#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3iod s ALA 5 N 0.00 3.13 -0.10 0.55 0.00 -1.26 -4.91 121.76 119.17 3iod s ALA 5 Ca 0.00 0.75 -0.00 0.00 0.00 0.00 0.00 51.96 52.70 3iod s ALA 5 Cb 0.00 -3.29 0.02 0.00 0.00 0.00 0.00 23.12 19.86 3iod s ALA 5 CO 0.00 -0.23 -0.07 0.12 0.00 0.00 0.00 175.76 175.57 3iod s PHE 6 N -1.57 1.39 -0.40 0.00 5.36 -1.26 -5.03 117.98 116.47 3iod s PHE 6 Ca 0.56 -0.65 -0.09 0.00 -0.96 0.00 0.00 56.93 55.79 3iod s PHE 6 Cb -0.24 -1.16 0.06 0.00 -0.34 0.00 0.00 43.02 41.34 3iod s PHE 6 CO 0.30 -0.46 0.23 -1.01 -1.46 0.00 0.00 175.22 172.82 3iod s HIS 7 N 1.57 3.30 0.73 10.12 3.76 -1.26 -5.09 115.29 128.42 3iod s HIS 7 Ca 0.02 -1.35 -0.15 0.00 -0.15 0.00 0.00 55.06 53.43 3iod s HIS 7 Cb -0.13 -2.74 0.04 0.00 1.11 0.00 0.00 32.58 30.86 3iod s HIS 7 CO -0.06 -0.78 1.19 -1.25 -0.85 0.00 0.00 174.74 172.99 3iod s PRO 8 N 1.46 2.18 0.00 8.40 0.04 -1.26 -2.65 135.00 143.17 3iod s PRO 8 Ca 0.02 1.70 0.00 0.00 0.04 0.00 0.00 61.00 62.77 3iod s PRO 8 Cb -0.22 -1.84 0.00 0.00 0.04 0.00 0.00 34.50 32.48 3iod s PRO 8 CO 0.03 -1.79 0.00 0.41 0.04 0.00 0.00 177.00 175.69 3iod n GLY 9 N 0.26 0.17 3.30 0.56 0.00 -1.26 -4.98 105.19 103.25 3iod n GLY 9 Ca 0.13 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.99 3iod n GLY 9 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3iod s GLU 10 N -1.31 1.22 -0.20 1.61 2.02 -1.08 -5.06 118.70 115.90 3iod s GLU 10 Ca 0.00 -1.57 -0.27 0.00 0.02 0.00 0.00 54.97 53.16 3iod s GLU 10 Cb 0.00 -0.72 -0.00 0.00 0.10 0.00 0.00 34.13 33.51 3iod s GLU 10 CO 0.00 0.03 0.91 -1.17 0.02 0.00 0.00 175.26 175.05 3iod s LEU 11 N -3.25 4.14 -0.19 1.80 2.96 -1.25 -4.26 118.68 118.62 3iod s LEU 11 Ca 0.22 1.24 -0.04 0.00 -0.22 0.00 0.00 54.13 55.34 3iod s LEU 11 Cb 0.03 -3.35 -0.02 0.00 0.50 0.00 0.00 46.19 43.35 3iod s LEU 11 CO 0.05 -0.51 -0.04 0.20 -1.32 0.00 0.00 176.35 174.73 3iod s ASN 12 N 1.21 4.52 -0.21 3.68 0.01 0.34 -4.98 114.94 119.50 3iod s ASN 12 Ca 0.40 -0.28 -0.05 0.00 -0.71 0.00 0.00 52.86 52.23 3iod s ASN 12 Cb -0.16 -1.76 -0.02 0.00 0.41 0.00 0.00 41.25 39.72 3iod s ASN 12 CO 0.10 0.06 -0.00 -0.69 -1.51 0.00 0.00 177.10 175.06 3iod s VAL 13 N 1.01 3.83 -0.04 1.60 1.01 -1.26 -0.64 120.40 125.90 3iod s VAL 13 Ca 0.01 -0.35 0.07 0.00 0.00 0.00 0.00 61.98 61.70 3iod s VAL 13 Cb -0.15 -2.74 -0.02 0.00 0.00 0.00 0.00 36.38 33.47 3iod s VAL 13 CO 0.01 0.41 -0.24 -0.31 0.00 0.00 0.00 175.10 174.97 3iod s TYR 14 N 1.21 2.42 -0.22 5.22 2.02 -0.47 -4.99 117.35 122.55 3iod s TYR 14 Ca 0.03 -0.53 0.09 0.00 -0.37 0.00 0.00 57.07 56.30 3iod s TYR 14 Cb -0.15 -1.56 -0.20 0.00 -0.40 0.00 0.00 41.96 39.66 3iod s TYR 14 CO 0.01 -0.09 -0.08 0.43 -1.57 0.00 0.00 175.55 174.25 3iod n SER 15 N 2.65 1.22 -4.69 2.29 7.64 -1.26 -0.78 113.62 120.69 3iod n SER 15 Ca -0.17 -0.07 -0.42 0.00 1.01 0.00 0.00 58.87 59.22 3iod n SER 15 Cb 0.52 0.28 -0.03 0.00 -1.01 0.00 0.00 64.21 63.97 3iod n SER 15 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3iod s ALA 16 N -2.47 3.47 0.28 -0.43 0.00 -1.26 -3.83 121.76 117.51 3iod s ALA 16 Ca -0.21 0.64 0.01 0.00 0.00 0.00 0.00 51.96 52.40 3iod s ALA 16 Cb 0.07 -3.50 0.60 0.00 0.00 0.00 0.00 23.12 20.29 3iod s ALA 16 CO 0.67 -0.71 1.77 -1.35 0.00 0.00 0.00 175.76 176.14 3iod h PRO 17 N 7.36 0.68 -0.96 0.00 0.11 -1.93 -1.62 132.00 135.64 3iod h PRO 17 Ca -0.35 -0.04 0.07 0.00 0.11 0.00 0.00 66.00 65.79 3iod h PRO 17 Cb 1.17 -0.15 -0.07 0.00 0.11 0.00 0.00 31.00 32.06 3iod h PRO 17 CO 0.87 0.45 0.62 0.78 -0.21 0.00 0.00 178.00 180.51 3iod h GLY 18 N 0.70 1.44 0.78 -0.55 0.00 -1.97 -0.54 103.07 102.93 3iod h GLY 18 Ca 0.50 -0.44 -0.01 0.00 0.00 0.00 0.00 47.33 47.39 3iod h GLY 18 CO -0.36 0.30 -0.07 -0.55 0.00 0.00 0.00 176.54 175.86 3iod h ASP 19 N 1.08 -0.17 0.30 0.19 3.32 -1.70 -0.85 116.42 118.60 3iod h ASP 19 Ca 0.42 -0.17 -0.07 0.00 0.02 0.00 0.00 57.03 57.22 3iod h ASP 19 Cb 0.22 0.04 -0.01 0.00 0.22 0.00 0.00 39.33 39.81 3iod h ASP 19 CO -0.17 0.08 -0.33 1.62 -1.72 0.00 0.00 179.24 178.72 3iod h VAL 20 N -0.42 1.24 -0.29 -1.35 3.04 -1.23 -1.21 116.25 116.04 3iod h VAL 20 Ca -0.02 -1.16 -0.06 0.00 -1.01 0.00 0.00 66.70 64.44 3iod h VAL 20 Cb 0.33 1.60 -0.01 0.00 -2.01 0.00 0.00 31.29 31.20 3iod h VAL 20 CO 0.03 0.34 -0.06 0.00 -1.01 0.00 0.00 177.57 176.87 3iod h ALA 21 N 1.63 0.39 -0.24 3.17 0.00 -0.99 0.82 119.26 124.05 3iod h ALA 21 Ca 0.00 -0.27 -0.01 0.00 0.00 0.00 0.00 54.91 54.63 3iod h ALA 21 Cb 0.60 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 3iod h ALA 21 CO 0.04 0.20 0.11 -0.44 0.00 0.00 0.00 179.25 179.16 3iod h ASP 22 N 0.31 0.32 -0.49 0.00 3.32 -0.85 -0.77 116.42 118.26 3iod h ASP 22 Ca 0.07 -0.14 -0.06 0.00 0.02 0.00 0.00 57.03 56.92 3iod h ASP 22 Cb 0.53 -0.08 -0.02 0.00 0.22 0.00 0.00 39.33 39.98 3iod h ASP 22 CO 0.03 0.38 0.07 0.58 -1.72 0.00 0.00 179.24 178.57 3iod h VAL 23 N 0.24 1.25 -0.58 -1.35 2.07 -1.19 -0.93 116.25 115.78 3iod h VAL 23 Ca 0.08 -0.94 -0.01 0.00 0.82 0.00 0.00 66.70 66.64 3iod h VAL 23 Cb 0.15 0.91 -0.03 0.00 -1.52 0.00 0.00 31.29 30.81 3iod h VAL 23 CO -0.01 0.33 0.31 -1.28 0.02 0.00 0.00 177.57 176.94 3iod h SER 24 N 0.69 0.72 -0.28 0.57 0.87 -0.71 -0.79 113.55 114.61 3iod h SER 24 Ca 0.15 -0.10 -0.01 0.00 -1.23 0.00 0.00 61.79 60.59 3iod h SER 24 Cb 0.41 -0.18 -0.01 0.00 -0.44 0.00 0.00 62.40 62.17 3iod h SER 24 CO 0.01 0.62 0.13 -0.09 -0.53 0.00 0.00 176.83 176.97 3iod h ARG 25 N 0.78 0.42 -0.28 2.24 2.43 -0.97 -0.72 114.38 118.28 3iod h ARG 25 Ca 0.20 -0.07 0.02 0.00 -0.81 0.00 0.00 59.98 59.32 3iod h ARG 25 Cb 0.06 -0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 29.51 3iod h ARG 25 CO -0.03 0.41 0.14 0.00 -1.51 0.00 0.00 179.97 178.98 3iod h ALA 26 N 0.98 0.34 -0.58 2.80 0.00 -1.02 -0.84 119.26 120.94 3iod h ALA 26 Ca 0.10 0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.97 3iod h ALA 26 Cb 0.14 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 3iod h ALA 26 CO -0.01 -0.25 0.16 -0.07 0.00 0.00 0.00 179.25 179.08 3iod h LEU 27 N 0.29 0.82 -0.49 0.00 3.38 -0.91 -1.92 115.31 116.48 3iod h LEU 27 Ca 0.11 -0.14 -0.12 0.00 0.09 0.00 0.00 57.88 57.83 3iod h LEU 27 Cb 0.03 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.56 3iod h LEU 27 CO -0.08 0.78 -0.16 -0.09 0.09 0.00 0.00 178.44 178.99 3iod h ARG 28 N 0.85 0.97 -0.23 1.13 2.43 -0.78 -1.34 114.38 117.42 3iod h ARG 28 Ca 0.19 -0.39 -0.02 0.00 -0.81 0.00 0.00 59.98 58.95 3iod h ARG 28 Cb 0.27 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 29.76 3iod h ARG 28 CO -0.01 1.06 0.06 -0.07 -1.51 0.00 0.00 179.97 179.50 3iod h LEU 29 N 0.82 0.29 -0.75 3.80 3.38 -0.59 -0.26 115.31 122.01 3iod h LEU 29 Ca 0.12 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.06 3iod h LEU 29 Cb 0.72 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.40 3iod h LEU 29 CO 0.06 0.30 0.00 0.35 0.09 0.00 0.00 178.44 179.24 3iod n THR 30 N -4.41 0.26 -0.15 0.22 -2.24 -0.77 -4.91 114.28 102.28 3iod n THR 30 Ca 0.00 -0.27 0.00 0.00 -2.27 0.00 0.00 64.05 61.51 3iod n THR 30 Cb 0.15 0.13 0.00 0.00 -2.10 0.00 0.00 70.33 68.51 3iod n THR 30 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3iod n GLY 31 N 0.84 0.73 3.76 3.38 0.00 -0.11 -5.06 105.19 108.72 3iod n GLY 31 Ca 0.07 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.69 3iod n GLY 31 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3iod s ARG 32 N -0.72 4.56 -0.22 1.61 1.81 -0.52 -4.99 118.95 120.48 3iod s ARG 32 Ca 0.00 1.89 -0.17 0.00 -1.72 0.00 0.00 55.73 55.73 3iod s ARG 32 Cb 0.00 -3.14 -0.03 0.00 -0.45 0.00 0.00 34.95 31.32 3iod s ARG 32 CO 0.00 0.11 0.45 1.03 -0.68 0.00 0.00 175.30 176.21 3iod s ARG 33 N -1.55 4.14 -0.18 3.54 0.52 -0.95 -4.02 118.95 120.45 3iod s ARG 33 Ca 0.46 0.27 -0.23 0.00 -0.52 0.00 0.00 55.73 55.71 3iod s ARG 33 Cb -0.33 -3.58 -0.02 0.00 0.52 0.00 0.00 34.95 31.54 3iod s ARG 33 CO 0.43 -0.15 0.73 0.08 0.02 0.00 0.00 175.30 176.41 3iod s VAL 34 N 1.66 4.95 -0.13 3.52 1.01 -1.26 -0.41 120.40 129.74 3iod s VAL 34 Ca 0.20 1.40 -0.03 0.00 0.00 0.00 0.00 61.98 63.55 3iod s VAL 34 Cb -0.15 -4.04 -0.03 0.00 0.00 0.00 0.00 36.38 32.16 3iod s VAL 34 CO 0.09 0.07 -0.02 -0.04 0.00 0.00 0.00 175.10 175.20 3iod s MET 35 N 2.03 3.47 -0.14 2.72 1.00 0.58 -0.07 119.30 128.89 3iod s MET 35 Ca 0.33 -0.47 -0.01 0.00 0.00 0.00 0.00 55.69 55.55 3iod s MET 35 Cb -0.16 -2.90 -0.01 0.00 0.00 0.00 0.00 34.83 31.75 3iod s MET 35 CO 0.11 0.40 -0.12 -1.17 0.00 0.00 0.00 175.02 174.24 3iod s LEU 36 N -0.06 2.76 -0.45 -0.03 2.96 0.12 -0.01 118.68 123.97 3iod s LEU 36 Ca 0.03 -0.32 0.03 0.00 -0.22 0.00 0.00 54.13 53.65 3iod s LEU 36 Cb -0.13 -1.63 0.12 0.00 0.50 0.00 0.00 46.19 45.05 3iod s LEU 36 CO 0.02 0.15 0.18 -0.69 -1.32 0.00 0.00 176.35 174.70 3iod s VAL 37 N 0.42 2.55 0.02 1.68 1.01 0.26 -1.37 120.40 124.97 3iod s VAL 37 Ca -0.09 -2.85 -0.30 0.00 0.00 0.00 0.00 61.98 58.74 3iod s VAL 37 Cb -0.16 -2.81 -0.05 0.00 0.00 0.00 0.00 36.38 33.37 3iod s VAL 37 CO 0.05 -0.72 1.15 -2.84 0.00 0.00 0.00 175.10 172.74 3iod s PRO 38 N 0.28 4.45 0.16 2.72 0.02 -1.26 -1.85 135.00 139.51 3iod s PRO 38 Ca 0.14 1.67 0.01 0.00 0.02 0.00 0.00 61.00 62.84 3iod s PRO 38 Cb -0.23 -3.41 -0.04 0.00 0.02 0.00 0.00 34.50 30.84 3iod s PRO 38 CO -0.04 -0.25 0.02 0.95 -0.33 0.00 0.00 177.00 177.36 3iod s THR 39 N 1.27 0.48 -0.30 0.99 -4.23 0.06 -4.92 115.64 108.99 3iod s THR 39 Ca 0.57 -1.95 0.11 0.00 -1.18 0.00 0.00 61.69 59.23 3iod s THR 39 Cb -0.27 -2.09 0.69 0.00 1.34 0.00 0.00 72.50 72.18 3iod s THR 39 CO 0.27 -0.48 1.71 0.23 -0.54 0.00 0.00 174.62 175.82 3iod n MET 40 N -0.19 3.41 0.00 3.99 2.81 -1.26 -1.91 117.12 123.97 3iod n MET 40 Ca -0.06 -3.07 0.00 0.00 -1.81 0.00 0.00 57.70 52.76 3iod n MET 40 Cb 0.63 -2.12 0.00 0.00 -0.71 0.00 0.00 33.22 31.02 3iod n MET 40 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3iod n GLY 41 N -0.32 -0.79 3.46 3.03 0.00 -1.26 -4.65 105.19 104.66 3iod n GLY 41 Ca 0.37 -1.13 -0.19 0.00 0.00 0.00 0.00 46.02 45.07 3iod n GLY 41 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3iod n ALA 42 N 1.19 -2.23 -2.05 4.61 0.00 -1.26 -4.89 120.51 115.87 3iod n ALA 42 Ca 0.00 -0.04 -0.41 0.00 0.00 0.00 0.00 53.44 52.99 3iod n ALA 42 Cb 0.00 -3.62 -0.04 0.00 0.00 0.00 0.00 19.45 15.79 3iod n ALA 42 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3iod s LEU 43 N -6.12 4.47 0.00 0.00 1.43 -1.26 -4.74 118.68 112.45 3iod s LEU 43 Ca 0.20 2.16 0.01 0.00 -1.03 0.00 0.00 54.13 55.47 3iod s LEU 43 Cb -0.04 -3.61 -0.00 0.00 0.03 0.00 0.00 46.19 42.57 3iod s LEU 43 CO 0.77 -0.29 0.04 0.00 0.23 0.00 0.00 176.35 177.10 3iod n HIS 44 N 2.40 0.14 0.24 0.29 1.44 -1.26 -4.98 115.22 113.48 3iod n HIS 44 Ca 0.03 -0.92 0.14 0.00 -2.01 0.00 0.00 57.72 54.96 3iod n HIS 44 Cb 0.45 -0.03 0.79 0.00 0.12 0.00 0.00 29.99 31.33 3iod n HIS 44 CO 0.00 0.00 0.00 1.49 -2.81 0.00 0.00 176.34 175.02 3iod h GLU 45 N 0.00 0.00 -0.26 -1.40 4.57 -1.98 -0.39 114.58 115.13 3iod h GLU 45 Ca -0.12 0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 58.05 3iod h GLU 45 Cb 0.44 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.01 3iod h GLU 45 CO 0.20 0.00 0.13 0.78 -1.18 0.00 0.00 179.01 178.94 3iod h GLY 46 N 0.00 0.39 1.03 1.92 0.00 -1.92 -0.62 103.07 103.87 3iod h GLY 46 Ca 0.04 -0.19 -0.03 0.00 0.00 0.00 0.00 47.33 47.16 3iod h GLY 46 CO -0.00 0.18 0.37 0.45 0.00 0.00 0.00 176.54 177.54 3iod h HIS 47 N 0.29 1.15 0.00 5.60 3.86 -1.51 -2.85 115.15 121.69 3iod h HIS 47 Ca 0.09 -0.06 -0.04 0.00 -1.16 0.00 0.00 60.37 59.20 3iod h HIS 47 Cb 0.10 -0.35 -0.01 0.00 1.06 0.00 0.00 27.41 28.21 3iod h HIS 47 CO -0.03 0.84 -0.18 -0.07 0.86 0.00 0.00 177.93 179.36 3iod h LEU 48 N 1.12 0.00 -1.04 2.43 3.38 -0.95 -1.07 115.31 119.19 3iod h LEU 48 Ca 0.27 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 58.19 3iod h LEU 48 Cb 0.13 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.85 3iod h LEU 48 CO -0.03 0.18 0.15 0.00 0.09 0.00 0.00 178.44 178.82 3iod h ALA 49 N 1.82 1.22 0.09 1.53 0.00 -0.88 0.10 119.26 123.14 3iod h ALA 49 Ca -0.00 -0.20 -0.00 0.00 0.00 0.00 0.00 54.91 54.71 3iod h ALA 49 Cb 0.32 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.89 3iod h ALA 49 CO 0.02 0.54 -0.04 -0.07 0.00 0.00 0.00 179.25 179.70 3iod h LEU 50 N 0.81 -0.10 -0.58 0.00 3.38 -1.15 -1.27 115.31 116.41 3iod h LEU 50 Ca 0.18 -0.14 0.07 0.00 0.09 0.00 0.00 57.88 58.09 3iod h LEU 50 Cb 0.28 0.03 -0.06 0.00 0.09 0.00 0.00 40.66 40.99 3iod h LEU 50 CO -0.00 0.08 0.25 0.58 0.09 0.00 0.00 178.44 179.44 3iod h VAL 51 N -0.27 0.85 -0.31 1.22 2.07 -1.04 -0.84 116.25 117.93 3iod h VAL 51 Ca -0.01 -0.16 -0.11 0.00 0.82 0.00 0.00 66.70 67.24 3iod h VAL 51 Cb 0.23 0.35 -0.01 0.00 -1.52 0.00 0.00 31.29 30.33 3iod h VAL 51 CO 0.02 0.08 -0.26 0.03 0.02 0.00 0.00 177.57 177.47 3iod h ARG 52 N 0.46 0.61 -0.67 1.57 3.08 -0.74 0.16 114.38 118.84 3iod h ARG 52 Ca 0.28 -0.24 -0.03 0.00 0.07 0.00 0.00 59.98 60.05 3iod h ARG 52 Cb 0.28 -0.03 -0.03 0.00 0.08 0.00 0.00 29.97 30.28 3iod h ARG 52 CO -0.25 0.81 0.29 0.00 -1.07 0.00 0.00 179.97 179.75 3iod h ALA 53 N 1.19 0.87 -0.29 0.04 0.00 -0.88 -2.32 119.26 117.87 3iod h ALA 53 Ca 0.07 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 54.82 3iod h ALA 53 Cb 0.72 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 3iod h ALA 53 CO 0.06 0.47 0.17 0.00 0.00 0.00 0.00 179.25 179.94 3iod h ALA 54 N 1.13 0.37 -0.82 0.00 0.00 -0.77 -3.14 119.26 116.04 3iod h ALA 54 Ca 0.23 -0.06 0.05 0.00 0.00 0.00 0.00 54.91 55.13 3iod h ALA 54 Cb 0.17 -0.12 -0.05 0.00 0.00 0.00 0.00 17.79 17.79 3iod h ALA 54 CO -0.02 -0.11 0.54 0.87 0.00 0.00 0.00 179.25 180.52 3iod h LYS 55 N 0.36 0.94 0.00 0.00 1.57 -0.72 -2.70 116.57 116.03 3iod h LYS 55 Ca 0.10 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.83 3iod h LYS 55 Cb 0.03 -0.21 0.00 0.00 0.08 0.00 0.00 32.23 32.13 3iod h LYS 55 CO -0.02 0.62 0.00 2.89 -0.57 0.00 0.00 179.45 182.38 3iod n ARG 56 N -4.46 0.08 -2.31 3.15 1.85 -0.90 -4.61 116.66 109.47 3iod n ARG 56 Ca 0.11 0.14 -0.43 0.00 -1.00 0.00 0.00 57.85 56.68 3iod n ARG 56 Cb 0.15 -1.50 -0.02 0.00 -1.05 0.00 0.00 32.46 30.03 3iod n ARG 56 CO 0.00 0.00 0.00 0.08 -0.01 0.00 0.00 177.63 177.70 3iod s VAL 57 N -2.88 4.08 0.32 8.89 1.01 -1.02 -4.95 120.40 125.85 3iod s VAL 57 Ca 0.12 1.29 -0.29 0.00 0.00 0.00 0.00 61.98 63.11 3iod s VAL 57 Cb 0.13 -3.87 -0.11 0.00 0.00 0.00 0.00 36.38 32.54 3iod s VAL 57 CO 0.35 -0.15 1.52 -2.84 0.00 0.00 0.00 175.10 173.98 3iod s PRO 58 N 3.73 4.15 0.00 2.72 0.02 -1.26 -1.78 135.00 142.57 3iod s PRO 58 Ca 0.60 2.52 0.00 0.00 0.02 0.00 0.00 61.00 64.14 3iod s PRO 58 Cb -0.24 -3.02 0.00 0.00 0.02 0.00 0.00 34.50 31.26 3iod s PRO 58 CO 0.19 -0.55 0.00 0.41 -0.33 0.00 0.00 177.00 176.73 3iod n GLY 59 N 1.51 0.63 3.76 0.52 0.00 -1.26 -4.78 105.19 105.58 3iod n GLY 59 Ca 0.05 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.69 3iod n GLY 59 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3iod s SER 60 N -2.34 5.92 -0.10 1.61 1.04 -0.73 -2.23 113.70 116.86 3iod s SER 60 Ca 0.00 2.47 0.02 0.00 0.48 0.00 0.00 55.95 58.92 3iod s SER 60 Cb 0.00 -2.62 -0.02 0.00 0.10 0.00 0.00 66.02 63.49 3iod s SER 60 CO 0.00 -1.10 -0.16 0.54 0.98 0.00 0.00 173.24 173.50 3iod s VAL 61 N -1.45 2.85 -0.27 5.02 0.11 0.45 -4.82 120.40 122.29 3iod s VAL 61 Ca 0.65 -0.75 -0.10 0.00 -2.93 0.00 0.00 61.98 58.84 3iod s VAL 61 Cb -0.33 -2.16 -0.05 0.00 -1.53 0.00 0.00 36.38 32.32 3iod s VAL 61 CO 0.40 0.55 0.17 -0.69 -3.33 0.00 0.00 175.10 172.20 3iod s VAL 62 N 0.06 5.19 -0.24 2.04 1.01 -1.26 -0.31 120.40 126.89 3iod s VAL 62 Ca -0.06 0.13 -0.08 0.00 0.00 0.00 0.00 61.98 61.96 3iod s VAL 62 Cb -0.15 -3.46 -0.04 0.00 0.00 0.00 0.00 36.38 32.74 3iod s VAL 62 CO 0.05 0.27 0.09 -0.69 0.00 0.00 0.00 175.10 174.82 3iod s VAL 63 N 1.67 4.63 -0.22 2.92 1.01 0.99 -2.02 120.40 129.38 3iod s VAL 63 Ca 0.07 -0.07 -0.04 0.00 0.00 0.00 0.00 61.98 61.94 3iod s VAL 63 Cb -0.16 -3.16 -0.01 0.00 0.00 0.00 0.00 36.38 33.05 3iod s VAL 63 CO 0.09 0.35 -0.03 -0.69 0.00 0.00 0.00 175.10 174.83 3iod s VAL 64 N 1.35 3.56 0.10 2.92 1.01 0.03 -0.58 120.40 128.80 3iod s VAL 64 Ca 0.06 -0.43 -0.10 0.00 0.00 0.00 0.00 61.98 61.50 3iod s VAL 64 Cb -0.15 -2.62 -0.06 0.00 0.00 0.00 0.00 36.38 33.55 3iod s VAL 64 CO 0.05 0.42 0.43 -0.94 0.00 0.00 0.00 175.10 175.06 3iod s SER 65 N 1.39 6.66 -0.19 3.32 1.04 -0.77 -0.76 113.70 124.39 3iod s SER 65 Ca 0.05 0.84 -0.01 0.00 0.48 0.00 0.00 55.95 57.30 3iod s SER 65 Cb -0.14 -2.20 0.05 0.00 0.10 0.00 0.00 66.02 63.83 3iod s SER 65 CO -0.01 0.14 -0.01 -0.63 0.98 0.00 0.00 173.24 173.71 3iod s ILE 66 N -1.45 0.86 -0.27 -1.02 1.01 -0.31 -0.76 121.20 119.26 3iod s ILE 66 Ca 0.35 -0.66 -0.11 0.00 0.00 0.00 0.00 60.65 60.24 3iod s ILE 66 Cb -0.14 -1.21 0.11 0.00 0.01 0.00 0.00 42.46 41.23 3iod s ILE 66 CO 0.19 -0.07 0.60 0.12 0.00 0.00 0.00 174.94 175.78 3iod s PHE 67 N 1.72 -1.14 -0.52 3.97 5.36 -0.80 -4.19 117.98 122.38 3iod s PHE 67 Ca -0.01 2.09 -0.20 0.00 -0.96 0.00 0.00 56.93 57.85 3iod s PHE 67 Cb -0.17 0.65 0.06 0.00 -0.34 0.00 0.00 43.02 43.22 3iod s PHE 67 CO -0.07 -0.59 0.68 0.08 -1.46 0.00 0.00 175.22 173.86 3iod s VAL 68 N 2.48 4.79 -0.48 3.12 1.01 -1.26 -4.25 120.40 125.81 3iod s VAL 68 Ca -0.06 -0.40 -0.27 0.00 0.00 0.00 0.00 61.98 61.25 3iod s VAL 68 Cb -0.10 -4.35 0.03 0.00 0.00 0.00 0.00 36.38 31.96 3iod s VAL 68 CO -0.18 -0.87 1.03 0.21 0.00 0.00 0.00 175.10 175.29 3iod s ASN 69 N 2.76 6.54 0.62 3.32 2.47 -1.26 -4.90 114.94 124.49 3iod s ASN 69 Ca 0.17 0.24 0.39 0.00 0.42 0.00 0.00 52.86 54.08 3iod s ASN 69 Cb -0.18 -2.50 2.03 0.00 -1.45 0.00 0.00 41.25 39.15 3iod s ASN 69 CO 0.13 -1.17 2.24 -0.65 -3.72 0.00 0.00 177.10 173.93 3iod h PRO 70 N 9.18 0.00 0.00 0.43 0.11 -1.97 -2.93 132.00 136.82 3iod h PRO 70 Ca -0.24 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.87 3iod h PRO 70 Cb 1.07 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.18 3iod h PRO 70 CO 1.08 0.01 0.00 1.98 -0.21 0.00 0.00 178.00 180.87 3iod h MET 71 N 0.00 0.00 -0.09 1.05 4.05 -1.90 -2.89 114.93 115.15 3iod h MET 71 Ca -0.00 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.42 3iod h MET 71 Cb 0.17 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 30.97 3iod h MET 71 CO 0.00 0.00 0.00 0.00 0.23 0.00 0.00 176.91 177.14 3iod n GLN 72 N -3.07 2.01 0.00 0.39 10.64 -1.11 -3.96 117.38 122.28 3iod n GLN 72 Ca 0.03 -1.49 0.00 0.00 -1.83 0.00 0.00 57.00 53.71 3iod n GLN 72 Cb 0.43 -1.46 0.00 0.00 -0.86 0.00 0.00 30.24 28.35 3iod n GLN 72 CO 0.00 0.00 0.00 1.19 -1.83 0.00 0.00 177.06 176.42 3iod n PHE 73 N 0.77 0.00 0.00 2.61 3.72 -1.10 -4.63 117.46 118.84 3iod n PHE 73 Ca 0.17 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.57 3iod n PHE 73 Cb 0.47 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.01 3iod n PHE 73 CO 0.00 0.00 0.00 -0.11 -0.05 0.00 0.00 176.76 176.60 3iod n LEU 79 N 0.00 0.00 0.21 