1.03 113.55 124.36 3h3f h SER 160 Ca -0.51 -0.07 0.00 0.00 -0.47 0.00 0.00 61.79 60.74 3h3f h SER 160 Cb 1.19 -0.10 0.00 0.00 -0.31 0.00 0.00 62.40 63.19 3h3f h SER 160 CO 0.56 0.47 0.00 0.61 -0.87 0.00 0.00 176.83 177.60 3h3f n GLY 161 N -0.92 2.06 0.22 -0.77 0.00 -1.26 -1.32 105.19 103.20 3h3f n GLY 161 Ca 0.01 -0.12 0.00 0.00 0.00 0.00 0.00 46.02 45.91 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 0.09 1.06 0.10 0.00 -1.24 -0.26 0.96 115.58 116.29 3h3f h ASN 163 Ca 0.00 -0.10 -0.00 0.00 0.71 0.00 0.00 56.30 56.91 3h3f h ASN 163 Cb 0.17 -0.27 0.00 0.00 0.73 0.00 0.00 38.32 38.95 3h3f h ASN 163 CO 0.00 0.86 -0.05 0.25 -1.29 0.00 0.00 177.43 177.20 3h3f h LEU 164 N 1.19 -0.11 -0.99 0.34 5.85 -1.78 -2.23 115.31 117.58 3h3f h LEU 164 Ca 0.30 -0.47 0.25 0.00 0.84 0.00 0.00 57.88 58.79 3h3f h LEU 164 Cb 0.04 0.03 -0.13 0.00 0.37 0.00 0.00 40.66 40.97 3h3f h LEU 164 CO -0.05 0.49 0.57 0.44 -0.34 0.00 0.00 178.44 179.55 3h3f h ASP 165 N -0.78 0.61 0.09 1.25 5.19 -1.78 0.11 116.42 121.12 3h3f h ASP 165 Ca -0.01 0.15 -0.24 0.00 -0.62 0.00 0.00 57.03 56.30 3h3f h ASP 165 Cb 0.58 0.06 0.01 0.00 0.18 0.00 0.00 39.33 40.15 3h3f h ASP 165 CO 0.02 0.06 -0.92 0.28 -3.12 0.00 0.00 179.24 175.56 3h3f h SER 166 N 0.53 0.77 -0.28 6.45 0.02 -0.78 -1.58 113.55 118.68 3h3f h SER 166 Ca 0.64 -0.58 -0.07 0.00 -0.84 0.00 0.00 61.79 60.95 3h3f h SER 166 Cb 1.26 -0.23 -0.02 0.00 0.14 0.00 0.00 62.40 63.54 3h3f h SER 166 CO -0.50 1.37 -0.04 0.00 -1.14 0.00 0.00 176.83 176.53 3h3f h ALA 167 N 0.59 1.21 -0.08 3.77 0.00 -0.79 -1.82 119.26 122.15 3h3f h ALA 167 Ca -0.09 -0.25 -0.22 0.00 0.00 0.00 0.00 54.91 54.35 3h3f h ALA 167 Cb 1.56 -0.16 0.01 0.00 0.00 0.00 0.00 17.79 19.19 3h3f h ALA 167 CO 0.18 0.52 -0.85 0.00 0.00 0.00 0.00 179.25 179.09 3h3f h ARG 168 N 0.60 0.64 -0.51 0.00 3.08 -0.59 -2.05 114.38 115.54 3h3f h ARG 168 Ca 0.12 -0.57 -0.01 0.00 0.07 0.00 0.00 59.98 59.58 3h3f h ARG 168 Cb 0.43 0.14 -0.02 0.00 0.08 0.00 0.00 29.97 30.59 3h3f h ARG 168 CO 0.02 1.19 0.27 0.35 -1.07 0.00 0.00 179.97 180.73 3h3f h PHE 169 N 0.41 0.71 -0.03 3.04 3.04 -1.17 -1.70 116.94 121.24 3h3f h PHE 169 Ca -0.07 -0.02 -0.10 0.00 3.98 0.00 0.00 57.97 61.76 3h3f h PHE 169 Cb 1.47 -0.23 -0.01 0.00 2.56 0.00 0.00 35.95 39.74 3h3f h PHE 169 CO 0.08 0.54 -0.45 0.00 -2.02 0.00 0.00 178.31 176.46 3h3f h ARG 170 N 0.68 0.08 -0.22 1.11 3.08 -1.32 0.62 114.38 118.42 3h3f h ARG 170 Ca 0.18 -0.04 -0.01 0.00 0.07 0.00 0.00 59.98 60.18 3h3f h ARG 170 Cb 0.07 -0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.11 3h3f h ARG 170 CO -0.03 0.51 0.11 -0.92 -1.07 0.00 0.00 179.97 178.57 3h3f h TYR 171 N 0.07 0.31 -0.15 3.04 3.20 -1.22 -2.61 116.97 119.60 3h3f h TYR 171 Ca 0.00 -0.01 -0.13 0.00 3.14 0.00 0.00 58.73 61.73 3h3f h TYR 171 Cb 0.82 -0.10 -0.01 0.00 1.54 0.00 0.00 36.73 38.98 3h3f h TYR 171 CO 0.00 0.31 -0.45 -0.07 -1.64 0.00 0.00 178.16 176.31 3h3f h LEU 172 N 0.23 0.40 -0.48 2.82 3.38 -0.63 -2.84 115.31 118.18 3h3f h LEU 172 Ca 0.08 -0.18 -0.12 0.00 0.09 0.00 0.00 57.88 57.74 3h3f h LEU 172 Cb 0.11 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 3h3f h LEU 172 CO -0.01 0.80 -0.19 -0.03 0.09 0.00 0.00 178.44 179.10 3h3f h MET 173 N 0.30 0.97 -0.54 1.13 1.85 -0.90 -1.85 114.93 115.90 3h3f h MET 173 Ca 0.02 -0.41 -0.08 0.00 -0.61 0.00 0.00 59.70 58.63 3h3f h MET 173 Cb 0.92 -0.04 -0.02 0.00 0.43 0.00 0.00 31.60 32.89 3h3f h MET 173 CO 0.08 1.08 0.02 0.78 -0.40 0.00 0.00 176.91 178.46 3h3f h GLY 174 N 0.83 0.97 1.03 1.39 0.00 -1.49 -1.13 103.07 104.68 3h3f h GLY 174 Ca 0.11 -0.66 -0.04 0.00 0.00 0.00 0.00 47.33 46.74 3h3f h GLY 174 CO 0.06 0.61 0.32 -2.09 0.00 0.00 0.00 176.54 175.44 3h3f h GLU 175 N 0.84 1.12 -0.63 4.80 4.81 -1.38 3.18 114.58 127.32 3h3f h GLU 175 Ca 0.16 -0.19 -0.05 0.00 -0.13 0.00 0.00 59.36 59.15 3h3f h GLU 175 Cb 0.47 -0.19 -0.03 0.00 0.63 0.00 0.00 28.75 29.64 3h3f h GLU 175 CO 0.02 0.90 0.20 0.00 -0.73 0.00 0.00 179.01 179.41 3h3f h ARG 176 N 1.08 0.97 0.00 1.92 3.08 -1.12 -3.30 114.38 117.02 3h3f h ARG 176 Ca 0.25 -0.20 -0.02 0.00 0.07 0.00 0.00 59.98 60.08 3h3f h ARG 176 Cb 0.19 -0.14 -0.00 0.00 0.08 0.00 0.00 29.97 30.10 3h3f h ARG 176 CO -0.02 0.85 -1.22 1.28 -1.07 0.00 0.00 179.97 179.78 3h3f n LEU 177 N -4.38 0.69 0.00 3.04 4.32 -0.45 -4.99 117.00 115.24 3h3f n LEU 177 Ca 0.04 0.27 0.00 0.00 -0.02 0.00 0.00 56.01 56.30 3h3f n LEU 177 Cb 0.21 -0.03 0.00 0.00 -1.62 0.00 0.00 43.42 41.97 3h3f n LEU 177 CO 0.40 -0.12 0.00 0.61 -1.22 0.00 0.00 177.39 177.06 3h3f n GLY 178 N 1.22 0.84 3.22 -0.72 0.00 1.05 -5.04 105.19 105.76 3h3f n GLY 178 Ca -0.02 -0.63 -0.20 0.00 0.00 0.00 0.00 46.02 45.17 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 -2.00 1.34 0.45 1.61 1.01 -0.54 -5.02 120.40 117.26 3h3f s VAL 179 Ca 0.00 -1.46 -0.25 0.00 0.00 0.00 0.00 61.98 60.27 3h3f s VAL 179 Cb 0.00 -1.31 -0.08 0.00 0.00 0.00 0.00 36.38 34.99 3h3f s VAL 179 CO 0.00 -0.21 1.38 -2.28 0.00 0.00 0.00 175.10 173.99 3h3f s HIS 180 N -1.40 2.54 0.31 5.22 5.65 -1.26 -4.21 115.29 122.13 3h3f s HIS 180 Ca 0.03 1.33 0.05 0.00 0.25 0.00 0.00 55.06 56.71 3h3f s HIS 180 Cb -0.09 -3.82 0.69 0.00 -1.18 0.00 0.00 32.58 28.18 3h3f s HIS 180 CO 0.03 -2.67 1.82 0.00 -0.65 0.00 0.00 174.74 173.27 3h3f h ALA 181 N 2.28 1.66 -0.52 1.58 0.00 -1.91 0.64 119.26 122.99 3h3f h ALA 181 Ca -0.50 0.04 0.15 0.00 0.00 0.00 0.00 54.91 54.60 3h3f h ALA 181 Cb 1.26 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.89 3h3f h ALA 181 CO 0.61 0.04 0.68 -0.07 0.00 0.00 0.00 179.25 180.51 3h3f h LEU 182 N 0.84 0.00 -0.72 0.00 4.07 -1.91 -1.58 115.31 116.01 3h3f h LEU 182 Ca 0.52 