#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ijo s THR 5 N 0.00 4.02 0.03 0.58 2.01 -1.26 -4.63 115.64 116.39 3ijo s THR 5 Ca 0.00 1.35 -0.30 0.00 0.31 0.00 0.00 61.69 63.04 3ijo s THR 5 Cb 0.00 -3.87 -0.06 0.00 0.01 0.00 0.00 72.50 68.59 3ijo s THR 5 CO 0.00 -0.03 1.30 -0.69 -0.69 0.00 0.00 174.62 174.51 3ijo s VAL 6 N 2.60 3.84 -0.46 3.82 1.01 0.91 -4.83 120.40 127.29 3ijo s VAL 6 Ca 0.60 1.27 -0.24 0.00 0.00 0.00 0.00 61.98 63.60 3ijo s VAL 6 Cb -0.27 -3.81 0.03 0.00 0.00 0.00 0.00 36.38 32.33 3ijo s VAL 6 CO 0.23 0.04 0.83 -0.69 0.00 0.00 0.00 175.10 175.51 3ijo s VAL 7 N 1.76 4.59 -0.24 2.92 1.01 -1.26 0.17 120.40 129.35 3ijo s VAL 7 Ca 0.61 0.47 -0.15 0.00 0.00 0.00 0.00 61.98 62.91 3ijo s VAL 7 Cb -0.30 -4.37 -0.04 0.00 0.00 0.00 0.00 36.38 31.67 3ijo s VAL 7 CO 0.27 -0.79 0.36 -0.69 0.00 0.00 0.00 175.10 174.26 3ijo s VAL 8 N 3.45 5.20 -0.10 2.92 1.01 0.11 -1.26 120.40 131.73 3ijo s VAL 8 Ca 0.31 0.59 -0.13 0.00 0.00 0.00 0.00 61.98 62.76 3ijo s VAL 8 Cb -0.12 -3.69 -0.05 0.00 0.00 0.00 0.00 36.38 32.52 3ijo s VAL 8 CO 0.23 0.21 0.30 0.28 0.00 0.00 0.00 175.10 176.12 3ijo s THR 9 N 1.65 5.26 0.28 3.92 -1.32 0.44 0.15 115.64 126.03 3ijo s THR 9 Ca 0.16 0.57 -0.04 0.00 -1.21 0.00 0.00 61.69 61.17 3ijo s THR 9 Cb -0.15 -3.61 0.02 0.00 -1.51 0.00 0.00 72.50 67.25 3ijo s THR 9 CO 0.08 0.50 0.44 1.07 -2.21 0.00 0.00 174.62 174.51 3ijo n THR 10 N 2.68 0.00 -3.86 5.08 5.66 -0.48 -2.06 114.28 121.29 3ijo n THR 10 Ca -0.14 -1.23 -0.12 0.00 -3.05 0.00 0.00 64.05 59.51 3ijo n THR 10 Cb 0.53 0.83 -0.14 0.00 -1.55 0.00 0.00 70.33 70.00 3ijo n THR 10 CO 0.00 0.00 0.00 -0.51 -3.05 0.00 0.00 175.07 171.51 3ijo s ILE 11 N -2.62 -0.00 -0.36 1.09 2.07 -1.26 -0.42 121.20 119.69 3ijo s ILE 11 Ca 0.20 0.01 -0.28 0.00 -1.41 0.00 0.00 60.65 59.16 3ijo s ILE 11 Cb -0.02 -0.03 -0.01 0.00 0.13 0.00 0.00 42.46 42.54 3ijo s ILE 11 CO 0.14 0.00 1.65 -0.76 -1.91 0.00 0.00 174.94 174.07 3ijo s LEU 12 N 0.04 3.53 -0.29 8.50 1.43 -1.26 -4.38 118.68 126.25 3ijo s LEU 12 Ca -0.00 1.11 -0.04 0.00 -1.03 0.00 0.00 54.13 54.16 3ijo s LEU 12 Cb -0.01 -3.51 0.16 0.00 0.03 0.00 0.00 46.19 42.87 3ijo s LEU 12 CO -0.00 -1.61 0.59 -0.70 0.23 0.00 0.00 176.35 174.85 3ijo s GLU 13 N 5.41 0.54 0.27 1.70 2.56 -0.33 -4.98 118.70 123.86 3ijo s GLU 13 Ca 0.73 1.11 -0.29 0.00 0.00 0.00 0.00 54.97 56.51 3ijo s GLU 13 Cb -0.19 0.56 -0.09 0.00 2.00 0.00 0.00 34.13 36.41 3ijo s GLU 13 CO 0.33 -0.47 1.17 -1.12 -0.56 0.00 0.00 175.26 174.61 3ijo s SER 14 N 2.83 7.11 -0.41 -1.70 0.01 -1.26 -0.04 113.70 120.24 3ijo s SER 14 Ca 0.11 2.36 0.05 0.00 1.31 0.00 0.00 55.95 59.79 3ijo s SER 14 Cb -0.14 -2.63 0.64 0.00 0.21 0.00 0.00 66.02 64.11 3ijo s SER 14 CO -0.20 -0.29 1.82 -0.81 0.41 0.00 0.00 173.24 174.18 3ijo n PRO 15 N 1.42 2.28 -0.02 12.44 -0.04 -1.26 -4.91 135.00 144.92 3ijo n PRO 15 Ca 0.00 -3.05 -0.13 0.00 -0.04 0.00 0.00 63.50 60.29 3ijo n PRO 15 Cb 0.44 -2.11 -0.11 0.00 -0.04 0.00 0.00 33.50 31.68 3ijo n PRO 15 CO 0.00 0.00 0.00 1.88 -0.04 0.00 0.00 175.50 177.34 3ijo h TYR 16 N 1.13 -0.03 -3.11 0.54 0.05 -0.79 -0.59 116.97 114.17 3ijo h TYR 16 Ca 0.53 -0.00 -0.28 0.00 0.05 0.00 0.00 58.73 59.03 3ijo h TYR 16 Cb 2.60 0.01 -0.35 0.00 1.01 0.00 0.00 36.73 40.00 3ijo h TYR 16 CO 1.47 0.62 -0.62 0.08 -1.05 0.00 0.00 178.16 178.66 3ijo s VAL 17 N -3.42 -0.22 0.02 -2.88 1.01 -0.61 -1.05 120.40 113.25 3ijo s VAL 17 Ca -0.16 0.31 0.00 0.00 0.00 0.00 0.00 61.98 62.13 3ijo s VAL 17 Cb -0.00 -0.29 -0.02 0.00 0.00 0.00 0.00 36.38 36.07 3ijo s VAL 17 CO 0.64 0.13 -0.03 -0.04 0.00 0.00 0.00 175.10 175.80 3ijo s MET 18 N 2.03 0.32 0.25 2.72 -1.94 -0.05 -1.19 119.30 121.44 3ijo s MET 18 Ca -0.00 -0.62 -0.30 0.00 -1.71 0.00 0.00 55.69 53.06 3ijo s MET 18 Cb -0.12 0.08 -0.09 0.00 2.01 0.00 0.00 34.83 36.71 3ijo s MET 18 CO -0.06 -0.04 1.28 -1.64 -0.01 0.00 0.00 175.02 174.55 3ijo s MET 19 N -1.47 4.42 0.63 2.03 -1.94 -1.26 -1.31 119.30 120.40 3ijo s MET 19 Ca -0.16 2.06 -0.16 0.00 -1.71 0.00 0.00 55.69 55.73 3ijo s MET 19 Cb -0.10 -3.16 -0.02 0.00 2.01 0.00 0.00 34.83 33.56 3ijo s MET 19 CO -0.01 -0.17 1.10 0.15 -0.01 0.00 0.00 175.02 176.09 3ijo s LYS 20 N -0.75 2.98 0.13 2.03 1.02 0.19 -4.82 119.74 120.52 3ijo s LYS 20 Ca 0.53 1.40 -0.24 0.00 0.02 0.00 0.00 55.97 57.68 3ijo s LYS 20 Cb -0.37 -1.97 -0.03 0.00 -0.52 0.00 0.00 37.83 34.94 3ijo s LYS 20 CO 0.43 -1.11 1.65 -0.22 -0.92 0.00 0.00 175.35 175.18 3ijo h LYS 21 N 0.30 -0.28 0.00 1.68 1.63 -1.94 -2.55 116.57 115.41 3ijo h LYS 21 Ca -0.47 0.02 -0.07 0.00 -0.85 0.00 0.00 60.65 59.27 3ijo h LYS 21 Cb 1.24 0.06 -0.01 0.00 -0.60 0.00 0.00 32.23 32.93 3ijo h LYS 21 CO 0.55 -0.19 -0.35 -2.95 -3.45 0.00 0.00 179.45 173.07 3ijo h ASN 22 N -0.29 0.00 0.00 4.20 -1.07 -1.96 -3.39 115.58 113.07 3ijo h ASN 22 Ca 0.09 0.00 0.00 0.00 0.07 0.00 0.00 56.30 56.46 3ijo h ASN 22 Cb 0.42 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 36.67 3ijo h ASN 22 CO -0.26 0.35 0.00 1.57 0.07 0.00 0.00 177.43 179.16 3ijo n HIS 23 N -3.22 0.00 -1.50 4.14 -0.00 -0.96 -3.37 115.22 110.31 3ijo n HIS 23 Ca 0.02 0.00 -0.40 0.00 0.46 0.00 0.00 57.72 57.80 3ijo n HIS 23 Cb 0.65 0.00 -0.02 0.00 -0.12 0.00 0.00 29.99 30.50 3ijo n HIS 23 CO 0.00 0.00 0.00 -1.91 0.46 0.00 0.00 176.34 174.89 3ijo n GLU 24 N 0.00 3.46 0.00 1.57 4.07 -1.26 -3.16 120.64 125.32 3ijo n GLU 24 Ca 0.00 -2.41 0.00 0.00 -0.06 0.00 0.00 57.16 54.69 3ijo n GLU 24 Cb 0.00 -2.96 0.00 0.00 -0.06 0.00 0.00 31.44 28.42 3ijo n GLU 24 CO 0.00 0.00 0.00 -1.33 -0.06 0.00 0.00 177.13 175.74 3ijo n MET 25 N 4.34 0.00 -4.40 5.31 2.81 -1.22 -5.17 117.12 118.79 3ijo n MET 25 Ca 0.69 0.00 -0.25 0.00 -1.81 0.00 0.00 57.70 56.33 3ijo n MET 25 Cb 0.29 0.00 -0.09 0.00 -0.71 0.00 0.00 33.22 32.71 3ijo n MET 25 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 3ijo s LEU 26 N 0.00 2.88 0.13 4.03 1.43 -1.19 -5.14 118.68 120.83 3ijo s LEU 26 Ca 0.00 -1.01 0.02 0.00 -1.03 0.00 0.00 54.13 52.12 3ijo s LEU 26 Cb 0.00 -1.27 -0.04 0.00 0.03 0.00 0.00 46.19 44.91 3ijo s LEU 26 CO 0.00 -0.16 -0.05 -1.83 0.23 0.00 0.00 176.35 174.54 3ijo s GLU 27 N -3.65 0.97 3.82 1.70 -1.05 -1.26 -4.80 118.70 114.43 3ijo s GLU 27 Ca 0.33 -1.42 0.00 0.00 -0.15 0.00 0.00 54.97 53.73 3ijo s GLU 27 Cb -0.01 -0.32 0.00 0.00 -0.44 0.00 0.00 34.13 33.36 3ijo s GLU 27 CO 0.18 -0.03 0.00 0.41 0.95 0.00 0.00 175.26 176.77 3ijo n GLY 28 N -0.14 1.03 0.37 -3.83 0.00 -1.26 -2.69 105.19 98.67 3ijo n GLY 28 Ca -0.10 -0.61 0.19 0.00 0.00 0.00 0.00 46.02 45.50 3ijo n GLY 28 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 3ijo h ASN 29 N 8.35 0.00 0.05 1.61 2.35 -1.92 -1.78 115.58 124.24 3ijo h ASN 29 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 3ijo h ASN 29 Cb 0.00 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.37 3ijo h ASN 29 CO 0.00 0.00 0.00 -0.08 -1.65 0.00 0.00 177.43 175.70 3ijo h GLU 30 N 0.00 0.00 0.00 0.81 4.57 -1.91 -2.03 114.58 116.01 3ijo h GLU 30 Ca 0.18 0.00 -0.00 0.00 -1.18 0.00 0.00 59.36 58.36 3ijo h GLU 30 Cb 0.87 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 29.46 3ijo h GLU 30 CO -0.00 0.00 -0.01 0.00 -1.18 0.00 0.00 179.01 177.82 3ijo h ARG 31 N 0.00 0.00 -6.56 1.92 3.08 -1.45 -3.46 114.38 107.91 3ijo h ARG 31 Ca 0.00 0.00 -0.65 0.00 0.07 0.00 0.00 59.98 59.40 3ijo h ARG 31 Cb 0.03 0.00 -0.16 0.00 0.08 0.00 0.00 29.97 29.91 3ijo h ARG 31 CO 0.00 0.01 -0.77 0.71 -1.07 0.00 0.00 179.97 178.85 3ijo s TYR 32 N -3.77 2.53 0.09 3.04 2.02 -0.77 -0.63 117.35 119.86 3ijo s TYR 32 Ca -0.00 -0.26 -0.03 0.00 -0.37 0.00 0.00 57.07 56.41 3ijo s TYR 32 Cb 0.10 -1.27 -0.03 0.00 -0.40 0.00 0.00 41.96 40.35 3ijo s TYR 32 CO 0.52 0.47 0.05 -1.83 -1.57 0.00 0.00 175.55 173.19 3ijo s GLU 33 N -2.59 0.78 0.00 -0.62 -1.05 -0.42 -4.84 118.70 109.97 3ijo s GLU 33 Ca 0.22 -1.25 0.00 0.00 -0.15 0.00 0.00 54.97 53.79 3ijo s GLU 33 Cb -0.09 0.25 0.00 0.00 -0.44 0.00 0.00 34.13 33.85 3ijo s GLU 33 CO 0.12 -0.20 0.00 0.41 0.95 0.00 0.00 175.26 176.54 3ijo n GLY 34 N -0.00 2.61 0.27 -3.83 0.00 -1.26 -0.87 105.19 102.11 3ijo n GLY 34 Ca -0.11 -1.80 -0.08 0.00 0.00 0.00 0.00 46.02 44.04 3ijo n GLY 34 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 3ijo h TYR 35 N 0.00 -0.61 0.00 1.61 3.20 -0.80 0.73 116.97 121.10 3ijo h TYR 35 Ca 0.00 0.04 -0.10 0.00 3.14 0.00 0.00 58.73 61.81 3ijo h TYR 35 Cb 0.00 0.31 -0.01 0.00 1.54 0.00 0.00 36.73 38.57 3ijo h TYR 35 CO 0.00 -0.31 -0.45 0.00 -1.64 0.00 0.00 178.16 175.76 3ijo h VAL 37 N 0.00 1.16 -0.61 0.00 2.07 -1.24 0.10 116.25 117.73 3ijo h VAL 37 Ca -0.00 -0.48 -0.06 0.00 0.82 0.00 0.00 66.70 66.97 3ijo h VAL 37 Cb 0.84 1.09 -0.03 0.00 -1.52 0.00 0.00 31.29 