4.37 7.94 -1.26 -4.91 117.00 123.34 3iod n LEU 79 Ca 0.00 0.00 0.06 0.00 -1.11 0.00 0.00 56.01 54.96 3iod n LEU 79 Cb 0.00 0.00 0.44 0.00 0.53 0.00 0.00 43.42 44.39 3iod n LEU 79 CO 0.00 0.00 0.77 0.44 -1.11 0.00 0.00 177.39 177.49 3iod h ASP 80 N 0.00 0.00 1.55 1.96 3.32 -2.04 -3.09 116.42 118.11 3iod h ASP 80 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3iod h ASP 80 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 3iod h ASP 80 CO 0.00 0.31 -0.01 0.00 -1.72 0.00 0.00 179.24 177.82 3iod h ALA 81 N 1.69 1.00 -2.63 3.45 0.00 -2.08 -3.47 119.26 117.22 3iod h ALA 81 Ca -0.00 0.00 -0.53 0.00 0.00 0.00 0.00 54.91 54.38 3iod h ALA 81 Cb 0.67 0.00 0.04 0.00 0.00 0.00 0.00 17.79 18.50 3iod h ALA 81 CO 0.04 0.00 0.80 -0.47 0.00 0.00 0.00 179.25 179.62 3iod s TYR 82 N -3.12 3.11 0.13 0.00 5.04 -1.17 -4.94 117.35 116.39 3iod s TYR 82 Ca 0.10 0.83 -0.32 0.00 -2.44 0.00 0.00 57.07 55.25 3iod s TYR 82 Cb 0.11 -3.83 -0.11 0.00 0.35 0.00 0.00 41.96 38.48 3iod s TYR 82 CO 0.61 -2.91 1.80 -0.35 -1.34 0.00 0.00 175.55 173.37 3iod n PRO 83 N 3.49 2.70 -3.94 4.97 -0.04 -1.26 -5.01 135.00 135.91 3iod n PRO 83 Ca 0.11 0.98 -0.30 0.00 -0.04 0.00 0.00 63.50 64.26 3iod n PRO 83 Cb 0.40 -2.86 -0.16 0.00 -0.04 0.00 0.00 33.50 30.84 3iod n PRO 83 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 3iod s ARG 84 N 2.44 1.72 -0.42 0.54 0.52 -1.26 -4.47 118.95 118.01 3iod s ARG 84 Ca 0.81 -0.75 0.07 0.00 -0.52 0.00 0.00 55.73 55.35 3iod s ARG 84 Cb -0.51 -2.30 0.23 0.00 0.52 0.00 0.00 34.95 32.89 3iod s ARG 84 CO 0.37 -0.46 0.51 0.25 0.02 0.00 0.00 175.30 175.99 3iod n THR 85 N 4.76 -0.46 -0.15 0.02 -2.24 -1.26 -5.02 114.28 109.93 3iod n THR 85 Ca -0.13 -4.04 -0.04 0.00 -2.27 0.00 0.00 64.05 57.57 3iod n THR 85 Cb 0.47 -1.92 0.16 0.00 -2.10 0.00 0.00 70.33 66.93 3iod n THR 85 CO 0.00 0.00 0.00 -0.65 -0.57 0.00 0.00 175.07 173.85 3iod h PRO 86 N 4.33 0.89 0.15 -0.78 0.11 -1.99 -2.11 132.00 132.59 3iod h PRO 86 Ca 0.12 -0.19 0.00 0.00 0.11 0.00 0.00 66.00 66.04 3iod h PRO 86 Cb 0.86 -0.13 -0.03 0.00 0.11 0.00 0.00 31.00 31.82 3iod h PRO 86 CO 0.48 0.81 -0.33 -0.44 -0.21 0.00 0.00 178.00 178.31 3iod h ASP 87 N 0.85 -0.98 -0.90 -2.05 3.32 -2.00 -2.23 116.42 112.42 3iod h ASP 87 Ca 0.18 0.10 0.10 0.00 0.02 0.00 0.00 57.03 57.43 3iod h ASP 87 Cb 0.33 0.35 -0.08 0.00 0.22 0.00 0.00 39.33 40.16 3iod h ASP 87 CO 0.00 -0.37 0.54 0.44 -1.72 0.00 0.00 179.24 178.13 3iod h ASP 88 N -0.53 0.80 0.10 6.45 3.32 -1.98 -2.49 116.42 122.09 3iod h ASP 88 Ca -0.01 0.04 0.00 0.00 0.02 0.00 0.00 57.03 57.08 3iod h ASP 88 Cb 0.50 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 39.93 3iod h ASP 88 CO -0.14 0.46 -0.09 0.44 -1.72 0.00 0.00 179.24 178.19 3iod h ASP 89 N 0.91 -0.23 0.10 6.45 3.32 -1.09 -1.63 116.42 124.26 3iod h ASP 89 Ca 0.43 0.02 -0.06 0.00 0.02 0.00 0.00 57.03 57.44 3iod h ASP 89 Cb 0.37 0.08 -0.01 0.00 0.22 0.00 0.00 39.33 39.98 3iod h ASP 89 CO -0.24 -0.14 -0.22 -0.07 -1.72 0.00 0.00 179.24 176.86 3iod h LEU 90 N -0.20 0.21 -0.28 1.55 3.38 -1.18 -1.61 115.31 117.18 3iod h LEU 90 Ca 0.00 -0.05 -0.00 0.00 0.09 0.00 0.00 57.88 57.92 3iod h LEU 90 Cb 0.19 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 3iod h LEU 90 CO -0.02 0.44 0.17 0.00 0.09 0.00 0.00 178.44 179.12 3iod h ALA 91 N 1.59 0.36 -0.42 1.53 0.00 -1.05 0.76 119.26 122.01 3iod h ALA 91 Ca 0.03 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3iod h ALA 91 Cb 0.50 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 3iod h ALA 91 CO 0.03 -0.15 0.27 1.96 0.00 0.00 0.00 179.25 181.36 3iod h GLN 92 N 0.36 0.57 -0.54 0.00 4.20 -0.82 0.47 115.11 119.33 3iod h GLN 92 Ca 0.10 -0.05 0.02 0.00 0.06 0.00 0.00 58.65 58.78 3iod h GLN 92 Cb 0.01 -0.12 -0.03 0.00 0.30 0.00 0.00 27.48 27.63 3iod h GLN 92 CO -0.02 0.41 0.34 -0.07 -0.67 0.00 0.00 178.83 178.82 3iod h LEU 93 N 0.57 0.57 -0.44 1.46 3.38 -1.12 0.10 115.31 119.83 3iod h LEU 93 Ca 0.15 -0.00 0.06 0.00 0.09 0.00 0.00 57.88 58.18 3iod h LEU 93 Cb -0.03 -0.13 -0.05 0.00 0.09 0.00 0.00 40.66 40.54 3iod h LEU 93 CO -0.03 0.41 0.14 0.03 0.09 0.00 0.00 178.44 179.07 3iod h ARG 94 N 0.69 0.29 -0.51 1.13 3.08 -0.48 -1.39 114.38 117.18 3iod h ARG 94 Ca 0.21 -0.02 0.03 0.00 0.07 0.00 0.00 59.98 60.27 3iod h ARG 94 Cb -0.03 -0.07 -0.03 0.00 0.08 0.00 0.00 29.97 29.93 3iod h ARG 94 CO -0.07 0.19 0.34 0.00 -1.07 0.00 0.00 179.97 179.36 3iod h ALA 95 N 1.30 1.75 -0.01 0.04 0.00 -0.34 -1.75 119.26 120.26 3iod h ALA 95 Ca 0.21 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.09 3iod h ALA 95 Cb 0.22 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.85 3iod h ALA 95 CO -0.23 0.19 -0.09 0.39 0.00 0.00 0.00 179.25 179.51 3iod n GLU 96 N -4.47 0.88 -1.42 0.00 -0.58 -0.03 -4.92 120.64 110.10 3iod n GLU 96 Ca 0.06 -0.32 -0.09 0.00 -0.42 0.00 0.00 57.16 56.39 3iod n GLU 96 Cb 0.14 -1.49 -0.03 0.00 -0.57 0.00 0.00 31.44 29.49 3iod n GLU 96 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3iod n GLY 97 N 1.23 0.85 3.75 0.62 0.00 -0.66 -5.00 105.19 105.98 3iod n GLY 97 Ca 0.16 -0.63 -0.41 0.00 0.00 0.00 0.00 46.02 45.14 3iod n GLY 97 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3iod s VAL 98 N -2.34 2.68 -0.11 1.61 1.01 -0.60 -4.92 120.40 117.73 3iod s VAL 98 Ca 0.00 0.59 0.22 0.00 0.00 0.00 0.00 61.98 62.79 3iod s VAL 98 Cb 0.00 -3.38 -0.22 0.00 0.00 0.00 0.00 36.38 32.78 3iod s VAL 98 CO 0.00 0.10 0.68 -0.62 0.00 0.00 0.00 175.10 175.26 3iod n GLU 99 N 2.08 0.63 -3.98 2.72 1.02 -1.24 -3.87 120.64 118.01 3iod n GLU 99 Ca 0.06 -0.09 -0.21 0.00 -0.02 0.00 0.00 57.16 56.90 3iod n GLU 99 Cb 0.41 -1.62 -0.17 0.00 -0.02 0.00 0.00 31.44 30.03 3iod n GLU 99 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 3iod s ILE 100 N -3.46 0.46 -0.13 -3.67 1.01 -0.86 -0.51 121.20 114.05 3iod s ILE 100 Ca -0.05 -0.02 -0.01 0.00 0.00 0.00 0.00 60.65 60.57 3iod s ILE 100 Cb 0.13 -0.55 -0.02 0.00 0.01 0.00 0.00 42.46 42.03 3iod s ILE 100 CO 0.87 0.24 -0.09 0.00 0.00 0.00 0.00 174.94 175.96 3iod s ALA 101 N 1.37 2.81 -0.28 9.38 0.00 0.18 -0.79 121.76 134.43 3iod s ALA 101 Ca -0.04 -0.87 -0.05 0.00 0.00 0.00 0.00 51.96 51.00 3iod s ALA 101 Cb -0.13 -1.33 0.02 0.00 0.00 0.00 0.00 23.12 21.67 3iod s ALA 101 CO -0.02 0.29 0.03 0.12 0.00 0.00 0.00 175.76 176.18 3iod s PHE 102 N 0.16 3.13 -0.57 0.00 5.36 0.06 -1.37 117.98 124.75 3iod s PHE 102 Ca -0.04 -1.20 0.06 0.00 -0.96 0.00 0.00 56.93 54.79 3iod s PHE 102 Cb -0.14 -2.19 0.24 0.00 -0.34 0.00 0.00 43.02 40.59 3iod s PHE 102 CO 0.04 -0.64 0.65 0.25 -1.46 0.00 0.00 175.22 174.07 3iod n THR 103 N 4.79 1.34 -1.80 0.12 -2.24 0.04 -1.16 114.28 115.38 3iod n THR 103 Ca -0.15 -4.80 -0.32 0.00 -2.27 0.00 0.00 64.05 56.50 3iod n THR 103 Cb 0.47 -2.05 0.04 0.00 -2.10 0.00 0.00 70.33 66.69 3iod n THR 103 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 3iod s PRO 104 N -1.97 2.97 0.58 -0.78 0.04 -1.25 -4.42 135.00 130.17 3iod s PRO 104 Ca 0.37 1.24 -0.09 0.00 0.04 0.00 0.00 61.00 62.57 3iod s PRO 104 Cb 0.14 -1.98 -0.03 0.00 0.04 0.00 0.00 34.50 32.67 3iod s PRO 104 CO -0.06 -1.10 0.95 0.95 0.04 0.00 0.00 177.00 177.79 3iod s THR 105 N -2.52 4.62 0.20 1.26 -4.23 -1.26 -4.91 115.64 108.80 3iod s THR 105 Ca 0.64 0.59 -0.10 0.00 -1.18 0.00 0.00 61.69 61.64 3iod s THR 105 Cb -0.18 -3.82 0.14 0.00 1.34 0.00 0.00 72.50 69.99 3iod s THR 105 CO 0.43 -0.98 1.83 0.74 -0.54 0.00 0.00 174.62 176.09 3iod h THR 106 N -0.17 1.22 -0.69 3.99 2.02 -1.96 -2.15 112.91 115.17 3iod h THR 106 Ca -0.45 -0.54 -0.02 0.00 0.77 0.00 0.00 66.41 66.17 3iod h THR 106 Cb 1.20 0.23 -0.03 0.00 -1.74 0.00 0.00 68.15 67.81 3iod h THR 106 CO 0.62 0.24 0.33 0.00 0.37 0.00 0.00 175.52 177.08 3iod h ALA 107 N 1.22 1.29 -0.07 6.16 0.00 -1.94 0.21 119.26 126.14 3iod h ALA 107 Ca 0.26 -0.14 -0.13 0.00 0.00 0.00 0.00 54.91 54.91 3iod h ALA 107 Cb 0.02 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.52 3iod h ALA 107 CO -0.04 0.55 -0.54 0.00 0.00 0.00 0.00 179.25 179.21 3iod h ALA 108 N 1.40 0.96 0.05 0.00 0.00 -1.87 -2.21 119.26 117.59 3iod h ALA 108 Ca 0.24 -0.50 -0.27 0.00 0.00 0.00 0.00 54.91 54.37 3iod h ALA 108 Cb 0.09 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.77 3iod h ALA 108 CO -0.03 0.69 -1.43 0.52 0.00 0.00 0.00 179.25 178.99 3iod h MET 109 N 0.15 0.11 -1.70 0.00 2.86 -0.91 -3.40 114.93 112.03 3iod h MET 109 Ca 0.00 -0.18 -0.52 0.00 -2.06 0.00 0.00 59.70 56.94 3iod h MET 109 Cb 1.01 0.07 -0.41 0.00 0.06 0.00 0.00 31.60 32.32 3iod h MET 109 CO 0.08 0.91 -0.88 0.66 1.06 0.00 0.00 176.91 178.74 3iod n TYR 110 N -3.31 2.60 0.29 -0.22 4.01 0.70 -4.89 117.16 116.35 3iod n TYR 110 Ca -0.12 -3.41 0.17 0.00 -0.16 0.00 0.00 57.90 54.38 3iod n TYR 110 Cb 1.02 -0.31 0.84 0.00 -0.31 0.00 0.00 39.34 40.57 3iod n TYR 110 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 3iod h PRO 111 N 2.85 0.00 -0.21 -0.72 0.13 -1.61 -1.68 132.00 130.75 3iod h PRO 111 Ca 0.14 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.26 3iod h PRO 111 Cb 0.87 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.99 3iod h PRO 111 CO 0.71 0.05 -0.00 -0.25 -0.23 0.00 0.00 178.00 178.28 3iod n ASP 112 N -3.28 3.50 0.00 1.44 8.00 -1.26 -5.08 116.55 119.86 3iod n ASP 112 Ca -0.01 -3.08 0.00 0.00 0.71 0.00 0.00 54.79 52.41 3iod n ASP 112 Cb 0.23 -0.53 0.00 0.00 -0.02 0.00 0.00 41.12 40.80 3iod n ASP 112 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3iod n GLY 113 N -0.74 1.32 3.38 0.44 0.00 -0.63 -4.19 