#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2iua s SER 2 N 0.00 0.49 0.62 3.17 0.15 -1.26 -5.01 113.70 111.86 2iua s SER 2 Ca 0.00 0.44 0.00 0.00 0.70 0.00 0.00 55.95 57.09 2iua s SER 2 Cb 0.00 0.71 0.00 0.00 -1.71 0.00 0.00 66.02 65.02 2iua s SER 2 CO 0.00 -0.26 0.96 1.67 1.20 0.00 0.00 173.24 176.81 2iua n GLN 3 N 5.35 0.03 -3.72 5.44 7.27 -1.26 -4.49 117.38 126.00 2iua n GLN 3 Ca -0.06 0.89 -0.14 0.00 0.07 0.00 0.00 57.00 57.77 2iua n GLN 3 Cb 0.50 -2.50 -0.09 0.00 2.41 0.00 0.00 30.24 30.55 2iua n GLN 3 CO 0.00 0.00 0.00 -1.12 0.07 0.00 0.00 177.06 176.01 2iua s SER 4 N -2.93 -0.39 0.02 1.69 0.01 -1.26 -5.14 113.70 105.70 2iua s SER 4 Ca 0.00 0.64 0.07 0.00 1.31 0.00 0.00 55.95 57.97 2iua s SER 4 Cb 0.00 0.70 -0.02 0.00 0.21 0.00 0.00 66.02 66.90 2iua s SER 4 CO 0.00 -0.26 -0.22 -0.89 0.41 0.00 0.00 173.24 172.28 2iua s THR 5 N -0.28 1.75 0.11 1.44 2.01 -1.26 -4.42 115.64 114.99 2iua s THR 5 Ca -0.04 -1.12 0.03 0.00 0.31 0.00 0.00 61.69 60.87 2iua s THR 5 Cb -0.03 -1.49 -0.04 0.00 0.01 0.00 0.00 72.50 70.94 2iua s THR 5 CO 0.02 0.34 -0.08 -0.31 -0.69 0.00 0.00 174.62 173.90 2iua s TYR 6 N -0.68 1.01 0.16 4.92 1.51 -0.22 -4.96 117.35 119.08 2iua s TYR 6 Ca 0.08 -0.78 -0.03 0.00 -1.01 0.00 0.00 57.07 55.34 2iua s TYR 6 Cb -0.09 -0.55 -0.05 0.00 -0.11 0.00 0.00 41.96 41.16 2iua s TYR 6 CO 0.01 -0.05 0.36 -1.54 -1.11 0.00 0.00 175.55 173.22 2iua s SER 7 N -2.82 6.43 0.23 2.29 1.04 -1.26 -0.68 113.70 118.94 2iua s SER 7 Ca 0.10 0.48 -0.13 0.00 0.48 0.00 0.00 55.95 56.87 2iua s SER 7 Cb 0.01 -2.04 0.28 0.00 0.10 0.00 0.00 66.02 64.37 2iua s SER 7 CO -0.02 0.03 1.60 0.25 0.98 0.00 0.00 173.24 176.07 2iua h LEU 8 N 2.53 -0.84 -0.73 2.42 5.85 -0.81 0.12 115.31 123.84 2iua h LEU 8 Ca -0.47 0.24 -0.12 0.00 0.84 0.00 0.00 57.88 58.37 2iua h LEU 8 Cb 1.17 0.51 -0.01 0.00 0.37 0.00 0.00 40.66 42.70 2iua h LEU 8 CO 0.71 -0.27 -0.28 -0.08 -0.34 0.00 0.00 178.44 178.18 2iua h GLU 9 N -0.03 0.66 -0.50 1.25 4.81 -1.67 0.11 114.58 119.22 2iua h GLU 9 Ca 0.34 -0.28 -0.02 0.00 -0.13 0.00 0.00 59.36 59.27 2iua h GLU 9 Cb 0.56 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.90 2iua h GLU 9 CO -0.79 0.87 0.24 0.37 -0.73 0.00 0.00 179.01 178.97 2iua h GLN 10 N 0.57 0.73 -0.28 1.92 4.15 -1.11 -2.21 115.11 118.87 2iua h GLN 10 Ca 0.07 -0.11 -0.06 0.00 0.77 0.00 0.00 58.65 59.33 2iua h GLN 10 Cb 0.77 -0.13 -0.01 0.00 0.21 