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.48 3h3f h LEU 182 Cb 0.72 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.46 3h3f h LEU 182 CO -0.30 0.00 -0.40 -1.20 -1.08 0.00 0.00 178.44 175.46 3h3f n SER 183 N -3.42 1.45 -4.70 -0.43 7.64 0.22 -4.89 113.62 109.48 3h3f n SER 183 Ca 0.10 -1.22 -0.38 0.00 1.01 0.00 0.00 58.87 58.38 3h3f n SER 183 Cb 0.87 0.57 -0.07 0.00 -1.01 0.00 0.00 64.21 64.56 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 0.95 3.08 0.00 0.00 0.09 -0.88 -4.89 115.29 113.64 3h3f s HIS 185 Ca 0.21 0.11 0.00 0.00 -0.00 0.00 0.00 55.06 55.37 3h3f s HIS 185 Cb -0.14 -1.78 0.00 0.00 -0.00 0.00 0.00 32.58 30.66 3h3f s HIS 185 CO 0.08 0.39 0.00 0.41 -0.00 0.00 0.00 174.74 175.62 3h3f n GLY 186 N 2.27 2.76 3.14 -2.22 0.00 -1.26 -2.86 105.19 107.01 3h3f n GLY 186 Ca -0.18 -0.04 -0.32 0.00 0.00 0.00 0.00 46.02 45.48 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 -0.77 2.53 -0.27 1.61 0.52 -1.26 -4.80 118.94 116.50 3h3f s TRP 187 Ca 0.00 -1.30 -0.11 0.00 0.02 0.00 0.00 56.10 54.72 3h3f s TRP 187 Cb 0.00 -1.75 -0.05 0.00 -1.15 0.00 0.00 33.47 30.53 3h3f s TRP 187 CO 0.00 -0.61 0.18 0.42 0.02 0.00 0.00 176.95 176.95 3h3f s ILE 188 N 0.92 5.23 0.23 2.03 -1.09 -1.26 -0.78 121.20 126.48 3h3f s ILE 188 Ca -0.05 0.14 0.00 0.00 -2.23 0.00 0.00 60.65 58.51 3h3f s ILE 188 Cb -0.15 -3.48 -0.00 0.00 -1.58 0.00 0.00 42.46 37.25 3h3f s ILE 188 CO -0.03 0.27 0.00 0.18 -1.23 0.00 0.00 174.94 174.13 3h3f n LEU 189 N 4.95 0.00 0.00 2.97 4.77 0.20 -4.74 117.00 125.15 3h3f n LEU 189 Ca -0.14 -1.48 0.00 0.00 -0.03 0.00 0.00 56.01 54.36 3h3f n LEU 189 Cb 0.52 0.19 0.00 0.00 -2.33 0.00 0.00 43.42 41.80 3h3f n LEU 189 CO 0.33 -0.21 0.00 0.61 -1.33 0.00 0.00 177.39 176.79 3h3f n GLY 190 N 2.09 0.48 3.80 -0.72 0.00 -0.59 -0.71 105.19 109.53 3h3f n GLY 190 Ca -0.09 -0.95 -0.38 0.00 0.00 0.00 0.00 46.02 44.59 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 4.17 0.25 1.61 2.02 -1.26 -1.52 118.70 123.96 3h3f s GLU 191 Ca 0.00 0.64 -0.31 0.00 0.02 0.00 0.00 54.97 55.31 3h3f s GLU 191 Cb 0.00 -3.27 -0.12 0.00 0.10 0.00 0.00 34.13 30.84 3h3f s GLU 191 CO 0.00 0.56 1.56 1.58 0.02 0.00 0.00 175.26 178.99 3h3f n HIS 192 N 2.09 2.56 -1.09 1.61 -0.00 -1.26 -2.62 115.22 116.50 3h3f n HIS 192 Ca -0.10 0.27 0.00 0.00 -0.00 0.00 0.00 57.72 57.89 3h3f n HIS 192 Cb 0.51 -2.56 0.00 0.00 -0.00 0.00 0.00 29.99 27.94 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 2.63 0.87 0.49 1.57 0.00 -1.26 -4.64 105.19 104.86 3h3f n GLY 193 Ca 0.12 -1.45 0.32 0.00 0.00 0.00 0.00 46.02 45.02 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 2.45 0.19 -0.17 1.61 5.19 -1.85 -2.94 116.42 120.90 3h3f h ASP 194 Ca 0.00 0.05 -0.19 0.00 -0.62 0.00 0.00 57.03 56.27 3h3f h ASP 194 Cb 0.00 0.02 -0.30 0.00 0.18 0.00 0.00 39.33 39.24 3h3f h ASP 194 CO 0.00 0.00 -0.89 -1.54 -3.12 0.00 0.00 179.24 173.69 3h3f n SER 195 N -4.39 1.75 -4.71 6.45 3.41 -1.26 -5.03 113.62 109.84 3h3f n SER 195 Ca 0.29 -2.69 -0.35 0.00 -0.26 0.00 0.00 58.87 55.86 3h3f n SER 195 Cb 1.20 -0.40 0.11 0.00 -0.26 0.00 0.00 64.21 64.86 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 -2.86 3.94 -0.24 4.04 1.04 -1.08 -4.39 113.70 114.16 3h3f s SER 196 Ca 0.36 2.46 -0.06 0.00 0.48 0.00 0.00 55.95 59.18 3h3f s SER 196 Cb 0.37 -2.60 -0.02 0.00 0.10 0.00 0.00 66.02 63.88 3h3f s SER 196 CO -0.09 -2.44 0.02 -0.69 0.98 0.00 0.00 173.24 171.02 3h3f s VAL 197 N -1.89 3.87 -0.20 5.02 1.01 0.11 -4.91 120.40 123.41 3h3f s VAL 197 Ca 0.76 -0.34 -0.26 0.00 0.00 0.00 0.00 61.98 62.15 3h3f s VAL 197 Cb -0.32 -2.80 -0.01 0.00 0.00 0.00 0.00 36.38 33.26 3h3f s VAL 197 CO 0.47 0.36 0.87 -2.16 0.00 0.00 0.00 175.10 174.64 3h3f s PRO 198 N 1.55 4.25 -0.87 2.72 0.04 -1.26 0.59 135.00 142.02 3h3f s PRO 198 Ca 0.06 1.06 -0.17 0.00 0.04 0.00 0.00 61.00 61.99 3h3f s PRO 198 Cb -0.15 -3.61 0.15 0.00 0.04 0.00 0.00 34.50 30.93 3h3f s PRO 198 CO 0.00 -0.45 0.99 0.08 0.04 0.00 0.00 177.00 177.67 3h3f s VAL 199 N 2.58 4.98 0.33 -0.36 1.01 0.04 -4.85 120.40 124.12 3h3f s VAL 199 Ca 0.38 -1.76 0.05 0.00 0.00 0.00 0.00 61.98 60.65 3h3f s VAL 199 Cb -0.16 -4.67 0.13 0.00 0.00 0.00 0.00 36.38 31.68 3h3f s VAL 199 CO 0.10 -1.35 1.83 -0.50 0.00 0.00 0.00 175.10 175.18 3h3f h TRP 200 N 8.58 0.46 -0.09 5.22 4.06 -1.95 -2.76 115.95 129.48 3h3f h TRP 200 Ca 0.10 -0.07 0.03 0.00 2.06 0.00 0.00 58.89 61.01 3h3f h TRP 200 Cb 1.03 -0.13 -0.00 0.00 -1.00 0.00 0.00 29.16 29.06 3h3f h TRP 200 CO 1.10 0.55 0.14 0.66 -3.56 0.00 0.00 178.44 177.33 3h3f h SER 201 N 0.41 0.00 -0.28 -3.49 4.64 -1.97 -3.05 113.55 109.81 3h3f h SER 201 Ca 0.08 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.40 3h3f h SER 201 Cb 0.46 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.55 3h3f h SER 201 CO 0.03 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.60 3h3f n GLY 202 N -1.30 3.79 3.71 -0.77 0.00 -1.04 -4.89 105.19 104.70 3h3f n GLY 202 Ca -0.01 -0.93 -0.41 0.00 0.00 0.00 0.00 46.02 44.68 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 -2.51 4.52 0.04 1.61 -1.94 -1.15 -4.38 119.30 115.48 3h3f s MET 203 Ca 0.39 1.23 -0.27 0.00 -1.71 0.00 0.00 55.69 55.32 3h3f s MET 203 Cb 0.31 -3.45 0.07 0.00 2.01 0.00 0.00 34.83 33.77 3h3f s MET 203 CO 0.10 0.00 0.67 0.54 -0.01 0.00 0.00 175.02 176.33 3h3f s ASN 204 N 0.90 -0.59 -0.11 3.03 4.22 -1.14 -0.73 114.94 120.53 3h3f s ASN 204 Ca 0.47 0.36 0.02 0.00 -2.14 0.00 0.00 52.86 51.57 3h3f s ASN 204 Cb -0.20 0.55 -0.01 0.00 1.28 0.00 0.00 41.25 42.87 3h3f s ASN 204 CO 0.24 -0.75 -0.19 -0.69 -2.04 0.00 0.00 177.10 173.68 3h3f s VAL 205 N -2.38 2.52 -1.85 3.54 1.01 -1.18 -2.08 120.40 119.99 3h3f s VAL 205 