105.19 104.77 3iod n GLY 113 Ca 0.21 -0.66 -0.45 0.00 0.00 0.00 0.00 46.02 45.12 3iod n GLY 113 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3iod s LEU 114 N 0.00 5.66 0.00 0.99 1.43 -1.26 -4.86 118.68 120.65 3iod s LEU 114 Ca 0.00 -1.37 0.00 0.00 -1.03 0.00 0.00 54.13 51.73 3iod s LEU 114 Cb 0.00 -2.21 0.00 0.00 0.03 0.00 0.00 46.19 44.01 3iod s LEU 114 CO 0.00 -0.70 0.00 -1.14 0.23 0.00 0.00 176.35 174.74 3iod n ARG 115 N 5.29 0.00 -2.62 1.70 0.63 -1.26 -5.00 116.66 115.40 3iod n ARG 115 Ca -0.12 0.00 -0.41 0.00 -0.92 0.00 0.00 57.85 56.40 3iod n ARG 115 Cb 0.43 0.00 -0.04 0.00 0.45 0.00 0.00 32.46 33.30 3iod n ARG 115 CO 0.00 0.00 0.00 0.99 -2.51 0.00 0.00 177.63 176.11 3iod s THR 116 N 0.30 4.25 0.20 5.15 2.01 -1.26 -5.03 115.64 121.27 3iod s THR 116 Ca 0.00 1.84 -0.03 0.00 0.31 0.00 0.00 61.69 63.81 3iod s THR 116 Cb 0.00 -4.18 -0.03 0.00 0.01 0.00 0.00 72.50 68.30 3iod s THR 116 CO 0.00 0.27 0.19 0.42 -0.69 0.00 0.00 174.62 174.80 3iod s THR 117 N 0.12 0.01 -0.13 -0.82 -4.23 -1.26 -5.12 115.64 104.21 3iod s THR 117 Ca 0.50 -1.87 -0.18 0.00 -1.18 0.00 0.00 61.69 58.96 3iod s THR 117 Cb -0.26 -2.38 -0.04 0.00 1.34 0.00 0.00 72.50 71.16 3iod s THR 117 CO 0.31 -0.06 0.45 -0.69 -0.54 0.00 0.00 174.62 174.10 3iod s VAL 118 N -4.12 5.20 -0.46 2.29 1.01 -1.26 -5.05 120.40 118.02 3iod s VAL 118 Ca 0.34 0.90 -0.14 0.00 0.00 0.00 0.00 61.98 63.07 3iod s VAL 118 Cb 0.06 -3.79 0.07 0.00 0.00 0.00 0.00 36.38 32.71 3iod s VAL 118 CO 0.10 0.33 0.36 -1.58 0.00 0.00 0.00 175.10 174.31 3iod s GLN 119 N 0.62 2.91 0.98 2.72 2.00 -1.26 -4.60 119.66 123.03 3iod s GLN 119 Ca 0.25 -1.34 -0.12 0.00 -2.00 0.00 0.00 55.36 52.14 3iod s GLN 119 Cb -0.15 -4.05 0.18 0.00 0.80 0.00 0.00 33.01 29.79 3iod s GLN 119 CO 0.09 -0.99 1.08 -2.14 -0.50 0.00 0.00 175.29 172.84 3iod s PRO 120 N 1.60 0.56 0.91 1.67 0.02 -1.26 -5.05 135.00 133.45 3iod s PRO 120 Ca 0.04 0.76 -0.15 0.00 0.02 0.00 0.00 61.00 61.67 3iod s PRO 120 Cb -0.24 -1.73 0.22 0.00 0.02 0.00 0.00 34.50 32.77 3iod s PRO 120 CO 0.06 -2.70 0.91 0.41 -0.33 0.00 0.00 177.00 175.35 3iod n GLY 121 N -0.69 -2.32 0.31 0.52 0.00 -1.26 -4.88 105.19 96.87 3iod n GLY 121 Ca 0.06 -1.55 0.15 0.00 0.00 0.00 0.00 46.02 44.68 3iod n GLY 121 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3iod h PRO 122 N 0.00 0.00 -0.47 1.61 0.11 -2.03 -1.82 132.00 129.40 3iod h PRO 122 Ca -0.33 0.00 0.14 0.00 0.11 0.00 0.00 66.00 65.92 3iod h PRO 122 Cb 0.97 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.06 3iod h PRO 122 CO 0.22 0.00 0.35 1.25 -0.21 0.00 0.00 178.00 179.61 3iod h LEU 123 N 0.00 0.00 -1.07 2.35 5.85 -1.96 -1.54 115.31 118.94 3iod h LEU 123 Ca 0.03 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.75 3iod h LEU 123 Cb 0.17 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.20 3iod h LEU 123 CO -0.00 0.00 0.00 0.00 -0.34 0.00 0.00 178.44 178.10 3iod h ALA 124 N 1.73 1.00 -0.00 1.25 0.00 -1.66 -2.57 119.26 119.01 3iod h ALA 124 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.13 3iod h ALA 124 Cb 0.93 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.72 3iod h ALA 124 CO -0.00 0.00 -0.22 0.00 0.00 0.00 0.00 179.25 179.02 3iod n ALA 125 N -1.83 2.98 -2.52 0.00 0.00 -0.58 -3.96 120.51 114.60 3iod n ALA 125 Ca 0.01 -0.31 -0.24 0.00 0.00 0.00 0.00 53.44 52.89 3iod n ALA 125 Cb 0.19 -1.24 -0.08 0.00 0.00 0.00 0.00 19.45 18.32 3iod n ALA 125 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 3iod s GLU 126 N -2.63 2.18 4.79 0.00 2.02 -0.97 -2.86 118.70 121.23 3iod s GLU 126 Ca 0.23 -1.72 0.00 0.00 0.02 0.00 0.00 54.97 53.50 3iod s GLU 126 Cb 0.19 -2.00 0.00 0.00 0.10 0.00 0.00 34.13 32.43 3iod s GLU 126 CO 0.54 0.09 0.00 1.28 0.02 0.00 0.00 175.26 177.19 3iod n LEU 127 N -1.05 0.00 0.25 1.80 4.77 -1.26 -0.06 117.00 121.46 3iod n LEU 127 Ca -0.03 0.00 0.14 0.00 -0.03 0.00 0.00 56.01 56.08 3iod n LEU 127 Cb 0.62 0.00 0.81 0.00 -2.33 0.00 0.00 43.42 42.52 3iod n LEU 127 CO 0.44 0.00 1.12 -0.33 -1.33 0.00 0.00 177.39 177.28 3iod h GLU 128 N 0.00 0.00 -0.00 3.23 4.39 -1.92 -2.15 114.58 118.13 3iod h GLU 128 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 3iod h GLU 128 Cb 0.00 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.65 3iod h GLU 128 CO 0.00 0.00 -0.19 0.41 -1.16 0.00 0.00 179.01 178.07 3iod n GLY 129 N -1.42 -1.35 0.43 -3.84 0.00 0.92 -4.07 105.19 95.87 3iod n GLY 129 Ca -0.01 -0.21 -0.15 0.00 0.00 0.00 0.00 46.02 45.65 3iod n GLY 129 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3iod h GLY 130 N 5.00 -1.19 0.85 -0.02 0.00 -1.23 -2.55 103.07 103.92 3iod h GLY 130 Ca 0.00 0.57 0.00 0.00 0.00 0.00 0.00 47.33 47.90 3iod h GLY 130 CO 0.00 -0.35 -0.06 -1.55 0.00 0.00 0.00 176.54 174.58 3iod n PRO 131 N -5.07 0.82 -3.22 4.80 -0.04 -1.26 -4.42 135.00 126.62 3iod n PRO 131 Ca -0.10 -0.24 -0.24 0.00 -0.04 0.00 0.00 63.50 62.89 3iod n PRO 131 Cb 0.39 -1.50 -0.06 0.00 -0.04 0.00 0.00 33.50 32.29 3iod n PRO 131 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 3iod n ARG 132 N -0.88 1.19 0.05 0.54 1.74 -0.98 -4.98 116.66 113.32 3iod n ARG 132 Ca 0.17 -3.57 0.08 0.00 -0.77 0.00 0.00 57.85 53.75 3iod n ARG 132 Cb 0.25 -1.52 0.34 0.00 -1.02 0.00 0.00 32.46 30.50 3iod n ARG 132 CO 0.00 0.00 0.00 -0.35 -1.52 0.00 0.00 177.63 175.76 3iod n PRO 133 N 1.04 0.06 0.00 5.56 -0.04 -1.07 -1.53 135.00 139.02 3iod n PRO 133 Ca 0.24 0.35 0.10 0.00 -0.04 0.00 0.00 63.50 64.15 3iod n PRO 133 Cb 0.53 -1.63 0.06 0.00 -0.04 0.00 0.00 33.50 32.41 3iod n PRO 133 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 3iod n THR 134 N -1.76 0.00 0.05 0.52 -2.24 -1.26 -4.69 114.28 104.90 3iod n THR 134 Ca 0.02 -0.45 -0.11 0.00 -2.27 0.00 0.00 64.05 61.25 3iod n THR 134 Cb 0.16 1.35 -0.05 0.00 -2.10 0.00 0.00 70.33 69.69 3iod n THR 134 CO 0.00 0.00 0.00 -0.74 -0.57 0.00 0.00 175.07 173.76 3iod h HIS 135 N 3.32 -0.30 0.00 4.78 6.17 -1.54 -2.31 115.15 125.27 3iod h HIS 135 Ca 0.00 0.01 -0.08 0.00 0.71 0.00 0.00 60.37 61.01 3iod h HIS 135 Cb 0.76 0.13 -0.01 0.00 2.52 0.00 0.00 27.41 30.81 3iod h HIS 135 CO 0.00 -0.18 -0.38 0.74 0.71 0.00 0.00 177.93 178.82 3iod h PHE 136 N -0.20 0.00 -0.76 5.26 0.04 -1.84 -2.03 116.94 117.42 3iod h PHE 136 Ca 0.04 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.82 3iod h PHE 136 Cb 0.25 0.00 -0.04 0.00 2.20 0.00 0.00 35.95 38.36 3iod h PHE 136 CO -0.18 0.38 0.49 0.00 -0.60 0.00 0.00 178.31 178.41 3iod h ALA 137 N 1.62 0.97 -0.27 2.45 0.00 -1.77 0.15 119.26 122.41 3iod h ALA 137 Ca -0.00 -0.06 0.04 0.00 0.00 0.00 0.00 54.91 54.88 3iod h ALA 137 Cb 1.16 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 18.61 3iod h ALA 137 CO 0.05 0.40 0.05 0.78 0.00 0.00 0.00 179.25 180.53 3iod h GLY 138 N 1.03 0.30 0.78 0.00 0.00 -0.82 -1.15 103.07 103.22 3iod h GLY 138 Ca 0.28 -0.02 -0.02 0.00 0.00 0.00 0.00 47.33 47.56 3iod h GLY 138 CO -0.06 -0.01 -0.00 -2.08 0.00 0.00 0.00 176.54 174.39 3iod h VAL 139 N 0.16 1.26 -0.19 4.60 2.07 -1.05 -2.16 116.25 120.94 3iod h VAL 139 Ca 0.12 -0.85 -0.12 0.00 0.82 0.00 0.00 66.70 66.67 3iod h VAL 139 Cb 0.12 1.53 -0.01 0.00 -1.52 0.00 0.00 31.29 31.41 3iod h VAL 139 CO -0.16 0.25 -0.40 -0.07 0.02 0.00 0.00 177.57 177.22 3iod h LEU 140 N 0.00 0.45 -0.29 2.57 3.38 -0.67 -0.61 115.31 120.14 3iod h LEU 140 Ca 0.04 -0.19 -0.02 0.00 0.09 0.00 0.00 57.88 57.80 3iod h LEU 140 Cb 0.38 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.00 3iod h LEU 140 CO 0.01 0.80 0.10 0.74 0.09 0.00 0.00 178.44 180.18 3iod h THR 141 N 0.36 1.19 -0.30 0.22 2.02 -1.16 -0.10 112.91 115.14 3iod h THR 141 Ca 0.03 -0.60 -0.16 0.00 0.77 0.00 0.00 66.41 66.46 3iod h THR 141 Cb 0.85 1.05 -0.01 0.00 -1.74 0.00 0.00 68.15 68.31 3iod h THR 141 CO 0.07 0.20 -0.44 1.62 0.37 0.00 0.00 175.52 177.34 3iod h VAL 142 N 0.31 1.29 -0.52 3.16 3.04 -1.13 -2.09 116.25 120.31 3iod h VAL 142 Ca 0.09 -1.63 -0.12 0.00 -1.01 0.00 0.00 66.70 64.04 3iod h VAL 142 Cb 0.22 1.53 -0.02 0.00 -2.01 0.00 0.00 31.29 31.01 3iod h VAL 142 CO -0.00 0.53 -0.14 0.58 -1.01 0.00 0.00 177.57 177.52 3iod h VAL 143 N 0.61 1.27 -0.40 1.51 2.07 -1.03 -0.59 116.25 119.69 3iod h VAL 143 Ca 0.04 -1.30 0.04 0.00 0.82 0.00 0.00 66.70 66.30 3iod h VAL 143 Cb 1.00 1.01 -0.04 0.00 -1.52 0.00 0.00 31.29 31.74 3iod h VAL 143 CO 0.10 0.45 0.17 0.25 0.02 0.00 0.00 177.57 178.56 3iod h LEU 144 N 0.88 0.23 -0.37 2.57 5.85 -0.88 0.14 115.31 123.73 3iod h LEU 144 Ca 0.13 0.03 0.01 0.00 0.84 0.00 0.00 57.88 58.89 3iod h LEU 144 Cb 0.71 -0.01 -0.02 0.00 0.37 0.00 0.00 40.66 41.71 3iod h LEU 144 CO 0.05 0.17 0.23 0.11 -0.34 0.00 0.00 178.44 178.67 3iod h LYS 145 N 0.36 0.46 -0.93 1.25 1.57 -0.91 -0.85 116.57 117.53 3iod h LYS 145 Ca 0.18 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.93 3iod h LYS 145 Cb 0.12 -0.10 -0.05 0.00 0.08 0.00 0.00 32.23 32.28 3iod h LYS 145 CO -0.15 0.31 0.59 -0.07 -0.57 0.00 0.00 179.45 179.56 3iod h LEU 146 N 0.48 1.09 -1.11 2.94 3.38 -0.84 0.61 115.31 121.85 3iod h LEU 146 Ca 0.14 -0.04 -0.07 0.00 0.09 0.00 0.00 57.88 58.00 3iod h LEU 146 Cb -0.03 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.43 3iod h LEU 146 CO -0.05 0.81 -0.11 -0.07 0.09 0.00 0.00 178.44 179.11 3iod h LEU 147 N 1.27 0.48 -0.24 1.67 3.38 -0.41 -0.71 115.31 120.75 3iod h LEU 147 Ca 0.34 -0.12 -0.21 0.00 0.09 0.00 0.00 57.88 57.98 3iod h LEU 147 Cb -0.11 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.51 3iod h LEU 147 CO -0.07 0.63 -0.91 1.56 0.09 