0.00 0.00 27.48 28.32 2iua h GLN 10 CO 0.06 0.61 -0.04 1.25 -1.93 0.00 0.00 178.83 178.78 2iua h LEU 11 N 0.67 0.52 -0.72 -2.39 5.85 -0.55 -1.51 115.31 117.19 2iua h LEU 11 Ca 0.17 -0.35 0.16 0.00 0.84 0.00 0.00 57.88 58.71 2iua h LEU 11 Cb 0.13 -0.14 -0.12 0.00 0.37 0.00 0.00 40.66 40.90 2iua h LEU 11 CO -0.02 0.75 0.07 0.00 -0.34 0.00 0.00 178.44 178.90 2iua h ALA 12 N 0.80 0.82 -0.29 1.25 0.00 -0.74 0.33 119.26 121.43 2iua h ALA 12 Ca 0.07 0.20 -0.13 0.00 0.00 0.00 0.00 54.91 55.05 2iua h ALA 12 Cb 0.50 0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.61 2iua h ALA 12 CO 0.02 -0.39 -0.37 -0.44 0.00 0.00 0.00 179.25 178.07 2iua h ASP 13 N 0.17 0.70 -0.23 0.00 3.32 -1.10 -0.41 116.42 118.86 2iua h ASP 13 Ca 0.40 -0.30 -0.01 0.00 0.02 0.00 0.00 57.03 57.13 2iua h ASP 13 Cb 0.69 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 40.03 2iua h ASP 13 CO -0.58 1.00 0.09 0.15 -1.72 0.00 0.00 179.24 178.18 2iua h PHE 14 N 0.55 0.35 0.00 4.55 3.04 -0.21 -2.98 116.94 122.25 2iua h PHE 14 Ca 0.05 -0.03 0.00 0.00 3.98 0.00 0.00 57.97 61.98 2iua h PHE 14 Cb 0.89 -0.11 0.00 0.00 2.56 0.00 0.00 35.95 39.29 2iua h PHE 14 CO 0.04 0.38 0.00 -0.07 -2.02 0.00 0.00 178.31 176.64 2iua h LEU 15 N 0.22 0.00 -1.79 0.59 4.07 -0.12 -3.47 115.31 114.81 2iua h LEU 15 Ca 0.08 0.00 -0.28 0.00 0.08 0.00 0.00 57.88 57.76 2iua h LEU 15 Cb 0.18 0.00 0.15 0.00 1.08 0.00 0.00 40.66 42.07 2iua h LEU 15 CO -0.01 0.00 -0.68 0.29 -1.08 0.00 0.00 178.44 176.96 2iua n LYS 16 N -2.59 -5.34 -4.17 1.13 5.02 -0.24 -5.04 118.16 106.93 2iua n LYS 16 Ca 0.02 0.74 -0.16 0.00 -2.02 0.00 0.00 58.31 56.89 2iua n LYS 16 Cb 0.28 -5.42 -0.14 0.00 -0.02 0.00 0.00 35.03 29.73 2iua n LYS 16 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2iua s VAL 17 N -3.32 0.47 0.70 -0.18 1.01 -0.76 -5.06 120.40 113.27 2iua s VAL 17 Ca 0.05 -0.37 -0.14 0.00 0.00 0.00 0.00 61.98 61.52 2iua s VAL 17 Cb -0.01 -0.42 0.02 0.00 0.00 0.00 0.00 36.38 35.98 2iua s VAL 17 CO 0.64 0.05 1.12 -0.70 0.00 0.00 0.00 175.10 176.21 2iua s GLU 18 N -0.35 2.50 0.12 2.72 2.12 -1.19 -4.47 118.70 120.15 2iua s GLU 18 Ca 0.00 1.41 0.04 0.00 0.36 0.00 0.00 54.97 56.79 2iua s GLU 18 Cb -0.03 -1.91 -0.04 0.00 0.26 0.00 0.00 34.13 32.41 2iua s GLU 18 CO -0.00 -1.49 -0.10 -0.59 -0.54 0.00 0.00 175.26 172.54 2iua s PHE 19 N -2.41 1.12 -0.12 5.30 -0.12 -1.26 -1.67 117.98 118.82 2iua s PHE 19 Ca 0.67 -0.73 -0.04 0.00 -0.05 0.00 0.00 56.93 56.78 2iua s PHE 19 Cb -0.21 -0.60 0.06 0.00 -0.63 0.00 0.00 43.02 41.64 2iua s PHE 19 CO 0.46 0.01 0.16 -0.65 -0.05 0.00 0.00 175.22 175.15 2iua s GLN 20 N -3.31 0.07 0.00 1.99 -1.52 -0.68 -4.98 119.66 111.22 2iua s GLN 20 Ca 0.11 0.37 0.00 0.00 -1.95 0.00 0.00 55.36 53.89 2iua s GLN 20 Cb 0.00 -0.74 0.00 0.00 -0.22 0.00 0.00 33.01 32.05 2iua s GLN 20 CO -0.00 -0.45 0.00 0.41 -0.25 0.00 0.00 175.29 175.00 2iua n GLY 21 N 5.32 0.35 3.29 3.09 0.00 -1.26 -0.29 105.19 115.69 2iua n GLY 21 Ca -0.05 -1.23 -0.41 0.00 0.00 0.00 0.00 46.02 44.33 2iua n GLY 21 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2iua s ASN 22 N -4.00 5.72 0.60 1.61 2.47 -1.26 -4.97 114.94 115.12 2iua s ASN 22 Ca 0.00 -1.44 0.31 0.00 0.42 0.00 0.00 52.86 52.15 2iua s ASN 22 Cb 0.00 -2.02 1.68 0.00 -1.45 0.00 0.00 41.25 39.46 2iua s ASN 22 CO 0.00 -0.54 1.93 1.23 -3.72 0.00 0.00 177.10 176.00 2iua h GLY 23 N 8.46 0.00 -0.02 1.21 0.00 -1.96 -1.61 103.07 109.15 2iua h GLY 23 Ca -0.24 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.09 2iua h GLY 23 CO 0.77 0.00 -0.46 0.00 0.00 0.00 0.00 176.54 176.85 2iua n ALA 24 N -1.89 3.52 -1.69 3.60 0.00 -1.26 -1.90 120.51 120.90 2iua n ALA 24 Ca -0.02 -0.49 -0.44 0.00 0.00 0.00 0.00 53.44 52.49 2iua n ALA 24 Cb 0.27 -0.99 -0.02 0.00 0.00 0.00 0.00 19.45 18.72 2iua n ALA 24 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 2iua n THR 25 N -0.72 1.19 -3.71 0.00 -1.04 -0.61 -4.70 114.28 104.69 2iua n THR 25 Ca 0.09 -0.30 -0.35 0.00 -2.04 0.00 0.00 64.05 61.45 2iua n THR 25 Cb 0.38 -1.58 -0.05 0.00 -1.82 0.00 0.00 70.33 67.26 2iua n THR 25 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 2iua s LEU 26 N -0.24 4.38 -0.06 -4.42 1.43 -1.26 -0.78 118.68 117.72 2iua s LEU 26 Ca 0.65 0.63 -0.03 0.00 -1.03 0.00 0.00 54.13 54.35 2iua s LEU 26 Cb -0.61 -2.67 0.04 0.00 0.03 0.00 0.00 46.19 42.99 2iua s LEU 26 CO 0.52 0.26 0.09 -0.76 0.23 0.00 0.00 176.35 176.69 2iua s LEU 27 N -1.66 0.09 -0.06 1.79 1.43 0.15 -4.59 118.68 115.83 2iua s LEU 27 Ca 0.27 0.11 0.20 0.00 -1.03 0.00 0.00 54.13 53.68 2iua s LEU 27 Cb -0.14 -0.02 0.39 0.00 0.03 0.00 0.00 46.19 46.45 2iua s LEU 27 CO 0.15 -0.26 1.17 -1.54 0.23 0.00 0.00 176.35 176.10 2iua n SER 28 N 5.31 1.14 0.00 2.29 3.41 -0.28 -1.06 113.62 124.43 2iua n SER 28 Ca -0.04 -2.51 0.00 0.00 -0.26 0.00 0.00 58.87 56.06 2iua n SER 