Ca -0.05 -0.86 0.00 0.00 0.00 0.00 0.00 61.98 61.08 3h3f s VAL 205 Cb -0.01 -2.01 0.00 0.00 0.00 0.00 0.00 36.38 34.37 3h3f s VAL 205 CO -0.01 0.55 0.00 0.00 0.00 0.00 0.00 175.10 175.63 3h3f n ALA 206 N 3.46 -0.55 -0.74 5.51 0.00 -1.26 -0.34 120.51 126.59 3h3f n ALA 206 Ca -0.18 0.20 0.00 0.00 0.00 0.00 0.00 53.44 53.46 3h3f n ALA 206 Cb 0.53 -2.14 0.00 0.00 0.00 0.00 0.00 19.45 17.83 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 -0.90 0.79 3.46 0.00 0.00 -1.26 -4.98 105.19 102.30 3h3f n GLY 207 Ca -0.24 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.35 3h3f n GLY 207 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3h3f s VAL 208 N -3.01 4.34 -0.19 1.61 1.01 0.53 -4.99 120.40 119.69 3h3f s VAL 208 Ca 0.00 -0.49 -0.35 0.00 0.00 0.00 0.00 61.98 61.14 3h3f s VAL 208 Cb 0.00 -4.72 -0.12 0.00 0.00 0.00 0.00 36.38 31.54 3h3f s VAL 208 CO 0.00 -1.50 1.95 -0.24 0.00 0.00 0.00 175.10 175.32 3h3f n SER 209 N 7.67 2.95 -0.13 3.32 2.88 -1.26 -3.10 113.62 125.96 3h3f n SER 209 Ca 0.01 0.81 -0.07 0.00 -1.33 0.00 0.00 58.87 58.29 3h3f n SER 209 Cb 0.46 -1.32 0.09 0.00 -0.75 0.00 0.00 64.21 62.70 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 10.00 0.85 -1.00 2.46 4.07 -1.25 -2.94 115.31 127.50 3h3f h LEU 210 Ca -0.43 -0.26 -0.09 0.00 0.08 0.00 0.00 57.88 57.19 3h3f h LEU 210 Cb 1.29 -0.23 -0.01 0.00 1.08 0.00 0.00 40.66 42.79 3h3f h LEU 210 CO 0.97 0.97 -0.41 0.50 -1.08 0.00 0.00 178.44 179.40 3h3f h LYS 211 N 0.77 0.00 0.00 1.13 3.64 -1.77 -1.40 116.57 118.94 3h3f h LYS 211 Ca 0.13 0.00 -0.16 0.00 -1.27 0.00 0.00 60.65 59.35 3h3f h LYS 211 Cb 0.61 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.41 3h3f h LYS 211 CO 0.04 0.41 -0.74 1.15 -2.27 0.00 0.00 179.45 178.03 3h3f h THR 212 N 0.00 1.51 -0.00 1.00 2.02 -1.93 -2.24 112.91 113.28 3h3f h THR 212 Ca -0.00 -2.57 -0.21 0.00 0.77 0.00 0.00 66.41 64.40 3h3f h THR 212 Cb 0.87 2.39 -0.00 0.00 -1.74 0.00 0.00 68.15 69.67 3h3f h THR 212 CO 0.05 0.73 -0.90 0.25 0.37 0.00 0.00 175.52 176.02 3h3f h LEU 213 N 0.00 0.43 -6.46 2.58 5.85 -1.33 -3.41 115.31 112.97 3h3f h LEU 213 Ca -0.01 -0.34 -0.59 0.00 0.84 0.00 0.00 57.88 57.78 3h3f h LEU 213 Cb 1.33 -0.13 -0.39 0.00 0.37 0.00 0.00 40.66 41.85 3h3f h LEU 213 CO 0.10 1.14 -0.92 -2.28 -0.34 0.00 0.00 178.44 176.13 3h3f s HIS 214 N -3.27 1.33 0.61 1.25 2.46 -0.54 -5.02 115.29 112.11 3h3f s HIS 214 Ca -0.05 -2.39 0.27 0.00 0.47 0.00 0.00 55.06 53.37 3h3f s HIS 214 Cb 0.09 -1.12 1.29 0.00 -0.13 0.00 0.00 32.58 32.72 3h3f s HIS 214 CO 0.85 -0.80 1.70 -1.35 -2.47 0.00 0.00 174.74 172.67 3h3f h PRO 215 N 5.72 0.00 0.00 2.88 0.11 -1.64 0.28 132.00 139.35 3h3f h PRO 215 Ca 0.24 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.35 3h3f h PRO 215 Cb 0.90 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.01 3h3f h PRO 215 CO 0.40 0.00 0.00 0.39 -0.21 0.00 0.00 178.00 178.58 3h3f n GLU 216 N -3.43 0.26 -1.57 1.05 4.71 -1.26 -4.92 120.64 115.49 3h3f n GLU 216 Ca 0.11 0.06 -0.61 0.00 -0.01 0.00 0.00 57.16 56.71 3h3f n GLU 216 Cb 0.88 -1.50 -0.09 0.00 -1.01 0.00 0.00 31.44 29.72 3h3f n GLU 216 CO 0.00 0.00 0.00 -0.11 0.09 0.00 0.00 177.13 177.11 3h3f n LEU 217 N -1.34 1.02 -1.84 -4.62 7.94 0.98 -0.25 117.00 118.88 3h3f n LEU 217 Ca 0.10 1.07 -0.19 0.00 -1.11 0.00 0.00 56.01 55.89 3h3f n LEU 217 Cb 0.22 -0.80 -0.04 0.00 0.53 0.00 0.00 43.42 43.34 3h3f n LEU 217 CO 0.20 -0.82 -0.21 0.61 -1.11 0.00 0.00 177.39 176.05 3h3f n GLY 218 N 3.46 0.52 0.00 -3.96 0.00 -1.26 -5.01 105.19 98.94 3h3f n GLY 218 Ca 0.27 -0.11 0.00 0.00 0.00 0.00 0.00 46.02 46.19 3h3f n GLY 218 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3h3f n THR 219 N -3.37 0.00 1.18 2.61 -2.24 0.65 -4.83 114.28 108.28 3h3f n THR 219 Ca -0.21 0.00 0.12 0.00 -2.27 0.00 0.00 64.05 61.70 3h3f n THR 219 Cb 0.65 -0.77 0.25 0.00 -2.10 0.00 0.00 70.33 68.36 3h3f n THR 219 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 3h3f n ASP 220 N -1.48 1.66 0.08 3.42 10.43 -1.26 -3.55 116.55 125.84 3h3f n ASP 220 Ca 0.00 -1.32 0.13 0.00 2.57 0.00 0.00 54.79 56.17 3h3f n ASP 220 Cb 0.00 0.20 0.42 0.00 1.84 0.00 0.00 41.12 43.58 3h3f n ASP 220 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 3h3f n ALA 221 N -0.07 2.37 -1.81 2.24 0.00 -1.26 -4.82 120.51 117.15 3h3f n ALA 221 Ca 0.13 -0.06 -0.42 0.00 0.00 0.00 0.00 53.44 53.08 3h3f n ALA 221 Cb 0.42 -1.44 -0.03 0.00 0.00 0.00 0.00 19.45 18.40 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 -4.24 5.61 0.45 0.00 2.15 -1.23 -4.80 116.67 114.61 3h3f s ASP 222 Ca 0.11 1.51 0.22 0.00 0.43 0.00 0.00 52.55 54.81 3h3f s ASP 222 Cb 0.14 -2.52 1.07 0.00 -0.30 0.00 0.00 42.92 41.30 3h3f s ASP 222 CO 0.60 -1.90 1.92 0.07 -0.17 0.00 0.00 175.17 175.69 3h3f h LYS 223 N 14.21 0.00 -0.08 4.34 -0.00 -1.93 -2.77 116.57 130.34 3h3f h LYS 223 Ca -0.36 0.00 0.00 0.00 -0.00 0.00 0.00 60.65 60.29 3h3f h LYS 223 Cb 1.20 0.00 0.00 0.00 -0.00 0.00 0.00 32.23 33.43 3h3f h LYS 223 CO 1.01 0.23 0.00 0.39 -0.00 0.00 0.00 179.45 181.09 3h3f n GLU 224 N -3.70 2.13 -3.58 0.07 1.02 -1.26 -4.99 120.64 110.33 3h3f n GLU 224 Ca -0.01 -1.66 -0.25 0.00 -0.02 0.00 0.00 57.16 55.22 3h3f n GLU 224 Cb 0.35 -1.47 0.05 0.00 -0.02 0.00 0.00 31.44 30.35 3h3f n GLU 224 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 3h3f n GLN 225 N 0.98 -2.25 0.00 3.49 6.02 -1.05 -4.89 117.38 119.69 3h3f n GLN 225 Ca 0.16 0.59 0.13 0.00 -0.01 0.00 0.00 57.00 57.87 3h3f n GLN 225 Cb 0.52 -4.77 0.70 0.00 1.02 0.00 0.00 30.24 27.71 3h3f n GLN 225 CO 0.00 0.00 0.00 0.91 -1.01 0.00 0.00 177.06 176.96 3h3f n TRP 226 N -3.97 0.00 -0.02 1.08 7.02 -1.26 -1.97 117.44 118.32 3h3f n TRP 