0.00 0.00 178.44 179.74 3iod h GLN 148 N 0.47 0.27 -0.05 1.13 1.08 -0.22 0.67 115.11 118.46 3iod h GLN 148 Ca 0.09 -0.29 -0.02 0.00 -1.45 0.00 0.00 58.65 56.98 3iod h GLN 148 Cb 0.47 0.09 -0.00 0.00 -0.05 0.00 0.00 27.48 27.98 3iod h GLN 148 CO 0.03 1.01 -0.04 0.82 -0.95 0.00 0.00 178.83 179.70 3iod h ILE 149 N 0.15 1.36 0.00 2.54 2.04 -0.67 -3.35 117.51 119.58 3iod h ILE 149 Ca -0.06 -1.13 -0.26 0.00 1.00 0.00 0.00 64.86 64.42 3iod h ILE 149 Cb 1.54 2.01 -0.04 0.00 -0.74 0.00 0.00 36.82 39.59 3iod h ILE 149 CO 0.14 0.31 -1.63 0.52 0.00 0.00 0.00 178.15 177.49 3iod n VAL 150 N -4.78 1.49 -3.95 1.67 0.31 -0.29 -4.11 118.33 108.67 3iod n VAL 150 Ca -0.08 -0.77 -0.36 0.00 -0.01 0.00 0.00 64.34 63.13 3iod n VAL 150 Cb 0.27 -0.95 0.01 0.00 -0.91 0.00 0.00 33.84 32.26 3iod n VAL 150 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 3iod n ARG 151 N -3.00 -1.21 -1.96 5.55 5.12 0.23 -4.79 116.66 116.60 3iod n ARG 151 Ca -0.15 0.27 -0.33 0.00 -1.93 0.00 0.00 57.85 55.71 3iod n ARG 151 Cb 0.99 -3.56 0.02 0.00 -1.16 0.00 0.00 32.46 28.75 3iod n ARG 151 CO 0.00 0.00 0.00 -1.25 -1.93 0.00 0.00 177.63 174.45 3iod s PRO 152 N -6.77 3.17 0.22 5.56 0.04 -1.26 -4.87 135.00 131.08 3iod s PRO 152 Ca 0.34 1.26 -0.04 0.00 0.04 0.00 0.00 61.00 62.60 3iod s PRO 152 Cb -0.16 -2.01 0.20 0.00 0.04 0.00 0.00 34.50 32.58 3iod s PRO 152 CO 0.92 -0.94 1.63 -0.44 0.04 0.00 0.00 177.00 178.22 3iod h ASP 153 N 0.32 0.75 -4.65 6.66 3.32 -0.80 -3.43 116.42 118.60 3iod h ASP 153 Ca -0.47 -0.27 -0.18 0.00 0.02 0.00 0.00 57.03 56.13 3iod h ASP 153 Cb 1.23 -0.21 -0.23 0.00 0.22 0.00 0.00 39.33 40.34 3iod h ASP 153 CO 0.56 0.96 -0.67 -0.13 -1.72 0.00 0.00 179.24 178.24 3iod s ARG 154 N -4.57 0.25 -0.01 3.56 0.52 -1.21 -1.41 118.95 116.08 3iod s ARG 154 Ca -0.09 -0.41 0.04 0.00 -0.52 0.00 0.00 55.73 54.74 3iod s ARG 154 Cb 0.13 0.09 -0.01 0.00 0.52 0.00 0.00 34.95 35.69 3iod s ARG 154 CO 0.83 -0.04 -0.12 0.54 0.02 0.00 0.00 175.30 176.52 3iod s VAL 155 N -1.06 0.99 -0.13 3.52 0.11 -0.36 -0.70 120.40 122.77 3iod s VAL 155 Ca -0.12 -0.52 0.02 0.00 -2.93 0.00 0.00 61.98 58.43 3iod s VAL 155 Cb -0.07 -0.84 -0.00 0.00 -1.53 0.00 0.00 36.38 33.94 3iod s VAL 155 CO -0.00 0.28 -0.19 -0.36 -3.33 0.00 0.00 175.10 171.50 3iod s PHE 156 N -0.20 2.68 0.04 1.54 0.40 -0.47 -0.55 117.98 121.43 3iod s PHE 156 Ca 0.03 -1.03 0.04 0.00 -0.60 0.00 0.00 56.93 55.37 3iod s PHE 156 Cb -0.06 -1.80 -0.02 0.00 0.51 0.00 0.00 43.02 41.65 3iod s PHE 156 CO -0.00 -0.43 -0.11 -0.06 0.70 0.00 0.00 175.22 175.32 3iod s PHE 157 N 0.55 0.94 0.38 0.36 0.08 -0.57 -4.22 117.98 115.50 3iod s PHE 157 Ca -0.12 -0.40 -0.24 0.00 0.12 0.00 0.00 56.93 56.30 3iod s PHE 157 Cb -0.16 -0.55 -0.10 0.00 -0.57 0.00 0.00 43.02 41.63 3iod s PHE 157 CO 0.04 -0.01 0.98 0.20 -0.10 0.00 0.00 175.22 176.33 3iod s GLY 158 N -1.32 2.64 0.46 4.36 0.00 -1.26 -0.80 107.32 111.38 3iod s GLY 158 Ca -0.03 0.53 0.31 0.00 0.00 0.00 0.00 44.72 45.52 3iod s GLY 158 CO 0.01 0.91 1.91 0.83 0.00 0.00 0.00 173.10 176.76 3iod h GLU 159 N 2.51 0.00 -0.81 2.90 5.08 -0.94 -3.20 114.58 120.12 3iod h GLU 159 Ca -0.48 0.00 0.15 0.00 -1.00 0.00 0.00 59.36 58.03 3iod h GLU 159 Cb 1.20 0.00 -0.10 0.00 0.50 0.00 0.00 28.75 30.35 3iod h GLU 159 CO 0.63 0.00 0.38 -0.22 -1.00 0.00 0.00 179.01 178.79 3iod h LYS 160 N 0.00 0.51 -3.20 2.33 3.64 -1.92 -2.49 116.57 115.45 3iod h LYS 160 Ca 0.00 -0.03 -0.80 0.00 -1.27 0.00 0.00 60.65 58.55 3iod h LYS 160 Cb 0.43 -0.12 -0.26 0.00 -0.41 0.00 0.00 32.23 31.88 3iod h LYS 160 CO 0.00 0.34 0.95 -0.25 -2.27 0.00 0.00 179.45 178.22 3iod n ASP 161 N -4.94 6.02 -0.15 4.20 8.00 -1.21 -4.67 116.55 123.81 3iod n ASP 161 Ca 0.16 -3.29 -0.12 0.00 0.71 0.00 0.00 54.79 52.26 3iod n ASP 161 Cb 0.44 -1.33 -0.01 0.00 -0.02 0.00 0.00 41.12 40.20 3iod n ASP 161 CO 0.00 0.00 0.00 0.22 -0.39 0.00 0.00 177.20 177.03 3iod h TYR 162 N 5.76 1.15 -0.65 1.24 3.20 -1.67 -1.22 116.97 124.77 3iod h TYR 162 Ca 0.23 -0.30 -0.08 0.00 3.14 0.00 0.00 58.73 61.73 3iod h TYR 162 Cb 0.67 -0.26 -0.03 0.00 1.54 0.00 0.00 36.73 38.65 3iod h TYR 162 CO 1.01 1.13 0.11 0.37 -1.64 0.00 0.00 178.16 179.14 3iod h GLN 163 N 0.84 1.07 -0.49 1.82 4.15 -1.88 -0.39 115.11 120.23 3iod h GLN 163 Ca 0.10 -0.28 0.02 0.00 0.77 0.00 0.00 58.65 59.26 3iod h GLN 163 Cb 0.85 -0.13 -0.03 0.00 0.21 0.00 0.00 27.48 28.38 3iod h GLN 163 CO 0.08 0.98 0.30 0.37 -1.93 0.00 0.00 178.83 178.63 3iod h GLN 164 N 1.00 0.60 -0.33 1.69 4.15 -1.86 -0.89 115.11 119.47 3iod h GLN 164 Ca 0.20 -0.04 0.01 0.00 0.77 0.00 0.00 58.65 59.60 3iod h GLN 164 Cb 0.43 -0.13 -0.02 0.00 0.21 0.00 0.00 27.48 27.96 3iod h GLN 164 CO 0.01 0.39 0.20 1.25 -1.93 0.00 0.00 178.83 178.76 3iod h LEU 165 N 0.61 0.33 -0.38 -2.39 5.85 -0.73 0.22 115.31 118.82 3iod h LEU 165 Ca 0.19 -0.00 0.03 0.00 0.84 0.00 0.00 57.88 58.95 3iod h LEU 165 Cb -0.02 -0.07 -0.04 0.00 0.37 0.00 0.00 40.66 40.91 3iod h LEU 165 CO -0.07 0.24 0.17 0.58 -0.34 0.00 0.00 178.44 179.02 3iod h VAL 166 N 0.41 0.94 -0.38 1.05 2.07 -0.81 -0.86 116.25 118.68 3iod h VAL 166 Ca 0.13 -0.12 -0.07 0.00 0.82 0.00 0.00 66.70 67.46 3iod h VAL 166 Cb -0.01 0.57 -0.02 0.00 -1.52 0.00 0.00 31.29 30.31 3iod h VAL 166 CO -0.05 0.06 -0.07 -0.07 0.02 0.00 0.00 177.57 177.46 3iod h LEU 167 N 0.35 0.61 -0.73 2.57 3.38 -0.86 -0.78 115.31 119.83 3iod h LEU 167 Ca 0.16 -0.15 -0.10 0.00 0.09 0.00 0.00 57.88 57.88 3iod h LEU 167 Cb 0.10 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.67 3iod h LEU 167 CO -0.14 0.73 -0.10 0.40 0.09 0.00 0.00 178.44 179.42 3iod h ILE 168 N 0.59 1.26 -0.48 1.22 2.04 -0.52 0.58 117.51 122.20 3iod h ILE 168 Ca 0.11 -1.20 -0.03 0.00 1.00 0.00 0.00 64.86 64.75 3iod h ILE 168 Cb 0.48 1.01 -0.02 0.00 -0.74 0.00 0.00 36.82 37.54 3iod h ILE 168 CO 0.03 0.41 0.18 0.03 0.00 0.00 0.00 178.15 178.80 3iod h ARG 169 N 0.78 0.69 -0.29 2.37 3.08 -0.50 -1.21 114.38 119.29 3iod h ARG 169 Ca 0.13 -0.10 -0.04 0.00 0.07 0.00 0.00 59.98 60.04 3iod h ARG 169 Cb 0.61 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.53 3iod h ARG 169 CO 0.04 0.58 0.02 1.96 -1.07 0.00 0.00 179.97 181.50 3iod h GLN 170 N 0.68 0.49 -0.36 0.04 4.20 -0.40 -0.85 115.11 118.91 3iod h GLN 170 Ca 0.16 -0.15 0.07 0.00 0.06 0.00 0.00 58.65 58.80 3iod h GLN 170 Cb 0.15 -0.05 -0.06 0.00 0.30 0.00 0.00 27.48 27.82 3iod h GLN 170 CO -0.01 0.62 -0.01 1.25 -0.67 0.00 0.00 178.83 180.01 3iod h LEU 171 N 0.30 -0.18 -0.05 1.46 5.85 -0.52 0.14 115.31 122.32 3iod h LEU 171 Ca 0.08 0.09 -0.00 0.00 0.84 0.00 0.00 57.88 58.89 3iod h LEU 171 Cb 0.38 0.16 -0.00 0.00 0.37 0.00 0.00 40.66 41.57 3iod h LEU 171 CO 0.01 -0.05 0.02 0.58 -0.34 0.00 0.00 178.44 178.66 3iod h VAL 172 N 0.08 1.12 -0.12 1.05 2.07 -1.13 -0.80 116.25 118.53 3iod h VAL 172 Ca 0.18 -0.35 -0.00 0.00 0.82 0.00 0.00 66.70 67.35 3iod h VAL 172 Cb 0.25 1.26 -0.01 0.00 -1.52 0.00 0.00 31.29 31.27 3iod h VAL 172 CO -0.31 0.10 0.07 0.00 0.02 0.00 0.00 177.57 177.45 3iod h ALA 173 N 0.88 0.15 -0.06 1.67 0.00 -0.98 -0.67 119.26 120.25 3iod h ALA 173 Ca 0.02 -0.03 -0.12 0.00 0.00 0.00 0.00 54.91 54.77 3iod h ALA 173 Cb 0.14 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 3iod h ALA 173 CO -0.00 -0.34 -0.52 -0.44 0.00 0.00 0.00 179.25 177.95 3iod h ASP 174 N 0.13 0.19 -0.61 0.00 3.32 -0.57 -2.64 116.42 116.23 3iod h ASP 174 Ca 0.04 -0.09 0.00 0.00 0.02 0.00 0.00 57.03 57.00 3iod h ASP 174 Cb 0.03 -0.05 0.00 0.00 0.22 0.00 0.00 39.33 39.52 3iod h ASP 174 CO -0.01 0.68 0.00 0.49 -1.72 0.00 0.00 179.24 178.68 3iod n PHE 175 N -3.93 1.16 -3.59 4.55 3.72 -0.32 -4.97 117.46 114.09 3iod n PHE 175 Ca -0.02 -0.58 -0.27 0.00 -0.05 0.00 0.00 57.45 56.54 3iod n PHE 175 Cb 0.55 -0.14 0.03 0.00 -0.94 0.00 0.00 39.48 38.98 3iod n PHE 175 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 3iod n ASN 176 N 1.11 -5.07 -4.74 4.37 4.13 -0.86 -4.92 115.26 109.30 3iod n ASN 176 Ca 0.23 -0.57 -0.41 0.00 1.68 0.00 0.00 54.58 55.51 3iod n ASN 176 Cb 0.75 -4.07 -0.03 0.00 -1.54 0.00 0.00 39.78 34.89 3iod n ASN 176 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 3iod s LEU 177 N -7.01 4.43 -1.26 3.41 1.43 -0.31 -4.91 118.68 114.45 3iod s LEU 177 Ca 0.53 2.31 -0.08 0.00 -1.03 0.00 0.00 54.13 55.87 3iod s LEU 177 Cb -0.26 -3.61 0.18 0.00 0.03 0.00 0.00 46.19 42.53 3iod s LEU 177 CO 0.66 -0.46 1.94 -0.67 0.23 0.00 0.00 176.35 178.06 3iod n ASP 178 N 2.63 5.92 -3.79 2.29 2.03 -1.26 -4.85 116.55 119.52 3iod n ASP 178 Ca 0.05 -3.17 -0.13 0.00 0.52 0.00 0.00 54.79 52.07 3iod n ASP 178 Cb 0.44 -1.42 -0.11 0.00 -0.72 0.00 0.00 41.12 39.31 3iod n ASP 178 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 3iod s VAL 179 N -0.41 0.03 -0.11 5.18 0.11 -1.26 -4.81 120.40 119.12 3iod s VAL 179 Ca 0.42 -0.21 -0.16 0.00 -2.93 0.00 0.00 61.98 59.10 3iod s VAL 179 Cb 0.11 -0.43 -0.05 0.00 -1.53 0.00 0.00 36.38 34.49 3iod s VAL 179 CO -0.01 -0.12 0.40 0.00 -3.33 0.00 0.00 175.10 172.04 3iod s ALA 180 N -0.41 3.56 -0.24 1.54 0.00 -0.50 -4.97 121.76 120.74 3iod s ALA 180 Ca -0.05 -0.29 -0.15 0.00 0.00 0.00 0.00 51.96 51.47 3iod s ALA 180 Cb -0.03 -2.51 -0.04 0.00 0.00 0.00 0.00 23.12 20.54 3iod s ALA 180 CO 0.01 0.12 0.38 0.08 0.00 0.00 0.00 175.76 176.35 3iod s VAL 181 N 0.27 5.19 -0.27 0.00 1.01 -1.26 -1.23 120.40 124.11 3iod s VAL 181 Ca 0.22 0.62 -0.06 0.00 0.00 0.00 0.00 61.98 62.76 3iod s VAL 181 Cb -0.15 -3.71 -0.00 0.00 0.00 0.00 0.00 36.38 32.52 3iod s VAL 181 CO 0.08 0.20 0.05 -0.69 0.00 0.00 0.00 175.10 