28 Cb 0.50 -0.35 0.00 0.00 -0.26 0.00 0.00 64.21 64.10 2iua n SER 28 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2iua n GLY 29 N -0.01 -1.59 3.29 5.00 0.00 -1.20 -4.87 105.19 105.82 2iua n GLY 29 Ca 0.09 -1.06 -0.25 0.00 0.00 0.00 0.00 46.02 44.79 2iua n GLY 29 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2iua s VAL 30 N -2.43 1.80 0.10 1.61 -7.23 -1.26 -0.38 120.40 112.61 2iua s VAL 30 Ca 0.00 -1.46 -0.19 0.00 -1.81 0.00 0.00 61.98 58.52 2iua s VAL 30 Cb 0.00 -1.60 0.04 0.00 0.56 0.00 0.00 36.38 35.38 2iua s VAL 30 CO 0.00 0.06 0.45 -0.70 -0.31 0.00 0.00 175.10 174.60 2iua s GLU 31 N -1.68 1.07 0.46 4.82 2.56 -0.39 -4.83 118.70 120.71 2iua s GLU 31 Ca 0.08 -0.53 -0.24 0.00 0.00 0.00 0.00 54.97 54.28 2iua s GLU 31 Cb -0.10 0.48 -0.07 0.00 2.00 0.00 0.00 34.13 36.44 2iua s GLU 31 CO 0.04 -0.41 1.24 -1.21 -0.56 0.00 0.00 175.26 174.35 2iua s GLU 32 N -3.33 3.70 0.54 4.30 0.41 -1.26 -4.31 118.70 118.75 2iua s GLU 32 Ca -0.00 1.96 0.26 0.00 -0.41 0.00 0.00 54.97 56.78 2iua s GLU 32 Cb 0.01 -2.48 1.42 0.00 -1.78 0.00 0.00 34.13 31.30 2iua s GLU 32 CO -0.09 -0.65 1.99 0.97 -0.49 0.00 0.00 175.26 177.00 2iua h ILE 33 N 1.96 0.69 0.00 -1.63 2.10 -1.95 -0.14 117.51 118.54 2iua h ILE 33 Ca -0.50 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.44 2iua h ILE 33 Cb 1.26 0.73 0.00 0.00 -1.09 0.00 0.00 36.82 37.72 2iua h ILE 33 CO 0.60 0.00 -0.39 -1.84 -1.08 0.00 0.00 178.15 175.44 2iua n GLU 34 N -4.30 0.03 0.00 2.19 0.00 -1.26 -3.97 120.64 113.33 2iua n GLU 34 Ca 0.09 0.01 0.02 0.00 0.00 0.00 0.00 57.16 57.29 2iua n GLU 34 Cb 0.60 -1.52 -0.02 0.00 0.00 0.00 0.00 31.44 30.51 2iua n GLU 34 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.13 177.52 2iua n GLU 35 N -1.57 4.62 -1.82 3.44 1.02 -0.19 -5.03 120.64 121.11 2iua n GLU 35 Ca 0.06 -0.13 -0.40 0.00 -0.02 0.00 0.00 57.16 56.67 2iua n GLU 35 Cb 0.35 -0.77 0.02 0.00 -0.02 0.00 0.00 31.44 31.02 2iua n GLU 35 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2iua s ALA 36 N -1.23 3.23 0.48 0.62 0.00 -0.45 -4.92 121.76 119.49 2iua s ALA 36 Ca 0.02 1.44 0.05 0.00 0.00 0.00 0.00 51.96 53.48 2iua s ALA 36 Cb 0.03 -3.58 -0.01 0.00 0.00 0.00 0.00 23.12 19.56 2iua s ALA 36 CO 0.16 -1.17 0.23 0.15 0.00 0.00 0.00 175.76 175.12 2iua s LYS 37 N -2.45 2.24 0.35 0.00 -0.14 -1.19 -4.24 119.74 114.31 2iua s LYS 37 Ca 0.61 -2.01 0.16 0.00 -1.36 0.00 0.00 55.97 