226 Ca -0.13 0.00 -0.09 0.00 -1.02 0.00 0.00 57.50 56.25 3h3f n TRP 226 Cb 0.62 -0.17 0.06 0.00 -2.42 0.00 0.00 31.31 29.40 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 0.00 0.63 -0.00 -0.99 1.57 -1.88 -2.84 116.57 113.06 3h3f h LYS 227 Ca 0.00 -0.35 0.00 0.00 -1.87 0.00 0.00 60.65 58.43 3h3f h LYS 227 Cb 0.14 0.02 -0.00 0.00 0.08 0.00 0.00 32.23 32.47 3h3f h LYS 227 CO 0.00 0.96 0.00 1.96 -0.57 0.00 0.00 179.45 181.81 3h3f h GLN 228 N 0.51 0.00 -0.22 3.15 1.08 -1.78 0.49 115.11 118.34 3h3f h GLN 228 Ca 0.03 0.00 -0.08 0.00 -1.45 0.00 0.00 58.65 57.15 3h3f h GLN 228 Cb 1.00 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 28.42 3h3f h GLN 228 CO 0.09 0.00 -0.17 0.28 -0.95 0.00 0.00 178.83 178.09 3h3f h VAL 229 N 0.00 1.32 -0.18 -0.54 2.07 -1.62 0.43 116.25 117.72 3h3f h VAL 229 Ca 0.00 -1.29 -0.04 0.00 0.82 0.00 0.00 66.70 66.19 3h3f h VAL 229 Cb 0.01 1.67 -0.01 0.00 -1.52 0.00 0.00 31.29 31.45 3h3f h VAL 229 CO -0.00 0.40 -0.02 -0.74 0.02 0.00 0.00 177.57 177.22 3h3f h HIS 230 N 0.20 0.38 -0.94 1.57 -0.00 -1.33 -1.63 115.15 113.40 3h3f h HIS 230 Ca 0.04 -0.08 0.21 0.00 -0.00 0.00 0.00 60.37 60.55 3h3f h HIS 230 Cb 0.69 -0.10 -0.12 0.00 -0.00 0.00 0.00 27.41 27.89 3h3f h HIS 230 CO 0.07 0.58 0.50 -0.22 -0.00 0.00 0.00 177.93 178.86 3h3f h LYS 231 N 0.07 0.54 -0.61 5.26 1.63 0.03 0.75 116.57 124.24 3h3f h LYS 231 Ca 0.05 -0.03 -0.09 0.00 -0.85 0.00 0.00 60.65 59.72 3h3f h LYS 231 Cb 0.44 -0.12 -0.02 0.00 -0.60 0.00 0.00 32.23 31.93 3h3f h LYS 231 CO 0.01 0.36 0.01 1.96 -3.45 0.00 0.00 179.45 178.34 3h3f h GLN 232 N 0.55 1.07 0.11 1.90 4.20 0.37 -1.87 115.11 121.44 3h3f h GLN 232 Ca 0.57 -0.33 0.02 0.00 0.06 0.00 0.00 58.65 58.97 3h3f h GLN 232 Cb 1.01 -0.10 -0.03 0.00 0.30 0.00 0.00 27.48 28.66 3h3f h GLN 232 CO -0.46 1.03 -0.24 0.28 -0.67 0.00 0.00 178.83 178.77 3h3f h VAL 233 N 0.98 0.46 -0.77 -0.54 2.07 -0.26 -2.70 116.25 115.48 3h3f h VAL 233 Ca 0.18 0.00 0.18 0.00 0.82 0.00 0.00 66.70 67.87 3h3f h VAL 233 Cb 0.54 0.46 -0.12 0.00 -1.52 0.00 0.00 31.29 30.66 3h3f h VAL 233 CO 0.03 0.00 0.18 0.58 0.02 0.00 0.00 177.57 178.38 3h3f h VAL 234 N -0.44 0.46 -0.14 2.57 2.07 -0.64 -2.75 116.25 117.39 3h3f h VAL 234 Ca 0.03 -0.09 0.00 0.00 0.82 0.00 0.00 66.70 67.46 3h3f h VAL 234 Cb 0.47 0.19 0.00 0.00 -1.52 0.00 0.00 31.29 30.42 3h3f h VAL 234 CO -0.14 0.05 0.00 0.47 0.02 0.00 0.00 177.57 177.96 3h3f n ASP 235 N -5.18 2.01 0.06 0.57 8.00 -0.73 -4.50 116.55 116.80 3h3f n ASP 235 Ca 0.16 -1.72 -0.15 0.00 0.71 0.00 0.00 54.79 53.78 3h3f n ASP 235 Cb 0.51 -0.09 -0.06 0.00 -0.02 0.00 0.00 41.12 41.46 3h3f n ASP 235 CO 0.00 0.00 0.00 0.77 -0.39 0.00 0.00 177.20 177.58 3h3f h SER 236 N 2.83 0.61 -0.62 -2.24 4.64 -1.16 -2.86 113.55 114.76 3h3f h SER 236 Ca 0.00 -0.50 0.05 0.00 -0.47 0.00 0.00 61.79 60.87 3h3f h SER 236 Cb 0.61 -0.19 -0.05 0.00 -0.31 0.00 0.00 62.40 62.46 3h3f h SER 236 CO 0.00 1.30 0.33 0.00 -0.87 0.00 0.00 176.83 177.60 3h3f h ALA 237 N 0.65 0.81 -0.26 5.18 0.00 -1.80 0.58 119.26 124.43 3h3f h ALA 237 Ca -0.10 0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.80 3h3f h ALA 237 Cb 1.63 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 19.30 3h3f h ALA 237 CO 0.18 0.01 0.01 -0.92 0.00 0.00 0.00 179.25 178.52 3h3f h TYR 238 N 0.63 0.39 0.15 0.00 3.20 -1.86 -0.78 116.97 118.69 3h3f h TYR 238 Ca 0.27 -0.03 -0.27 0.00 3.14 0.00 0.00 58.73 61.84 3h3f h TYR 238 Cb 0.16 -0.12 0.01 0.00 1.54 0.00 0.00 36.73 38.33 3h3f h TYR 238 CO -0.09 0.39 -1.34 0.93 -1.64 0.00 0.00 178.16 176.41 3h3f h GLU 239 N 0.37 0.31 0.04 1.82 4.39 -0.93 -2.00 114.58 118.58 3h3f h GLU 239 Ca 0.09 -0.53 -0.00 0.00 0.34 0.00 0.00 59.36 59.26 3h3f h GLU 239 Cb 0.24 0.20 0.00 0.00 -0.10 0.00 0.00 28.75 29.08 3h3f h GLU 239 CO 0.00 1.25 -0.02 0.28 -1.16 0.00 0.00 179.01 179.37 3h3f h VAL 240 N -0.21 1.06 -0.86 3.13 2.07 0.15 -2.50 116.25 119.09 3h3f h VAL 240 Ca -0.27 -0.31 0.20 0.00 0.82 0.00 0.00 66.70 67.15 3h3f h VAL 240 Cb 1.83 1.26 -0.12 0.00 -1.52 0.00 0.00 31.29 32.74 3h3f h VAL 240 CO 0.12 0.08 0.34 0.40 0.02 0.00 0.00 177.57 178.53 3h3f h ILE 241 N -0.19 0.50 0.00 4.57 2.04 -1.21 0.20 117.51 123.42 3h3f h ILE 241 Ca -0.01 -0.13 -0.06 0.00 1.00 0.00 0.00 64.86 65.66 3h3f h ILE 241 Cb 0.17 0.08 -0.01 0.00 -0.74 0.00 0.00 36.82 36.32 3h3f h ILE 241 CO 0.01 0.07 -0.29 0.50 0.00 0.00 0.00 178.15 178.43 3h3f h LYS 242 N 0.38 0.00 0.05 2.37 3.64 -1.28 0.23 116.57 121.96 3h3f h LYS 242 Ca 0.52 0.00 -0.27 0.00 -1.27 0.00 0.00 60.65 59.63 3h3f h LYS 242 Cb 0.95 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.74 3h3f h LYS 242 CO -0.52 0.29 -1.47 -0.07 -2.27 0.00 0.00 179.45 175.42 3h3f h LEU 243 N 0.00 0.16 -0.72 5.20 4.07 -0.46 -3.43 115.31 120.14 3h3f h LEU 243 Ca -0.00 -0.68 0.00 0.00 0.08 0.00 0.00 57.88 57.28 3h3f h LEU 243 Cb 0.60 -0.05 0.00 0.00 1.08 0.00 0.00 40.66 42.29 3h3f h LEU 243 CO 0.04 1.61 0.00 2.29 -1.08 0.00 0.00 178.44 181.29 3h3f n LYS 244 N -4.11 -0.26 0.00 1.13 2.85 0.48 -5.03 118.16 113.23 3h3f n LYS 244 Ca -0.31 -0.36 0.00 0.00 -1.05 0.00 0.00 58.31 56.59 3h3f n LYS 244 Cb 0.81 -0.85 0.00 0.00 -0.65 0.00 0.00 35.03 34.34 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 0.07 2.97 3.64 2.58 0.00 0.80 -4.98 105.19 110.26 3h3f n GLY 245 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.01 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 -2.61 -0.08 0.04 1.61 1.13 -1.25 -4.79 117.35 111.39 3h3f s TYR 246 Ca 0.00 -0.05 0.06 0.00 -1.41 0.00 0.00 57.07 55.67 3h3f s TYR 246 Cb 0.00 0.56 -0.03 0.00 -1.10 0.00 0.00 41.96 41.39 3h3f s TYR 246 CO 0.00 -0.38 -0.14 0.95 -2.51 0.00 0.00 175.55 173.46 3h3f s THR 