174.75 3iod s VAL 182 N 1.72 3.92 -0.10 2.92 1.01 0.29 -4.97 120.40 125.19 3iod s VAL 182 Ca 0.16 -0.51 -0.18 0.00 0.00 0.00 0.00 61.98 61.45 3iod s VAL 182 Cb -0.15 -2.92 -0.04 0.00 0.00 0.00 0.00 36.38 33.26 3iod s VAL 182 CO 0.09 0.22 0.48 -0.83 0.00 0.00 0.00 175.10 175.06 3iod s GLY 183 N 1.52 2.42 -0.13 4.51 0.00 -1.26 -1.51 107.32 112.87 3iod s GLY 183 Ca 0.04 -0.18 -0.00 0.00 0.00 0.00 0.00 44.72 44.58 3iod s GLY 183 CO 0.01 0.72 -0.12 0.14 0.00 0.00 0.00 173.10 173.85 3iod s VAL 184 N 0.42 3.19 0.53 1.40 1.01 0.02 -4.91 120.40 122.05 3iod s VAL 184 Ca 0.26 -0.62 -0.22 0.00 0.00 0.00 0.00 61.98 61.41 3iod s VAL 184 Cb -0.15 -2.34 -0.06 0.00 0.00 0.00 0.00 36.38 33.82 3iod s VAL 184 CO 0.11 0.52 1.20 -2.65 0.00 0.00 0.00 175.10 174.28 3iod n PRO 185 N 3.45 1.46 -1.76 2.72 -0.02 -1.26 -0.31 135.00 139.28 3iod n PRO 185 Ca -0.18 0.54 -0.42 0.00 -2.02 0.00 0.00 63.50 61.42 3iod n PRO 185 Cb 0.53 -2.38 -0.03 0.00 -0.02 0.00 0.00 33.50 31.60 3iod n PRO 185 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 3iod s THR 186 N -1.34 2.09 0.01 3.45 2.01 -1.26 -4.71 115.64 115.89 3iod s THR 186 Ca 0.70 0.06 -0.20 0.00 0.31 0.00 0.00 61.69 62.57 3iod s THR 186 Cb -0.45 -3.04 -0.06 0.00 0.01 0.00 0.00 72.50 68.97 3iod s THR 186 CO 0.51 0.01 0.59 -0.69 -0.69 0.00 0.00 174.62 174.34 3iod s VAL 187 N 0.86 4.88 0.09 3.82 1.01 -1.26 -5.01 120.40 124.79 3iod s VAL 187 Ca 0.71 1.24 0.08 0.00 0.00 0.00 0.00 61.98 64.02 3iod s VAL 187 Cb -0.49 -3.93 -0.03 0.00 0.00 0.00 0.00 36.38 31.93 3iod s VAL 187 CO 0.36 0.44 -0.22 -0.13 0.00 0.00 0.00 175.10 175.55 3iod s ARG 188 N -0.34 1.22 1.06 2.72 0.52 -1.26 -0.97 118.95 121.90 3iod s ARG 188 Ca 0.31 -1.15 -0.12 0.00 -0.52 0.00 0.00 55.73 54.24 3iod s ARG 188 Cb -0.18 -1.49 0.23 0.00 0.52 0.00 0.00 34.95 34.02 3iod s ARG 188 CO 0.18 0.35 1.06 -1.21 0.02 0.00 0.00 175.30 175.70 3iod s GLU 189 N -1.79 -0.12 0.49 3.54 0.41 0.32 -4.86 118.70 116.68 3iod s GLU 189 Ca 0.08 0.81 0.20 0.00 -0.41 0.00 0.00 54.97 55.64 3iod s GLU 189 Cb -0.10 -1.65 1.23 0.00 -1.78 0.00 0.00 34.13 31.84 3iod s GLU 189 CO 0.04 -3.18 2.00 0.00 -0.49 0.00 0.00 175.26 173.63 3iod h ALA 190 N -2.23 2.26 -0.01 5.21 0.00 -2.01 -0.38 119.26 122.11 3iod h ALA 190 Ca -0.57 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.33 3iod h ALA 190 Cb 1.32 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.10 3iod h ALA 190 CO 0.52 -0.40 -0.13 -0.40 0.00 0.00 0.00 179.25 178.83 3iod n ASP 191 N -4.43 0.91 0.00 0.00 5.75 -1.26 -4.92 116.55 112.59 3iod n ASP 191 Ca 0.09 -0.95 0.00 0.00 -0.01 0.00 0.00 54.79 53.92 3iod n ASP 191 Cb 0.48 0.03 0.00 0.00 -1.03 0.00 0.00 41.12 40.60 3iod n ASP 191 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3iod n GLY 192 N 1.26 1.37 3.69 6.12 0.00 -0.15 -4.88 105.19 112.60 3iod n GLY 192 Ca 0.15 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.74 3iod n GLY 192 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 3iod n LEU 193 N 0.00 3.95 -4.72 0.99 7.94 -1.26 -4.59 117.00 119.31 3iod n LEU 193 Ca 0.00 0.99 -0.42 0.00 -1.11 0.00 0.00 56.01 55.47 3iod n LEU 193 Cb 0.00 -1.53 -0.03 0.00 0.53 0.00 0.00 43.42 42.39 3iod n LEU 193 CO 0.00 0.13 1.33 0.00 -1.11 0.00 0.00 177.39 177.74 3iod s ALA 194 N 2.74 3.89 0.27 1.96 0.00 -1.26 -0.52 121.76 128.83 3iod s ALA 194 Ca 0.83 1.52 -0.30 0.00 0.00 0.00 0.00 51.96 54.01 3iod s ALA 194 Cb -0.51 -3.67 -0.10 0.00 0.00 0.00 0.00 23.12 18.84 3iod s ALA 194 CO 0.38 -0.88 1.39 -1.64 0.00 0.00 0.00 175.76 175.02 3iod s MET 195 N 1.17 4.30 -0.11 0.00 -1.94 -0.14 -4.85 119.30 117.72 3iod s MET 195 Ca 0.73 2.26 -0.22 0.00 -1.71 0.00 0.00 55.69 56.75 3iod s MET 195 Cb -0.48 -3.11 0.05 0.00 2.01 0.00 0.00 34.83 33.31 3iod s MET 195 CO 0.32 -0.35 0.55 0.45 -0.01 0.00 0.00 175.02 175.98 3iod s SER 196 N 0.15 -0.52 0.58 3.03 0.15 -1.26 -4.93 113.70 110.88 3iod s SER 196 Ca 0.56 0.75 0.34 0.00 0.70 0.00 0.00 55.95 58.31 3iod s SER 196 Cb -0.41 0.75 1.74 0.00 -1.71 0.00 0.00 66.02 66.39 3iod s SER 196 CO 0.45 -0.40 2.15 0.77 1.20 0.00 0.00 173.24 177.42 3iod h SER 197 N 4.15 0.00 0.95 5.45 4.64 -1.95 -2.30 113.55 124.48 3iod h SER 197 Ca -0.28 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.04 3iod h SER 197 Cb 1.16 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.25 3iod h SER 197 CO 0.29 0.05 0.00 0.03 -0.87 0.00 0.00 176.83 176.33 3iod h ARG 198 N 0.00 0.00 0.00 4.77 3.08 -1.95 -3.22 114.38 117.07 3iod h ARG 198 Ca -0.00 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.02 3iod h ARG 198 Cb 0.26 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.30 3iod h ARG 198 CO 0.01 0.00 -0.12 -0.91 -1.07 0.00 0.00 179.97 177.88 3iod h ASN 199 N 0.00 0.00 0.01 7.04 2.35 -1.79 -2.17 115.58 121.02 3iod h ASN 199 Ca 0.00 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.75 3iod h ASN 199 Cb 0.47 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.84 3iod h ASN 199 CO 0.00 0.12 -0.00 0.08 -1.65 0.00 0.00 177.43 175.98 3iod h ARG 200 N 0.00 0.00 -0.23 0.81 0.11 -1.76 -1.60 114.38 111.71 3iod h ARG 200 Ca -0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 3iod h ARG 200 Cb 0.23 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.31 3iod h ARG 200 CO 0.02 0.00 0.00 0.66 0.10 0.00 0.00 179.97 180.75 3iod n TYR 201 N -3.53 0.31 -3.64 4.08 4.01 -0.81 -4.79 117.16 112.79 3iod n TYR 201 Ca -0.03 -0.16 -0.36 0.00 -0.16 0.00 0.00 57.90 57.19 3iod n TYR 201 Cb 0.08 0.00 -0.09 0.00 -0.31 0.00 0.00 39.34 39.02 3iod n TYR 201 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 3iod s LEU 202 N -1.03 4.15 0.82 7.72 1.43 -0.60 -4.79 118.68 126.37 3iod s LEU 202 Ca 0.17 0.19 -0.12 0.00 -1.03 0.00 0.00 54.13 53.35 3iod s LEU 202 Cb 0.09 -2.15 0.09 0.00 0.03 0.00 0.00 46.19 44.24 3iod s LEU 202 CO 0.12 0.08 1.12 1.51 0.23 0.00 0.00 176.35 179.40 3iod s ASP 203 N 0.88 4.28 0.32 2.29 1.47 -1.26 -4.61 116.67 120.04 3iod s ASP 203 Ca 0.09 1.14 0.06 0.00 1.18 0.00 0.00 52.55 55.02 3iod s ASP 203 Cb -0.13 -1.81 0.88 0.00 -0.34 0.00 0.00 42.92 41.52 3iod s ASP 203 CO 0.03 -2.08 1.55 -2.65 0.68 0.00 0.00 175.17 172.71 3iod n PRO 204 N -3.48 -0.07 0.01 2.11 -0.02 -1.26 0.50 135.00 132.78 3iod n PRO 204 Ca 0.07 1.46 -0.13 0.00 -2.02 0.00 0.00 63.50 62.88 3iod n PRO 204 Cb 0.58 -2.38 -0.09 0.00 -0.02 0.00 0.00 33.50 31.59 3iod n PRO 204 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3iod h ALA 205 N 1.98 -0.02 -0.59 3.55 0.00 -1.99 -2.20 119.26 119.98 3iod h ALA 205 Ca 0.65 -0.18 -0.06 0.00 0.00 0.00 0.00 54.91 55.32 3iod h ALA 205 Cb 1.44 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 19.22 3iod h ALA 205 CO -0.90 -0.33 0.13 1.96 0.00 0.00 0.00 179.25 180.11 3iod h GLN 206 N -0.38 0.93 -0.59 0.00 4.20 -1.63 -0.68 115.11 116.97 3iod h GLN 206 Ca -0.00 -0.21 -0.00 0.00 0.06 0.00 0.00 58.65 58.50 3iod h GLN 206 Cb 0.36 -0.13 -0.03 0.00 0.30 0.00 0.00 27.48 27.98 3iod h GLN 206 CO 0.00 0.84 0.36 -0.09 -0.67 0.00 0.00 178.83 179.27 3iod h ARG 207 N 0.89 0.80 -0.38 1.46 9.65 0.04 0.14 114.38 126.98 3iod h ARG 207 Ca 0.19 -0.07 0.00 0.00 -1.10 0.00 0.00 59.98 59.00 3iod h ARG 207 Cb 0.34 -0.17 -0.02 0.00 -1.39 0.00 0.00 29.97 28.73 3iod h ARG 207 CO 0.00 0.57 0.24 0.00 2.80 0.00 0.00 179.97 183.59 3iod h ALA 208 N 1.18 0.49 0.00 2.80 0.00 -0.80 -3.01 119.26 119.91 3iod h ALA 208 Ca 0.21 -0.04 -0.10 0.00 0.00 0.00 0.00 54.91 54.98 3iod h ALA 208 Cb -0.02 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 3iod h ALA 208 CO -0.04 -0.03 -0.47 0.00 0.00 0.00 0.00 179.25 178.70 3iod h ALA 209 N 1.12 1.21 0.00 0.00 0.00 -0.83 -3.23 119.26 117.54 3iod h ALA 209 Ca 0.14 -0.43 -0.00 0.00 0.00 0.00 0.00 54.91 54.62 3iod h ALA 209 Cb -0.02 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.69 3iod h ALA 209 CO -0.03 0.59 -0.02 0.00 0.00 0.00 0.00 179.25 179.80 3iod h ALA 210 N 1.53 1.10 0.00 0.00 0.00 -0.58 -1.50 119.26 119.81 3iod h ALA 210 Ca -0.00 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 3iod h ALA 210 Cb 0.84 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.63 3iod h ALA 210 CO 0.06 0.02 -0.00 -0.24 0.00 0.00 0.00 179.25 179.09 3iod h VAL 211 N 0.00 0.12 0.00 0.00 3.04 -1.66 -2.65 116.25 115.10 3iod h VAL 211 Ca -0.00 -0.01 -0.01 0.00 -1.01 0.00 0.00 66.70 65.67 3iod h VAL 211 Cb 0.14 1.01 -0.00 0.00 -2.01 0.00 0.00 31.29 30.43 3iod h VAL 211 CO 0.00 0.00 -0.05 0.00 -1.01 0.00 0.00 177.57 176.51 3iod h ALA 212 N 2.00 1.80 0.26 3.17 0.00 -1.52 -1.02 119.26 123.96 3iod h ALA 212 Ca -0.00 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 3iod h ALA 212 Cb 0.01 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.79 3iod h ALA 212 CO 0.00 0.07 -0.13 -0.07 0.00 0.00 0.00 179.25 179.12 3iod h LEU 213 N 0.00 -0.30 -0.60 0.00 4.07 -1.70 0.12 115.31 116.90 3iod h LEU 213 Ca -0.00 -0.12 -0.14 0.00 0.08 0.00 0.00 57.88 57.70 3iod h LEU 213 Cb 0.10 0.08 -0.01 0.00 1.08 0.00 0.00 40.66 41.91 3iod h LEU 213 CO 0.01 -0.05 -0.35 0.77 -1.08 0.00 0.00 178.44 177.74 3iod h SER 214 N -0.55 0.77 -0.65 -0.43 4.64 -1.70 -1.57 113.55 114.06 3iod h SER 214 Ca -0.04 -0.33 -0.00 0.00 -0.47 0.00 0.00 61.79 60.95 3iod h SER 214 Cb 0.40 -0.21 -0.03 0.00 -0.31 0.00 0.00 62.40 62.25 3iod h SER 214 CO 0.06 1.04 0.39 0.00 -0.87 0.00 0.00 176.83 177.46 3iod h ALA 215 N 1.00 0.82 -0.10 5.18 0.00 -1.16 0.17 119.26 125.18 3iod h ALA 215 Ca 0.06 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 3iod h ALA 215 Cb 0.88 