#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ieo n TRP 5 N 0.00 1.44 -0.78 4.41 4.27 -1.26 -4.90 117.44 120.61 3ieo n TRP 5 Ca 0.00 0.68 0.00 0.00 -3.89 0.00 0.00 57.50 54.29 3ieo n TRP 5 Cb 0.00 -2.28 0.00 0.00 -1.36 0.00 0.00 31.31 27.67 3ieo n TRP 5 CO 0.00 0.00 0.00 0.41 -2.29 0.00 0.00 177.69 175.81 3ieo n GLY 6 N 1.16 4.33 0.01 -1.67 0.00 -0.16 -5.04 105.19 103.82 3ieo n GLY 6 Ca 0.09 -0.60 0.00 0.00 0.00 0.00 0.00 46.02 45.51 3ieo n GLY 6 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3ieo n TYR 7 N 0.00 0.00 -2.25 1.61 4.02 -1.26 -4.02 117.16 115.26 3ieo n TYR 7 Ca 0.00 -0.38 -0.23 0.00 -0.01 0.00 0.00 57.90 57.28 3ieo n TYR 7 Cb 0.00 -0.04 0.14 0.00 -0.02 0.00 0.00 39.34 39.42 3ieo n TYR 7 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3ieo n GLY 8 N -0.40 -0.24 0.33 2.72 0.00 -1.26 -4.71 105.19 101.62 3ieo n GLY 8 Ca 0.01 -1.89 0.04 0.00 0.00 0.00 0.00 46.02 44.18 3ieo n GLY 8 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 3ieo h LYS 9 N 0.00 0.86 0.00 1.61 3.64 -1.98 -1.80 116.57 118.90 3ieo h LYS 9 Ca -0.33 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.00 3ieo h LYS 9 Cb 1.07 -0.19 0.00 0.00 -0.41 0.00 0.00 32.23 32.69 3ieo h LYS 9 CO 0.30 0.57 -0.79 0.72 -2.27 0.00 0.00 179.45 177.98 3ieo n HIS 10 N -4.68 0.27 -1.88 1.91 8.25 -1.26 -4.36 115.22 113.46 3ieo n HIS 10 Ca 0.15 0.08 0.01 0.00 -0.26 0.00 0.00 57.72 57.70 3ieo n HIS 10 Cb 0.29 -0.43 0.01 0.00 1.12 0.00 0.00 29.99 30.98 3ieo n HIS 10 CO 0.00 0.00 0.00 0.27 0.64 0.00 0.00 176.34 177.25 3ieo n ASN 11 N -1.87 0.18 -2.19 0.41 0.23 -1.18 -4.94 115.26 105.90 3ieo n ASN 11 Ca 0.03 -2.04 -0.02 0.00 -0.53 0.00 0.00 54.58 52.02 3ieo n ASN 11 Cb 0.41 -0.21 0.01 0.00 -2.08 0.00 0.00 39.78 37.91 3ieo n ASN 11 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3ieo n GLY 12 N -0.11 0.44 0.32 4.83 0.00 -0.68 -0.99 105.19 109.00 3ieo n GLY 12 Ca 0.01 -1.91 0.14 0.00 0.00 0.00 0.00 46.02 44.26 3ieo n GLY 12 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3ieo h PRO 13 N 0.00 0.00 -0.00 1.61 0.11 -1.85 0.11 132.00 131.98 3ieo h PRO 13 Ca -0.03 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.08 3ieo h PRO 13 Cb 0.09 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.20 3ieo h PRO 13 CO 0.03 0.00 -0.02 0.39 -0.21 0.00 0.00 178.00 178.19 3ieo n GLU 14 N -2.79 0.12 -0.00 1.05 -0.58 -1.26 -3.59 120.64 113.59 3ieo n GLU 14 Ca -0.02 -0.01 0.06 0.00 -0.42 0.00 0.00 57.16 56.77 3ieo n GLU 14 Cb 0.40 -1.50 -0.07 0.00 -0.57 0.00 0.00 31.44 29.70 3ieo n GLU 14 CO 0.00 0.00 0.00 0.72 -0.48 0.00 0.00 177.13 177.37 3ieo n HIS 15 N -1.43 0.00 0.14 -0.32 8.25 0.36 -4.72 115.22 117.50 3ieo n HIS 15 Ca 0.09 0.00 0.03 0.00 -0.26 0.00 0.00 57.72 57.58 3ieo n HIS 15 Cb 0.31 -0.09 0.43 0.00 1.12 0.00 0.00 29.99 31.76 3ieo n HIS 15 CO 0.00 0.00 0.00 -1.49 0.64 0.00 0.00 176.34 175.49 3ieo h TRP 16 N 0.00 0.20 -0.36 4.41 6.55 -1.61 -2.24 115.95 122.91 3ieo h TRP 16 Ca 0.00 -0.02 0.10 0.00 0.95 0.00 0.00 58.89 59.93 3ieo h TRP 16 Cb 0.36 -0.06 -0.01 0.00 -0.86 0.00 0.00 29.16 28.58 3ieo h TRP 16 CO 0.00 0.31 0.27 1.12 -1.05 0.00 0.00 178.44 179.09 3ieo h HIS 17 N 0.19 0.00 0.30 0.49 2.07 -1.83 0.14 115.15 116.51 3ieo h HIS 17 Ca 0.04 0.00 -0.01 0.00 -2.85 0.00 0.00 60.37 57.55 3ieo h HIS 17 Cb 0.31 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.30 3ieo h HIS 17 CO 0.00 0.00 -0.15 0.87 -3.07 0.00 0.00 177.93 175.59 3ieo h LYS 18 N 0.00 -0.39 0.01 5.12 1.57 -1.77 -2.38 116.57 118.73 3ieo h LYS 18 Ca 0.17 0.03 -0.21 0.00 -1.87 0.00 0.00 60.65 58.77 3ieo h LYS 18 Cb 0.71 0.09 -0.03 0.00 0.08 0.00 0.00 32.23 33.08 3ieo h LYS 18 CO -0.00 -0.24 -0.98 -0.44 -0.57 0.00 0.00 179.45 177.21 3ieo h ASP 19 N -0.43 0.05 -3.02 0.86 5.19 -1.72 -3.42 116.42 113.93 3ieo h ASP 19 Ca -0.04 -0.05 -0.61 0.00 -0.62 0.00 0.00 57.03 55.71 3ieo h ASP 19 Cb 0.33 -0.02 -0.40 0.00 0.18 0.00 0.00 39.33 39.42 3ieo h ASP 19 CO 0.07 1.00 -0.76 -0.36 -3.12 0.00 0.00 179.24 176.07 3ieo s PHE 20 N -2.81 2.19 0.58 4.55 0.08 0.47 -4.97 117.98 118.07 3ieo s PHE 20 Ca 0.00 -2.67 0.29 0.00 0.12 0.00 0.00 56.93 54.67 3ieo s PHE 20 Cb 0.10 -1.84 1.47 0.00 -0.57 0.00 0.00 43.02 42.19 3ieo s PHE 20 CO 0.82 -0.72 1.91 -1.35 -0.10 0.00 0.00 175.22 175.78 3ieo h PRO 21 N 5.99 0.00 0.00 0.24 0.11 -1.65 -1.24 132.00 135.44 3ieo h PRO 21 Ca 0.12 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.23 3ieo h PRO 21 Cb 0.87 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.98 3ieo h PRO 21 CO 0.52 0.00 0.00 1.51 -0.21 0.00 0.00 178.00 179.82 3ieo n ILE 22 N -3.86 0.76 0.28 4.15 3.06 -1.26 -2.22 119.36 120.27 3ieo n ILE 22 Ca 0.10 0.19 0.13 0.00 -2.50 0.00 0.00 62.75 60.67 3ieo n ILE 22 Cb 0.70 -0.97 0.82 0.00 0.54 0.00 0.00 39.64 40.73 3ieo n ILE 22 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 3ieo h ALA 23 N 2.59 1.51 -0.66 1.51 0.00 -1.54 0.15 119.26 122.82 3ieo h ALA 23 Ca 0.00 -0.04 -0.18 0.00 0.00 0.00 0.00 54.91 54.69 3ieo h ALA 23 Cb 0.15 -0.01 -0.11 0.00 0.00 0.00 0.00 17.79 17.83 3ieo h ALA 23 CO 0.00 0.05 0.20 1.63 0.00 0.00 0.00 179.25 181.14 3ieo n LYS 24 N -3.88 3.61 -0.94 0.00 5.02 -0.94 -4.95 118.16 116.08 3ieo n LYS 24 Ca -0.03 -3.08 -0.18 0.00 -2.02 0.00 0.00 58.31 53.00 3ieo n LYS 24 Cb 0.13 -2.16 0.14 0.00 -0.02 0.00 0.00 35.03 33.12 3ieo n LYS 24 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3ieo n GLY 25 N -0.21 -1.87 0.05 0.72 0.00 0.54 -5.00 105.19 99.42 3ieo n GLY 25 Ca 0.38 -1.61 0.11 0.00 0.00 0.00 0.00 46.02 44.90 3ieo n GLY 25 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3ieo n GLU 26 N -3.03 0.14 -2.68 1.61 -0.58 -1.26 -4.31 120.64 110.53 3ieo n GLU 26 Ca 0.10 -0.10 -0.08 0.00 -0.42 0.00 0.00 57.16 56.65 3ieo n GLU 26 Cb 0.35 -1.50 0.03 0.00 -0.57 0.00 0.00 31.44 29.76 3ieo n GLU 26 CO 0.00 0.00 0.00 2.89 -0.48 0.00 0.00 177.13 179.54 3ieo n ARG 27 N -1.34 1.63 -2.72 3.49 1.85 -1.26 -4.81 116.66 113.51 3ieo n ARG 27 Ca 0.06 -3.48 -0.33 0.00 -1.00 0.00 0.00 57.85 53.10 3ieo n ARG 27 Cb 0.34 -1.49 -0.06 0.00 -1.05 0.00 0.00 32.46 30.20 3ieo n ARG 27 CO 0.00 0.00 0.00 -0.65 -0.01 0.00 0.00 177.63 176.97 3ieo s GLN 28 N -3.41 4.07 0.18 2.89 -1.52 -1.26 -2.93 119.66 117.68 3ieo s GLN 28 Ca 0.30 1.20 0.07 0.00 -1.95 0.00 0.00 55.36 54.98 3ieo s GLN 28 Cb 0.40 -2.15 -0.04 0.00 -0.22 0.00 0.00 33.01 31.00 3ieo s GLN 28 CO -0.00 -0.18 -0.14 -1.12 -0.25 0.00 0.00 175.29 173.60 3ieo s SER 29 N -2.12 2.35 1.05 5.90 0.01 -1.26 -4.66 113.70 114.97 3ieo s SER 29 Ca 0.64 -0.98 -0.16 0.00 1.31 0.00 0.00 55.95 56.76 3ieo s SER 29 Cb -0.12 -0.10 0.23 0.00 0.21 0.00 0.00 66.02 66.24 3ieo s SER 29 CO 0.16 -0.19 1.21 -0.81 0.41 0.00 0.00 173.24 174.02 3ieo n PRO 30 N -0.17 -1.61 -4.27 12.44 -0.04 -1.26 -4.61 135.00 135.47 3ieo n PRO 30 Ca -0.10 -1.87 -0.15 0.00 -0.04 0.00 0.00 63.50 61.34 3ieo n PRO 30 Cb 0.60 -1.34 -0.10 0.00 -0.04 0.00 0.00 33.50 32.61 3ieo n PRO 30 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 3ieo s VAL 31 N -3.55 0.76 0.12 0.52 -7.23 -1.26 -0.74 120.40 109.02 3ieo s VAL 31 Ca 0.70 -2.00 -0.30 0.00 -1.81 0.00 0.00 61.98 58.57 3ieo s VAL 31 Cb -0.03 -2.24 -0.06 0.00 0.56 0.00 0.00 36.38 34.61 3ieo s VAL 31 CO 0.50 -0.38 0.97 -0.62 -0.31 0.00 0.00 175.10 175.26 3ieo s ASP 32 N -3.23 7.49 -0.68 4.85 3.68 -1.26 -2.61 116.67 124.92 3ieo s ASP 32 Ca 0.27 1.81 -0.19 0.00 2.13 0.00 0.00 52.55 56.57 3ieo s ASP 32 Cb 0.06 -2.59 0.11 0.00 -1.45 0.00 0.00 42.92 39.05 3ieo s ASP 32 CO 0.06 -0.07 0.81 -0.63 0.13 0.00 0.00 175.17 175.48 3ieo s ILE 33 N -0.05 4.80 -0.70 4.11 1.01 0.32 -4.92 121.20 125.77 3ieo s ILE 33 Ca 0.47 -1.12 -0.27 0.00 0.00 0.00 0.00 60.65 59.73 3ieo s ILE 33 Cb -0.24 -4.56 0.02 0.00 0.01 0.00 0.00 42.46 37.69 3ieo s ILE 33 CO 0.30 -1.23 1.35 -0.62 0.00 0.00 0.00 174.94 174.74 3ieo s ASP 34 N 3.51 6.08 0.58 3.58 2.15 -1.26 -0.47 116.67 130.83 3ieo s ASP 34 Ca 0.17 -0.28 0.27 0.00 0.43 0.00 0.00 52.55 53.14 3ieo s ASP 34 Cb -0.19 -2.56 1.67 0.00 -0.30 0.00 0.00 42.92 41.55 3ieo s ASP 34 CO 0.03 -1.87 2.20 0.71 -0.17 0.00 0.00 175.17 176.07 3ieo h THR 35 N 6.15 0.61 0.00 1.71 1.35 -1.94 -1.70 112.91 119.09 3ieo h THR 35 Ca -0.27 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.59 3ieo h THR 35 Cb 1.07 0.96 0.00 0.00 -1.73 0.00 0.00 68.15 68.44 3ieo h THR 35 CO 1.26 0.00 -0.16 1.41 -0.25 0.00 0.00 175.52 177.78 3ieo n HIS 36 N -3.98 0.43 0.38 4.73 8.25 -1.26 -3.92 115.22 119.85 3ieo n HIS 36 Ca -0.02 0.13 0.08 0.00 -0.26 0.00 0.00 57.72 57.65 3ieo n HIS 36 Cb 0.15 -0.66 -0.11 0.00 1.12 0.00 0.00 29.99 30.49 3ieo n HIS 36 CO 0.00 0.00 0.00 2.41 0.64 0.00 0.00 176.34 