53.37 2iua s LYS 37 Cb -0.43 -1.94 1.11 0.00 -1.68 0.00 0.00 37.83 34.89 2iua s LYS 37 CO 0.55 -0.34 1.67 1.15 -0.76 0.00 0.00 175.35 177.62 2iua h THR 38 N 1.17 0.31 0.00 2.17 2.02 -1.74 0.29 112.91 117.12 2iua h THR 38 Ca -0.41 -0.11 0.00 0.00 0.77 0.00 0.00 66.41 66.66 2iua h THR 38 Cb 1.28 -0.04 0.00 0.00 -1.74 0.00 0.00 68.15 67.65 2iua h THR 38 CO 0.66 0.06 0.00 0.00 0.37 0.00 0.00 175.52 176.61 2iua n ALA 39 N -2.32 2.14 -2.69 6.16 0.00 -1.26 -1.44 120.51 121.09 2iua n ALA 39 Ca 0.32 -0.09 -0.34 0.00 0.00 0.00 0.00 53.44 53.32 2iua n ALA 39 Cb 1.00 -1.39 -0.05 0.00 0.00 0.00 0.00 19.45 19.01 2iua n ALA 39 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 2iua s HIS 40 N -2.83 3.56 -0.10 0.00 3.76 0.10 -1.12 115.29 118.67 2iua s HIS 40 Ca 0.16 0.63 -0.10 0.00 -0.15 0.00 0.00 55.06 55.61 2iua s HIS 40 Cb 0.16 -2.04 -0.05 0.00 1.11 0.00 0.00 32.58 31.76 2iua s HIS 40 CO 0.40 0.55 0.22 0.42 -0.85 0.00 0.00 174.74 175.49 2iua s ILE 41 N -1.39 5.36 0.28 0.60 1.01 0.49 -1.84 121.20 125.71 2iua s ILE 41 Ca 0.32 0.40 -0.02 0.00 0.00 0.00 0.00 60.65 61.34 2iua s ILE 41 Cb -0.13 -3.50 -0.02 0.00 0.01 0.00 0.00 42.46 38.82 2iua s ILE 41 CO 0.18 0.58 0.34 0.28 0.00 0.00 0.00 174.94 176.32 2iua s THR 42 N -0.85 0.00 0.16 2.92 -1.32 -0.62 -1.26 115.64 114.67 2iua s THR 42 Ca 0.17 -1.76 0.07 0.00 -1.21 0.00 0.00 61.69 58.97 2iua s THR 42 Cb -0.13 -2.49 -0.04 0.00 -1.51 0.00 0.00 72.50 68.33 2iua s THR 42 CO 0.06 0.00 -0.15 0.72 -2.21 0.00 0.00 174.62 173.04 2iua s PHE 43 N -3.64 1.63 -0.24 9.09 -0.12 -1.26 0.70 117.98 124.15 2iua s PHE 43 Ca 0.33 -0.54 -0.18 0.00 -0.05 0.00 0.00 56.93 56.49 2iua s PHE 43 Cb 0.02 -0.81 -0.03 0.00 -0.63 0.00 0.00 43.02 41.58 2iua s PHE 43 CO 0.17 0.27 0.52 -1.17 -0.05 0.00 0.00 175.22 174.97 2iua s LEU 44 N -2.85 4.09 0.00 -1.99 0.20 0.12 -4.62 118.68 113.63 2iua s LEU 44 Ca 0.16 0.59 0.00 0.00 0.69 0.00 0.00 54.13 55.57 2iua s LEU 44 Cb -0.03 -2.69 0.00 0.00 -0.43 0.00 0.00 46.19 43.03 2iua s LEU 44 CO 0.05 -0.25 0.44 -0.67 -0.29 0.00 0.00 176.35 175.63 2iua n ASP 45 N 5.27 0.00 0.00 3.68 -0.08 -1.26 -4.82 116.55 119.33 2iua n ASP 45 Ca -0.04 0.44 0.00 0.00 -1.51 0.00 0.00 54.79 53.68 2iua n ASP 45 Cb 0.50 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.96 2iua n ASP 45 CO 0.00 0.00 0.00 -3.20 0.12 0.00 0.00 177.20 174.12 2iua n ASN 46 N -0.85 0.00 -0.04 1.67 5.15 -1.26 -4.86 115.26 