#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3i3o s VAL 8 N 0.00 4.18 -0.12 -2.13 1.01 -1.26 -4.38 120.40 117.71 3i3o s VAL 8 Ca 0.00 1.43 0.07 0.00 0.00 0.00 0.00 61.98 63.47 3i3o s VAL 8 Cb 0.00 -3.92 -0.12 0.00 0.00 0.00 0.00 36.38 32.34 3i3o s VAL 8 CO 0.00 -0.13 -0.02 0.35 0.00 0.00 0.00 175.10 175.31 3i3o n THR 9 N 5.38 0.75 -4.27 3.92 -2.24 0.15 -4.97 114.28 113.01 3i3o n THR 9 Ca 0.14 -0.40 -0.15 0.00 -2.27 0.00 0.00 64.05 61.38 3i3o n THR 9 Cb 0.45 -0.81 -0.10 0.00 -2.10 0.00 0.00 70.33 67.76 3i3o n THR 9 CO 0.00 0.00 0.00 -0.04 -0.57 0.00 0.00 175.07 174.46 3i3o s MET 10 N -2.26 1.20 0.39 -0.78 -1.94 -1.00 -5.02 119.30 109.89 3i3o s MET 10 Ca -0.10 -1.60 -0.26 0.00 -1.71 0.00 0.00 55.69 52.02 3i3o s MET 10 Cb 0.04 -0.32 -0.09 0.00 2.01 0.00 0.00 34.83 36.47 3i3o s MET 10 CO 0.39 -0.16 1.19 -2.14 -0.01 0.00 0.00 175.02 174.30 3i3o s PRO 11 N -3.93 4.08 0.10 2.03 0.02 -1.26 -4.31 135.00 131.73 3i3o s PRO 11 Ca 0.27 1.90 -0.31 0.00 0.02 0.00 0.00 61.00 62.89 3i3o s PRO 11 Cb 0.06 -2.73 -0.10 0.00 0.02 0.00 0.00 34.50 31.76 3i3o s PRO 11 CO 0.07 -0.31 1.78 0.00 -0.33 0.00 0.00 177.00 178.20 3i3o s ALA 12 N -1.37 3.73 0.03 -1.55 0.00 -1.26 -4.34 121.76 116.99 3i3o s ALA 12 Ca 0.56 1.36 -0.27 0.00 0.00 0.00 0.00 51.96 53.61 3i3o s ALA 12 Cb -0.32 -3.75 0.09 0.00 0.00 0.00 0.00 23.12 19.14 3i3o s ALA 12 CO 0.41 -1.21 0.77 1.14 0.00 0.00 0.00 175.76 176.87 3i3o s GLN 13 N 2.81 0.99 0.03 0.00 -2.07 -1.26 -4.99 119.66 115.17 3i3o s GLN 13 Ca 0.79 -0.23 -0.15 0.00 -1.82 0.00 0.00 55.36 53.95 3i3o s GLN 13 Cb -0.44 0.46 0.02 0.00 -1.09 0.00 0.00 33.01 31.97 3i3o s GLN 13 CO 0.35 -0.40 0.33 -1.58 -1.32 0.00 0.00 175.29 172.66 3i3o s HIS 14 N -2.83 -0.15 0.01 9.60 2.46 -1.26 -3.98 115.29 119.15 3i3o s HIS 14 Ca 0.00 0.08 0.08 0.00 0.47 0.00 0.00 55.06 55.69 3i3o s HIS 14 Cb -0.01 0.12 -0.02 0.00 -0.13 0.00 0.00 32.58 32.54 3i3o s HIS 14 CO -0.06 -0.49 -0.23 -0.65 -2.47 0.00 0.00 174.74 170.83 3i3o s GLN 15 N -2.28 1.69 0.09 2.88 -0.21 0.15 -4.95 119.66 117.04 3i3o s GLN 15 Ca -0.07 -0.91 -0.34 0.00 0.02 0.00 0.00 55.36 54.06 3i3o s GLN 15 Cb -0.02 -1.74 -0.16 0.00 1.00 0.00 0.00 33.01 32.10 3i3o s GLN 15 CO -0.01 0.46 1.59 -0.97 -2.12 0.00 0.00 175.29 174.24 3i3o h ASN 16 N 5.20 -1.15 -2.02 5.90 -0.73 -1.91 -3.41 115.58 117.46 3i3o h ASN 16 Ca -0.42 0.09 -0.54 0.00 1.87 0.00 0.00 56.30 57.29 3i3o h ASN 16 Cb 1.14 0.37 -0.08 0.00 0.27 0.00 0.00 38.32 40.02 3i3o h ASN 16 CO 0.46 -0.61 -0.57 -1.59 -0.37 0.00 0.00 177.43 174.75 3i3o s LYS 17 N -5.95 2.43 -0.01 6.67 -2.85 -1.26 -5.06 119.74 113.71 3i3o s LYS 17 Ca -0.18 -1.43 0.04 0.00 -1.00 0.00 0.00 55.97 53.40 3i3o s LYS 17 Cb 0.05 -2.23 -0.01 0.00 -2.06 0.00 0.00 37.83 33.57 3i3o s LYS 17 CO 0.62 0.23 -0.13 -1.14 0.10 0.00 0.00 175.35 175.02 3i3o s GLN 18 N -3.80 1.06 0.36 1.78 0.74 -1.26 -4.02 119.66 114.53 3i3o s GLN 18 Ca 0.35 -0.48 -0.27 0.00 0.05 0.00 0.00 55.36 55.02 3i3o s GLN 18 Cb -0.05 -1.03 -0.12 0.00 1.10 0.00 0.00 33.01 32.92 3i3o s GLN 18 CO 0.22 0.28 1.13 -2.30 -0.55 0.00 0.00 175.29 174.08 3i3o n PRO 19 N 2.74 1.67 -1.48 1.67 -0.01 -1.26 -5.15 135.00 133.18 3i3o n PRO 19 Ca -0.14 0.59 -0.32 0.00 -0.01 0.00 0.00 63.50 63.62 3i3o n PRO 19 Cb 0.55 -2.13 0.07 0.00 -0.01 0.00 0.00 33.50 31.99 3i3o n PRO 19 CO 0.00 0.00 0.00 0.20 -0.01 0.00 0.00 175.50 175.69 3i3o s GLY 20 N -0.53 1.85 -0.27 -1.23 0.00 -1.25 -5.03 107.32 100.85 3i3o s GLY 20 Ca 0.59 0.35 -0.08 0.00 0.00 0.00 0.00 44.72 45.58 3i3o s GLY 20 CO 0.60 0.69 0.09 -0.42 0.00 0.00 0.00 173.10 174.05 3i3o s ILE 21 N -2.72 4.31 0.35 0.90 -1.09 -1.26 -4.82 121.20 116.87 3i3o s ILE 21 Ca 0.63 -0.30 0.04 0.00 -2.23 0.00 0.00 60.65 58.79 3i3o s ILE 21 Cb -0.18 -3.08 0.18 0.00 -1.58 0.00 0.00 42.46 37.80 3i3o s ILE 21 CO 0.50 0.25 1.91 -0.08 -1.23 0.00 0.00 174.94 176.29 3i3o h GLU 22 N 8.26 0.56 0.00 2.79 4.81 -1.96 -2.59 114.58 126.45 3i3o h GLU 22 Ca -0.36 -0.10 0.00 0.00 -0.13 0.00 0.00 59.36 58.77 3i3o h GLU 22 Cb 1.16 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 30.45 3i3o h GLU 22 CO 0.59 0.53 0.00 0.66 -0.73 0.00 0.00 179.01 180.06 3i3o h SER 23 N 0.55 0.00 0.30 1.04 4.64 -1.98 -1.70 113.55 116.39 3i3o h SER 23 Ca 0.13 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.45 3i3o h SER 23 Cb 0.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.32 3i3o h SER 23 CO -0.00 0.00 -0.25 0.18 -0.87 0.00 0.00 176.83 175.89 3i3o n LEU 24 N -2.55 0.86 -4.79 5.97 4.77 -0.98 -4.96 117.00 115.33 3i3o n LEU 24 Ca 0.00 -0.18 -0.36 0.00 -0.03 0.00 0.00 56.01 55.45 3i3o n LEU 24 Cb 0.19 -0.15 -0.06 0.00 -2.33 0.00 0.00 43.42 41.07 3i3o n LEU 24 CO 0.20 0.16 0.67 -0.04 -1.33 0.00 0.00 177.39 177.05 3i3o s MET 25 N -2.56 4.44 -0.15 3.23 -1.94 -0.64 -5.07 119.30 116.61 3i3o s MET 25 Ca 0.24 1.32 -0.02 0.00 -1.71 0.00 0.00 55.69 55.51 3i3o s MET 25 Cb 0.19 -2.63 0.05 0.00 2.01 0.00 0.00 34.83 34.45 3i3o s MET 25 CO 0.53 0.14 0.03 1.21 -0.01 0.00 0.00 175.02 176.92 3i3o s ASN 26 N -1.72 2.43 0.82 3.03 2.47 -1.26 -3.50 114.94 117.21 3i3o s ASN 26 Ca 0.54 -0.56 -0.12 0.00 0.42 0.00 0.00 52.86 53.14 3i3o s ASN 26 Cb -0.17 -0.53 0.09 0.00 -1.45 0.00 0.00 41.25 39.19 3i3o s ASN 26 CO 0.22 -0.27 1.15 -2.16 -3.72 0.00 0.00 177.10 172.32 3i3o s PRO 27 N 1.91 1.85 0.27 0.43 0.04 -1.26 -4.20 135.00 134.04 3i3o s PRO 27 Ca 0.01 0.24 -0.30 0.00 0.04 0.00 0.00 61.00 61.00 3i3o s PRO 27 Cb -0.15 -1.92 -0.10 0.00 0.04 0.00 0.00 34.50 32.36 3i3o s PRO 27 CO -0.07 -1.70 1.36 -0.51 0.04 0.00 0.00 177.00 176.11 3i3o s LEU 28 N -5.70 4.41 0.50 -3.56 1.43 -1.23 -4.94 118.68 109.59 3i3o s LEU 28 Ca 0.62 2.61 -0.22 0.00 -1.03 0.00 0.00 54.13 56.11 3i3o s LEU 28 Cb -0.12 -3.63 -0.08 0.00 0.03 0.00 0.00 46.19 42.38 3i3o s LEU 28 CO 0.51 -0.59 0.95 -2.65 0.23 0.00 0.00 176.35 174.80 3i3o n PRO 29 N 1.83 1.13 -2.91 1.29 -0.02 -1.26 -4.88 135.00 130.17 3i3o n PRO 29 Ca 0.04 0.42 -0.43 0.00 -2.02 0.00 0.00 63.50 61.50 3i3o n PRO 29 Cb 0.41 -2.06 -0.05 0.00 -0.02 0.00 0.00 33.50 31.79 3i3o n PRO 29 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 3i3o s GLN 30 N -2.29 3.24 0.00 -0.52 -0.21 -1.26 -4.85 119.66 113.78 3i3o s GLN 30 Ca 0.68 -0.51 0.23 0.00 0.02 0.00 0.00 55.36 55.78 3i3o s GLN 30 Cb -0.49 -4.10 0.04 0.00 1.00 0.00 0.00 33.01 29.46 3i3o s GLN 30 CO 0.53 -1.50 1.10 1.97 -2.12 0.00 0.00 175.29 175.27 3i3o n PHE 31 N 7.24 0.00 -4.15 0.91 1.16 -1.26 -1.60 117.46 119.76 3i3o n PHE 31 Ca -0.01 0.00 -0.17 0.00 -1.87 0.00 0.00 57.45 55.40 3i3o n PHE 31 Cb 0.47 -0.04 -0.15 0.00 -1.61 0.00 0.00 39.48 38.15 3i3o n PHE 31 CO 0.00 0.00 0.00 -2.00 -1.87 0.00 0.00 176.76 172.89 3i3o s GLU 32 N -2.72 0.50 -0.33 3.97 2.12 -1.26 -4.16 118.70 116.81 3i3o s GLU 32 Ca 0.14 -0.15 -0.17 0.00 0.36 0.00 0.00 54.97 55.16 3i3o s GLU 32 Cb 0.17 -0.51 -0.01 0.00 0.26 0.00 0.00 34.13 34.04 3i3o s GLU 32 CO 0.69 0.05 0.45 0.34 -0.54 0.00 0.00 175.26 176.25 3i3o s ASP 33 N 0.19 6.27 0.50 -1.70 -1.08 -1.26 -4.93 116.67 114.66 3i3o s ASP 33 Ca -0.02 -0.03 0.16 0.00 -0.52 0.00 0.00 52.55 52.14 3i3o s ASP 33 Cb -0.06 -2.24 1.21 0.00 -1.46 0.00 0.00 42.92 40.37 3i3o s ASP 33 CO -0.00 -0.39 2.09 -0.65 0.52 0.00 0.00 175.17 176.73 3i3o h PRO 34 N 8.41 0.12 -0.00 4.34 0.11 -2.02 -1.94 132.00 141.01 3i3o h PRO 34 Ca -0.29 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.81 3i3o h PRO 34 Cb 1.14 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.22 3i3o h PRO 34 CO 0.73 0.08 -0.03 0.09 -0.21 0.00 0.00 178.00 178.66 3i3o n ASN 35 N -4.49 0.03 -4.71 -2.05 3.02 -1.26 -4.87 115.26 100.93 3i3o n ASN 35 Ca 0.02 0.33 -0.42 0.00 -0.03 0.00 0.00 54.58 54.48 3i3o n ASN 35 Cb 0.22 -0.42 -0.03 0.00 -0.61 0.00 0.00 39.78 38.94 3i3o n ASN 35 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 3i3o s TYR 36 N -2.92 2.78 -0.25 3.10 5.04 -0.73 -4.98 117.35 119.39 3i3o s TYR 36 Ca 0.17 0.39 -0.01 0.00 -2.44 0.00 0.00 57.07 55.17 3i3o s TYR 36 Cb 0.19 -4.04 0.03 0.00 0.35 0.00 0.00 41.96 38.49 3i3o s TYR 36 CO 0.53 -4.00 -0.06 0.15 -1.34 0.00 0.00 175.55 170.83 3i3o s LYS 37 N 1.61 2.76 0.67 4.97 1.02 -1.26 -5.05 119.74 124.45 3i3o s LYS 37 Ca 0.74 -1.03 -0.14 0.00 0.02 0.00 0.00 55.97 55.56 3i3o s LYS 37 Cb -0.45 -2.99 0.00 0.00 -0.52 0.00 0.00 37.83 33.86 3i3o s LYS 37 CO 0.32 -0.43 1.10 0.20 -0.92 0.00 0.00 175.35 175.62 3i3o s GLY 38 N 1.30 2.07 -0.01 -3.33 0.00 -1.26 -4.99 107.32 101.10 3i3o s GLY 38 Ca -0.01 0.47 0.23 0.00 0.00 0.00 0.00 44.72 45.41 3i3o s GLY 38 CO -0.04 0.82 1.15 -1.14 0.00 0.00 0.00 173.10 173.89 3i3o n SER 39 N -2.55 0.79 -1.95 1.64 3.41 -1.26 -4.99 113.62 108.70 3i3o n SER 39 Ca 0.10 -2.00 -0.16 0.00 -0.26 0.00 0.00 58.87 56.54 3i3o n SER 39 Cb 0.52 -0.24 -0.00 0.00 -0.26 0.00 0.00 64.21 64.24 3i3o n SER 39 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3i3o n GLU 40 N 0.39 -1.82 0.22 4.33 1.02 -1.26 -4.91 120.64 118.61 3i3o n GLU 40 Ca 0.02 0.76 0.07 0.00 -0.02 0.00 0.00 57.16 57.99 3i3o n GLU 40 Cb 1.09 -5.17 0.51 0.00 -0.02 0.00 0.00 31.44 27.85 3i3o n GLU 40 CO 0.00 0.00 0.00 0.87 1.18 0.00 0.00 177.13 179.18 3i3o h LYS 41 N -0.23 0.00 0.00 3.49 1.57 -1.89 -2.92 116.57 116.60 3i3o h LYS 41 Ca -0.39 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.36 3i3o h LYS 41 Cb 1.28 0.00 -0.07 0.00 0.08 0.00 0.00 32.23 33.52 3i3o h LYS 41 CO 0.45 0.24 -0.56 1.28 -0.57 0.00 0.00 179.45 180.28 3i3o n LEU 42 N -3.97 2.31 -4.67 2.94 4.77 -0.39 -4.58 117.00 113.39 3i3o n LEU 42 Ca -0.02 -3.43 -0.51 0.00 -0.03 0.00 0.00 56.01 52.02 3i3o n LEU 42 Cb 0.31 -0.41 -0.06 0.00 -2.33 0.00 