179.39 3ieo n THR 37 N -1.88 0.00 -2.38 1.59 -1.04 -0.68 -4.96 114.28 104.93 3ieo n THR 37 Ca 0.06 -0.25 -0.38 0.00 -2.04 0.00 0.00 64.05 61.43 3ieo n THR 37 Cb 0.39 0.55 -0.03 0.00 -1.82 0.00 0.00 70.33 69.42 3ieo n THR 37 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3ieo s ALA 38 N -2.86 3.19 -0.08 2.41 0.00 -0.96 -4.82 121.76 118.63 3ieo s ALA 38 Ca -0.00 0.90 0.02 0.00 0.00 0.00 0.00 51.96 52.88 3ieo s ALA 38 Cb 0.12 -3.35 -0.02 0.00 0.00 0.00 0.00 23.12 19.86 3ieo s ALA 38 CO 0.69 -0.39 -0.13 0.21 0.00 0.00 0.00 175.76 176.14 3ieo s LYS 39 N -2.19 2.79 0.23 0.00 2.20 -0.80 -4.76 119.74 117.21 3ieo s LYS 39 Ca 0.55 -0.67 -0.30 0.00 -0.36 0.00 0.00 55.97 55.19 3ieo s LYS 39 Cb -0.29 -2.49 -0.10 0.00 -1.51 0.00 0.00 37.83 33.44 3ieo s LYS 39 CO 0.37 0.52 1.47 -0.47 -0.36 0.00 0.00 175.35 176.87 3ieo s TYR 40 N -0.44 3.02 -0.30 4.03 6.14 -1.26 0.34 117.35 128.87 3ieo s TYR 40 Ca 0.06 0.94 0.02 0.00 0.64 0.00 0.00 57.07 58.72 3ieo s TYR 40 Cb -0.12 -3.85 0.07 0.00 0.42 0.00 0.00 41.96 38.48 3ieo s TYR 40 CO 0.02 -2.85 -0.03 0.34 0.64 0.00 0.00 175.55 173.66 3ieo s ASP 41 N 0.53 4.66 0.50 4.32 3.68 -0.62 -4.85 116.67 124.89 3ieo s ASP 41 Ca 0.62 -1.61 0.17 0.00 2.13 0.00 0.00 52.55 53.85 3ieo s ASP 41 Cb -0.42 -1.62 1.21 0.00 -1.45 0.00 0.00 42.92 40.64 3ieo s ASP 41 CO 0.41 -0.27 2.09 -0.65 0.13 0.00 0.00 175.17 176.88 3ieo h PRO 42 N 7.79 0.00 0.00 4.34 0.11 -1.94 -2.59 132.00 139.71 3ieo h PRO 42 Ca -0.15 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.96 3ieo h PRO 42 Cb 1.04 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.15 3ieo h PRO 42 CO 0.50 0.08 0.00 -1.13 -0.21 0.00 0.00 178.00 177.24 3ieo n SER 43 N -4.36 0.00 -4.69 -2.05 3.41 -1.26 -4.82 113.62 99.85 3ieo n SER 43 Ca -0.03 -0.84 -0.42 0.00 -0.26 0.00 0.00 58.87 57.32 3ieo n SER 43 Cb 0.16 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.08 3ieo n SER 43 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 3ieo s LEU 44 N -1.89 4.27 0.54 1.04 1.43 -0.98 -5.02 118.68 118.08 3ieo s LEU 44 Ca 0.32 1.50 -0.16 0.00 -1.03 0.00 0.00 54.13 54.76 3ieo s LEU 44 Cb 0.15 -3.50 -0.06 0.00 0.03 0.00 0.00 46.19 42.81 3ieo s LEU 44 CO 0.25 -0.38 1.01 -0.54 0.23 0.00 0.00 176.35 176.92 3ieo s LYS 45 N 1.75 3.74 0.48 1.70 1.02 -1.19 -4.87 119.74 122.37 3ieo s LYS 45 Ca 0.47 1.02 -0.23 0.00 0.02 0.00 0.00 55.97 57.25 3ieo s LYS 45 Cb -0.19 -2.10 -0.07 0.00 -0.52 0.00 0.00 37.83 34.96 3ieo s LYS 45 CO 0.19 -0.45 1.27 -2.14 -0.92 0.00 0.00 175.35 173.31 3ieo s PRO 46 N -4.13 3.56 0.44 -1.68 0.02 -1.26 0.46 135.00 132.40 3ieo s PRO 46 Ca 0.60 2.04 -0.23 0.00 0.02 0.00 0.00 61.00 63.43 3ieo s PRO 46 Cb -0.12 -2.42 -0.08 0.00 0.02 0.00 0.00 34.50 31.90 3ieo s PRO 46 CO 0.34 -0.80 1.12 -1.17 -0.33 0.00 0.00 177.00 176.17 3ieo s LEU 47 N -3.10 4.06 -0.22 -5.54 0.20 -1.26 -2.66 118.68 110.16 3ieo s LEU 47 Ca 0.65 2.20 -0.01 0.00 0.69 0.00 0.00 54.13 57.66 3ieo s LEU 47 Cb -0.35 -4.23 0.06 0.00 -0.43 0.00 0.00 46.19 41.24 3ieo s LEU 47 CO 0.43 -0.76 -0.01 -0.55 -0.29 0.00 0.00 176.35 175.17 3ieo s SER 48 N -1.45 3.51 -0.28 3.68 0.15 0.46 -4.88 113.70 114.88 3ieo s SER 48 Ca 0.61 -1.07 -0.00 0.00 0.70 0.00 0.00 55.95 56.19 3ieo s SER 48 Cb -0.26 -0.94 0.05 0.00 -1.71 0.00 0.00 66.02 63.16 3ieo s SER 48 CO 0.32 -0.27 -0.04 -0.69 1.20 0.00 0.00 173.24 173.75 3ieo s VAL 49 N 1.58 2.71 -0.54 4.45 1.01 -1.26 -1.38 120.40 126.96 3ieo s VAL 49 Ca -0.03 -1.46 0.03 0.00 0.00 0.00 0.00 61.98 60.52 3ieo s VAL 49 Cb -0.18 -2.56 0.14 0.00 0.00 0.00 0.00 36.38 33.78 3ieo s VAL 49 CO -0.08 -0.07 0.29 -0.44 0.00 0.00 0.00 175.10 174.81 3ieo s SER 50 N 1.20 4.47 0.00 3.32 0.01 -0.68 -4.93 113.70 117.09 3ieo s SER 50 Ca -0.06 -3.02 0.16 0.00 1.31 0.00 0.00 55.95 54.34 3ieo s SER 50 Cb -0.20 -1.67 0.40 0.00 0.21 0.00 0.00 66.02 64.76 3ieo s SER 50 CO -0.03 -0.25 1.32 -1.22 0.41 0.00 0.00 173.24 173.48 3ieo n TYR 51 N 3.13 0.58 0.03 2.43 0.53 -1.26 -2.23 117.16 120.37 3ieo n TYR 51 Ca 0.06 -0.42 0.01 0.00 -1.02 0.00 0.00 57.90 56.53 3ieo n TYR 51 Cb 0.33 -0.01 0.35 0.00 -1.03 0.00 0.00 39.34 38.98 3ieo n TYR 51 CO 0.00 0.00 0.00 0.38 -1.02 0.00 0.00 176.86 176.22 3ieo h ASP 52 N 3.06 0.43 -0.32 7.72 2.03 -1.91 -2.64 116.42 124.78 3ieo h ASP 52 Ca 0.00 -0.06 0.00 0.00 -0.73 0.00 0.00 57.03 56.24 3ieo h ASP 52 Cb 0.82 -0.11 0.00 0.00 -0.83 0.00 0.00 39.33 39.21 3ieo h ASP 52 CO 0.00 0.47 0.00 1.67 -1.03 0.00 0.00 179.24 180.35 3ieo n GLN 53 N -4.33 2.21 -1.61 4.15 -0.06 -1.26 -5.00 117.38 111.48 3ieo n GLN 53 Ca 0.01 -1.84 -0.45 0.00 -2.00 0.00 0.00 57.00 52.73 3ieo n GLN 53 Cb 0.20 -1.46 -0.02 0.00 -4.06 0.00 0.00 30.24 24.90 3ieo n GLN 53 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 3ieo n ALA 54 N 1.05 0.03 -3.82 1.69 0.00 -1.00 -4.61 120.51 113.84 3ieo n ALA 54 Ca 0.18 0.39 -0.30 0.00 0.00 0.00 0.00 53.44 53.71 3ieo n ALA 54 Cb 0.50 -2.07 -0.15 0.00 0.00 0.00 0.00 19.45 17.73 3ieo n ALA 54 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 3ieo s THR 55 N -0.93 1.43 0.41 0.00 2.01 -1.26 -4.88 115.64 112.42 3ieo s THR 55 Ca 0.60 -1.94 -0.21 0.00 0.31 0.00 0.00 61.69 60.45 3ieo s THR 55 Cb -0.69 -2.06 -0.11 0.00 0.01 0.00 0.00 72.50 69.65 3ieo s THR 55 CO 0.59 -0.70 0.94 -0.94 -0.69 0.00 0.00 174.62 173.82 3ieo s SER 56 N 1.13 6.98 -0.00 3.53 1.04 -1.26 0.29 113.70 125.41 3ieo s SER 56 Ca 0.12 1.68 -0.00 0.00 0.48 0.00 0.00 55.95 58.23 3ieo s SER 56 Cb -0.19 -2.54 -0.00 0.00 0.10 0.00 0.00 66.02 63.39 3ieo s SER 56 CO -0.15 -0.31 -0.00 0.18 0.98 0.00 0.00 173.24 173.93 3ieo n LEU 57 N -0.47 1.26 -3.76 2.42 4.77 -0.27 -3.96 117.00 117.00 3ieo n LEU 57 Ca 0.06 0.00 -0.07 0.00 -0.03 0.00 0.00 56.01 55.97 3ieo n LEU 57 Cb 0.53 -0.01 -0.02 0.00 -2.33 0.00 0.00 43.42 41.59 3ieo n LEU 57 CO 0.38 0.22 0.51 0.00 -1.33 0.00 0.00 177.39 177.17 3ieo s ARG 58 N -2.01 1.57 -0.06 3.23 1.70 -1.23 -0.99 118.95 121.16 3ieo s ARG 58 Ca -0.01 -0.82 0.01 0.00 -0.47 0.00 0.00 55.73 54.44 3ieo s ARG 58 Cb 0.00 0.56 0.02 0.00 -0.57 0.00 0.00 34.95 34.96 3ieo s ARG 58 CO 0.01 -0.71 -0.09 -1.50 -1.08 0.00 0.00 175.30 171.93 3ieo s ILE 59 N -3.75 0.90 -0.09 4.99 2.07 -0.62 -1.33 121.20 123.37 3ieo s ILE 59 Ca 0.09 -0.32 0.02 0.00 -1.41 0.00 0.00 60.65 59.03 3ieo s ILE 59 Cb -0.04 -0.87 0.01 0.00 0.13 0.00 0.00 42.46 41.69 3ieo s ILE 59 CO 0.02 0.31 -0.15 -0.22 -1.91 0.00 0.00 174.94 173.00 3ieo s LEU 60 N 0.92 1.70 -0.39 8.50 2.96 -0.31 -1.56 118.68 130.50 3ieo s LEU 60 Ca -0.10 -0.37 -0.26 0.00 -0.22 0.00 0.00 54.13 53.17 3ieo s LEU 60 Cb -0.15 -0.99 0.02 0.00 0.50 0.00 0.00 46.19 45.57 3ieo s LEU 60 CO 0.01 0.04 0.95 0.21 -1.32 0.00 0.00 176.35 176.24 3ieo s ASN 61 N 0.77 6.66 -0.12 3.68 3.84 -0.39 -0.33 114.94 129.05 3ieo s ASN 61 Ca -0.12 0.51 0.16 0.00 0.21 0.00 0.00 52.86 53.62 3ieo s ASN 61 Cb -0.16 -2.47 0.57 0.00 -0.55 0.00 0.00 41.25 38.64 3ieo s ASN 61 CO 0.02 -0.93 1.48 -0.46 -2.79 0.00 0.00 177.10 174.43 3ieo n ASN 62 N 6.94 4.14 0.00 -4.21 0.23 -1.01 0.27 115.26 121.62 3ieo n ASN 62 Ca 0.08 -2.60 0.00 0.00 -0.53 0.00 0.00 54.58 51.53 3ieo n ASN 62 Cb 0.48 -0.50 0.00 0.00 -2.08 0.00 0.00 39.78 37.68 3ieo n ASN 62 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3ieo n GLY 63 N 0.36 1.21 0.00 4.83 0.00 -1.26 -4.75 105.19 105.57 3ieo n GLY 63 Ca 0.21 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.23 3ieo n GLY 63 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 3ieo n HIS 64 N -2.00 0.00 -3.46 1.61 1.44 -1.26 -4.67 115.22 106.88 3ieo n HIS 64 Ca 0.00 0.00 -0.03 0.00 -2.01 0.00 0.00 57.72 55.68 3ieo n HIS 64 Cb 0.00 0.00 0.01 0.00 0.12 0.00 0.00 29.99 30.12 3ieo n HIS 64 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 3ieo n ALA 65 N -1.16 -0.96 -2.47 1.59 0.00 -1.26 -4.86 120.51 111.39 3ieo n ALA 65 Ca 0.00 -0.54 -0.32 0.00 0.00 0.00 0.00 53.44 52.58 3ieo n ALA 65 Cb 0.07 0.39 -0.13 0.00 0.00 0.00 0.00 19.45 19.78 3ieo n ALA 65 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 3ieo s PHE 66 N -5.29 2.64 -0.20 0.00 -0.12 -1.26 -2.41 117.98 111.35 3ieo s PHE 66 Ca 0.08 -0.20 -0.05 0.00 -0.05 0.00 0.00 56.93 56.72 3ieo s PHE 66 Cb -0.02 -1.56 -0.02 0.00 -0.63 0.00 0.00 43.02 40.79 3ieo s PHE 66 CO 0.04 0.21 -0.01 -0.80 -0.05 0.00 0.00 175.22 174.62 3ieo s ASN 67 N -1.04 4.72 -0.31 1.98 0.02 0.55 -4.21 114.94 116.66 3ieo s ASN 67 Ca 0.13 -0.24 -0.18 0.00 -1.02 0.00 0.00 52.86 51.55 3ieo s ASN 67 Cb -0.11 -1.81 -0.02 0.00 0.02 0.00 0.00 41.25 39.34 3ieo s ASN 67 CO 0.03 0.04 0.50 -0.69 0.02 0.00 0.00 177.10 177.00 3ieo s VAL 68 N 1.11 5.05 0.02 1.60 1.01 0.29 -1.16 120.40 128.32 3ieo s VAL 68 Ca 0.02 0.59 0.02 0.00 