#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3iob s ILE 3 N 0.00 2.92 0.80 0.00 1.01 -1.26 -4.98 121.20 119.69 3iob s ILE 3 Ca 0.00 0.73 -0.14 0.00 0.00 0.00 0.00 60.65 61.23 3iob s ILE 3 Cb 0.00 -3.46 0.04 0.00 0.01 0.00 0.00 42.46 39.05 3iob s ILE 3 CO 0.00 0.09 0.91 -2.65 0.00 0.00 0.00 174.94 173.30 3iob n PRO 4 N 2.99 0.16 -1.83 2.79 -0.02 -1.26 -4.90 135.00 132.93 3iob n PRO 4 Ca 0.09 0.12 -0.42 0.00 -2.02 0.00 0.00 63.50 61.27 3iob n PRO 4 Cb 0.41 -2.20 -0.03 0.00 -0.02 0.00 0.00 33.50 31.67 3iob n PRO 4 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3iob s ALA 5 N -2.09 3.83 -0.15 3.55 0.00 -1.26 -4.91 121.76 120.73 3iob s ALA 5 Ca 0.69 1.49 -0.00 0.00 0.00 0.00 0.00 51.96 54.14 3iob s ALA 5 Cb -0.30 -3.65 0.03 0.00 0.00 0.00 0.00 23.12 19.20 3iob s ALA 5 CO 0.55 -0.87 -0.08 0.12 0.00 0.00 0.00 175.76 175.48 3iob s PHE 6 N 0.85 1.74 -0.44 0.00 5.36 -1.26 -5.05 117.98 119.19 3iob s PHE 6 Ca 0.70 -1.01 -0.15 0.00 -0.96 0.00 0.00 56.93 55.51 3iob s PHE 6 Cb -0.47 -1.35 0.04 0.00 -0.34 0.00 0.00 43.02 40.91 3iob s PHE 6 CO 0.36 -0.60 0.34 -1.01 -1.46 0.00 0.00 175.22 172.85 3iob s HIS 7 N 1.62 3.24 0.41 10.12 3.76 -1.26 -5.07 115.29 128.12 3iob s HIS 7 Ca 0.03 -0.77 -0.27 0.00 -0.15 0.00 0.00 55.06 53.90 3iob s HIS 7 Cb -0.14 -2.84 -0.10 0.00 1.11 0.00 0.00 32.58 30.61 3iob s HIS 7 CO -0.08 -0.69 1.41 -2.30 -0.85 0.00 0.00 174.74 172.23 3iob n PRO 8 N 5.17 2.34 -0.93 8.40 -0.02 -1.26 -2.46 135.00 146.24 3iob n PRO 8 Ca -0.12 0.83 0.00 0.00 -2.02 0.00 0.00 63.50 62.19 3iob n PRO 8 Cb 0.45 -2.58 0.00 0.00 -0.02 0.00 0.00 33.50 31.36 3iob n PRO 8 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3iob n GLY 9 N 0.59 0.79 3.57 -1.23 0.00 -1.26 -5.01 105.19 102.64 3iob n GLY 9 Ca 0.04 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.82 3iob n GLY 9 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3iob s GLU 10 N -0.18 2.02 -0.33 1.61 2.02 -1.03 -5.03 118.70 117.79 3iob s GLU 10 Ca 0.00 -1.54 -0.29 0.00 0.02 0.00 0.00 54.97 53.16 3iob s GLU 10 Cb 0.00 -2.01 0.01 0.00 0.10 0.00 0.00 34.13 32.23 3iob s GLU 10 CO 0.00 0.36 1.22 -1.17 0.02 0.00 0.00 175.26 175.69 3iob s LEU 11 N -3.51 3.85 -0.31 1.80 2.96 -1.25 -4.35 118.68 117.88 3iob s LEU 11 Ca 0.30 1.05 -0.10 0.00 -0.22 0.00 0.00 54.13 55.16 3iob s LEU 11 Cb -0.06 -3.54 -0.02 0.00 0.50 0.00 0.00 46.19 43.07 3iob s LEU 11 CO 0.17 -1.05 0.17 0.20 -1.32 0.00 0.00 176.35 174.52 3iob s ASN 12 N 2.45 5.72 -0.21 3.68 0.01 0.66 -4.97 114.94 122.28 3iob s ASN 12 Ca 0.52 -0.38 -0.07 0.00 -0.71 0.00 0.00 52.86 52.21 3iob s ASN 12 Cb -0.14 -2.05 -0.04 0.00 0.41 0.00 0.00 41.25 39.43 3iob s ASN 12 CO 0.22 -0.17 0.07 -0.69 -1.51 0.00 0.00 177.10 175.03 3iob s VAL 13 N 1.67 4.65 -0.04 1.60 1.01 -1.26 -1.05 120.40 126.97 3iob s VAL 13 Ca 0.06 -0.07 0.04 0.00 0.00 0.00 0.00 61.98 62.00 3iob s VAL 13 Cb -0.17 -3.13 0.00 0.00 0.00 0.00 0.00 36.38 33.09 3iob s VAL 13 CO 0.08 0.41 -0.15 -0.31 0.00 0.00 0.00 175.10 175.13 3iob s TYR 14 N 0.85 1.51 -0.04 5.22 2.02 -0.21 -4.99 117.35 121.71 3iob s TYR 14 Ca 0.04 -0.44 0.13 0.00 -0.37 0.00 0.00 57.07 56.43 3iob s TYR 14 Cb -0.14 -1.04 -0.20 0.00 -0.40 0.00 0.00 41.96 40.19 3iob s TYR 14 CO 0.02 -0.16 0.24 0.43 -1.57 0.00 0.00 175.55 174.51 3iob n SER 15 N 3.25 1.90 -4.67 2.29 7.64 -1.26 -0.58 113.62 122.19 3iob n SER 15 Ca -0.19 0.00 -0.41 0.00 1.01 0.00 0.00 58.87 59.29 3iob n SER 15 Cb 0.53 1.43 -0.05 0.00 -1.01 0.00 0.00 64.21 65.12 3iob n SER 15 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3iob s ALA 16 N -2.80 3.50 0.25 -0.43 0.00 -1.26 -4.00 121.76 117.02 3iob s ALA 16 Ca -0.05 -0.08 -0.04 0.00 0.00 0.00 0.00 51.96 51.78 3iob s ALA 16 Cb 0.08 -3.07 0.48 0.00 0.00 0.00 0.00 23.12 20.60 3iob s ALA 16 CO 0.55 -0.52 1.70 -1.35 0.00 0.00 0.00 175.76 176.14 3iob h PRO 17 N 7.31 0.32 -0.92 0.00 0.11 -1.92 -1.73 132.00 135.17 3iob h PRO 17 Ca -0.32 -0.02 0.08 0.00 0.11 0.00 0.00 66.00 65.85 3iob h PRO 17 Cb 1.15 -0.07 -0.06 0.00 0.11 0.00 0.00 31.00 32.12 3iob h PRO 17 CO 0.80 0.21 0.59 0.78 -0.21 0.00 0.00 178.00 180.18 3iob h GLY 18 N 0.33 1.35 0.81 -0.55 0.00 -1.96 -0.92 103.07 102.13 3iob h GLY 18 Ca 0.42 -0.41 -0.00 0.00 0.00 0.00 0.00 47.33 47.34 3iob h GLY 18 CO -0.47 0.27 -0.01 -0.55 0.00 0.00 0.00 176.54 175.78 3iob h ASP 19 N 1.01 -0.03 -0.01 0.19 3.32 -1.73 -1.31 116.42 117.86 3iob h ASP 19 Ca 0.41 -0.18 -0.09 0.00 0.02 0.00 0.00 57.03 57.18 3iob h ASP 19 Cb 0.26 0.01 -0.01 0.00 0.22 0.00 0.00 39.33 39.80 3iob h ASP 19 CO -0.16 0.17 -0.24 1.62 -1.72 0.00 0.00 179.24 178.91 3iob h VAL 20 N -0.22 1.25 -0.26 -1.35 3.04 -1.31 -1.64 116.25 115.77 3iob h VAL 20 Ca -0.00 -1.20 0.02 0.00 -1.01 0.00 0.00 66.70 64.50 3iob h VAL 20 Cb 0.21 1.35 -0.02 0.00 -2.01 0.00 0.00 31.29 30.82 3iob h VAL 20 CO 0.01 0.38 0.13 0.00 -1.01 0.00 0.00 177.57 177.07 3iob h ALA 21 N 1.38 0.31 -0.53 3.17 0.00 -1.06 0.12 119.26 122.66 3iob h ALA 21 Ca 0.06 0.01 -0.11 0.00 0.00 0.00 0.00 54.91 54.86 3iob h ALA 21 Cb 0.62 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.35 3iob h ALA 21 CO 0.04 -0.27 -0.09 -0.44 0.00 0.00 0.00 179.25 178.50 3iob h ASP 22 N 0.27 0.99 -0.38 0.00 3.32 -0.95 -1.31 116.42 118.37 3iob h ASP 22 Ca 0.10 -0.35 -0.11 0.00 0.02 0.00 0.00 57.03 56.70 3iob h ASP 22 Cb 0.02 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.29 3iob h ASP 22 CO -0.07 1.11 -0.19 0.58 -1.72 0.00 0.00 179.24 178.95 3iob h VAL 23 N 0.86 1.28 -0.21 -1.35 2.07 -1.19 -1.38 116.25 116.33 3iob h VAL 23 Ca 0.14 -1.33 -0.00 0.00 0.82 0.00 0.00 66.70 66.32 3iob h VAL 23 Cb 0.66 1.32 -0.01 0.00 -1.52 0.00 0.00 31.29 31.73 3iob h VAL 23 CO 0.05 0.44 0.11 -1.28 0.02 0.00 0.00 177.57 176.91 3iob h SER 24 N 0.61 0.26 -0.22 0.57 0.87 -0.65 0.59 113.55 115.58 3iob h SER 24 Ca 0.08 -0.09 0.03 0.00 -1.23 0.00 0.00 61.79 60.59 3iob h SER 24 Cb 0.75 -0.07 -0.03 0.00 -0.44 0.00 0.00 62.40 62.61 3iob h SER 24 CO 0.06 0.27 0.06 -0.09 -0.53 0.00 0.00 176.83 176.60 3iob h ARG 25 N 0.23 0.15 -0.39 2.24 2.43 -1.21 -1.58 114.38 116.25 3iob h ARG 25 Ca 0.07 -0.01 0.04 0.00 -0.81 0.00 0.00 59.98 59.27 3iob h ARG 25 Cb 0.07 -0.03 -0.04 0.00 -0.42 0.00 0.00 29.97 29.55 3iob h ARG 25 CO -0.01 0.10 0.17 0.00 -1.51 0.00 0.00 179.97 178.72 3iob h ALA 26 N 1.15 0.48 -0.73 2.80 0.00 -1.05 -2.76 119.26 119.15 3iob h ALA 26 Ca 0.10 0.03 -0.04 0.00 0.00 0.00 0.00 54.91 55.00 3iob h ALA 26 Cb 0.09 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 3iob h ALA 26 CO -0.12 -0.20 0.30 -0.07 0.00 0.00 0.00 179.25 179.15 3iob h LEU 27 N 0.36 1.00 -1.41 0.00 3.38 -0.63 -2.69 115.31 115.32 3iob h LEU 27 Ca 0.17 -0.17 -0.03 0.00 0.09 0.00 0.00 57.88 57.95 3iob h LEU 27 Cb 0.11 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.58 3iob h LEU 27 CO -0.14 0.90 0.12 -0.09 0.09 0.00 0.00 178.44 179.31 3iob h ARG 28 N 1.05 0.51 -0.00 1.13 2.43 -1.15 -1.88 114.38 116.47 3iob h ARG 28 Ca 0.24 -0.07 -0.08 0.00 -0.81 0.00 0.00 59.98 59.26 3iob h ARG 28 Cb 0.20 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 29.65 3iob h ARG 28 CO -0.02 0.45 -0.39 -0.07 -1.51 0.00 0.00 179.97 178.43 3iob h LEU 29 N 0.51 0.00 0.00 3.80 3.38 -1.20 -2.58 115.31 119.22 3iob h LEU 29 Ca 0.12 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.09 3iob h LEU 29 Cb 0.15 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.90 3iob h LEU 29 CO -0.01 0.39 0.00 0.35 0.09 0.00 0.00 178.44 179.26 3iob n THR 30 N -4.07 0.00 -1.48 0.22 -2.24 -0.74 -4.88 114.28 101.08 3iob n THR 30 Ca -0.02 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.76 3iob n THR 30 Cb 0.42 -0.52 0.00 0.00 -2.10 0.00 0.00 70.33 68.13 3iob n THR 30 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3iob n GLY 31 N 0.88 0.97 3.88 3.38 0.00 -0.97 -5.10 105.19 108.22 3iob n GLY 31 Ca 0.22 -0.49 -0.26 0.00 0.00 0.00 0.00 46.02 45.49 3iob n GLY 31 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3iob s ARG 32 N -3.10 3.20 -0.24 1.61 1.81 -1.00 -4.94 118.95 116.29 3iob s ARG 32 Ca 0.00 -0.73 -0.07 0.00 -1.72 0.00 0.00 55.73 53.22 3iob s ARG 32 Cb 0.00 -2.82 -0.02 0.00 -0.45 0.00 0.00 34.95 31.66 3iob s ARG 32 CO 0.00 0.50 0.05 1.03 -0.68 0.00 0.00 175.30 176.20 3iob s ARG 33 N -3.21 3.59 -0.15 3.54 1.81 -0.62 -4.37 118.95 119.53 3iob s ARG 33 Ca 0.33 -0.51 -0.25 0.00 -1.72 0.00 0.00 55.73 53.58 3iob s ARG 33 Cb -0.10 -3.26 -0.02 0.00 -0.45 0.00 0.00 34.95 31.12 3iob s ARG 33 CO 0.26 -0.19 0.82 0.08 -0.68 0.00 0.00 175.30 175.59 3iob s VAL 34 N 1.59 4.90 -0.12 3.52 1.01 -1.26 -1.23 120.40 128.80 3iob s VAL 34 Ca 0.06 1.62 -0.01 0.00 0.00 0.00 0.00 61.98 63.65 3iob s VAL 34 Cb -0.15 -4.13 -0.02 0.00 0.00 0.00 0.00 36.38 32.08 3iob s VAL 34 CO 0.02 0.05 -0.09 -0.04 0.00 0.00 0.00 175.10 175.05 3iob s MET 35 N 1.98 3.27 -0.12 2.72 -1.94 -0.17 0.06 119.30 125.11 3iob s MET 35 Ca 0.38 -0.60 0.01 0.00 -1.71 0.00 0.00 55.69 53.77 3iob s MET 35 Cb -0.17 -2.70 -0.01 0.00 2.01 0.00 0.00 34.83 33.96 3iob s MET 35 CO 0.13 0.36 -0.15 -1.17 -0.01 0.00 0.00 175.02 174.18 3iob s LEU 36 N 0.01 2.59 -0.38 -0.03 2.96 -0.38 0.10 118.68 123.54 3iob s LEU 36 Ca -0.02 -0.36 0.03 0.00 -0.22 0.00 0.00 54.13 53.56 3iob s LEU 36 Cb -0.14 -1.56 0.11 0.00 0.50 0.00 0.00 46.19 45.10 3iob s LEU 36 CO 0.03 0.18 0.12 -0.69 -1.32 0.00 0.00 176.35 174.68 3iob s VAL 37 N 0.25 1.92 0.04 1.68 1.01 0.02 -1.33 120.40 123.98 3iob s VAL 37 Ca -0.10 -2.33 -0.30 0.00 0.00 0.00 0.00 61.98 59.24 