31.67 3ijo h VAL 37 CO 0.06 0.16 0.15 0.44 0.02 0.00 0.00 177.57 178.40 3ijo h ASP 38 N 0.19 0.93 -0.64 0.57 3.32 -0.51 -2.81 116.42 117.46 3ijo h ASP 38 Ca 0.07 -0.23 -0.03 0.00 0.02 0.00 0.00 57.03 56.86 3ijo h ASP 38 Cb 0.17 -0.25 -0.03 0.00 0.22 0.00 0.00 39.33 39.44 3ijo h ASP 38 CO -0.01 0.92 0.28 0.25 -1.72 0.00 0.00 179.24 178.97 3ijo h LEU 39 N 0.90 0.86 -0.39 1.55 5.85 -0.52 -2.41 115.31 121.14 3ijo h LEU 39 Ca 0.19 -0.15 0.02 0.00 0.84 0.00 0.00 57.88 58.78 3ijo h LEU 39 Cb 0.36 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 41.14 3ijo h LEU 39 CO 0.00 0.77 0.23 0.00 -0.34 0.00 0.00 178.44 179.10 3ijo h ALA 40 N 1.12 0.49 -0.18 1.25 0.00 -0.70 -0.03 119.26 121.21 3ijo h ALA 40 Ca 0.22 -0.01 0.04 0.00 0.00 0.00 0.00 54.91 55.16 3ijo h ALA 40 Cb 0.16 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.80 3ijo h ALA 40 CO -0.02 -0.10 -0.06 0.00 0.00 0.00 0.00 179.25 179.07 3ijo h ALA 41 N 1.17 0.10 -0.30 0.00 0.00 -1.29 0.25 119.26 119.19 3ijo h ALA 41 Ca 0.15 0.07 0.01 0.00 0.00 0.00 0.00 54.91 55.14 3ijo h ALA 41 Cb 0.00 0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 3ijo h ALA 41 CO -0.07 -0.49 0.19 0.93 0.00 0.00 0.00 179.25 179.81 3ijo h GLU 42 N -0.02 0.37 -0.65 0.00 4.39 -1.11 -0.28 114.58 117.28 3ijo h GLU 42 Ca 0.09 -0.02 0.02 0.00 0.34 0.00 0.00 59.36 59.79 3ijo h GLU 42 Cb 0.15 -0.08 -0.04 0.00 -0.10 0.00 0.00 28.75 28.68 3ijo h GLU 42 CO -0.19 0.24 0.41 0.82 -1.16 0.00 0.00 179.01 179.13 3ijo h ILE 43 N 0.38 1.12 -0.01 3.13 1.08 -0.70 -1.23 117.51 121.29 3ijo h ILE 43 Ca 0.12 -0.28 -0.13 0.00 -0.39 0.00 0.00 64.86 64.18 3ijo h ILE 43 Cb -0.02 0.22 -0.02 0.00 -3.07 0.00 0.00 36.82 33.94 3ijo h ILE 43 CO -0.04 0.15 -0.59 0.00 -0.69 0.00 0.00 178.15 176.98 3ijo h ALA 44 N 1.26 1.00 0.39 1.87 0.00 -0.69 -0.59 119.26 122.50 3ijo h ALA 44 Ca 0.25 -0.53 -0.02 0.00 0.00 0.00 0.00 54.91 54.61 3ijo h ALA 44 Cb -0.04 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.67 3ijo h ALA 44 CO -0.08 0.73 -0.19 -0.22 0.00 0.00 0.00 179.25 179.49 3ijo h LYS 45 N 0.04 -0.50 0.00 0.00 3.64 -0.64 0.36 116.57 119.47 3ijo h LYS 45 Ca -0.01 0.03 -0.05 0.00 -1.27 0.00 0.00 60.65 59.36 3ijo h LYS 45 Cb 1.04 0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 32.97 3ijo h LYS 45 CO 0.08 -0.24 -0.23 0.45 -2.27 0.00 0.00 179.45 177.24 3ijo h HIS 46 N -0.69 0.00 -0.01 1.91 3.86 -1.01 -1.93 115.15 117.28 3ijo h HIS 46 Ca -0.05 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.16 3ijo h HIS 46 Cb 0.49 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.96 3ijo h HIS 46 CO -0.01 0.23 -0.58 0.00 0.86 0.00 0.00 177.93 178.43 3ijo n GLY 48 N 1.45 -0.24 3.36 0.00 0.00 -0.15 -5.04 105.19 104.56 3ijo n GLY 48 Ca 0.07 0.03 -0.20 0.00 0.00 0.00 0.00 46.02 45.93 3ijo n GLY 48 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3ijo s PHE 49 N -3.29 1.79 0.17 1.61 -0.12 -0.07 -5.03 117.98 113.05 3ijo s PHE 49 Ca 0.15 -0.52 0.01 0.00 -0.05 0.00 0.00 56.93 56.51 3ijo s PHE 49 Cb -0.07 -0.84 -0.04 0.00 -0.63 0.00 0.00 43.02 41.45 3ijo s PHE 49 CO 0.60 0.39 0.33 -1.59 -0.05 0.00 0.00 175.22 174.91 3ijo s LYS 50 N -3.45 3.48 0.13 1.99 0.00 -1.26 -4.57 119.74 116.06 3ijo s LYS 50 Ca 0.22 -0.47 -0.15 0.00 0.00 0.00 0.00 55.97 55.57 3ijo s LYS 50 Cb -0.02 -2.91 0.03 0.00 0.00 0.00 0.00 37.83 34.93 3ijo s LYS 50 CO 0.08 0.47 0.38 1.52 0.00 0.00 0.00 175.35 177.80 3ijo s TYR 51 N -1.80 -0.10 -0.13 1.78 1.13 -1.26 -0.06 117.35 116.91 3ijo s TYR 51 Ca 0.36 -0.24 0.00 0.00 -1.41 0.00 0.00 57.07 55.79 3ijo s TYR 51 Cb -0.11 0.21 0.02 0.00 -1.10 0.00 0.00 41.96 40.99 3ijo s TYR 51 CO 0.29 -0.71 -0.11 0.21 -2.51 0.00 0.00 175.55 172.71 3ijo s LYS 52 N -3.83 1.96 -0.03 -3.49 2.20 0.13 -4.85 119.74 111.82 3ijo s LYS 52 Ca 0.05 -0.43 -0.30 0.00 -0.36 0.00 0.00 55.97 54.93 3ijo s LYS 52 Cb 0.02 -1.87 -0.04 0.00 -1.51 0.00 0.00 37.83 34.43 3ijo s LYS 52 CO -0.10 -0.24 1.22 -0.51 -0.36 0.00 0.00 175.35 175.37 3ijo s LEU 53 N 1.55 4.30 -0.06 5.43 1.43 -1.26 -0.71 118.68 129.34 3ijo s LEU 53 Ca 0.04 1.87 0.04 0.00 -1.03 0.00 0.00 54.13 55.06 3ijo s LEU 53 Cb -0.13 -3.56 -0.00 0.00 0.03 0.00 0.00 46.19 42.53 3ijo s LEU 53 CO -0.09 -0.58 -0.21 0.42 0.23 0.00 0.00 176.35 176.12 3ijo s THR 54 N 2.07 1.74 -0.12 5.49 -4.23 0.12 -4.84 115.64 115.87 3ijo s THR 54 Ca 0.57 -0.87 -0.27 0.00 -1.18 0.00 0.00 61.69 59.94 3ijo s THR 54 Cb -0.26 -1.49 -0.02 0.00 1.34 0.00 0.00 72.50 72.07 3ijo s THR 54 CO 0.23 0.49 0.91 -0.63 -0.54 0.00 0.00 174.62 175.09 3ijo s ILE 55 N 0.14 4.85 0.13 2.99 -1.09 -1.26 -1.38 121.20 125.57 3ijo s ILE 55 Ca -0.09 1.84 -0.35 0.00 -2.23 0.00 0.00 60.65 59.82 3ijo s ILE 55 Cb -0.14 -4.23 -0.16 0.00 -1.58 0.00 0.00 42.46 36.35 3ijo s ILE 55 CO 0.05 0.04 1.35 0.55 -1.23 0.00 0.00 174.94 175.70 3ijo n VAL 56 N 4.51 0.25 -0.11 2.92 3.14 0.44 -4.88 118.33 124.59 3ijo n VAL 56 Ca 0.06 -0.06 -0.06 0.00 -2.96 0.00 0.00 64.34 61.32 3ijo n VAL 56 Cb 0.49 -0.98 0.02 0.00 -1.06 0.00 0.00 33.84 32.31 3ijo n VAL 56 CO 0.00 0.00 0.00 1.23 -6.46 0.00 0.00 176.83 171.60 3ijo h GLY 57 N 4.51 0.46 -1.03 7.55 0.00 -1.93 -2.70 103.07 109.93 3ijo h GLY 57 Ca -0.46 -0.05 0.00 0.00 0.00 0.00 0.00 47.33 46.81 3ijo h GLY 57 CO 0.78 0.00 0.00 2.09 0.00 0.00 0.00 176.54 179.41 3ijo n ASP 58 N -5.05 1.98 -0.97 0.19 5.68 -1.26 -4.94 116.55 112.18 3ijo n ASP 58 Ca 0.02 -1.72 -0.11 0.00 -0.50 0.00 0.00 54.79 52.47 3ijo n ASP 58 Cb 0.15 -0.09 -0.04 0.00 -1.14 0.00 0.00 41.12 40.00 3ijo n ASP 58 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3ijo n GLY 59 N 1.21 0.96 3.43 6.12 0.00 -1.02 -4.97 105.19 110.92 3ijo n GLY 59 Ca 0.17 -0.48 -0.25 0.00 0.00 0.00 0.00 46.02 45.46 3ijo n GLY 59 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ijo s LYS 60 N -3.32 1.55 -0.09 1.61 1.02 -1.26 -4.98 119.74 114.26 3ijo s LYS 60 Ca 0.00 -1.61 -0.27 0.00 0.02 0.00 0.00 55.97 54.10 3ijo s LYS 60 Cb 0.00 -1.74 -0.24 0.00 -0.52 0.00 0.00 37.83 35.33 3ijo s LYS 60 CO 0.00 0.35 0.94 1.88 -0.92 0.00 0.00 175.35 177.60 3ijo h TYR 61 N 2.82 0.05 0.00 3.18 -1.99 -1.88 -1.83 116.97 117.32 3ijo h TYR 61 Ca -0.43 -0.03 0.00 0.00 2.00 0.00 0.00 58.73 60.27 3ijo h TYR 61 Cb 1.23 -0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.95 3ijo h TYR 61 CO 0.74 0.86 0.00 0.41 -0.00 0.00 0.00 178.16 180.17 3ijo n GLY 62 N 1.17 4.02 3.34 3.88 0.00 -1.05 -1.45 105.19 115.11 3ijo n GLY 62 Ca -0.10 -0.60 -0.10 0.00 0.00 0.00 0.00 46.02 45.22 3ijo n GLY 62 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ijo s ALA 63 N 0.00 -0.51 -0.26 4.61 0.00 -1.25 -4.64 121.76 119.72 3ijo s ALA 63 Ca 0.00 -0.45 -0.11 0.00 0.00 0.00 0.00 51.96 51.40 3ijo s ALA 63 Cb 0.00 0.73 -0.05 0.00 0.00 0.00 0.00 23.12 23.80 3ijo s ALA 63 CO 0.00 -0.65 0.18 0.50 0.00 0.00 0.00 175.76 175.79 3ijo s ARG 64 N -3.88 4.02 -0.21 0.00 3.52 -1.26 -1.76 118.95 119.38 3ijo s ARG 64 Ca 0.09 -0.27 -0.28 0.00 -0.13 0.00 0.00 55.73 55.13 3ijo s ARG 64 Cb 0.02 -3.59 -0.05 0.00 -1.56 0.00 0.00 34.95 29.77 3ijo s ARG 64 CO -0.06 -0.05 2.11 0.34 -0.81 0.00 0.00 175.30 176.83 3ijo s ASP 65 N 1.36 5.66 0.30 -2.12 -1.08 -0.81 -4.89 116.67 115.09 3ijo s ASP 65 Ca 0.08 1.88 -0.29 0.00 -0.52 0.00 0.00 52.55 53.70 3ijo s ASP 65 Cb -0.15 -2.52 -0.10 0.00 -1.46 0.00 0.00 42.92 38.70 3ijo s ASP 65 CO 0.07 -1.80 1.35 0.00 0.52 0.00 0.00 175.17 175.31 3ijo s ALA 66 N 7.58 3.54 0.00 3.66 0.00 -1.26 0.17 121.76 135.44 3ijo s ALA 66 Ca 0.95 1.29 0.00 0.00 0.00 0.00 0.00 51.96 54.20 3ijo s ALA 66 Cb -0.32 -3.51 0.00 0.00 0.00 0.00 0.00 23.12 19.29 3ijo s ALA 66 CO 0.35 -0.69 0.00 -0.40 0.00 0.00 0.00 175.76 175.03 3ijo n ASP 67 N 1.30 0.00 -0.07 0.00 3.85 -1.26 -4.68 116.55 115.69 3ijo n ASP 67 Ca 0.02 0.00 -0.06 0.00 -0.71 0.00 0.00 54.79 54.04 3ijo n ASP 67 Cb 0.41 0.00 -0.16 0.00 -1.35 0.00 0.00 41.12 40.03 3ijo n ASP 67 CO 0.00 0.00 0.00 1.07 -1.01 0.00 0.00 177.20 177.26 3ijo n THR 68 N 0.00 1.20 -1.11 2.12 5.66 -1.11 -4.99 114.28 116.04 3ijo n THR 68 Ca 0.00 -0.79 -0.04 0.00 -3.05 0.00 0.00 64.05 60.17 3ijo n THR 68 Cb 0.00 -0.46 -0.02 0.00 -1.55 0.00 0.00 70.33 68.30 3ijo n THR 68 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 175.07 172.31 3ijo n LYS 69 N -2.71 -0.90 -3.09 1.09 4.76 0.45 -5.00 118.16 112.76 3ijo n LYS 69 Ca -0.26 0.48 -0.39 0.00 -2.87 0.00 0.00 58.31 55.27 3ijo n LYS 69 Cb 1.05 -4.30 -0.05 0.00 -1.84 0.00 0.00 35.03 29.88 3ijo n LYS 69 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 3ijo s ILE 70 N -1.83 4.79 0.11 -0.18 1.01 -1.26 -4.77 121.20 119.07 3ijo s ILE 70 Ca 0.00 1.46 -0.26 0.00 0.00 0.00 0.00 60.65 61.84 3ijo s ILE 70 Cb 0.00 -4.03 -0.06 0.00 0.01 0.00 0.00 42.46 38.37 3ijo