0.00 0.00 0.00 61.98 62.62 3ieo s VAL 68 Cb -0.14 -3.88 -0.04 0.00 0.00 0.00 0.00 36.38 32.32 3ieo s VAL 68 CO 0.01 -0.06 -0.00 -1.61 0.00 0.00 0.00 175.10 173.44 3ieo s GLU 69 N 2.34 2.72 0.21 2.72 2.02 -0.44 -0.36 118.70 127.90 3ieo s GLU 69 Ca 0.19 -0.67 0.10 0.00 0.02 0.00 0.00 54.97 54.62 3ieo s GLU 69 Cb -0.15 -2.63 -0.05 0.00 0.10 0.00 0.00 34.13 31.40 3ieo s GLU 69 CO 0.11 0.60 -0.20 -0.06 0.02 0.00 0.00 175.26 175.74 3ieo s PHE 70 N -1.13 2.07 -0.42 1.61 0.40 0.38 -1.11 117.98 119.77 3ieo s PHE 70 Ca 0.21 -0.41 -0.29 0.00 -0.60 0.00 0.00 56.93 55.84 3ieo s PHE 70 Cb -0.12 -0.99 0.02 0.00 0.51 0.00 0.00 43.02 42.45 3ieo s PHE 70 CO 0.12 0.49 1.09 0.34 0.70 0.00 0.00 175.22 177.96 3ieo s ASP 71 N -2.96 6.72 -0.24 1.36 -1.08 0.15 -4.85 116.67 115.76 3ieo s ASP 71 Ca 0.22 0.62 0.12 0.00 -0.52 0.00 0.00 52.55 53.00 3ieo s ASP 71 Cb -0.06 -2.54 0.51 0.00 -1.46 0.00 0.00 42.92 39.38 3ieo s ASP 71 CO 0.10 -1.10 1.45 -0.90 0.52 0.00 0.00 175.17 175.23 3ieo n ASP 72 N 7.44 3.11 -0.17 -0.34 3.85 -1.26 -4.57 116.55 124.62 3ieo n ASP 72 Ca 0.11 -3.42 0.08 0.00 -0.71 0.00 0.00 54.79 50.86 3ieo n ASP 72 Cb 0.48 -0.60 0.42 0.00 -1.35 0.00 0.00 41.12 40.08 3ieo n ASP 72 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.20 174.65 3ieo n SER 73 N -0.88 0.50 -3.74 -1.12 3.41 -1.26 -4.82 113.62 105.70 3ieo n SER 73 Ca 0.28 -1.59 -0.10 0.00 -0.26 0.00 0.00 58.87 57.21 3ieo n SER 73 Cb 0.98 -0.04 -0.04 0.00 -0.26 0.00 0.00 64.21 64.85 3ieo n SER 73 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 3ieo s GLN 74 N -1.93 1.36 -1.38 4.33 -0.21 -1.26 -5.10 119.66 115.47 3ieo s GLN 74 Ca 0.25 -0.87 -0.08 0.00 0.02 0.00 0.00 55.36 54.68 3ieo s GLN 74 Cb 0.12 0.51 -0.02 0.00 1.00 0.00 0.00 33.01 34.63 3ieo s GLN 74 CO 0.20 -0.57 2.78 -0.25 -2.12 0.00 0.00 175.29 175.32 3ieo n ASP 75 N -0.33 8.24 0.00 5.90 9.92 -1.26 -4.77 116.55 134.24 3ieo n ASP 75 Ca -0.10 -2.80 0.00 0.00 -0.53 0.00 0.00 54.79 51.36 3ieo n ASP 75 Cb 0.63 -1.47 0.00 0.00 -0.64 0.00 0.00 41.12 39.64 3ieo n ASP 75 CO 0.00 0.00 0.00 0.29 0.13 0.00 0.00 177.20 177.62 3ieo n LYS 76 N 2.72 0.00 -1.89 -1.24 5.02 -1.26 -4.76 118.16 116.75 3ieo n LYS 76 Ca 0.70 0.00 -0.42 0.00 -2.02 0.00 0.00 58.31 56.57 3ieo n LYS 76 Cb 0.28 0.00 -0.03 0.00 -0.02 0.00 0.00 35.03 35.27 3ieo n LYS 76 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3ieo s ALA 77 N -4.00 2.71 0.08 7.82 0.00 -1.26 -4.77 121.76 122.34 3ieo s ALA 77 Ca 0.00 0.29 0.06 0.00 0.00 0.00 0.00 51.96 52.31 3ieo s ALA 77 Cb 0.00 -4.07 -0.03 0.00 0.00 0.00 0.00 23.12 19.02 3ieo s ALA 77 CO 0.00 -2.88 -0.16 0.14 0.00 0.00 0.00 175.76 172.86 3ieo s VAL 78 N 7.70 1.32 -0.12 0.00 -7.23 -0.95 -1.22 120.40 119.90 3ieo s VAL 78 Ca 0.85 -1.35 0.02 0.00 -1.81 0.00 0.00 61.98 59.69 3ieo s VAL 78 Cb -0.24 -1.23 0.01 0.00 0.56 0.00 0.00 36.38 35.48 3ieo s VAL 78 CO 0.32 -0.14 -0.20 -0.22 -0.31 0.00 0.00 175.10 174.56 3ieo s LEU 79 N -1.72 1.96 0.00 1.32 0.20 -0.16 -1.69 118.68 118.59 3ieo s LEU 79 Ca 0.01 -0.53 0.06 0.00 0.69 0.00 0.00 54.13 54.36 3ieo s LEU 79 Cb -0.10 -1.30 -0.02 0.00 -0.43 0.00 0.00 46.19 44.34 3ieo s LEU 79 CO 0.03 0.07 0.22 2.29 -0.29 0.00 0.00 176.35 178.66 3ieo n LYS 80 N 4.05 0.37 0.00 1.98 2.85 -0.48 -2.22 118.16 124.71 3ieo n LYS 80 Ca -0.20 -2.73 0.00 0.00 -1.05 0.00 0.00 58.31 54.33 3ieo n LYS 80 Cb 0.52 2.16 0.00 0.00 -0.65 0.00 0.00 35.03 37.06 3ieo n LYS 80 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 3ieo n GLY 81 N -0.49 -2.11 7.00 2.58 0.00 -1.26 -0.40 105.19 110.51 3ieo n GLY 81 Ca 0.05 -1.48 0.00 0.00 0.00 0.00 0.00 46.02 44.59 3ieo n GLY 81 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ieo n GLY 82 N -0.08 2.12 0.35 -0.02 0.00 0.17 -1.71 105.19 106.02 3ieo n GLY 82 Ca 0.00 -0.50 0.08 0.00 0.00 0.00 0.00 46.02 45.60 3ieo n GLY 82 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3ieo n PRO 83 N 13.25 1.45 -3.34 1.61 -0.04 -1.26 -3.14 135.00 143.53 3ieo n PRO 83 Ca 0.00 -0.69 -0.34 0.00 -0.04 0.00 0.00 63.50 62.43 3ieo n PRO 83 Cb 0.00 -1.28 -0.06 0.00 -0.04 0.00 0.00 33.50 32.12 3ieo n PRO 83 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 3ieo s LEU 84 N -1.36 4.26 -0.18 1.53 1.43 -0.70 -5.06 118.68 118.60 3ieo s LEU 84 Ca 0.24 1.07 -0.06 0.00 -1.03 0.00 0.00 54.13 54.35 3ieo s LEU 84 Cb 0.13 -3.49 -0.04 0.00 0.03 0.00 0.00 46.19 42.82 3ieo s LEU 84 CO 0.19 0.02 0.03 -1.81 0.23 0.00 0.00 176.35 175.01 3ieo s ASP 85 N -1.96 5.31 0.48 2.29 -0.00 -1.26 -4.35 116.67 117.19 3ieo s ASP 85 Ca 0.43 -0.02 0.00 0.00 -0.00 0.00 0.00 52.55 52.95 3ieo s ASP 85 Cb -0.13 -1.90 0.00 0.00 -0.00 0.00 0.00 42.92 40.88 3ieo s ASP 85 CO 0.20 0.14 0.00 0.61 -0.00 0.00 0.00 175.17 176.12 3ieo n GLY 86 N 3.73 0.92 3.23 0.21 0.00 -1.26 -4.91 105.19 107.10 3ieo n GLY 86 Ca -0.17 -0.77 -0.29 0.00 0.00 0.00 0.00 46.02 44.79 3ieo n GLY 86 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3ieo s THR 87 N 0.00 1.83 -0.09 2.61 2.01 -1.26 -4.47 115.64 116.27 3ieo s THR 87 Ca 0.00 -0.95 0.03 0.00 0.31 0.00 0.00 61.69 61.07 3ieo s THR 87 Cb 0.00 -1.54 0.01 0.00 0.01 0.00 0.00 72.50 70.98 3ieo s THR 87 CO 0.00 0.51 -0.17 -0.31 -0.69 0.00 0.00 174.62 173.96 3ieo s TYR 88 N -0.23 1.94 -0.07 4.92 4.12 -0.94 -1.33 117.35 125.76 3ieo s TYR 88 Ca 0.00 -0.79 -0.08 0.00 0.02 0.00 0.00 57.07 56.22 3ieo s TYR 88 Cb -0.12 -1.36 -0.04 0.00 -1.52 0.00 0.00 41.96 38.92 3ieo s TYR 88 CO 0.02 -0.37 0.21 1.03 0.02 0.00 0.00 175.55 176.47 3ieo s ARG 89 N 0.61 3.55 0.03 -0.62 0.52 -0.01 -0.98 118.95 122.06 3ieo s ARG 89 Ca -0.15 -0.02 -0.30 0.00 -0.52 0.00 0.00 55.73 54.74 3ieo s ARG 89 Cb -0.16 -3.18 -0.07 0.00 0.52 0.00 0.00 34.95 32.06 3ieo s ARG 89 CO 0.05 0.74 1.53 -1.17 0.02 0.00 0.00 175.30 176.46 3ieo s LEU 90 N -1.19 4.34 -0.10 2.53 2.96 -0.36 -0.81 118.68 126.05 3ieo s LEU 90 Ca 0.19 2.29 -0.00 0.00 -0.22 0.00 0.00 54.13 56.39 3ieo s LEU 90 Cb -0.13 -3.56 -0.06 0.00 0.50 0.00 0.00 46.19 42.93 3ieo s LEU 90 CO 0.08 -0.81 -0.10 0.00 -1.32 0.00 0.00 176.35 174.21 3ieo n ILE 91 N 4.72 0.58 -3.69 6.68 3.06 -0.29 -4.63 119.36 125.79 3ieo n ILE 91 Ca 0.15 -0.21 -0.09 0.00 -2.50 0.00 0.00 62.75 60.09 3ieo n ILE 91 Cb 0.42 -0.98 -0.02 0.00 0.54 0.00 0.00 39.64 39.60 3ieo n ILE 91 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 3ieo s GLN 92 N -2.20 1.56 0.18 9.51 1.03 -1.24 -0.47 119.66 128.04 3ieo s GLN 92 Ca -0.14 -0.79 0.06 0.00 0.04 0.00 0.00 55.36 54.53 3ieo s GLN 92 Cb 0.04 0.59 -0.05 0.00 0.03 0.00 0.00 33.01 33.62 3ieo s GLN 92 CO 0.23 -0.70 -0.10 -0.59 -2.54 0.00 0.00 175.29 171.58 3ieo s PHE 93 N -3.85 1.50 0.27 9.60 -0.12 0.51 -0.73 117.98 125.15 3ieo s PHE 93 Ca 0.07 -0.71 -0.18 0.00 -0.05 0.00 0.00 56.93 56.07 3ieo s PHE 93 Cb -0.04 -0.75 0.01 0.00 -0.63 0.00 0.00 43.02 41.61 3ieo s PHE 93 CO -0.01 0.18 0.64 -3.38 -0.05 0.00 0.00 175.22 172.60 3ieo s HIS 94 N -3.19 0.01 0.25 3.49 -3.43 -1.02 -0.55 115.29 110.84 3ieo s HIS 94 Ca 0.21 -0.43 0.11 0.00 -0.80 0.00 0.00 55.06 54.14 3ieo s HIS 94 Cb 0.02 0.53 -0.05 0.00 -1.43 0.00 0.00 32.58 31.65 3ieo s HIS 94 CO 0.04 -1.16 -0.20 -0.06 -2.00 0.00 0.00 174.74 171.37 3ieo s PHE 95 N -3.93 2.18 -0.09 0.38 0.40 -1.26 -2.13 117.98 113.53 3ieo s PHE 95 Ca 0.15 -0.38 0.02 0.00 -0.60 0.00 0.00 56.93 56.12 3ieo s PHE 95 Cb -0.04 -0.98 -0.02 0.00 0.51 0.00 0.00 43.02 42.49 3ieo s PHE 95 CO 0.08 0.61 -0.13 -1.01 0.70 0.00 0.00 175.22 175.47 3ieo s HIS 96 N -2.42 2.78 0.11 0.36 3.76 0.12 -4.74 115.29 115.25 3ieo s HIS 96 Ca 0.27 -0.33 -0.11 0.00 -0.15 0.00 0.00 55.06 54.74 3ieo s HIS 96 Cb -0.05 -1.73 0.01 0.00 1.11 0.00 0.00 32.58 31.92 3ieo s HIS 96 CO 0.12 0.04 0.27 1.67 -0.85 0.00 0.00 174.74 176.00 3ieo s TRP 97 N -0.29 0.07 0.57 1.40 -2.14 -1.23 -0.38 118.94 116.94 3ieo s TRP 97 Ca 0.02 -0.46 0.09 0.00 2.66 0.00 0.00 56.10 58.41 3ieo s TRP 97 Cb -0.13 0.04 0.08 0.00 -3.10 0.00 0.00 33.47 30.37 3ieo s TRP 97 CO 0.03 -0.62 0.79 0.20 -2.66 0.00 0.00 176.95 174.68 3ieo s GLY 98 N -2.86 1.75 0.08 3.67 0.00 -1.17 -1.29 107.32 107.50 3ieo s GLY 98 Ca 0.06 -2.09 0.25 0.00 0.00 0.00 0.00 44.72 42.94 3ieo s GLY 98 CO -0.10 -1.64 1.39 -1.14 0.00 0.00 0.00 173.10 171.61 3ieo n SER 99 N -2.25 0.60 -3.92 1.64 3.41 -1.26 -4.16 113.62 107.68 3ieo n SER 99 Ca 0.15 0.03 -0.09 0.00 -0.26 0.00 0.00 58.87 58.70 3ieo n SER 99 Cb 0.61 0.14 -0.07 0.00 -0.26 0.00 0.00 64.21 64.63 3ieo n SER 99 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 3ieo s LEU 100 N -3.78 1.38 0.49 1.04 2.01 -1.26 -5.06 118.68 113.50 3ieo s LEU 100 Ca 0.08 -0.76 0.28 0.00 0.01 0.00 0.00 54.13 53.74 3ieo s LEU 100 Cb 0.15 0.98 0.91 0.00 0.01 0.00 0.00 46.19 48.24 