0.00 43.42 40.94 3i3o n LEU 42 CO 0.35 1.16 1.28 1.17 -1.33 0.00 0.00 177.39 180.02 3i3o n LYS 43 N -0.82 1.70 -0.80 3.23 4.81 -0.80 -1.21 118.16 124.28 3i3o n LYS 43 Ca 0.16 0.62 0.00 0.00 -0.87 0.00 0.00 58.31 58.22 3i3o n LYS 43 Cb 0.77 -2.37 0.00 0.00 0.02 0.00 0.00 35.03 33.45 3i3o n LYS 43 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3i3o n GLY 44 N 3.81 0.82 3.78 3.14 0.00 -0.69 -4.92 105.19 111.14 3i3o n GLY 44 Ca 0.22 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.87 3i3o n GLY 44 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3i3o s LYS 45 N -0.26 4.10 -0.21 1.61 -0.14 -0.35 -4.82 119.74 119.67 3i3o s LYS 45 Ca 0.00 1.56 -0.06 0.00 -1.36 0.00 0.00 55.97 56.11 3i3o s LYS 45 Cb 0.00 -2.52 -0.03 0.00 -1.68 0.00 0.00 37.83 33.59 3i3o s LYS 45 CO 0.00 -0.21 0.03 -0.80 -0.76 0.00 0.00 175.35 173.61 3i3o s ASN 46 N -1.52 5.12 -0.02 2.83 0.01 -1.26 -0.64 114.94 119.46 3i3o s ASN 46 Ca 0.59 -0.12 0.07 0.00 -0.71 0.00 0.00 52.86 52.68 3i3o s ASN 46 Cb -0.23 -1.89 -0.02 0.00 0.41 0.00 0.00 41.25 39.53 3i3o s ASN 46 CO 0.29 0.07 -0.23 -0.69 -1.51 0.00 0.00 177.10 175.03 3i3o s VAL 47 N 0.95 1.82 -0.15 1.60 1.01 0.42 -0.84 120.40 125.22 3i3o s VAL 47 Ca 0.03 -0.98 -0.00 0.00 0.00 0.00 0.00 61.98 61.02 3i3o s VAL 47 Cb -0.14 -1.52 -0.01 0.00 0.00 0.00 0.00 36.38 34.71 3i3o s VAL 47 CO 0.02 0.52 -0.13 -0.22 0.00 0.00 0.00 175.10 175.29 3i3o s LEU 48 N -0.51 2.67 -0.11 3.92 2.96 -0.51 0.29 118.68 127.39 3i3o s LEU 48 Ca 0.08 -0.38 0.00 0.00 -0.22 0.00 0.00 54.13 53.62 3i3o s LEU 48 Cb -0.09 -1.61 0.02 0.00 0.50 0.00 0.00 46.19 45.01 3i3o s LEU 48 CO -0.01 0.12 -0.10 -0.51 -1.32 0.00 0.00 176.35 174.54 3i3o s ILE 49 N 0.62 1.15 -0.07 6.68 2.07 0.39 -0.29 121.20 131.75 3i3o s ILE 49 Ca -0.07 -0.39 -0.22 0.00 -1.41 0.00 0.00 60.65 58.56 3i3o s ILE 49 Cb -0.15 -1.12 -0.04 0.00 0.13 0.00 0.00 42.46 41.27 3i3o s ILE 49 CO 0.03 0.38 0.64 0.42 -1.91 0.00 0.00 174.94 174.50 3i3o s THR 50 N 1.45 5.06 -0.69 4.00 -4.23 -0.31 -0.98 115.64 119.94 3i3o s THR 50 Ca 0.01 1.32 -0.03 0.00 -1.18 0.00 0.00 61.69 61.81 3i3o s THR 50 Cb -0.13 -3.98 0.00 0.00 1.34 0.00 0.00 72.50 69.73 3i3o s THR 50 CO -0.06 0.29 0.37 0.61 -0.54 0.00 0.00 174.62 175.28 3i3o n GLY 51 N 3.06 0.17 0.47 3.99 0.00 0.63 -2.32 105.19 111.18 3i3o n GLY 51 Ca -0.03 -0.33 0.06 0.00 0.00 0.00 0.00 46.02 45.73 3i3o n GLY 51 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3i3o n GLY 52 N -1.13 0.15 0.13 -0.02 0.00 -1.11 -3.89 105.19 99.32 3i3o n GLY 52 Ca -0.03 -0.31 0.11 0.00 0.00 0.00 0.00 46.02 45.79 3i3o n GLY 52 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 3i3o h ASP 53 N 1.59 0.00 -5.19 1.61 2.03 -1.82 -3.09 116.42 111.55 3i3o h ASP 53 Ca 0.00 0.00 -0.10 0.00 -0.73 0.00 0.00 57.03 56.20 3i3o h ASP 53 Cb 0.36 0.00 -0.04 0.00 -0.83 0.00 0.00 39.33 38.82 3i3o h ASP 53 CO 0.00 0.04 0.08 -0.94 -1.03 0.00 0.00 179.24 177.39 3i3o s SER 54 N -5.53 0.28 0.68 4.15 1.04 -1.26 -4.12 113.70 108.94 3i3o s SER 54 Ca 0.01 -1.19 0.00 0.00 0.48 0.00 0.00 55.95 55.24 3i3o s SER 54 Cb 0.09 0.76 0.00 0.00 0.10 0.00 0.00 66.02 66.96 3i3o s SER 54 CO 0.77 -1.49 0.00 0.61 0.98 0.00 0.00 173.24 174.12 3i3o n GLY 55 N -0.52 2.48 0.24 7.32 0.00 -1.26 -1.08 105.19 112.37 3i3o n GLY 55 Ca -0.04 -0.21 -0.06 0.00 0.00 0.00 0.00 46.02 45.70 3i3o n GLY 55 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3i3o h ILE 56 N 0.00 1.16 -0.76 -0.61 2.04 -1.89 -2.33 117.51 115.12 3i3o h ILE 56 Ca 0.00 -0.32 0.03 0.00 1.00 0.00 0.00 64.86 65.57 3i3o h ILE 56 Cb 0.00 0.30 -0.04 0.00 -0.74 0.00 0.00 36.82 36.34 3i3o h ILE 56 CO 0.00 0.16 0.50 1.23 0.00 0.00 0.00 178.15 180.04 3i3o h GLY 57 N 0.81 1.06 0.98 5.37 0.00 -1.57 -0.32 103.07 109.40 3i3o h GLY 57 Ca 0.22 -0.38 -0.01 0.00 0.00 0.00 0.00 47.33 47.16 3i3o h GLY 57 CO -0.04 0.34 0.25 -0.09 0.00 0.00 0.00 176.54 176.99 3i3o h ARG 58 N 0.96 0.61 -0.70 4.80 2.43 -0.58 -0.05 114.38 121.85 3i3o h ARG 58 Ca 0.29 -0.07 -0.06 0.00 -0.81 0.00 0.00 59.98 59.33 3i3o h ARG 58 Cb -0.01 -0.12 -0.03 0.00 -0.42 0.00 0.00 29.97 29.39 3i3o h ARG 58 CO -0.08 0.47 0.19 0.00 -1.51 0.00 0.00 179.97 179.05 3i3o h ALA 59 N 1.10 0.92 -0.27 2.80 0.00 -0.96 -1.93 119.26 120.92 3i3o h ALA 59 Ca 0.15 -0.24 -0.05 0.00 0.00 0.00 0.00 54.91 54.78 3i3o h ALA 59 Cb 0.04 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.55 3i3o h ALA 59 CO -0.03 0.63 -0.02 0.28 0.00 0.00 0.00 179.25 180.11 3i3o h VAL 60 N 1.05 1.26 -0.56 0.00 2.07 -0.94 -0.57 116.25 118.56 3i3o h VAL 60 Ca 0.22 -0.97 0.05 0.00 0.82 0.00 0.00 66.70 66.83 3i3o h VAL 60 Cb 0.34 1.36 -0.05 0.00 -1.52 0.00 0.00 31.29 31.42 3i3o h VAL 60 CO -0.00 0.31 0.29 0.28 0.02 0.00 0.00 177.57 178.46 3i3o h SER 61 N 0.26 0.41 -0.24 0.57 0.02 -0.79 0.70 113.55 114.48 3i3o h SER 61 Ca 0.07 0.03 -0.06 0.00 -0.84 0.00 0.00 61.79 61.00 3i3o h SER 61 Cb 0.46 -0.04 -0.01 0.00 0.14 0.00 0.00 62.40 62.95 3i3o h SER 61 CO 0.02 0.28 -0.07 0.40 -1.14 0.00 0.00 176.83 176.32 3i3o h ILE 62 N 0.55 1.29 -0.66 3.27 2.04 -1.23 -1.41 117.51 121.37 3i3o h ILE 62 Ca 0.25 -1.08 -0.04 0.00 1.00 0.00 0.00 64.86 64.99 3i3o h ILE 62 Cb 0.17 1.51 -0.03 0.00 -0.74 0.00 0.00 36.82 37.72 3i3o h ILE 62 CO -0.18 0.34 0.27 0.00 0.00 0.00 0.00 178.15 178.58 3i3o h ALA 63 N 0.75 0.85 -0.80 1.87 0.00 -0.93 -1.46 119.26 119.54 3i3o h ALA 63 Ca 0.06 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.80 3i3o h ALA 63 Cb 0.54 -0.26 -0.04 0.00 0.00 0.00 0.00 17.79 18.03 3i3o h ALA 63 CO 0.03 0.46 0.52 0.74 0.00 0.00 0.00 179.25 181.00 3i3o h PHE 64 N 0.92 1.02 -0.47 0.00 -1.00 -0.72 -2.01 116.94 114.68 3i3o h PHE 64 Ca 0.22 0.02 0.02 0.00 2.81 0.00 0.00 57.97 61.03 3i3o h PHE 64 Cb 0.20 -0.34 -0.03 0.00 3.61 0.00 0.00 35.95 39.39 3i3o h PHE 64 CO 0.01 0.65 0.29 0.00 -1.61 0.00 0.00 178.31 177.65 3i3o h ALA 65 N 1.28 0.60 0.00 2.45 0.00 -0.93 -0.96 119.26 121.71 3i3o h ALA 65 Ca 0.29 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.18 3i3o h ALA 65 Cb -0.10 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.54 3i3o h ALA 65 CO -0.06 -0.01 -0.04 0.87 0.00 0.00 0.00 179.25 180.01 3i3o h LYS 66 N 0.58 0.00 -0.29 0.00 1.57 -0.84 -0.84 116.57 116.75 3i3o h LYS 66 Ca 0.18 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.96 3i3o h LYS 66 Cb -0.01 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.30 3i3o h LYS 66 CO -0.07 0.04 0.00 0.39 -0.57 0.00 0.00 179.45 179.24 3i3o n GLU 67 N -3.62 1.87 -0.37 3.15 -0.58 -0.46 -4.33 120.64 116.31 3i3o n GLU 67 Ca -0.02 -1.34 0.00 0.00 -0.42 0.00 0.00 57.16 55.38 3i3o n GLU 67 Cb 0.14 -1.36 0.00 0.00 -0.57 0.00 0.00 31.44 29.65 3i3o n GLU 67 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3i3o n GLY 68 N 1.16 0.75 3.81 0.62 0.00 -0.32 -1.27 105.19 109.95 3i3o n GLY 68 Ca 0.15 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.82 3i3o n GLY 68 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3i3o s ALA 69 N -2.34 3.28 -0.04 4.61 0.00 -0.64 -1.70 121.76 124.93 3i3o s ALA 69 Ca 0.00 0.27 -0.21 0.00 0.00 0.00 0.00 51.96 52.02 3i3o s ALA 69 Cb 0.00 -2.95 -0.05 0.00 0.00 0.00 0.00 23.12 20.12 3i3o s ALA 69 CO 0.00 0.26 0.59 -0.80 0.00 0.00 0.00 175.76 175.81 3i3o s ASN 70 N -1.87 6.92 -0.15 0.00 0.01 0.18 -4.19 114.94 115.84 3i3o s ASN 70 Ca 0.50 1.09 0.02 0.00 -0.71 0.00 0.00 52.86 53.77 3i3o s ASN 70 Cb -0.14 -2.36 0.01 0.00 0.41 0.00 0.00 41.25 39.17 3i3o s ASN 70 CO 0.20 0.04 -0.21 -0.63 -1.51 0.00 0.00 177.10 174.98 3i3o s ILE 71 N 0.17 2.11 -0.23 0.60 -1.09 -0.31 -0.44 121.20 122.01 3i3o s ILE 71 Ca 0.31 -0.95 -0.09 0.00 -2.23 0.00 0.00 60.65 57.69 3i3o s ILE 71 Cb -0.17 -1.85 -0.04 0.00 -1.58 0.00 0.00 42.46 38.81 3i3o s ILE 71 CO 0.16 0.54 0.11 0.00 -1.23 0.00 0.00 174.94 174.53 3i3o s ALA 72 N 0.92 3.44 -0.23 9.38 0.00 0.14 -1.44 121.76 133.97 3i3o s ALA 72 Ca -0.04 -0.93 -0.02 0.00 0.00 0.00 0.00 51.96 50.97 3i3o s ALA 72 Cb -0.15 -2.16 0.01 0.00 0.00 0.00 0.00 23.12 20.81 3i3o s ALA 72 CO -0.04 -0.19 -0.07 0.42 0.00 0.00 0.00 175.76 175.88 3i3o s ILE 73 N 1.06 3.00 -0.03 0.00 1.01 0.22 -0.46 121.20 126.00 3i3o s ILE 73 Ca 0.06 -0.76 -0.03 0.00 0.00 0.00 0.00 60.65 59.92 3i3o s ILE 73 Cb -0.14 -2.41 -0.04 0.00 0.01 0.00 0.00 42.46 39.88 3i3o s ILE 73 CO 0.04 0.36 0.15 0.00 0.00 0.00 0.00 174.94 175.49 3i3o s ALA 74 N 1.40 3.87 0.17 9.38 0.00 -0.15 -0.41 121.76 136.02 3i3o s ALA 74 Ca 0.04 -0.76 -0.24 0.00 0.00 0.00 0.00 51.96 50.99 3i3o s ALA 74 Cb -0.15 -1.84 0.06 0.00 0.00 0.00 0.00 23.12 21.19 3i3o s ALA 74 CO -0.05 0.71 0.85 1.52 0.00 0.00 0.00 175.76 178.79 3i3o s TYR 75 N -1.24 -0.21 0.00 0.00 -0.85 -1.06 -0.27 117.35 113.71 3i3o s TYR 75 Ca 0.24 -0.10 0.00 0.00 -0.52 0.00 0.00 57.07 56.69 3i3o s TYR 75 Cb -0.12 0.64 0.00 0.00 0.38 0.00 0.00 41.96 42.86 3i3o s TYR 75 CO 0.15 -0.91 0.08 -0.11 -1.52 0.00 0.00 175.55 173.24 3i3o n LEU 76 N -0.43 0.41 -0.12 -3.49 7.94 -1.26 -1.44 117.00 118.61 3i3o n LEU 76 Ca -0.07 0.47 0.00 0.00 -1.11 0.00 0.00 56.01 55.30 3i3o n LEU 76 Cb 0.61 -0.43 0.00 0.00 0.53 0.00 0.00 43.42 44.13 3i3o n LEU 76 CO 0.13 -0.43 0.13 -0.90 -1.11 0.00 0.00 177.39 175.21 3i3o n ASP 77 N -1.78 0.00 -4.23 1.96 5.75 -1.26 -2.30 116.55 114.69 3i3o n ASP 77 Ca 0.00 -1.08 -0.43 0.00 -0.01 0.00 0.00 54.79 53.27 3i3o n ASP 77 Cb 0.00 -0.02 0.00 0.00 -1.03 0.00 0.00 41.12 40.07 3i3o n ASP 77 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 3i3o n GLU 78 N 0.00 3.32 -0.35 0.11 4.71 -1.26 -4.76 120.64 122.42 3i3o n GLU 78 Ca 0.00 -3.46 -0.03 0.00 -0.01 0.00 0.00 57.16 53.65 3i3o n GLU 78 Cb 0.52 -3.15 