s ILE 70 CO 0.00 0.40 0.82 0.26 0.00 0.00 0.00 174.94 176.42 3ijo s TRP 71 N -0.21 3.82 0.33 3.97 0.52 -1.26 -1.93 118.94 124.18 3ijo s TRP 71 Ca 0.35 1.61 0.04 0.00 0.02 0.00 0.00 56.10 58.12 3ijo s TRP 71 Cb -0.20 -2.86 0.04 0.00 -1.15 0.00 0.00 33.47 29.30 3ijo s TRP 71 CO 0.21 0.34 0.31 0.27 0.02 0.00 0.00 176.95 178.10 3ijo n ASN 72 N 2.36 1.83 0.00 2.95 0.23 -0.73 -4.18 115.26 117.73 3ijo n ASN 72 Ca -0.02 -2.07 0.00 0.00 -0.53 0.00 0.00 54.58 51.96 3ijo n ASN 72 Cb 0.49 -0.09 0.00 0.00 -2.08 0.00 0.00 39.78 38.11 3ijo n ASN 72 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3ijo n GLY 73 N 0.99 -0.33 0.23 4.83 0.00 -1.26 -1.54 105.19 108.11 3ijo n GLY 73 Ca 0.02 -1.08 0.06 0.00 0.00 0.00 0.00 46.02 45.02 3ijo n GLY 73 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 3ijo h MET 74 N 0.00 0.00 -0.10 1.61 2.86 -0.34 -2.08 114.93 116.87 3ijo h MET 74 Ca 0.00 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.63 3ijo h MET 74 Cb 0.00 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.66 3ijo h MET 74 CO 0.00 0.18 0.03 0.28 1.06 0.00 0.00 176.91 178.46 3ijo h VAL 75 N 0.00 1.18 -0.95 -2.22 2.07 -1.50 -2.74 116.25 112.09 3ijo h VAL 75 Ca -0.00 -0.56 0.07 0.00 0.82 0.00 0.00 66.70 67.03 3ijo h VAL 75 Cb 0.33 1.37 -0.06 0.00 -1.52 0.00 0.00 31.29 31.41 3ijo h VAL 75 CO 0.02 0.16 0.62 1.23 0.02 0.00 0.00 177.57 179.62 3ijo h GLY 76 N -0.03 1.42 1.77 2.17 0.00 -0.89 -0.77 103.07 106.74 3ijo h GLY 76 Ca 0.03 -0.44 -0.03 0.00 0.00 0.00 0.00 47.33 46.89 3ijo h GLY 76 CO -0.00 0.31 -0.01 0.83 0.00 0.00 0.00 176.54 177.66 3ijo h GLU 77 N 1.09 0.30 0.02 4.80 5.08 -1.13 0.95 114.58 125.68 3ijo h GLU 77 Ca 0.41 -0.05 -0.07 0.00 -1.00 0.00 0.00 59.36 58.66 3ijo h GLU 77 Cb 0.21 -0.05 0.01 0.00 0.50 0.00 0.00 28.75 29.41 3ijo h GLU 77 CO -0.16 0.33 -0.27 -0.07 -1.00 0.00 0.00 179.01 177.84 3ijo h LEU 78 N 0.29 0.21 -0.95 1.33 3.38 -1.14 0.13 115.31 118.57 3ijo h LEU 78 Ca 0.07 -0.84 0.02 0.00 0.09 0.00 0.00 57.88 57.22 3ijo h LEU 78 Cb 0.22 -0.07 -0.05 0.00 0.09 0.00 0.00 40.66 40.85 3ijo h LEU 78 CO 0.01 1.03 0.63 0.58 0.09 0.00 0.00 178.44 180.77 3ijo h VAL 79 N -0.58 1.20 -0.07 1.22 2.07 -0.94 -2.87 116.25 116.28 3ijo h VAL 79 Ca -0.04 -0.43 0.00 0.00 0.82 0.00 0.00 66.70 67.05 3ijo h VAL 79 Cb 1.08 -0.15 0.00 0.00 -1.52 0.00 0.00 31.29 30.70 3ijo h VAL 79 CO 0.05 0.23 0.00 -1.22 0.02 0.00 0.00 177.57 176.65 3ijo n TYR 80 N -4.45 0.07 -0.54 1.57 4.01 0.31 -4.95 117.16 113.18 3ijo n TYR 80 Ca 0.12 -0.04 0.00 0.00 -0.16 0.00 0.00 57.90 57.82 3ijo n TYR 80 Cb 0.06 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.09 3ijo n TYR 80 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3ijo n GLY 81 N 1.24 0.68 0.10 2.72 0.00 -1.08 -4.95 105.19 103.90 3ijo n GLY 81 Ca 0.17 -0.43 0.12 0.00 0.00 0.00 0.00 46.02 45.88 3ijo n GLY 81 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3ijo h LYS 82 N 0.65 0.00 -3.75 1.61 1.79 -1.04 -3.47 116.57 112.37 3ijo h LYS 82 Ca 0.00 0.00 -0.14 0.00 -2.18 0.00 0.00 60.65 58.33 3ijo h LYS 82 Cb 0.00 0.00 -0.19 0.00 -1.58 0.00 0.00 32.23 30.46 3ijo h LYS 82 CO 0.00 0.00 -0.54 0.00 -1.08 0.00 0.00 179.45 177.83 3ijo s ALA 83 N -3.19 -0.11 -0.13 3.86 0.00 -0.58 -5.00 121.76 116.61 3ijo s ALA 83 Ca 0.06 -0.45 0.19 0.00 0.00 0.00 0.00 51.96 51.76 3ijo s ALA 83 Cb 0.11 0.20 -0.18 0.00 0.00 0.00 0.00 23.12 23.25 3ijo s ALA 83 CO 0.70 -0.27 0.65 -0.25 0.00 0.00 0.00 175.76 176.59 3ijo n ASP 84 N 1.06 0.54 -3.56 0.00 8.00 -0.39 -4.48 116.55 117.72 3ijo n ASP 84 Ca -0.21 0.23 -0.15 0.00 0.71 0.00 0.00 54.79 55.38 3ijo n ASP 84 Cb 0.57 0.70 -0.06 0.00 -0.02 0.00 0.00 41.12 42.31 3ijo n ASP 84 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 3ijo s ILE 85 N -3.02 0.00 -0.15 0.53 2.07 -1.13 -4.27 121.20 115.24 3ijo s ILE 85 Ca -0.05 0.00 0.00 0.00 -1.41 0.00 0.00 60.65 59.19 3ijo s ILE 85 Cb 0.09 -1.00 -0.00 0.00 0.13 0.00 0.00 42.46 41.68 3ijo s ILE 85 CO 0.83 0.00 -0.15 0.00 -1.91 0.00 0.00 174.94 173.71 3ijo s ALA 86 N -0.80 2.51 -0.32 1.50 0.00 0.25 -0.42 121.76 124.48 3ijo s ALA 86 Ca -0.06 -1.01 0.02 0.00 0.00 0.00 0.00 51.96 50.91 3ijo s ALA 86 Cb -0.01 -1.21 0.09 0.00 0.00 0.00 0.00 23.12 21.99 3ijo s ALA 86 CO 0.05 0.03 0.04 0.42 0.00 0.00 0.00 175.76 176.30 3ijo s ILE 87 N 0.71 1.84 0.10 0.00 1.01 -0.88 -1.89 121.20 122.09 3ijo s ILE 87 Ca -0.07 -1.95 -0.26 0.00 0.00 0.00 0.00 60.65 58.37 3ijo s ILE 87 Cb -0.16 -2.31 0.08 0.00 0.01 0.00 0.00 42.46 40.09 3ijo s ILE 87 CO 0.01 -0.53 1.09 0.00 0.00 0.00 0.00 174.94 175.51 3ijo s ALA 88 N 1.15 -1.86 -0.92 9.38 0.00 -1.26 -4.59 121.76 123.65 3ijo s ALA 88 Ca 0.08 0.23 -0.08 0.00 0.00 0.00 0.00 51.96 52.19 3ijo s ALA 88 Cb -0.19 0.58 -0.07 0.00 0.00 0.00 0.00 23.12 23.45 3ijo s ALA 88 CO -0.12 -1.06 2.11 -0.35 0.00 0.00 0.00 175.76 176.34 3ijo n PRO 89 N -0.53 2.06 -3.45 0.00 -0.04 -1.26 -4.71 135.00 127.08 3ijo n PRO 89 Ca -0.06 -1.56 -0.41 0.00 -0.04 0.00 0.00 63.50 61.44 3ijo n PRO 89 Cb 0.61 -2.55 -0.10 0.00 -0.04 0.00 0.00 33.50 31.43 3ijo n PRO 89 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 3ijo s LEU 90 N 0.30 4.46 0.14 1.53 2.96 -1.26 -5.00 118.68 121.79 3ijo s LEU 90 Ca 0.43 -0.29 -0.30 0.00 -0.22 0.00 0.00 54.13 53.75 3ijo s LEU 90 Cb 0.11 -2.27 -0.07 0.00 0.50 0.00 0.00 46.19 44.46 3ijo s LEU 90 CO -0.01 -0.30 1.25 -0.89 -1.32 0.00 0.00 176.35 175.08 3ijo s THR 91 N 1.92 3.62 -0.15 3.68 2.01 -1.26 -1.85 115.64 123.60 3ijo s THR 91 Ca 0.10 1.25 -0.29 0.00 0.31 0.00 0.00 61.69 63.06 3ijo s THR 91 Cb -0.17 -3.80 -0.02 0.00 0.01 0.00 0.00 72.50 68.52 3ijo s THR 91 CO 0.11 0.15 1.30 -0.63 -0.69 0.00 0.00 174.62 174.86 3ijo s ILE 92 N 0.53 4.20 0.19 1.82 1.01 -0.50 -4.88 121.20 123.56 3ijo s ILE 92 Ca 0.57 1.45 0.02 0.00 0.00 0.00 0.00 60.65 62.70 3ijo s ILE 92 Cb -0.33 -3.94 -0.05 0.00 0.01 0.00 0.00 42.46 38.16 3ijo s ILE 92 CO 0.33 -0.12 -0.00 0.42 0.00 0.00 0.00 174.94 175.57 3ijo s THR 93 N 3.49 0.80 0.03 2.92 -4.23 -1.26 -4.77 115.64 112.62 3ijo s THR 93 Ca 0.57 -2.00 -0.25 0.00 -1.18 0.00 0.00 61.69 58.83 3ijo s THR 93 Cb -0.23 -2.17 -0.17 0.00 1.34 0.00 0.00 72.50 71.26 3ijo s THR 93 CO 0.17 -0.44 1.43 0.25 -0.54 0.00 0.00 174.62 175.48 3ijo h LEU 94 N 2.64 -0.15 -1.72 4.79 5.85 -1.98 -0.31 115.31 124.42 3ijo h LEU 94 Ca -0.37 -0.21 -0.03 0.00 0.84 0.00 0.00 57.88 58.11 3ijo h LEU 94 Cb 1.21 0.04 -0.00 0.00 0.37 0.00 0.00 40.66 42.27 3ijo h LEU 94 CO 0.63 0.14 -0.14 -0.37 -0.34 0.00 0.00 178.44 178.36 3ijo h VAL 95 N -0.44 1.10 -0.03 1.05 -1.51 -2.00 -2.17 116.25 112.25 3ijo h VAL 95 Ca -0.02 -0.48 -0.09 0.00 -1.23 0.00 0.00 66.70 64.89 3ijo h VAL 95 Cb 0.35 1.26 0.01 0.00 -2.13 0.00 0.00 31.29 30.77 3ijo h VAL 95 CO 0.03 0.14 -0.32 0.03 -1.23 0.00 0.00 177.57 176.22 3ijo h ARG 96 N 0.00 0.27 -0.16 5.19 3.08 -1.93 -3.25 114.38 117.58 3ijo h ARG 96 Ca -0.00 -0.25 0.05 0.00 0.07 0.00 0.00 59.98 59.85 3ijo h ARG 96 Cb 0.25 0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.35 3ijo h ARG 96 CO 0.02 0.93 0.18 1.49 -1.07 0.00 0.00 179.97 181.52 3ijo h GLU 97 N -0.30 0.00 0.00 0.04 4.57 -0.63 0.30 114.58 118.55 3ijo h GLU 97 Ca -0.03 0.00 -0.03 0.00 -1.18 0.00 0.00 59.36 58.12 3ijo h GLU 97 Cb 1.02 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 29.60 3ijo h GLU 97 CO 0.06 0.00 -0.14 0.93 -1.18 0.00 0.00 179.01 178.68 3ijo h GLU 98 N 0.00 0.00 0.00 1.92 5.08 -1.44 -3.32 114.58 116.83 3ijo h GLU 98 Ca 0.08 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.44 3ijo h GLU 98 Cb 0.44 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.69 3ijo h GLU 98 CO -0.00 0.14 -1.05 1.33 -1.00 0.00 0.00 179.01 178.43 3ijo n VAL 99 N -3.42 0.00 -4.38 3.13 0.24 0.83 -5.06 118.33 109.67 3ijo n VAL 99 Ca -0.01 -0.03 -0.19 0.00 -2.04 0.00 0.00 64.34 62.08 3ijo n VAL 99 Cb 0.33 0.47 -0.10 0.00 -1.47 0.00 0.00 33.84 33.06 3ijo n VAL 99 CO 0.00 0.00 0.00 0.27 -2.14 0.00 0.00 176.83 174.96 3ijo s ILE 100 N -2.08 0.93 -0.06 1.34 -4.36 0.15 -4.07 121.20 113.05 3ijo s ILE 100 Ca -0.00 -2.01 -0.03 0.00 -0.26 0.00 0.00 60.65 58.35 3ijo s ILE 100 Cb 0.01 -2.66 -0.04 0.00 1.25 0.00 0.00 42.46 41.02 3ijo s ILE 100 CO 0.05 -0.05 0.09 -1.81 0.24 0.00 0.00 174.94 173.45 3ijo s ASP 101 N -3.39 5.83 -0.00 4.36 1.01 -0.52 -4.27 116.67 119.68 3ijo s ASP 101 Ca 0.36 0.26 0.07 0.00 0.71 0.00 0.00 52.55 53.95 3ijo s ASP 101 Cb 0.08 -1.75 -0.03 0.00 1.01 0.00 0.00 42.92 42.23 3ijo s ASP 101 CO 0.14 0.34 -0.22 -0.36 0.21 0.00 0.00 175.17 175.28 3ijo s PHE 102 N -1.07 2.46 1.19 4.23 0.08 -1.26 -0.87 117.98 122.74 3ijo s PHE 102 Ca 0.18 -0.33 -0.17 0.00 0.12 0.00 0.00 56.93 56.73 3ijo s PHE 102 Cb -0.12 -1.50 0.28 0.00 -0.57 0.00 