3ieo s LEU 100 CO 0.70 -0.77 1.81 0.44 1.01 0.00 0.00 176.35 179.55 3ieo h ASP 101 N 2.72 0.00 0.02 2.29 3.45 -1.91 -2.91 116.42 120.09 3ieo h ASP 101 Ca -0.33 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.13 3ieo h ASP 101 Cb 1.20 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.97 3ieo h ASP 101 CO 0.55 0.04 0.00 0.61 -1.57 0.00 0.00 179.24 178.87 3ieo n GLY 102 N 0.48 -0.86 3.29 2.75 0.00 -1.26 -3.54 105.19 106.04 3ieo n GLY 102 Ca 0.02 -0.17 -0.09 0.00 0.00 0.00 0.00 46.02 45.78 3ieo n GLY 102 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 3ieo s GLN 103 N -2.03 1.03 0.00 1.61 -2.07 -1.10 -4.73 119.66 112.38 3ieo s GLN 103 Ca 0.40 -1.07 0.00 0.00 -1.82 0.00 0.00 55.36 52.87 3ieo s GLN 103 Cb 0.19 0.37 0.00 0.00 -1.09 0.00 0.00 33.01 32.48 3ieo s GLN 103 CO 0.32 -0.36 0.00 0.41 -1.32 0.00 0.00 175.29 174.33 3ieo n GLY 104 N -0.16 3.48 3.75 2.60 0.00 -1.06 -3.39 105.19 110.43 3ieo n GLY 104 Ca -0.11 -0.50 -0.30 0.00 0.00 0.00 0.00 46.02 45.11 3ieo n GLY 104 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3ieo s SER 105 N 0.00 4.03 -0.16 1.61 1.04 -0.59 -3.53 113.70 116.09 3ieo s SER 105 Ca 0.00 1.53 -0.17 0.00 0.48 0.00 0.00 55.95 57.80 3ieo s SER 105 Cb 0.00 -2.24 -0.06 0.00 0.10 0.00 0.00 66.02 63.82 3ieo s SER 105 CO 0.00 -2.29 -0.32 -0.62 0.98 0.00 0.00 173.24 170.98 3ieo n GLU 106 N -3.67 0.49 -2.02 4.02 1.02 -1.26 -4.85 120.64 114.37 3ieo n GLU 106 Ca 0.07 0.19 -0.36 0.00 -0.02 0.00 0.00 57.16 57.05 3ieo n GLU 106 Cb 0.55 -1.35 0.03 0.00 -0.02 0.00 0.00 31.44 30.65 3ieo n GLU 106 CO 0.00 0.00 0.00 -1.01 1.18 0.00 0.00 177.13 177.30 3ieo s HIS 107 N -2.77 2.43 0.21 -0.32 3.76 -1.26 -4.25 115.29 113.08 3ieo s HIS 107 Ca -0.27 1.52 0.09 0.00 -0.15 0.00 0.00 55.06 56.26 3ieo s HIS 107 Cb 0.04 -3.44 -0.05 0.00 1.11 0.00 0.00 32.58 30.24 3ieo s HIS 107 CO 0.39 -2.11 -0.16 0.95 -0.85 0.00 0.00 174.74 172.96 3ieo s THR 108 N -1.67 1.91 -0.21 1.30 -4.23 -1.07 -4.69 115.64 106.98 3ieo s THR 108 Ca 0.76 -2.19 0.01 0.00 -1.18 0.00 0.00 61.69 59.09 3ieo s THR 108 Cb -0.29 -2.06 0.04 0.00 1.34 0.00 0.00 72.50 71.54 3ieo s THR 108 CO 0.33 -0.49 -0.11 -0.69 -0.54 0.00 0.00 174.62 173.11 3ieo s VAL 109 N -2.68 1.75 -1.50 2.29 1.01 -0.72 0.12 120.40 120.68 3ieo s VAL 109 Ca 0.23 -1.11 -0.02 0.00 0.00 0.00 0.00 61.98 61.08 3ieo s VAL 109 Cb -0.03 -1.82 0.02 0.00 0.00 0.00 0.00 36.38 34.56 3ieo s VAL 109 CO 0.08 0.16 0.29 0.47 0.00 0.00 0.00 175.10 176.11 3ieo n ASP 110 N 4.64 -0.10 0.00 3.32 10.43 0.38 -0.77 116.55 134.45 3ieo n ASP 110 Ca -0.15 -1.12 0.00 0.00 2.57 0.00 0.00 54.79 56.09 3ieo n ASP 110 Cb 0.46 -2.45 0.00 0.00 1.84 0.00 0.00 41.12 40.97 3ieo n ASP 110 CO 0.00 0.00 0.00 0.29 -1.07 0.00 0.00 177.20 176.42 3ieo n LYS 111 N -4.46 -0.51 -2.75 -1.24 4.76 -1.26 -4.99 118.16 107.71 3ieo n LYS 111 Ca -0.28 0.13 -0.42 0.00 -2.87 0.00 0.00 58.31 54.87 3ieo n LYS 111 Cb 0.67 -3.74 -0.03 0.00 -1.84 0.00 0.00 35.03 30.09 3ieo n LYS 111 CO 0.00 0.00 0.00 0.21 -1.37 0.00 0.00 177.40 176.24 3ieo s LYS 112 N -0.75 4.33 -0.08 1.97 2.20 0.05 -5.02 119.74 122.44 3ieo s LYS 112 Ca 0.00 1.24 -0.19 0.00 -0.36 0.00 0.00 55.97 56.66 3ieo s LYS 112 Cb 0.00 -3.58 -0.04 0.00 -1.51 0.00 0.00 37.83 32.69 3ieo s LYS 112 CO 0.00 -0.41 0.52 0.15 -0.36 0.00 0.00 175.35 175.25 3ieo s LYS 113 N 2.41 4.32 0.73 4.03 1.02 -1.26 -1.75 119.74 129.23 3ieo s LYS 113 Ca 0.43 0.55 -0.09 0.00 0.02 0.00 0.00 55.97 56.89 3ieo s LYS 113 Cb -0.17 -3.40 0.06 0.00 -0.52 0.00 0.00 37.83 33.80 3ieo s LYS 113 CO 0.12 0.23 1.07 0.71 -0.92 0.00 0.00 175.35 176.56 3ieo s TYR 114 N 0.36 2.97 0.32 3.18 1.51 -1.26 -4.70 117.35 119.73 3ieo s TYR 114 Ca 0.28 0.59 0.06 0.00 -1.01 0.00 0.00 57.07 56.99 3ieo s TYR 114 Cb -0.16 -3.26 0.55 0.00 -0.11 0.00 0.00 41.96 38.98 3ieo s TYR 114 CO 0.13 -1.48 1.79 0.00 -1.11 0.00 0.00 175.55 174.88 3ieo h ALA 115 N -0.73 1.25 -2.95 3.71 0.00 -1.32 -1.51 119.26 117.72 3ieo h ALA 115 Ca -0.45 -0.30 0.04 0.00 0.00 0.00 0.00 54.91 54.20 3ieo h ALA 115 Cb 1.31 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.97 3ieo h ALA 115 CO 0.62 0.49 0.27 0.00 0.00 0.00 0.00 179.25 180.64 3ieo s ALA 116 N -4.53 -1.05 -0.07 0.00 0.00 -1.05 -3.06 121.76 112.00 3ieo s ALA 116 Ca -0.06 -0.48 -0.04 0.00 0.00 0.00 0.00 51.96 51.38 3ieo s ALA 116 Cb 0.14 0.76 0.03 0.00 0.00 0.00 0.00 23.12 24.05 3ieo s ALA 116 CO 0.77 -1.02 0.16 -2.00 0.00 0.00 0.00 175.76 173.66 3ieo s GLU 117 N -3.14 0.14 -0.14 0.00 2.12 0.49 -1.15 118.70 117.00 3ieo s GLU 117 Ca 0.13 0.32 -0.06 0.00 0.36 0.00 0.00 54.97 55.72 3ieo s GLU 117 Cb -0.05 -0.07 -0.04 0.00 0.26 0.00 0.00 34.13 34.23 3ieo s GLU 117 CO 0.09 -0.11 0.08 -1.17 -0.54 0.00 0.00 175.26 173.61 3ieo s LEU 118 N 0.76 3.98 -0.20 2.70 2.96 -0.15 0.10 118.68 128.82 3ieo s LEU 118 Ca -0.06 0.23 0.01 0.00 -0.22 0.00 0.00 54.13 54.10 3ieo s LEU 118 Cb -0.07 -1.98 0.04 0.00 0.50 0.00 0.00 46.19 44.68 3ieo s LEU 118 CO -0.04 0.29 -0.13 -1.00 -1.32 0.00 0.00 176.35 174.15 3ieo s HIS 119 N -0.34 2.69 -0.26 5.38 3.76 -0.90 0.09 115.29 125.70 3ieo s HIS 119 Ca 0.09 -1.75 -0.09 0.00 -0.15 0.00 0.00 55.06 53.17 3ieo s HIS 119 Cb -0.12 -1.78 -0.04 0.00 1.11 0.00 0.00 32.58 31.76 3ieo s HIS 119 CO 0.02 -0.79 0.13 -0.51 -0.85 0.00 0.00 174.74 172.74 3ieo s LEU 120 N 1.31 3.74 -0.16 0.89 1.02 -0.47 -2.43 118.68 122.57 3ieo s LEU 120 Ca -0.01 -0.10 -0.07 0.00 0.02 0.00 0.00 54.13 53.97 3ieo s LEU 120 Cb -0.16 -2.02 -0.04 0.00 0.02 0.00 0.00 46.19 43.99 3ieo s LEU 120 CO -0.09 -0.03 0.08 -0.69 0.02 0.00 0.00 176.35 175.64 3ieo s VAL 121 N 1.64 4.97 0.02 -1.59 1.01 0.09 -1.62 120.40 124.92 3ieo s VAL 121 Ca 0.07 0.02 0.02 0.00 0.00 0.00 0.00 61.98 62.09 3ieo s VAL 121 Cb -0.15 -3.22 -0.02 0.00 0.00 0.00 0.00 36.38 32.99 3ieo s VAL 121 CO 0.07 0.50 -0.06 -1.00 0.00 0.00 0.00 175.10 174.61 3ieo s HIS 122 N -0.04 0.55 -0.09 5.22 3.76 -0.03 -1.14 115.29 123.52 3ieo s HIS 122 Ca 0.07 -0.34 0.03 0.00 -0.15 0.00 0.00 55.06 54.67 3ieo s HIS 122 Cb -0.12 -0.34 -0.01 0.00 1.11 0.00 0.00 32.58 33.22 3ieo s HIS 122 CO 0.01 -0.06 -0.18 1.67 -0.85 0.00 0.00 174.74 175.33 3ieo s TRP 123 N -0.89 2.67 -0.65 1.40 1.48 0.01 -0.59 118.94 122.37 3ieo s TRP 123 Ca -0.06 -0.62 -0.29 0.00 -1.06 0.00 0.00 56.10 54.08 3ieo s TRP 123 Cb -0.07 -1.72 -0.13 0.00 -1.16 0.00 0.00 33.47 30.39 3ieo s TRP 123 CO 0.00 -0.16 2.49 -1.71 -4.06 0.00 0.00 176.95 173.51 3ieo n ASN 124 N 3.13 1.57 0.08 -2.66 2.85 -0.30 -0.83 115.26 119.11 3ieo n ASN 124 Ca -0.18 -0.15 0.05 0.00 -0.11 0.00 0.00 54.58 54.20 3ieo n ASN 124 Cb 0.52 -1.31 0.27 0.00 1.24 0.00 0.00 39.78 40.51 3ieo n ASN 124 CO 0.00 0.00 0.00 0.35 -2.11 0.00 0.00 177.26 175.50 3ieo n THR 125 N 7.72 1.40 0.54 -0.44 -2.24 -0.44 -1.23 114.28 119.59 3ieo n THR 125 Ca 0.48 0.62 0.07 0.00 -2.27 0.00 0.00 64.05 62.95 3ieo n THR 125 Cb 0.32 -1.62 0.32 0.00 -2.10 0.00 0.00 70.33 67.25 3ieo n THR 125 CO 0.00 0.00 0.00 2.29 -0.57 0.00 0.00 175.07 176.79 3ieo n LYS 127 N -1.84 0.04 -0.35 -0.78 2.85 -1.26 -2.77 118.16 114.05 3ieo n LYS 127 Ca -0.01 0.23 0.12 0.00 -1.05 0.00 0.00 58.31 57.60 3ieo n LYS 127 Cb 0.06 -1.50 0.31 0.00 -0.65 0.00 0.00 35.03 33.25 3ieo n LYS 127 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 3ieo n TYR 128 N -1.46 0.92 0.00 5.58 4.02 -0.37 -5.01 117.16 120.85 3ieo n TYR 128 Ca 0.04 -0.46 0.00 0.00 -0.01 0.00 0.00 57.90 57.47 3ieo n TYR 128 Cb 0.16 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.48 3ieo n TYR 128 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3ieo n GLY 129 N 1.64 1.68 3.61 2.72 0.00 -1.11 -4.26 105.19 109.47 3ieo n GLY 129 Ca 0.24 -0.10 -0.12 0.00 0.00 0.00 0.00 46.02 46.03 3ieo n GLY 129 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 3ieo s ASP 130 N 0.00 0.50 0.20 1.61 1.47 -1.26 -5.04 116.67 114.15 3ieo s ASP 130 Ca 0.00 -1.30 -0.13 0.00 1.18 0.00 0.00 52.55 52.30 3ieo s ASP 130 Cb 0.00 0.72 0.22 0.00 -0.34 0.00 0.00 42.92 43.51 3ieo s ASP 130 CO 0.00 -1.41 1.66 0.15 0.68 0.00 0.00 175.17 176.25 3ieo h PHE 131 N 2.09 -0.14 -0.46 2.11 3.04 -1.94 -0.97 116.94 120.66 3ieo h PHE 131 Ca -0.29 0.04 0.09 0.00 3.98 0.00 0.00 57.97 61.79 3ieo h PHE 131 Cb 1.24 0.15 -0.07 0.00 2.56 0.00 0.00 35.95 39.83 3ieo h PHE 131 CO 1.32 -0.18 0.02 0.78 -2.02 0.00 0.00 178.31 178.23 3ieo h GLY 132 N 0.06 0.49 1.46 2.40 0.00 -1.97 -1.20 103.07 104.32 3ieo h GLY 132 Ca 0.28 0.04 -0.20 0.00 0.00 0.00 0.00 47.33 47.44 3ieo h GLY 132 CO -0.51 -0.11 -0.77 0.50 0.00 0.00 0.00 176.54 175.65 3ieo h LYS 133 N 0.14 0.52 -1.02 4.80 1.79 -1.77 -3.28 116.57 117.74 3ieo h LYS 133 Ca 0.23 -0.44 0.25 0.00 -2.18 0.00 0.00 60.65 58.51 