0.09 0.00 -1.01 0.00 0.00 31.44 27.89 3i3o n GLU 78 CO 0.00 0.00 0.00 0.93 0.09 0.00 0.00 177.13 178.15 3i3o h GLU 79 N 6.71 1.27 -0.35 3.49 4.39 -1.98 -0.18 114.58 127.92 3i3o h GLU 79 Ca 0.40 -0.11 -0.01 0.00 0.34 0.00 0.00 59.36 59.98 3i3o h GLU 79 Cb 0.78 -0.27 -0.02 0.00 -0.10 0.00 0.00 28.75 29.14 3i3o h GLU 79 CO 1.48 0.89 0.19 0.78 -1.16 0.00 0.00 179.01 181.19 3i3o h GLY 80 N 1.29 0.53 0.89 -3.84 0.00 -1.99 0.01 103.07 99.96 3i3o h GLY 80 Ca 0.34 -0.25 -0.04 0.00 0.00 0.00 0.00 47.33 47.38 3i3o h GLY 80 CO -0.06 0.24 0.03 -0.55 0.00 0.00 0.00 176.54 176.20 3i3o h ASP 81 N 0.44 0.51 -0.81 0.19 3.32 -1.74 -2.14 116.42 116.19 3i3o h ASP 81 Ca 0.12 -0.28 0.03 0.00 0.02 0.00 0.00 57.03 56.92 3i3o h ASP 81 Cb 0.08 -0.14 -0.05 0.00 0.22 0.00 0.00 39.33 39.44 3i3o h ASP 81 CO -0.02 0.66 0.52 0.00 -1.72 0.00 0.00 179.24 178.68 3i3o h ALA 82 N 0.87 1.05 -0.55 3.45 0.00 -0.90 -1.54 119.26 121.64 3i3o h ALA 82 Ca 0.09 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.94 3i3o h ALA 82 Cb 0.38 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 3i3o h ALA 82 CO 0.01 0.36 0.24 -0.97 0.00 0.00 0.00 179.25 178.88 3i3o h ASN 83 N 1.02 0.75 -0.50 0.00 -1.24 -0.86 -1.43 115.58 113.32 3i3o h ASN 83 Ca 0.32 -0.16 -0.03 0.00 0.71 0.00 0.00 56.30 57.14 3i3o h ASN 83 Cb -0.02 -0.19 -0.02 0.00 0.73 0.00 0.00 38.32 38.82 3i3o h ASN 83 CO -0.10 0.70 0.19 -0.08 -1.29 0.00 0.00 177.43 176.85 3i3o h GLU 84 N 0.75 0.75 -0.56 6.67 4.81 -1.00 -2.09 114.58 123.91 3i3o h GLU 84 Ca 0.19 -0.14 0.02 0.00 -0.13 0.00 0.00 59.36 59.29 3i3o h GLU 84 Cb 0.17 -0.12 -0.03 0.00 0.63 0.00 0.00 28.75 29.40 3i3o h GLU 84 CO -0.02 0.68 0.36 1.15 -0.73 0.00 0.00 179.01 180.44 3i3o h THR 85 N 0.67 1.10 -0.79 0.32 2.02 -1.16 -2.31 112.91 112.76 3i3o h THR 85 Ca 0.16 -0.25 0.06 0.00 0.77 0.00 0.00 66.41 67.16 3i3o h THR 85 Cb 0.21 0.32 -0.06 0.00 -1.74 0.00 0.00 68.15 66.89 3i3o h THR 85 CO -0.01 0.13 0.47 0.50 0.37 0.00 0.00 175.52 176.98 3i3o h LYS 86 N 0.72 0.84 -0.64 6.66 3.64 -1.02 -0.16 116.57 126.61 3i3o h LYS 86 Ca 0.22 -0.05 -0.08 0.00 -1.27 0.00 0.00 60.65 59.47 3i3o h LYS 86 Cb -0.03 -0.19 -0.02 0.00 -0.41 0.00 0.00 32.23 31.57 3i3o h LYS 86 CO -0.07 0.56 0.10 1.96 -2.27 0.00 0.00 179.45 179.72 3i3o h GLN 87 N 0.87 1.06 -0.72 1.90 4.20 -0.90 -0.23 115.11 121.30 3i3o h GLN 87 Ca 0.35 -0.29 -0.06 0.00 0.06 0.00 0.00 58.65 58.70 3i3o h GLN 87 Cb 0.17 -0.12 -0.03 0.00 0.30 0.00 0.00 27.48 27.80 3i3o h GLN 87 CO -0.17 0.99 0.21 1.88 -0.67 0.00 0.00 178.83 181.06 3i3o h TYR 88 N 0.98 1.17 -0.12 2.96 0.05 -1.00 -1.79 116.97 119.22 3i3o h TYR 88 Ca 0.19 -0.13 -0.01 0.00 0.05 0.00 0.00 58.73 58.84 3i3o h TYR 88 Cb 0.45 -0.34 -0.01 0.00 1.01 0.00 0.00 36.73 37.84 3i3o h TYR 88 CO 0.03 0.94 0.04 0.28 -1.05 0.00 0.00 178.16 178.40 3i3o h VAL 89 N 1.07 1.18 -0.01 -2.88 2.07 -0.75 -3.16 116.25 113.77 3i3o h VAL 89 Ca 0.23 -0.54 -0.08 0.00 0.82 0.00 0.00 66.70 67.14 3i3o h VAL 89 Cb 0.33 1.31 -0.01 0.00 -1.52 0.00 0.00 31.29 31.40 3i3o h VAL 89 CO -0.00 0.16 -0.35 -0.33 0.02 0.00 0.00 177.57 177.06 3i3o h GLU 90 N 0.01 0.02 -0.71 1.57 5.08 -0.96 -1.59 114.58 118.00 3i3o h GLU 90 Ca 0.04 -0.01 0.21 0.00 -1.00 0.00 0.00 59.36 58.60 3i3o h GLU 90 Cb 0.21 -0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.44 3i3o h GLU 90 CO -0.00 0.37 0.61 -0.22 -1.00 0.00 0.00 179.01 178.77 3i3o h LYS 91 N 0.02 0.00 -0.09 2.33 3.64 -1.28 0.27 116.57 121.46 3i3o h LYS 91 Ca -0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 3i3o h LYS 91 Cb 0.63 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.45 3i3o h LYS 91 CO 0.05 0.00 0.00 0.39 -2.27 0.00 0.00 179.45 177.62 3i3o n GLU 92 N -3.94 1.41 -1.18 1.90 -0.58 -0.60 -4.92 120.64 112.74 3i3o n GLU 92 Ca 0.14 -0.62 -0.05 0.00 -0.42 0.00 0.00 57.16 56.21 3i3o n GLU 92 Cb 0.87 -1.35 -0.02 0.00 -0.57 0.00 0.00 31.44 30.37 3i3o n GLU 92 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3i3o n GLY 93 N 0.98 0.79 3.84 0.62 0.00 0.96 -4.93 105.19 107.45 3i3o n GLY 93 Ca 0.15 -0.81 -0.22 0.00 0.00 0.00 0.00 46.02 45.14 3i3o n GLY 93 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3i3o s VAL 94 N -2.20 2.47 0.26 1.61 -7.23 -1.26 -5.08 120.40 108.97 3i3o s VAL 94 Ca 0.00 -1.46 -0.21 0.00 -1.81 0.00 0.00 61.98 58.50 3i3o s VAL 94 Cb 0.00 -2.93 -0.09 0.00 0.56 0.00 0.00 36.38 33.92 3i3o s VAL 94 CO 0.00 0.00 0.79 -0.54 -0.31 0.00 0.00 175.10 175.04 3i3o s LYS 95 N -4.08 4.30 -0.03 4.82 1.02 -1.26 -4.44 119.74 120.08 3i3o s LYS 95 Ca 0.45 0.96 0.01 0.00 0.02 0.00 0.00 55.97 57.42 3i3o s LYS 95 Cb -0.01 -2.78 0.01 0.00 -0.52 0.00 0.00 37.83 34.53 3i3o s LYS 95 CO 0.26 0.33 -0.04 0.00 -0.92 0.00 0.00 175.35 174.97 3i3o s VAL 97 N 0.59 1.68 -0.19 0.00 1.01 -0.52 -5.01 120.40 117.96 3i3o s VAL 97 Ca -0.07 -0.76 -0.12 0.00 0.00 0.00 0.00 61.98 61.03 3i3o s VAL 97 Cb -0.11 -1.51 -0.05 0.00 0.00 0.00 0.00 36.38 34.72 3i3o s VAL 97 CO -0.00 0.48 0.20 -0.76 0.00 0.00 0.00 175.10 175.01 3i3o s LEU 98 N 0.83 4.21 -0.58 3.92 1.43 -1.26 -0.61 118.68 126.61 3i3o s LEU 98 Ca -0.09 0.32 0.04 0.00 -1.03 0.00 0.00 54.13 53.37 3i3o s LEU 98 Cb -0.16 -2.20 0.17 0.00 0.03 0.00 0.00 46.19 44.03 3i3o s LEU 98 CO 0.00 0.13 0.41 -0.76 0.23 0.00 0.00 176.35 176.36 3i3o s LEU 99 N 0.53 3.43 0.59 1.79 1.43 0.46 -4.95 118.68 121.95 3i3o s LEU 99 Ca 0.11 -3.46 -0.17 0.00 -1.03 0.00 0.00 54.13 49.58 3i3o s LEU 99 Cb -0.12 -1.16 -0.03 0.00 0.03 0.00 0.00 46.19 44.90 3i3o s LEU 99 CO 0.01 -0.13 1.09 -2.16 0.23 0.00 0.00 176.35 175.39 3i3o s PRO 100 N -0.75 3.20 0.00 1.29 0.04 -1.26 -2.56 135.00 134.96 3i3o s PRO 100 Ca 0.27 1.38 0.00 0.00 0.04 0.00 0.00 61.00 62.69 3i3o s PRO 100 Cb -0.04 -2.00 0.00 0.00 0.04 0.00 0.00 34.50 32.50 3i3o s PRO 100 CO -0.16 -0.93 0.00 0.41 0.04 0.00 0.00 177.00 176.36 3i3o n GLY 101 N -0.48 3.80 3.54 0.56 0.00 -0.52 -4.91 105.19 107.17 3i3o n GLY 101 Ca 0.10 -1.46 -0.43 0.00 0.00 0.00 0.00 46.02 44.23 3i3o n GLY 101 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3i3o s ASP 102 N 0.00 6.40 0.00 1.61 -1.08 -1.26 -4.03 116.67 118.31 3i3o s ASP 102 Ca 0.00 -0.15 0.20 0.00 -0.52 0.00 0.00 52.55 52.07 3i3o s ASP 102 Cb 0.00 -2.38 1.18 0.00 -1.46 0.00 0.00 42.92 40.25 3i3o s ASP 102 CO 0.00 -0.93 1.66 0.18 0.52 0.00 0.00 175.17 176.60 3i3o n LEU 103 N 6.74 0.00 0.00 -1.34 4.77 -1.26 -2.41 117.00 123.50 3i3o n LEU 103 Ca 0.02 0.00 0.12 0.00 -0.03 0.00 0.00 56.01 56.11 3i3o n LEU 103 Cb 0.48 0.00 0.57 0.00 -2.33 0.00 0.00 43.42 42.14 3i3o n LEU 103 CO 0.59 0.00 0.88 -1.54 -1.33 0.00 0.00 177.39 175.99 3i3o n SER 104 N -0.86 0.00 -4.61 -1.43 3.41 -1.26 -4.52 113.62 104.35 3i3o n SER 104 Ca 0.15 0.09 -0.38 0.00 -0.26 0.00 0.00 58.87 58.47 3i3o n SER 104 Cb 0.07 -0.34 -0.10 0.00 -0.26 0.00 0.00 64.21 63.57 3i3o n SER 104 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3i3o s ASP 105 N -2.68 6.08 0.17 4.04 2.15 -1.01 -4.91 116.67 120.50 3i3o s ASP 105 Ca 0.20 0.06 -0.15 0.00 0.43 0.00 0.00 52.55 53.09 3i3o s ASP 105 Cb 0.16 -2.13 0.13 0.00 -0.30 0.00 0.00 42.92 40.78 3i3o s ASP 105 CO 0.38 -0.04 1.69 -0.08 -0.17 0.00 0.00 175.17 176.95 3i3o h GLU 106 N 8.14 0.10 -0.88 4.34 4.81 -1.89 -2.43 114.58 126.77 3i3o h GLU 106 Ca -0.35 -0.01 0.05 0.00 -0.13 0.00 0.00 59.36 58.92 3i3o h GLU 106 Cb 1.18 -0.02 -0.06 0.00 0.63 0.00 0.00 28.75 30.48 3i3o h GLU 106 CO 0.59 0.07 0.56 0.37 -0.73 0.00 0.00 179.01 179.86 3i3o h GLN 107 N 0.11 1.01 -0.29 1.92 5.75 -1.96 -0.79 115.11 120.86 3i3o h GLN 107 Ca 0.21 -0.06 -0.04 0.00 -0.15 0.00 0.00 58.65 58.61 3i3o h GLN 107 Cb 0.31 -0.23 -0.02 0.00 1.07 0.00 0.00 27.48 28.61 3i3o h GLN 107 CO -0.36 0.67 -0.01 1.25 -2.65 0.00 0.00 178.83 177.73 3i3o h HIS 108 N 1.04 0.45 -0.80 3.99 2.76 -1.75 -0.14 115.15 120.71 3i3o h HIS 108 Ca 0.37 -0.04 -0.03 0.00 -2.20 0.00 0.00 60.37 58.47 3i3o h HIS 108 Cb 0.10 -0.13 -0.04 0.00 1.55 0.00 0.00 27.41 28.89 3i3o h HIS 108 CO -0.02 0.46 0.39 0.00 -1.30 0.00 0.00 177.93 177.46 3i3o h LYS 110 N 1.13 0.98 -0.54 0.00 1.57 -0.75 -3.22 116.57 115.74 3i3o h LYS 110 Ca 0.28 -0.45 -0.02 0.00 -1.87 0.00 0.00 60.65 58.59 3i3o h LYS 110 Cb 0.11 -0.02 -0.03 0.00 0.08 0.00 0.00 32.23 32.37 3i3o h LYS 110 CO -0.04 1.12 0.26 -0.44 -0.57 0.00 0.00 179.45 179.78 3i3o h ASP 111 N 0.83 0.68 0.46 0.86 3.32 -0.66 -1.82 116.42 120.09 3i3o h ASP 111 Ca 0.10 -0.06 -0.12 0.00 0.02 0.00 0.00 57.03 56.97 3i3o h ASP 111 Cb 0.84 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 40.21 3i3o h ASP 111 CO 0.07 0.58 -0.53 0.16 -1.72 0.00 0.00 179.24 177.81 3i3o h ILE 112 N 0.76 1.37 -0.06 0.35 3.07 -1.31 0.73 117.51 122.41 3i3o h ILE 112 Ca 0.19 -1.81 -0.09 0.00 1.55 0.00 0.00 64.86 64.70 3i3o h ILE 112 Cb 0.08 1.95 0.00 0.00 -0.27 0.00 0.00 36.82 38.58 3i3o h ILE 112 CO -0.03 0.52 -0.33 0.58 -1.05 0.00 0.00 178.15 177.85 3i3o h VAL 113 N 0.05 1.43 -0.77 0.16 2.07 -1.53 -1.23 116.25 116.44 3i3o h VAL 113 Ca -0.00 -1.75 0.04 0.00 0.82 0.00 0.00 66.70 65.81 3i3o h VAL 113 Cb 0.95 2.35 -0.05 0.00 -1.52 0.00 0.00 31.29 33.02 3i3o h VAL 113 CO 0.07 0.50 0.48 -0.61 0.02 0.00 0.00 177.57 178.04 3i3o h GLN 114 N -0.16 0.90 -0.44 1.57 4.15 -1.23 -1.88 115.11 118.02 3i3o h GLN 114 Ca -0.02 -0.05 -0.12 0.00 0.77 0.00 0.00 58.65 59.22 3i3o h GLN 114 Cb 0.99 -0.20 -0.01 0.00 0.21 0.00 0.00 27.48 28.46 3i3o h GLN 114 CO 0.07 0.59 -0.20 1.49 -1.93 0.00 0.00 178.83 178.85 3i3o h GLU 115 N 0.93 0.92 -0.40 1.69 4.57 -0.81 -1.17 114.58 120.30 3i3o h GLU 115 Ca 0.32 -0.39 0.06 0.00 -1.18 0.00 0.00 59.36 58.16 3i3o h GLU 115 Cb 0.06 -0.03 -0.05 0.00 -0.16 