0.00 43.02 41.11 3ijo s PHE 102 CO 0.08 0.10 1.05 -1.54 -0.10 0.00 0.00 175.22 174.81 3ijo s SER 103 N -0.93 0.94 0.72 1.36 1.04 0.63 -4.94 113.70 112.52 3ijo s SER 103 Ca 0.12 1.03 -0.16 0.00 0.48 0.00 0.00 55.95 57.41 3ijo s SER 103 Cb -0.10 -1.55 0.01 0.00 0.10 0.00 0.00 66.02 64.48 3ijo s SER 103 CO 0.01 -4.16 0.96 0.29 0.98 0.00 0.00 173.24 171.33 3ijo n LYS 104 N -4.84 0.50 -1.95 4.02 4.76 -1.26 -4.59 118.16 114.80 3ijo n LYS 104 Ca 0.08 0.23 -0.41 0.00 -2.87 0.00 0.00 58.31 55.34 3ijo n LYS 104 Cb 0.58 -2.22 -0.01 0.00 -1.84 0.00 0.00 35.03 31.54 3ijo n LYS 104 CO 0.00 0.00 0.00 -1.25 -1.37 0.00 0.00 177.40 174.78 3ijo s PRO 105 N -3.34 4.22 -0.00 1.97 0.04 -1.26 -4.57 135.00 132.06 3ijo s PRO 105 Ca 0.73 2.41 0.20 0.00 0.04 0.00 0.00 61.00 64.38 3ijo s PRO 105 Cb -0.34 -3.01 -0.23 0.00 0.04 0.00 0.00 34.50 30.95 3ijo s PRO 105 CO 0.50 -0.37 0.79 1.97 0.04 0.00 0.00 177.00 179.93 3ijo n PHE 106 N 0.61 0.00 -3.66 0.56 1.16 0.28 -4.96 117.46 111.44 3ijo n PHE 106 Ca 0.01 0.00 -0.14 0.00 -1.87 0.00 0.00 57.45 55.44 3ijo n PHE 106 Cb 0.40 -0.07 -0.08 0.00 -1.61 0.00 0.00 39.48 38.12 3ijo n PHE 106 CO 0.00 0.00 0.00 1.41 -1.87 0.00 0.00 176.76 176.30 3ijo s MET 107 N -2.98 0.73 0.13 3.97 0.00 -1.25 -5.01 119.30 114.89 3ijo s MET 107 Ca 0.05 0.51 -0.01 0.00 0.00 0.00 0.00 55.69 56.24 3ijo s MET 107 Cb 0.15 0.35 -0.05 0.00 0.00 0.00 0.00 34.83 35.28 3ijo s MET 107 CO 0.83 -0.15 0.31 -1.12 0.00 0.00 0.00 175.02 174.90 3ijo s SER 108 N -0.27 6.41 0.26 1.11 0.01 -1.26 -1.22 113.70 118.73 3ijo s SER 108 Ca -0.04 0.40 -0.21 0.00 1.31 0.00 0.00 55.95 57.40 3ijo s SER 108 Cb -0.03 -2.01 0.03 0.00 0.21 0.00 0.00 66.02 64.21 3ijo s SER 108 CO 0.03 0.07 0.73 -1.48 0.41 0.00 0.00 173.24 173.00 3ijo s LEU 109 N -2.83 -0.27 0.07 2.44 -0.00 -0.96 -4.79 118.68 112.34 3ijo s LEU 109 Ca 0.38 -0.56 -0.07 0.00 -0.00 0.00 0.00 54.13 53.87 3ijo s LEU 109 Cb -0.12 2.68 -0.01 0.00 -0.00 0.00 0.00 46.19 48.74 3ijo s LEU 109 CO 0.27 -1.30 0.14 -0.83 -0.00 0.00 0.00 176.35 174.64 3ijo s GLY 110 N -2.91 0.15 0.39 -3.48 0.00 -1.26 -1.31 107.32 98.90 3ijo s GLY 110 Ca 0.11 -0.65 -0.26 0.00 0.00 0.00 0.00 44.72 43.91 3ijo s GLY 110 CO 0.06 -0.81 1.31 -0.42 0.00 0.00 0.00 173.10 173.23 3ijo s ILE 111 N -3.48 2.61 0.26 0.90 1.01 -1.26 0.21 121.20 121.44 3ijo s ILE 111 Ca 0.02 0.55 -0.08 0.00 0.00 0.00 0.00 60.65 61.14 3ijo s ILE 111 Cb 0.04 -3.33 -0.01 0.00 0.01 0.00 0.00 42.46 39.16 3ijo s ILE 111 CO -0.09 0.09 0.41 -0.94 0.00 0.00 0.00 174.94 174.41 3ijo s SER 112 N -0.68 0.15 -0.15 3.58 1.04 0.37 -0.31 113.70 117.70 3ijo s SER 112 Ca 0.56 -1.14 -0.03 0.00 0.48 0.00 0.00 55.95 55.82 3ijo s SER 112 Cb -0.39 0.56 -0.03 0.00 0.10 0.00 0.00 66.02 66.27 3ijo s SER 112 CO 0.50 -1.11 -0.04 -0.63 0.98 0.00 0.00 173.24 172.94 3ijo s ILE 113 N -3.85 3.86 -0.18 -1.02 1.01 -1.26 -1.37 121.20 118.40 3ijo s ILE 113 Ca 0.27 -0.38 -0.04 0.00 0.00 0.00 0.00 60.65 60.51 3ijo s ILE 113 Cb 0.01 -2.68 -0.02 0.00 0.01 0.00 0.00 42.46 39.78 3ijo s ILE 113 CO 0.12 0.51 -0.03 -0.32 0.00 0.00 0.00 174.94 175.22 3ijo s MET 114 N 0.24 3.62 0.22 2.79 -2.45 0.51 -1.76 119.30 122.47 3ijo s MET 114 Ca -0.03 -0.53 0.10 0.00 -1.25 0.00 0.00 55.69 53.98 3ijo s MET 114 Cb -0.14 -2.98 -0.05 0.00 1.25 0.00 0.00 34.83 32.92 3ijo s MET 114 CO 0.03 0.12 -0.19 0.96 1.05 0.00 0.00 175.02 176.98 3ijo s ILE 115 N 0.70 2.17 0.29 10.11 -4.36 -0.54 -1.28 121.20 128.29 3ijo s ILE 115 Ca -0.01 -2.20 -0.29 0.00 -0.26 0.00 0.00 60.65 57.89 3ijo s ILE 115 Cb -0.14 -2.12 -0.10 0.00 1.25 0.00 0.00 42.46 41.35 3ijo s ILE 115 CO 0.02 -0.37 1.30 -0.75 0.24 0.00 0.00 174.94 175.39 3ijo s LYS 116 N -3.23 4.38 0.19 0.37 2.47 -1.26 -1.47 119.74 121.19 3ijo s LYS 116 Ca 0.24 2.16 -0.33 0.00 -1.56 0.00 0.00 55.97 56.48 3ijo s LYS 116 Cb -0.05 -3.11 -0.15 0.00 -1.46 0.00 0.00 37.83 33.07 3ijo s LYS 116 CO 0.11 -0.19 1.34 1.63 0.16 0.00 0.00 175.35 178.39 3ijo n LYS 117 N 1.34 1.64 0.00 4.03 5.02 0.81 -1.88 118.16 129.13 3ijo n LYS 117 Ca 0.02 0.59 0.00 0.00 -2.02 0.00 0.00 58.31 56.89 3ijo n LYS 117 Cb 0.42 -2.20 0.00 0.00 -0.02 0.00 0.00 35.03 33.23 3ijo n LYS 117 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3ijo n GLY 118 N 2.31 1.02 3.73 0.72 0.00 -1.26 -4.99 105.19 106.72 3ijo n GLY 118 Ca 0.14 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.74 3ijo n GLY 118 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3ijo n THR 119 N -2.00 0.50 -1.38 2.61 -1.04 -0.79 -4.84 114.28 107.34 3ijo n THR 119 Ca 0.00 -0.13 -0.38 0.00 -2.04 0.00 0.00 64.05 61.50 3ijo n THR 119 Cb 0.00 -1.98 -0.02 0.00 -1.82 0.00 0.00 70.33 66.51 3ijo n THR 119 CO 0.00 0.00 0.00 -2.65 -0.64 0.00 0.00 175.07 171.78 3ijo n PRO 120 N 3.08 3.00 -3.80 -2.82 -0.02 -1.26 -4.82 135.00 128.35 3ijo n PRO 120 Ca 0.12 -2.22 -0.13 0.00 -2.02 0.00 0.00 63.50 59.25 3ijo n PRO 120 Cb 0.36 -2.95 -0.14 0.00 -0.02 0.00 0.00 33.50 30.75 3ijo n PRO 120 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 3ijo s ILE 121 N 2.95 -0.03 0.00 4.25 -1.09 -1.26 -5.03 121.20 121.00 3ijo s ILE 121 Ca 0.57 0.10 0.00 0.00 -2.23 0.00 0.00 60.65 59.09 3ijo s ILE 121 Cb 0.15 -0.13 0.00 0.00 -1.58 0.00 0.00 42.46 40.90 3ijo s ILE 121 CO -0.05 0.04 0.01 -0.62 -1.23 0.00 0.00 174.94 173.09 3ijo n GLU 122 N 3.62 5.49 -3.72 2.79 4.71 -1.26 -4.93 120.64 127.33 3ijo n GLU 122 Ca -0.20 -0.01 -0.07 0.00 -0.01 0.00 0.00 57.16 56.87 3ijo n GLU 122 Cb 0.55 -0.42 -0.02 0.00 -1.01 0.00 0.00 31.44 30.54 3ijo n GLU 122 CO 0.00 0.00 0.00 -1.54 0.09 0.00 0.00 177.13 175.68 3ijo s SER 123 N -0.79 -0.28 0.21 1.62 1.04 -1.26 -3.29 113.70 110.96 3ijo s SER 123 Ca 0.00 -0.39 -0.06 0.00 0.48 0.00 0.00 55.95 55.98 3ijo s SER 123 Cb 0.00 0.59 0.18 0.00 0.10 0.00 0.00 66.02 66.89 3ijo s SER 123 CO 0.00 -1.06 1.69 0.00 0.98 0.00 0.00 173.24 174.85 3ijo h ALA 124 N 2.00 0.95 -0.68 5.32 0.00 -1.94 -2.24 119.26 122.67 3ijo h ALA 124 Ca -0.23 -0.29 0.09 0.00 0.00 0.00 0.00 54.91 54.47 3ijo h ALA 124 Cb 1.25 -0.22 -0.07 0.00 0.00 0.00 0.00 17.79 18.76 3ijo h ALA 124 CO 0.27 0.64 0.33 1.05 0.00 0.00 0.00 179.25 181.53 3ijo h GLU 125 N 0.89 0.55 -0.46 0.00 -0.00 -1.96 0.18 114.58 113.78 3ijo h GLU 125 Ca 0.16 -0.03 0.05 0.00 -0.00 0.00 0.00 59.36 59.54 3ijo h GLU 125 Cb 0.51 -0.12 -0.05 0.00 -0.00 0.00 0.00 28.75 29.09 3ijo h GLU 125 CO 0.03 0.36 0.18 -0.44 -0.00 0.00 0.00 179.01 179.14 3ijo h ASP 126 N 0.57 0.21 -0.47 3.06 3.45 -1.81 -0.86 116.42 120.56 3ijo h ASP 126 Ca 0.33 0.05 0.02 0.00 0.43 0.00 0.00 57.03 57.86 3ijo h ASP 126 Cb 0.34 0.02 -0.03 0.00 -0.56 0.00 0.00 39.33 39.10 3ijo h ASP 126 CO -0.26 0.16 0.29 -0.07 -1.57 0.00 0.00 179.24 177.78 3ijo h LEU 127 N 0.37 0.47 -1.23 1.55 3.38 -0.84 -2.97 115.31 116.03 3ijo h LEU 127 Ca 0.21 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 58.12 3ijo h LEU 127 Cb 0.19 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 3ijo h LEU 127 CO -0.20 0.33 -0.15 0.77 0.09 0.00 0.00 178.44 179.28 3ijo h SER 128 N 0.57 0.32 0.00 -0.43 4.64 -0.24 -2.97 113.55 115.44 3ijo h SER 128 Ca 0.19 -0.08 0.00 0.00 -0.47 0.00 0.00 61.79 61.43 3ijo h SER 128 Cb 0.00 -0.09 0.00 0.00 -0.31 0.00 0.00 62.40 62.01 3ijo h SER 128 CO -0.08 0.51 0.00 0.29 -0.87 0.00 0.00 176.83 176.67 3ijo n LYS 129 N -4.22 0.97 -4.13 4.77 5.02 -0.40 -4.91 118.16 115.26 3ijo n LYS 129 Ca -0.00 0.00 -0.12 0.00 -2.02 0.00 0.00 58.31 56.16 3ijo n LYS 129 Cb 0.31 -1.34 -0.08 0.00 -0.02 0.00 0.00 35.03 33.91 3ijo n LYS 129 CO 0.00 0.00 0.00 1.14 -0.52 0.00 0.00 177.40 178.02 3ijo s GLN 130 N -2.00 1.46 0.00 1.97 1.03 -1.12 -5.08 119.66 115.92 3ijo s GLN 130 Ca 0.31 -1.58 0.00 0.00 0.04 0.00 0.00 55.36 54.14 3ijo s GLN 130 Cb 0.14 0.36 0.00 0.00 0.03 0.00 0.00 33.01 33.54 3ijo s GLN 130 CO 0.24 -0.55 0.00 0.25 -2.54 0.00 0.00 175.29 172.70 3ijo n THR 131 N -0.38 0.00 0.06 3.63 -2.24 -1.26 -4.80 114.28 109.29 3ijo n THR 131 Ca 0.01 -0.05 0.02 0.00 -2.27 0.00 0.00 64.05 61.76 3ijo n THR 131 Cb 0.64 0.45 0.37 0.00 -2.10 0.00 0.00 70.33 69.69 3ijo n THR 131 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 3ijo h GLU 132 N 0.00 0.38 -4.77 -0.78 3.07 -1.97 -3.39 114.58 107.12 3ijo h GLU 132 Ca 0.00 -0.07 -0.68 0.00 -0.50 0.00 0.00 59.36 58.11 3ijo h GLU 132 Cb 0.00 -0.06 -0.26 0.00 -0.84 0.00 0.00 28.75 27.59 3ijo h GLU 132 CO 0.00 0.42 -0.61 0.42 -1.40 0.00 0.00 179.01 177.84 3ijo s ILE 133 N -4.95 4.01 0.54 3.13 1.01 -1.26 -4.88 121.20 118.79 3ijo s ILE 133 Ca -0.07 -0.75 -0.17 0.00 0.00 0.00 0.00 60.65 59.66 3ijo s ILE 133 Cb 0.16 -3.11 -0.06 0.00 0.01 0.00 0.00 42.46 39.46 3ijo s ILE 133 CO 0.74 0.02 1.02 0.00 0.00 0.00 0.00 174.94 176.72 3ijo s ALA 134 N 1.49 2.92 -0.00 