3ieo h LYS 133 Cb 0.33 0.10 -0.11 0.00 -1.58 0.00 0.00 32.23 30.97 3ieo h LYS 133 CO -0.36 1.07 0.64 0.00 -1.08 0.00 0.00 179.45 179.72 3ieo h ALA 134 N 0.80 2.04 -0.32 3.86 0.00 -0.53 -2.00 119.26 123.11 3ieo h ALA 134 Ca -0.04 0.08 -0.09 0.00 0.00 0.00 0.00 54.91 54.86 3ieo h ALA 134 Cb 1.37 0.02 -0.05 0.00 0.00 0.00 0.00 17.79 19.13 3ieo h ALA 134 CO 0.14 -0.47 0.11 1.33 0.00 0.00 0.00 179.25 180.36 3ieo n VAL 135 N -4.73 1.49 -0.01 0.00 0.24 -0.51 -2.75 118.33 112.06 3ieo n VAL 135 Ca 0.26 -0.69 0.00 0.00 -2.04 0.00 0.00 64.34 61.86 3ieo n VAL 135 Cb 0.81 -0.55 0.00 0.00 -1.47 0.00 0.00 33.84 32.63 3ieo n VAL 135 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3ieo n GLN 136 N 0.09 2.35 -4.57 7.34 6.02 -0.75 -4.97 117.38 122.89 3ieo n GLN 136 Ca 0.17 -1.34 -0.22 0.00 -0.01 0.00 0.00 57.00 55.61 3ieo n GLN 136 Cb 0.80 -1.00 -0.15 0.00 1.02 0.00 0.00 30.24 30.91 3ieo n GLN 136 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 3ieo s GLN 137 N -0.84 1.17 0.44 -1.09 -1.52 -1.11 -5.04 119.66 111.66 3ieo s GLN 137 Ca 0.00 -0.44 0.11 0.00 -1.95 0.00 0.00 55.36 53.09 3ieo s GLN 137 Cb 0.00 -1.08 0.97 0.00 -0.22 0.00 0.00 33.01 32.68 3ieo s GLN 137 CO 0.00 0.21 2.04 -1.00 -0.25 0.00 0.00 175.29 176.29 3ieo h PRO 138 N 6.11 0.24 -0.73 2.91 0.13 -1.86 -1.19 132.00 137.61 3ieo h PRO 138 Ca -0.33 -0.03 -0.35 0.00 -0.87 0.00 0.00 66.00 64.42 3ieo h PRO 138 Cb 1.17 -0.05 -0.21 0.00 0.13 0.00 0.00 31.00 32.05 3ieo h PRO 138 CO 0.49 0.24 0.34 -0.40 -0.23 0.00 0.00 178.00 178.43 3ieo n ASP 139 N -4.42 3.50 0.18 1.44 3.85 -1.26 -4.14 116.55 115.70 3ieo n ASP 139 Ca -0.00 -3.59 0.04 0.00 -0.71 0.00 0.00 54.79 50.53 3ieo n ASP 139 Cb 0.15 -0.75 0.33 0.00 -1.35 0.00 0.00 41.12 39.50 3ieo n ASP 139 CO 0.00 0.00 0.00 1.23 -1.01 0.00 0.00 177.20 177.42 3ieo h GLY 140 N 1.27 0.00 -4.58 6.12 0.00 -1.08 -3.43 103.07 101.38 3ieo h GLY 140 Ca 0.43 0.00 -0.36 0.00 0.00 0.00 0.00 47.33 47.40 3ieo h GLY 140 CO 0.79 0.00 -0.76 1.08 0.00 0.00 0.00 176.54 177.65 3ieo s LEU 141 N -7.31 2.27 -0.07 3.11 1.43 0.20 -1.15 118.68 117.16 3ieo s LEU 141 Ca -0.01 -0.59 0.01 0.00 -1.03 0.00 0.00 54.13 52.51 3ieo s LEU 141 Cb 0.12 -0.37 0.02 0.00 0.03 0.00 0.00 46.19 45.98 3ieo s LEU 141 CO 0.70 -0.13 -0.09 0.00 0.23 0.00 0.00 176.35 177.05 3ieo s ALA 142 N -1.34 1.14 -0.15 4.21 0.00 0.24 -0.20 121.76 125.66 3ieo s ALA 142 Ca -0.05 -0.36 -0.00 0.00 0.00 0.00 0.00 51.96 51.54 3ieo s ALA 142 Cb -0.10 -0.61 -0.01 0.00 0.00 0.00 0.00 23.12 22.40 3ieo s ALA 142 CO 0.01 -0.03 -0.13 0.08 0.00 0.00 0.00 175.76 175.69 3ieo s VAL 143 N 0.95 2.90 -0.32 0.00 1.01 -0.69 -0.85 120.40 123.41 3ieo s VAL 143 Ca -0.10 -0.69 -0.19 0.00 0.00 0.00 0.00 61.98 61.00 3ieo s VAL 143 Cb -0.15 -2.23 -0.01 0.00 0.00 0.00 0.00 36.38 33.99 3ieo s VAL 143 CO 0.00 0.51 0.58 -0.22 0.00 0.00 0.00 175.10 175.97 3ieo s LEU 144 N 0.74 4.21 -0.17 3.92 0.20 -0.64 -1.19 118.68 125.74 3ieo s LEU 144 Ca -0.06 0.26 -0.08 0.00 0.69 0.00 0.00 54.13 54.94 3ieo s LEU 144 Cb -0.15 -2.72 -0.05 0.00 -0.43 0.00 0.00 46.19 42.84 3ieo s LEU 144 CO 0.01 -0.48 0.11 -0.83 -0.29 0.00 0.00 176.35 174.88 3ieo s GLY 145 N 1.69 2.03 -0.07 7.98 0.00 0.77 -1.37 107.32 118.36 3ieo s GLY 145 Ca 0.23 -0.69 0.01 0.00 0.00 0.00 0.00 44.72 44.26 3ieo s GLY 145 CO 0.12 -0.02 -0.08 -0.42 0.00 0.00 0.00 173.10 172.71 3ieo s ILE 146 N 0.02 0.89 0.36 0.90 1.01 0.11 -1.07 121.20 123.42 3ieo s ILE 146 Ca 0.09 -0.30 -0.26 0.00 0.00 0.00 0.00 60.65 60.18 3ieo s ILE 146 Cb -0.12 -0.87 -0.09 0.00 0.01 0.00 0.00 42.46 41.39 3ieo s ILE 146 CO -0.00 0.31 1.06 -0.36 0.00 0.00 0.00 174.94 175.95 3ieo s PHE 147 N 1.02 3.36 -0.13 3.97 0.08 -1.26 -0.98 117.98 124.05 3ieo s PHE 147 Ca -0.09 1.67 -0.03 0.00 0.12 0.00 0.00 56.93 58.60 3ieo s PHE 147 Cb -0.15 -3.16 -0.03 0.00 -0.57 0.00 0.00 43.02 39.11 3ieo s PHE 147 CO -0.00 -0.58 -0.03 -0.51 -0.10 0.00 0.00 175.22 173.99 3ieo s LEU 148 N -2.30 3.32 0.10 -0.37 1.02 -0.30 -0.34 118.68 119.81 3ieo s LEU 148 Ca 0.54 -0.05 0.08 0.00 0.02 0.00 0.00 54.13 54.73 3ieo s LEU 148 Cb -0.25 -1.78 -0.03 0.00 0.02 0.00 0.00 46.19 44.15 3ieo s LEU 148 CO 0.31 0.24 -0.22 -1.59 0.02 0.00 0.00 176.35 175.12 3ieo s LYS 149 N -0.09 1.19 -0.06 1.70 -2.85 0.26 -1.51 119.74 118.38 3ieo s LYS 149 Ca 0.02 -1.16 -0.30 0.00 -1.00 0.00 0.00 55.97 53.54 3ieo s LYS 149 Cb -0.13 -1.47 -0.02 0.00 -2.06 0.00 0.00 37.83 34.14 3ieo s LYS 149 CO 0.02 0.35 1.06 0.08 0.10 0.00 0.00 175.35 176.96 3ieo s VAL 150 N -1.10 4.63 0.00 1.79 1.01 -1.25 0.17 120.40 125.64 3ieo s VAL 150 Ca 0.08 1.90 0.00 0.00 0.00 0.00 0.00 61.98 63.96 3ieo s VAL 150 Cb -0.10 -4.22 0.00 0.00 0.00 0.00 0.00 36.38 32.06 3ieo s VAL 150 CO 0.04 0.05 0.00 0.61 0.00 0.00 0.00 175.10 175.80 3ieo n GLY 151 N 3.12 1.22 3.77 4.51 0.00 0.29 -4.85 105.19 113.26 3ieo n GLY 151 Ca 0.09 0.36 -0.38 0.00 0.00 0.00 0.00 46.02 46.08 3ieo n GLY 151 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3ieo s SER 152 N 2.00 7.34 0.69 1.61 0.01 -1.26 -4.19 113.70 119.90 3ieo s SER 152 Ca 0.00 1.92 -0.17 0.00 1.31 0.00 0.00 55.95 59.01 3ieo s SER 152 Cb 0.00 -2.59 -0.04 0.00 0.21 0.00 0.00 66.02 63.60 3ieo s SER 152 CO 0.00 -0.07 0.61 0.00 0.41 0.00 0.00 173.24 174.19 3ieo n ALA 153 N 0.75 -1.19 -3.46 1.44 0.00 -1.26 -2.83 120.51 113.97 3ieo n ALA 153 Ca 0.01 -0.18 -0.37 0.00 0.00 0.00 0.00 53.44 52.90 3ieo n ALA 153 Cb 0.49 -1.90 -0.12 0.00 0.00 0.00 0.00 19.45 17.92 3ieo n ALA 153 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 3ieo s LYS 154 N -2.71 2.46 0.24 0.00 2.47 -1.25 -4.75 119.74 116.19 3ieo s LYS 154 Ca 0.68 -1.34 -0.05 0.00 -1.56 0.00 0.00 55.97 53.69 3ieo s LYS 154 Cb -0.37 -3.43 0.34 0.00 -1.46 0.00 0.00 37.83 32.92 3ieo s LYS 154 CO 0.56 -0.75 1.84 -1.35 0.16 0.00 0.00 175.35 175.81 3ieo h PRO 155 N 8.14 0.91 0.00 4.03 0.11 -1.92 -2.14 132.00 141.14 3ieo h PRO 155 Ca -0.21 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.85 3ieo h PRO 155 Cb 1.07 -0.20 0.00 0.00 0.11 0.00 0.00 31.00 31.98 3ieo h PRO 155 CO 0.61 0.60 0.00 0.41 -0.21 0.00 0.00 178.00 179.41 3ieo n GLY 156 N -1.33 -0.71 0.01 -0.55 0.00 -1.24 -2.74 105.19 98.63 3ieo n GLY 156 Ca 0.13 -0.12 0.08 0.00 0.00 0.00 0.00 46.02 46.10 3ieo n GLY 156 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 3ieo n LEU 157 N -0.94 0.23 0.30 0.99 7.94 -0.81 -4.60 117.00 120.13 3ieo n LEU 157 Ca 0.15 -0.15 0.17 0.00 -1.11 0.00 0.00 56.01 55.07 3ieo n LEU 157 Cb 0.07 0.00 0.98 0.00 0.53 0.00 0.00 43.42 45.00 3ieo n LEU 157 CO 0.11 0.06 1.12 -0.61 -1.11 0.00 0.00 177.39 176.96 3ieo h GLN 158 N 0.00 0.00 -0.00 1.96 5.75 -1.49 -1.93 115.11 119.39 3ieo h GLN 158 Ca 0.00 0.00 -0.19 0.00 -0.15 0.00 0.00 58.65 58.31 3ieo h GLN 158 Cb 0.65 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 29.19 3ieo h GLN 158 CO 0.00 0.02 -0.84 0.87 -2.65 0.00 0.00 178.83 176.23 3ieo h LYS 159 N 0.00 0.15 -0.26 1.69 1.57 -1.82 -1.02 116.57 116.88 3ieo h LYS 159 Ca -0.00 -0.16 -0.08 0.00 -1.87 0.00 0.00 60.65 58.55 3ieo h LYS 159 Cb 0.07 0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.41 3ieo h LYS 159 CO 0.00 0.90 -0.14 0.28 -0.57 0.00 0.00 179.45 179.92 3ieo h VAL 160 N 0.08 1.30 -0.53 0.50 2.07 -1.76 -3.23 116.25 114.69 3ieo h VAL 160 Ca -0.03 -1.23 0.11 0.00 0.82 0.00 0.00 66.70 66.36 3ieo h VAL 160 Cb 1.45 1.56 -0.09 0.00 -1.52 0.00 0.00 31.29 32.69 3ieo h VAL 160 CO 0.12 0.39 -0.01 0.58 0.02 0.00 0.00 177.57 178.67 3ieo h VAL 161 N 0.27 0.57 0.00 2.57 2.07 -1.09 -2.53 116.25 118.11 3ieo h VAL 161 Ca 0.06 -0.04 -0.03 0.00 0.82 0.00 0.00 66.70 67.51 3ieo h VAL 161 Cb 0.65 0.45 -0.00 0.00 -1.52 0.00 0.00 31.29 30.87 3ieo h VAL 161 CO 0.04 0.02 -0.14 0.44 0.02 0.00 0.00 177.57 177.95 3ieo h ASP 162 N 0.10 0.00 0.69 0.57 3.32 -1.23 -2.77 116.42 117.10 3ieo h ASP 162 Ca 0.27 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.32 3ieo h ASP 162 Cb 0.41 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.96 3ieo h ASP 162 CO -0.46 0.14 -0.66 0.55 -1.72 0.00 0.00 179.24 177.09 3ieo n VAL 163 N -3.77 0.22 0.26 -1.35 3.14 -0.96 -4.24 118.33 111.63 3ieo n VAL 163 Ca -0.02 -0.19 0.12 0.00 -2.96 0.00 0.00 64.34 61.28 3ieo n VAL 163 Cb 0.24 0.03 0.71 0.00 -1.06 0.00 0.00 33.84 33.77 3ieo n VAL 163 CO 0.00 0.00 0.00 -0.07 -6.46 0.00 0.00 176.83 170.30 3ieo h LEU 164 N 0.00 0.00 -1.37 6.55 3.38 -1.41 -1.43 115.31 121.02 3ieo h LEU 164 Ca 0.00 0.00 0.09 0.00 0.09 0.00 0.00 57.88 58.06 3ieo h LEU 164 Cb 0.68 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.38 3ieo h LEU 164 CO 0.00 0.11 0.50 0.44 0.09 0.00 0.00 178.44 179.58 3ieo h ASP 165 N 0.00 0.64 0.42 -0.43 5.19 -1.78 -2.39 