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 18.40 3iod h ALA 215 CO 0.08 0.30 0.04 0.00 0.00 0.00 0.00 179.25 179.66 3iod h ALA 216 N 1.20 0.12 -0.42 0.00 0.00 -0.53 -0.27 119.26 119.36 3iod h ALA 216 Ca 0.23 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 3iod h ALA 216 Cb -0.03 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 3iod h ALA 216 CO -0.04 -0.30 0.22 -0.07 0.00 0.00 0.00 179.25 179.06 3iod h LEU 217 N 0.01 0.53 -0.53 0.00 3.38 -1.06 -0.68 115.31 116.95 3iod h LEU 217 Ca 0.03 -0.10 -0.15 0.00 0.09 0.00 0.00 57.88 57.75 3iod h LEU 217 Cb 0.15 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.76 3iod h LEU 217 CO -0.00 0.47 -0.48 0.71 0.09 0.00 0.00 178.44 179.23 3iod h THR 218 N 0.54 1.30 -0.21 0.22 1.35 -0.93 -0.49 112.91 114.69 3iod h THR 218 Ca 0.15 -1.69 0.04 0.00 -0.55 0.00 0.00 66.41 64.36 3iod h THR 218 Cb 0.07 1.63 -0.04 0.00 -1.73 0.00 0.00 68.15 68.08 3iod h THR 218 CO -0.02 0.53 -0.05 0.00 -0.25 0.00 0.00 175.52 175.74 3iod h ALA 219 N 0.96 0.15 -0.57 6.62 0.00 -0.92 -2.36 119.26 123.14 3iod h ALA 219 Ca 0.03 0.08 0.04 0.00 0.00 0.00 0.00 54.91 55.05 3iod h ALA 219 Cb 1.03 0.15 -0.04 0.00 0.00 0.00 0.00 17.79 18.93 3iod h ALA 219 CO 0.10 -0.47 0.32 0.00 0.00 0.00 0.00 179.25 179.20 3iod h ALA 220 N 1.21 0.73 -0.45 0.00 0.00 -0.83 0.17 119.26 120.10 3iod h ALA 220 Ca 0.10 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 3iod h ALA 220 Cb 0.15 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 3iod h ALA 220 CO -0.21 0.01 0.24 0.00 0.00 0.00 0.00 179.25 179.29 3iod h ALA 221 N 1.28 1.57 0.01 0.00 0.00 -0.81 -1.07 119.26 120.24 3iod h ALA 221 Ca 0.24 -0.08 -0.24 0.00 0.00 0.00 0.00 54.91 54.84 3iod h ALA 221 Cb 0.09 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.66 3iod h ALA 221 CO -0.13 0.36 -1.21 0.45 0.00 0.00 0.00 179.25 178.72 3iod h HIS 222 N 0.63 0.03 0.00 0.00 3.86 -0.94 -3.25 115.15 115.48 3iod h HIS 222 Ca 0.16 -0.02 -0.01 0.00 -1.16 0.00 0.00 60.37 59.34 3iod h HIS 222 Cb 0.03 -0.00 -0.00 0.00 1.06 0.00 0.00 27.41 28.50 3iod h HIS 222 CO 0.00 1.02 -0.06 0.00 0.86 0.00 0.00 177.93 179.75 3iod h ALA 223 N 0.97 1.05 0.00 2.45 0.00 -0.06 -3.30 119.26 120.37 3iod h ALA 223 Ca -0.09 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.76 3iod h ALA 223 Cb 1.85 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.63 3iod h ALA 223 CO 0.12 0.08 0.00 0.00 0.00 0.00 0.00 179.25 179.45 3iod h ALA 224 N 1.94 1.00 -0.03 0.00 0.00 -1.25 -0.22 119.26 120.70 3iod h ALA 224 Ca -0.00 0.00 0.01 0.00 0.00 0.00 0.00 54.91 54.92 3iod h ALA 224 Cb 0.46 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.25 3iod h ALA 224 CO 0.01 0.00 0.02 1.79 0.00 0.00 0.00 179.25 181.07 3iod h THR 225 N 0.00 0.75 -0.07 0.00 1.35 -1.78 -0.46 112.91 112.70 3iod h THR 225 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.86 3iod h THR 225 Cb 0.19 0.98 0.00 0.00 -1.73 0.00 0.00 68.15 67.59 3iod h THR 225 CO 0.00 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 175.27 3iod n ALA 226 N -2.43 2.57 0.00 6.62 0.00 -0.09 -4.21 120.51 122.96 3iod n ALA 226 Ca -0.02 -0.44 0.00 0.00 0.00 0.00 0.00 53.44 52.98 3iod n ALA 226 Cb 0.11 -1.17 0.00 0.00 0.00 0.00 0.00 19.45 18.39 3iod n ALA 226 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3iod n GLY 227 N 1.13 2.01 0.32 0.00 0.00 -0.69 -4.56 105.19 103.40 3iod n GLY 227 Ca 0.18 -2.13 -0.07 0.00 0.00 0.00 0.00 46.02 44.01 3iod n GLY 227 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3iod h ALA 228 N 0.00 0.94 -0.33 4.61 0.00 -1.93 -2.13 119.26 120.42 3iod h ALA 228 Ca 0.00 -0.23 -0.02 0.00 0.00 0.00 0.00 54.91 54.66 3iod h ALA 228 Cb 0.00 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.50 3iod h ALA 228 CO 0.00 0.64 0.14 0.37 0.00 0.00 0.00 179.25 180.40 3iod h GLN 229 N 1.07 0.48 -0.71 0.00 5.75 -1.98 -0.73 115.11 118.99 3iod h GLN 229 Ca 0.23 -0.08 0.04 0.00 -0.15 0.00 0.00 58.65 58.69 3iod h GLN 229 Cb 0.33 -0.08 -0.05 0.00 1.07 0.00 0.00 27.48 28.75 3iod h GLN 229 CO -0.00 0.47 0.43 0.00 -2.65 0.00 0.00 178.83 177.08 3iod h ALA 230 N 0.99 0.93 0.05 3.38 0.00 -1.77 0.12 119.26 122.96 3iod h ALA 230 Ca 0.11 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 3iod h ALA 230 Cb 0.16 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.75 3iod h ALA 230 CO -0.01 0.18 -0.03 0.00 0.00 0.00 0.00 179.25 179.39 3iod h ALA 231 N 1.32 -0.07 -0.62 0.00 0.00 -1.01 -0.11 119.26 118.76 3iod h ALA 231 Ca 0.29 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 55.07 3iod h ALA 231 Cb 0.08 0.03 -0.03 0.00 0.00 0.00 0.00 17.79 17.87 3iod h ALA 231 CO -0.13 -0.43 0.32 -0.07 0.00 0.00 0.00 179.25 178.94 3iod h LEU 232 N -0.30 0.79 -0.83 0.00 3.38 -0.91 -2.05 115.31 115.40 3iod h LEU 232 Ca -0.01 -0.11 -0.10 0.00 0.09 0.00 0.00 57.88 57.75 3iod h LEU 232 Cb 0.26 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.80 3iod h LEU 232 CO 0.01 0.68 -0.19 0.44 0.09 0.00 0.00 178.44 179.47 3iod h ASP 233 N 0.85 0.67 -0.05 -0.43 3.32 -0.67 -0.26 116.42 119.85 3iod h ASP 233 Ca 0.22 -0.22 0.01 0.00 0.02 0.00 0.00 57.03 57.05 3iod h ASP 233 Cb 0.08 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.44 3iod h ASP 233 CO -0.03 0.86 0.01 0.00 -1.72 0.00 0.00 179.24 178.36 3iod h ALA 234 N 1.20 0.05 -0.42 3.45 0.00 -0.78 -0.57 119.26 122.19 3iod h ALA 234 Ca 0.09 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 3iod h ALA 234 Cb 0.66 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.44 3iod h ALA 234 CO 0.05 -0.47 0.26 0.00 0.00 0.00 0.00 179.25 179.09 3iod h ALA 235 N 1.04 0.53 -0.79 0.00 0.00 -1.08 -2.38 119.26 116.59 3iod h ALA 235 Ca 0.02 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.85 3iod h ALA 235 Cb 0.02 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.60 3iod h ALA 235 CO -0.03 0.02 0.38 -0.09 0.00 0.00 0.00 179.25 179.52 3iod h ARG 236 N 0.55 1.13 -0.52 0.00 9.65 -0.89 -1.17 114.38 123.13 3iod h ARG 236 Ca 0.15 -0.16 -0.04 0.00 -1.10 0.00 0.00 59.98 58.83 3iod h ARG 236 Cb -0.01 -0.21 -0.02 0.00 -1.39 0.00 0.00 29.97 28.34 3iod h ARG 236 CO -0.03 0.87 0.15 0.00 2.80 0.00 0.00 179.97 183.76 3iod h ALA 237 N 1.30 0.68 -0.22 2.80 0.00 -0.85 0.26 119.26 123.23 3iod h ALA 237 Ca 0.27 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 3iod h ALA 237 Cb 0.11 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 3iod h ALA 237 CO -0.03 0.35 0.09 0.28 0.00 0.00 0.00 179.25 179.93 3iod h VAL 238 N 0.71 1.16 -0.76 0.00 2.07 -1.06 -1.94 116.25 116.44 3iod h VAL 238 Ca 0.17 -0.49 -0.05 0.00 0.82 0.00 0.00 66.70 67.15 3iod h VAL 238 Cb 0.29 1.08 -0.03 0.00 -1.52 0.00 0.00 31.29 31.11 3iod h VAL 238 CO -0.00 0.16 0.29 -0.07 0.02 0.00 0.00 177.57 177.97 3iod h LEU 239 N 0.20 1.05 -2.18 2.57 3.38 -1.01 -2.06 115.31 117.27 3iod h LEU 239 Ca 0.07 -0.18 -0.01 0.00 0.09 0.00 0.00 57.88 57.86 3iod h LEU 239 Cb 0.17 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 40.65 3iod h LEU 239 CO -0.01 0.95 -0.05 0.44 0.09 0.00 0.00 178.44 179.86 3iod h ASP 240 N 1.10 0.00 -0.15 -0.43 3.32 -0.36 -1.87 116.42 118.03 3iod h ASP 240 Ca 0.25 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.30 3iod h ASP 240 Cb 0.23 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.78 3iod h ASP 240 CO -0.02 0.05 0.00 0.00 -1.72 0.00 0.00 179.24 177.55 3iod n ALA 241 N -2.37 2.53 -2.76 3.45 0.00 -0.74 -4.84 120.51 115.79 3iod n ALA 241 Ca -0.03 -0.47 -0.39 0.00 0.00 0.00 0.00 53.44 52.56 3iod n ALA 241 Cb 0.14 -1.11 -0.11 0.00 0.00 0.00 0.00 19.45 18.36 3iod n ALA 241 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3iod s ALA 242 N -1.81 3.36 -0.05 0.00 0.00 -0.70 -5.04 121.76 117.50 3iod s ALA 242 Ca 0.31 -1.36 -0.29 0.00 0.00 0.00 0.00 51.96 50.62 3iod s ALA 242 Cb 0.17 -2.46 -0.07 0.00 0.00 0.00 0.00 23.12 20.75 3iod s ALA 242 CO 0.25 -0.89 1.89 -1.25 0.00 0.00 0.00 175.76 175.76 3iod s PRO 243 N 1.66 3.96 -0.57 0.00 0.04 -1.26 -2.91 135.00 135.91 3iod s PRO 243 Ca 0.05 2.32 0.00 0.00 0.04 0.00 0.00 61.00 63.41 3iod s PRO 243 Cb -0.17 -4.14 0.00 0.00 0.04 0.00 0.00 34.50 30.23 3iod s PRO 243 CO 0.08 -1.14 0.00 0.41 0.04 0.00 0.00 177.00 176.38 3iod n GLY 244 N 4.64 0.45 3.53 0.56 0.00 -1.26 -4.83 105.19 108.28 3iod n GLY 244 Ca 0.21 -0.70 -0.38 0.00 0.00 0.00 0.00 46.02 45.14 3iod n GLY 244 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3iod s VAL 245 N -2.26 4.99 -0.27 1.61 1.01 -1.15 -4.39 120.40 119.94 3iod s VAL 245 Ca 0.00 -0.04 -0.08 0.00 0.00 0.00 0.00 61.98 61.86 3iod s VAL 245 Cb 0.00 -3.42 -0.02 0.00 0.00 0.00 0.00 36.38 32.95 3iod s VAL 245 CO 0.00 0.21 0.09 0.00 0.00 0.00 0.00 175.10 175.39 3iod s ALA 246 N 1.70 3.16 -0.12 5.51 0.00 0.13 -4.95 121.76 127.20 3iod s ALA 246 Ca 0.06 -1.24 -0.25 0.00 0.00 0.00 0.00 51.96 50.53 3iod s ALA 246 Cb -0.16 -2.15 -0.03 0.00 0.00 0.00 0.00 23.12 20.79 3iod s ALA 246 CO 0.09 -0.65 0.78 0.08 0.00 0.00 0.00 175.76 176.06 3iod s VAL 247 N 1.59 4.95 -0.14 0.00 1.01 -1.26 0.41 120.40 126.96 3iod s VAL 247 Ca 0.05 1.57 -0.18 0.00 0.00 0.00 0.00 61.98 63.42 3iod s VAL 247 Cb -0.16 -4.11 -0.16 0.00 0.00 0.00 0.00 36.38 31.96 3iod s VAL 247 CO 0.04 0.13 0.40 0.44 0.00 0.00 0.00 175.10 176.10 3iod h ASP 248 N 7.07 0.00 -5.09 3.32 3.32 -1.26 -3.48 116.42 120.31 3iod h ASP 248 Ca -0.35 -0.57 -0.10 0.00 0.02 0.00 0.00 57.03 56.03 3iod h ASP 248 Cb 1.17 0.00 -0.16 0.00 0.22 0.00 0.00 39.33 40.55 3iod h ASP 248 CO 0.79 0.92 -0.33 -0.72 -1.72 0.00 0.00 179.24 178.18 