9.38 0.00 -0.14 -4.85 121.76 130.57 3ijo s ALA 134 Ca 0.02 0.32 -0.18 0.00 0.00 0.00 0.00 51.96 52.12 3ijo s ALA 134 Cb -0.18 -3.18 0.03 0.00 0.00 0.00 0.00 23.12 19.80 3ijo s ALA 134 CO 0.03 -0.45 0.39 1.52 0.00 0.00 0.00 175.76 177.25 3ijo s TYR 135 N -2.47 -0.27 0.08 0.00 1.13 -1.26 -0.48 117.35 114.07 3ijo s TYR 135 Ca 0.62 0.37 -0.03 0.00 -1.41 0.00 0.00 57.07 56.62 3ijo s TYR 135 Cb -0.13 0.17 0.01 0.00 -1.10 0.00 0.00 41.96 40.92 3ijo s TYR 135 CO 0.31 -0.48 0.15 0.41 -2.51 0.00 0.00 175.55 173.44 3ijo n GLY 136 N 0.98 1.86 3.28 5.49 0.00 -1.14 -4.82 105.19 110.84 3ijo n GLY 136 Ca -0.20 -1.08 -0.18 0.00 0.00 0.00 0.00 46.02 44.56 3ijo n GLY 136 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3ijo s THR 137 N -2.81 0.00 0.40 2.61 -4.23 -1.24 -1.07 115.64 109.31 3ijo s THR 137 Ca 0.03 -1.98 -0.24 0.00 -1.18 0.00 0.00 61.69 58.32 3ijo s THR 137 Cb -0.01 -2.51 -0.09 0.00 1.34 0.00 0.00 72.50 71.24 3ijo s THR 137 CO 0.02 0.00 1.10 -0.22 -0.54 0.00 0.00 174.62 174.98 3ijo s LEU 138 N -3.32 4.16 0.42 4.79 2.96 -1.26 -2.27 118.68 124.16 3ijo s LEU 138 Ca 0.40 2.17 -0.22 0.00 -0.22 0.00 0.00 54.13 56.26 3ijo s LEU 138 Cb 0.03 -4.12 -0.10 0.00 0.50 0.00 0.00 46.19 42.50 3ijo s LEU 138 CO 0.24 -0.59 0.99 -1.81 -1.32 0.00 0.00 176.35 173.86 3ijo s ASP 139 N -1.38 6.82 -1.67 3.68 -0.00 -0.19 -4.18 116.67 119.75 3ijo s ASP 139 Ca 0.58 1.83 -0.01 0.00 -0.00 0.00 0.00 52.55 54.95 3ijo s ASP 139 Cb -0.26 -2.56 0.00 0.00 -0.00 0.00 0.00 42.92 40.10 3ijo s ASP 139 CO 0.32 -0.45 0.09 -1.20 -0.00 0.00 0.00 175.17 173.94 3ijo n SER 140 N -0.45 -5.70 -4.14 0.27 7.64 -1.26 -4.82 113.62 105.15 3ijo n SER 140 Ca 0.06 -0.04 -0.27 0.00 1.01 0.00 0.00 58.87 59.63 3ijo n SER 140 Cb 0.52 -4.73 -0.08 0.00 -1.01 0.00 0.00 64.21 58.91 3ijo n SER 140 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 3ijo s GLY 141 N -2.15 2.77 0.39 0.23 0.00 -1.26 -2.52 107.32 104.79 3ijo s GLY 141 Ca 0.05 -0.98 0.21 0.00 0.00 0.00 0.00 44.72 43.99 3ijo s GLY 141 CO 0.06 -1.89 1.63 1.48 0.00 0.00 0.00 173.10 174.37 3ijo h SER 142 N 1.66 0.00 -0.13 1.64 4.64 -1.91 -3.17 113.55 116.28 3ijo h SER 142 Ca -0.35 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 60.91 3ijo h SER 142 Cb 1.28 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.37 3ijo h SER 142 CO 0.57 0.25 -0.15 0.74 -0.87 0.00 0.00 176.83 177.38 3ijo h THR 143 N 0.00 1.36 -0.41 2.95 2.02 -1.96 -1.24 112.91 115.62 3ijo h THR 143 Ca -0.00 -1.33 0.07 0.00 0.77 0.00 0.00 66.41 65.93 3ijo h THR 143 Cb 1.05 1.93 -0.07 0.00 -1.74 0.00 0.00 68.15 69.33 3ijo h THR 143 CO 0.03 0.39 0.01 0.50 0.37 0.00 0.00 175.52 176.82 3ijo h LYS 144 N -0.06 0.11 -0.90 6.66 3.64 -1.73 -2.09 116.57 122.20 3ijo h LYS 144 Ca 0.02 -0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.38 3ijo h LYS 144 Cb 0.68 -0.03 -0.04 0.00 -0.41 0.00 0.00 32.23 32.43 3ijo h LYS 144 CO 0.04 0.08 0.53 0.93 -2.27 0.00 0.00 179.45 178.75 3ijo h GLU 145 N 0.12 1.23 -0.52 1.90 4.39 -1.50 -1.08 114.58 119.12 3ijo h GLU 145 Ca 0.20 -0.12 0.08 0.00 0.34 0.00 0.00 59.36 59.87 3ijo h GLU 145 Cb 0.28 -0.25 -0.10 0.00 -0.10 0.00 0.00 28.75 28.58 3ijo h GLU 145 CO -0.33 0.87 -0.41 0.35 -1.16 0.00 0.00 179.01 178.33 3ijo h PHE 146 N 1.25 -1.19 -0.31 4.33 3.57 -0.52 -0.83 116.94 123.24 3ijo h PHE 146 Ca 0.32 0.08 -0.13 0.00 3.53 0.00 0.00 57.97 61.77 3ijo h PHE 146 Cb -0.03 0.59 -0.00 0.00 2.79 0.00 0.00 35.95 39.30 3ijo h PHE 146 CO 0.01 -0.42 -0.30 0.74 -2.23 0.00 0.00 178.31 176.11 3ijo h PHE 147 N -0.25 0.89 -0.87 0.41 0.04 -1.14 -2.02 116.94 114.01 3ijo h PHE 147 Ca 0.18 -0.27 0.11 0.00 2.80 0.00 0.00 57.97 60.79 3ijo h PHE 147 Cb 0.57 -0.19 -0.06 0.00 2.20 0.00 0.00 35.95 38.46 3ijo h PHE 147 CO -0.66 1.03 0.56 -0.09 -0.60 0.00 0.00 178.31 178.55 3ijo h ARG 148 N 0.51 0.78 -0.25 1.51 2.43 -0.90 -2.55 114.38 115.90 3ijo h ARG 148 Ca 0.05 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 3ijo h ARG 148 Cb 0.87 -0.18 0.00 0.00 -0.42 0.00 0.00 29.97 30.24 3ijo h ARG 148 CO 0.07 0.51 0.00 0.54 -1.51 0.00 0.00 179.97 179.59 3ijo n ARG 149 N -4.54 2.38 -2.37 0.20 1.74 -0.34 -4.99 116.66 108.74 3ijo n ARG 149 Ca 0.16 -2.12 -0.42 0.00 -0.77 0.00 0.00 57.85 54.70 3ijo n ARG 149 Cb 0.36 -1.48 -0.03 0.00 -1.02 0.00 0.00 32.46 30.29 3ijo n ARG 149 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 3ijo s SER 150 N -1.63 7.04 0.03 0.55 0.15 -0.77 -4.91 113.70 114.16 3ijo s SER 150 Ca 0.34 2.14 0.23 0.00 0.70 0.00 0.00 55.95 59.36 3ijo s SER 150 Cb 0.21 -2.59 0.15 0.00 -1.71 0.00 0.00 66.02 62.08 3ijo s SER 150 CO 0.30 -0.46 1.13 0.29 1.20 0.00 0.00 173.24 175.70 3ijo n LYS 151 N 3.44 0.16 -2.15 5.44 4.76 -1.26 -4.46 118.16 124.10 3ijo n LYS 151 Ca 0.08 0.00 -0.41 0.00 -2.87 0.00 0.00 58.31 55.11 3ijo n LYS 151 Cb 0.45 -1.56 -0.03 0.00 -1.84 0.00 0.00 35.03 32.06 3ijo n LYS 151 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 3ijo s ILE 152 N -3.11 2.97 0.14 -0.18 -1.09 -1.26 -4.86 121.20 113.80 3ijo s ILE 152 Ca 0.07 0.84 -0.30 0.00 -2.23 0.00 0.00 60.65 59.02 3ijo s ILE 152 Cb 0.15 -3.53 -0.05 0.00 -1.58 0.00 0.00 42.46 37.45 3ijo s ILE 152 CO 0.78 0.15 1.57 0.00 -1.23 0.00 0.00 174.94 176.20 3ijo h ALA 153 N 4.82 -0.61 -0.28 9.38 0.00 -1.99 0.33 119.26 130.90 3ijo h ALA 153 Ca -0.46 0.02 0.01 0.00 0.00 0.00 0.00 54.91 54.48 3ijo h ALA 153 Cb 1.22 0.95 -0.02 0.00 0.00 0.00 0.00 17.79 19.94 3ijo h ALA 153 CO 0.75 -0.95 0.17 0.28 0.00 0.00 0.00 179.25 179.49 3ijo h VAL 154 N -0.41 1.04 -0.24 0.00 2.07 -1.99 -2.64 116.25 114.08 3ijo h VAL 154 Ca 0.10 -0.12 -0.15 0.00 0.82 0.00 0.00 66.70 67.35 3ijo h VAL 154 Cb 0.61 0.66 -0.01 0.00 -1.52 0.00 0.00 31.29 31.03 3ijo h VAL 154 CO -0.53 0.06 -0.46 -0.26 0.02 0.00 0.00 177.57 176.41 3ijo h PHE 155 N 0.35 0.73 -0.50 1.57 0.04 -1.89 -2.23 116.94 115.02 3ijo h PHE 155 Ca 0.11 -0.23 -0.01 0.00 2.80 0.00 0.00 57.97 60.64 3ijo h PHE 155 Cb -0.01 -0.15 -0.02 0.00 2.20 0.00 0.00 35.95 37.97 3ijo h PHE 155 CO -0.07 0.95 0.26 0.22 -0.60 0.00 0.00 178.31 179.07 3ijo h ASP 156 N 0.49 0.63 -0.62 2.17 3.58 -0.83 0.15 116.42 121.99 3ijo h ASP 156 Ca 0.03 -0.11 -0.02 0.00 0.42 0.00 0.00 57.03 57.35 3ijo h ASP 156 Cb 0.98 -0.16 -0.03 0.00 1.72 0.00 0.00 39.33 41.84 3ijo h ASP 156 CO 0.09 0.56 0.31 0.11 -2.88 0.00 0.00 179.24 177.43 3ijo h LYS 157 N 0.66 0.91 -0.48 0.28 1.79 -1.39 0.49 116.57 118.83 3ijo h LYS 157 Ca 0.17 -0.12 -0.10 0.00 -2.18 0.00 0.00 60.65 58.43 3ijo h LYS 157 Cb 0.08 -0.17 -0.02 0.00 -1.58 0.00 0.00 32.23 30.54 3ijo h LYS 157 CO -0.03 0.71 -0.08 0.52 -1.08 0.00 0.00 179.45 179.50 3ijo h MET 158 N 0.91 0.89 -0.49 3.15 2.86 -0.74 -2.08 114.93 119.44 3ijo h MET 158 Ca 0.22 -0.32 -0.07 0.00 -2.06 0.00 0.00 59.70 57.47 3ijo h MET 158 Cb 0.09 -0.06 -0.02 0.00 0.06 0.00 0.00 31.60 31.68 3ijo h MET 158 CO -0.03 0.97 0.02 2.35 1.06 0.00 0.00 176.91 181.27 3ijo h TRP 159 N 0.74 0.92 -0.83 -0.22 2.91 -0.21 0.33 115.95 119.58 3ijo h TRP 159 Ca 0.13 -0.15 0.05 0.00 1.13 0.00 0.00 58.89 60.04 3ijo h TRP 159 Cb 0.61 -0.24 -0.06 0.00 -0.51 0.00 0.00 29.16 28.97 3ijo h TRP 159 CO 0.05 0.87 0.52 1.15 -1.03 0.00 0.00 178.44 179.99 3ijo h THR 160 N 0.71 1.08 -0.23 2.65 2.02 -0.83 0.63 112.91 118.94 3ijo h THR 160 Ca 0.14 -0.34 -0.04 0.00 0.77 0.00 0.00 66.41 66.95 3ijo h THR 160 Cb 0.49 0.01 -0.01 0.00 -1.74 0.00 0.00 68.15 66.90 3ijo h THR 160 CO 0.02 0.18 0.01 0.22 0.37 0.00 0.00 175.52 176.32 3ijo h TYR 161 N 0.98 0.43 -0.18 3.16 3.20 -1.07 -3.28 116.97 120.21 3ijo h TYR 161 Ca 0.35 -0.07 -0.03 0.00 3.14 0.00 0.00 58.73 62.12 3ijo h TYR 161 Cb 0.10 -0.11 -0.01 0.00 1.54 0.00 0.00 36.73 38.25 3ijo h TYR 161 CO -0.03 0.57 0.01 0.52 -1.64 0.00 0.00 178.16 177.59 3ijo h MET 162 N 0.17 0.31 0.00 1.82 2.86 -0.14 -1.12 114.93 118.84 3ijo h MET 162 Ca 0.07 -0.10 0.00 0.00 -2.06 0.00 0.00 59.70 57.61 3ijo h MET 162 Cb 0.39 -0.03 0.00 0.00 0.06 0.00 0.00 31.60 32.02 3ijo h MET 162 CO 0.01 0.51 0.00 0.07 1.06 0.00 0.00 176.91 178.56 3ijo h ARG 163 N 0.07 0.00 0.00 1.72 0.11 -1.02 -2.91 114.38 112.35 3ijo h ARG 163 Ca 0.05 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.13 3ijo h ARG 163 Cb 0.37 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.45 3ijo h ARG 163 CO 0.01 0.00 -0.32 0.43 0.10 0.00 0.00 179.97 180.19 3ijo n SER 164 N -2.86 0.39 -4.72 0.08 7.64 -1.09 -5.04 113.62 108.02 3ijo n SER 164 Ca -0.02 -0.62 -0.38 0.00 1.01 0.00 0.00 58.87 58.85 3ijo n SER 164 Cb 0.11 1.01 0.05 0.00 -1.01 0.00 0.00 64.21 64.36 3ijo n SER 164 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3ijo n ALA 165 N -1.16 1.35 -3.70 -0.43 0.00 -0.44 -5.03 120.51 111.08 3ijo n ALA 165 Ca 0.01 0.11 -0.13 0.00 0.00 