116.42 118.07 3ieo h ASP 165 Ca -0.00 0.01 0.00 0.00 -0.62 0.00 0.00 57.03 56.42 3ieo h ASP 165 Cb 0.28 -0.12 0.00 0.00 0.18 0.00 0.00 39.33 39.67 3ieo h ASP 165 CO 0.01 0.39 -0.19 -1.54 -3.12 0.00 0.00 179.24 174.80 3ieo n SER 166 N -4.49 0.54 -2.63 6.45 3.41 -0.54 -3.91 113.62 112.45 3ieo n SER 166 Ca 0.12 -0.48 -0.12 0.00 -0.26 0.00 0.00 58.87 58.14 3ieo n SER 166 Cb 0.30 -0.03 0.03 0.00 -0.26 0.00 0.00 64.21 64.25 3ieo n SER 166 CO 0.00 0.00 0.00 2.30 -0.16 0.00 0.00 175.04 177.18 3ieo n ILE 167 N -1.03 1.28 -0.16 -1.33 -5.35 -0.90 -4.67 119.36 107.20 3ieo n ILE 167 Ca 0.12 -3.40 -0.11 0.00 -0.27 0.00 0.00 62.75 59.09 3ieo n ILE 167 Cb 0.31 0.34 -0.00 0.00 -1.74 0.00 0.00 39.64 38.55 3ieo n ILE 167 CO 0.00 0.00 0.00 0.50 -1.76 0.00 0.00 176.55 175.29 3ieo h LYS 168 N 2.88 0.98 -6.19 6.28 3.64 -1.67 -3.42 116.57 119.08 3ieo h LYS 168 Ca -0.02 -0.41 -0.52 0.00 -1.27 0.00 0.00 60.65 58.42 3ieo h LYS 168 Cb 1.15 -0.04 -0.06 0.00 -0.41 0.00 0.00 32.23 32.87 3ieo h LYS 168 CO 0.54 1.09 -0.54 0.95 -2.27 0.00 0.00 179.45 179.22 3ieo s THR 169 N -4.69 3.86 0.09 1.00 -4.23 -1.26 -0.44 115.64 109.97 3ieo s THR 169 Ca -0.12 -1.55 -0.36 0.00 -1.18 0.00 0.00 61.69 58.48 3ieo s THR 169 Cb 0.12 -3.18 -0.17 0.00 1.34 0.00 0.00 72.50 70.61 3ieo s THR 169 CO 0.87 -0.30 1.33 1.17 -0.54 0.00 0.00 174.62 177.15 3ieo n LYS 170 N -1.15 1.16 0.00 3.99 4.81 0.20 -2.42 118.16 124.76 3ieo n LYS 170 Ca -0.06 0.42 0.00 0.00 -0.87 0.00 0.00 58.31 57.80 3ieo n LYS 170 Cb 0.59 -2.05 0.00 0.00 0.02 0.00 0.00 35.03 33.59 3ieo n LYS 170 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3ieo n GLY 171 N 2.49 2.31 3.79 3.14 0.00 0.14 -4.45 105.19 112.61 3ieo n GLY 171 Ca 0.18 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.85 3ieo n GLY 171 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ieo s LYS 172 N -0.37 3.97 0.04 1.61 1.02 -1.01 -4.89 119.74 120.11 3ieo s LYS 172 Ca 0.00 1.42 -0.06 0.00 0.02 0.00 0.00 55.97 57.35 3ieo s LYS 172 Cb 0.00 -2.29 -0.01 0.00 -0.52 0.00 0.00 37.83 35.01 3ieo s LYS 172 CO 0.00 -0.29 0.10 -1.54 -0.92 0.00 0.00 175.35 172.70 3ieo s SER 173 N -1.81 0.18 0.12 2.83 1.04 -1.26 -1.26 113.70 113.54 3ieo s SER 173 Ca 0.63 -0.56 0.03 0.00 0.48 0.00 0.00 55.95 56.53 3ieo s SER 173 Cb -0.18 0.24 -0.04 0.00 0.10 0.00 0.00 66.02 66.13 3ieo s SER 173 CO 0.23 -0.54 -0.09 0.00 0.98 0.00 0.00 173.24 173.82 3ieo s ALA 174 N -2.79 1.22 0.39 5.32 0.00 -0.60 -4.96 121.76 120.35 3ieo s ALA 174 Ca -0.03 -1.37 -0.27 0.00 0.00 0.00 0.00 51.96 50.28 3ieo s ALA 174 Cb -0.00 0.08 -0.10 0.00 0.00 0.00 0.00 23.12 23.09 3ieo s ALA 174 CO -0.05 -0.12 1.48 -0.51 0.00 0.00 0.00 175.76 176.55 3ieo s ASP 175 N -2.94 6.23 -0.45 0.00 1.01 -1.26 -1.60 116.67 117.65 3ieo s ASP 175 Ca 0.12 3.03 0.07 0.00 0.71 0.00 0.00 52.55 56.48 3ieo s ASP 175 Cb 0.02 -2.67 0.25 0.00 1.01 0.00 0.00 42.92 41.54 3ieo s ASP 175 CO -0.01 -0.95 0.79 0.33 0.21 0.00 0.00 175.17 175.54 3ieo n PHE 176 N 0.30 -2.32 -3.59 4.23 7.35 -0.16 -4.74 117.46 118.54 3ieo n PHE 176 Ca 0.02 -2.38 -0.27 0.00 -0.76 0.00 0.00 57.45 54.06 3ieo n PHE 176 Cb 0.40 0.94 -0.03 0.00 0.35 0.00 0.00 39.48 41.14 3ieo n PHE 176 CO 0.00 0.00 0.00 0.95 -0.76 0.00 0.00 176.76 176.95 3ieo s THR 177 N 0.01 5.16 -1.19 -2.13 -4.23 -1.25 -3.13 115.64 108.87 3ieo s THR 177 Ca 0.32 -0.34 -0.01 0.00 -1.18 0.00 0.00 61.69 60.48 3ieo s THR 177 Cb 0.22 -3.76 0.00 0.00 1.34 0.00 0.00 72.50 70.30 3ieo s THR 177 CO -0.19 -0.28 0.12 0.59 -0.54 0.00 0.00 174.62 174.32 3ieo n ASN 178 N -0.96 -4.50 -4.75 3.99 4.13 -1.25 -4.97 115.26 106.95 3ieo n ASN 178 Ca -0.04 -0.07 -0.39 0.00 1.68 0.00 0.00 54.58 55.76 3ieo n ASN 178 Cb 0.54 -3.57 -0.06 0.00 -1.54 0.00 0.00 39.78 35.16 3ieo n ASN 178 CO 0.00 0.00 0.00 0.12 0.28 0.00 0.00 177.26 177.66 3ieo s PHE 179 N -2.79 3.62 -0.43 3.10 5.36 -1.26 -5.03 117.98 120.54 3ieo s PHE 179 Ca 0.06 1.09 -0.09 0.00 -0.96 0.00 0.00 56.93 57.04 3ieo s PHE 179 Cb -0.03 -2.59 0.09 0.00 -0.34 0.00 0.00 43.02 40.15 3ieo s PHE 179 CO 0.07 0.28 0.27 0.34 -1.46 0.00 0.00 175.22 174.73 3ieo s ASP 180 N 0.12 5.63 0.00 6.13 3.68 -1.26 -4.51 116.67 126.45 3ieo s ASP 180 Ca 0.30 -1.62 0.17 0.00 2.13 0.00 0.00 52.55 53.52 3ieo s ASP 180 Cb -0.17 -1.98 0.83 0.00 -1.45 0.00 0.00 42.92 40.15 3ieo s ASP 180 CO 0.15 -0.57 1.48 -0.81 0.13 0.00 0.00 175.17 175.55 3ieo n PRO 181 N 4.90 0.23 0.31 4.34 -0.04 -1.26 -2.16 135.00 141.31 3ieo n PRO 181 Ca -0.09 0.13 0.20 0.00 -0.04 0.00 0.00 63.50 63.70 3ieo n PRO 181 Cb 0.42 -1.50 1.00 0.00 -0.04 0.00 0.00 33.50 33.38 3ieo n PRO 181 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3ieo h ARG 182 N 0.00 0.00 0.00 0.54 3.08 -1.92 -2.39 114.38 113.69 3ieo h ARG 182 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3ieo h ARG 182 Cb 0.16 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.21 3ieo h ARG 182 CO 0.00 0.01 0.00 0.41 -1.07 0.00 0.00 179.97 179.32 3ieo n GLY 183 N -0.70 -0.86 0.20 0.04 0.00 -0.92 -3.01 105.19 99.95 3ieo n GLY 183 Ca -0.02 -0.14 0.04 0.00 0.00 0.00 0.00 46.02 45.90 3ieo n GLY 183 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3ieo n LEU 184 N -0.92 1.17 -4.79 0.99 4.77 -0.90 -3.63 117.00 113.70 3ieo n LEU 184 Ca 0.17 -0.82 -0.38 0.00 -0.03 0.00 0.00 56.01 54.96 3ieo n LEU 184 Cb 0.08 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.11 3ieo n LEU 184 CO 0.13 0.24 0.11 -0.76 -1.33 0.00 0.00 177.39 175.78 3ieo s LEU 185 N -1.26 4.40 0.00 2.23 1.43 -1.16 -4.91 118.68 119.40 3ieo s LEU 185 Ca 0.07 0.88 -0.15 0.00 -1.03 0.00 0.00 54.13 53.90 3ieo s LEU 185 Cb 0.06 -2.60 0.22 0.00 0.03 0.00 0.00 46.19 43.90 3ieo s LEU 185 CO 0.17 0.21 0.86 -0.81 0.23 0.00 0.00 176.35 177.01 3ieo n PRO 186 N 2.51 -2.28 -0.02 1.29 -0.04 -1.26 -4.96 135.00 130.24 3ieo n PRO 186 Ca -0.12 -1.36 -0.13 0.00 -0.04 0.00 0.00 63.50 61.85 3ieo n PRO 186 Cb 0.52 -1.19 -0.10 0.00 -0.04 0.00 0.00 33.50 32.69 3ieo n PRO 186 CO 0.00 0.00 0.00 1.49 -0.04 0.00 0.00 175.50 176.95 3ieo h GLU 187 N 0.00 0.01 -6.26 0.54 4.81 -1.92 -3.44 114.58 108.31 3ieo h GLU 187 Ca -0.31 -0.00 -0.56 0.00 -0.13 0.00 0.00 59.36 58.35 3ieo h GLU 187 Cb 0.93 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 30.27 3ieo h GLU 187 CO 0.21 0.55 0.01 0.45 -0.73 0.00 0.00 179.01 179.50 3ieo s SER 188 N -5.76 7.11 -0.11 1.04 0.15 -1.26 -4.98 113.70 109.90 3ieo s SER 188 Ca -0.16 1.32 0.15 0.00 0.70 0.00 0.00 55.95 57.96 3ieo s SER 188 Cb 0.01 -2.39 0.62 0.00 -1.71 0.00 0.00 66.02 62.55 3ieo s SER 188 CO 0.68 0.23 1.49 0.18 1.20 0.00 0.00 173.24 177.02 3ieo n LEU 189 N 1.90 4.17 -4.72 3.45 4.77 -1.26 -4.69 117.00 120.62 3ieo n LEU 189 Ca -0.09 -2.11 -0.43 0.00 -0.03 0.00 0.00 56.01 53.36 3ieo n LEU 189 Cb 0.50 -0.54 -0.02 0.00 -2.33 0.00 0.00 43.42 41.03 3ieo n LEU 189 CO 0.43 0.68 1.12 0.47 -1.33 0.00 0.00 177.39 178.75 3ieo n ASP 190 N 0.87 3.39 -3.78 -1.43 10.43 -1.26 -4.91 116.55 119.86 3ieo n ASP 190 Ca 0.22 1.16 -0.09 0.00 2.57 0.00 0.00 54.79 58.65 3ieo n ASP 190 Cb 0.80 -1.53 -0.06 0.00 1.84 0.00 0.00 41.12 42.16 3ieo n ASP 190 CO 0.00 0.00 0.00 -0.72 -1.07 0.00 0.00 177.20 175.41 3ieo s TYR 191 N -0.29 0.04 0.14 1.24 -0.85 -1.26 -0.96 117.35 115.40 3ieo s TYR 191 Ca 0.63 -0.42 0.04 0.00 -0.52 0.00 0.00 57.07 56.80 3ieo s TYR 191 Cb -0.55 0.06 -0.04 0.00 0.38 0.00 0.00 41.96 41.82 3ieo s TYR 191 CO 0.52 -0.62 0.15 -1.58 -1.52 0.00 0.00 175.55 172.50 3ieo s TRP 192 N -3.85 3.22 0.02 -3.49 0.51 -0.27 -1.44 118.94 113.64 3ieo s TRP 192 Ca 0.05 0.03 0.02 0.00 -2.12 0.00 0.00 56.10 54.08 3ieo s TRP 192 Cb 0.04 -1.56 -0.01 0.00 -0.81 0.00 0.00 33.47 31.12 3ieo s TRP 192 CO -0.11 0.52 -0.06 -0.08 -0.51 0.00 0.00 176.95 176.72 3ieo s THR 193 N -1.67 0.40 0.09 2.01 -1.32 -0.26 0.41 115.64 115.31 3ieo s THR 193 Ca 0.31 -0.67 -0.25 0.00 -1.21 0.00 0.00 61.69 59.87 3ieo s THR 193 Cb -0.11 -0.43 0.08 0.00 -1.51 0.00 0.00 72.50 70.53 3ieo s THR 193 CO 0.24 -0.19 0.69 -0.72 -2.21 0.00 0.00 174.62 172.43 3ieo s TYR 194 N -0.83 -0.50 0.09 9.09 -0.85 -1.09 -1.57 117.35 121.69 3ieo s TYR 194 Ca -0.06 0.40 -0.26 0.00 -0.52 0.00 0.00 57.07 56.63 3ieo s TYR 194 Cb -0.06 0.54 -0.06 0.00 0.38 0.00 0.00 41.96 42.75 3ieo s TYR 194 CO 0.00 -0.74 0.82 -1.25 -1.52 0.00 0.00 175.55 172.86 3ieo s PRO 195 N -3.26 4.57 0.00 -3.49 0.04 -1.26 -1.07 135.00 130.53 3ieo s PRO 195 Ca 0.01 1.20 0.00 0.00 0.04 0.00 0.00 61.00 62.24 3ieo s PRO 195 Cb -0.01 -3.35 0.00 0.00 0.04 0.00 0.00 34.50 31.18 3ieo s PRO 195 CO -0.09 0.32 0.00 0.41 0.04 0.00 0.00 177.00 177.67 3ieo n GLY 196 N 2.20 3.49 3.31 0.56 0.00 0.45 -4.82 105.19 110.38 3ieo n GLY 196 Ca -0.02 -0.42 -0.11 0.00 0.00 0.00 