0.00 0.00 28.75 28.57 3i3o h GLU 115 CO -0.13 1.05 0.11 1.15 -1.18 0.00 0.00 179.01 180.02 3i3o h THR 116 N 0.75 0.84 -0.55 0.32 2.02 -1.01 -0.96 112.91 114.33 3i3o h THR 116 Ca 0.10 -0.09 -0.11 0.00 0.77 0.00 0.00 66.41 67.08 3i3o h THR 116 Cb 0.77 0.55 -0.02 0.00 -1.74 0.00 0.00 68.15 67.71 3i3o h THR 116 CO 0.06 0.05 -0.08 0.58 0.37 0.00 0.00 175.52 176.50 3i3o h VAL 117 N 0.26 1.27 -0.51 3.16 2.07 -1.12 0.87 116.25 122.25 3i3o h VAL 117 Ca 0.19 -1.23 0.02 0.00 0.82 0.00 0.00 66.70 66.50 3i3o h VAL 117 Cb 0.20 0.93 -0.03 0.00 -1.52 0.00 0.00 31.29 30.87 3i3o h VAL 117 CO -0.22 0.44 0.32 -0.09 0.02 0.00 0.00 177.57 178.03 3i3o h ARG 118 N 0.91 0.62 0.18 1.57 2.43 -0.88 0.14 114.38 119.34 3i3o h ARG 118 Ca 0.15 -0.04 -0.35 0.00 -0.81 0.00 0.00 59.98 58.93 3i3o h ARG 118 Cb 0.64 -0.14 0.01 0.00 -0.42 0.00 0.00 29.97 30.06 3i3o h ARG 118 CO 0.04 0.41 -1.71 1.96 -1.51 0.00 0.00 179.97 179.16 3i3o h GLN 119 N 0.64 0.39 0.00 0.20 1.08 -0.93 -3.37 115.11 113.11 3i3o h GLN 119 Ca 0.20 -0.67 -0.02 0.00 -1.45 0.00 0.00 58.65 56.71 3i3o h GLN 119 Cb -0.01 0.25 -0.00 0.00 -0.05 0.00 0.00 27.48 27.66 3i3o h GLN 119 CO -0.07 1.30 -1.25 1.28 -0.95 0.00 0.00 178.83 179.14 3i3o n LEU 120 N -3.58 0.69 0.00 1.46 4.77 0.28 -4.98 117.00 115.63 3i3o n LEU 120 Ca -0.23 0.27 0.00 0.00 -0.03 0.00 0.00 56.01 56.02 3i3o n LEU 120 Cb 1.08 -0.03 0.00 0.00 -2.33 0.00 0.00 43.42 42.14 3i3o n LEU 120 CO 0.52 -0.11 0.00 0.61 -1.33 0.00 0.00 177.39 177.08 3i3o n GLY 121 N 1.23 2.89 3.38 -0.72 0.00 0.48 -4.97 105.19 107.47 3i3o n GLY 121 Ca -0.02 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.97 3i3o n GLY 121 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3i3o n SER 122 N 0.00 -1.57 -3.82 1.61 3.41 -1.24 -4.89 113.62 107.11 3i3o n SER 122 Ca 0.00 -1.85 -0.20 0.00 -0.26 0.00 0.00 58.87 56.56 3i3o n SER 122 Cb 0.00 2.56 -0.17 0.00 -0.26 0.00 0.00 64.21 66.34 3i3o n SER 122 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 3i3o s LEU 123 N 0.00 1.01 -0.09 1.04 2.96 -1.26 -4.58 118.68 117.76 3i3o s LEU 123 Ca 0.20 -0.07 0.03 0.00 -0.22 0.00 0.00 54.13 54.06 3i3o s LEU 123 Cb -0.03 -0.35 -0.08 0.00 0.50 0.00 0.00 46.19 46.24 3i3o s LEU 123 CO 0.05 -0.12 -0.06 0.59 -1.32 0.00 0.00 176.35 175.50 3i3o n ASN 124 N 4.44 3.16 -3.85 3.68 4.13 -0.02 -4.56 115.26 122.24 3i3o n ASN 124 Ca -0.20 -0.04 -0.18 0.00 1.68 0.00 0.00 54.58 55.84 3i3o n ASN 124 Cb 0.50 0.08 -0.16 0.00 -1.54 0.00 0.00 39.78 38.66 3i3o n ASN 124 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 3i3o s ILE 125 N -2.20 0.34 -0.14 2.41 1.01 -0.92 -1.37 121.20 120.33 3i3o s ILE 125 Ca -0.11 -0.01 0.01 0.00 0.00 0.00 0.00 60.65 60.54 3i3o s ILE 125 Cb 0.03 -0.41 -0.00 0.00 0.01 0.00 0.00 42.46 42.09 3i3o s ILE 125 CO 0.26 0.18 -0.16 -0.22 0.00 0.00 0.00 174.94 175.00 3i3o s LEU 126 N 0.97 2.46 -0.34 2.97 2.96 -0.48 -1.43 118.68 125.80 3i3o s LEU 126 Ca -0.10 -0.46 -0.02 0.00 -0.22 0.00 0.00 54.13 53.32 3i3o s LEU 126 Cb -0.14 -1.55 0.07 0.00 0.50 0.00 0.00 46.19 45.07 3i3o s LEU 126 CO -0.01 0.11 0.07 -0.69 -1.32 0.00 0.00 176.35 174.51 3i3o s VAL 127 N 0.69 3.10 -0.39 1.68 1.01 0.60 -1.09 120.40 126.00 3i3o s VAL 127 Ca -0.08 -1.61 -0.25 0.00 0.00 0.00 0.00 61.98 60.05 3i3o s VAL 127 Cb -0.16 -2.91 0.02 0.00 0.00 0.00 0.00 36.38 33.33 3i3o s VAL 127 CO 0.02 -0.31 0.87 0.20 0.00 0.00 0.00 175.10 175.88 3i3o s ASN 128 N 1.42 6.58 0.00 3.32 0.01 -0.38 -1.16 114.94 124.72 3i3o s ASN 128 Ca -0.00 0.35 0.00 0.00 -0.71 0.00 0.00 52.86 52.50 3i3o s ASN 128 Cb -0.21 -2.43 0.00 0.00 0.41 0.00 0.00 41.25 39.02 3i3o s ASN 128 CO -0.02 -0.86 0.00 -3.20 -1.51 0.00 0.00 177.10 171.51 3i3o n ASN 129 N 6.74 0.00 -4.75 -1.22 5.15 -1.15 -0.98 115.26 119.05 3i3o n ASN 129 Ca 0.05 0.00 -0.38 0.00 -0.60 0.00 0.00 54.58 53.65 3i3o n ASN 129 Cb 0.48 0.00 0.03 0.00 -0.53 0.00 0.00 39.78 39.76 3i3o n ASN 129 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 3i3o s VAL 130 N 0.00 2.22 -0.07 3.44 0.11 -0.98 -4.77 120.40 120.35 3i3o s VAL 130 Ca 0.00 0.17 -0.30 0.00 -2.93 0.00 0.00 61.98 58.92 3i3o s VAL 130 Cb 0.00 -3.09 0.10 0.00 -1.53 0.00 0.00 36.38 31.86 3i3o s VAL 130 CO 0.00 0.00 0.82 0.00 -3.33 0.00 0.00 175.10 172.59 3i3o s ALA 131 N -1.33 -1.83 0.11 1.54 0.00 -1.26 -4.68 121.76 114.31 3i3o s ALA 131 Ca 0.70 1.31 0.05 0.00 0.00 0.00 0.00 51.96 54.02 3i3o s ALA 131 Cb -0.39 -0.15 -0.04 0.00 0.00 0.00 0.00 23.12 22.55 3i3o s ALA 131 CO 0.47 -0.42 -0.12 -0.65 0.00 0.00 0.00 175.76 175.04 3i3o s GLN 132 N -1.63 0.93 -0.09 0.00 -0.21 -1.26 -4.99 119.66 112.41 3i3o s GLN 132 Ca -0.04 -1.21 -0.07 0.00 0.02 0.00 0.00 55.36 54.06 3i3o s GLN 132 Cb -0.00 -0.69 0.03 0.00 1.00 0.00 0.00 33.01 33.34 3i3o s GLN 132 CO 0.02 0.12 0.23 1.14 -2.12 0.00 0.00 175.29 174.68 3i3o s GLN 133 N -2.80 0.25 -0.43 2.91 -2.07 -1.26 -4.91 119.66 111.35 3i3o s GLN 133 Ca 0.08 0.36 0.02 0.00 -1.82 0.00 0.00 55.36 54.00 3i3o s GLN 133 Cb -0.03 0.06 0.14 0.00 -1.09 0.00 0.00 33.01 32.09 3i3o s GLN 133 CO 0.01 -0.07 0.24 0.71 -1.32 0.00 0.00 175.29 174.87 3i3o s TYR 134 N 0.41 1.87 0.46 9.60 2.02 -1.26 -4.77 117.35 125.68 3i3o s TYR 134 Ca -0.02 -2.36 -0.24 0.00 -0.37 0.00 0.00 57.07 54.08 3i3o s TYR 134 Cb -0.04 -1.80 -0.09 0.00 -0.40 0.00 0.00 41.96 39.64 3i3o s TYR 134 CO -0.02 -0.79 1.20 -2.30 -1.57 0.00 0.00 175.55 172.08 3i3o n PRO 135 N 3.58 1.67 -3.91 -1.71 -0.02 -1.26 -4.91 135.00 128.44 3i3o n PRO 135 Ca 0.09 0.60 -0.11 0.00 -2.02 0.00 0.00 63.50 62.07 3i3o n PRO 135 Cb 0.35 -2.33 -0.11 0.00 -0.02 0.00 0.00 33.50 31.39 3i3o n PRO 135 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 3i3o s GLN 136 N -2.33 0.33 0.17 -0.52 -1.52 -0.17 -5.03 119.66 110.60 3i3o s GLN 136 Ca 0.65 -0.37 0.20 0.00 -1.95 0.00 0.00 55.36 53.88 3i3o s GLN 136 Cb -0.49 0.13 0.84 0.00 -0.22 0.00 0.00 33.01 33.27 3i3o s GLN 136 CO 0.55 -0.07 1.61 0.00 -0.25 0.00 0.00 175.29 177.13 3i3o n GLN 137 N 1.84 0.12 -3.61 2.91 10.64 -1.26 -4.41 117.38 123.61 3i3o n GLN 137 Ca -0.21 0.38 -0.01 0.00 -1.83 0.00 0.00 57.00 55.34 3i3o n GLN 137 Cb 0.56 -1.75 -0.01 0.00 -0.86 0.00 0.00 30.24 28.18 3i3o n GLN 137 CO 0.00 0.00 0.00 0.20 -1.83 0.00 0.00 177.06 175.43 3i3o s GLY 138 N -3.36 -0.36 0.36 2.61 0.00 -1.26 -4.92 107.32 100.39 3i3o s GLY 138 Ca 0.05 1.08 0.09 0.00 0.00 0.00 0.00 44.72 45.93 3i3o s GLY 138 CO 0.33 0.29 1.90 -2.00 0.00 0.00 0.00 173.10 173.62 3i3o h LEU 139 N 2.00 0.63 -2.82 0.66 5.85 -1.89 -1.19 115.31 118.55 3i3o h LEU 139 Ca -0.22 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.53 3i3o h LEU 139 Cb 1.19 -0.10 -0.00 0.00 0.37 0.00 0.00 40.66 42.12 3i3o h LEU 139 CO 0.26 0.35 0.01 -0.33 -0.34 0.00 0.00 178.44 178.38 3i3o h GLU 140 N 0.68 0.00 -0.57 1.25 5.08 -2.00 -1.11 114.58 117.91 3i3o h GLU 140 Ca 0.40 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.76 3i3o h GLU 140 Cb 0.61 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.86 3i3o h GLU 140 CO -0.17 0.00 0.00 0.66 -1.00 0.00 0.00 179.01 178.50 3i3o n TYR 141 N -3.31 0.78 -3.54 4.33 4.02 -0.45 -4.81 117.16 114.18 3i3o n TYR 141 Ca -0.03 -0.38 -0.41 0.00 -0.01 0.00 0.00 57.90 57.07 3i3o n TYR 141 Cb 0.08 -0.01 -0.11 0.00 -0.02 0.00 0.00 39.34 39.28 3i3o n TYR 141 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 176.86 176.27 3i3o s ILE 142 N -1.27 4.91 0.70 -0.72 1.01 -0.42 -4.96 121.20 120.45 3i3o s ILE 142 Ca 0.38 -0.66 -0.11 0.00 0.00 0.00 0.00 60.65 60.25 3i3o s ILE 142 Cb 0.20 -3.69 0.01 0.00 0.01 0.00 0.00 42.46 38.99 3i3o s ILE 142 CO 0.25 -0.20 1.07 0.42 0.00 0.00 0.00 174.94 176.48 3i3o s THR 143 N 1.63 3.85 0.23 2.92 -4.23 -1.26 -4.89 115.64 113.89 3i3o s THR 143 Ca 0.04 0.60 -0.07 0.00 -1.18 0.00 0.00 61.69 61.07 3i3o s THR 143 Cb -0.19 -3.49 0.22 0.00 1.34 0.00 0.00 72.50 70.38 3i3o s THR 143 CO 0.08 -0.78 1.90 0.00 -0.54 0.00 0.00 174.62 175.28 3i3o h ALA 144 N -0.66 1.16 -0.43 3.99 0.00 -1.99 -1.21 119.26 120.12 3i3o h ALA 144 Ca -0.45 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.39 3i3o h ALA 144 Cb 1.23 -0.37 -0.02 0.00 0.00 0.00 0.00 17.79 18.63 3i3o h ALA 144 CO 0.61 0.59 0.29 0.93 0.00 0.00 0.00 179.25 181.66 3i3o h GLU 145 N 1.25 0.57 -0.35 0.00 3.07 -2.00 -1.54 114.58 115.59 3i3o h GLU 145 Ca 0.33 -0.04 -0.07 0.00 -0.50 0.00 0.00 59.36 59.09 3i3o h GLU 145 Cb -0.11 -0.13 -0.01 0.00 -0.84 0.00 0.00 28.75 27.66 3i3o h GLU 145 CO -0.07 0.38 -0.04 0.37 -1.40 0.00 0.00 179.01 178.25 3i3o h GLN 146 N 0.59 0.64 -0.14 2.33 4.15 -1.82 -1.73 115.11 119.13 3i3o h GLN 146 Ca 0.16 -0.23 0.05 0.00 0.77 0.00 0.00 58.65 59.40 3i3o h GLN 146 Cb -0.06 -0.05 -0.06 0.00 0.21 0.00 0.00 27.48 27.52 3i3o h GLN 146 CO -0.03 0.79 -0.25 1.25 -1.93 0.00 0.00 178.83 178.65 3i3o h LEU 147 N 0.44 -0.79 -0.60 -2.39 5.85 -1.06 -0.84 115.31 115.92 3i3o h LEU 147 Ca 0.09 0.13 -0.12 0.00 0.84 0.00 0.00 57.88 58.82 3i3o h LEU 147 Cb 0.53 0.35 -0.01 0.00 0.37 0.00 0.00 40.66 41.89 3i3o h LEU 147 CO 0.03 -0.30 -0.21 -0.33 -0.34 0.00 0.00 178.44 177.28 3i3o h GLU 148 N -0.32 0.89 -0.57 1.25 5.08 -1.24 -1.92 114.58 117.75 3i3o h GLU 148 Ca 0.10 -0.37 0.00 0.00 -1.00 0.00 0.00 59.36 58.10 3i3o h GLU 148 Cb 0.47 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.66 3i3o h GLU 148 CO -0.32 1.01 0.36 -0.22 -1.00 0.00 0.00 179.01 178.85 3i3o h LYS 149 N 0.77 0.75 -0.31 2.33 3.64 -1.15 0.06 116.57 122.66 3i3o h LYS 149 Ca 0.10 -0.05 -0.02 0.00 -1.27 0.00 0.00 60.65 59.41 3i3o h LYS 149 Cb 0.76 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 32.40 3i3o h LYS 149 CO 0.06 0.52 0.11 1.15 -2.27 0.00 0.00 179.45 