0.00 0.00 53.44 53.43 3ijo n ALA 165 Cb 0.10 -2.32 -0.13 0.00 0.00 0.00 0.00 19.45 17.10 3ijo n ALA 165 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 3ijo s GLU 166 N -2.90 0.19 0.69 0.00 0.41 -1.26 -3.81 118.70 112.01 3ijo s GLU 166 Ca 0.73 0.61 -0.14 0.00 -0.41 0.00 0.00 54.97 55.76 3ijo s GLU 166 Cb -0.42 -0.09 0.02 0.00 -1.78 0.00 0.00 34.13 31.85 3ijo s GLU 166 CO 0.48 -0.21 1.12 -2.14 -0.49 0.00 0.00 175.26 174.02 3ijo s PRO 167 N 1.68 2.60 0.44 0.39 0.02 -1.26 -5.09 135.00 133.78 3ijo s PRO 167 Ca -0.05 1.41 -0.21 0.00 0.02 0.00 0.00 61.00 62.16 3ijo s PRO 167 Cb -0.11 -1.92 -0.13 0.00 0.02 0.00 0.00 34.50 32.36 3ijo s PRO 167 CO -0.09 -1.41 0.41 0.45 -0.33 0.00 0.00 177.00 176.04 3ijo n SER 168 N -2.64 -1.46 -0.72 2.53 2.88 -1.25 -4.89 113.62 108.06 3ijo n SER 168 Ca 0.11 0.86 0.08 0.00 -1.33 0.00 0.00 58.87 58.58 3ijo n SER 168 Cb 0.52 -1.06 0.12 0.00 -0.75 0.00 0.00 64.21 63.04 3ijo n SER 168 CO 0.00 0.00 0.00 1.33 -1.23 0.00 0.00 175.04 175.14 3ijo n VAL 169 N -1.01 0.32 -3.40 2.46 0.24 -1.26 -4.98 118.33 110.69 3ijo n VAL 169 Ca 0.11 -0.66 -0.32 0.00 -2.04 0.00 0.00 64.34 61.43 3ijo n VAL 169 Cb 0.41 1.06 -0.05 0.00 -1.47 0.00 0.00 33.84 33.79 3ijo n VAL 169 CO 0.00 0.00 0.00 -0.36 -2.14 0.00 0.00 176.83 174.33 3ijo s PHE 170 N -1.22 3.42 0.14 6.34 0.08 -1.26 -3.59 117.98 121.90 3ijo s PHE 170 Ca 0.23 0.89 0.07 0.00 0.12 0.00 0.00 56.93 58.25 3ijo s PHE 170 Cb 0.14 -2.27 -0.04 0.00 -0.57 0.00 0.00 43.02 40.28 3ijo s PHE 170 CO 0.21 0.26 -0.17 0.14 -0.10 0.00 0.00 175.22 175.56 3ijo s VAL 171 N -1.83 1.60 -0.16 -0.44 -7.23 -0.96 -4.96 120.40 106.42 3ijo s VAL 171 Ca 0.48 -1.80 0.16 0.00 -1.81 0.00 0.00 61.98 59.00 3ijo s VAL 171 Cb -0.11 -1.69 0.03 0.00 0.56 0.00 0.00 36.38 35.17 3ijo s VAL 171 CO 0.21 -0.34 1.30 0.08 -0.31 0.00 0.00 175.10 176.04 3ijo h ARG 172 N 3.43 0.00 -3.57 4.82 -0.00 -1.93 -0.47 114.38 116.65 3ijo h ARG 172 Ca -0.41 0.00 -0.09 0.00 -0.00 0.00 0.00 59.98 59.48 3ijo h ARG 172 Cb 1.20 0.00 -0.15 0.00 -0.00 0.00 0.00 29.97 31.02 3ijo h ARG 172 CO 0.50 0.42 -0.29 0.95 -0.00 0.00 0.00 179.97 181.55 3ijo s THR 173 N -2.98 0.11 0.25 0.08 -4.23 -1.26 -4.72 115.64 102.89 3ijo s THR 173 Ca 0.02 -0.90 -0.05 0.00 -1.18 0.00 0.00 61.69 59.57 3ijo s THR 173 Cb 0.08 -1.14 0.25 0.00 1.34 0.00 0.00 72.50 73.02 3ijo s THR 173 CO 0.76 -0.50 1.91 0.74 -0.54 0.00 0.00 174.62 176.99 3ijo h THR 174 N 2.91 1.19 -0.84 3.99 2.02 -1.96 -1.34 112.91 118.89 3ijo h THR 174 Ca -0.33 -0.43 0.08 0.00 0.77 0.00 0.00 66.41 66.50 3ijo h THR 174 Cb 1.21 -0.17 -0.06 0.00 -1.74 0.00 0.00 68.15 67.39 3ijo h THR 174 CO 0.51 0.23 0.55 0.00 0.37 0.00 0.00 175.52 177.17 3ijo h ALA 175 N 1.38 1.64 -0.17 6.16 0.00 -1.97 0.48 119.26 126.78 3ijo h ALA 175 Ca 0.38 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.24 3ijo h ALA 175 Cb -0.04 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.52 3ijo h ALA 175 CO -0.11 0.21 -0.02 1.49 0.00 0.00 0.00 179.25 180.83 3ijo h GLU 176 N 0.87 0.32 -0.58 0.00 4.81 -1.68 -0.93 114.58 117.40 3ijo h GLU 176 Ca 0.38 -0.11 0.09 0.00 -0.13 0.00 0.00 59.36 59.58 3ijo h GLU 176 Cb 0.32 -0.02 -0.07 0.00 0.63 0.00 0.00 28.75 29.60 3ijo h GLU 176 CO -0.14 0.56 0.19 0.78 -0.73 0.00 0.00 179.01 179.67 3ijo h GLY 177 N 0.05 0.78 0.97 1.92 0.00 -0.63 -1.10 103.07 105.06 3ijo h GLY 177 Ca 0.05 -0.09 -0.13 0.00 0.00 0.00 0.00 47.33 47.16 3ijo h GLY 177 CO 0.01 -0.04 -0.36 -2.08 0.00 0.00 0.00 176.54 174.07 3ijo h VAL 178 N 0.35 1.31 -0.34 4.60 2.07 -0.83 -1.66 116.25 121.75 3ijo h VAL 178 Ca 0.29 -1.56 -0.01 0.00 0.82 0.00 0.00 66.70 66.24 3ijo h VAL 178 Cb 0.37 1.72 -0.02 0.00 -1.52 0.00 0.00 31.29 31.85 3ijo h VAL 178 CO -0.32 0.49 0.18 0.00 0.02 0.00 0.00 177.57 177.95 3ijo h ALA 179 N 0.65 1.68 -0.27 1.67 0.00 -1.01 -1.87 119.26 120.12 3ijo h ALA 179 Ca 0.02 -0.06 -0.10 0.00 0.00 0.00 0.00 54.91 54.78 3ijo h ALA 179 Cb 0.95 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.60 3ijo h ALA 179 CO 0.08 0.27 -0.23 -0.09 0.00 0.00 0.00 179.25 179.29 3ijo h ARG 180 N 0.47 0.63 -0.23 0.00 2.43 -0.70 -1.99 114.38 114.98 3ijo h ARG 180 Ca 0.12 -0.31 0.05 0.00 -0.81 0.00 0.00 59.98 59.02 3ijo h ARG 180 Cb 0.02 0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 29.53 3ijo h ARG 180 CO -0.02 0.91 -0.06 0.28 -1.51 0.00 0.00 179.97 179.57 3ijo h VAL 181 N 0.35 0.76 -0.02 0.20 2.07 -1.08 -2.51 116.25 116.02 3ijo h VAL 181 Ca 0.05 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.53 3ijo h VAL 181 Cb 0.78 0.76 -0.01 0.00 -1.52 0.00 0.00 31.29 31.30 3ijo h VAL 181 CO 0.06 0.00 -0.19 0.03 0.02 0.00 0.00 177.57 177.49 3ijo h ARG 182 N -0.01 0.03 -0.30 1.57 3.08 -1.12 -2.93 114.38 114.69 3ijo h ARG 182 Ca 0.11 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.15 3ijo h ARG 182 Cb 0.18 -0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.22 3ijo h ARG 182 CO -0.24 0.22 0.00 1.63 -1.07 0.00 0.00 179.97 180.51 3ijo n LYS 183 N -4.30 2.17 -0.38 0.04 5.02 -0.77 -4.43 118.16 115.51 3ijo n LYS 183 Ca -0.02 -2.00 0.11 0.00 -2.02 0.00 0.00 58.31 54.38 3ijo n LYS 183 Cb 0.26 -1.39 0.31 0.00 -0.02 0.00 0.00 35.03 34.19 3ijo n LYS 183 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 3ijo n SER 184 N 1.08 3.82 -3.69 4.39 7.64 -0.95 -4.94 113.62 120.97 3ijo n SER 184 Ca 0.15 -2.05 -0.28 0.00 1.01 0.00 0.00 58.87 57.70 3ijo n SER 184 Cb 0.49 -0.48 0.00 0.00 -1.01 0.00 0.00 64.21 63.22 3ijo n SER 184 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 3ijo n LYS 185 N 1.48 -4.09 -0.46 1.43 5.02 -1.26 -0.82 118.16 119.46 3ijo n LYS 185 Ca 0.23 0.52 0.00 0.00 -2.02 0.00 0.00 58.31 57.04 3ijo n LYS 185 Cb 0.62 -5.30 0.00 0.00 -0.02 0.00 0.00 35.03 30.33 3ijo n LYS 185 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3ijo n GLY 186 N -1.39 1.03 0.47 0.72 0.00 -1.26 -4.91 105.19 99.84 3ijo n GLY 186 Ca 0.02 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.16 3ijo n GLY 186 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3ijo n LYS 187 N -2.00 1.62 -4.02 1.61 4.76 -0.00 -4.76 118.16 115.38 3ijo n LYS 187 Ca 0.00 -0.93 -0.19 0.00 -2.87 0.00 0.00 58.31 54.33 3ijo n LYS 187 Cb 0.00 -1.42 -0.16 0.00 -1.84 0.00 0.00 35.03 31.61 3ijo n LYS 187 CO 0.00 0.00 0.00 -0.47 -1.37 0.00 0.00 177.40 175.56 3ijo s TYR 188 N -1.88 0.51 -0.02 2.13 5.04 -1.26 -0.96 117.35 120.91 3ijo s TYR 188 Ca 0.34 -0.09 0.03 0.00 -2.44 0.00 0.00 57.07 54.91 3ijo s TYR 188 Cb 0.18 -0.54 -0.03 0.00 0.35 0.00 0.00 41.96 41.93 3ijo s TYR 188 CO 0.29 -0.17 -0.10 0.00 -1.34 0.00 0.00 175.55 174.23 3ijo s ALA 189 N 1.03 2.87 -0.13 3.97 0.00 0.36 -4.54 121.76 125.32 3ijo s ALA 189 Ca -0.10 -1.00 -0.01 0.00 0.00 0.00 0.00 51.96 50.86 3ijo s ALA 189 Cb -0.14 -1.06 -0.02 0.00 0.00 0.00 0.00 23.12 21.90 3ijo s ALA 189 CO -0.01 0.59 -0.10 -0.47 0.00 0.00 0.00 175.76 175.76 3ijo s TYR 190 N -0.88 2.86 -0.38 0.00 5.04 -0.41 -2.91 117.35 120.68 3ijo s TYR 190 Ca 0.14 -0.48 -0.14 0.00 -2.44 0.00 0.00 57.07 54.15 3ijo s TYR 190 Cb -0.11 -1.85 0.01 0.00 0.35 0.00 0.00 41.96 40.36 3ijo s TYR 190 CO 0.04 -0.10 0.28 -0.51 -1.34 0.00 0.00 175.55 173.91 3ijo s LEU 191 N 0.19 4.88 0.22 6.97 1.43 -0.23 -0.36 118.68 131.79 3ijo s LEU 191 Ca -0.06 -0.72 -0.12 0.00 -1.03 0.00 0.00 54.13 52.20 3ijo s LEU 191 Cb -0.15 -2.15 -0.00 0.00 0.03 0.00 0.00 46.19 43.92 3ijo s LEU 191 CO 0.04 -0.37 0.43 -1.48 0.23 0.00 0.00 176.35 175.21 3ijo s LEU 192 N 1.70 0.45 0.26 1.79 2.34 -0.47 -4.32 118.68 120.43 3ijo s LEU 192 Ca 0.05 -0.89 -0.30 0.00 0.06 0.00 0.00 54.13 53.05 3ijo s LEU 192 Cb -0.18 1.64 -0.10 0.00 -0.56 0.00 0.00 46.19 46.99 3ijo s LEU 192 CO 0.10 -1.07 1.31 -1.61 -1.06 0.00 0.00 176.35 174.02 3ijo s GLU 193 N -4.00 4.38 0.37 1.48 2.02 -1.26 -0.48 118.70 121.21 3ijo s GLU 193 Ca 0.21 2.13 0.14 0.00 0.02 0.00 0.00 54.97 57.48 3ijo s GLU 193 Cb 0.00 -3.14 0.99 0.00 0.10 0.00 0.00 34.13 32.09 3ijo s GLU 193 CO 0.06 -0.22 1.78 0.66 0.02 0.00 0.00 175.26 177.57 3ijo h SER 194 N 4.48 0.54 -0.38 -0.19 4.64 -0.55 -0.87 113.55 121.23 3ijo h SER 194 Ca -0.47 0.08 0.04 0.00 -0.47 0.00 0.00 61.79 60.98 3ijo h SER 194 Cb 1.22 -0.01 -0.04 0.00 -0.31 0.00 0.00 62.40 63.26 3ijo h SER 194 CO 0.72 0.15 0.15 0.71 -0.87 0.00 0.00 176.83 177.69 3ijo h THR 195 N 0.50 0.92 -0.20 2.95 1.35 -1.86 0.11 112.91 116.68 3ijo h THR 195 Ca 0.57 -0.11 -0.19 0.00 -0.55 0.00 0.00 66.41 66.14 3ijo h THR 195 Cb 1.27 0.57 0.00 0.00 -1.73 0.00 0.00 68.15 68.26 3ijo h THR 195 CO -0.31 0.06 -0.63 0.24 -0.25 0.00 0.00 175.52 174.63 3ijo h MET 196 N 0.32 0.71 -0.34 4.72 2.86 -1.55 -2.47 114.93 119.18 3ijo h MET 196 Ca 0.17 -0.49 0.01 0.00 -2.06 0.00 0.00 59.70 57.32 3ijo h MET 