247 N -2.62 3.06 0.00 -3.49 -4.23 -1.26 -4.29 115.64 102.81 3h3f s THR 247 Ca 0.13 -1.12 0.00 0.00 -1.18 0.00 0.00 61.69 59.52 3h3f s THR 247 Cb 0.03 -2.33 0.00 0.00 1.34 0.00 0.00 72.50 71.54 3h3f s THR 247 CO -0.03 0.31 0.00 0.35 -0.54 0.00 0.00 174.62 174.71 3h3f n THR 248 N 1.40 0.00 -0.03 3.99 -2.24 -1.26 -4.61 114.28 111.54 3h3f n THR 248 Ca -0.16 0.00 -0.15 0.00 -2.27 0.00 0.00 64.05 61.47 3h3f n THR 248 Cb 0.52 -0.33 -0.12 0.00 -2.10 0.00 0.00 70.33 68.31 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 0.25 -0.12 4.78 4.06 -1.96 -2.26 115.95 120.70 3h3f h TRP 249 Ca 0.00 -0.14 0.00 0.00 2.06 0.00 0.00 58.89 60.81 3h3f h TRP 249 Cb 0.10 -0.03 -0.01 0.00 -1.00 0.00 0.00 29.16 28.23 3h3f h TRP 249 CO 0.00 0.96 0.06 0.00 -3.56 0.00 0.00 178.44 175.91 3h3f h ALA 250 N 0.23 0.14 -0.79 1.49 0.00 -1.99 -1.94 119.26 116.40 3h3f h ALA 250 Ca -0.03 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.83 3h3f h ALA 250 Cb 1.04 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.76 3h3f h ALA 250 CO 0.05 -0.38 0.33 0.97 0.00 0.00 0.00 179.25 180.22 3h3f h ILE 251 N 0.14 1.26 -0.71 0.00 6.09 -1.94 -0.86 117.51 121.48 3h3f h ILE 251 Ca 0.04 -0.80 0.14 0.00 -1.37 0.00 0.00 64.86 62.88 3h3f h ILE 251 Cb -0.00 0.30 -0.10 0.00 0.47 0.00 0.00 36.82 37.49 3h3f h ILE 251 CO -0.02 0.33 0.21 1.23 -3.07 0.00 0.00 178.15 176.83 3h3f h GLY 252 N 1.15 1.01 0.65 8.18 0.00 -1.24 0.54 103.07 113.35 3h3f h GLY 252 Ca 0.27 -0.07 -0.09 0.00 0.00 0.00 0.00 47.33 47.44 3h3f h GLY 252 CO -0.02 -0.15 -0.31 1.41 0.00 0.00 0.00 176.54 177.47 3h3f h LEU 253 N 0.33 0.37 -1.63 3.11 3.38 -1.25 -0.59 115.31 119.03 3h3f h LEU 253 Ca 0.39 -0.67 -0.02 0.00 0.09 0.00 0.00 57.88 57.67 3h3f h LEU 253 Cb 0.63 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.26 3h3f h LEU 253 CO -0.45 0.98 -0.02 -1.28 0.09 0.00 0.00 178.44 177.76 3h3f h SER 254 N -0.22 0.19 0.38 -0.43 0.87 -0.95 -1.83 113.55 111.56 3h3f h SER 254 Ca -0.02 -0.02 -0.26 0.00 -1.23 0.00 0.00 61.79 60.25 3h3f h SER 254 Cb 0.98 -0.05 0.01 0.00 -0.44 0.00 0.00 62.40 62.90 3h3f h SER 254 CO 0.06 0.25 -1.13 0.58 -0.53 0.00 0.00 176.83 176.06 3h3f h VAL 255 N 0.20 1.40 -0.86 2.23 2.07 0.39 -2.93 116.25 118.76 3h3f h VAL 255 Ca 0.05 -2.66 0.12 0.00 0.82 0.00 0.00 66.70 65.03 3h3f h VAL 255 Cb 0.18 2.68 -0.06 0.00 -1.52 0.00 0.00 31.29 32.56 3h3f h VAL 255 CO 0.01 0.79 0.56 0.00 0.02 0.00 0.00 177.57 178.94 3h3f h ALA 256 N 0.56 1.78 -0.11 1.67 0.00 -0.85 -1.42 119.26 120.89 3h3f h ALA 256 Ca -0.13 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.79 3h3f h ALA 256 Cb 1.81 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 19.44 3h3f h ALA 256 CO 0.20 0.02 0.07 0.22 0.00 0.00 0.00 179.25 179.75 3h3f h ASP 257 N 0.74 0.11 -0.69 0.00 -0.00 -1.25 -0.98 116.42 114.35 3h3f h ASP 257 Ca 0.42 0.00 -0.03 0.00 -0.00 0.00 0.00 57.03 57.42 3h3f h ASP 257 Cb 0.58 -0.02 -0.03 0.00 -0.00 0.00 0.00 39.33 39.85 3h3f h ASP 257 CO -0.18 0.08 0.31 -0.07 -0.00 0.00 0.00 179.24 179.38 3h3f h LEU 258 N 0.14 0.92 -1.32 2.28 3.38 -1.17 -2.33 115.31 117.21 3h3f h LEU 258 Ca 0.04 -0.15 0.03 0.00 0.09 0.00 0.00 57.88 57.90 3h3f h LEU 258 Cb -0.01 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 40.47 3h3f h LEU 258 CO -0.02 0.81 0.48 0.00 0.09 0.00 0.00 178.44 179.80 3h3f h ALA 259 N 1.14 1.57 0.48 1.53 0.00 -1.09 -2.20 119.26 120.69 3h3f h ALA 259 Ca 0.23 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.09 3h3f h ALA 259 Cb 0.15 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 3h3f h ALA 259 CO -0.03 0.36 -0.34 1.49 0.00 0.00 0.00 179.25 180.74 3h3f h GLU 260 N 0.89 -0.77 -0.92 0.00 4.81 -0.61 0.51 114.58 118.50 3h3f h GLU 260 Ca 0.28 0.05 0.17 0.00 -0.13 0.00 0.00 59.36 59.74 3h3f h GLU 260 Cb 0.04 0.17 -0.10 0.00 0.63 0.00 0.00 28.75 29.49 3h3f h GLU 260 CO -0.08 -0.51 0.50 0.77 -0.73 0.00 0.00 179.01 178.96 3h3f h SER 261 N -0.80 0.61 -0.00 1.04 0.02 -1.41 -0.72 113.55 112.30 3h3f h SER 261 Ca -0.05 0.10 -0.00 0.00 -0.84 0.00 0.00 61.79 61.00 3h3f h SER 261 Cb 0.67 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.21 3h3f h SER 261 CO 0.02 0.22 0.00 0.40 -1.14 0.00 0.00 176.83 176.33 3h3f h ILE 262 N 0.66 1.23 0.00 3.27 2.04 -0.69 -2.33 117.51 121.69 3h3f h ILE 262 Ca 0.52 -0.68 -0.05 0.00 1.00 0.00 0.00 64.86 65.65 3h3f h ILE 262 Cb 0.79 1.70 -0.01 0.00 -0.74 0.00 0.00 36.82 38.56 3h3f h ILE 262 CO -0.39 0.18 -0.23 0.24 0.00 0.00 0.00 178.15 177.95 3h3f h MET 263 N -0.29 0.00 -0.25 2.37 2.86 0.52 -3.00 114.93 117.14 3h3f h MET 263 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 3h3f h MET 263 Cb 0.29 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.95 3h3f h MET 263 CO 0.00 0.23 0.00 1.63 1.06 0.00 0.00 176.91 179.83 3h3f n LYS 264 N -3.27 2.80 -4.13 1.72 5.02 -0.32 -5.00 118.16 114.98 3h3f n LYS 264 Ca 0.01 -2.29 -0.31 0.00 -2.02 0.00 0.00 58.31 53.70 3h3f n LYS 264 Cb 0.50 -1.45 -0.05 0.00 -0.02 0.00 0.00 35.03 34.02 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 -0.08 -0.54 0.08 4.39 5.15 -0.95 -4.86 115.26 118.45 3h3f n ASN 265 Ca 0.14 -1.18 -0.11 0.00 -0.60 0.00 0.00 54.58 52.83 3h3f n ASN 265 Cb 0.58 -2.20 -0.10 0.00 -0.53 0.00 0.00 39.78 37.53 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 -1.93 0.21 -1.22 1.20 4.07 -1.62 -3.44 115.31 112.58 3h3f h LEU 266 Ca -0.66 -0.22 -0.32 0.00 0.08 0.00 0.00 57.88 56.76 3h3f h LEU 266 Cb 1.39 -0.07 0.13 0.00 1.08 0.00 0.00 40.66 43.19 3h3f h LEU 266 CO 0.64 1.13 -0.63 0.54 -1.08 0.00 0.00 178.44 179.05 3h3f n ARG 267 N -3.49 -6.48 -2.68 1.13 1.74 -0.35 -5.02 116.66 101.51 3h3f n ARG 267 Ca -0.04 0.73 -0.29 0.00 -0.77 0.00 0.00 