3iob s VAL 37 Cb -0.16 -2.40 -0.05 0.00 0.00 0.00 0.00 36.38 33.78 3iob s VAL 37 CO 0.06 -0.69 1.12 -2.84 0.00 0.00 0.00 175.10 172.76 3iob s PRO 38 N 0.78 4.47 0.22 2.72 0.02 -1.26 -2.04 135.00 139.92 3iob s PRO 38 Ca 0.13 1.65 0.00 0.00 0.02 0.00 0.00 61.00 62.80 3iob s PRO 38 Cb -0.20 -3.39 -0.04 0.00 0.02 0.00 0.00 34.50 30.88 3iob s PRO 38 CO -0.09 -0.19 0.10 0.95 -0.33 0.00 0.00 177.00 177.44 3iob s THR 39 N 1.05 0.28 -0.22 0.99 -4.23 0.21 -4.91 115.64 108.80 3iob s THR 39 Ca 0.56 -1.99 0.14 0.00 -1.18 0.00 0.00 61.69 59.22 3iob s THR 39 Cb -0.27 -2.50 0.55 0.00 1.34 0.00 0.00 72.50 71.62 3iob s THR 39 CO 0.29 -0.06 1.47 0.23 -0.54 0.00 0.00 174.62 176.01 3iob n MET 40 N -0.34 2.74 0.00 3.99 2.81 -1.26 -1.85 117.12 123.21 3iob n MET 40 Ca 0.00 -2.95 0.00 0.00 -1.81 0.00 0.00 57.70 52.95 3iob n MET 40 Cb 0.66 -1.88 0.00 0.00 -0.71 0.00 0.00 33.22 31.29 3iob n MET 40 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3iob n GLY 41 N -0.63 0.08 3.85 3.03 0.00 -1.26 -4.68 105.19 105.57 3iob n GLY 41 Ca 0.26 -0.99 -0.32 0.00 0.00 0.00 0.00 46.02 44.98 3iob n GLY 41 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3iob n ALA 42 N 2.26 -2.36 -2.01 4.61 0.00 -1.26 -4.87 120.51 116.88 3iob n ALA 42 Ca 0.00 -0.31 -0.41 0.00 0.00 0.00 0.00 53.44 52.72 3iob n ALA 42 Cb 0.00 -2.94 -0.03 0.00 0.00 0.00 0.00 19.45 16.48 3iob n ALA 42 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3iob s LEU 43 N -6.81 4.46 0.00 0.00 1.43 -1.26 -4.91 118.68 111.59 3iob s LEU 43 Ca 0.31 2.26 0.01 0.00 -1.03 0.00 0.00 54.13 55.68 3iob s LEU 43 Cb -0.12 -3.61 -0.01 0.00 0.03 0.00 0.00 46.19 42.48 3iob s LEU 43 CO 0.89 -0.36 0.05 0.00 0.23 0.00 0.00 176.35 177.16 3iob n HIS 44 N 2.31 0.41 0.14 0.29 1.44 -1.26 -5.01 115.22 113.54 3iob n HIS 44 Ca 0.04 -1.66 0.15 0.00 -2.01 0.00 0.00 57.72 54.24 3iob n HIS 44 Cb 0.44 -0.11 0.70 0.00 0.12 0.00 0.00 29.99 31.15 3iob n HIS 44 CO 0.00 0.00 0.00 0.93 -2.81 0.00 0.00 176.34 174.46 3iob h GLU 45 N 0.00 0.00 -0.11 -1.40 4.39 -1.98 -0.19 114.58 115.29 3iob h GLU 45 Ca -0.24 0.00 0.02 0.00 0.34 0.00 0.00 59.36 59.48 3iob h GLU 45 Cb 0.80 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.44 3iob h GLU 45 CO 0.39 0.00 -0.02 0.78 -1.16 0.00 0.00 179.01 178.99 3iob h GLY 46 N 0.00 0.08 1.19 -3.84 0.00 -1.92 -0.90 103.07 97.69 3iob h GLY 46 Ca 0.12 0.03 -0.05 0.00 0.00 0.00 0.00 47.33 47.44 3iob h GLY 46 CO -0.00 -0.04 0.24 0.45 0.00 0.00 0.00 176.54 177.19 3iob h HIS 47 N 0.01 1.05 -0.11 5.60 3.86 -1.45 -2.72 115.15 121.39 3iob h HIS 47 Ca 0.05 -0.08 -0.04 0.00 -1.16 0.00 0.00 60.37 59.14 3iob h HIS 47 Cb 0.07 -0.31 -0.01 0.00 1.06 0.00 0.00 27.41 28.22 3iob h HIS 47 CO -0.15 0.82 -0.13 -0.07 0.86 0.00 0.00 177.93 179.26 3iob h LEU 48 N 1.00 0.15 -0.99 2.43 3.38 -1.08 -1.71 115.31 118.48 3iob h LEU 48 Ca 0.23 -0.03 -0.03 0.00 0.09 0.00 0.00 57.88 58.14 3iob h LEU 48 Cb 0.24 -0.04 -0.03 0.00 0.09 0.00 0.00 40.66 40.92 3iob h LEU 48 CO -0.01 0.30 0.33 0.00 0.09 0.00 0.00 178.44 179.15 3iob h ALA 49 N 1.72 1.21 -0.42 1.53 0.00 -0.84 0.13 119.26 122.59 3iob h ALA 49 Ca 0.03 -0.16 -0.03 0.00 0.00 0.00 0.00 54.91 54.76 3iob h ALA 49 Cb 0.33 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 3iob h ALA 49 CO 0.02 0.60 0.15 -0.07 0.00 0.00 0.00 179.25 179.94 3iob h LEU 50 N 1.05 0.60 -0.35 0.00 3.38 -1.26 -1.98 115.31 116.75 3iob h LEU 50 Ca 0.25 -0.19 0.02 0.00 0.09 0.00 0.00 57.88 58.05 3iob h LEU 50 Cb 0.13 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 40.70 3iob h LEU 50 CO -0.03 0.63 0.18 0.58 0.09 0.00 0.00 178.44 179.89 3iob h VAL 51 N 0.53 1.00 -0.51 1.22 2.07 -1.03 -1.58 116.25 117.96 3iob h VAL 51 Ca 0.14 -0.13 -0.04 0.00 0.82 0.00 0.00 66.70 67.49 3iob h VAL 51 Cb 0.23 0.59 -0.02 0.00 -1.52 0.00 0.00 31.29 30.57 3iob h VAL 51 CO -0.01 0.07 0.16 0.03 0.02 0.00 0.00 177.57 177.84 3iob h ARG 52 N 0.37 0.75 -0.50 1.57 3.08 -0.63 -0.02 114.38 119.00 3iob h ARG 52 Ca 0.14 -0.13 -0.04 0.00 0.07 0.00 0.00 59.98 60.02 3iob h ARG 52 Cb 0.04 -0.13 -0.02 0.00 0.08 0.00 0.00 29.97 29.94 3iob h ARG 52 CO -0.09 0.65 0.15 0.00 -1.07 0.00 0.00 179.97 179.61 3iob h ALA 53 N 1.44 0.66 -0.23 0.04 0.00 -1.01 -2.74 119.26 117.42 3iob h ALA 53 Ca 0.17 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 3iob h ALA 53 Cb 0.22 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 3iob h ALA 53 CO -0.01 0.32 0.13 0.00 0.00 0.00 0.00 179.25 179.69 3iob h ALA 54 N 1.01 0.29 -0.54 0.00 0.00 -0.68 -3.18 119.26 116.17 3iob h ALA 54 Ca 0.16 -0.05 0.03 0.00 0.00 0.00 0.00 54.91 55.05 3iob h ALA 54 Cb 0.28 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.95 3iob h ALA 54 CO -0.00 -0.19 0.36 0.87 0.00 0.00 0.00 179.25 180.29 3iob h LYS 55 N 0.27 0.62 0.00 0.00 1.57 -0.87 -2.83 116.57 115.33 3iob h LYS 55 Ca 0.08 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.82 3iob h LYS 55 Cb 0.04 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 32.21 3iob h LYS 55 CO -0.01 0.41 0.00 2.89 -0.57 0.00 0.00 179.45 182.17 3iob n ARG 56 N -4.47 0.03 -1.96 3.15 1.85 -1.05 -4.69 116.66 109.52 3iob n ARG 56 Ca 0.06 0.05 -0.42 0.00 -1.00 0.00 0.00 57.85 56.54 3iob n ARG 56 Cb 0.13 -1.50 -0.03 0.00 -1.05 0.00 0.00 32.46 30.01 3iob n ARG 56 CO 0.00 0.00 0.00 0.08 -0.01 0.00 0.00 177.63 177.70 3iob s VAL 57 N -2.97 3.30 0.28 8.89 1.01 -1.07 -4.94 120.40 124.90 3iob s VAL 57 Ca 0.13 0.59 -0.30 0.00 0.00 0.00 0.00 61.98 62.40 3iob s VAL 57 Cb 0.17 -3.38 -0.12 0.00 0.00 0.00 0.00 36.38 33.06 3iob s VAL 57 CO 0.47 -0.02 1.63 -2.84 0.00 0.00 0.00 175.10 174.34 3iob s PRO 58 N 3.27 4.11 0.00 2.72 0.02 -1.26 -1.38 135.00 142.49 3iob s PRO 58 Ca 0.74 2.60 0.00 0.00 0.02 0.00 0.00 61.00 64.36 3iob s PRO 58 Cb -0.37 -3.03 0.00 0.00 0.02 0.00 0.00 34.50 31.12 3iob s PRO 58 CO 0.31 -0.67 0.00 0.41 -0.33 0.00 0.00 177.00 176.72 3iob n GLY 59 N 2.58 0.90 3.76 0.52 0.00 -1.26 -4.75 105.19 106.94 3iob n GLY 59 Ca 0.10 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.71 3iob n GLY 59 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3iob n SER 60 N 0.00 3.45 -4.17 1.61 3.41 -0.48 -1.59 113.62 115.86 3iob n SER 60 Ca 0.00 1.18 -0.30 0.00 -0.26 0.00 0.00 58.87 59.49 3iob n SER 60 Cb 0.00 -1.60 -0.17 0.00 -0.26 0.00 0.00 64.21 62.18 3iob n SER 60 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 3iob s VAL 61 N -1.15 1.78 -0.24 -3.33 0.11 -0.37 -4.81 120.40 112.40 3iob s VAL 61 Ca 0.57 -0.86 -0.12 0.00 -2.93 0.00 0.00 61.98 58.63 3iob s VAL 61 Cb -0.47 -1.55 -0.05 0.00 -1.53 0.00 0.00 36.38 32.78 3iob s VAL 61 CO 0.61 0.50 0.24 -0.69 -3.33 0.00 0.00 175.10 172.42 3iob s VAL 62 N 0.38 5.30 -0.24 2.04 1.01 -1.26 -1.00 120.40 126.64 3iob s VAL 62 Ca -0.16 0.34 -0.07 0.00 0.00 0.00 0.00 61.98 62.08 3iob s VAL 62 Cb -0.17 -3.57 -0.03 0.00 0.00 0.00 0.00 36.38 32.61 3iob s VAL 62 CO 0.07 0.30 0.06 -0.69 0.00 0.00 0.00 175.10 174.84 3iob s VAL 63 N 1.25 4.24 -0.26 2.92 1.01 0.11 -2.47 120.40 127.21 3iob s VAL 63 Ca 0.11 -0.20 -0.07 0.00 0.00 0.00 0.00 61.98 61.82 3iob s VAL 63 Cb -0.14 -2.97 -0.01 0.00 0.00 0.00 0.00 36.38 33.25 3iob s VAL 63 CO 0.06 0.36 0.06 -0.69 0.00 0.00 0.00 175.10 174.89 3iob s VAL 64 N 1.48 4.06 0.08 2.92 1.01 -0.23 -0.80 120.40 128.92 3iob s VAL 64 Ca 0.06 -0.38 -0.15 0.00 0.00 0.00 0.00 61.98 61.51 3iob s VAL 64 Cb -0.15 -2.95 -0.06 0.00 0.00 0.00 0.00 36.38 33.21 3iob s VAL 64 CO 0.03 0.27 0.50 -0.94 0.00 0.00 0.00 175.10 174.97 3iob s SER 65 N 1.56 6.87 -0.21 3.32 1.04 -0.86 -0.95 113.70 124.46 3iob s SER 65 Ca 0.05 1.07 0.01 0.00 0.48 0.00 0.00 55.95 57.56 3iob s SER 65 Cb -0.16 -2.29 0.05 0.00 0.10 0.00 0.00 66.02 63.73 3iob s SER 65 CO 0.02 0.21 -0.07 -0.63 0.98 0.00 0.00 173.24 173.76 3iob s ILE 66 N -1.27 1.48 -0.25 -1.02 1.01 0.01 -0.62 121.20 120.53 3iob s ILE 66 Ca 0.31 -1.05 -0.10 0.00 0.00 0.00 0.00 60.65 59.82 3iob s ILE 66 Cb -0.16 -1.68 0.10 0.00 0.01 0.00 0.00 42.46 40.73 3iob s ILE 66 CO 0.18 0.02 0.56 0.12 0.00 0.00 0.00 174.94 175.81 3iob s PHE 67 N 1.44 -1.07 -0.54 3.97 5.36 -0.77 -4.11 117.98 122.26 3iob s PHE 67 Ca -0.03 1.95 -0.23 0.00 -0.96 0.00 0.00 56.93 57.66 3iob s PHE 67 Cb -0.17 0.57 0.04 0.00 -0.34 0.00 0.00 43.02 43.12 3iob s PHE 67 CO -0.07 -0.56 0.88 0.08 -1.46 0.00 0.00 175.22 174.08 3iob s VAL 68 N 2.53 4.49 -0.42 3.12 1.01 -1.26 -4.39 120.40 125.48 3iob s VAL 68 Ca -0.05 0.12 -0.29 0.00 0.00 0.00 0.00 61.98 61.76 3iob s VAL 68 Cb -0.11 -4.49 0.02 0.00 0.00 0.00 0.00 36.38 31.81 3iob s VAL 68 CO -0.16 -1.05 1.10 0.21 0.00 0.00 0.00 175.10 175.19 3iob s ASN 69 N 2.80 6.72 0.53 3.32 2.47 -1.26 -4.89 114.94 124.64 3iob s ASN 69 Ca 0.27 0.64 0.32 0.00 0.42 0.00 0.00 52.86 54.51 3iob s ASN 69 Cb -0.14 -2.54 1.33 0.00 -1.45 0.00 0.00 41.25 38.46 3iob s ASN 69 CO 0.18 -1.10 1.98 1.55 -3.72 0.00 0.00 177.10 175.98 3iob h PRO 70 N 8.82 0.00 0.00 0.43 0.13 -1.99 -3.05 132.00 136.34 3iob h PRO 70 Ca -0.22 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.91 3iob h PRO 70 Cb 1.06 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.19 3iob h PRO 70 CO 1.09 0.06 0.00 1.98 -0.23 0.00 0.00 178.00 180.89 3iob h MET 71 N 0.00 0.00 0.00 0.86 4.05 -1.92 -3.53 114.93 114.40 3iob h MET 71 Ca -0.00 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.42 3iob h MET 71 Cb 0.52 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.32 3iob h MET 71 CO 0.01 0.00 0.00 0.00 0.23 0.00 0.00 176.91 177.15 3iob n GLN 72 N -3.09 0.00 0.00 0.39 10.64 -1.16 -4.13 117.38 120.03 3iob n GLN 72 Ca 0.02 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.19 3iob n GLN 72 Cb 0.41 -0.45 0.00 0.00 -0.86 0.00 0.00 30.24 29.34 3iob n GLN 72 CO 0.00 0.00 0.00 0.25 -1.83 0.00 0.00 177.06 175.48 3iob n THR 85 N -2.49 0.00 -0.05 -0.39 -2.24 -1.26 -4.77 114.28 103.08 3iob n THR 85 Ca 0.00 0.00 -0.10 0.00 -2.27 0.00 0.00 64.05 61.68 3iob n THR 85 Cb 0.00 0.00 -0.03 0.00 -2.10 0.00 0.00 70.33 68.20 3iob n THR 85 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 3iob h PRO 86 N 0.00 0.29 -0.51 -0.78 0.13 -2.02 -0.66 132.00 128.45 3iob h PRO 86 Ca 0.00 -0.02 0.04 0.00 -0.87 0.00 0.00 66.00 65.15 3iob h PRO 86 Cb 0.00 -0.06 -0.04 0.00 0.13 0.00 0.00 31.00 31.02 3iob h PRO 86 CO 0.00 0.22 0.27 -0.44 -0.23 0.00 0.00 178.00 177.82 3iob h ASP 87 N 0.28 0.40 -0.46 1.44 3.32 -2.06 -0.75 116.42 118.58 3iob h ASP 87 Ca 0.08 0.02 -0.05 0.00 0.02 0.00 0.00 57.03 57.10 3iob h ASP 87 Cb -0.00 -0.05 -0.02 0.00 0.22 0.00 0.00 39.33 39.48 3iob h ASP 87 CO -0.02 0.28 0.10 -0.78 -1.72 0.00 0.00 179.24 177.10 3iob h ASP 88 N 0.53 0.71 -0.29 6.45 3.58 -1.96 -2.05 116.42 123.39 3iob h ASP 88 Ca 0.22 -0.24 0.04 0.00 0.42 0.00 0.00 57.03 57.48 3iob h ASP 88 Cb 0.11 -0.19 -0.04 0.00 1.72 0.00 0.00 39.33 40.94 3iob h ASP 88 CO -0.15 0.77 0.03 0.44 -2.88 0.00 0.00 179.24 177.45 3iob h ASP 89 N 0.62 -0.05 -0.44 2.28 3.32 -0.75 -1.73 116.42 119.67 3iob h ASP 89 Ca 0.14 0.06 -0.05 0.00 0.02 0.00 0.00 57.03 57.20 3iob h ASP 89 Cb 0.34 0.09 -0.02 0.00 0.22 0.00 0.00 39.33 39.96 3iob h ASP 89 CO 0.00 0.01 0.11 -0.07 -1.72 0.00 0.00 179.24 177.58 3iob h LEU 90 N 0.12 0.71 -0.75 1.55 3.38 -1.05 -1.36 115.31 117.92 3iob h LEU 90 Ca 0.13 -0.12 -0.03 0.00 0.09 0.00 0.00 57.88 57.95 3iob h LEU 90 Cb 0.16 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 40.69 3iob h LEU 90 CO -0.20 0.71 0.36 0.00 0.09 0.00 0.00 178.44 179.39 3iob h ALA 91 N 1.39 0.96 -0.60 1.53 0.00 -1.07 -1.04 119.26 120.44 3iob h ALA 91 Ca 0.16 -0.15 -0.04 0.00 0.00 0.00 0.00 54.91 54.88 3iob h ALA 91 Cb 0.29 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 3iob h ALA 91 CO -0.00 0.53 0.21 1.96 0.00 0.00 0.00 179.25 181.95 3iob h GLN 92 N 1.05 0.91 -0.66 0.00 4.20 -0.57 -1.05 115.11 118.98 3iob h GLN 92 Ca 0.26 -0.18 -0.02 0.00 0.06 0.00 0.00 58.65 58.76 3iob h GLN 92 Cb 0.12 -0.14 -0.03 0.00 0.30 0.00 0.00 27.48 27.73 3iob h GLN 92 CO -0.03 0.79 0.33 -0.07 -0.67 0.00 0.00 178.83 179.18 3iob h LEU 93 N 0.83 0.85 -0.64 1.46 3.38 -1.08 -2.04 115.31 118.07 3iob h LEU 93 Ca 0.20 -0.12 -0.01 0.00 0.09 0.00 0.00 57.88 58.03 3iob h LEU 93 Cb 0.25 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.75 3iob h LEU 93 CO -0.01 0.74 0.36 -0.09 0.09 0.00 0.00 178.44 179.53 3iob h ARG 94 N 0.91 0.88 0.00 1.13 2.43 -0.97 -1.82 114.38 116.94 3iob h ARG 94 Ca 0.23 -0.10 -0.03 0.00 -0.81 0.00 0.00 59.98 59.27 3iob h ARG 94 Cb 0.10 -0.18 -0.00 0.00 -0.42 0.00 0.00 29.97 29.47 3iob h ARG 94 CO -0.03 0.66 -0.15 0.00 -1.51 0.00 0.00 179.97 178.94 3iob h ALA 95 N 1.18 1.46 -0.00 2.80 0.00 -0.94 -1.97 119.26 121.79 3iob h ALA 95 Ca 0.23 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.00 3iob h ALA 95 Cb 0.02 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.79 3iob h ALA 95 CO -0.04 0.18 -0.16 0.39 0.00 0.00 0.00 179.25 179.63 3iob n GLU 96 N -3.94 0.64 -1.33 0.00 -0.58 -0.73 -4.94 120.64 109.75 3iob n GLU 96 Ca -0.02 -0.26 -0.03 0.00 -0.42 0.00 0.00 57.16 56.43 3iob n GLU 96 Cb 0.24 -1.49 -0.01 0.00 -0.57 0.00 0.00 31.44 29.60 3iob n GLU 96 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3iob n GLY 97 N 1.32 0.51 3.73 0.62 0.00 -0.74 -5.02 105.19 105.60 3iob n GLY 97 Ca 0.13 -0.90 -0.41 0.00 0.00 0.00 0.00 46.02 44.83 3iob n GLY 97 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3iob s VAL 98 N -2.11 3.60 -0.12 1.61 1.01 -0.93 -4.95 120.40 118.51 3iob s VAL 98 Ca 0.00 1.30 0.22 0.00 0.00 0.00 0.00 61.98 63.50 3iob s VAL 98 Cb 0.00 -3.83 -0.22 0.00 0.00 0.00 0.00 36.38 32.33 3iob s VAL 98 CO 0.00 0.18 0.69 -0.62 0.00 0.00 0.00 175.10 175.35 3iob n GLU 99 N 2.84 0.62 -3.97 2.72 1.02 -1.24 -3.92 120.64 118.71 3iob n GLU 99 Ca 0.06 -0.09 -0.22 0.00 -0.02 0.00 0.00 57.16 56.89 3iob n GLU 99 Cb 0.45 -1.62 -0.17 0.00 -0.02 0.00 0.00 31.44 30.07 3iob n GLU 99 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 3iob s ILE 100 N -3.45 0.49 -0.16 -3.67 1.01 -1.03 -0.25 121.20 114.14 3iob s ILE 100 Ca -0.05 -0.02 -0.02 0.00 0.00 0.00 0.00 60.65 60.55 3iob s ILE 100 Cb 0.13 -0.58 -0.02 0.00 0.01 0.00 0.00 42.46 42.00 3iob s ILE 100 CO 0.87 0.25 -0.07 0.00 0.00 0.00 0.00 174.94 175.98 3iob s ALA 101 N 1.43 2.82 -0.32 9.38 0.00 -0.21 -1.07 121.76 133.78 3iob s ALA 101 Ca -0.03 -0.94 -0.07 0.00 0.00 0.00 0.00 51.96 50.92 3iob s ALA 101 Cb -0.13 -1.48 0.02 0.00 0.00 0.00 0.00 23.12 21.53 3iob s ALA 101 CO -0.03 0.06 0.11 0.12 0.00 0.00 0.00 175.76 176.02 3iob s PHE 102 N 0.65 3.20 -0.56 0.00 5.36 -0.13 -1.04 117.98 125.46 3iob s PHE 102 Ca -0.04 -1.13 0.07 0.00 -0.96 0.00 0.00 56.93 54.87 3iob s PHE 102 Cb -0.15 -2.29 0.27 0.00 -0.34 0.00 0.00 43.02 40.51 3iob s PHE 102 CO 0.02 -0.64 0.74 0.25 -1.46 0.00 0.00 175.22 174.13 3iob n THR 103 N 4.87 1.75 -1.76 0.12 -2.24 0.26 -0.81 114.28 116.46 3iob n THR 103 Ca -0.13 -5.02 -0.31 0.00 -2.27 0.00 0.00 64.05 56.32 3iob n THR 103 Cb 0.46 -1.84 0.03 0.00 -2.10 0.00 0.00 70.33 66.89 3iob n THR 103 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 3iob s PRO 104 N -2.41 3.28 0.56 -0.78 0.04 -1.26 -4.53 135.00 129.92 3iob s PRO 104 Ca 0.41 0.79 -0.06 0.00 0.04 0.00 0.00 61.00 62.18 3iob s PRO 104 Cb 0.19 -2.04 -0.00 0.00 0.04 0.00 0.00 34.50 32.68 3iob s PRO 104 CO -0.06 -0.81 0.87 0.95 0.04 0.00 0.00 177.00 178.00 3iob s THR 105 N -3.15 3.98 0.25 1.26 -4.23 -1.26 -4.89 115.64 107.61 3iob s THR 105 Ca 0.56 0.06 -0.03 0.00 -1.18 0.00 0.00 61.69 61.11 3iob s THR 105 Cb -0.12 -3.56 0.22 0.00 1.34 0.00 0.00 72.50 70.38 3iob s THR 105 CO 0.54 -0.57 1.77 0.74 -0.54 0.00 0.00 174.62 176.56 3iob h THR 106 N -0.07 0.78 -0.34 3.99 2.02 -1.97 -2.15 112.91 115.16 3iob h THR 106 Ca -0.46 -0.22 -0.05 0.00 0.77 0.00 0.00 66.41 66.46 3iob h THR 106 Cb 1.24 0.08 -0.02 0.00 -1.74 0.00 0.00 68.15 67.72 3iob h THR 106 CO 0.61 0.12 0.00 0.00 0.37 0.00 0.00 175.52 176.62 3iob h ALA 107 N 1.52 1.39 -0.19 6.16 0.00 -1.94 0.20 119.26 126.39 3iob h ALA 107 Ca 0.43 -0.19 -0.18 0.00 0.00 0.00 0.00 54.91 54.97 3iob h ALA 107 Cb 0.55 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.19 3iob h ALA 107 CO -0.33 0.43 -0.60 0.00 0.00 0.00 0.00 179.25 178.75 3iob h ALA 108 N 1.51 0.59 0.07 0.00 0.00 -1.82 -2.13 119.26 117.48 3iob h ALA 108 Ca 0.11 -0.54 -0.26 0.00 0.00 0.00 0.00 54.91 54.22 3iob h ALA 108 Cb 0.32 -0.07 0.01 0.00 0.00 0.00 0.00 17.79 18.05 3iob h ALA 108 CO 0.01 0.70 -1.11 0.52 0.00 0.00 0.00 179.25 179.36 3iob h MET 109 N 0.47 0.47 -2.27 0.00 2.86 -1.12 -3.38 114.93 111.96 3iob h MET 109 Ca -0.00 -0.60 -0.59 0.00 -2.06 0.00 0.00 59.70 56.45 3iob h MET 109 Cb 1.17 0.19 -0.42 0.00 0.06 0.00 0.00 31.60 32.60 3iob h MET 109 CO 0.12 1.24 -0.66 0.66 1.06 0.00 0.00 176.91 179.33 3iob n TYR 110 N -3.72 3.87 0.31 -0.22 4.01 0.67 -4.90 117.16 117.18 3iob n TYR 110 Ca -0.10 -4.01 0.21 0.00 -0.16 0.00 0.00 57.90 53.84 3iob n TYR 110 Cb 0.93 -0.49 1.01 0.00 -0.31 0.00 0.00 39.34 40.47 3iob n TYR 110 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 3iob h PRO 111 N 3.11 0.00 -0.29 -0.72 0.13 -1.57 -0.91 132.00 131.76 3iob h PRO 111 Ca 0.14 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.27 3iob h PRO 111 Cb 0.54 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.67 3iob h PRO 111 CO 0.81 0.00 0.00 -0.25 -0.23 0.00 0.00 178.00 178.33 3iob n ASP 112 N -3.07 3.59 -0.11 1.44 8.00 -1.26 -5.08 116.55 120.06 3iob n ASP 112 Ca -0.02 -2.69 0.00 0.00 0.71 0.00 0.00 54.79 52.79 3iob n ASP 112 Cb 0.16 -0.44 0.00 0.00 -0.02 0.00 0.00 41.12 40.82 3iob n ASP 112 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3iob n GLY 113 N -0.18 -0.59 3.58 0.44 0.00 -0.35 -4.62 105.19 103.47 3iob n GLY 113 Ca 0.18 -1.11 -0.43 0.00 0.00 0.00 0.00 46.02 44.66 3iob n GLY 113 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3iob s LEU 114 N 0.00 3.97 0.00 0.99 1.43 -1.26 -4.85 118.68 118.96 3iob s LEU 114 Ca 0.00 0.26 0.00 0.00 -1.03 0.00 0.00 54.13 53.36 3iob s LEU 114 Cb 0.00 -3.25 0.00 0.00 0.03 0.00 0.00 46.19 42.97 3iob s LEU 114 CO 0.00 -1.02 0.00 -1.14 0.23 0.00 0.00 176.35 174.42 3iob n ARG 115 N 7.14 0.00 -2.46 1.70 0.63 -1.26 -5.05 116.66 117.36 3iob n ARG 115 Ca 0.07 0.00 -0.41 0.00 -0.92 0.00 0.00 57.85 56.59 3iob n ARG 115 Cb 0.48 0.00 -0.04 0.00 0.45 0.00 0.00 32.46 33.36 3iob n ARG 115 CO 0.00 0.00 0.00 0.99 -2.51 0.00 0.00 177.63 176.11 3iob s THR 116 N 0.27 3.81 0.21 5.15 2.01 -1.26 -5.03 115.64 120.80 3iob s THR 116 Ca 0.00 1.50 -0.00 0.00 0.31 0.00 0.00 61.69 63.50 3iob s THR 116 Cb 0.00 -3.96 -0.04 0.00 0.01 0.00 0.00 72.50 68.51 3iob s THR 116 CO 0.00 0.23 0.12 0.42 -0.69 0.00 0.00 174.62 174.70 3iob s THR 117 N 0.03 0.15 -0.08 -0.82 -4.23 -1.26 -5.12 115.64 104.30 3iob s THR 117 Ca 0.52 -2.00 -0.16 0.00 -1.18 0.00 0.00 61.69 58.87 3iob s THR 117 Cb -0.30 -2.51 -0.05 0.00 1.34 0.00 0.00 72.50 70.98 3iob s THR 117 CO 0.35 -0.03 0.42 -0.69 -0.54 0.00 0.00 174.62 174.12 3iob s VAL 118 N -4.05 5.15 -0.37 2.29 1.01 -1.26 -5.06 120.40 118.10 3iob s VAL 118 Ca 0.38 0.84 -0.09 0.00 0.00 0.00 0.00 61.98 63.10 3iob s VAL 118 Cb 0.07 -3.74 0.04 0.00 0.00 0.00 0.00 36.38 32.75 3iob s VAL 118 CO 0.12 0.43 0.19 -1.58 0.00 0.00 0.00 175.10 174.26 3iob s GLN 119 N -0.04 2.73 0.89 2.72 2.00 -1.26 -4.65 119.66 122.05 3iob s GLN 119 Ca 0.23 -1.17 -0.11 0.00 -2.00 0.00 0.00 55.36 52.32 3iob s GLN 119 Cb -0.15 -3.67 0.13 0.00 0.80 0.00 0.00 33.01 30.12 3iob s GLN 119 CO 0.10 -0.73 1.11 -2.14 -0.50 0.00 0.00 175.29 173.13 3iob s PRO 120 N 1.49 1.24 1.20 1.67 0.02 -1.26 -5.04 135.00 134.32 3iob s PRO 120 Ca 0.01 1.28 -0.20 0.00 0.02 0.00 0.00 61.00 62.11 3iob s PRO 120 Cb -0.20 -1.77 0.30 0.00 0.02 0.00 0.00 34.50 32.85 3iob s PRO 120 CO 0.05 -2.39 1.00 0.41 -0.33 0.00 0.00 177.00 175.74 3iob n GLY 121 N -0.33 -2.96 0.31 0.52 0.00 -1.26 -4.87 105.19 96.59 3iob n GLY 121 Ca 0.10 -1.46 0.19 0.00 0.00 0.00 0.00 46.02 44.85 3iob n GLY 121 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3iob h PRO 122 N 0.00 0.00 -0.56 1.61 0.11 -2.03 -1.65 132.00 129.48 3iob h PRO 122 Ca -0.39 0.00 0.14 0.00 0.11 0.00 0.00 66.00 65.86 3iob h PRO 122 Cb 1.20 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.28 3iob h PRO 122 CO 0.25 0.03 0.39 1.25 -0.21 0.00 0.00 178.00 179.71 3iob h LEU 123 N 0.00 0.12 -1.38 2.35 5.85 -1.97 -1.94 115.31 118.35 3iob h LEU 123 Ca -0.00 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.73 3iob h LEU 123 Cb 0.17 -0.02 0.00 0.00 0.37 0.00 0.00 40.66 41.18 3iob h LEU 123 CO 0.00 0.07 0.00 0.00 -0.34 0.00 0.00 178.44 178.17 3iob h ALA 124 N 1.72 1.00 0.00 1.25 0.00 -1.63 -2.06 119.26 119.54 3iob h ALA 124 Ca 0.27 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.18 3iob h ALA 124 Cb 0.88 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.67 3iob h ALA 124 CO -0.03 0.00 -0.63 0.00 0.00 0.00 0.00 179.25 178.58 3iob n ALA 125 N -1.88 3.28 -2.08 0.00 0.00 -0.73 -3.95 120.51 115.16 3iob n ALA 125 Ca 0.00 -0.32 -0.21 0.00 0.00 0.00 0.00 53.44 52.91 3iob n ALA 125 Cb 0.17 -1.12 0.03 0.00 0.00 0.00 0.00 19.45 18.53 3iob n ALA 125 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 3iob s GLU 126 N -3.10 2.72 3.75 0.00 2.02 -0.78 -3.25 118.70 120.07 3iob s GLU 126 Ca 0.08 -0.79 0.00 0.00 0.02 0.00 0.00 54.97 54.28 3iob s GLU 126 Cb 0.15 -2.56 0.00 0.00 0.10 0.00 0.00 34.13 31.83 3iob s GLU 126 CO 0.72 -0.52 0.00 1.28 0.02 0.00 0.00 175.26 176.76 3iob n LEU 127 N -2.19 0.00 0.30 1.80 4.77 -1.26 0.36 117.00 120.78 3iob n LEU 127 Ca 0.06 0.00 0.16 0.00 -0.03 0.00 0.00 56.01 56.21 3iob n LEU 127 Cb 0.59 0.00 0.95 0.00 -2.33 0.00 0.00 43.42 42.63 3iob n LEU 127 CO 0.45 0.00 1.12 -0.33 -1.33 0.00 0.00 177.39 177.29 3iob h GLU 128 N 0.00 0.00 0.00 3.23 4.39 -1.92 -1.86 114.58 118.43 3iob h GLU 128 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 3iob h GLU 128 Cb 0.00 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.65 3iob h GLU 128 CO 0.00 0.02 0.00 0.41 -1.16 0.00 0.00 179.01 178.28 3iob n GLY 129 N -1.16 -1.25 0.00 -3.84 0.00 0.16 -2.97 105.19 96.13 3iob n GLY 129 Ca -0.03 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 45.95 3iob n GLY 129 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3iob n GLY 130 N 0.56 -2.80 0.20 -0.02 0.00 -0.70 -2.57 105.19 99.86 3iob n GLY 130 Ca 0.05 0.19 0.03 0.00 0.00 0.00 0.00 46.02 46.28 3iob n GLY 130 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3iob h PRO 131 N 0.00 0.03 -2.60 1.61 0.13 -1.79 -3.39 132.00 125.99 3iob h PRO 131 Ca 0.00 -0.01 -0.60 0.00 -0.87 0.00 0.00 66.00 64.52 3iob h PRO 131 Cb 0.00 -0.00 -0.41 0.00 0.13 0.00 0.00 31.00 30.71 3iob h PRO 131 CO 0.00 0.34 -0.67 0.54 -0.23 0.00 0.00 178.00 177.99 3iob n ARG 132 N -4.15 1.80 0.11 0.86 1.74 -1.16 -4.96 116.66 110.90 3iob n ARG 132 Ca -0.02 -4.30 0.11 0.00 -0.77 0.00 0.00 57.85 52.87 3iob n ARG 132 Cb 0.37 -2.12 0.47 0.00 -1.02 0.00 0.00 32.46 30.16 3iob n ARG 132 CO 0.00 0.00 0.00 -0.35 -1.52 0.00 0.00 177.63 175.76 3iob n PRO 133 N 1.62 0.16 -0.06 5.56 -0.04 -1.06 -1.97 135.00 139.21 3iob n PRO 133 Ca 0.25 0.43 0.06 0.00 -0.04 0.00 0.00 63.50 64.19 3iob n PRO 133 Cb 0.40 -1.83 0.08 0.00 -0.04 0.00 0.00 33.50 32.12 3iob n PRO 133 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 3iob n THR 134 N -2.13 0.33 -0.02 0.52 -2.24 -1.26 -4.72 114.28 104.76 3iob n THR 134 Ca 0.02 -0.66 -0.11 0.00 -2.27 0.00 0.00 64.05 61.03 3iob n THR 134 Cb 0.19 0.99 -0.05 0.00 -2.10 0.00 0.00 70.33 69.37 3iob n THR 134 CO 0.00 0.00 0.00 -0.74 -0.57 0.00 0.00 175.07 173.76 3iob h HIS 135 N 2.14 0.17 0.00 4.78 6.17 -1.69 -2.83 115.15 123.88 3iob h HIS 135 Ca 0.00 0.00 -0.12 0.00 0.71 0.00 0.00 60.37 60.97 3iob h HIS 135 Cb 0.55 -0.06 -0.02 0.00 2.52 0.00 0.00 27.41 30.41 3iob h HIS 135 CO 0.08 0.11 -0.56 0.74 0.71 0.00 0.00 177.93 179.00 3iob h PHE 136 N 0.18 0.00 -0.83 5.26 0.04 -1.85 -1.44 116.94 118.30 3iob h PHE 136 Ca 0.05 0.00 0.07 0.00 2.80 0.00 0.00 57.97 60.89 3iob h PHE 136 Cb -0.02 0.00 -0.06 0.00 2.20 0.00 0.00 35.95 38.06 3iob h PHE 136 CO -0.07 0.56 0.50 0.00 -0.60 0.00 0.00 178.31 178.70 3iob h ALA 137 N 1.44 1.16 -0.14 2.45 0.00 -1.79 0.14 119.26 122.51 3iob h ALA 137 Ca -0.01 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 3iob h ALA 137 Cb 1.07 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.67 3iob h ALA 137 CO 0.07 0.19 0.05 0.78 0.00 0.00 0.00 179.25 180.34 3iob h GLY 138 N 0.88 0.24 0.70 0.00 0.00 -1.06 -0.99 103.07 102.85 3iob h GLY 138 Ca 0.38 -0.14 0.01 0.00 0.00 0.00 0.00 47.33 47.57 3iob h GLY 138 CO -0.20 0.13 -0.22 -2.08 0.00 0.00 0.00 176.54 174.17 3iob h VAL 139 N 0.05 0.51 -0.31 4.60 2.07 -1.06 -1.45 116.25 120.66 3iob h VAL 139 Ca 0.05 0.00 -0.06 0.00 0.82 0.00 0.00 66.70 67.51 3iob h VAL 139 Cb 0.22 0.51 -0.02 0.00 -1.52 0.00 0.00 31.29 30.49 3iob h VAL 139 CO -0.00 0.00 -0.04 -0.07 0.02 0.00 0.00 177.57 177.48 3iob h LEU 140 N -0.46 0.47 0.11 2.57 3.38 -0.92 -0.54 115.31 119.92 3iob h LEU 140 Ca 0.01 -0.10 -0.01 0.00 0.09 0.00 0.00 57.88 57.87 3iob h LEU 140 Cb 0.45 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.07 3iob h LEU 140 CO -0.07 0.57 -0.05 0.74 0.09 0.00 0.00 178.44 179.71 3iob h THR 141 N 0.47 0.98 -0.41 0.22 2.02 -1.01 -0.53 112.91 114.66 3iob h THR 141 Ca 0.10 -0.33 -0.11 0.00 0.77 0.00 0.00 66.41 66.83 3iob h THR 141 Cb 0.38 1.19 -0.01 0.00 -1.74 0.00 0.00 68.15 67.96 3iob h THR 141 CO 0.02 0.08 -0.20 1.62 0.37 0.00 0.00 175.52 177.40 3iob h VAL 142 N -0.30 1.27 -0.47 3.16 3.04 -1.04 -2.32 116.25 119.58 3iob h VAL 142 Ca -0.02 -1.32 -0.05 0.00 -1.01 0.00 0.00 66.70 64.30 3iob h VAL 142 Cb 0.25 1.17 -0.02 0.00 -2.01 0.00 0.00 31.29 30.68 3iob h VAL 142 CO 0.02 0.45 0.08 0.58 -1.01 0.00 0.00 177.57 177.70 3iob h VAL 143 N 0.71 1.25 -0.47 1.51 2.07 -1.08 -0.78 116.25 119.46 3iob h VAL 143 Ca 0.10 -0.90 0.02 0.00 0.82 0.00 0.00 66.70 66.75 3iob h VAL 143 Cb 0.72 0.92 -0.03 0.00 -1.52 0.00 0.00 31.29 31.38 3iob h VAL 143 CO 0.06 0.32 0.27 0.25 0.02 0.00 0.00 177.57 178.49 3iob h LEU 144 N 0.65 0.44 -0.37 2.57 5.85 -0.96 -0.46 115.31 123.02 3iob h LEU 144 Ca 0.14 0.01 0.02 0.00 0.84 0.00 0.00 57.88 58.89 3iob h LEU 144 Cb 0.38 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 41.29 3iob h LEU 144 CO 0.01 0.31 0.21 0.11 -0.34 0.00 0.00 178.44 178.74 3iob h LYS 145 N 0.55 0.41 -0.75 1.25 1.57 -1.15 -1.66 116.57 116.80 3iob h LYS 145 Ca 0.19 -0.02 -0.05 0.00 -1.87 0.00 0.00 60.65 58.90 3iob h LYS 145 Cb 0.03 -0.09 -0.03 0.00 0.08 0.00 0.00 32.23 32.21 3iob h LYS 145 CO -0.09 0.27 0.27 -0.07 -0.57 0.00 0.00 179.45 179.26 3iob h LEU 146 N 0.42 1.05 -1.00 2.94 3.38 -0.84 0.11 115.31 121.37 3iob h LEU 146 Ca 0.15 -0.17 0.01 0.00 0.09 0.00 0.00 57.88 57.96 3iob h LEU 146 Cb 0.02 -0.27 -0.05 0.00 0.09 0.00 0.00 40.66 40.45 3iob h LEU 146 CO -0.08 0.95 0.66 -0.07 0.09 0.00 0.00 178.44 179.99 3iob h LEU 147 N 1.09 1.14 -0.35 1.67 3.38 -0.76 -0.82 115.31 120.67 3iob h LEU 147 Ca 0.25 -0.03 -0.19 0.00 0.09 0.00 0.00 57.88 58.00 3iob h LEU 147 Cb 0.25 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 40.71 3iob h LEU 147 CO -0.02 0.83 -0.79 1.56 0.09 0.00 0.00 178.44 180.11 3iob h GLN 148 N 1.35 0.36 0.02 1.13 1.08 -0.70 0.16 115.11 118.51 3iob h GLN 148 Ca 0.37 -0.32 -0.00 0.00 -1.45 0.00 0.00 58.65 57.25 3iob h GLN 148 Cb -0.15 0.08 0.00 0.00 -0.05 0.00 0.00 27.48 27.36 3iob h GLN 148 CO -0.08 0.98 -0.01 0.82 -0.95 0.00 0.00 178.83 179.59 3iob h ILE 149 N 0.23 1.30 0.00 2.54 2.04 -0.81 -3.37 117.51 119.44 3iob h ILE 149 Ca -0.04 -1.02 -0.27 0.00 1.00 0.00 0.00 64.86 64.53 3iob h ILE 149 Cb 1.38 1.98 -0.05 0.00 -0.74 0.00 0.00 36.82 39.39 3iob h ILE 149 CO 0.13 0.26 -1.60 0.58 0.00 0.00 0.00 178.15 177.52 3iob h VAL 150 N -0.48 0.93 -6.55 1.67 2.07 -1.21 -3.35 116.25 109.33 3iob h VAL 150 Ca -0.00 -2.74 -0.51 0.00 0.82 0.00 0.00 66.70 64.27 3iob h VAL 150 Cb 0.45 2.45 0.02 0.00 -1.52 0.00 0.00 31.29 32.69 3iob h VAL 150 CO 0.01 0.53 -0.96 0.54 0.02 0.00 0.00 177.57 177.70 3iob n ARG 151 N -3.07 -1.10 -1.68 1.57 1.74 0.56 -4.76 116.66 109.92 3iob n ARG 151 Ca -0.14 0.30 -0.31 0.00 -0.77 0.00 0.00 57.85 56.92 3iob n ARG 151 Cb 1.02 -3.58 0.04 0.00 -1.02 0.00 0.00 32.46 28.93 3iob n ARG 151 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 3iob s PRO 152 N -6.63 3.07 0.11 5.56 0.04 -1.26 -4.89 135.00 131.01 3iob s PRO 152 Ca 0.41 0.97 -0.07 0.00 0.04 0.00 0.00 61.00 62.35 3iob s PRO 152 Cb -0.18 -2.01 -0.16 0.00 0.04 0.00 0.00 34.50 32.19 3iob s PRO 152 CO 0.91 -0.99 1.24 -0.44 0.04 0.00 0.00 177.00 177.76 3iob h ASP 153 N -0.49 0.60 -4.54 6.66 3.32 -0.70 -3.43 116.42 117.83 3iob h ASP 153 Ca -0.44 -0.51 -0.23 0.00 0.02 0.00 0.00 57.03 55.87 3iob h ASP 153 Cb 1.21 -0.19 -0.23 0.00 0.22 0.00 0.00 39.33 40.34 3iob h ASP 153 CO 0.57 1.32 -0.72 -0.13 -1.72 0.00 0.00 179.24 178.57 3iob s ARG 154 N -3.15 0.31 -0.01 3.56 0.52 -1.20 -1.91 118.95 117.07 3iob s ARG 154 Ca -0.06 -0.47 0.06 0.00 -0.52 0.00 0.00 55.73 54.74 3iob s ARG 154 Cb 0.08 -0.07 -0.02 0.00 0.52 0.00 0.00 34.95 35.46 3iob s ARG 154 CO 0.88 0.00 -0.19 0.54 0.02 0.00 0.00 175.30 176.55 3iob s VAL 155 N -0.98 1.53 -0.11 3.52 0.11 -0.23 -1.25 120.40 122.99 3iob s VAL 155 Ca -0.09 -0.84 0.03 0.00 -2.93 0.00 0.00 61.98 58.14 3iob s VAL 155 Cb -0.07 -1.27 -0.01 0.00 -1.53 0.00 0.00 36.38 33.50 3iob s VAL 155 CO -0.00 0.42 -0.20 -0.36 -3.33 0.00 0.00 175.10 171.63 3iob s PHE 156 N -0.47 2.65 0.05 1.54 0.40 -0.44 -0.64 117.98 121.07 3iob s PHE 156 Ca 0.07 -0.91 0.03 0.00 -0.60 0.00 0.00 56.93 55.52 3iob s PHE 156 Cb -0.07 -1.76 -0.02 0.00 0.51 0.00 0.00 43.02 41.67 3iob s PHE 156 CO -0.01 -0.35 -0.08 -0.06 0.70 0.00 0.00 175.22 175.42 3iob s PHE 157 N 0.35 0.73 0.25 0.36 0.08 -0.67 -4.23 117.98 114.84 3iob s PHE 157 Ca -0.16 -0.49 -0.28 0.00 0.12 0.00 0.00 56.93 56.12 3iob s PHE 157 Cb -0.17 -0.43 -0.09 0.00 -0.57 0.00 0.00 43.02 41.75 3iob s PHE 157 CO 0.08 -0.07 0.90 0.20 -0.10 0.00 0.00 175.22 176.23 3iob s GLY 158 N -1.59 2.98 0.40 4.36 0.00 -1.26 -0.46 107.32 111.74 3iob s GLY 158 Ca -0.09 0.53 0.28 0.00 0.00 0.00 0.00 44.72 45.44 3iob s GLY 158 CO 0.01 1.04 1.85 0.83 0.00 0.00 0.00 173.10 176.83 3iob h GLU 159 N 3.88 0.00 -0.93 2.90 5.08 -0.83 -3.08 114.58 121.60 3iob h GLU 159 Ca -0.46 0.00 0.07 0.00 -1.00 0.00 0.00 59.36 57.97 3iob h GLU 159 Cb 1.20 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 30.39 3iob h GLU 159 CO 0.67 0.00 0.60 -0.22 -1.00 0.00 0.00 179.01 179.06 3iob h LYS 160 N 0.00 1.02 -3.04 2.33 3.64 -1.92 -2.45 116.57 116.15 3iob h LYS 160 Ca 0.00 -0.06 -0.81 0.00 -1.27 0.00 0.00 60.65 58.51 3iob h LYS 160 Cb 0.25 -0.23 -0.27 0.00 -0.41 0.00 0.00 32.23 31.57 3iob h LYS 160 CO 0.00 0.67 0.81 -0.25 -2.27 0.00 0.00 179.45 178.41 3iob n ASP 161 N -4.50 6.26 -0.21 4.20 8.00 -1.16 -4.67 116.55 124.47 3iob n ASP 161 Ca 0.14 -3.35 -0.08 0.00 0.71 0.00 0.00 54.79 52.21 3iob n ASP 161 Cb 0.21 -1.30 0.02 0.00 -0.02 0.00 0.00 41.12 40.04 3iob n ASP 161 CO 0.00 0.00 0.00 0.22 -0.39 0.00 0.00 177.20 177.03 3iob h TYR 162 N 5.61 0.94 -0.57 1.24 3.20 -1.66 -1.02 116.97 124.71 3iob h TYR 162 Ca 0.21 -0.10 -0.05 0.00 3.14 0.00 0.00 58.73 61.92 3iob h TYR 162 Cb 0.65 -0.27 -0.02 0.00 1.54 0.00 0.00 36.73 38.62 3iob h TYR 162 CO 1.00 0.79 0.14 0.37 -1.64 0.00 0.00 178.16 178.82 3iob h GLN 163 N 0.82 0.91 -0.35 1.82 4.15 -1.88 0.22 115.11 120.80 3iob h GLN 163 Ca 0.19 -0.22 0.07 0.00 0.77 0.00 0.00 58.65 59.45 3iob h GLN 163 Cb 0.30 -0.12 -0.06 0.00 0.21 0.00 0.00 27.48 27.81 3iob h GLN 163 CO -0.00 0.85 -0.02 0.37 -1.93 0.00 0.00 178.83 178.09 3iob h GLN 164 N 0.82 0.07 -0.39 1.69 4.15 -1.88 -1.14 115.11 118.43 3iob h GLN 164 Ca 0.18 -0.00 0.04 0.00 0.77 0.00 0.00 58.65 59.63 3iob h GLN 164 Cb 0.34 -0.02 -0.04 0.00 0.21 0.00 0.00 27.48 27.98 3iob h GLN 164 CO 0.00 0.05 0.18 1.25 -1.93 0.00 0.00 178.83 178.37 3iob h LEU 165 N 0.07 0.24 -0.67 -2.39 5.85 -0.25 -1.03 115.31 117.12 3iob h LEU 165 Ca 0.17 0.03 0.01 0.00 0.84 0.00 0.00 57.88 58.93 3iob h LEU 165 Cb 0.24 -0.01 -0.03 0.00 0.37 0.00 0.00 40.66 41.23 3iob h LEU 165 CO -0.31 0.18 0.44 0.58 -0.34 0.00 0.00 178.44 178.99 3iob h VAL 166 N 0.36 1.16 -0.43 1.05 2.07 -0.75 -1.47 116.25 118.24 3iob h VAL 166 Ca 0.17 -0.31 -0.06 0.00 0.82 0.00 0.00 66.70 67.32 3iob h VAL 166 Cb 0.10 0.19 -0.02 0.00 -1.52 0.00 0.00 31.29 30.04 3iob h VAL 166 CO -0.14 0.16 0.01 -0.07 0.02 0.00 0.00 177.57 177.55 3iob h LEU 167 N 0.90 0.65 -0.57 2.57 3.38 -0.95 -0.68 115.31 120.61 3iob h LEU 167 Ca 0.25 -0.14 -0.11 0.00 0.09 0.00 0.00 57.88 57.97 3iob h LEU 167 Cb -0.09 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.47 3iob h LEU 167 CO -0.06 0.72 -0.08 0.40 0.09 0.00 0.00 178.44 179.50 3iob h ILE 168 N 0.65 1.27 -0.75 1.22 2.04 -0.88 0.91 117.51 121.97 3iob h ILE 168 Ca 0.13 -1.25 0.08 0.00 1.00 0.00 0.00 64.86 64.82 3iob h ILE 168 Cb 0.39 0.92 -0.07 0.00 -0.74 0.00 0.00 36.82 37.32 3iob h ILE 168 CO 0.01 0.44 0.41 0.03 0.00 0.00 0.00 178.15 179.05 3iob h ARG 169 N 0.94 0.70 -0.48 2.37 3.08 -0.84 -0.78 114.38 119.37 3iob h ARG 169 Ca 0.15 -0.04 -0.07 0.00 0.07 0.00 0.00 59.98 60.08 3iob h ARG 169 Cb 0.66 -0.16 -0.02 0.00 0.08 0.00 0.00 29.97 30.53 3iob h ARG 169 CO 0.05 0.46 0.01 1.96 -1.07 0.00 0.00 179.97 181.38 3iob h GLN 170 N 0.72 0.84 -0.23 0.04 4.20 -0.70 -1.59 115.11 118.41 3iob h GLN 170 Ca 0.35 -0.26 0.05 0.00 0.06 0.00 0.00 58.65 58.85 3iob h GLN 170 Cb 0.29 -0.08 -0.05 0.00 0.30 0.00 0.00 27.48 27.94 3iob h GLN 170 CO -0.23 0.88 -0.12 1.25 -0.67 0.00 0.00 178.83 179.94 3iob h LEU 171 N 0.70 -0.40 -0.29 1.46 5.85 -0.47 0.11 115.31 122.27 3iob h LEU 171 Ca 0.14 0.09 -0.00 0.00 0.84 0.00 0.00 57.88 58.95 3iob h LEU 171 Cb 0.49 0.22 -0.01 0.00 0.37 0.00 0.00 40.66 41.72 3iob h LEU 171 CO 0.02 -0.15 0.17 0.58 -0.34 0.00 0.00 178.44 178.72 3iob h VAL 172 N -0.10 1.11 -0.12 1.05 2.07 -1.02 -1.41 116.25 117.84 3iob h VAL 172 Ca 0.12 -0.28 -0.01 0.00 0.82 0.00 0.00 66.70 67.35 3iob h VAL 172 Cb 0.28 0.77 -0.00 0.00 -1.52 0.00 0.00 31.29 30.82 3iob h VAL 172 CO -0.29 0.11 0.04 0.00 0.02 0.00 0.00 177.57 177.45 3iob h ALA 173 N 1.05 0.15 -0.13 1.67 0.00 -1.16 -0.79 119.26 120.05 3iob h ALA 173 Ca 0.10 -0.12 -0.10 0.00 0.00 0.00 0.00 54.91 54.79 3iob h ALA 173 Cb 0.03 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 3iob h ALA 173 CO -0.02 -0.23 -0.35 -0.44 0.00 0.00 0.00 179.25 178.21 3iob h ASP 174 N 0.00 0.27 -0.66 0.00 3.32 -0.64 -2.85 116.42 115.85 3iob h ASP 174 Ca 0.04 -0.10 0.00 0.00 0.02 0.00 0.00 57.03 56.99 3iob h ASP 174 Cb 0.22 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 39.70 3iob h ASP 174 CO -0.00 0.61 0.00 0.49 -1.72 0.00 0.00 179.24 178.62 3iob n PHE 175 N -4.07 0.89 -3.33 4.55 3.72 -0.54 -4.96 117.46 113.71 3iob n PHE 175 Ca -0.01 -0.50 -0.24 0.00 -0.05 0.00 0.00 57.45 56.65 3iob n PHE 175 Cb 0.44 -0.01 0.05 0.00 -0.94 0.00 0.00 39.48 39.02 3iob n PHE 175 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 3iob n ASN 176 N 1.43 -6.01 -4.75 4.37 4.13 -0.99 -4.94 115.26 108.50 3iob n ASN 176 Ca 0.22 -0.43 -0.41 0.00 1.68 0.00 0.00 54.58 55.64 3iob n ASN 176 Cb 0.59 -4.80 -0.03 0.00 -1.54 0.00 0.00 39.78 34.00 3iob n ASN 176 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 3iob s LEU 177 N -6.97 4.44 -1.18 3.41 1.43 -0.34 -4.96 118.68 114.52 3iob s LEU 177 Ca 0.45 2.45 -0.08 0.00 -1.03 0.00 0.00 54.13 55.92 3iob s LEU 177 Cb -0.20 -3.62 0.24 0.00 0.03 0.00 0.00 46.19 42.63 3iob s LEU 177 CO 0.55 -0.45 1.59 -0.67 0.23 0.00 0.00 176.35 177.60 3iob n ASP 178 N 1.87 5.68 -3.70 2.29 2.03 -1.26 -4.86 116.55 118.61 3iob n ASP 178 Ca 0.03 -3.21 -0.14 0.00 0.52 0.00 0.00 54.79 51.99 3iob n ASP 178 Cb 0.43 -1.40 -0.09 0.00 -0.72 0.00 0.00 41.12 39.35 3iob n ASP 178 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 3iob s VAL 179 N -0.91 0.02 -0.14 5.18 0.11 -1.26 -4.86 120.40 118.54 3iob s VAL 179 Ca 0.36 -0.18 -0.16 0.00 -2.93 0.00 0.00 61.98 59.07 3iob s VAL 179 Cb 0.04 -0.70 -0.04 0.00 -1.53 0.00 0.00 36.38 34.15 3iob s VAL 179 CO 0.03 -0.10 0.38 0.00 -3.33 0.00 0.00 175.10 172.09 3iob s ALA 180 N -0.60 3.53 -0.20 1.54 0.00 -0.81 -4.97 121.76 120.26 3iob s ALA 180 Ca -0.07 -0.32 -0.16 0.00 0.00 0.00 0.00 51.96 51.41 3iob s ALA 180 Cb -0.03 -2.52 -0.04 0.00 0.00 0.00 0.00 23.12 20.53 3iob s ALA 180 CO 0.04 0.05 0.39 0.08 0.00 0.00 0.00 175.76 176.32 3iob s VAL 181 N 0.53 5.21 -0.20 0.00 1.01 -1.26 -1.07 120.40 124.61 3iob s VAL 181 Ca 0.21 0.69 -0.02 0.00 0.00 0.00 0.00 61.98 62.86 3iob s VAL 181 Cb -0.14 -3.72 0.00 0.00 0.00 0.00 0.00 36.38 32.52 3iob s VAL 181 CO 0.07 0.26 -0.12 -0.69 0.00 0.00 0.00 175.10 174.62 3iob s VAL 182 N 1.29 2.77 -0.02 2.92 1.01 0.19 -4.96 120.40 123.60 3iob s VAL 182 Ca 0.19 -0.70 -0.23 0.00 0.00 0.00 0.00 61.98 61.24 3iob s VAL 182 Cb -0.15 -2.22 -0.05 0.00 0.00 0.00 0.00 36.38 33.97 3iob s VAL 182 CO 0.08 0.48 0.68 -0.83 0.00 0.00 0.00 175.10 175.51 3iob s GLY 183 N 1.35 2.66 -0.14 4.51 0.00 -1.26 -1.67 107.32 112.77 3iob s GLY 183 Ca 0.05 0.14 -0.01 0.00 0.00 0.00 0.00 44.72 44.89 3iob s GLY 183 CO -0.07 1.03 -0.11 0.14 0.00 0.00 0.00 173.10 174.09 3iob s VAL 184 N 0.30 3.19 0.53 1.40 1.01 0.39 -4.89 120.40 122.33 3iob s VAL 184 Ca 0.36 -0.61 -0.22 0.00 0.00 0.00 0.00 61.98 61.51 3iob s VAL 184 Cb -0.18 -2.36 -0.06 0.00 0.00 0.00 0.00 36.38 33.78 3iob s VAL 184 CO 0.19 0.51 1.22 -2.65 0.00 0.00 0.00 175.10 174.38 3iob n PRO 185 N 3.62 1.52 -1.78 2.72 -0.02 -1.26 -0.15 135.00 139.65 3iob n PRO 185 Ca -0.18 0.56 -0.42 0.00 -2.02 0.00 0.00 63.50 61.44 3iob n PRO 185 Cb 0.53 -2.40 -0.03 0.00 -0.02 0.00 0.00 33.50 31.57 3iob n PRO 185 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 3iob s THR 186 N -1.32 2.27 0.05 3.45 2.01 -1.26 -4.72 115.64 116.11 3iob s THR 186 Ca 0.70 0.13 -0.25 0.00 0.31 0.00 0.00 61.69 62.57 3iob s THR 186 Cb -0.44 -3.08 -0.05 0.00 0.01 0.00 