179.02 3i3o h THR 150 N 0.76 1.19 -0.52 1.00 2.02 -0.93 -1.82 112.91 114.61 3i3o h THR 150 Ca 0.21 -0.60 -0.12 0.00 0.77 0.00 0.00 66.41 66.66 3i3o h THR 150 Cb -0.06 1.00 -0.02 0.00 -1.74 0.00 0.00 68.15 67.33 3i3o h THR 150 CO -0.04 0.21 -0.15 -0.26 0.37 0.00 0.00 175.52 175.64 3i3o h PHE 151 N 0.35 1.16 -0.64 3.16 -1.00 -1.27 -0.73 116.94 117.98 3i3o h PHE 151 Ca 0.10 -0.26 -0.04 0.00 2.81 0.00 0.00 57.97 60.58 3i3o h PHE 151 Cb 0.21 -0.28 -0.03 0.00 3.61 0.00 0.00 35.95 39.46 3i3o h PHE 151 CO -0.00 1.09 0.23 -0.09 -1.61 0.00 0.00 178.31 177.93 3i3o h ARG 152 N 0.89 0.97 0.22 1.51 2.43 -0.78 -0.51 114.38 119.11 3i3o h ARG 152 Ca 0.13 -0.19 -0.31 0.00 -0.81 0.00 0.00 59.98 58.80 3i3o h ARG 152 Cb 0.73 -0.15 0.03 0.00 -0.42 0.00 0.00 29.97 30.16 3i3o h ARG 152 CO 0.06 0.83 -1.40 0.97 -1.51 0.00 0.00 179.97 178.92 3i3o h ILE 153 N 0.90 1.25 0.06 1.20 6.09 -1.36 -2.44 117.51 123.21 3i3o h ILE 153 Ca 0.21 -2.62 -0.24 0.00 -1.37 0.00 0.00 64.86 60.83 3i3o h ILE 153 Cb 0.24 3.01 -0.02 0.00 0.47 0.00 0.00 36.82 40.53 3i3o h ILE 153 CO -0.01 0.79 -1.16 0.78 -3.07 0.00 0.00 178.15 175.48 3i3o h ASN 154 N 0.01 0.19 0.00 2.19 4.21 -1.10 -3.37 115.58 117.72 3i3o h ASN 154 Ca -0.25 -0.21 0.00 0.00 1.21 0.00 0.00 56.30 57.04 3i3o h ASN 154 Cb 2.04 -0.06 0.00 0.00 -1.12 0.00 0.00 38.32 39.18 3i3o h ASN 154 CO 0.23 1.17 -0.82 0.00 -1.29 0.00 0.00 177.43 176.71 3i3o n ILE 155 N -3.41 0.00 -0.20 2.81 0.13 -0.51 -4.61 119.36 113.57 3i3o n ILE 155 Ca -0.05 0.00 -0.03 0.00 -1.10 0.00 0.00 62.75 61.56 3i3o n ILE 155 Cb 0.98 -0.52 0.15 0.00 -0.84 0.00 0.00 39.64 39.42 3i3o n ILE 155 CO 0.00 0.00 0.00 -0.26 2.80 0.00 0.00 176.55 179.09 3i3o h PHE 156 N 0.00 0.99 -0.35 9.51 0.04 -1.17 -2.00 116.94 123.96 3i3o h PHE 156 Ca 0.00 -0.07 -0.00 0.00 2.80 0.00 0.00 57.97 60.70 3i3o h PHE 156 Cb 0.82 -0.30 -0.02 0.00 2.20 0.00 0.00 35.95 38.66 3i3o h PHE 156 CO 0.00 0.78 0.21 0.66 -0.60 0.00 0.00 178.31 179.36 3i3o h SER 157 N 0.95 0.41 -0.49 2.17 4.64 -1.59 -0.88 113.55 118.76 3i3o h SER 157 Ca 0.22 -0.02 -0.11 0.00 -0.47 0.00 0.00 61.79 61.41 3i3o h SER 157 Cb 0.22 -0.10 -0.02 0.00 -0.31 0.00 0.00 62.40 62.19 3i3o h SER 157 CO -0.01 0.31 -0.12 1.88 -0.87 0.00 0.00 176.83 178.02 3i3o h TYR 158 N 0.48 1.08 0.25 4.77 -1.99 -1.63 -1.11 116.97 118.81 3i3o h TYR 158 Ca 0.13 -0.22 -0.01 0.00 2.00 0.00 0.00 58.73 60.62 3i3o h TYR 158 Cb -0.02 -0.27 0.00 0.00 2.00 0.00 0.00 36.73 38.44 3i3o h TYR 158 CO 0.00 1.02 -0.12 0.74 -0.00 0.00 0.00 178.16 179.80 3i3o h PHE 159 N 0.86 -0.31 -0.38 4.88 0.04 -0.89 -2.26 116.94 118.90 3i3o h PHE 159 Ca 0.13 -0.01 -0.11 0.00 2.80 0.00 0.00 57.97 60.79 3i3o h PHE 159 Cb 0.67 0.10 -0.01 0.00 2.20 0.00 0.00 35.95 38.91 3i3o h PHE 159 CO 0.04 -0.08 -0.20 0.45 -0.60 0.00 0.00 178.31 177.92 3i3o h HIS 160 N -0.48 0.92 -0.29 -0.55 3.86 -1.14 0.03 115.15 117.50 3i3o h HIS 160 Ca -0.03 -0.23 -0.03 0.00 -1.16 0.00 0.00 60.37 58.91 3i3o h HIS 160 Cb 0.36 -0.21 -0.01 0.00 1.06 0.00 0.00 27.41 28.61 3i3o h HIS 160 CO -0.02 0.99 0.08 0.28 0.86 0.00 0.00 177.93 180.12 3i3o h VAL 161 N 0.60 1.21 -0.57 2.45 2.07 -1.30 -2.16 116.25 118.55 3i3o h VAL 161 Ca 0.08 -0.69 -0.11 0.00 0.82 0.00 0.00 66.70 66.80 3i3o h VAL 161 Cb 0.75 1.11 -0.02 0.00 -1.52 0.00 0.00 31.29 31.61 3i3o h VAL 161 CO 0.06 0.23 -0.06 0.74 0.02 0.00 0.00 177.57 178.56 3i3o h THR 162 N 0.31 1.27 -0.67 2.57 2.02 -1.32 -0.28 112.91 116.81 3i3o h THR 162 Ca 0.09 -1.21 0.03 0.00 0.77 0.00 0.00 66.41 66.09 3i3o h THR 162 Cb 0.27 0.89 -0.04 0.00 -1.74 0.00 0.00 68.15 67.53 3i3o h THR 162 CO -0.00 0.43 0.41 0.50 0.37 0.00 0.00 175.52 177.24 3i3o h LYS 163 N 0.93 0.78 -0.10 6.66 3.64 -0.96 -1.81 116.57 125.72 3i3o h LYS 163 Ca 0.15 -0.05 -0.15 0.00 -1.27 0.00 0.00 60.65 59.34 3i3o h LYS 163 Cb 0.62 -0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 32.25 3i3o h LYS 163 CO 0.04 0.52 -0.59 0.00 -2.27 0.00 0.00 179.45 177.15 3i3o h ALA 164 N 1.29 0.82 0.00 5.00 0.00 -0.93 -3.08 119.26 122.36 3i3o h ALA 164 Ca 0.27 -0.53 -0.07 0.00 0.00 0.00 0.00 54.91 54.58 3i3o h ALA 164 Cb 0.03 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 3i3o h ALA 164 CO -0.11 0.71 -0.32 0.00 0.00 0.00 0.00 179.25 179.54 3i3o h ALA 165 N 1.14 1.32 -0.66 0.00 0.00 -0.50 -3.26 119.26 117.31 3i3o h ALA 165 Ca -0.00 -0.29 0.15 0.00 0.00 0.00 0.00 54.91 54.77 3i3o h ALA 165 Cb 1.10 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.80 3i3o h ALA 165 CO 0.10 0.40 0.45 -0.07 0.00 0.00 0.00 179.25 180.12 3i3o h LEU 166 N 0.00 0.23 -2.24 0.00 3.38 -1.25 0.27 115.31 115.71 3i3o h LEU 166 Ca -0.00 0.01 0.02 0.00 0.09 0.00 0.00 57.88 58.00 3i3o h LEU 166 Cb 0.62 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 41.33 3i3o h LEU 166 CO 0.04 0.12 0.07 0.28 0.09 0.00 0.00 178.44 179.04 3i3o h SER 167 N 0.25 0.00 -0.00 -0.43 0.02 -1.75 -3.14 113.55 108.50 3i3o h SER 167 Ca 0.32 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.27 3i3o h SER 167 Cb 0.90 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.44 3i3o h SER 167 CO -0.07 0.00 -0.56 1.41 -1.14 0.00 0.00 176.83 176.47 3i3o n HIS 168 N -4.10 0.00 -3.44 3.45 8.25 0.92 -4.99 115.22 115.31 3i3o n HIS 168 Ca -0.01 0.00 -0.36 0.00 -0.26 0.00 0.00 57.72 57.09 3i3o n HIS 168 Cb 0.17 0.00 -0.06 0.00 1.12 0.00 0.00 29.99 31.22 3i3o n HIS 168 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 3i3o s LEU 169 N -2.49 4.39 0.36 2.41 1.43 -0.92 -4.59 118.68 119.28 3i3o s LEU 169 Ca 0.06 1.00 0.04 0.00 -1.03 0.00 0.00 54.13 54.20 3i3o s LEU 169 Cb 0.10 -3.01 -0.03 0.00 0.03 0.00 0.00 46.19 43.28 3i3o s LEU 169 CO 0.51 0.19 0.17 -0.54 0.23 0.00 0.00 176.35 176.91 3i3o s LYS 170 N -1.68 1.80 0.05 1.70 1.02 -1.26 -4.97 119.74 116.40 3i3o s LYS 170 Ca 0.33 -2.07 -0.36 0.00 0.02 0.00 0.00 55.97 53.88 3i3o s LYS 170 Cb -0.16 -0.25 -0.16 0.00 -0.52 0.00 0.00 37.83 36.75 3i3o s LYS 170 CO 0.18 -0.51 1.48 0.94 -0.92 0.00 0.00 175.35 176.51 3i3o n GLN 171 N -0.75 1.45 -0.03 1.68 7.27 -1.18 -1.42 117.38 124.39 3i3o n GLN 171 Ca -0.01 0.53 0.00 0.00 0.07 0.00 0.00 57.00 57.59 3i3o n GLN 171 Cb 0.64 -2.22 0.00 0.00 2.41 0.00 0.00 30.24 31.08 3i3o n GLN 171 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 3i3o n GLY 172 N 3.04 0.42 3.94 1.69 0.00 0.12 -4.99 105.19 109.41 3i3o n GLY 172 Ca 0.19 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.96 3i3o n GLY 172 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3i3o s ASP 173 N -2.42 4.81 -0.03 1.61 1.01 -0.51 -4.95 116.67 116.19 3i3o s ASP 173 Ca 0.00 0.37 -0.08 0.00 0.71 0.00 0.00 52.55 53.54 3i3o s ASP 173 Cb 0.00 -1.02 0.01 0.00 1.01 0.00 0.00 42.92 42.92 3i3o s ASP 173 CO 0.00 -1.58 0.19 -0.69 0.21 0.00 0.00 175.17 173.30 3i3o s VAL 174 N -3.20 0.04 -0.05 -1.27 1.01 -0.47 -2.36 120.40 114.10 3i3o s VAL 174 Ca 0.60 -0.37 0.04 0.00 0.00 0.00 0.00 61.98 62.26 3i3o s VAL 174 Cb -0.10 -0.40 -0.00 0.00 0.00 0.00 0.00 36.38 35.87 3i3o s VAL 174 CO 0.44 -0.20 -0.19 -0.63 0.00 0.00 0.00 175.10 174.52 3i3o s ILE 175 N -0.74 1.57 -0.07 2.22 1.01 0.34 -1.38 121.20 124.16 3i3o s ILE 175 Ca -0.08 -0.79 0.03 0.00 0.00 0.00 0.00 60.65 59.81 3i3o s ILE 175 Cb -0.05 -1.35 0.01 0.00 0.01 0.00 0.00 42.46 41.08 3i3o s ILE 175 CO 0.01 0.45 -0.16 -0.63 0.00 0.00 0.00 174.94 174.61 3i3o s ILE 176 N 0.07 1.41 -0.13 2.92 1.01 -0.25 -1.67 121.20 124.55 3i3o s ILE 176 Ca -0.06 -0.66 0.01 0.00 0.00 0.00 0.00 60.65 59.94 3i3o s ILE 176 Cb -0.13 -1.25 -0.01 0.00 0.01 0.00 0.00 42.46 41.09 3i3o s ILE 176 CO 0.03 0.41 -0.16 0.20 0.00 0.00 0.00 174.94 175.43 3i3o s ASN 177 N 0.41 3.75 -0.34 3.58 0.01 -0.46 -1.25 114.94 120.64 3i3o s ASN 177 Ca -0.12 -0.41 -0.26 0.00 -0.71 0.00 0.00 52.86 51.36 3i3o s ASN 177 Cb -0.15 -1.56 0.01 0.00 0.41 0.00 0.00 41.25 39.96 3i3o s ASN 177 CO 0.04 0.14 0.93 -0.89 -1.51 0.00 0.00 177.10 175.81 3i3o s THR 178 N 0.46 4.63 0.00 1.60 2.01 -0.15 -1.67 115.64 122.52 3i3o s THR 178 Ca -0.11 1.34 0.00 0.00 0.31 0.00 0.00 61.69 63.23 3i3o s THR 178 Cb -0.16 -4.30 0.00 0.00 0.01 0.00 0.00 72.50 68.05 3i3o s THR 178 CO 0.05 -0.44 0.00 0.00 -0.69 0.00 0.00 174.62 173.54 3i3o n ALA 179 N 6.63 0.00 -3.59 7.40 0.00 0.42 -4.87 120.51 126.49 3i3o n ALA 179 Ca 0.07 0.00 -0.07 0.00 0.00 0.00 0.00 53.44 53.44 3i3o n ALA 179 Cb 0.48 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.88 3i3o n ALA 179 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3i3o s SER 180 N -0.90 -0.26 0.50 0.00 0.15 -1.26 -4.50 113.70 107.44 3i3o s SER 180 Ca 0.00 0.25 0.25 0.00 0.70 0.00 0.00 55.95 57.14 3i3o s SER 180 Cb 0.00 0.22 1.33 0.00 -1.71 0.00 0.00 66.02 65.86 3i3o s SER 180 CO 0.00 -0.26 1.94 -0.29 1.20 0.00 0.00 173.24 175.83 3i3o h ILE 181 N 2.34 0.69 0.00 6.45 2.10 -1.50 -2.04 117.51 125.55 3i3o h ILE 181 Ca -0.15 -0.04 -0.00 0.00 1.08 0.00 0.00 64.86 65.75 3i3o h ILE 181 Cb 1.17 0.57 -0.00 0.00 -1.09 0.00 0.00 36.82 37.47 3i3o h ILE 181 CO 0.28 0.02 -0.02 -0.37 -1.08 0.00 0.00 178.15 176.98 3i3o h VAL 182 N 0.11 0.36 -0.08 2.19 -1.51 -1.86 0.60 116.25 116.05 3i3o h VAL 182 Ca 0.34 -0.11 -0.07 0.00 -1.23 0.00 0.00 66.70 65.63 3i3o h VAL 182 Cb 1.20 1.08 -0.01 0.00 -2.13 0.00 0.00 31.29 31.43 3i3o h VAL 182 CO -0.04 0.02 -0.25 0.00 -1.23 0.00 0.00 177.57 176.07 3i3o h ALA 183 N 1.98 1.43 0.04 5.19 0.00 -1.61 0.74 119.26 127.04 3i3o h ALA 183 Ca -0.00 -0.27 -0.36 0.00 0.00 0.00 0.00 54.91 54.28 3i3o h ALA 183 Cb 0.08 -0.07 -0.05 0.00 0.00 0.00 0.00 17.79 17.75 3i3o h ALA 183 CO 0.00 0.41 -2.16 0.66 0.00 0.00 0.00 179.25 178.16 3i3o n TYR 184 N -4.19 0.60 0.15 0.00 