57.85 57.49 3h3f n ARG 267 Cb 0.94 -5.45 -0.01 0.00 -1.02 0.00 0.00 32.46 26.92 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 -5.74 3.63 -0.24 5.56 0.52 -1.18 -4.66 118.95 116.84 3h3f s ARG 268 Ca 0.30 0.33 -0.16 0.00 -0.52 0.00 0.00 55.73 55.67 3h3f s ARG 268 Cb -0.13 -2.37 -0.04 0.00 0.52 0.00 0.00 34.95 32.94 3h3f s ARG 268 CO 0.64 -0.16 0.41 0.08 0.02 0.00 0.00 175.30 176.29 3h3f s VAL 269 N -2.63 5.16 0.04 3.52 1.01 -1.26 -1.59 120.40 124.67 3h3f s VAL 269 Ca 0.49 0.69 0.07 0.00 0.00 0.00 0.00 61.98 63.23 3h3f s VAL 269 Cb -0.10 -3.74 -0.02 0.00 0.00 0.00 0.00 36.38 32.51 3h3f s VAL 269 CO 0.40 0.18 -0.19 -1.00 0.00 0.00 0.00 175.10 174.49 3h3f s HIS 270 N 1.81 1.70 -1.08 5.22 0.09 -0.03 -4.84 115.29 118.15 3h3f s HIS 270 Ca 0.18 -0.37 -0.22 0.00 -0.00 0.00 0.00 55.06 54.65 3h3f s HIS 270 Cb -0.15 -1.01 0.01 0.00 -0.00 0.00 0.00 32.58 31.43 3h3f s HIS 270 CO 0.09 0.09 1.73 -1.25 -0.00 0.00 0.00 174.74 175.39 3h3f s PRO 271 N -1.20 3.23 0.27 8.40 0.04 -1.26 -0.65 135.00 143.83 3h3f s PRO 271 Ca 0.06 -1.12 0.08 0.00 0.04 0.00 0.00 61.00 60.06 3h3f s PRO 271 Cb -0.09 -5.31 -0.05 0.00 0.04 0.00 0.00 34.50 29.09 3h3f s PRO 271 CO 0.02 -2.83 -0.11 0.96 0.04 0.00 0.00 177.00 175.08 3h3f s ILE 272 N 7.16 1.89 -0.11 0.56 -4.36 -1.18 -1.66 121.20 123.50 3h3f s ILE 272 Ca 0.58 -2.20 -0.11 0.00 -0.26 0.00 0.00 60.65 58.65 3h3f s ILE 272 Cb -0.01 -2.36 -0.05 0.00 1.25 0.00 0.00 42.46 41.30 3h3f s ILE 272 CO 0.01 -0.37 0.26 -0.94 0.24 0.00 0.00 174.94 174.13 3h3f s SER 273 N -3.45 6.50 0.22 4.36 1.04 0.36 -3.02 113.70 119.71 3h3f s SER 273 Ca 0.28 0.59 -0.01 0.00 0.48 0.00 0.00 55.95 57.29 3h3f s SER 273 Cb 0.01 -2.15 -0.03 0.00 0.10 0.00 0.00 66.02 63.94 3h3f s SER 273 CO 0.12 0.27 0.19 0.28 0.98 0.00 0.00 173.24 175.08 3h3f s THR 274 N -0.47 0.00 -0.57 2.02 -1.32 -1.11 -1.07 115.64 113.12 3h3f s THR 274 Ca 0.17 -1.94 -0.24 0.00 -1.21 0.00 0.00 61.69 58.47 3h3f s THR 274 Cb -0.13 -2.48 0.04 0.00 -1.51 0.00 0.00 72.50 68.42 3h3f s THR 274 CO 0.06 0.00 0.96 -0.32 -2.21 0.00 0.00 174.62 173.11 3h3f s MET 275 N -4.03 3.31 -0.19 7.08 1.75 -1.26 -2.66 119.30 123.30 3h3f s MET 275 Ca 0.38 -0.32 0.16 0.00 -1.25 0.00 0.00 55.69 54.65 3h3f s MET 275 Cb 0.06 -4.08 0.49 0.00 2.84 0.00 0.00 34.83 34.14 3h3f s MET 275 CO 0.14 -1.54 1.39 1.47 -0.65 0.00 0.00 175.02 175.83 3h3f n LEU 276 N 7.56 3.71 -4.59 4.11 -0.00 -0.80 -4.98 117.00 122.01 3h3f n LEU 276 Ca 0.01 -3.17 -0.53 0.00 -0.00 0.00 0.00 56.01 52.32 3h3f n LEU 276 Cb 0.47 -0.55 -0.06 0.00 -0.00 0.00 0.00 43.42 43.29 3h3f n LEU 276 CO 0.64 0.79 0.89 1.17 -0.00 0.00 0.00 177.39 180.88 3h3f n LYS 277 N -0.76 1.06 0.00 1.47 4.81 -1.26 -1.94 118.16 121.54 3h3f n LYS 277 Ca 0.23 0.38 0.00 0.00 -0.87 0.00 0.00 58.31 58.05 3h3f n LYS 277 Cb 0.88 -2.02 0.00 0.00 0.02 0.00 0.00 35.03 33.92 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 2.49 1.55 3.26 3.14 0.00 0.33 -4.97 105.19 111.00 3h3f n GLY 278 Ca 0.19 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.06 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 2.28 -0.67 0.99 1.02 -0.82 -4.79 118.68 116.69 3h3f s LEU 279 Ca 0.00 -1.13 -0.04 0.00 0.02 0.00 0.00 54.13 52.98 3h3f s LEU 279 Cb 0.00 -0.20 0.03 0.00 0.02 0.00 0.00 46.19 46.05 3h3f s LEU 279 CO 0.00 -0.48 0.14 -1.22 0.02 0.00 0.00 176.35 174.81 3h3f n TYR 280 N -0.26 -1.73 -0.59 0.29 4.01 -1.26 -1.36 117.16 116.26 3h3f n TYR 280 Ca -0.08 0.14 0.00 0.00 -0.16 0.00 0.00 57.90 57.80 3h3f n TYR 280 Cb 0.62 -1.87 0.00 0.00 -0.31 0.00 0.00 39.34 37.79 3h3f n TYR 280 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3h3f n GLY 281 N -0.74 0.78 3.66 2.72 0.00 -1.26 -4.86 105.19 105.48 3h3f n GLY 281 Ca -0.03 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.64 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 -2.93 4.43 0.00 -0.61 1.01 -0.47 -5.00 121.20 117.64 3h3f s ILE 282 Ca 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 60.65 60.46 3h3f s ILE 282 Cb 0.00 -2.91 0.00 0.00 0.01 0.00 0.00 42.46 39.56 3h3f s ILE 282 CO 0.00 0.56 0.08 0.29 0.00 0.00 0.00 174.94 175.87 3h3f n LYS 283 N 2.63 5.70 -3.38 2.79 4.76 -1.26 0.12 118.16 129.52 3h3f n LYS 283 Ca -0.18 -0.08 -0.23 0.00 -2.87 0.00 0.00 58.31 54.95 3h3f n LYS 283 Cb 0.53 -0.58 -0.01 0.00 -1.84 0.00 0.00 35.03 33.14 3h3f n LYS 283 CO 0.00 0.00 0.00 -1.21 -1.37 0.00 0.00 177.40 174.82 3h3f s GLU 284 N -0.84 3.35 -1.28 1.97 0.41 -1.26 -4.89 118.70 116.16 3h3f s GLU 284 Ca 0.00 -0.49 -0.18 0.00 -0.41 0.00 0.00 54.97 53.89 3h3f s GLU 284 Cb 0.00 -2.68 0.01 0.00 -1.78 0.00 0.00 34.13 29.68 3h3f s GLU 284 CO 0.00 0.08 1.95 -0.25 -0.49 0.00 0.00 175.26 176.55 3h3f n ASP 285 N -1.79 4.05 -4.61 -0.19 8.00 -1.26 -3.99 116.55 116.77 3h3f n ASP 285 Ca -0.03 -2.84 -0.29 0.00 0.71 0.00 0.00 54.79 52.34 3h3f n ASP 285 Cb 0.57 -1.64 -0.09 0.00 -0.02 0.00 0.00 41.12 39.93 3h3f n ASP 285 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 3h3f s VAL 286 N 4.88 3.50 -0.30 2.53 -7.23 -1.26 -4.97 120.40 117.55 3h3f s VAL 286 Ca 0.54 -1.29 -0.14 0.00 -1.81 0.00 0.00 61.98 59.28 3h3f s VAL 286 Cb 0.08 -2.67 -0.03 0.00 0.56 0.00 0.00 36.38 34.32 3h3f s VAL 286 CO 0.04 0.06 0.32 -0.36 -0.31 0.00 0.00 175.10 174.85 3h3f s PHE 287 N -1.35 3.23 0.10 2.82 0.08 -1.26 -1.91 117.98 119.69 3h3f s PHE 287 Ca 0.23 0.17 0.03 0.00 0.12 0.00 0.00 56.93 57.48 3h3f s PHE 287 Cb -0.11 -2.56 -0.04 0.00 -0.57 0.00 0.00 43.02 39.75 3h3f s PHE 287 CO 0.15 -0.29 -0.08 -0.51 -0.10 0.00 0.00 175.22 174.40 3h3f s LEU 288 N 1.97 2.46 0.15 -0.37 1.43 -1.09 -4.78 118.68 118.46 3h3f s LEU 288 Ca 0.12 -0.92 -0.30 0.00 -1.03 0.00 0.00 54.13 52.00 3h3f s LEU 