0.00 72.50 68.93 3iob s THR 186 CO 0.51 0.01 0.79 -0.69 -0.69 0.00 0.00 174.62 174.54 3iob s VAL 187 N 1.48 4.71 0.12 3.82 1.01 -1.26 -5.01 120.40 125.27 3iob s VAL 187 Ca 0.75 1.67 0.08 0.00 0.00 0.00 0.00 61.98 64.48 3iob s VAL 187 Cb -0.48 -4.14 -0.04 0.00 0.00 0.00 0.00 36.38 31.73 3iob s VAL 187 CO 0.33 0.36 -0.19 -0.13 0.00 0.00 0.00 175.10 175.46 3iob s ARG 188 N -0.03 1.12 1.07 2.72 0.52 -1.26 -1.18 118.95 121.91 3iob s ARG 188 Ca 0.39 -1.21 -0.15 0.00 -0.52 0.00 0.00 55.73 54.24 3iob s ARG 188 Cb -0.21 -1.27 0.22 0.00 0.52 0.00 0.00 34.95 34.22 3iob s ARG 188 CO 0.24 0.28 1.11 -1.21 0.02 0.00 0.00 175.30 175.74 3iob s GLU 189 N -2.18 -0.17 0.49 3.54 0.41 0.39 -4.87 118.70 116.31 3iob s GLU 189 Ca 0.08 0.22 0.14 0.00 -0.41 0.00 0.00 54.97 55.00 3iob s GLU 189 Cb -0.08 -1.69 1.17 0.00 -1.78 0.00 0.00 34.13 31.74 3iob s GLU 189 CO 0.05 -3.07 2.12 0.00 -0.49 0.00 0.00 175.26 173.86 3iob h ALA 190 N -2.13 1.95 -0.11 5.21 0.00 -2.01 -1.05 119.26 121.12 3iob h ALA 190 Ca -0.50 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.40 3iob h ALA 190 Cb 1.32 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.06 3iob h ALA 190 CO 0.49 0.03 0.00 -0.40 0.00 0.00 0.00 179.25 179.37 3iob n ASP 191 N -4.51 1.73 0.00 0.00 5.68 -1.26 -4.92 116.55 113.27 3iob n ASP 191 Ca -0.00 -1.64 0.00 0.00 -0.50 0.00 0.00 54.79 52.64 3iob n ASP 191 Cb 0.12 -0.06 0.00 0.00 -1.14 0.00 0.00 41.12 40.03 3iob n ASP 191 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3iob n GLY 192 N 1.18 2.61 3.70 6.12 0.00 -0.40 -4.88 105.19 113.52 3iob n GLY 192 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 3iob n GLY 192 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3iob s LEU 193 N 0.00 4.38 0.23 0.99 2.96 -1.26 -4.59 118.68 121.40 3iob s LEU 193 Ca 0.00 2.69 -0.31 0.00 -0.22 0.00 0.00 54.13 56.29 3iob s LEU 193 Cb 0.00 -3.58 -0.12 0.00 0.50 0.00 0.00 46.19 42.99 3iob s LEU 193 CO 0.00 -0.94 1.70 0.00 -1.32 0.00 0.00 176.35 175.78 3iob n ALA 194 N 5.05 2.81 -1.91 5.97 0.00 -1.26 -0.46 120.51 130.71 3iob n ALA 194 Ca 0.16 0.39 -0.41 0.00 0.00 0.00 0.00 53.44 53.58 3iob n ALA 194 Cb 0.38 -2.51 -0.03 0.00 0.00 0.00 0.00 19.45 17.29 3iob n ALA 194 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 3iob s MET 195 N 0.72 4.34 -0.19 0.00 -1.94 -0.33 -4.83 119.30 117.06 3iob s MET 195 Ca 0.72 2.18 -0.26 0.00 -1.71 0.00 0.00 55.69 56.62 3iob s MET 195 Cb -0.50 -3.14 0.07 0.00 2.01 0.00 0.00 34.83 33.27 3iob s MET 195 CO 0.37 -0.30 0.68 0.45 -0.01 0.00 0.00 175.02 176.21 3iob s SER 196 N 0.19 -0.69 0.56 3.03 0.15 -1.26 -4.94 113.70 110.73 3iob s SER 196 Ca 0.56 1.16 0.24 0.00 0.70 0.00 0.00 55.95 58.61 3iob s SER 196 Cb -0.39 1.12 1.59 0.00 -1.71 0.00 0.00 66.02 66.64 3iob s SER 196 CO 0.43 -0.36 2.21 0.77 1.20 0.00 0.00 173.24 177.49 3iob h SER 197 N 4.38 0.00 0.94 5.45 4.64 -1.94 -2.31 113.55 124.71 3iob h SER 197 Ca -0.28 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.03 3iob h SER 197 Cb 1.16 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.24 3iob h SER 197 CO 0.17 0.00 -0.04 0.03 -0.87 0.00 0.00 176.83 176.13 3iob h ARG 198 N 0.00 0.00 -0.37 4.77 3.08 -1.96 -3.24 114.38 116.65 3iob h ARG 198 Ca -0.00 0.00 0.08 0.00 0.07 0.00 0.00 59.98 60.13 3iob h ARG 198 Cb 0.01 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.04 3iob h ARG 198 CO 0.00 0.04 0.26 -0.91 -1.07 0.00 0.00 179.97 178.29 3iob h ASN 199 N 0.00 0.15 0.92 7.04 2.35 -1.79 -1.73 115.58 122.51 3iob h ASN 199 Ca -0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 3iob h ASN 199 Cb 0.52 -0.03 0.00 0.00 0.05 0.00 0.00 38.32 38.86 3iob h ASN 199 CO 0.01 0.09 0.00 0.08 -1.65 0.00 0.00 177.43 175.96 3iob h ARG 200 N 0.17 0.00 0.00 0.81 0.11 -1.78 -2.33 114.38 111.36 3iob h ARG 200 Ca 0.17 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.25 3iob h ARG 200 Cb 0.47 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.55 3iob h ARG 200 CO -0.03 0.00 0.00 1.88 0.10 0.00 0.00 179.97 181.92 3iob h TYR 201 N 0.00 0.00 -3.26 4.08 0.05 -1.56 -3.45 116.97 112.83 3iob h TYR 201 Ca 0.00 0.00 -0.53 0.00 0.05 0.00 0.00 58.73 58.25 3iob h TYR 201 Cb 0.46 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 38.20 3iob h TYR 201 CO 0.00 0.00 0.52 -0.51 -1.05 0.00 0.00 178.16 177.12 3iob s LEU 202 N -4.88 4.38 0.93 3.88 1.43 -0.88 -5.04 118.68 118.50 3iob s LEU 202 Ca 0.06 1.96 -0.12 0.00 -1.03 0.00 0.00 54.13 55.00 3iob s LEU 202 Cb 0.10 -3.58 0.15 0.00 0.03 0.00 0.00 46.19 42.89 3iob s LEU 202 CO 0.51 -0.41 1.12 1.51 0.23 0.00 0.00 176.35 179.32 3iob s ASP 203 N 0.96 3.29 0.24 2.29 1.47 -1.26 -4.63 116.67 119.03 3iob s ASP 203 Ca 0.57 1.04 -0.05 0.00 1.18 0.00 0.00 52.55 55.29 3iob s ASP 203 Cb -0.28 -1.65 0.41 0.00 -0.34 0.00 0.00 42.92 41.06 3iob s ASP 203 CO 0.29 -2.70 1.78 -0.65 0.68 0.00 0.00 175.17 174.58 3iob h PRO 204 N -1.60 0.64 -0.62 2.11 0.11 -1.98 0.40 132.00 131.06 3iob h PRO 204 Ca -0.52 -0.04 -0.07 0.00 0.11 0.00 0.00 66.00 65.49 3iob h PRO 204 Cb 1.33 -0.15 -0.03 0.00 0.11 0.00 0.00 31.00 32.27 3iob h PRO 204 CO 0.61 0.43 0.13 0.00 -0.21 0.00 0.00 178.00 178.95 3iob h ALA 205 N 1.47 0.83 -0.29 -0.75 0.00 -1.99 -1.23 119.26 117.29 3iob h ALA 205 Ca 0.39 -0.25 -0.18 0.00 0.00 0.00 0.00 54.91 54.87 3iob h ALA 205 Cb 0.44 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.99 3iob h ALA 205 CO -0.29 0.56 -0.54 1.96 0.00 0.00 0.00 179.25 180.95 3iob h GLN 206 N 0.93 0.87 -0.46 0.00 4.20 -1.70 -1.22 115.11 117.73 3iob h GLN 206 Ca 0.19 -0.54 -0.08 0.00 0.06 0.00 0.00 58.65 58.29 3iob h GLN 206 Cb 0.39 0.06 -0.02 0.00 0.30 0.00 0.00 27.48 28.21 3iob h GLN 206 CO 0.01 1.18 -0.02 -0.09 -0.67 0.00 0.00 178.83 179.23 3iob h ARG 207 N 0.67 0.76 -0.48 1.46 9.65 -0.09 0.57 114.38 126.92 3iob h ARG 207 Ca 0.02 -0.21 -0.10 0.00 -1.10 0.00 0.00 59.98 58.58 3iob h ARG 207 Cb 1.14 -0.09 -0.02 0.00 -1.39 0.00 0.00 29.97 29.62 3iob h ARG 207 CO 0.12 0.79 -0.10 0.00 2.80 0.00 0.00 179.97 183.58 3iob h ALA 208 N 1.26 0.65 0.00 2.80 0.00 -1.13 -3.12 119.26 119.73 3iob h ALA 208 Ca 0.14 -0.33 -0.11 0.00 0.00 0.00 0.00 54.91 54.61 3iob h ALA 208 Cb 0.47 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 3iob h ALA 208 CO 0.02 0.54 -0.51 0.00 0.00 0.00 0.00 179.25 179.30 3iob h ALA 209 N 0.89 1.10 0.00 0.00 0.00 -0.75 -3.13 119.26 117.37 3iob h ALA 209 Ca 0.12 -0.46 -0.00 0.00 0.00 0.00 0.00 54.91 54.56 3iob h ALA 209 Cb 0.64 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.35 3iob h ALA 209 CO 0.04 0.64 -0.01 0.00 0.00 0.00 0.00 179.25 179.92 3iob h ALA 210 N 1.49 1.05 -0.04 0.00 0.00 -0.83 -1.62 119.26 119.31 3iob h ALA 210 Ca -0.01 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.90 3iob h ALA 210 Cb 0.94 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.72 3iob h ALA 210 CO 0.07 0.02 0.05 -0.24 0.00 0.00 0.00 179.25 179.14 3iob h VAL 211 N 0.00 0.44 -0.24 0.00 3.04 -1.64 -2.81 116.25 115.03 3iob h VAL 211 Ca -0.00 0.00 0.03 0.00 -1.01 0.00 0.00 66.70 65.72 3iob h VAL 211 Cb 0.21 0.96 -0.01 0.00 -2.01 0.00 0.00 31.29 30.43 3iob h VAL 211 CO 0.00 0.00 0.16 0.00 -1.01 0.00 0.00 177.57 176.73 3iob h ALA 212 N 1.94 1.99 0.63 3.17 0.00 -1.52 -1.98 119.26 123.48 3iob h ALA 212 Ca 0.02 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 3iob h ALA 212 Cb 0.11 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 3iob h ALA 212 CO -0.00 -0.03 -0.41 -0.07 0.00 0.00 0.00 179.25 178.74 3iob h LEU 213 N 0.19 -1.06 -0.65 0.00 4.07 -1.73 0.15 115.31 116.28 3iob h LEU 213 Ca 0.10 0.07 -0.12 0.00 0.08 0.00 0.00 57.88 58.01 3iob h LEU 213 Cb 0.17 0.32 -0.01 0.00 1.08 0.00 0.00 40.66 42.21 3iob h LEU 213 CO -0.02 -0.63 -0.24 0.77 -1.08 0.00 0.00 178.44 177.24 3iob h SER 214 N -0.99 0.81 -0.59 -0.43 4.64 -1.74 -2.17 113.55 113.08 3iob h SER 214 Ca -0.08 -0.30 -0.03 0.00 -0.47 0.00 0.00 61.79 60.92 3iob h SER 214 Cb 0.81 -0.22 -0.03 0.00 -0.31 0.00 0.00 62.40 62.65 3iob h SER 214 CO 0.06 1.02 0.27 0.00 -0.87 0.00 0.00 176.83 177.30 3iob h ALA 215 N 1.04 0.76 -0.59 5.18 0.00 -1.35 -1.23 119.26 123.08 3iob h ALA 215 Ca 0.09 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 54.86 3iob h ALA 215 Cb 0.76 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 18.29 3iob h ALA 215 CO 0.06 0.34 0.36 0.00 0.00 0.00 0.00 179.25 180.02 3iob h ALA 216 N 1.10 0.75 -0.16 0.00 0.00 -0.53 -1.33 119.26 119.09 3iob h ALA 216 Ca 0.20 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 55.01 3iob h ALA 216 Cb 0.15 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.70 3iob h ALA 216 CO -0.02 0.21 -0.04 -0.07 0.00 0.00 0.00 179.25 179.33 3iob h LEU 217 N 0.79 0.31 -0.89 0.00 3.38 -1.14 -0.82 115.31 116.95 3iob h LEU 217 Ca 0.21 -0.38 -0.07 0.00 0.09 0.00 0.00 57.88 57.74 3iob h LEU 217 Cb -0.04 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 40.60 3iob h LEU 217 CO -0.04 0.61 0.10 0.71 0.09 0.00 0.00 178.44 179.91 3iob h THR 218 N 0.00 1.24 -0.29 0.22 1.35 -1.24 -0.40 112.91 113.80 3iob h THR 218 Ca 0.04 -0.94 -0.00 0.00 -0.55 0.00 0.00 66.41 64.96 3iob h THR 218 Cb 0.48 0.70 -0.01 0.00 -1.73 0.00 0.00 68.15 67.58 3iob h THR 218 CO 0.02 0.35 0.18 0.00 -0.25 0.00 0.00 175.52 175.81 3iob h ALA 219 N 1.23 0.36 -0.70 6.62 0.00 -1.14 -2.55 119.26 123.09 3iob h ALA 219 Ca 0.18 -0.04 0.04 0.00 0.00 0.00 0.00 54.91 55.09 3iob h ALA 219 Cb 0.38 -0.12 -0.05 0.00 0.00 0.00 0.00 17.79 18.00 3iob h ALA 219 CO 0.01 -0.14 0.42 0.00 0.00 0.00 0.00 179.25 179.54 3iob h ALA 220 N 1.07 0.92 -0.68 0.00 0.00 -0.80 0.51 119.26 120.28 3iob h ALA 220 Ca 0.10 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 55.02 3iob h ALA 220 Cb 0.00 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.56 3iob h ALA 220 CO -0.02 0.16 0.45 0.00 0.00 0.00 0.00 179.25 179.84 3iob h ALA 221 N 1.32 1.55 0.00 0.00 0.00 -0.74 -1.54 119.26 119.85 3iob h ALA 221 Ca 0.29 -0.04 -0.23 0.00 0.00 0.00 0.00 54.91 54.93 3iob h ALA 221 Cb 0.08 -0.26 -0.04 0.00 0.00 0.00 0.00 17.79 17.57 3iob h ALA 221 CO -0.14 0.41 -1.31 0.45 0.00 0.00 0.00 179.25 178.66 3iob h HIS 222 N 0.89 0.00 0.00 0.00 3.86 -1.09 -3.22 115.15 115.60 3iob h HIS 222 Ca 0.26 0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 59.46 3iob h HIS 222 Cb -0.05 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 28.42 3iob h HIS 222 CO -0.00 0.91 -0.03 0.00 0.86 0.00 0.00 177.93 179.67 3iob h ALA 223 N 1.09 1.03 0.00 2.45 0.00 -0.46 -3.31 119.26 120.06 3iob h ALA 223 Ca -0.14 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.74 3iob h ALA 223 Cb 1.82 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.61 3iob h ALA 223 CO 0.09 0.04 0.00 0.00 0.00 0.00 0.00 179.25 179.38 3iob h ALA 224 N 1.97 1.00 -0.27 0.00 0.00 -1.30 0.07 119.26 120.73 3iob h ALA 224 Ca -0.00 0.00 0.08 0.00 0.00 0.00 0.00 54.91 54.99 3iob h ALA 224 Cb 0.41 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 3iob h ALA 224 CO 0.00 0.00 0.26 1.79 0.00 0.00 0.00 179.25 181.31 3iob h THR 225 N 0.00 0.53 -0.24 0.00 1.35 -1.75 -0.81 112.91 112.00 3iob h THR 225 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.86 3iob h THR 225 Cb 0.20 0.80 0.00 0.00 -1.73 0.00 0.00 68.15 67.41 3iob h THR 225 CO 0.00 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 175.27 3iob n ALA 226 N -2.40 2.49 0.00 6.62 0.00 0.01 -4.50 120.51 122.73 3iob n ALA 226 Ca 0.04 -0.65 0.00 0.00 0.00 0.00 0.00 53.44 52.82 3iob n ALA 226 Cb 0.41 -1.02 0.00 0.00 0.00 0.00 0.00 19.45 18.84 3iob n ALA 226 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3iob n GLY 227 N 1.23 1.54 0.26 0.00 0.00 -0.47 -4.53 105.19 103.22 3iob n GLY 227 Ca 0.17 -2.13 -0.08 0.00 0.00 0.00 0.00 46.02 43.98 3iob n GLY 227 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3iob h ALA 228 N 0.00 0.74 -0.60 4.61 0.00 -1.92 -2.02 119.26 120.08 3iob h ALA 228 Ca 0.00 -0.17 -0.10 0.00 0.00 0.00 0.00 54.91 54.64 3iob h ALA 228 Cb 0.00 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.55 3iob h ALA 228 CO 0.00 0.37 -0.00 0.37 0.00 0.00 0.00 179.25 179.99 3iob h GLN 229 N 0.79 1.05 -0.82 0.00 5.75 -1.98 -0.74 115.11 119.17 3iob h GLN 229 Ca 0.19 -0.33 -0.04 0.00 -0.15 0.00 0.00 58.65 58.32 3iob h GLN 229 Cb 0.22 -0.10 -0.04 0.00 1.07 0.00 0.00 27.48 28.64 3iob h GLN 229 CO -0.01 1.02 0.36 0.00 -2.65 0.00 0.00 178.83 177.55 3iob h ALA 230 N 1.03 1.06 -0.04 3.38 0.00 -1.74 0.74 119.26 123.68 3iob h ALA 230 Ca 0.17 -0.18 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 3iob h ALA 230 Cb 0.55 -0.32 -0.00 0.00 0.00 0.00 0.00 17.79 18.02 3iob h ALA 230 CO 0.03 0.65 0.01 0.00 0.00 0.00 0.00 179.25 179.94 3iob h ALA 231 N 1.19 0.05 -0.83 0.00 0.00 -0.98 -0.66 119.26 118.04 3iob h ALA 231 Ca 0.28 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 55.02 3iob h ALA 231 Cb 0.16 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 17.90 3iob h ALA 231 CO -0.03 -0.31 0.39 -0.07 0.00 0.00 0.00 179.25 179.23 3iob h LEU 232 N -0.18 1.09 -0.53 0.00 3.38 -0.91 -1.92 115.31 116.24 3iob h LEU 232 Ca 0.01 -0.14 -0.13 0.00 0.09 0.00 0.00 57.88 57.71 3iob h LEU 232 Cb 0.27 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.72 3iob h LEU 232 CO 0.00 0.92 -0.22 0.44 0.09 0.00 0.00 178.44 179.68 3iob h ASP 233 N 1.18 0.99 -0.48 -0.43 3.32 -0.74 -0.96 116.42 119.30 3iob h ASP 233 Ca 0.28 -0.37 -0.02 0.00 0.02 0.00 0.00 57.03 56.94 3iob h ASP 233 Cb 0.13 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.39 3iob h ASP 233 CO -0.03 1.16 0.22 0.00 -1.72 0.00 0.00 179.24 178.86 3iob h ALA 234 N 0.91 0.62 -0.51 3.45 0.00 -0.91 -1.09 119.26 121.72 3iob h ALA 234 Ca 0.11 -0.12 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 3iob h ALA 234 Cb 0.79 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.36 3iob h ALA 234 CO 0.07 0.19 0.21 0.00 0.00 0.00 0.00 179.25 179.72 3iob h ALA 235 N 1.06 0.66 -0.81 0.00 0.00 -1.17 -2.58 119.26 116.43 3iob h ALA 235 Ca 0.16 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 3iob h ALA 235 Cb 0.13 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 17.69 3iob h ALA 235 CO -0.02 0.26 0.42 -0.09 0.00 0.00 0.00 179.25 179.82 3iob h ARG 236 N 0.68 1.14 -0.44 0.00 9.65 -0.99 -2.03 114.38 122.40 3iob h ARG 236 Ca 0.17 -0.15 0.04 0.00 -1.10 0.00 0.00 59.98 58.94 3iob h ARG 236 Cb 0.18 -0.22 -0.04 0.00 -1.39 0.00 0.00 29.97 28.50 3iob h ARG 236 CO -0.02 0.86 0.20 0.00 2.80 0.00 0.00 179.97 183.81 3iob h ALA 237 N 1.22 0.54 -0.14 2.80 0.00 -1.02 0.26 119.26 122.92 3iob h ALA 237 Ca 0.28 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.21 3iob h ALA 237 Cb 0.07 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 3iob h ALA 237 CO -0.04 -0.17 0.07 0.28 0.00 0.00 0.00 179.25 179.39 3iob h VAL 238 N 0.40 1.12 -0.71 0.00 2.07 -1.09 -2.35 116.25 115.70 3iob h VAL 238 Ca 0.20 -0.35 -0.00 0.00 0.82 0.00 0.00 66.70 67.37 3iob h VAL 238 Cb 0.13 1.09 -0.03 0.00 -1.52 0.00 0.00 31.29 30.96 3iob h VAL 238 CO -0.16 0.11 0.43 -0.07 0.02 0.00 0.00 177.57 177.90 3iob h LEU 239 N 0.10 0.84 -1.48 2.57 3.38 -1.20 -1.78 115.31 117.75 3iob h LEU 239 Ca 0.05 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3iob h LEU 239 Cb 0.11 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 40.65 3iob h LEU 239 CO -0.01 0.64 0.00 0.44 0.09 0.00 0.00 178.44 179.61 3iob h ASP 240 N 0.97 0.00 0.02 -0.43 3.32 -0.08 -2.49 116.42 117.72 3iob h ASP 240 Ca 0.25 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.30 3iob h ASP 240 Cb -0.04 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.51 3iob h ASP 240 CO -0.05 0.00 -0.03 0.00 -1.72 0.00 0.00 179.24 177.44 3iob n ALA 241 N -1.87 2.64 -2.79 3.45 0.00 -0.67 -4.88 120.51 116.38 3iob n ALA 241 Ca -0.00 -0.44 -0.35 0.00 0.00 0.00 0.00 53.44 52.65 3iob n ALA 241 Cb 0.14 -1.16 -0.09 0.00 0.00 0.00 0.00 19.45 18.33 3iob n ALA 241 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3iob s ALA 242 N -2.07 3.41 0.28 0.00 0.00 -0.94 -5.10 121.76 117.35 3iob s ALA 242 Ca 0.36 -0.75 -0.16 0.00 0.00 0.00 0.00 51.96 51.41 3iob s ALA 242 Cb 0.21 -1.74 -0.09 0.00 0.00 0.00 0.00 23.12 21.50 3iob s ALA 242 CO 0.36 0.41 0.72 -1.25 0.00 0.00 0.00 175.76 175.99 3iob s PRO 243 N -0.33 4.06 -1.20 0.00 0.04 -1.26 -4.28 135.00 132.03 3iob s PRO 243 Ca 0.08 0.70 0.00 0.00 0.04 0.00 0.00 61.00 61.82 3iob s PRO 243 Cb -0.12 -2.58 0.00 0.00 0.04 0.00 0.00 34.50 31.84 3iob s PRO 243 CO 0.02 0.24 0.00 0.41 0.04 0.00 0.00 177.00 177.71 3iob n GLY 244 N -0.02 0.08 3.07 0.56 0.00 -1.26 -4.87 105.19 102.76 3iob n GLY 244 Ca 0.01 -0.33 -0.33 0.00 0.00 0.00 0.00 46.02 45.38 3iob n GLY 244 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3iob s VAL 245 N -2.65 2.49 -0.58 1.61 1.01 -1.26 -4.37 120.40 116.66 3iob s VAL 245 Ca 0.00 -2.02 -0.20 0.00 0.00 0.00 0.00 61.98 59.76 3iob s VAL 245 Cb 0.00 -2.68 0.08 0.00 0.00 0.00 0.00 36.38 33.78 3iob s VAL 245 CO 0.00 -0.42 0.73 0.00 0.00 0.00 0.00 175.10 175.41 3iob s ALA 246 N 1.03 3.35 -0.11 5.51 0.00 -0.49 -4.92 121.76 126.13 3iob s ALA 246 Ca 0.04 -2.01 -0.29 0.00 0.00 0.00 0.00 51.96 49.69 3iob s ALA 246 Cb -0.20 -3.54 -0.03 0.00 0.00 0.00 0.00 23.12 19.35 3iob s ALA 246 CO -0.06 -2.33 1.36 0.08 0.00 0.00 0.00 175.76 174.81 3iob s VAL 247 N 2.93 4.06 -0.04 0.00 1.01 -1.26 -0.63 120.40 126.46 3iob s VAL 247 Ca 0.15 1.30 -0.13 0.00 0.00 0.00 0.00 61.98 63.30 3iob s VAL 247 Cb -0.21 -3.84 -0.31 0.00 0.00 0.00 0.00 36.38 32.01 3iob s VAL 247 CO 0.09 -0.10 0.73 0.44 0.00 0.00 0.00 175.10 176.26 3iob h ASP 248 N 8.43 0.63 -5.02 3.32 3.32 -0.90 -3.48 116.42 122.71 3iob h ASP 248 Ca -0.31 -0.92 -0.04 0.00 0.02 0.00 0.00 57.03 55.78 3iob h ASP 248 Cb 1.13 -0.20 -0.13 0.00 0.22 0.00 0.00 39.33 40.34 3iob h ASP 248 CO 0.95 1.73 0.11 -0.72 -1.72 0.00 0.00 179.24 179.60 3iob s TYR 249 N -2.56 -0.45 -0.22 4.55 -0.85 -1.15 -4.99 117.35 111.68 3iob s TYR 249 Ca -0.15 0.30 -0.03 0.00 -0.52 0.00 0.00 57.07 56.67 3iob s TYR 249 Cb 0.05 0.44 0.10 0.00 0.38 0.00 0.00 41.96 42.93 3iob s TYR 249 CO 0.86 -0.77 0.24 -1.17 -1.52 0.00 0.00 175.55 173.20 3iob s LEU 250 N -2.54 -0.15 -0.02 -3.49 2.96 -1.26 -1.91 118.68 112.27 3iob s LEU 250 Ca -0.00 -0.29 0.01 0.00 -0.22 0.00 0.00 54.13 53.62 3iob s LEU 250 Cb -0.00 0.44 0.01 0.00 0.50 0.00 0.00 46.19 47.15 3iob s LEU 250 CO -0.09 -0.34 -0.02 -1.61 -1.32 0.00 0.00 176.35 172.97 3iob s GLU 251 N 2.34 0.33 -0.21 1.98 2.02 -0.35 -4.98 118.70 119.83 3iob s GLU 251 Ca 0.08 -0.02 -0.08 0.00 0.02 0.00 0.00 54.97 54.97 3iob s GLU 251 Cb -0.15 -0.42 -0.04 0.00 0.10 0.00 0.00 34.13 33.61 3iob s GLU 251 CO -0.16 -0.05 0.10 -1.17 0.02 0.00 0.00 175.26 174.00 3iob s LEU 252 N 0.57 3.86 0.28 1.80 2.96 -1.26 -0.93 118.68 125.96 3iob s LEU 252 Ca -0.06 0.05 0.02 0.00 -0.22 0.00 0.00 54.13 53.92 3iob s LEU 252 Cb -0.09 -2.01 -0.05 0.00 0.50 0.00 0.00 46.19 44.55 3iob s LEU 252 CO -0.01 0.10 0.11 -0.13 -1.32 0.00 0.00 176.35 175.10 3iob