0.00 46.02 45.47 3ieo n GLY 196 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3ieo s SER 197 N 1.98 0.09 0.68 1.61 1.04 -1.15 -1.94 113.70 116.01 3ieo s SER 197 Ca 0.00 -1.23 -0.15 0.00 0.48 0.00 0.00 55.95 55.05 3ieo s SER 197 Cb 0.00 0.43 0.01 0.00 0.10 0.00 0.00 66.02 66.57 3ieo s SER 197 CO 0.00 -0.92 1.14 -0.76 0.98 0.00 0.00 173.24 173.69 3ieo s LEU 198 N -3.11 3.37 0.00 2.42 1.43 -0.94 -4.53 118.68 117.33 3ieo s LEU 198 Ca 0.33 2.13 0.18 0.00 -1.03 0.00 0.00 54.13 55.74 3ieo s LEU 198 Cb 0.05 -4.57 0.29 0.00 0.03 0.00 0.00 46.19 41.99 3ieo s LEU 198 CO 0.10 -1.85 1.22 0.35 0.23 0.00 0.00 176.35 176.40 3ieo n THR 199 N -2.49 0.40 -4.43 5.49 -2.24 -1.26 -4.42 114.28 105.33 3ieo n THR 199 Ca 0.11 -0.70 -0.29 0.00 -2.27 0.00 0.00 64.05 60.90 3ieo n THR 199 Cb 0.51 1.03 -0.13 0.00 -2.10 0.00 0.00 70.33 69.65 3ieo n THR 199 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 3ieo s THR 200 N -1.33 2.38 0.31 4.28 -4.23 -1.26 -4.72 115.64 111.07 3ieo s THR 200 Ca 0.28 -1.66 -0.27 0.00 -1.18 0.00 0.00 61.69 58.86 3ieo s THR 200 Cb 0.17 -2.05 -0.14 0.00 1.34 0.00 0.00 72.50 71.82 3ieo s THR 200 CO 0.24 0.12 0.85 -2.65 -0.54 0.00 0.00 174.62 172.65 3ieo n PRO 201 N 0.99 1.00 0.00 3.99 -0.02 -1.26 0.10 135.00 139.80 3ieo n PRO 201 Ca -0.17 0.35 0.00 0.00 -2.02 0.00 0.00 63.50 61.66 3ieo n PRO 201 Cb 0.53 -1.66 0.00 0.00 -0.02 0.00 0.00 33.50 32.34 3ieo n PRO 201 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 3ieo n PRO 202 N 0.69 0.52 -3.79 0.52 -0.04 -1.26 -5.00 135.00 126.64 3ieo n PRO 202 Ca 0.11 0.00 -0.29 0.00 -0.04 0.00 0.00 63.50 63.28 3ieo n PRO 202 Cb 0.33 -1.09 0.01 0.00 -0.04 0.00 0.00 33.50 32.71 3ieo n PRO 202 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 3ieo n LEU 203 N -0.23 -2.20 -4.72 1.53 4.77 0.29 -4.88 117.00 111.55 3ieo n LEU 203 Ca 0.00 -0.70 -0.42 0.00 -0.03 0.00 0.00 56.01 54.86 3ieo n LEU 203 Cb 0.05 -2.41 -0.03 0.00 -2.33 0.00 0.00 43.42 38.69 3ieo n LEU 203 CO 0.00 0.36 1.04 -0.76 -1.33 0.00 0.00 177.39 176.70 3ieo s LEU 204 N -7.08 4.39 -1.46 2.23 1.43 -1.26 -4.54 118.68 112.38 3ieo s LEU 204 Ca 0.61 2.36 -0.09 0.00 -1.03 0.00 0.00 54.13 55.98 3ieo s LEU 204 Cb -0.31 -3.60 0.03 0.00 0.03 0.00 0.00 46.19 42.34 3ieo s LEU 204 CO 0.75 -0.62 2.52 -0.62 0.23 0.00 0.00 176.35 178.61 3ieo n GLU 205 N 3.46 3.80 -0.01 1.70 1.02 -1.26 -2.21 120.64 127.15 3ieo n GLU 205 Ca 0.10 -2.82 0.01 0.00 -0.02 0.00 0.00 57.16 54.42 3ieo n GLU 205 Cb 0.42 -2.86 0.01 0.00 -0.02 0.00 0.00 31.44 29.00 3ieo n GLU 205 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3ieo s VAL 207 N -1.09 3.52 -0.41 0.00 1.01 -0.82 -0.63 120.40 121.98 3ieo s VAL 207 Ca 0.02 -0.47 -0.23 0.00 0.00 0.00 0.00 61.98 61.30 3ieo s VAL 207 Cb 0.02 -2.55 0.02 0.00 0.00 0.00 0.00 36.38 33.86 3ieo s VAL 207 CO 0.00 0.47 0.78 -0.89 0.00 0.00 0.00 175.10 175.46 3ieo s THR 208 N 0.78 4.69 0.09 3.92 2.01 0.72 -0.41 115.64 127.44 3ieo s THR 208 Ca -0.02 0.62 -0.21 0.00 0.31 0.00 0.00 61.69 62.40 3ieo s THR 208 Cb -0.15 -4.27 -0.07 0.00 0.01 0.00 0.00 72.50 68.02 3ieo s THR 208 CO 0.02 -0.59 0.61 0.26 -0.69 0.00 0.00 174.62 174.22 3ieo s TRP 209 N 3.21 3.83 -0.20 4.92 0.52 -0.24 -1.70 118.94 129.28 3ieo s TRP 209 Ca 0.30 1.35 -0.03 0.00 0.02 0.00 0.00 56.10 57.74 3ieo s TRP 209 Cb -0.13 -2.55 0.06 0.00 -1.15 0.00 0.00 33.47 29.71 3ieo s TRP 209 CO 0.20 0.58 0.06 0.42 0.02 0.00 0.00 176.95 178.23 3ieo s ILE 210 N -1.12 0.36 -0.35 2.03 1.01 -0.33 -2.68 121.20 120.12 3ieo s ILE 210 Ca 0.30 -0.53 -0.04 0.00 0.00 0.00 0.00 60.65 60.39 3ieo s ILE 210 Cb -0.20 -0.96 0.07 0.00 0.01 0.00 0.00 42.46 41.37 3ieo s ILE 210 CO 0.20 -0.29 0.10 -0.69 0.00 0.00 0.00 174.94 174.26 3ieo s VAL 211 N 1.92 3.33 0.29 2.92 1.01 0.16 -0.17 120.40 129.88 3ieo s VAL 211 Ca 0.01 -1.51 -0.30 0.00 0.00 0.00 0.00 61.98 60.18 3ieo s VAL 211 Cb -0.17 -3.02 -0.13 0.00 0.00 0.00 0.00 36.38 33.06 3ieo s VAL 211 CO -0.11 -0.31 1.38 0.18 0.00 0.00 0.00 175.10 176.24 3ieo n LEU 212 N 4.68 3.47 0.05 3.92 4.77 -0.24 -1.11 117.00 132.53 3ieo n LEU 212 Ca -0.10 1.17 -0.11 0.00 -0.03 0.00 0.00 56.01 56.95 3ieo n LEU 212 Cb 0.43 -1.47 0.01 0.00 -2.33 0.00 0.00 43.42 40.06 3ieo n LEU 212 CO 0.30 -0.40 0.32 0.50 -1.33 0.00 0.00 177.39 176.78 3ieo h LYS 213 N 3.57 0.41 -5.26 3.23 3.64 -1.38 -3.41 116.57 117.37 3ieo h LYS 213 Ca -0.46 -0.35 -0.63 0.00 -1.27 0.00 0.00 60.65 57.94 3ieo h LYS 213 Cb 1.27 0.08 -0.14 0.00 -0.41 0.00 0.00 32.23 33.03 3ieo h LYS 213 CO 0.70 1.00 -0.10 -2.00 -2.27 0.00 0.00 179.45 176.78 3ieo s GLU 214 N -3.54 3.97 0.60 1.90 2.12 -1.26 -5.01 118.70 117.47 3ieo s GLU 214 Ca -0.06 0.13 -0.13 0.00 0.36 0.00 0.00 54.97 55.28 3ieo s GLU 214 Cb 0.10 -3.68 -0.05 0.00 0.26 0.00 0.00 34.13 30.76 3ieo s GLU 214 CO 0.85 -0.38 1.02 -1.25 -0.54 0.00 0.00 175.26 174.96 3ieo s PRO 215 N 2.24 3.59 0.29 4.30 0.04 -1.26 -4.64 135.00 139.56 3ieo s PRO 215 Ca 0.18 0.88 -0.15 0.00 0.04 0.00 0.00 61.00 61.96 3ieo s PRO 215 Cb -0.16 -2.08 -0.09 0.00 0.04 0.00 0.00 34.50 32.22 3ieo s PRO 215 CO 0.10 -0.57 0.71 0.96 0.04 0.00 0.00 177.00 178.24 3ieo s ILE 216 N -2.93 4.70 -0.10 0.56 -4.36 0.54 -4.89 121.20 114.73 3ieo s ILE 216 Ca 0.57 0.92 -0.15 0.00 -0.26 0.00 0.00 60.65 61.73 3ieo s ILE 216 Cb -0.11 -3.64 -0.05 0.00 1.25 0.00 0.00 42.46 39.91 3ieo s ILE 216 CO 0.46 -0.11 0.38 -0.55 0.24 0.00 0.00 174.94 175.35 3ieo s SER 217 N -2.20 6.62 0.15 4.36 0.15 -1.26 -0.58 113.70 120.95 3ieo s SER 217 Ca 0.52 0.73 0.08 0.00 0.70 0.00 0.00 55.95 57.98 3ieo s SER 217 Cb -0.11 -2.23 -0.04 0.00 -1.71 0.00 0.00 66.02 61.93 3ieo s SER 217 CO 0.18 0.15 -0.17 0.68 1.20 0.00 0.00 173.24 175.28 3ieo s VAL 218 N -0.01 1.67 0.36 4.45 -7.23 0.13 -3.81 120.40 115.94 3ieo s VAL 218 Ca 0.21 -1.85 -0.16 0.00 -1.81 0.00 0.00 61.98 58.38 3ieo s VAL 218 Cb -0.15 -1.75 -0.09 0.00 0.56 0.00 0.00 36.38 34.96 3ieo s VAL 218 CO 0.09 -0.34 0.78 -0.94 -0.31 0.00 0.00 175.10 174.38 3ieo s SER 219 N -2.59 6.78 0.28 4.85 1.04 -1.21 0.11 113.70 122.95 3ieo s SER 219 Ca 0.13 1.35 0.01 0.00 0.48 0.00 0.00 55.95 57.92 3ieo s SER 219 Cb -0.05 -2.40 0.64 0.00 0.10 0.00 0.00 66.02 64.30 3ieo s SER 219 CO 0.05 -0.26 1.69 -1.28 0.98 0.00 0.00 173.24 174.42 3ieo h SER 220 N 2.06 0.18 -0.10 7.02 0.87 -1.93 -0.83 113.55 120.82 3ieo h SER 220 Ca -0.48 0.16 -0.06 0.00 -1.23 0.00 0.00 61.79 60.18 3ieo h SER 220 Cb 1.18 0.17 -0.01 0.00 -0.44 0.00 0.00 62.40 63.29 3ieo h SER 220 CO 0.64 -0.03 -0.09 1.05 -0.53 0.00 0.00 176.83 177.87 3ieo h GLU 221 N 0.33 0.40 -0.57 2.24 9.09 -1.96 0.11 114.58 124.24 3ieo h GLU 221 Ca 0.51 -0.10 -0.03 0.00 0.05 0.00 0.00 59.36 59.80 3ieo h GLU 221 Cb 0.95 -0.05 -0.03 0.00 -1.65 0.00 0.00 28.75 27.97 3ieo h GLU 221 CO -0.54 0.51 0.25 1.96 0.05 0.00 0.00 179.01 181.23 3ieo h GLN 222 N 0.38 0.84 0.00 1.06 4.20 -1.56 -2.99 115.11 117.04 3ieo h GLN 222 Ca 0.08 -0.14 -0.15 0.00 0.06 0.00 0.00 58.65 58.50 3ieo h GLN 222 Cb 0.40 -0.14 -0.02 0.00 0.30 0.00 0.00 27.48 28.02 3ieo h GLN 222 CO 0.02 0.71 -0.71 -0.24 -0.67 0.00 0.00 178.83 177.94 3ieo h VAL 223 N 0.77 1.33 -0.70 -0.54 3.04 -1.01 -3.07 116.25 116.07 3ieo h VAL 223 Ca 0.19 -2.59 0.06 0.00 -1.01 0.00 0.00 66.70 63.35 3ieo h VAL 223 Cb 0.17 2.47 -0.06 0.00 -2.01 0.00 0.00 31.29 31.86 3ieo h VAL 223 CO -0.02 0.70 0.40 -0.07 -1.01 0.00 0.00 177.57 177.57 3ieo h LEU 224 N 0.00 0.61 -0.57 3.16 3.38 -0.73 -2.63 115.31 118.52 3ieo h LEU 224 Ca -0.01 0.03 -0.13 0.00 0.09 0.00 0.00 57.88 57.86 3ieo h LEU 224 Cb 1.41 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 42.06 3ieo h LEU 224 CO 0.09 0.39 -0.24 0.11 0.09 0.00 0.00 178.44 178.88 3ieo h LYS 225 N 0.74 0.89 -0.93 1.13 1.57 -1.44 -1.34 116.57 117.19 3ieo h LYS 225 Ca 0.31 -0.38 0.24 0.00 -1.87 0.00 0.00 60.65 58.96 3ieo h LYS 225 Cb 0.19 -0.03 -0.17 0.00 0.08 0.00 0.00 32.23 32.30 3ieo h LYS 225 CO -0.18 1.03 0.04 0.74 -0.57 0.00 0.00 179.45 180.51 3ieo h PHE 226 N 0.76 -0.01 -0.00 -1.35 -1.00 -1.39 -2.16 116.94 111.79 3ieo h PHE 226 Ca 0.10 0.07 0.00 0.00 2.81 0.00 0.00 57.97 60.94 3ieo h PHE 226 Cb 0.79 0.15 0.00 0.00 3.61 0.00 0.00 35.95 40.50 3ieo h PHE 226 CO 0.05 -0.37 -0.03 0.54 -1.61 0.00 0.00 178.31 176.89 3ieo n ARG 227 N -5.43 0.90 0.06 1.51 1.74 -0.53 -2.42 116.66 112.50 3ieo n ARG 227 Ca 0.21 -0.19 0.12 0.00 -0.77 0.00 0.00 57.85 57.22 3ieo n ARG 227 Cb 0.69 -1.50 0.18 0.00 -1.02 0.00 0.00 32.46 30.81 3ieo n ARG 227 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 3ieo n LYS 228 N -0.88 0.29 -0.92 5.56 5.02 -0.81 -4.44 118.16 121.98 3ieo n LYS 228 Ca 0.19 0.09 -0.33 0.00 -2.02 0.00 0.00 58.31 56.24 3ieo n LYS 228 Cb 0.21 -1.69 