288 Cb -0.16 -0.18 -0.08 0.00 0.03 0.00 0.00 46.19 45.80 3h3f s LEU 288 CO 0.11 -0.37 1.23 -0.44 0.23 0.00 0.00 176.35 177.11 3h3f s SER 289 N -2.78 7.04 0.05 2.29 0.01 -0.58 -2.75 113.70 116.98 3h3f s SER 289 Ca 0.09 2.22 -0.15 0.00 1.31 0.00 0.00 55.95 59.41 3h3f s SER 289 Cb 0.01 -2.60 0.03 0.00 0.21 0.00 0.00 66.02 63.67 3h3f s SER 289 CO -0.02 -0.44 0.35 0.54 0.41 0.00 0.00 173.24 174.08 3h3f s VAL 290 N 0.31 0.07 -0.06 3.43 0.11 -1.17 -1.55 120.40 121.55 3h3f s VAL 290 Ca 0.56 -0.59 -0.30 0.00 -2.93 0.00 0.00 61.98 58.72 3h3f s VAL 290 Cb -0.33 -0.95 -0.06 0.00 -1.53 0.00 0.00 36.38 33.51 3h3f s VAL 290 CO 0.35 -0.33 1.81 -2.84 -3.33 0.00 0.00 175.10 170.76 3h3f s PRO 291 N -2.57 4.02 -0.01 1.54 0.02 -1.26 -3.09 135.00 133.65 3h3f s PRO 291 Ca -0.05 2.26 0.08 0.00 0.02 0.00 0.00 61.00 63.31 3h3f s PRO 291 Cb -0.01 -4.09 -0.02 0.00 0.02 0.00 0.00 34.50 30.40 3h3f s PRO 291 CO -0.03 -1.06 -0.24 0.00 -0.33 0.00 0.00 177.00 175.34 3h3f s VAL 293 N -0.66 4.95 -0.06 0.00 1.01 -0.72 -0.85 120.40 124.07 3h3f s VAL 293 Ca 0.11 1.32 0.06 0.00 0.00 0.00 0.00 61.98 63.46 3h3f s VAL 293 Cb -0.10 -4.01 -0.01 0.00 0.00 0.00 0.00 36.38 32.26 3h3f s VAL 293 CO -0.00 0.04 -0.25 -0.22 0.00 0.00 0.00 175.10 174.67 3h3f s LEU 294 N 2.31 2.06 0.00 3.92 2.96 -0.62 -2.55 118.68 126.76 3h3f s LEU 294 Ca 0.31 -0.51 0.00 0.00 -0.22 0.00 0.00 54.13 53.71 3h3f s LEU 294 Cb -0.16 -1.36 0.00 0.00 0.50 0.00 0.00 46.19 45.17 3h3f s LEU 294 CO 0.09 0.24 0.00 0.61 -1.32 0.00 0.00 176.35 175.97 3h3f n GLY 295 N 2.99 2.83 0.05 7.98 0.00 -0.94 -1.22 105.19 116.89 3h3f n GLY 295 Ca -0.18 -0.72 0.11 0.00 0.00 0.00 0.00 46.02 45.23 3h3f n GLY 295 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3h3f n GLN 296 N 0.00 0.09 -0.75 1.61 10.64 -1.25 -1.92 117.38 125.79 3h3f n GLN 296 Ca 0.00 0.24 -0.02 0.00 -1.83 0.00 0.00 57.00 55.38 3h3f n GLN 296 Cb 0.00 -1.64 0.22 0.00 -0.86 0.00 0.00 30.24 27.97 3h3f n GLN 296 CO 0.00 0.00 0.00 0.09 -1.83 0.00 0.00 177.06 175.32 3h3f n ASN 297 N -1.79 3.19 0.00 2.61 5.03 -1.26 -5.00 115.26 118.03 3h3f n ASN 297 Ca 0.04 -3.49 0.00 0.00 0.87 0.00 0.00 54.58 52.00 3h3f n ASN 297 Cb 0.26 -0.64 0.00 0.00 -1.02 0.00 0.00 39.78 38.38 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 -0.88 0.35 3.59 7.41 0.00 -0.81 -4.50 105.19 110.36 3h3f n GLY 298 Ca 0.33 -0.99 -0.42 0.00 0.00 0.00 0.00 46.02 44.94 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 4.83 -0.34 -0.61 1.01 -0.52 -2.21 121.20 123.35 3h3f s ILE 299 Ca 0.00 0.87 0.10 0.00 0.00 0.00 0.00 60.65 61.62 3h3f s ILE 299 Cb 0.00 -4.12 -0.12 0.00 0.01 0.00 0.00 42.46 38.23 3h3f s ILE 299 CO 0.00 -0.30 0.37 -1.54 0.00 0.00 0.00 174.94 173.46 3h3f n SER 300 N 6.17 1.06 -3.81 3.58 3.41 -1.06 -4.43 113.62 118.54 3h3f n SER 300 Ca 0.01 -0.53 -0.09 0.00 -0.26 0.00 0.00 58.87 58.00 3h3f n SER 300 Cb 0.48 1.13 -0.04 0.00 -0.26 0.00 0.00 64.21 65.52 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 -2.26 -0.19 -0.03 4.04 1.11 -1.26 -5.03 116.67 113.04 3h3f s ASP 301 Ca 0.02 -0.61 0.01 0.00 0.18 0.00 0.00 52.55 52.15 3h3f s ASP 301 Cb 0.07 0.57 0.02 0.00 1.07 0.00 0.00 42.92 44.65 3h3f s ASP 301 CO 0.41 -1.06 -0.04 -0.69 1.18 0.00 0.00 175.17 174.96 3h3f s VAL 302 N -3.91 0.47 0.36 -1.27 1.01 -1.26 -1.75 120.40 114.05 3h3f s VAL 302 Ca 0.12 -0.13 -0.21 0.00 0.00 0.00 0.00 61.98 61.76 3h3f s VAL 302 Cb -0.01 -0.48 -0.10 0.00 0.00 0.00 0.00 36.38 35.79 3h3f s VAL 302 CO -0.00 0.19 0.89 -0.69 0.00 0.00 0.00 175.10 175.49 3h3f s VAL 303 N 0.65 4.40 -0.72 2.92 1.01 0.38 -4.98 120.40 124.06 3h3f s VAL 303 Ca -0.08 1.48 -0.09 0.00 0.00 0.00 0.00 61.98 63.29 3h3f s VAL 303 Cb -0.11 -3.74 0.19 0.00 0.00 0.00 0.00 36.38 32.72 3h3f s VAL 303 CO -0.00 -0.12 0.61 -0.54 0.00 0.00 0.00 175.10 175.05 3h3f s LYS 304 N -2.72 3.12 0.53 2.72 1.02 -1.26 -4.57 119.74 118.58 3h3f s LYS 304 Ca 0.56 -2.45 -0.20 0.00 0.02 0.00 0.00 55.97 53.89 3h3f s LYS 304 Cb -0.13 -4.12 -0.06 0.00 -0.52 0.00 0.00 37.83 33.00 3h3f s LYS 304 CO 0.17 -1.24 1.15 0.08 -0.92 0.00 0.00 175.35 174.59 3h3f s VAL 305 N 0.14 3.09 -0.52 3.17 1.01 -1.26 -4.97 120.40 121.07 3h3f s VAL 305 Ca 0.17 0.71 -0.18 0.00 0.00 0.00 0.00 61.98 62.68 3h3f s VAL 305 Cb -0.15 -3.31 0.07 0.00 0.00 0.00 0.00 36.38 32.99 3h3f s VAL 305 CO -0.06 -0.11 0.60 -0.89 0.00 0.00 0.00 175.10 174.64 3h3f s THR 306 N -1.70 4.93 0.09 3.92 2.01 -1.26 -5.07 115.64 118.57 3h3f s THR 306 Ca 0.71 -0.69 -0.05 0.00 0.31 0.00 0.00 61.69 61.97 3h3f s THR 306 Cb -0.26 -4.31 -0.05 0.00 0.01 0.00 0.00 72.50 67.89 3h3f s THR 306 CO 0.29 -0.83 0.34 -0.76 -0.69 0.00 0.00 174.62 172.97 3h3f s LEU 307 N 2.47 4.31 0.00 4.42 1.43 -1.26 -5.05 118.68 125.00 3h3f s LEU 307 Ca 0.13 0.57 -0.10 0.00 -1.03 0.00 0.00 54.13 53.70 3h3f s LEU 307 Cb -0.21 -3.09 0.14 0.00 0.03 0.00 0.00 46.19 43.07 3h3f s LEU 307 CO 0.10 0.13 0.43 0.35 0.23 0.00 0.00 176.35 177.59 3h3f n THR 308 N 0.45 0.00 0.10 5.49 -2.24 -1.26 -4.80 114.28 112.02 3h3f n THR 308 Ca -0.05 -0.13 -0.16 0.00 -2.27 0.00 0.00 64.05 61.44 3h3f n THR 308 Cb 0.52 -0.84 -0.14 0.00 -2.10 0.00 0.00 70.33 67.77 3h3f n THR 308 CO 0.00 0.00 0.00 -1.28 -0.57 0.00 0.00 175.07 173.22 3h3f h SER 309 N -2.12 0.43 -0.34 3.42 0.87 -2.00 -2.70 113.55 111.11 3h3f h SER 309 Ca -0.17 -0.48 -0.12 0.00 -1.23 0.00 0.00 61.79 59.79 3h3f h SER 309 Cb 0.55 -0.14 -0.01 0.00 -0.44 0.00 0.00 62.40 62.37 3h3f h SER 309 CO 0.11 1.38 -0.26 -0.33 -0.53 0.00 0.00 176.83 177.20 3h3f h GLU 310 N 0.08 0.78 -0.86 2.24 5.08 -1.98 -3.05 114.58 116.86 3h3f h GLU 310 Ca -0.15 -0.38 0.13 0.00 -1.00 0.00 0.00 59.36 57.97 3h3f h GLU 310 Cb 1.98 -0.00 -0.09 0.00 0.50 0.00 