4.01 0.01 -4.58 117.16 113.15 3i3o n TYR 184 Ca -0.01 0.16 0.08 0.00 -0.16 0.00 0.00 57.90 57.96 3i3o n TYR 184 Cb 0.34 -1.09 -0.12 0.00 -0.31 0.00 0.00 39.34 38.16 3i3o n TYR 184 CO 0.00 0.00 0.00 0.39 -0.46 0.00 0.00 176.86 176.79 3i3o n GLU 185 N -3.20 0.77 0.00 -0.72 -0.58 -0.08 -5.08 120.64 111.76 3i3o n GLU 185 Ca -0.34 -0.12 0.00 0.00 -0.42 0.00 0.00 57.16 56.29 3i3o n GLU 185 Cb 1.05 -1.35 0.00 0.00 -0.57 0.00 0.00 31.44 30.57 3i3o n GLU 185 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3i3o n GLY 186 N 1.54 -2.42 2.85 0.62 0.00 0.25 -5.02 105.19 103.02 3i3o n GLY 186 Ca -0.02 -1.40 -0.17 0.00 0.00 0.00 0.00 46.02 44.44 3i3o n GLY 186 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3i3o s ASN 187 N -3.27 0.85 0.56 1.61 3.84 -1.26 -4.78 114.94 112.50 3i3o s ASN 187 Ca 0.00 0.23 0.31 0.00 0.21 0.00 0.00 52.86 53.62 3i3o s ASN 187 Cb 0.00 0.40 1.68 0.00 -0.55 0.00 0.00 41.25 42.78 3i3o s ASN 187 CO 0.00 -0.27 2.15 1.05 -2.79 0.00 0.00 177.10 177.24 3i3o h GLU 188 N 8.33 0.00 -0.10 0.43 4.11 -1.97 -2.27 114.58 123.12 3i3o h GLU 188 Ca -0.14 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.29 3i3o h GLU 188 Cb 1.13 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.38 3i3o h GLU 188 CO 0.18 0.07 0.00 0.25 0.07 0.00 0.00 179.01 179.57 3i3o n THR 189 N -3.53 0.10 -2.95 -1.06 -2.24 -1.26 -4.47 114.28 98.87 3i3o n THR 189 Ca -0.02 -0.53 -0.18 0.00 -2.27 0.00 0.00 64.05 61.05 3i3o n THR 189 Cb 0.19 1.33 -0.01 0.00 -2.10 0.00 0.00 70.33 69.74 3i3o n THR 189 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 3i3o n LEU 190 N 1.30 1.88 0.00 3.22 4.77 -0.85 -1.00 117.00 126.33 3i3o n LEU 190 Ca 0.15 -4.78 -0.12 0.00 -0.03 0.00 0.00 56.01 51.23 3i3o n LEU 190 Cb 0.58 0.35 -0.08 0.00 -2.33 0.00 0.00 43.42 41.94 3i3o n LEU 190 CO 0.15 2.10 0.73 0.40 -1.33 0.00 0.00 177.39 179.44 3i3o h ILE 191 N 1.98 1.24 -0.28 -0.08 2.04 -1.78 0.48 117.51 121.11 3i3o h ILE 191 Ca 0.07 -0.71 -0.02 0.00 1.00 0.00 0.00 64.86 65.20 3i3o h ILE 191 Cb 0.95 1.68 -0.01 0.00 -0.74 0.00 0.00 36.82 38.70 3i3o h ILE 191 CO 0.58 0.19 0.08 -2.24 0.00 0.00 0.00 178.15 176.76 3i3o h ASP 192 N -0.26 0.42 -0.48 1.72 2.03 -1.93 -1.82 116.42 116.09 3i3o h ASP 192 Ca 0.00 -0.21 0.03 0.00 -0.73 0.00 0.00 57.03 56.12 3i3o h ASP 192 Cb 0.30 -0.11 -0.04 0.00 -0.83 0.00 0.00 39.33 38.66 3i3o h ASP 192 CO 0.00 0.52 0.27 0.22 -1.03 0.00 0.00 179.24 179.22 3i3o h TYR 193 N 0.29 0.51 -0.70 4.15 3.20 -1.92 -1.27 116.97 121.24 3i3o h TYR 193 Ca 0.09 0.02 -0.03 0.00 3.14 0.00 0.00 58.73 61.95 3i3o h TYR 193 Cb 0.25 -0.16 -0.03 0.00 1.54 0.00 0.00 36.73 38.33 3i3o h TYR 193 CO 0.01 0.28 0.33 0.66 -1.64 0.00 0.00 178.16 177.80 3i3o h SER 194 N 0.54 0.90 -0.81 -2.11 4.64 -0.84 -1.63 113.55 114.24 3i3o h SER 194 Ca 0.20 -0.10 -0.01 0.00 -0.47 0.00 0.00 61.79 61.42 3i3o h SER 194 Cb 0.05 -0.23 -0.04 0.00 -0.31 0.00 0.00 62.40 61.87 3i3o h SER 194 CO -0.11 0.77 0.48 0.00 -0.87 0.00 0.00 176.83 177.10 3i3o h ALA 195 N 1.37 1.03 -0.33 5.18 0.00 -0.49 0.66 119.26 126.68 3i3o h ALA 195 Ca 0.24 -0.10 -0.08 0.00 0.00 0.00 0.00 54.91 54.97 3i3o h ALA 195 Cb 0.11 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 3i3o h ALA 195 CO -0.03 0.50 -0.15 1.79 0.00 0.00 0.00 179.25 181.37 3i3o h THR 196 N 1.11 1.25 -0.10 0.00 1.35 -0.43 -1.12 112.91 114.96 3i3o h THR 196 Ca 0.29 -1.12 -0.15 0.00 -0.55 0.00 0.00 66.41 64.88 3i3o h THR 196 Cb -0.03 1.16 -0.01 0.00 -1.73 0.00 0.00 68.15 67.54 3i3o h THR 196 CO -0.05 0.37 -0.60 0.11 -0.25 0.00 0.00 175.52 175.09 3i3o h LYS 197 N 0.53 0.35 -0.41 4.72 1.79 -0.71 -1.55 116.57 121.29 3i3o h LYS 197 Ca 0.09 -0.24 -0.08 0.00 -2.18 0.00 0.00 60.65 58.25 3i3o h LYS 197 Cb 0.56 0.03 -0.02 0.00 -1.58 0.00 0.00 32.23 31.22 3i3o h LYS 197 CO 0.04 0.85 -0.06 0.78 -1.08 0.00 0.00 179.45 179.98 3i3o h GLY 198 N 1.32 0.75 1.05 3.86 0.00 -0.58 -1.48 103.07 107.99 3i3o h GLY 198 Ca -0.01 -0.51 -0.06 0.00 0.00 0.00 0.00 47.33 46.76 3i3o h GLY 198 CO 0.10 0.47 0.25 0.00 0.00 0.00 0.00 176.54 177.37 3i3o h ALA 199 N 1.30 0.98 -0.74 3.60 0.00 -0.74 -2.49 119.26 121.16 3i3o h ALA 199 Ca 0.12 -0.22 -0.05 0.00 0.00 0.00 0.00 54.91 54.77 3i3o h ALA 199 Cb 0.48 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 17.95 3i3o h ALA 199 CO 0.03 0.65 0.28 0.82 0.00 0.00 0.00 179.25 181.02 3i3o h ILE 200 N 1.11 1.25 0.15 0.00 2.04 -0.79 0.68 117.51 121.95 3i3o h ILE 200 Ca 0.24 -0.82 -0.01 0.00 1.00 0.00 0.00 64.86 65.28 3i3o h ILE 200 Cb 0.28 0.38 0.00 0.00 -0.74 0.00 0.00 36.82 36.75 3i3o h ILE 200 CO -0.01 0.33 -0.07 0.58 0.00 0.00 0.00 178.15 178.98 3i3o h VAL 201 N 1.09 0.88 -0.39 1.67 2.07 -1.06 -0.04 116.25 120.46 3i3o h VAL 201 Ca 0.25 -0.09 -0.06 0.00 0.82 0.00 0.00 66.70 67.61 3i3o h VAL 201 Cb 0.23 0.93 -0.02 0.00 -1.52 0.00 0.00 31.29 30.92 3i3o h VAL 201 CO -0.02 0.02 -0.03 0.00 0.02 0.00 0.00 177.57 177.57 3i3o h ALA 202 N 0.60 1.22 -0.73 1.67 0.00 -1.31 -1.92 119.26 118.79 3i3o h ALA 202 Ca -0.02 -0.24 0.01 0.00 0.00 0.00 0.00 54.91 54.66 3i3o h ALA 202 Cb 0.19 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.78 3i3o h ALA 202 CO 0.03 0.51 0.48 0.35 0.00 0.00 0.00 179.25 180.63 3i3o h PHE 203 N 0.60 0.91 -0.25 0.00 3.57 -0.68 -0.80 116.94 120.29 3i3o h PHE 203 Ca 0.12 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.63 3i3o h PHE 203 Cb 0.42 -0.31 -0.01 0.00 2.79 0.00 0.00 35.95 38.84 3i3o h PHE 203 CO 0.02 0.56 0.10 1.15 -2.23 0.00 0.00 178.31 177.91 3i3o h THR 204 N 0.97 1.17 -0.20 4.41 2.02 -0.52 0.76 112.91 121.53 3i3o h THR 204 Ca 0.27 -0.51 -0.00 0.00 0.77 0.00 0.00 66.41 66.94 3i3o h THR 204 Cb -0.09 1.05 -0.01 0.00 -1.74 0.00 0.00 68.15 67.36 3i3o h THR 204 CO -0.07 0.17 0.11 0.03 0.37 0.00 0.00 175.52 176.13 3i3o h ARG 205 N 0.25 0.28 -0.28 6.66 3.08 -1.13 -1.35 114.38 121.88 3i3o h ARG 205 Ca 0.08 -0.03 -0.04 0.00 0.07 0.00 0.00 59.98 60.06 3i3o h ARG 205 Cb 0.18 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.16 3i3o h ARG 205 CO -0.01 0.26 0.01 0.77 -1.07 0.00 0.00 179.97 179.93 3i3o h SER 206 N 0.22 0.48 -0.36 7.04 0.02 -1.04 -2.86 113.55 117.05 3i3o h SER 206 Ca 0.07 -0.30 -0.06 0.00 -0.84 0.00 0.00 61.79 60.66 3i3o h SER 206 Cb 0.06 -0.13 -0.02 0.00 0.14 0.00 0.00 62.40 62.45 3i3o h SER 206 CO -0.01 0.66 0.01 0.25 -1.14 0.00 0.00 176.83 176.60 3i3o h LEU 207 N 0.29 0.68 -1.07 5.07 5.85 -0.82 -1.77 115.31 123.53 3i3o h LEU 207 Ca 0.08 -0.15 -0.01 0.00 0.84 0.00 0.00 57.88 58.64 3i3o h LEU 207 Cb 0.40 -0.18 -0.04 0.00 0.37 0.00 0.00 40.66 41.21 3i3o h LEU 207 CO 0.01 0.74 0.46 0.77 -0.34 0.00 0.00 178.44 180.09 3i3o h SER 208 N 0.68 0.98 0.21 1.25 4.64 -1.10 -0.92 113.55 119.29 3i3o h SER 208 Ca 0.14 -0.07 -0.19 0.00 -0.47 0.00 0.00 61.79 61.19 3i3o h SER 208 Cb 0.40 -0.25 -0.00 0.00 -0.31 0.00 0.00 62.40 62.24 3i3o h SER 208 CO 0.01 0.77 -0.76 1.56 -0.87 0.00 0.00 176.83 177.54 3i3o h GLN 209 N 1.12 0.46 -0.77 4.77 1.08 -1.25 -2.50 115.11 118.02 3i3o h GLN 209 Ca 0.29 -0.39 -0.03 0.00 -1.45 0.00 0.00 58.65 57.07 3i3o h GLN 209 Cb -0.01 0.09 -0.03 0.00 -0.05 0.00 0.00 27.48 27.47 3i3o h GLN 209 CO -0.05 1.03 0.35 1.03 -0.95 0.00 0.00 178.83 180.24 3i3o h SER 210 N 0.31 1.02 -0.04 1.46 0.87 -0.85 -3.29 113.55 113.02 3i3o h SER 210 Ca -0.04 -0.15 0.00 0.00 -1.23 0.00 0.00 61.79 60.37 3i3o h SER 210 Cb 1.35 -0.26 0.00 0.00 -0.44 0.00 0.00 62.40 63.05 3i3o h SER 210 CO 0.14 0.88 0.00 0.18 -0.53 0.00 0.00 176.83 177.50 3i3o n LEU 211 N -4.36 2.75 -0.17 2.23 4.77 -0.39 -4.60 117.00 117.24 3i3o n LEU 211 Ca 0.07 -0.93 -0.08 0.00 -0.03 0.00 0.00 56.01 55.04 3i3o n LEU 211 Cb 0.15 -0.01 0.01 0.00 -2.33 0.00 0.00 43.42 41.24 3i3o n LEU 211 CO 0.40 0.47 1.00 1.62 -1.33 0.00 0.00 177.39 179.54 3i3o h VAL 212 N 4.28 1.18 0.00 4.08 3.04 -1.52 -0.54 116.25 126.77 3i3o h VAL 212 Ca 0.00 -0.47 0.00 0.00 -1.01 0.00 0.00 66.70 65.22 3i3o h VAL 212 Cb 0.91 0.60 0.00 0.00 -2.01 0.00 0.00 31.29 30.79 3i3o h VAL 212 CO 0.00 0.19 0.00 0.00 -1.01 0.00 0.00 177.57 176.75 3i3o n GLN 213 N -4.65 0.03 0.00 4.17 6.02 -1.26 -1.33 117.38 120.36 3i3o n GLN 213 Ca 0.02 0.22 0.14 0.00 -0.01 0.00 0.00 57.00 57.37 3i3o n GLN 213 Cb 0.10 -1.56 0.52 0.00 1.02 0.00 0.00 30.24 30.32 3i3o n GLN 213 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 3i3o n LYS 214 N -1.62 1.21 -1.92 -1.09 5.02 -0.23 -4.94 118.16 114.58 3i3o n LYS 214 Ca 0.04 -0.63 -0.06 0.00 -2.02 0.00 0.00 58.31 55.64 3i3o n LYS 214 Cb 0.22 -1.49 -0.01 0.00 -0.02 0.00 0.00 35.03 33.74 3i3o n LYS 214 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3i3o n GLY 215 N 1.23 0.27 3.28 0.72 0.00 -0.44 -3.13 105.19 107.12 3i3o n GLY 215 Ca 0.17 -0.67 -0.34 0.00 0.00 0.00 0.00 46.02 45.18 3i3o n GLY 215 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3i3o s ILE 216 N -2.28 2.91 0.07 -0.61 1.01 -1.06 0.11 121.20 121.36 3i3o s ILE 216 Ca 0.00 -0.67 -0.12 0.00 0.00 0.00 0.00 60.65 59.86 3i3o s ILE 216 Cb 0.00 -2.27 -0.06 0.00 0.01 0.00 0.00 42.46 40.14 3i3o s ILE 216 CO 0.00 0.49 0.44 -0.13 0.00 0.00 0.00 174.94 175.74 3i3o s ARG 217 N 1.04 3.86 -0.08 2.79 0.52 -0.99 -4.05 118.95 122.03 3i3o s ARG 217 Ca -0.01 0.31 -0.00 0.00 -0.52 0.00 0.00 55.73 55.52 3i3o s ARG 217 Cb -0.15 -3.04 0.02 0.00 0.52 0.00 0.00 34.95 32.31 3i3o s ARG 217 CO -0.02 0.58 -0.05 0.08 0.02 0.00 0.00 175.30 175.91 3i3o s VAL 218 N -1.33 0.69 0.25 3.52 1.01 -1.26 -0.51 120.40 122.78 3i3o s VAL 218 Ca 0.32 -0.12 -0.03 0.00 0.00 0.00 0.00 61.98 62.15 3i3o s VAL 218 Cb -0.15 -0.75 -0.02 0.00 0.00 0.00 0.00 36.38 35.46 3i3o s VAL 218 CO 0.17 0.30 0.28 0.20 