0.13 0.00 -0.02 0.00 0.00 35.03 33.66 3ieo n LYS 228 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 3ieo n LEU 229 N -2.12 2.81 -4.44 -0.35 7.99 -1.02 -4.81 117.00 115.07 3ieo n LEU 229 Ca 0.03 0.48 -0.33 0.00 -0.01 0.00 0.00 56.01 56.19 3ieo n LEU 229 Cb 0.44 -1.41 -0.14 0.00 -0.11 0.00 0.00 43.42 42.20 3ieo n LEU 229 CO 0.36 -2.37 -0.46 0.20 -1.51 0.00 0.00 177.39 173.62 3ieo s ASN 230 N -2.20 3.96 0.13 -1.43 0.02 0.42 -0.25 114.94 115.59 3ieo s ASN 230 Ca 0.67 -0.24 -0.08 0.00 -1.02 0.00 0.00 52.86 52.20 3ieo s ASN 230 Cb -0.26 -0.98 -0.06 0.00 0.02 0.00 0.00 41.25 39.96 3ieo s ASN 230 CO 0.57 0.31 1.36 -0.26 0.02 0.00 0.00 177.10 179.10 3ieo h PHE 231 N 5.64 0.83 -4.31 2.20 0.05 -1.62 -3.35 116.94 116.38 3ieo h PHE 231 Ca -0.42 -0.37 -0.52 0.00 3.82 0.00 0.00 57.97 60.48 3ieo h PHE 231 Cb 1.16 -0.13 0.13 0.00 2.00 0.00 0.00 35.95 39.12 3ieo h PHE 231 CO 0.49 1.17 0.32 0.54 -0.18 0.00 0.00 178.31 180.66 3ieo s ASN 232 N -7.06 4.50 0.57 2.17 4.22 -1.26 -4.38 114.94 113.71 3ieo s ASN 232 Ca -0.08 1.83 -0.05 0.00 -2.14 0.00 0.00 52.86 52.42 3ieo s ASN 232 Cb 0.09 -2.52 0.01 0.00 1.28 0.00 0.00 41.25 40.11 3ieo s ASN 232 CO 0.88 -2.04 0.86 -0.83 -2.04 0.00 0.00 177.10 173.93 3ieo s GLY 233 N -3.38 1.61 0.18 0.45 0.00 -1.26 -0.62 107.32 104.29 3ieo s GLY 233 Ca 0.61 -0.78 -0.33 0.00 0.00 0.00 0.00 44.72 44.22 3ieo s GLY 233 CO 0.56 -0.51 1.42 -2.21 0.00 0.00 0.00 173.10 172.36 3ieo n GLU 234 N -2.51 1.79 -1.38 2.90 2.13 -1.26 -1.90 120.64 120.41 3ieo n GLU 234 Ca 0.04 0.64 -0.06 0.00 0.66 0.00 0.00 57.16 58.45 3ieo n GLU 234 Cb 0.58 -2.31 -0.02 0.00 0.27 0.00 0.00 31.44 29.96 3ieo n GLU 234 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3ieo n GLY 235 N 2.63 0.65 3.68 8.31 0.00 -1.26 -5.05 105.19 114.15 3ieo n GLY 235 Ca 0.15 -0.77 -0.24 0.00 0.00 0.00 0.00 46.02 45.16 3ieo n GLY 235 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3ieo s GLU 236 N -2.89 2.43 0.63 1.61 2.02 -0.80 -5.11 118.70 116.59 3ieo s GLU 236 Ca 0.00 -1.28 -0.18 0.00 0.02 0.00 0.00 54.97 53.53 3ieo s GLU 236 Cb 0.00 -2.28 -0.02 0.00 0.10 0.00 0.00 34.13 31.93 3ieo s GLU 236 CO 0.00 0.39 1.26 -2.14 0.02 0.00 0.00 175.26 174.79 3ieo s PRO 237 N -3.54 2.72 -0.17 0.39 0.02 -1.26 -4.87 135.00 128.30 3ieo s PRO 237 Ca 0.31 1.96 -0.29 0.00 0.02 0.00 0.00 61.00 62.99 3ieo s PRO 237 Cb -0.07 -1.88 -0.00 0.00 0.02 0.00 0.00 34.50 32.56 3ieo s PRO 237 CO 0.20 -1.44 1.06 -2.00 -0.33 0.00 0.00 177.00 174.49 3ieo s GLU 238 N -3.37 4.33 -0.24 5.54 2.12 -1.26 -4.78 118.70 121.03 3ieo s GLU 238 Ca 0.80 1.42 0.02 0.00 0.36 0.00 0.00 54.97 57.57 3ieo s GLU 238 Cb -0.34 -3.61 0.05 0.00 0.26 0.00 0.00 34.13 30.49 3ieo s GLU 238 CO 0.37 -0.50 -0.10 -2.00 -0.54 0.00 0.00 175.26 172.49 3ieo s GLU 239 N 2.71 2.04 0.34 4.30 2.12 -1.26 -5.07 118.70 123.88 3ieo s GLU 239 Ca 0.47 -1.12 -0.29 0.00 0.36 0.00 0.00 54.97 54.40 3ieo s GLU 239 Cb -0.17 -2.70 -0.11 0.00 0.26 0.00 0.00 34.13 31.41 3ieo s GLU 239 CO 0.12 -0.54 1.53 -0.51 -0.54 0.00 0.00 175.26 175.32 3ieo s LEU 240 N 1.26 4.33 -0.90 2.70 1.43 -1.26 -1.86 118.68 124.37 3ieo s LEU 240 Ca -0.06 3.00 -0.25 0.00 -1.03 0.00 0.00 54.13 55.80 3ieo s LEU 240 Cb -0.19 -3.65 0.03 0.00 0.03 0.00 0.00 46.19 42.41 3ieo s LEU 240 CO -0.06 -0.88 1.48 -0.32 0.23 0.00 0.00 176.35 176.79 3ieo s MET 241 N -1.44 3.31 0.02 1.70 -2.45 0.66 -4.59 119.30 116.52 3ieo s MET 241 Ca 0.57 -0.68 -0.06 0.00 -1.25 0.00 0.00 55.69 54.27 3ieo s MET 241 Cb -0.47 -4.93 -0.01 0.00 1.25 0.00 0.00 34.83 30.67 3ieo s MET 241 CO 0.57 -2.35 0.10 0.14 1.05 0.00 0.00 175.02 174.53 3ieo s VAL 242 N 5.99 0.11 -1.43 10.11 -7.23 -1.26 -4.41 120.40 122.28 3ieo s VAL 242 Ca 0.47 -0.93 -0.09 0.00 -1.81 0.00 0.00 61.98 59.62 3ieo s VAL 242 Cb -0.04 -0.67 0.02 0.00 0.56 0.00 0.00 36.38 36.25 3ieo s VAL 242 CO -0.00 -0.51 1.03 0.47 -0.31 0.00 0.00 175.10 175.78 3ieo n ASP 243 N 1.08 -6.05 -2.28 4.85 10.43 -0.41 -4.86 116.55 119.31 3ieo n ASP 243 Ca -0.21 -0.52 -0.21 0.00 2.57 0.00 0.00 54.79 56.42 3ieo n ASP 243 Cb 0.57 -4.80 -0.08 0.00 1.84 0.00 0.00 41.12 38.66 3ieo n ASP 243 CO 0.00 0.00 0.00 -0.46 -1.07 0.00 0.00 177.20 175.67 3ieo n ASN 244 N -2.88 6.12 -4.23 -2.24 0.23 -1.15 -4.89 115.26 106.22 3ieo n ASN 244 Ca -0.01 -2.98 -0.25 0.00 -0.53 0.00 0.00 54.58 50.81 3ieo n ASN 244 Cb 0.57 -1.26 -0.14 0.00 -2.08 0.00 0.00 39.78 36.86 3ieo n ASN 244 CO 0.00 0.00 0.00 -1.66 -0.93 0.00 0.00 177.26 174.67 3ieo s TRP 245 N -0.97 1.72 -0.07 -2.53 1.48 -1.26 -4.51 118.94 112.81 3ieo s TRP 245 Ca 0.57 -0.37 -0.15 0.00 -1.06 0.00 0.00 56.10 55.10 3ieo s TRP 245 Cb 0.34 -1.03 -0.05 0.00 -1.16 0.00 0.00 33.47 31.57 3ieo s TRP 245 CO -0.14 0.07 0.38 0.50 -4.06 0.00 0.00 176.95 173.70 3ieo s ARG 246 N -1.11 4.04 0.86 3.25 3.52 -1.26 -4.99 118.95 123.25 3ieo s ARG 246 Ca 0.07 0.31 -0.12 0.00 -0.13 0.00 0.00 55.73 55.86 3ieo s ARG 246 Cb -0.09 -3.30 0.11 0.00 -1.56 0.00 0.00 34.95 30.11 3ieo s ARG 246 CO 0.01 0.50 1.12 -1.25 -0.81 0.00 0.00 175.30 174.87 3ieo s PRO 247 N -0.41 1.58 0.53 5.12 0.04 -1.26 -4.63 135.00 135.97 3ieo s PRO 247 Ca 0.22 0.48 -0.22 0.00 0.04 0.00 0.00 61.00 61.52 3ieo s PRO 247 Cb -0.15 -1.87 -0.05 0.00 0.04 0.00 0.00 34.50 32.46 3ieo s PRO 247 CO 0.10 -1.93 1.33 0.00 0.04 0.00 0.00 177.00 176.53 3ieo s ALA 248 N -3.20 2.87 0.28 8.56 0.00 -1.26 -4.34 121.76 124.67 3ieo s ALA 248 Ca 0.62 1.27 0.12 0.00 0.00 0.00 0.00 51.96 53.97 3ieo s ALA 248 Cb -0.15 -3.54 -0.05 0.00 0.00 0.00 0.00 23.12 19.39 3ieo s ALA 248 CO 0.54 -1.24 -0.18 -0.65 0.00 0.00 0.00 175.76 174.22 3ieo s GLN 249 N -2.85 1.73 0.15 0.00 -1.52 0.09 -4.95 119.66 112.31 3ieo s GLN 249 Ca 0.70 -1.75 -0.34 0.00 -1.95 0.00 0.00 55.36 52.01 3ieo s GLN 249 Cb -0.39 -1.80 -0.15 0.00 -0.22 0.00 0.00 33.01 30.46 3ieo s GLN 249 CO 0.46 0.33 1.44 -2.30 -0.25 0.00 0.00 175.29 174.97 3ieo n PRO 250 N -0.64 1.71 -0.06 2.91 -0.02 -1.26 -4.58 135.00 133.06 3ieo n PRO 250 Ca -0.05 0.62 -0.12 0.00 -2.02 0.00 0.00 63.50 61.92 3ieo n PRO 250 Cb 0.60 -2.31 0.00 0.00 -0.02 0.00 0.00 33.50 31.78 3ieo n PRO 250 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 3ieo h LEU 251 N 5.04 0.85 -1.88 2.45 5.85 -1.94 -3.43 115.31 122.25 3ieo h LEU 251 Ca -0.46 -0.43 -0.45 0.00 0.84 0.00 0.00 57.88 57.38 3ieo h LEU 251 Cb 1.29 -0.24 0.01 0.00 0.37 0.00 0.00 40.66 42.09 3ieo h LEU 251 CO 0.82 1.20 -0.86 0.29 -0.34 0.00 0.00 178.44 179.55 3ieo n LYS 252 N -4.01 -4.11 -0.98 1.25 5.02 -1.26 -2.39 118.16 111.68 3ieo n LYS 252 Ca -0.03 0.53 0.00 0.00 -2.02 0.00 0.00 58.31 56.78 3ieo n LYS 252 Cb 0.59 -4.88 0.00 0.00 -0.02 0.00 0.00 35.03 30.72 3ieo n LYS 252 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 3ieo n ASN 253 N -3.02 -2.66 -4.80 4.39 4.05 -1.26 -5.02 115.26 106.95 3ieo n ASN 253 Ca -0.30 0.00 -0.31 0.00 0.45 0.00 0.00 54.58 54.42 3ieo n ASN 253 Cb 0.68 -0.88 0.06 0.00 1.23 0.00 0.00 39.78 40.87 3ieo n ASN 253 CO 0.00 0.00 0.00 -0.13 -3.05 0.00 0.00 177.26 174.08 3ieo s ARG 254 N -0.31 2.76 -0.10 1.20 0.52 -1.00 -5.06 118.95 116.97 3ieo s ARG 254 Ca 0.00 1.10 0.02 0.00 -0.52 0.00 0.00 55.73 56.33 3ieo s ARG 254 Cb 0.00 -1.96 0.01 0.00 0.52 0.00 0.00 34.95 33.52 3ieo s ARG 254 CO 0.00 -1.25 -0.17 -1.14 0.02 0.00 0.00 175.30 172.76 3ieo s GLN 255 N -4.77 2.37 -0.20 3.54 0.74 -1.26 -5.03 119.66 115.05 3ieo s GLN 255 Ca 0.61 -0.63 -0.18 0.00 0.05 0.00 0.00 55.36 55.21 3ieo s GLN 255 Cb -0.16 -1.92 -0.03 0.00 1.10 0.00 0.00 33.01 31.99 3ieo s GLN 255 CO 0.51 0.02 0.50 0.42 -0.55 0.00 0.00 175.29 176.19 3ieo s ILE 256 N 0.75 5.12 -0.04 -2.34 1.01 -1.26 -4.69 121.20 119.75 3ieo s ILE 256 Ca -0.11 0.92 -0.09 0.00 0.00 0.00 0.00 60.65 61.37 3ieo s ILE 256 Cb -0.16 -3.83 -0.05 0.00 0.01 0.00 0.00 42.46 38.44 3ieo s ILE 256 CO 0.02 0.19 0.26 -0.54 0.00 0.00 0.00 174.94 174.87 3ieo s LYS 257 N 1.57 3.62 0.04 2.79 1.02 -0.61 -1.91 119.74 126.27 3ieo s LYS 257 Ca 0.23 0.04 -0.13 0.00 0.02 0.00 0.00 55.97 56.13 3ieo s LYS 257 Cb -0.15 -3.16 -0.06 0.00 -0.52 0.00 0.00 37.83 33.94 3ieo s LYS 257 CO 0.09 0.71 0.42 0.00 -0.92 0.00 0.00 175.35 175.66 3ieo s ALA 258 N -1.14 3.69 -1.70 5.17 0.00 0.15 -1.10 121.76 126.84 3ieo s ALA 258 Ca 0.22 -0.25 0.30 0.00 0.00 0.00 0.00 51.96 52.23 3ieo s ALA 258 Cb -0.14 -2.37 1.43 0.00 0.00 0.00 0.00 23.12 22.04 3ieo s ALA 258 CO 0.11 0.50 1.98 -1.13 0.00 0.00 0.00 175.76 177.22 3ieo n SER 259 N 1.44 0.30 0.00 0.00 3.41 -0.52 -1.59 113.62 116.66 3ieo n SER 259 Ca -0.11 -0.58 0.00 0.00 -0.26 0.00 0.00 58.87 57.91 3ieo n SER 259 Cb 0.52 -0.11 0.00 0.00 -0.26 0.00 0.00 64.21 64.36 3ieo n SER 259 CO 0.00 0.00 0.00 2.22 -0.16 0.00 0.00 175.04 177.10