196 Cb 0.13 0.08 -0.02 0.00 0.06 0.00 0.00 31.60 31.84 3ijo h MET 196 CO -0.16 1.11 0.22 -0.97 1.06 0.00 0.00 176.91 178.18 3ijo h ASN 197 N 0.52 0.37 -0.00 1.22 -0.73 -0.93 -1.82 115.58 114.20 3ijo h ASN 197 Ca -0.01 -0.01 -0.10 0.00 1.87 0.00 0.00 56.30 58.05 3ijo h ASN 197 Cb 1.22 -0.09 -0.01 0.00 0.27 0.00 0.00 38.32 39.71 3ijo h ASN 197 CO 0.13 0.27 -0.31 -0.33 -0.37 0.00 0.00 177.43 176.82 3ijo h GLU 198 N 0.44 0.45 0.56 6.67 5.08 -0.79 -1.61 114.58 125.38 3ijo h GLU 198 Ca 0.13 -0.19 -0.03 0.00 -1.00 0.00 0.00 59.36 58.27 3ijo h GLU 198 Cb -0.04 -0.02 0.01 0.00 0.50 0.00 0.00 28.75 29.20 3ijo h GLU 198 CO -0.04 0.71 -0.27 -0.92 -1.00 0.00 0.00 179.01 177.50 3ijo h TYR 199 N 0.39 -0.69 -0.91 4.33 3.20 -1.16 -3.16 116.97 118.96 3ijo h TYR 199 Ca 0.05 -0.02 0.09 0.00 3.14 0.00 0.00 58.73 61.99 3ijo h TYR 199 Cb 0.74 0.23 -0.06 0.00 1.54 0.00 0.00 36.73 39.17 3ijo h TYR 199 CO 0.02 -0.39 0.59 0.82 -1.64 0.00 0.00 178.16 177.56 3ijo h ILE 200 N -0.86 1.00 -0.09 1.81 1.08 -1.27 -1.37 117.51 117.81 3ijo h ILE 200 Ca -0.08 -0.33 0.02 0.00 -0.39 0.00 0.00 64.86 64.09 3ijo h ILE 200 Cb 0.62 -0.04 -0.00 0.00 -3.07 0.00 0.00 36.82 34.32 3ijo h ILE 200 CO 0.13 0.17 0.12 -0.08 -0.69 0.00 0.00 178.15 177.80 3ijo h GLU 201 N 0.96 0.00 -0.48 2.37 4.81 -1.26 -1.16 114.58 119.82 3ijo h GLU 201 Ca 0.41 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.64 3ijo h GLU 201 Cb 0.33 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.71 3ijo h GLU 201 CO -0.17 0.00 0.00 1.04 -0.73 0.00 0.00 179.01 179.15 3ijo n GLN 202 N -3.64 4.26 -5.16 1.92 1.13 -0.52 -4.82 117.38 110.54 3ijo n GLN 202 Ca -0.01 -3.06 -0.30 0.00 -1.94 0.00 0.00 57.00 51.69 3ijo n GLN 202 Cb 0.22 -2.13 -0.16 0.00 0.11 0.00 0.00 30.24 28.28 3ijo n GLN 202 CO 0.00 0.00 0.00 1.03 -1.44 0.00 0.00 177.06 176.65 3ijo s ARG 203 N -2.78 2.09 0.42 -1.09 1.81 -0.44 -0.22 118.95 118.74 3ijo s ARG 203 Ca 0.51 -0.83 -0.23 0.00 -1.72 0.00 0.00 55.73 53.45 3ijo s ARG 203 Cb 0.39 -1.91 -0.12 0.00 -0.45 0.00 0.00 34.95 32.87 3ijo s ARG 203 CO 0.14 0.44 0.76 1.63 -0.68 0.00 0.00 175.30 177.59 3ijo n LYS 204 N 2.71 0.90 -0.07 3.54 5.02 -1.26 -0.66 118.16 128.34 3ijo n LYS 204 Ca -0.16 0.32 0.02 0.00 -2.02 0.00 0.00 58.31 56.46 3ijo n LYS 204 Cb 0.52 -1.74 0.05 0.00 -0.02 0.00 0.00 35.03 33.84 3ijo n LYS 204 CO 0.00 0.00 0.00 -2.30 -0.52 0.00 0.00 177.40 174.58 3ijo n PRO 205 N 0.35 1.30 -3.55 1.97 -0.02 -1.26 -4.97 135.00 128.83 3ijo n PRO 205 Ca 0.11 -0.39 -0.19 0.00 -2.02 0.00 0.00 63.50 61.01 3ijo n PRO 205 Cb 0.39 -1.18 0.07 0.00 -0.02 0.00 0.00 33.50 32.75 3ijo n PRO 205 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3ijo n ASP 207 N -3.09 0.90 -4.76 0.00 5.75 -1.26 -5.01 116.55 109.08 3ijo n ASP 207 Ca -0.26 -0.95 -0.23 0.00 -0.01 0.00 0.00 54.79 53.35 3ijo n ASP 207 Cb 0.66 0.31 -0.06 0.00 -1.03 0.00 0.00 41.12 41.01 3ijo n ASP 207 CO 0.00 0.00 0.00 0.42 -0.11 0.00 0.00 177.20 177.51 3ijo s THR 208 N -0.56 3.23 0.06 2.12 -4.23 -1.26 -0.13 115.64 114.86 3ijo s THR 208 Ca 0.03 -1.62 -0.22 0.00 -1.18 0.00 0.00 61.69 58.70 3ijo s THR 208 Cb 0.02 -3.04 0.05 0.00 1.34 0.00 0.00 72.50 70.88 3ijo s THR 208 CO 0.06 -0.20 0.52 0.00 -0.54 0.00 0.00 174.62 174.46 3ijo s MET 209 N -3.87 1.05 -0.06 3.99 0.23 -0.54 -4.73 119.30 115.37 3ijo s MET 209 Ca 0.38 -0.27 -0.25 0.00 -1.03 0.00 0.00 55.69 54.52 3ijo s MET 209 Cb -0.04 0.48 -0.03 0.00 -1.53 0.00 0.00 34.83 33.71 3ijo s MET 209 CO 0.23 -0.39 0.78 0.21 -2.03 0.00 0.00 175.02 173.83 3ijo s LYS 210 N -2.59 4.45 0.06 3.16 2.20 -1.26 -1.47 119.74 124.29 3ijo s LYS 210 Ca -0.04 1.03 0.07 0.00 -0.36 0.00 0.00 55.97 56.67 3ijo s LYS 210 Cb -0.01 -3.46 -0.03 0.00 -1.51 0.00 0.00 37.83 32.82 3ijo s LYS 210 CO -0.03 -0.01 -0.20 0.14 -0.36 0.00 0.00 175.35 174.89 3ijo s VAL 211 N 0.99 1.64 0.00 4.02 -7.23 -0.72 -5.00 120.40 114.10 3ijo s VAL 211 Ca 0.41 -1.28 0.00 0.00 -1.81 0.00 0.00 61.98 59.31 3ijo s VAL 211 Cb -0.18 -1.45 0.00 0.00 0.56 0.00 0.00 36.38 35.31 3ijo s VAL 211 CO 0.20 0.12 0.00 0.61 -0.31 0.00 0.00 175.10 175.72 3ijo n GLY 212 N 1.65 -2.62 3.99 2.32 0.00 -1.21 -4.01 105.19 105.31 3ijo n GLY 212 Ca -0.18 -1.64 -0.19 0.00 0.00 0.00 0.00 46.02 44.00 3ijo n GLY 212 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3ijo s GLY 213 N -1.52 1.86 0.47 -0.02 0.00 -1.26 -4.95 107.32 101.91 3ijo s GLY 213 Ca 0.00 -1.57 -0.23 0.00 0.00 0.00 0.00 44.72 42.92 3ijo s GLY 213 CO 0.00 -1.29 1.22 -1.31 0.00 0.00 0.00 173.10 171.72 3ijo s ASN 214 N -4.44 6.04 0.25 1.64 0.01 -1.26 -4.79 114.94 112.38 3ijo s ASN 214 Ca 0.57 2.43 0.18 0.00 -0.71 0.00 0.00 52.86 55.34 3ijo s ASN 214 Cb -0.09 -2.61 0.06 0.00 0.41 0.00 0.00 41.25 39.01 3ijo s ASN 214 CO 0.37 -1.01 1.26 -0.07 -1.51 0.00 0.00 177.10 176.13 3ijo h LEU 215 N 2.04 0.00 -8.38 0.60 4.07 -0.98 -3.48 115.31 109.19 3ijo h LEU 215 Ca -0.50 0.00 -0.18 0.00 0.08 0.00 0.00 57.88 57.28 3ijo h LEU 215 Cb 1.26 0.00 -0.07 0.00 1.08 0.00 0.00 40.66 42.92 3ijo h LEU 215 CO 0.60 0.34 -0.11 1.51 -1.08 0.00 0.00 178.44 179.70 3ijo s ASP 216 N -6.07 0.51 -0.12 -0.43 1.47 -1.26 -4.95 116.67 105.81 3ijo s ASP 216 Ca 0.02 -1.29 -0.01 0.00 1.18 0.00 0.00 52.55 52.45 3ijo s ASP 216 Cb 0.08 0.67 0.03 0.00 -0.34 0.00 0.00 42.92 43.35 3ijo s ASP 216 CO 0.75 -1.31 -0.04 -0.44 0.68 0.00 0.00 175.17 174.82 3ijo s SER 217 N -3.15 2.28 0.00 2.11 0.01 -1.26 -4.20 113.70 109.48 3ijo s SER 217 Ca 0.26 -0.39 0.00 0.00 1.31 0.00 0.00 55.95 57.13 3ijo s SER 217 Cb -0.01 -0.75 0.00 0.00 0.21 0.00 0.00 66.02 65.47 3ijo s SER 217 CO 0.16 -0.17 0.00 2.29 0.41 0.00 0.00 173.24 175.93 3ijo n LYS 218 N 4.98 0.00 -3.60 12.44 2.85 -0.43 -5.03 118.16 129.37 3ijo n LYS 218 Ca -0.11 0.00 -0.07 0.00 -1.05 0.00 0.00 58.31 57.08 3ijo n LYS 218 Cb 0.49 0.00 -0.02 0.00 -0.65 0.00 0.00 35.03 34.85 3ijo n LYS 218 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 177.40 177.55 3ijo s GLY 219 N 0.00 -0.38 0.07 2.58 0.00 -1.26 -2.26 107.32 106.07 3ijo s GLY 219 Ca 0.00 0.60 -0.13 0.00 0.00 0.00 0.00 44.72 45.19 3ijo s GLY 219 CO 0.00 0.18 0.45 -0.19 0.00 0.00 0.00 173.10 173.54 3ijo s TYR 220 N -3.25 3.66 0.10 1.90 2.02 -0.36 -1.41 117.35 120.00 3ijo s TYR 220 Ca 0.08 0.96 0.06 0.00 -0.37 0.00 0.00 57.07 57.79 3ijo s TYR 220 Cb -0.01 -2.28 -0.03 0.00 -0.40 0.00 0.00 41.96 39.24 3ijo s TYR 220 CO -0.05 0.55 -0.15 0.20 -1.57 0.00 0.00 175.55 174.53 3ijo s GLY 221 N -1.47 0.99 0.08 0.71 0.00 -0.77 -0.56 107.32 106.29 3ijo s GLY 221 Ca 0.31 -1.15 -0.30 0.00 0.00 0.00 0.00 44.72 43.57 3ijo s GLY 221 CO 0.17 -1.19 1.02 -0.42 0.00 0.00 0.00 173.10 172.68 3ijo s ILE 222 N -1.67 4.46 0.03 0.90 1.01 -1.26 -4.53 121.20 120.13 3ijo s ILE 222 Ca 0.04 1.91 0.05 0.00 0.00 0.00 0.00 60.65 62.65 3ijo s ILE 222 Cb -0.08 -4.22 -0.03 0.00 0.01 0.00 0.00 42.46 38.14 3ijo s ILE 222 CO 0.03 0.23 -0.10 0.00 0.00 0.00 0.00 174.94 175.10 3ijo s ALA 223 N 0.45 2.91 0.10 9.38 0.00 -0.79 -0.27 121.76 133.54 3ijo s ALA 223 Ca 0.51 -1.10 0.01 0.00 0.00 0.00 0.00 51.96 51.37 3ijo s ALA 223 Cb -0.24 -1.00 -0.04 0.00 0.00 0.00 0.00 23.12 21.84 3ijo s ALA 223 CO 0.30 0.61 -0.05 0.95 0.00 0.00 0.00 175.76 177.57 3ijo s THR 224 N -1.03 0.60 0.58 0.00 -4.23 -0.05 -0.58 115.64 110.94 3ijo s THR 224 Ca 0.18 -1.92 -0.20 0.00 -1.18 0.00 0.00 61.69 58.57 3ijo s THR 224 Cb -0.11 -1.71 -0.04 0.00 1.34 0.00 0.00 72.50 71.98 3ijo s THR 224 CO 0.08 -0.84 1.25 -2.84 -0.54 0.00 0.00 174.62 171.74 3ijo s PRO 225 N -3.86 2.99 0.26 3.99 0.02 -1.26 -1.44 135.00 135.69 3ijo s PRO 225 Ca 0.13 1.96 -0.31 0.00 0.02 0.00 0.00 61.00 62.80 3ijo s PRO 225 Cb 0.06 -2.02 -0.12 0.00 0.02 0.00 0.00 34.50 32.43 3ijo s PRO 225 CO -0.04 -1.23 1.56 1.17 -0.33 0.00 0.00 177.00 178.13 3ijo n LYS 226 N -1.43 2.49 -0.91 5.54 3.00 -1.26 -0.99 118.16 124.59 3ijo n LYS 226 Ca 0.13 0.89 0.00 0.00 -0.00 0.00 0.00 58.31 59.33 3ijo n LYS 226 Cb 0.48 -2.64 0.00 0.00 0.00 0.00 0.00 35.03 32.87 3ijo n LYS 226 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 3ijo n GLY 227 N 2.49 0.49 3.78 3.14 0.00 -1.26 -4.99 105.19 108.84 3ijo n GLY 227 Ca 0.11 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.72 3ijo n GLY 227 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3ijo s SER 228 N -2.33 6.36 0.18 1.61 0.15 -0.17 -4.93 113.70 114.57 3ijo s SER 228 Ca 0.00 3.03 -0.09 0.00 0.70 0.00 0.00 55.95 59.59 3ijo s SER 228 Cb 0.00 -2.66 0.06 0.00 -1.71 0.00 0.00 66.02 61.71 3ijo s SER 228 CO 0.00 -0.87 1.64 0.77 1.20 0.00 0.00 173.24 175.98 3ijo h SER 229 N 3.20 1.05 -1.18 5.45 4.64 -1.94 -2.86 113.55 121.91 3ijo h SER 229 Ca -0.50 -0.30 0.34 0.00 -0.47 0.00 0.00 61.79 60.85 3ijo h SER 229 Cb 1.24 -0.28 -0.05 0.00 -0.31 0.00 0.00 62.40 63.00 3ijo h SER 229 CO 0.66 1.10 0.89 -0.07 -0.87 0.00 0.00 176.83 178.53 3ijo h LEU 230 N 0.97 0.00 -0.50 5.97 3.38 -1.96 -2.95 115.31 120.22 3ijo h LEU 230 Ca 0.17 0.00 0.05 0.00 0.09 0.00 0.00 57.88 58.19 3ijo h LEU 230 Cb 0.56 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.26 3ijo h LEU 230 CO 0.03 0.00 0.24 1.23 0.09 0.00 0.00 178.44 180.03 3ijo h GLY 231 N 0.00 0.69 0.88 0.83 0.00 -1.88 -1.35 103.07 102.24 3ijo h GLY 231 Ca 0.56 -0.16 -0.01 0.00 0.00 0.00 0.00 47.33 47.72 3ijo h GLY 231 CO -0.01 0.10 -0.27 -0.57 0.00 0.00 0.00 176.54 175.79 3ijo h ASN 232 N 0.47 -0.67 -0.81 0.19 -1.24 -1.73 -1.19 115.58 110.61 3ijo h ASN 232 Ca 0.22 0.04 0.02 0.00 0.71 0.00 0.00 56.30 57.29 3ijo h ASN 232 Cb 0.15 0.20 -0.04 0.00 0.73 0.00 0.00 38.32 39.35 3ijo h ASN 232 CO -0.17 -0.42 0.53 0.00 -1.29 0.00 0.00 177.43 176.08 3ijo h ALA 233 N -0.13 1.04 -0.05 1.57 0.00 -1.69 -2.48 119.26 117.52 3ijo h ALA 233 Ca -0.05 -0.04 0.01 0.00 0.00 0.00 0.00 54.91 54.83 3ijo h ALA 233 Cb 0.54 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 3ijo h ALA 233 CO 0.04 0.39 -0.01 0.28 0.00 0.00 0.00 179.25 179.96 3ijo h VAL 234 N 1.05 0.96 -0.24 0.00 2.07 -1.08 0.54 116.25 119.54 3ijo h VAL 234 Ca 0.31 -0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.88 3ijo h VAL 234 Cb -0.06 0.95 -0.06 0.00 -1.52 0.00 0.00 31.29 30.60 3ijo h VAL 234 CO -0.09 0.00 -0.17 -1.13 0.02 0.00 0.00 177.57 176.21 3ijo h ASN 235 N 0.00 -0.55 -0.35 0.57 -1.24 -0.99 -0.57 115.58 112.45 3ijo h ASN 235 Ca 0.02 0.11 -0.05 0.00 0.71 0.00 0.00 56.30 57.10 3ijo h ASN 235 Cb 0.03 0.28 -0.02 0.00 0.73 0.00 0.00 38.32 39.34 3ijo h ASN 235 CO -0.04 -0.21 0.08 -0.07 -1.29 0.00 0.00 177.43 175.89 3ijo h LEU 236 N -0.16 0.61 -0.88 0.34 3.38 -1.16 -1.51 115.31 115.93 3ijo h LEU 236 Ca 0.14 -0.10 -0.03 0.00 0.09 0.00 0.00 57.88 57.97 3ijo h LEU 236 Cb 0.36 -0.16 -0.04 0.00 0.09 0.00 0.00 40.66 40.92 3ijo h LEU 236 CO -0.34 0.63 0.41 0.00 0.09 0.00 0.00 178.44 179.23 3ijo h ALA 237 N 1.46 1.13 -0.25 1.53 0.00 -0.11 -1.09 119.26 121.92 3ijo h ALA 237 Ca 0.14 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 3ijo h ALA 237 Cb 0.28 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 3ijo h ALA 237 CO 0.00 0.66 0.07 0.28 0.00 0.00 0.00 179.25 180.26 3ijo h VAL 238 N 1.20 1.21 -0.29 0.00 2.07 -0.31 -0.86 116.25 119.28 3ijo h VAL 238 Ca 0.29 -0.68 0.05 0.00 0.82 0.00 0.00 66.70 67.18 3ijo h VAL 238 Cb 0.11 1.17 -0.04 0.00 -1.52 0.00 0.00 31.29 31.01 3ijo h VAL 238 CO -0.04 0.22 0.02 -0.07 0.02 0.00 0.00 177.57 177.72 3ijo h LEU 239 N 0.24 -0.08 -0.02 2.57 3.38 -1.15 0.04 115.31 120.29 3ijo h LEU 239 Ca 0.08 0.06 0.03 0.00 0.09 0.00 0.00 57.88 58.14 3ijo h LEU 239 Cb 0.27 0.10 -0.04 0.00 0.09 0.00 0.00 40.66 41.08 3ijo h LEU 239 CO -0.00 -0.01 -0.17 0.50 0.09 0.00 0.00 178.44 178.85 3ijo h LYS 240 N 0.11 -0.26 -0.90 1.13 1.63 -1.02 -0.58 116.57 116.67 3ijo h LYS 240 Ca 0.14 0.02 0.03 0.00 -0.85 0.00 0.00 60.65 59.98 3ijo h LYS 240 Cb 0.17 0.06 -0.05 0.00 -0.60 0.00 0.00 32.23 31.81 3ijo h LYS 240 CO -0.22 -0.17 0.59 -0.07 -3.45 0.00 0.00 179.45 176.13 3ijo h LEU 241 N -0.27 0.99 0.01 5.20 4.07 -0.87 -1.15 115.31 123.30 3ijo h LEU 241 Ca 0.06 -0.01 -0.00 0.00 0.08 0.00 0.00 57.88 58.01 3ijo h LEU 241 Cb 0.35 -0.23 0.00 0.00 1.08 0.00 0.00 40.66 41.86 3ijo h LEU 241 CO -0.18 0.69 -0.01 -1.28 -1.08 0.00 0.00 178.44 176.58 3ijo h SER 242 N 1.15 -0.01 0.34 -0.43 0.87 -0.46 -2.10 113.55 112.92 3ijo h SER 242 Ca 0.35 -0.14 -0.07 0.00 -1.23 0.00 0.00 61.79 60.70 3ijo h SER 242 Cb -0.02 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 61.93 3ijo h SER 242 CO -0.10 0.13 -0.32 -0.33 -0.53 0.00 0.00 176.83 175.68 3ijo h GLU 243 N -0.16 0.00 -0.01 2.24 5.08 -0.44 -2.20 114.58 119.10 3ijo h GLU 243 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3ijo h GLU 243 Cb 0.15 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.40 3ijo h GLU 243 CO 0.00 0.32 -0.01 1.04 -1.00 0.00 0.00 179.01 179.36 3ijo n GLN 244 N -4.10 1.36 -0.73 2.33 6.02 -0.50 -4.92 117.38 116.84 3ijo n GLN 244 Ca -0.02 -0.57 0.00 0.00 -0.01 0.00 0.00 57.00 56.40 3ijo n GLN 244 Cb 0.37 -1.49 0.00 0.00 1.02 0.00 0.00 30.24 30.14 3ijo n GLN 244 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3ijo n GLY 245 N 1.12 0.80 0.33 1.08 0.00 -0.83 -4.93 105.19 102.76 3ijo n GLY 245 Ca 0.20 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.17 3ijo n GLY 245 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3ijo h LEU 246 N 0.00 1.04 -0.79 0.99 5.85 -1.61 0.82 115.31 121.61 3ijo h LEU 246 Ca 0.00 -0.15 0.01 0.00 0.84 0.00 0.00 57.88 58.58 3ijo h LEU 246 Cb 0.00 -0.27 -0.04 0.00 0.37 0.00 0.00 40.66 40.72 3ijo h LEU 246 CO 0.00 0.90 0.52 -0.07 -0.34 0.00 0.00 178.44 179.45 3ijo h LEU 247 N 1.12 0.91 -0.54 2.25 3.38 -1.83 0.39 115.31 120.99 3ijo h LEU 247 Ca 0.27 -0.03 -0.13 0.00 0.09 0.00 0.00 57.88 58.08 3ijo h LEU 247 Cb 0.15 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.66 3ijo h LEU 247 CO -0.03 0.66 -0.22 0.44 0.09 0.00 0.00 178.44 179.38 3ijo h ASP 248 N 1.07 0.97 0.11 -0.43 3.45 -1.78 -1.45 116.42 118.37 3ijo h ASP 248 Ca 0.29 -0.37 0.02 0.00 0.43 0.00 0.00 57.03 57.40 3ijo h ASP 248 Cb -0.12 -0.27 -0.03 0.00 -0.56 0.00 0.00 39.33 38.36 3ijo h ASP 248 CO -0.06 1.14 -0.23 0.50 -1.57 0.00 0.00 179.24 179.02 3ijo h LYS 249 N 0.81 -0.41 -0.76 3.56 3.64 -0.07 -2.17 116.57 121.17 3ijo h LYS 249 Ca 0.11 0.03 0.04 0.00 -1.27 0.00 0.00 60.65 59.55 3ijo h LYS 249 Cb 0.79 0.09 -0.05 0.00 -0.41 0.00 0.00 32.23 32.65 3ijo h LYS 249 CO 0.07 -0.27 0.47 -0.07 -2.27 0.00 0.00 179.45 177.38 3ijo h LEU 250 N -0.43 0.77 -0.39 5.20 4.07 -0.06 -1.56 115.31 122.90 3ijo h LEU 250 Ca 0.03 0.00 0.01 0.00 0.08 0.00 0.00 57.88 58.00 3ijo h LEU 250 Cb 0.45 -0.16 -0.02 0.00 1.08 0.00 0.00 40.66 42.01 3ijo h LEU 250 CO -0.13 0.52 0.25 0.50 -1.08 0.00 0.00 178.44 178.50 3ijo h LYS 251 N 0.91 0.50 -0.33 1.13 1.63 -1.05 -1.59 116.57 117.77 3ijo h LYS 251 Ca 0.31 -0.03 -0.09 0.00 -0.85 0.00 0.00 60.65 59.99 3ijo h LYS 251 Cb 0.06 -0.11 -0.02 0.00 -0.60 0.00 0.00 32.23 31.56 3ijo h LYS 251 CO -0.13 0.33 -0.19 -0.91 -3.45 0.00 0.00 179.45 175.10 3ijo h ASN 252 N 0.52 0.61 -0.60 4.20 2.35 -1.10 -0.46 115.58 121.09 3ijo h ASN 252 Ca 0.15 -0.19 -0.01 0.00 -0.55 0.00 0.00 56.30 55.69 3ijo h ASN 252 Cb -0.04 -0.16 -0.03 0.00 0.05 0.00 0.00 38.32 38.14 3ijo h ASN 252 CO -0.04 0.80 0.32 0.50 -1.65 0.00 0.00 177.43 177.36 3ijo h LYS 253 N 0.54 0.84 0.00 0.81 3.64 -0.67 0.50 116.57 122.23 3ijo h LYS 253 Ca 0.09 -0.11 0.00 0.00 -1.27 0.00 0.00 60.65 59.36 3ijo h LYS 253 Cb 0.63 -0.16 0.00 0.00 -0.41 0.00 0.00 32.23 32.29 3ijo h LYS 253 CO 0.04 0.65 -1.21 0.91 -2.27 0.00 0.00 179.45 177.58 3ijo n TRP 254 N -4.56 0.30 -0.04 1.91 7.02 -0.65 -3.96 117.44 117.45 3ijo n TRP 254 Ca 0.04 0.09 -0.05 0.00 -1.02 0.00 0.00 57.50 56.56 3ijo n TRP 254 Cb 0.10 -0.50 -0.02 0.00 -2.42 0.00 0.00 31.31 28.47 3ijo n TRP 254 CO 0.00 0.00 0.00 0.91 -2.02 0.00 0.00 177.69 176.58 3ijo n TRP 255 N -2.10 0.00 -0.06 -5.99 8.01 -0.20 -4.72 117.44 112.39 3ijo n TRP 255 Ca 0.01 0.00 -0.06 0.00 -1.31 0.00 0.00 57.50 56.14 3ijo n TRP 255 Cb 0.47 -0.26 -0.15 0.00 -2.01 0.00 0.00 31.31 29.37 3ijo n TRP 255 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.69 177.34 3ijo n TYR 256 N -3.61 0.28 0.25 -5.99 4.01 -0.98 -3.29 117.16 107.82 3ijo n TYR 256 Ca -0.07 0.10 0.09 0.00 -0.16 0.00 0.00 57.90 57.86 3ijo n TYR 256 Cb 0.27 -0.98 0.63 0.00 -0.31 0.00 0.00 39.34 38.95 3ijo n TYR 256 CO 0.00 0.00 0.00 -0.44 -0.46 0.00 0.00 176.86 175.96 3ijo h ASP 257 N 0.00 0.00 0.14 7.72 3.32 -1.08 -2.82 116.42 123.69 3ijo h ASP 257 Ca -0.39 0.00 -0.24 0.00 0.02 0.00 0.00 57.03 56.42 3ijo h ASP 257 Cb 1.97 0.00 0.01 0.00 0.22 0.00 0.00 39.33 41.53 3ijo h ASP 257 CO 0.04 0.14 -0.93 0.11 -1.72 0.00 0.00 179.24 176.87 3ijo h LYS 258 N 0.00 0.57 0.00 3.56 1.79 -1.68 -3.49 116.57 117.32 3ijo h LYS 258 Ca -0.00 -0.58 0.00 0.00 -2.18 0.00 0.00 60.65 57.89 3ijo h LYS 258 Cb 0.28 0.15 0.00 0.00 -1.58 0.00 0.00 32.23 31.09 3ijo h LYS 258 CO 0.02 1.19 0.00 0.41 -1.08 0.00 0.00 179.45 179.99 3ijo n GLY 259 N 0.92 0.00 0.00 3.86 0.00 -1.07 -4.92 105.19 103.98 3ijo n GLY 259 Ca -0.08 0.00 0.05 0.00 0.00 0.00 0.00 46.02 45.99 3ijo n GLY 259 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3ijo n GLU 260 N 0.00 2.52 0.00 1.61 1.02 0.70 -5.05 120.64 121.44 3ijo n GLU 260 Ca 0.00 -0.03 0.05 0.00 -0.02 0.00 0.00 57.16 57.16 3ijo n GLU 260 Cb 0.00 -1.06 0.04 0.00 -0.02 0.00 0.00 31.44 30.40 3ijo n GLU 260 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31