0.00 0.00 0.00 175.10 176.05 3i3o s ASN 219 N 1.52 0.38 0.18 3.32 0.01 -0.67 -0.01 114.94 119.67 3i3o s ASN 219 Ca -0.01 -1.34 0.02 0.00 -0.71 0.00 0.00 52.86 50.83 3i3o s ASN 219 Cb -0.13 0.49 -0.05 0.00 0.41 0.00 0.00 41.25 41.97 3i3o s ASN 219 CO -0.04 -1.00 0.00 -0.83 -1.51 0.00 0.00 177.10 173.72 3i3o s GLY 220 N -3.16 1.27 -0.05 0.66 0.00 0.31 -1.35 107.32 104.99 3i3o s GLY 220 Ca 0.34 -1.61 0.05 0.00 0.00 0.00 0.00 44.72 43.50 3i3o s GLY 220 CO 0.14 -1.54 -0.21 0.14 0.00 0.00 0.00 173.10 171.63 3i3o s VAL 221 N -3.63 1.73 -0.49 1.40 1.01 -0.67 -0.84 120.40 118.91 3i3o s VAL 221 Ca 0.25 -0.88 0.03 0.00 0.00 0.00 0.00 61.98 61.37 3i3o s VAL 221 Cb 0.06 -1.47 0.13 0.00 0.00 0.00 0.00 36.38 35.09 3i3o s VAL 221 CO 0.05 0.49 0.24 0.00 0.00 0.00 0.00 175.10 175.87 3i3o s ALA 222 N -0.05 3.25 0.61 5.51 0.00 0.12 -0.44 121.76 130.76 3i3o s ALA 222 Ca -0.04 -3.07 -0.15 0.00 0.00 0.00 0.00 51.96 48.70 3i3o s ALA 222 Cb -0.13 -2.20 -0.03 0.00 0.00 0.00 0.00 23.12 20.76 3i3o s ALA 222 CO 0.03 -1.95 1.07 -2.14 0.00 0.00 0.00 175.76 172.77 3i3o s PRO 223 N 0.08 3.22 0.00 0.00 0.02 -1.26 -2.50 135.00 134.56 3i3o s PRO 223 Ca 0.15 1.23 0.00 0.00 0.02 0.00 0.00 61.00 62.40 3i3o s PRO 223 Cb -0.23 -2.02 0.00 0.00 0.02 0.00 0.00 34.50 32.27 3i3o s PRO 223 CO -0.03 -0.89 0.00 0.41 -0.33 0.00 0.00 177.00 176.16 3i3o n GLY 224 N -0.94 1.79 3.63 0.52 0.00 -0.69 -1.63 105.19 107.87 3i3o n GLY 224 Ca 0.09 -1.84 -0.43 0.00 0.00 0.00 0.00 46.02 43.84 3i3o n GLY 224 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3i3o s PRO 225 N 3.60 3.90 -0.07 1.61 0.04 -1.26 -4.93 135.00 137.88 3i3o s PRO 225 Ca 0.00 1.36 0.05 0.00 0.04 0.00 0.00 61.00 62.45 3i3o s PRO 225 Cb 0.00 -3.91 -0.01 0.00 0.04 0.00 0.00 34.50 30.62 3i3o s PRO 225 CO 0.00 -1.15 -0.24 0.42 0.04 0.00 0.00 177.00 176.07 3i3o s ILE 226 N 4.54 2.01 -0.70 0.56 -1.09 -1.26 0.04 121.20 125.30 3i3o s ILE 226 Ca 0.60 -1.02 -0.26 0.00 -2.23 0.00 0.00 60.65 57.73 3i3o s ILE 226 Cb -0.19 -1.71 -0.01 0.00 -1.58 0.00 0.00 42.46 38.97 3i3o s ILE 226 CO 0.24 0.56 1.75 0.86 -1.23 0.00 0.00 174.94 177.12 3i3o s TRP 227 N 0.02 1.83 0.18 3.97 -0.00 -0.52 -4.86 118.94 119.55 3i3o s TRP 227 Ca -0.09 0.54 -0.04 0.00 -0.00 0.00 0.00 56.10 56.52 3i3o s TRP 227 Cb -0.15 -4.21 -0.03 0.00 -0.00 0.00 0.00 33.47 29.09 3i3o s TRP 227 CO 0.05 -2.17 0.18 0.95 -0.00 0.00 0.00 176.95 175.97 3i3o s THR 228 N 8.46 0.05 0.58 5.86 -4.23 -1.26 -4.42 115.64 120.67 3i3o s THR 228 Ca 0.61 -1.77 0.27 0.00 -1.18 0.00 0.00 61.69 59.62 3i3o s THR 228 Cb -0.10 -2.18 0.35 0.00 1.34 0.00 0.00 72.50 71.90 3i3o s THR 228 CO 0.15 -0.21 2.15 -0.65 -0.54 0.00 0.00 174.62 175.52 3i3o h PRO 229 N 2.64 0.00 -0.39 3.99 0.11 -1.91 -2.06 132.00 134.38 3i3o h PRO 229 Ca -0.34 0.00 0.11 0.00 0.11 0.00 0.00 66.00 65.89 3i3o h PRO 229 Cb 1.23 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.32 3i3o h PRO 229 CO 0.52 0.00 0.32 1.25 -0.21 0.00 0.00 178.00 179.87 3i3o h LEU 230 N 0.00 0.00 0.09 2.35 5.85 -1.94 -2.94 115.31 118.72 3i3o h LEU 230 Ca 0.06 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.78 3i3o h LEU 230 Cb 0.31 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.35 3i3o h LEU 230 CO -0.00 0.00 -0.04 0.40 -0.34 0.00 0.00 178.44 178.46 3i3o h ILE 231 N 0.00 0.00 0.00 4.05 1.08 -1.70 -2.95 117.51 117.99 3i3o h ILE 231 Ca 0.18 -0.63 0.00 0.00 -0.39 0.00 0.00 64.86 64.02 3i3o h ILE 231 Cb 0.82 0.00 0.00 0.00 -3.07 0.00 0.00 36.82 34.57 3i3o h ILE 231 CO -0.00 0.00 0.00 1.55 -0.69 0.00 0.00 178.15 179.01 3i3o h PRO 232 N -0.75 0.00 0.00 2.37 0.13 -1.73 -1.45 132.00 130.57 3i3o h PRO 232 Ca -0.01 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.12 3i3o h PRO 232 Cb 0.09 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.22 3i3o h PRO 232 CO 0.02 0.00 -0.07 0.66 -0.23 0.00 0.00 178.00 178.38 3i3o h SER 233 N 0.00 0.00 0.00 1.44 4.64 -1.63 0.47 113.55 118.46 3i3o h SER 233 Ca 0.00 -0.02 -0.17 0.00 -0.47 0.00 0.00 61.79 61.13 3i3o h SER 233 Cb 0.30 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.36 3i3o h SER 233 CO 0.00 0.01 -1.59 -1.54 -0.87 0.00 0.00 176.83 172.84 3i3o n SER 234 N -2.30 2.05 -4.93 4.97 3.41 -0.85 -4.60 113.62 111.37 3i3o n SER 234 Ca 0.05 0.03 -0.25 0.00 -0.26 0.00 0.00 58.87 58.45 3i3o n SER 234 Cb 0.44 -0.23 -0.01 0.00 -0.26 0.00 0.00 64.21 64.15 3i3o n SER 234 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 3i3o s PHE 235 N -2.20 3.48 0.77 7.33 0.08 -0.60 -4.55 117.98 122.29 3i3o s PHE 235 Ca -0.14 0.45 -0.11 0.00 0.12 0.00 0.00 56.93 57.25 3i3o s PHE 235 Cb 0.05 -2.05 0.05 0.00 -0.57 0.00 0.00 43.02 40.50 3i3o s PHE 235 CO 0.21 -0.04 1.08 0.16 -0.10 0.00 0.00 175.22 176.53 3i3o s ASP 236 N -4.08 4.62 0.18 1.36 -4.77 -1.26 -4.75 116.67 107.97 3i3o s ASP 236 Ca 0.43 1.66 -0.14 0.00 -3.30 0.00 0.00 52.55 51.20 3i3o s ASP 236 Cb -0.10 -2.41 0.16 0.00 -1.09 0.00 0.00 42.92 39.48 3i3o s ASP 236 CO 0.39 -1.94 1.70 -0.33 0.70 0.00 0.00 175.17 175.68 3i3o h GLU 237 N -1.06 0.14 -0.40 2.11 5.08 -1.94 0.31 114.58 118.83 3i3o h GLU 237 Ca -0.45 -0.01 0.02 0.00 -1.00 0.00 0.00 59.36 57.92 3i3o h GLU 237 Cb 1.24 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 30.43 3i3o h GLU 237 CO 0.54 0.09 0.23 -0.22 -1.00 0.00 0.00 179.01 178.65 3i3o h LYS 238 N 0.15 0.45 -0.75 2.33 3.11 -1.93 0.15 116.57 120.08 3i3o h LYS 238 Ca 0.23 -0.03 -0.04 0.00 -2.81 0.00 0.00 60.65 58.00 3i3o h LYS 238 Cb 0.33 -0.10 -0.03 0.00 -1.00 0.00 0.00 32.23 31.43 3i3o h LYS 238 CO -0.36 0.30 0.29 -0.22 -2.81 0.00 0.00 179.45 176.65 3i3o h LYS 239 N 0.46 1.12 -0.58 1.90 1.63 -1.79 -2.87 116.57 116.43 3i3o h LYS 239 Ca 0.16 -0.20 -0.05 0.00 -0.85 0.00 0.00 60.65 59.71 3i3o h LYS 239 Cb 0.02 -0.18 -0.02 0.00 -0.60 0.00 0.00 32.23 31.44 3i3o h LYS 239 CO -0.08 0.91 0.15 0.28 -3.45 0.00 0.00 179.45 177.26 3i3o h VAL 240 N 1.09 1.25 0.00 2.00 2.07 -0.33 -1.70 116.25 120.63 3i3o h VAL 240 Ca 0.25 -0.88 -0.01 0.00 0.82 0.00 0.00 66.70 66.88 3i3o h VAL 240 Cb 0.21 0.71 -0.00 0.00 -1.52 0.00 0.00 31.29 30.69 3i3o h VAL 240 CO -0.02 0.33 -0.03 0.77 0.02 0.00 0.00 177.57 178.64 3i3o h SER 241 N 0.83 0.00 -0.02 0.57 4.64 -0.51 -2.66 113.55 116.41 3i3o h SER 241 Ca 0.18 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.50 3i3o h SER 241 Cb 0.34 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.43 3i3o h SER 241 CO 0.00 0.03 -0.02 0.00 -0.87 0.00 0.00 176.83 175.97 3i3o n GLN 242 N -3.36 0.84 -1.67 4.77 6.02 -1.05 0.33 117.38 123.26 3i3o n GLN 242 Ca -0.02 -1.21 -0.55 0.00 -0.01 0.00 0.00 57.00 55.21 3i3o n GLN 242 Cb 0.14 -1.23 -0.07 0.00 1.02 0.00 0.00 30.24 30.10 3i3o n GLN 242 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 3i3o n PHE 243 N 0.64 1.90 -0.20 1.08 7.35 -0.67 -2.09 117.46 125.48 3i3o n PHE 243 Ca 0.07 0.53 0.00 0.00 -0.76 0.00 0.00 57.45 57.29 3i3o n PHE 243 Cb 0.31 -2.43 0.00 0.00 0.35 0.00 0.00 39.48 37.71 3i3o n PHE 243 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 3i3o n GLY 244 N 3.65 0.90 0.21 7.13 0.00 -1.26 -4.23 105.19 111.59 3i3o n GLY 244 Ca 0.23 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.34 3i3o n GLY 244 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3i3o h SER 245 N 0.00 0.00 1.39 1.61 4.64 -1.69 -1.48 113.55 118.02 3i3o h SER 245 Ca 0.00 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 3i3o h SER 245 Cb 0.00 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.09 3i3o h SER 245 CO 0.00 0.26 -0.04 -0.55 -0.87 0.00 0.00 176.83 175.63 3i3o h ASN 246 N 0.00 0.00 -3.72 4.97 -1.07 -1.91 -3.42 115.58 110.42 3i3o h ASN 246 Ca -0.00 0.00 -0.49 0.00 0.07 0.00 0.00 56.30 55.88 3i3o h ASN 246 Cb 0.79 0.00 0.04 0.00 -2.07 0.00 0.00 38.32 37.09 3i3o h ASN 246 CO 0.03 0.04 0.18 0.68 0.07 0.00 0.00 177.43 178.43 3i3o s VAL 247 N -3.48 4.59 0.54 6.14 -7.23 -1.23 -4.95 120.40 114.77 3i3o s VAL 247 Ca 0.03 0.27 0.20 0.00 -1.81 0.00 0.00 61.98 60.67 3i3o s VAL 247 Cb 0.08 -3.77 0.30 0.00 0.56 0.00 0.00 36.38 33.55 3i3o s VAL 247 CO 0.60 -0.81 2.15 -0.65 -0.31 0.00 0.00 175.10 176.08 3i3o h PRO 248 N 0.04 0.00 0.00 4.82 0.11 -1.82 0.14 132.00 135.28 3i3o h PRO 248 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 3i3o h PRO 248 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 3i3o h PRO 248 CO 0.62 0.00 0.00 -1.33 -0.21 0.00 0.00 178.00 177.08 3i3o n MET 249 N -4.36 0.34 -3.23 1.05 2.81 -0.64 -4.91 117.12 108.17 3i3o n MET 249 Ca -0.01 0.05 -0.23 0.00 -1.81 0.00 0.00 57.70 55.70 3i3o n MET 249 Cb 0.16 -1.50 0.03 0.00 -0.71 0.00 0.00 33.22 31.19 3i3o n MET 249 CO 0.00 0.00 0.00 1.04 1.51 0.00 0.00 175.97 178.52 3i3o n GLN 250 N -1.29 -4.67 -3.50 0.03 6.02 0.49 -4.97 117.38 109.49 3i3o n GLN 250 Ca 0.12 0.74 -0.17 0.00 -0.01 0.00 0.00 57.00 57.68 3i3o n GLN 250 Cb 0.20 -5.57 -0.05 0.00 1.02 0.00 0.00 30.24 25.84 3i3o n GLN 250 CO 0.00 0.00 0.00 -0.98 -1.01 0.00 0.00 177.06 175.07 3i3o s ARG 251 N -5.90 1.11 0.67 -1.09 1.70 -0.56 -4.66 118.95 110.21 3i3o s ARG 251 Ca 0.38 0.08 -0.13 0.00 -0.47 0.00 0.00 55.73 55.59 3i3o s ARG 251 Cb -0.18 0.52 0.00 0.00 -0.57 0.00 0.00 34.95 34.72 3i3o s ARG 251 CO 0.47 -0.38 1.07 -1.25 -1.08 0.00 0.00 175.30 174.12 3i3o s PRO 252 N -1.79 2.94 0.54 3.89 0.04 -1.25 -4.78 135.00 134.61 3i3o s PRO 252 Ca -0.08 1.11 -0.11 0.00 0.04 0.00 0.00 61.00 61.95 3i3o s PRO 252 Cb -0.00 -1.99 -0.05 0.00 0.04 0.00 0.00 34.50 32.50 3i3o s PRO 252 CO 0.05 -1.10 0.95 0.20 0.04 0.00 0.00 177.00 177.13 3i3o s GLY 253 N -3.30 1.77 0.06 0.56 0.00 0.11 -4.87 107.32 101.65 3i3o s GLY 253 Ca 0.61 -0.10 -0.01 0.00 0.00 0.00 0.00 44.72 45.22 3i3o s GLY 253 CO 0.48 0.14 0.22 1.20 0.00 0.00 0.00 173.10 175.14 3i3o s GLN 254 N -4.66 3.46 0.41 2.90 -1.52 -1.26 -1.44 119.66 117.54 3i3o s GLN 254 Ca 0.54 -0.40 0.16 0.00 -1.95 0.00 0.00 55.36 53.71 3i3o s GLN 254 Cb -0.11 -3.03 1.03 0.00 -0.22 0.00 0.00 33.01 30.69 3i3o s GLN 254 CO 0.44 0.60 1.87 -1.35 -0.25 0.00 0.00 175.29 176.60 3i3o h PRO 255 N 3.11 0.45 0.00 2.91 0.11 -1.74 0.28 132.00 137.11 3i3o h PRO 255 Ca -0.45 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 65.62 3i3o h PRO 255 Cb 1.16 -0.10 -0.00 0.00 0.11 0.00 0.00 31.00 32.17 3i3o h PRO 255 CO 0.75 0.30 -0.06 0.10 -0.21 0.00 0.00 178.00 178.88 3i3o h TYR 256 N 0.46 0.00 0.00 0.65 -0.00 -1.46 -1.63 116.97 114.99 3i3o h TYR 256 Ca 0.45 0.00 0.00 0.00 0.00 0.00 0.00 58.73 59.18 3i3o h TYR 256 Cb 1.03 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.76 3i3o h TYR 256 CO -0.00 0.06 0.00 0.39 -0.00 0.00 0.00 178.16 178.61 3i3o n GLU 257 N -4.05 0.14 -0.02 0.10 1.02 0.09 -2.53 120.64 115.39 3i3o n GLU 257 Ca -0.03 0.40 -0.06 0.00 -0.02 0.00 0.00 57.16 57.46 3i3o n GLU 257 Cb 0.15 -1.79 -0.13 0.00 -0.02 0.00 0.00 31.44 29.65 3i3o n GLU 257 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 3i3o n LEU 258 N -2.06 0.71 -0.30 -4.62 7.99 -0.62 -4.56 117.00 113.54 3i3o n LEU 258 Ca 0.02 0.33 0.02 0.00 -0.01 0.00 0.00 56.01 56.37 3i3o n LEU 258 Cb 0.19 0.19 0.15 0.00 -0.11 0.00 0.00 43.42 43.85 3i3o n LEU 258 CO 0.17 0.32 1.17 0.00 -1.51 0.00 0.00 177.39 177.54 3i3o h ALA 259 N 1.15 1.19 0.00 -1.18 0.00 -1.47 -2.55 119.26 116.40 3i3o h ALA 259 Ca -0.28 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.60 3i3o h ALA 259 Cb 1.90 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 19.49 3i3o h ALA 259 CO 0.06 0.20 -0.16 -1.35 0.00 0.00 0.00 179.25 178.00 3i3o h PRO 260 N 0.90 0.00 -0.83 0.00 0.11 -1.80 -0.90 132.00 129.48 3i3o h PRO 260 Ca 0.39 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.49 3i3o h PRO 260 Cb 0.26 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 31.33 3i3o h PRO 260 CO -0.20 0.16 0.49 0.00 -0.21 0.00 0.00 178.00 178.24 3i3o h ALA 261 N 1.84 1.06 -0.41 -0.75 0.00 -1.74 0.40 119.26 119.65 3i3o h ALA 261 Ca -0.00 -0.10 -0.15 0.00 0.00 0.00 0.00 54.91 54.66 3i3o h ALA 261 Cb 0.49 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 3i3o h ALA 261 CO 0.02 0.53 -0.34 1.88 0.00 0.00 0.00 179.25 181.34 3i3o h TYR 262 N 1.14 1.14 -0.36 0.00 0.05 -1.28 -1.45 116.97 116.21 3i3o h TYR 262 Ca 0.30 -0.32 0.01 0.00 0.05 0.00 0.00 58.73 58.76 3i3o h TYR 262 Cb -0.03 -0.25 -0.02 0.00 1.01 0.00 0.00 36.73 37.44 3i3o h TYR 262 CO -0.00 1.16 0.22 0.28 -1.05 0.00 0.00 178.16 178.76 3i3o h VAL 263 N 0.79 1.06 -0.20 -2.88 2.07 -0.98 0.16 116.25 116.28 3i3o h VAL 263 Ca 0.07 -0.15 0.05 0.00 0.82 0.00 0.00 66.70 67.49 3i3o h VAL 263 Cb 0.93 0.57 -0.05 0.00 -1.52 0.00 0.00 31.29 31.23 3i3o h VAL 263 CO 0.09 0.08 -0.12 0.22 0.02 0.00 0.00 177.57 177.86 3i3o h TYR 264 N 0.45 -0.29 0.00 1.57 3.20 -0.79 -2.24 116.97 118.87 3i3o h TYR 264 Ca 0.14 0.02 -0.07 0.00 3.14 0.00 0.00 58.73 61.96 3i3o h TYR 264 Cb -0.02 0.16 -0.01 0.00 1.54 0.00 0.00 36.73 38.40 3i3o h TYR 264 CO -0.06 -0.18 -0.34 -0.07 -1.64 0.00 0.00 178.16 175.87 3i3o h LEU 265 N -0.11 0.00 0.00 2.82 3.38 -0.85 -3.21 115.31 117.34 3i3o h LEU 265 Ca 0.11 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 57.90 3i3o h LEU 265 Cb 0.28 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.00 3i3o h LEU 265 CO -0.26 0.34 -0.95 0.00 0.09 0.00 0.00 178.44 177.66 3i3o h ALA 266 N 1.66 0.51 -1.22 1.53 0.00 -0.41 -3.46 119.26 117.87 3i3o h ALA 266 Ca -0.00 -0.82 -0.46 0.00 0.00 0.00 0.00 54.91 53.62 3i3o h ALA 266 Cb 0.85 -0.04 0.04 0.00 0.00 0.00 0.00 17.79 18.64 3i3o h ALA 266 CO 0.04 1.07 -0.07 -1.54 0.00 0.00 0.00 179.25 178.76 3i3o s SER 267 N -6.51 5.05 0.07 0.00 1.04 -0.87 -4.88 113.70 107.59 3i3o s SER 267 Ca 0.01 -0.51 0.12 0.00 0.48 0.00 0.00 55.95 56.05 3i3o s SER 267 Cb 0.09 -0.15 0.53 0.00 0.10 0.00 0.00 66.02 66.59 3i3o s SER 267 CO 0.80 -1.33 1.38 -1.54 0.98 0.00 0.00 173.24 173.52 3i3o n SER 268 N -2.33 0.15 0.10 7.02 3.41 -1.26 -2.63 113.62 118.07 3i3o n SER 268 Ca 0.13 0.55 0.17 0.00 -0.26 0.00 0.00 58.87 59.45 3i3o n SER 268 Cb 0.60 -0.58 0.70 0.00 -0.26 0.00 0.00 64.21 64.68 3i3o n SER 268 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 3i3o h ASP 269 N 0.00 0.00 -0.60 4.04 3.32 -1.91 -2.36 116.42 118.91 3i3o h ASP 269 Ca 0.00 0.00 -0.36 0.00 0.02 0.00 0.00 57.03 56.69 3i3o h ASP 269 Cb 0.17 0.00 -0.21 0.00 0.22 0.00 0.00 39.33 39.50 3i3o h ASP 269 CO 0.00 0.00 0.04 -1.54 -1.72 0.00 0.00 179.24 176.02 3i3o n SER 270 N -4.30 3.77 0.21 6.45 3.41 -1.08 -4.80 113.62 117.29 3i3o n SER 270 Ca 0.05 -3.77 0.18 0.00 -0.26 0.00 0.00 58.87 55.07 3i3o n SER 270 Cb 0.43 -0.67 0.84 0.00 -0.26 0.00 0.00 64.21 64.56 3i3o n SER 270 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 3i3o h SER 271 N 1.33 0.00 -0.55 4.04 4.64 -1.61 0.16 113.55 121.57 3i3o h SER 271 Ca 0.36 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.68 3i3o h SER 271 Cb 1.68 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.77 3i3o h SER 271 CO 0.72 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 176.68 3i3o n TYR 272 N -3.59 1.63 -4.04 4.77 9.36 -1.26 -4.91 117.16 119.11 3i3o n TYR 272 Ca 0.02 -0.70 -0.34 0.00 3.32 0.00 0.00 57.90 60.20 3i3o n TYR 272 Cb 0.37 -0.37 -0.15 0.00 -0.63 0.00 0.00 39.34 38.56 3i3o n TYR 272 CO 0.00 0.00 0.00 0.08 0.22 0.00 0.00 176.86 177.16 3i3o s VAL 273 N -2.37 2.52 -0.07 2.97 1.01 0.56 -5.10 120.40 119.92 3i3o s VAL 273 Ca 0.50 -0.86 -0.16 0.00 0.00 0.00 0.00 61.98 61.46 3i3o s VAL 273 Cb 0.36 -2.14 0.03 0.00 0.00 0.00 0.00 36.38 34.64 3i3o s VAL 273 CO 0.18 0.44 0.39 0.28 0.00 0.00 0.00 175.10 176.39 3i3o s THR 274 N 1.34 0.03 -0.02 3.92 -1.32 -1.26 -4.69 115.64 113.64 3i3o s THR 274 Ca 0.04 -0.26 0.00 0.00 -1.21 0.00 0.00 61.69 60.26 3i3o s THR 274 Cb -0.14 -0.64 0.00 0.00 -1.51 0.00 0.00 72.50 70.20 3i3o s THR 274 CO -0.09 -0.14 0.00 0.61 -2.21 0.00 0.00 174.62 172.79 3i3o n GLY 275 N 1.77 0.47 3.89 6.08 0.00 0.99 -4.98 105.19 113.40 3i3o n GLY 275 Ca -0.18 -0.29 -0.20 0.00 0.00 0.00 0.00 46.02 45.34 3i3o n GLY 275 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3i3o s GLN 276 N -0.59 2.58 -0.07 1.61 -1.52 -1.26 -4.69 119.66 115.72 3i3o s GLN 276 Ca 0.00 -1.49 0.03 0.00 -1.95 0.00 0.00 55.36 51.95 3i3o s GLN 276 Cb 0.00 -2.42 0.01 0.00 -0.22 0.00 0.00 33.01 30.38 3i3o s GLN 276 CO 0.00 -0.17 -0.14 1.41 -0.25 0.00 0.00 175.29 176.14 3i3o s MET 277 N -4.13 1.86 -0.32 2.91 1.75 -1.26 -0.53 119.30 119.57 3i3o s MET 277 Ca 0.48 -0.49 -0.13 0.00 -1.25 0.00 0.00 55.69 54.30 3i3o s MET 277 Cb -0.04 -1.52 -0.02 0.00 2.84 0.00 0.00 34.83 36.09 3i3o s MET 277 CO 0.28 0.07 0.28 0.42 -0.65 0.00 0.00 175.02 175.42 3i3o s ILE 278 N 0.55 5.25 -0.43 10.11 -1.09 -0.02 -4.95 121.20 130.62 3i3o s ILE 278 Ca -0.14 0.00 -0.20 0.00 -2.23 0.00 0.00 60.65 58.09 3i3o s ILE 278 Cb -0.15 -3.71 0.02 0.00 -1.58 0.00 0.00 42.46 37.04 3i3o s ILE 278 CO 0.04 0.03 0.58 -1.00 -1.23 0.00 0.00 174.94 173.36 3i3o s HIS 279 N 1.85 3.10 -0.57 3.97 3.76 -1.26 -0.70 115.29 125.43 3i3o s HIS 279 Ca 0.09 -0.16 0.04 0.00 -0.15 0.00 0.00 55.06 54.88 3i3o s HIS 279 Cb -0.17 -3.20 0.14 0.00 1.11 0.00 0.00 32.58 30.46 3i3o s HIS 279 CO 0.11 -0.82 0.34 0.08 -0.85 0.00 0.00 174.74 173.60 3i3o s VAL 280 N 2.60 2.53 0.00 -0.90 1.01 -1.04 -4.92 120.40 119.68 3i3o s VAL 280 Ca 0.19 -3.55 0.00 0.00 0.00 0.00 0.00 61.98 58.62 3i3o s VAL 280 Cb -0.15 -2.73 0.00 0.00 0.00 0.00 0.00 36.38 33.50 3i3o s VAL 280 CO 0.17 -0.88 0.85 -0.46 0.00 0.00 0.00 175.10 174.78 3i3o n ASN 281 N 2.77 0.00 -0.10 3.32 0.23 -1.26 -1.70 115.26 118.52 3i3o n ASN 281 Ca 0.11 -1.72 -0.01 0.00 -0.53 0.00 0.00 54.58 52.42 3i3o n ASN 281 Cb 0.34 -0.14 -0.01 0.00 -2.08 0.00 0.00 39.78 37.89 3i3o n ASN 281 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3i3o n GLY 282 N 0.00 0.51 0.00 4.83 0.00 -1.26 -3.89 105.19 105.38 3i3o n GLY 282 Ca 0.00 -0.41 0.00 0.00 0.00 0.00 0.00 46.02 45.61 3i3o n GLY 282 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3i3o n GLY 283 N -2.50 1.06 3.67 -0.02 0.00 -1.26 -1.63 105.19 104.51 3i3o n GLY 283 Ca -0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.58 3i3o n GLY 283 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3i3o s VAL 284 N -2.00 3.73 -0.10 1.61 1.01 -1.25 -4.68 120.40 118.72 3i3o s VAL 284 Ca 0.00 0.95 -0.29 0.00 0.00 0.00 0.00 61.98 62.64 3i3o s VAL 284 Cb 0.00 -3.61 -0.01 0.00 0.00 0.00 0.00 36.38 32.75 3i3o s VAL 284 CO 0.00 -0.07 0.98 -0.63 0.00 0.00 0.00 175.10 175.39 3i3o s ILE 285 N 3.55 4.81 -0.11 2.22 -1.09 -1.26 -4.92 121.20 124.39 3i3o s ILE 285 Ca 0.67 2.00 0.15 0.00 -2.23 0.00 0.00 60.65 61.24 3i3o s ILE 285 Cb -0.31 -4.29 0.26 0.00 -1.58 0.00 0.00 42.46 36.54 3i3o s ILE 285 CO 0.26 0.03 1.13 1.33 -1.23 0.00 0.00 174.94 176.46 3i3o n VAL 286 N 4.47 1.50 -2.75 2.92 0.24 -1.26 -4.97 118.33 118.48 3i3o n VAL 286 Ca 0.08 -1.94 -0.22 0.00 -2.04 0.00 0.00 64.34 60.22 3i3o n VAL 286 Cb 0.49 -0.04 0.02 0.00 -1.47 0.00 0.00 33.84 32.83 3i3o n VAL 286 CO 0.00 0.00 0.00 -3.20 -2.14 0.00 0.00 176.83 171.49 3i3o n ASN 287 N -1.03 -6.01 0.00 -1.34 5.15 -1.26 -5.02 115.26 105.75 3i3o n ASN 287 Ca 0.13 -0.17 0.14 0.00 -0.60 0.00 0.00 54.58 54.09 3i3o n ASN 287 Cb 0.68 -4.92 0.85 0.00 -0.53 0.00 0.00 39.78 35.87 3i3o n ASN 287 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27