3iod s TYR 249 N -2.06 0.02 -0.22 4.55 -0.85 -1.02 -4.99 117.35 112.77 3iod s TYR 249 Ca -0.15 -0.28 -0.04 0.00 -0.52 0.00 0.00 57.07 56.08 3iod s TYR 249 Cb -0.00 0.01 0.09 0.00 0.38 0.00 0.00 41.96 42.44 3iod s TYR 249 CO 0.45 -0.49 0.19 -1.17 -1.52 0.00 0.00 175.55 173.01 3iod s LEU 250 N -2.31 0.06 -0.01 -3.49 2.96 -1.26 -1.70 118.68 112.93 3iod s LEU 250 Ca -0.02 -0.54 0.01 0.00 -0.22 0.00 0.00 54.13 53.36 3iod s LEU 250 Cb 0.01 0.16 0.00 0.00 0.50 0.00 0.00 46.19 46.86 3iod s LEU 250 CO -0.06 -0.36 -0.04 -1.61 -1.32 0.00 0.00 176.35 172.97 3iod s GLU 251 N 2.26 0.39 -0.24 1.98 2.02 0.01 -4.97 118.70 120.15 3iod s GLU 251 Ca 0.07 -0.12 -0.07 0.00 0.02 0.00 0.00 54.97 54.86 3iod s GLU 251 Cb -0.16 -0.40 -0.03 0.00 0.10 0.00 0.00 34.13 33.64 3iod s GLU 251 CO -0.18 0.05 0.06 -1.17 0.02 0.00 0.00 175.26 174.04 3iod s LEU 252 N 0.14 3.48 0.25 1.80 2.96 -1.26 -0.32 118.68 125.73 3iod s LEU 252 Ca -0.01 -0.16 0.04 0.00 -0.22 0.00 0.00 54.13 53.78 3iod s LEU 252 Cb -0.04 -1.92 -0.05 0.00 0.50 0.00 0.00 46.19 44.67 3iod s LEU 252 CO -0.00 0.00 -0.01 -0.13 -1.32 0.00 0.00 176.35 174.89 3iod s ARG 253 N 1.38 1.41 0.89 1.98 0.52 -0.06 -4.96 118.95 120.10 3iod s ARG 253 Ca 0.05 -1.72 -0.10 0.00 -0.52 0.00 0.00 55.73 53.44 3iod s ARG 253 Cb -0.15 -0.76 0.13 0.00 0.52 0.00 0.00 34.95 34.69 3iod s ARG 253 CO 0.03 -0.07 1.15 0.34 0.02 0.00 0.00 175.30 176.77 3iod s ASP 254 N -3.35 3.15 0.60 0.23 2.15 -1.25 -0.18 116.67 118.02 3iod s ASP 254 Ca 0.29 2.17 0.35 0.00 0.43 0.00 0.00 52.55 55.79 3iod s ASP 254 Cb 0.05 -2.57 1.96 0.00 -0.30 0.00 0.00 42.92 42.06 3iod s ASP 254 CO 0.10 -2.95 2.25 0.16 -0.17 0.00 0.00 175.17 174.56 3iod h ILE 255 N -1.69 0.31 -0.24 4.11 3.07 -1.85 0.12 117.51 121.35 3iod h ILE 255 Ca -0.43 -0.13 0.00 0.00 1.55 0.00 0.00 64.86 65.85 3iod h ILE 255 Cb 1.27 1.09 0.00 0.00 -0.27 0.00 0.00 36.82 38.91 3iod h ILE 255 CO 0.43 0.02 0.00 0.61 -1.05 0.00 0.00 178.15 178.16 3iod n GLY 256 N -1.04 0.57 2.21 0.16 0.00 -1.26 -4.92 105.19 100.90 3iod n GLY 256 Ca -0.03 -0.46 -0.08 0.00 0.00 0.00 0.00 46.02 45.45 3iod n GLY 256 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3iod n LEU 257 N 0.53 -0.84 0.00 0.99 4.77 0.43 -5.04 117.00 117.84 3iod n LEU 257 Ca 0.16 0.13 0.00 0.00 -0.03 0.00 0.00 56.01 56.27 3iod n LEU 257 Cb 0.36 -1.42 0.00 0.00 -2.33 0.00 0.00 43.42 40.03 3iod n LEU 257 CO 0.13 -0.31 0.00 0.61 -1.33 0.00 0.00 177.39 176.48 3iod n GLY 258 N -1.68 -1.35 0.00 -0.72 0.00 -1.26 -4.84 105.19 95.34 3iod n GLY 258 Ca -0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.93 3iod n GLY 258 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3iod n ASN 263 N 0.00 0.00 0.00 1.61 2.85 -1.26 -3.80 115.26 114.66 3iod n ASN 263 Ca 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.47 3iod n ASN 263 Cb 0.00 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.02 3iod n ASN 263 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 3iod n GLY 264 N -1.54 0.09 3.53 8.20 0.00 -1.26 -4.74 105.19 109.48 3iod n GLY 264 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 3iod n GLY 264 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3iod s SER 265 N -4.56 4.54 0.20 1.61 0.01 -1.26 0.61 113.70 114.84 3iod s SER 265 Ca 0.00 -0.09 -0.00 0.00 1.31 0.00 0.00 55.95 57.17 3iod s SER 265 Cb 0.00 -1.28 0.00 0.00 0.21 0.00 0.00 66.02 64.95 3iod s SER 265 CO 0.00 0.31 0.26 0.61 0.41 0.00 0.00 173.24 174.83 3iod n GLY 266 N 2.59 2.70 2.99 3.44 0.00 0.49 -4.05 105.19 113.35 3iod n GLY 266 Ca -0.18 -1.57 -0.22 0.00 0.00 0.00 0.00 46.02 44.05 3iod n GLY 266 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3iod s ARG 267 N -2.52 1.28 -0.21 1.61 6.06 0.74 -1.18 118.95 124.72 3iod s ARG 267 Ca 0.18 -0.32 -0.08 0.00 -2.50 0.00 0.00 55.73 53.00 3iod s ARG 267 Cb -0.00 -1.13 -0.04 0.00 0.06 0.00 0.00 34.95 33.84 3iod s ARG 267 CO 0.13 0.04 0.09 -1.17 -2.50 0.00 0.00 175.30 171.89 3iod s LEU 268 N 0.53 3.80 -0.03 -0.88 2.96 -0.06 -0.88 118.68 124.12 3iod s LEU 268 Ca -0.10 0.02 0.07 0.00 -0.22 0.00 0.00 54.13 53.90 3iod s LEU 268 Cb -0.13 -1.99 -0.02 0.00 0.50 0.00 0.00 46.19 44.55 3iod s LEU 268 CO 0.02 0.10 -0.23 -0.76 -1.32 0.00 0.00 176.35 174.15 3iod s LEU 269 N 0.85 2.04 0.01 -0.68 1.02 0.57 -1.35 118.68 121.14 3iod s LEU 269 Ca 0.05 -0.44 0.05 0.00 0.02 0.00 0.00 54.13 53.80 3iod s LEU 269 Cb -0.13 -1.23 -0.02 0.00 0.02 0.00 0.00 46.19 44.83 3iod s LEU 269 CO 0.03 0.27 -0.14 0.54 0.02 0.00 0.00 176.35 177.06 3iod s VAL 270 N -0.41 1.11 -0.03 -1.59 0.11 -0.20 -0.81 120.40 118.58 3iod s VAL 270 Ca 0.05 -0.78 0.02 0.00 -2.93 0.00 0.00 61.98 58.34 3iod s VAL 270 Cb -0.10 -0.96 0.01 0.00 -1.53 0.00 0.00 36.38 33.79 3iod s VAL 270 CO 0.00 0.17 -0.08 0.00 -3.33 0.00 0.00 175.10 171.87 3iod s ALA 271 N -0.56 0.79 0.05 1.54 0.00 -0.69 -1.71 121.76 121.17 3iod s ALA 271 Ca 0.04 -0.26 -0.08 0.00 0.00 0.00 0.00 51.96 51.66 3iod s ALA 271 Cb -0.06 -0.33 -0.00 0.00 0.00 0.00 0.00 23.12 22.72 3iod s ALA 271 CO 0.00 0.10 0.16 0.00 0.00 0.00 0.00 175.76 176.02 3iod s ALA 272 N 0.34 -0.22 -0.13 0.00 0.00 -0.40 -0.70 121.76 120.65 3iod s ALA 272 Ca -0.05 -0.44 -0.03 0.00 0.00 0.00 0.00 51.96 51.44 3iod s ALA 272 Cb -0.10 0.30 -0.03 0.00 0.00 0.00 0.00 23.12 23.29 3iod s ALA 272 CO 0.00 -0.37 -0.03 1.03 0.00 0.00 0.00 175.76 176.40 3iod s ARG 273 N -2.79 3.43 -0.37 0.00 0.52 0.17 0.27 118.95 120.18 3iod s ARG 273 Ca -0.03 -0.49 -0.02 0.00 -0.52 0.00 0.00 55.73 54.67 3iod s ARG 273 Cb -0.00 -2.86 0.09 0.00 0.52 0.00 0.00 34.95 32.70 3iod s ARG 273 CO -0.05 0.39 0.12 -0.51 0.02 0.00 0.00 175.30 175.27 3iod s LEU 274 N -0.04 4.80 0.00 2.53 1.02 0.16 -0.69 118.68 126.45 3iod s LEU 274 Ca 0.02 -1.84 0.00 0.00 0.02 0.00 0.00 54.13 52.33 3iod s LEU 274 Cb -0.13 -1.77 0.00 0.00 0.02 0.00 0.00 46.19 44.31 3iod s LEU 274 CO 0.02 -0.44 0.00 0.61 0.02 0.00 0.00 176.35 176.56 3iod n GLY 275 N 4.55 3.39 0.19 -3.19 0.00 -1.26 -2.00 105.19 106.87 3iod n GLY 275 Ca -0.04 -0.11 0.11 0.00 0.00 0.00 0.00 46.02 45.97 3iod n GLY 275 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3iod n THR 276 N 0.00 0.00 -2.90 2.61 -2.24 -1.26 -4.90 114.28 105.59 3iod n THR 276 Ca 0.00 -0.10 -0.42 0.00 -2.27 0.00 0.00 64.05 61.26 3iod n THR 276 Cb 0.00 0.81 -0.04 0.00 -2.10 0.00 0.00 70.33 69.00 3iod n THR 276 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 3iod s THR 277 N -2.76 4.71 -0.22 4.28 2.01 -0.85 -5.02 115.64 117.79 3iod s THR 277 Ca 0.15 1.13 -0.17 0.00 0.31 0.00 0.00 61.69 63.11 3iod s THR 277 Cb 0.18 -4.23 -0.03 0.00 0.01 0.00 0.00 72.50 68.42 3iod s THR 277 CO 0.68 -0.39 0.45 -0.60 -0.69 0.00 0.00 174.62 174.07 3iod s ARG 278 N 3.17 4.13 0.05 4.92 3.52 -1.26 -0.66 118.95 132.81 3iod s ARG 278 Ca 0.34 0.25 0.06 0.00 -0.13 0.00 0.00 55.73 56.25 3iod s ARG 278 Cb -0.13 -3.59 -0.04 0.00 -1.56 0.00 0.00 34.95 29.64 3iod s ARG 278 CO 0.15 -0.17 -0.12 -0.51 -0.81 0.00 0.00 175.30 173.85 3iod s LEU 279 N 1.71 2.94 0.14 -0.88 1.43 0.14 -4.96 118.68 119.21 3iod s LEU 279 Ca 0.20 -0.32 0.10 0.00 -1.03 0.00 0.00 54.13 53.08 3iod s LEU 279 Cb -0.15 -1.73 -0.04 0.00 0.03 0.00 0.00 46.19 44.30 3iod s LEU 279 CO 0.09 0.24 -0.24 -0.76 0.23 0.00 0.00 176.35 175.91 3iod s LEU 280 N -1.70 2.36 0.20 1.79 1.43 -1.26 -1.27 118.68 120.22 3iod s LEU 280 Ca 0.18 -0.78 -0.22 0.00 -1.03 0.00 0.00 54.13 52.28 3iod s LEU 280 Cb -0.11 -1.09 0.05 0.00 0.03 0.00 0.00 46.19 45.08 3iod s LEU 280 CO 0.09 0.11 0.62 -0.62 0.23 0.00 0.00 176.35 176.78 3iod s ASP 281 N -2.24 -0.44 0.21 2.29 -1.08 -0.69 -4.88 116.67 109.83 3iod s ASP 281 Ca 0.14 -0.24 -0.22 0.00 -0.52 0.00 0.00 52.55 51.71 3iod s ASP 281 Cb -0.09 0.63 0.05 0.00 -1.46 0.00 0.00 42.92 42.05 3iod s ASP 281 CO 0.07 -1.08 0.64 0.54 0.52 0.00 0.00 175.17 175.85 3iod s ASN 282 N -2.81 -0.44 -0.01 -0.34 2.20 -1.26 -1.03 114.94 111.25 3iod s ASN 282 Ca 0.05 -0.25 -0.19 0.00 -0.94 0.00 0.00 52.86 51.53 3iod s ASN 282 Cb -0.02 0.65 0.03 0.00 -2.00 0.00 0.00 41.25 39.91 3iod s ASN 282 CO -0.06 -1.11 0.40 -0.51 -2.94 0.00 0.00 177.10 172.88 3iod s ILE 283 N -3.82 0.05 0.31 0.54 2.07 -0.46 -4.97 121.20 114.92 3iod s ILE 283 Ca 0.05 -0.38 -0.29 0.00 -1.41 0.00 0.00 60.65 58.62 3iod s ILE 283 Cb -0.03 -0.76 -0.11 0.00 0.13 0.00 0.00 42.46 41.69 3iod s ILE 283 CO -0.05 -0.21 1.44 0.00 -1.91 0.00 0.00 174.94 174.21 3iod s ALA 284 N -1.53 3.59 -0.07 1.50 0.00 -1.26 -0.88 121.76 123.12 3iod s ALA 284 Ca -0.11 1.40 0.02 0.00 0.00 0.00 0.00 51.96 53.27 3iod s ALA 284 Cb -0.03 -3.56 0.01 0.00 0.00 0.00 0.00 23.12 19.54 3iod s ALA 284 CO 0.04 -0.83 -0.13 0.42 0.00 0.00 0.00 175.76 175.27 3iod s ILE 285 N -0.60 1.18 -0.24 0.00 -1.09 -0.33 -4.82 121.20 115.30 3iod s ILE 285 Ca 0.55 -0.50 -0.05 0.00 -2.23 0.00 0.00 60.65 58.42 3iod s ILE 285 Cb -0.43 -1.08 -0.01 0.00 -1.58 0.00 0.00 42.46 39.36 3iod s ILE 285 CO 0.52 0.37 -0.00 -1.61 -1.23 0.00 0.00 174.94 172.98 3iod s GLU 286 N 0.68 3.36 -0.14 2.79 0.41 -1.26 -0.38 118.70 124.17 3iod s GLU 286 Ca -0.14 -0.65 -0.24 0.00 -0.41 0.00 0.00 54.97 53.53 3iod s GLU 286 Cb -0.16 -3.12 -0.02 0.00 -1.78 0.00 0.00 34.13 29.05 3iod s GLU 286 CO 0.04 -0.24 0.78 0.42 -0.49 0.00 0.00 175.26 175.76 3iod s ILE 287 N 1.50 4.94 0.00 -1.63 -1.09 0.20 -4.44 121.20 120.68 3iod s ILE 287 Ca 0.05 1.54 0.00 0.00 -2.23 0.00 0.00 60.65 60.01 3iod s ILE 287 Cb -0.15 -4.09 0.00 0.00 -1.58 0.00 0.00 42.46 36.64 3iod s ILE 287 CO -0.01 0.10 0.00 0.61 -1.23 0.00 0.00 174.94 174.41