s ARG 253 N 0.80 1.48 1.09 1.98 1.81 -0.10 -4.33 118.95 121.68 3iob s ARG 253 Ca 0.05 -1.82 -0.18 0.00 -1.72 0.00 0.00 55.73 52.07 3iob s ARG 253 Cb -0.13 -0.27 0.25 0.00 -0.45 0.00 0.00 34.95 34.35 3iob s ARG 253 CO 0.02 -0.33 1.21 0.16 -0.68 0.00 0.00 175.30 175.68 3iob s ASP 254 N -3.34 1.94 0.51 0.23 1.47 -0.09 -0.45 116.67 116.93 3iob s ASP 254 Ca 0.37 0.47 0.30 0.00 1.18 0.00 0.00 52.55 54.86 3iob s ASP 254 Cb 0.07 -0.62 1.25 0.00 -0.34 0.00 0.00 42.92 43.27 3iob s ASP 254 CO 0.15 -3.48 1.95 0.16 0.68 0.00 0.00 175.17 174.63 3iob h ILE 255 N -2.15 0.28 -0.52 2.11 3.07 -1.85 -0.40 117.51 118.06 3iob h ILE 255 Ca -0.45 -0.73 0.00 0.00 1.55 0.00 0.00 64.86 65.23 3iob h ILE 255 Cb 1.27 1.57 0.00 0.00 -0.27 0.00 0.00 36.82 39.39 3iob h ILE 255 CO 0.36 0.10 0.00 0.61 -1.05 0.00 0.00 178.15 178.17 3iob n GLY 256 N -0.05 1.52 2.33 0.16 0.00 -1.26 -4.93 105.19 102.96 3iob n GLY 256 Ca -0.00 -0.57 -0.08 0.00 0.00 0.00 0.00 46.02 45.36 3iob n GLY 256 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3iob n LEU 257 N 1.00 -0.51 0.00 0.99 4.77 -0.16 -5.04 117.00 118.06 3iob n LEU 257 Ca 0.18 0.20 -0.09 0.00 -0.03 0.00 0.00 56.01 56.27 3iob n LEU 257 Cb 0.47 -1.60 0.06 0.00 -2.33 0.00 0.00 43.42 40.02 3iob n LEU 257 CO 0.13 -0.52 0.27 0.61 -1.33 0.00 0.00 177.39 176.54 3iob n GLY 258 N -1.63 -1.26 3.78 -0.72 0.00 -1.26 -4.76 105.19 99.34 3iob n GLY 258 Ca -0.08 -1.68 -0.41 0.00 0.00 0.00 0.00 46.02 43.85 3iob n GLY 258 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3iob s PRO 259 N -3.88 4.14 0.10 1.61 0.02 -1.26 -0.91 135.00 134.83 3iob s PRO 259 Ca 0.23 2.50 -0.31 0.00 0.02 0.00 0.00 61.00 63.44 3iob s PRO 259 Cb -0.01 -2.97 -0.09 0.00 0.02 0.00 0.00 34.50 31.45 3iob s PRO 259 CO 0.16 -0.48 1.66 1.41 -0.33 0.00 0.00 177.00 179.41 3iob s MET 260 N -2.06 4.19 1.06 5.54 1.75 -1.26 -3.88 119.30 124.64 3iob s MET 260 Ca 0.52 2.38 -0.13 0.00 -1.25 0.00 0.00 55.69 57.22 3iob s MET 260 Cb -0.45 -3.47 0.22 0.00 2.84 0.00 0.00 34.83 33.97 3iob s MET 260 CO 0.61 -0.72 1.07 -1.25 -0.65 0.00 0.00 175.02 174.09 3iob s PRO 261 N 2.22 -0.08 0.24 4.11 0.04 -1.26 -4.91 135.00 135.37 3iob s PRO 261 Ca 0.74 0.60 -0.03 0.00 0.04 0.00 0.00 61.00 62.36 3iob s PRO 261 Cb -0.42 -1.67 0.28 0.00 0.04 0.00 0.00 34.50 32.73 3iob s PRO 261 CO 0.32 -3.10 1.72 -0.07 0.04 0.00 0.00 177.00 175.92 3iob h LEU 262 N -2.16 0.77 -8.57 -3.56 3.38 -2.00 -3.45 115.31 99.73 3iob h LEU 262 Ca -0.57 -0.21 -0.23 0.00 0.09 0.00 0.00 57.88 56.95 3iob h LEU 262 Cb 1.33 -0.21 -0.15 0.00 0.09 0.00 0.00 40.66 41.73 3iob h LEU 262 CO 0.55 0.88 -0.63 0.54 0.09 0.00 0.00 178.44 179.87 3iob s ASN 263 N -6.67 0.33 0.00 -0.43 6.03 -1.26 -4.92 114.94 108.01 3iob s ASN 263 Ca -0.09 -1.32 0.00 0.00 -1.03 0.00 0.00 52.86 50.41 3iob s ASN 263 Cb 0.14 0.32 0.00 0.00 -3.03 0.00 0.00 41.25 38.69 3iob s ASN 263 CO 0.82 -0.78 0.00 0.61 -2.03 0.00 0.00 177.10 175.71 3iob n GLY 264 N -0.23 -0.93 3.80 0.45 0.00 -1.25 -4.94 105.19 102.10 3iob n GLY 264 Ca -0.01 -2.13 -0.37 0.00 0.00 0.00 0.00 46.02 43.51 3iob n GLY 264 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3iob s SER 265 N -4.00 7.14 0.13 1.61 0.01 -1.26 -1.23 113.70 116.10 3iob s SER 265 Ca 0.00 1.44 0.00 0.00 1.31 0.00 0.00 55.95 58.70 3iob s SER 265 Cb 0.00 -2.42 -0.00 0.00 0.21 0.00 0.00 66.02 63.80 3iob s SER 265 CO 0.00 0.13 0.17 0.61 0.41 0.00 0.00 173.24 174.56 3iob n GLY 266 N 1.16 3.00 2.84 3.44 0.00 0.94 -4.08 105.19 112.49 3iob n GLY 266 Ca -0.05 -1.56 -0.16 0.00 0.00 0.00 0.00 46.02 44.25 3iob n GLY 266 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3iob s ARG 267 N -2.38 0.26 -0.18 1.61 6.06 0.40 -1.49 118.95 123.22 3iob s ARG 267 Ca 0.13 0.04 -0.06 0.00 -2.50 0.00 0.00 55.73 53.34 3iob s ARG 267 Cb -0.00 -0.40 -0.04 0.00 0.06 0.00 0.00 34.95 34.57 3iob s ARG 267 CO 0.09 -0.09 0.03 -1.17 -2.50 0.00 0.00 175.30 171.66 3iob s LEU 268 N 0.77 3.59 0.01 -0.88 2.96 -0.36 -0.93 118.68 123.85 3iob s LEU 268 Ca -0.08 -0.02 0.07 0.00 -0.22 0.00 0.00 54.13 53.88 3iob s LEU 268 Cb -0.11 -1.91 -0.02 0.00 0.50 0.00 0.00 46.19 44.66 3iob s LEU 268 CO -0.01 0.14 -0.23 -0.76 -1.32 0.00 0.00 176.35 174.17 3iob s LEU 269 N 0.56 2.10 0.03 -0.68 1.02 -0.11 -1.25 118.68 120.35 3iob s LEU 269 Ca 0.01 -0.47 0.02 0.00 0.02 0.00 0.00 54.13 53.71 3iob s LEU 269 Cb -0.13 -1.13 -0.02 0.00 0.02 0.00 0.00 46.19 44.93 3iob s LEU 269 CO 0.02 0.24 -0.07 0.54 0.02 0.00 0.00 176.35 177.10 3iob s VAL 270 N -0.65 0.48 -0.02 -1.59 0.11 -0.38 -1.22 120.40 117.15 3iob s VAL 270 Ca 0.09 -0.87 -0.03 0.00 -2.93 0.00 0.00 61.98 58.24 3iob s VAL 270 Cb -0.09 -0.53 0.00 0.00 -1.53 0.00 0.00 36.38 34.24 3iob s VAL 270 CO 0.00 -0.27 0.07 0.00 -3.33 0.00 0.00 175.10 171.57 3iob s ALA 271 N -1.09 -0.17 0.03 1.54 0.00 -0.80 -1.78 121.76 119.49 3iob s ALA 271 Ca -0.07 0.01 -0.12 0.00 0.00 0.00 0.00 51.96 51.77 3iob s ALA 271 Cb -0.08 -0.04 0.01 0.00 0.00 0.00 0.00 23.12 23.02 3iob s ALA 271 CO 0.00 -0.10 0.26 0.00 0.00 0.00 0.00 175.76 175.93 3iob s ALA 272 N -0.52 -0.56 -0.17 0.00 0.00 -0.58 -0.15 121.76 119.78 3iob s ALA 272 Ca -0.06 -0.07 -0.05 0.00 0.00 0.00 0.00 51.96 51.78 3iob s ALA 272 Cb -0.04 0.27 -0.03 0.00 0.00 0.00 0.00 23.12 23.32 3iob s ALA 272 CO 0.00 -0.37 -0.00 1.03 0.00 0.00 0.00 175.76 176.42 3iob s ARG 273 N -2.38 3.77 -0.36 0.00 0.52 0.20 -0.82 118.95 119.89 3iob s ARG 273 Ca -0.06 -0.46 0.01 0.00 -0.52 0.00 0.00 55.73 54.70 3iob s ARG 273 Cb -0.02 -3.02 0.10 0.00 0.52 0.00 0.00 34.95 32.53 3iob s ARG 273 CO -0.02 0.24 0.09 -0.51 0.02 0.00 0.00 175.30 175.12 3iob s LEU 274 N 0.40 4.82 0.00 2.53 1.02 0.50 -1.39 118.68 126.55 3iob s LEU 274 Ca -0.01 -2.03 0.00 0.00 0.02 0.00 0.00 54.13 52.11 3iob s LEU 274 Cb -0.14 -1.70 0.00 0.00 0.02 0.00 0.00 46.19 44.38 3iob s LEU 274 CO 0.02 -0.42 0.00 0.61 0.02 0.00 0.00 176.35 176.58 3iob n GLY 275 N 4.40 3.61 0.92 -3.19 0.00 -1.26 -1.64 105.19 108.03 3iob n GLY 275 Ca 0.00 -0.06 0.12 0.00 0.00 0.00 0.00 46.02 46.08 3iob n GLY 275 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3iob n THR 276 N 0.00 0.26 -3.66 2.61 -2.24 -1.26 -4.90 114.28 105.09 3iob n THR 276 Ca 0.00 -0.55 -0.37 0.00 -2.27 0.00 0.00 64.05 60.86 3iob n THR 276 Cb 0.00 0.96 -0.10 0.00 -2.10 0.00 0.00 70.33 69.09 3iob n THR 276 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 3iob s THR 277 N -1.74 5.24 -0.22 4.28 2.01 -0.65 -5.07 115.64 119.49 3iob s THR 277 Ca 0.34 0.14 -0.10 0.00 0.31 0.00 0.00 61.69 62.39 3iob s THR 277 Cb 0.21 -3.46 -0.05 0.00 0.01 0.00 0.00 72.50 69.21 3iob s THR 277 CO 0.30 0.31 0.13 -0.60 -0.69 0.00 0.00 174.62 174.07 3iob s ARG 278 N 1.34 4.06 0.13 4.92 3.52 -1.26 -0.37 118.95 131.27 3iob s ARG 278 Ca 0.07 -0.28 0.10 0.00 -0.13 0.00 0.00 55.73 55.48 3iob s ARG 278 Cb -0.15 -3.43 -0.04 0.00 -1.56 0.00 0.00 34.95 29.78 3iob s ARG 278 CO 0.07 0.16 -0.21 -0.51 -0.81 0.00 0.00 175.30 173.99 3iob s LEU 279 N 0.76 2.58 0.09 -0.88 1.43 0.00 -4.98 118.68 117.67 3iob s LEU 279 Ca 0.07 -0.63 0.05 0.00 -1.03 0.00 0.00 54.13 52.58 3iob s LEU 279 Cb -0.13 -1.43 -0.03 0.00 0.03 0.00 0.00 46.19 44.63 3iob s LEU 279 CO 0.02 0.17 -0.13 -0.76 0.23 0.00 0.00 176.35 175.89 3iob s LEU 280 N -2.15 2.34 0.21 1.79 1.43 -1.26 -1.53 118.68 119.51 3iob s LEU 280 Ca 0.17 -0.71 -0.20 0.00 -1.03 0.00 0.00 54.13 52.36 3iob s LEU 280 Cb -0.10 -0.44 0.04 0.00 0.03 0.00 0.00 46.19 45.71 3iob s LEU 280 CO 0.09 -0.15 0.62 -0.62 0.23 0.00 0.00 176.35 176.51 3iob s ASP 281 N -2.08 -0.36 0.15 2.29 -1.08 -0.74 -4.90 116.67 109.94 3iob s ASP 281 Ca 0.02 -0.37 -0.24 0.00 -0.52 0.00 0.00 52.55 51.44 3iob s ASP 281 Cb -0.07 0.64 0.07 0.00 -1.46 0.00 0.00 42.92 42.10 3iob s ASP 281 CO 0.02 -1.13 0.74 0.54 0.52 0.00 0.00 175.17 175.86 3iob s ASN 282 N -2.85 -0.41 -0.04 -0.34 2.20 -1.26 -1.25 114.94 111.00 3iob s ASN 282 Ca 0.07 -0.18 -0.20 0.00 -0.94 0.00 0.00 52.86 51.61 3iob s ASN 282 Cb -0.03 0.56 0.04 0.00 -2.00 0.00 0.00 41.25 39.83 3iob s ASN 282 CO -0.03 -0.96 0.45 -0.51 -2.94 0.00 0.00 177.10 173.11 3iob s ILE 283 N -3.58 0.03 0.33 0.54 2.07 -0.38 -4.99 121.20 115.23 3iob s ILE 283 Ca 0.05 -0.28 -0.29 0.00 -1.41 0.00 0.00 60.65 58.73 3iob s ILE 283 Cb -0.02 -0.75 -0.11 0.00 0.13 0.00 0.00 42.46 41.71 3iob s ILE 283 CO -0.06 -0.15 1.43 0.00 -1.91 0.00 0.00 174.94 174.24 3iob s ALA 284 N -1.17 3.57 -0.03 1.50 0.00 -1.26 -1.23 121.76 123.13 3iob s ALA 284 Ca -0.12 1.43 0.03 0.00 0.00 0.00 0.00 51.96 53.30 3iob s ALA 284 Cb -0.03 -3.56 0.00 0.00 0.00 0.00 0.00 23.12 19.53 3iob s ALA 284 CO 0.06 -0.86 -0.12 0.42 0.00 0.00 0.00 175.76 175.26 3iob s ILE 285 N -0.84 1.04 -0.19 0.00 -1.09 -0.56 -4.82 121.20 114.74 3iob s ILE 285 Ca 0.53 -0.50 -0.01 0.00 -2.23 0.00 0.00 60.65 58.45 3iob s ILE 285 Cb -0.44 -0.91 0.00 0.00 -1.58 0.00 0.00 42.46 39.54 3iob s ILE 285 CO 0.55 0.31 -0.13 -1.61 -1.23 0.00 0.00 174.94 172.83 3iob s GLU 286 N 0.16 3.19 -0.40 2.79 0.41 -1.26 -0.04 118.70 123.54 3iob s GLU 286 Ca -0.04 -0.73 -0.25 0.00 -0.41 0.00 0.00 54.97 53.54 3iob s GLU 286 Cb -0.10 -2.75 0.02 0.00 -1.78 0.00 0.00 34.13 29.52 3iob s GLU 286 CO 0.01 -0.15 0.90 0.42 -0.49 0.00 0.00 175.26 175.95 3iob s ILE 287 N 1.25 4.58 0.00 -1.63 -1.09 -0.37 -4.53 121.20 119.42 3iob s ILE 287 Ca 0.03 1.00 0.00 0.00 -2.23 0.00 0.00 60.65 59.45 3iob s ILE 287 Cb -0.14 -4.34 0.00 0.00 -1.58 0.00 0.00 42.46 36.40 3iob s ILE 287 CO -0.06 -0.61 0.00 0.61 -1.23 0.00 0.00 174.94 173.65