0.00 28.75 31.14 3h3f h GLU 310 CO 0.20 1.00 0.47 0.93 -1.00 0.00 0.00 179.01 180.62 3h3f h GLU 311 N 0.56 0.68 0.00 2.33 5.08 -1.91 0.52 114.58 121.84 3h3f h GLU 311 Ca 0.06 -0.04 -0.00 0.00 -1.00 0.00 0.00 59.36 58.38 3h3f h GLU 311 Cb 0.82 -0.15 -0.00 0.00 0.50 0.00 0.00 28.75 29.92 3h3f h GLU 311 CO 0.07 0.45 -0.02 1.05 -1.00 0.00 0.00 179.01 179.56 3h3f h GLU 312 N 0.70 0.00 0.00 2.33 4.11 -1.48 -2.71 114.58 117.53 3h3f h GLU 312 Ca 0.45 0.00 -0.21 0.00 0.07 0.00 0.00 59.36 59.68 3h3f h GLU 312 Cb 0.58 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.79 3h3f h GLU 312 CO -0.32 0.02 -1.12 0.00 0.07 0.00 0.00 179.01 177.65 3h3f h ALA 313 N 1.98 0.53 0.78 1.06 0.00 -0.55 -2.48 119.26 120.59 3h3f h ALA 313 Ca -0.00 -0.96 -0.04 0.00 0.00 0.00 0.00 54.91 53.92 3h3f h ALA 313 Cb 0.57 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.40 3h3f h ALA 313 CO 0.00 1.20 -0.43 0.45 0.00 0.00 0.00 179.25 180.46 3h3f h HIS 314 N 0.00 -1.14 -1.13 0.00 3.86 0.13 -2.83 115.15 114.05 3h3f h HIS 314 Ca -0.09 -0.02 0.31 0.00 -1.16 0.00 0.00 60.37 59.42 3h3f h HIS 314 Cb 1.75 0.39 -0.07 0.00 1.06 0.00 0.00 27.41 30.54 3h3f h HIS 314 CO 0.00 -0.67 0.77 -0.07 0.86 0.00 0.00 177.93 178.82 3h3f h LEU 315 N -1.13 0.20 0.00 2.43 4.07 -1.58 -2.28 115.31 117.03 3h3f h LEU 315 Ca -0.10 0.04 -0.01 0.00 0.08 0.00 0.00 57.88 57.89 3h3f h LEU 315 Cb 0.89 0.01 -0.00 0.00 1.08 0.00 0.00 40.66 42.64 3h3f h LEU 315 CO 0.14 0.03 -0.22 0.50 -1.08 0.00 0.00 178.44 177.80 3h3f h LYS 316 N 0.17 0.00 0.07 1.13 3.64 -1.20 -2.02 116.57 118.37 3h3f h LYS 316 Ca 0.59 0.00 -0.12 0.00 -1.27 0.00 0.00 60.65 59.85 3h3f h LYS 316 Cb 1.95 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 33.78 3h3f h LYS 316 CO -0.15 0.04 -0.56 -0.22 -2.27 0.00 0.00 179.45 176.29 3h3f h LYS 317 N 0.00 0.15 -0.48 1.90 3.64 -1.25 -2.12 116.57 118.42 3h3f h LYS 317 Ca -0.00 -0.26 0.09 0.00 -1.27 0.00 0.00 60.65 59.20 3h3f h LYS 317 Cb 1.03 0.10 -0.07 0.00 -0.41 0.00 0.00 32.23 32.88 3h3f h LYS 317 CO 0.00 1.12 0.05 0.77 -2.27 0.00 0.00 179.45 179.13 3h3f h SER 318 N -0.67 -0.10 -1.00 4.20 0.02 -1.56 0.50 113.55 114.95 3h3f h SER 318 Ca -0.11 0.10 0.11 0.00 -0.84 0.00 0.00 61.79 61.05 3h3f h SER 318 Cb 1.37 0.16 -0.08 0.00 0.14 0.00 0.00 62.40 63.98 3h3f h SER 318 CO 0.06 -0.02 0.63 0.00 -1.14 0.00 0.00 176.83 176.36 3h3f h ALA 319 N 1.40 1.52 -0.37 3.77 0.00 -1.38 0.14 119.26 124.33 3h3f h ALA 319 Ca 0.24 0.02 -0.08 0.00 0.00 0.00 0.00 54.91 55.09 3h3f h ALA 319 Cb 0.34 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 3h3f h ALA 319 CO -0.36 0.24 -0.06 -0.44 0.00 0.00 0.00 179.25 178.64 3h3f h ASP 320 N 1.01 0.70 -0.08 0.00 3.45 -0.53 -2.68 116.42 118.29 3h3f h ASP 320 Ca 0.49 -0.35 -0.03 0.00 0.43 0.00 0.00 57.03 57.57 3h3f h ASP 320 Cb 0.46 -0.19 -0.00 0.00 -0.56 0.00 0.00 39.33 39.04 3h3f h ASP 320 CO -0.25 0.88 -0.08 0.74 -1.57 0.00 0.00 179.24 178.96 3h3f h THR 321 N 0.50 1.36 -0.69 0.35 2.02 0.43 -2.20 112.91 114.69 3h3f h THR 321 Ca 0.10 -1.22 0.00 0.00 0.77 0.00 0.00 66.41 66.06 3h3f h THR 321 Cb 0.56 2.00 -0.03 0.00 -1.74 0.00 0.00 68.15 68.93 3h3f h THR 321 CO 0.03 0.34 0.44 -0.07 0.37 0.00 0.00 175.52 176.64 3h3f h LEU 322 N -0.23 0.81 -1.06 2.58 -0.00 -0.81 -2.72 115.31 113.88 3h3f h LEU 322 Ca 0.01 -0.04 -0.10 0.00 -0.00 0.00 0.00 57.88 57.76 3h3f h LEU 322 Cb 0.58 -0.20 -0.01 0.00 -0.00 0.00 0.00 40.66 41.03 3h3f h LEU 322 CO 0.02 0.61 -0.47 -0.25 -0.00 0.00 0.00 178.44 178.35 3h3f h TRP 323 N 0.94 0.00 -0.08 1.13 2.91 -1.44 -1.90 115.95 117.51 3h3f h TRP 323 Ca 0.25 -0.00 -0.08 0.00 1.13 0.00 0.00 58.89 60.19 3h3f h TRP 323 Cb -0.08 -0.00 -0.01 0.00 -0.51 0.00 0.00 29.16 28.56 3h3f h TRP 323 CO -0.02 0.47 -0.31 0.78 -1.03 0.00 0.00 178.44 178.33 3h3f h GLY 324 N 1.40 0.16 0.17 2.65 0.00 -1.07 0.30 103.07 106.68 3h3f h GLY 324 Ca -0.00 -0.12 -0.00 0.00 0.00 0.00 0.00 47.33 47.20 3h3f h GLY 324 CO 0.06 0.11 -0.01 -2.22 0.00 0.00 0.00 176.54 174.48 3h3f h ILE 325 N 0.13 1.37 -0.97 2.60 2.04 -1.36 -3.31 117.51 118.01 3h3f h ILE 325 Ca 0.02 -1.75 0.10 0.00 1.00 0.00 0.00 64.86 64.22 3h3f h ILE 325 Cb 0.62 2.47 -0.08 0.00 -0.74 0.00 0.00 36.82 39.09 3h3f h ILE 325 CO 0.04 0.42 0.60 1.56 0.00 0.00 0.00 178.15 180.78 3h3f h GLN 326 N -0.87 0.98 -0.86 2.37 4.20 -1.28 -0.71 115.11 118.94 3h3f h GLN 326 Ca -0.00 -0.06 0.22 0.00 0.06 0.00 0.00 58.65 58.87 3h3f h GLN 326 Cb 0.72 -0.22 -0.13 0.00 0.30 0.00 0.00 27.48 28.14 3h3f h GLN 326 CO 0.01 0.65 0.27 0.87 -0.67 0.00 0.00 178.83 179.95 3h3f h LYS 327 N 1.01 0.26 -0.00 1.46 1.57 -0.50 -2.59 116.57 117.78 3h3f h LYS 327 Ca 0.46 -0.02 -0.16 0.00 -1.87 0.00 0.00 60.65 59.06 3h3f h LYS 327 Cb 0.37 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.60 3h3f h LYS 327 CO -0.24 0.17 -0.78 0.93 -0.57 0.00 0.00 179.45 178.97 3h3f h GLU 328 N 0.27 0.00 -6.78 3.15 3.07 -1.22 -3.46 114.58 109.61 3h3f h GLU 328 Ca 0.53 -0.00 -0.49 0.00 -0.50 0.00 0.00 59.36 58.90 3h3f h GLU 328 Cb 1.03 0.00 0.22 0.00 -0.84 0.00 0.00 28.75 29.17 3h3f h GLU 328 CO -0.60 0.78 -0.71 1.28 -1.40 0.00 0.00 179.01 178.36 3h3f n LEU 329 N -3.61 -1.02 -3.70 1.33 4.77 -0.98 -5.06 117.00 108.73 3h3f n LEU 329 Ca -0.01 0.11 -0.20 0.00 -0.03 0.00 0.00 56.01 55.89 3h3f n LEU 329 Cb 0.75 -1.12 -0.18 0.00 -2.33 0.00 0.00 43.42 40.55 3h3f n LEU 329 CO 0.44 -3.32 -0.35 -1.58 -1.33 0.00 0.00 177.39 171.26 3h3f s GLN 330 N -3.65 0.03 0.00 3.23 2.00 -1.26 -5.06 119.66 114.95 3h3f s GLN 330 Ca 0.58 0.31 0.00 0.00 -2.00 0.00 0.00 55.36 54.25 3h3f s GLN 330 Cb -0.18 -0.54 0.00 0.00 0.80 0.00 0.00 33.01 33.09 3h3f s GLN 330 CO 0.66 -0.30 0.26 1.19 -0.50 0.00 0.00 175.29 176.60