115.07 2iua n ASN 46 Ca 0.00 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.98 2iua n ASN 46 Cb 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.25 2iua n ASN 46 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 2iua n GLU 47 N 0.00 3.37 -2.48 1.20 1.02 -1.26 -5.05 120.64 117.44 2iua n GLU 47 Ca 0.00 0.00 -0.01 0.00 -0.02 0.00 0.00 57.16 57.13 2iua n GLU 47 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.42 2iua n GLU 47 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 2iua n LYS 48 N 0.00 -2.63 -0.76 3.49 4.76 -1.26 -4.98 118.16 116.79 2iua n LYS 48 Ca 0.00 2.23 -0.33 0.00 -2.87 0.00 0.00 58.31 57.34 2iua n LYS 48 Cb 0.00 -4.53 0.14 0.00 -1.84 0.00 0.00 35.03 28.79 2iua n LYS 48 CO 0.00 0.00 0.00 0.66 -1.37 0.00 0.00 177.40 176.69 2iua n TYR 49 N 0.40 -1.63 -0.43 2.13 4.01 -1.26 -4.78 117.16 115.60 2iua n TYR 49 Ca 0.02 0.19 0.40 0.00 -0.16 0.00 0.00 57.90 58.35 2iua n TYR 49 Cb 0.06 -1.66 0.76 0.00 -0.31 0.00 0.00 39.34 38.19 2iua n TYR 49 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2iua h ALA 50 N -1.72 3.29 -0.49 -0.72 0.00 -2.01 -1.53 119.26 116.08 2iua h ALA 50 Ca -0.47 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.33 2iua h ALA 50 Cb 1.32 0.11 -0.02 0.00 0.00 0.00 0.00 17.79 19.19 2iua h ALA 50 CO 0.35 -1.70 0.05 0.87 0.00 0.00 0.00 179.25 178.82 2iua h LYS 51 N 0.02 0.78 -0.97 0.00 1.79 -2.00 -1.41 116.57 114.77 2iua h LYS 51 Ca 0.68 -0.18 0.02 0.00 -2.18 0.00 0.00 60.65 58.98 2iua h LYS 51 Cb 2.67 -0.10 -0.05 0.00 -1.58 0.00 0.00 32.23 33.16 2iua h LYS 51 CO -0.03 0.75 0.64 0.45 -1.08 0.00 0.00 179.45 180.18 2iua h HIS 52 N 0.74 1.20 0.02 -1.35 3.86 -1.58 -2.50 115.15 115.54 2iua h HIS 52 Ca 0.15 0.03 -0.00 0.00 -1.16 0.00 0.00 60.37 59.39 2iua h HIS 52 Cb 0.38 -0.41 0.00 0.00 1.06 0.00 0.00 27.41 28.44 2iua h HIS 52 CO 0.02 0.74 -0.01 1.25 0.86 0.00 0.00 177.93 180.79 2iua h LEU 53 N 1.28 -0.02 0.48 2.43 5.85 -1.54 -3.04 115.31 120.74 2iua h LEU 53 Ca 0.37 -0.52 -0.02 0.00 0.84 0.00 0.00 57.88 58.54 2iua h LEU 53 Cb -0.09 0.00 0.00 0.00 0.37 0.00 0.00 40.66 40.95 2iua h LEU 53 CO -0.09 0.52 -0.23 0.50 -0.34 0.00 0.00 178.44 178.80 2iua h LYS 54 N -0.56 -0.62 -0.02 1.25 3.64 -1.21 -2.74 116.57 116.31 2iua h LYS 54 Ca -0.00 0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.42 2iua h LYS 54 Cb 0.54 0.14 0.00 0.00 -0.41 0.00 0.00 32.23 32.50 2iua h LYS 54 CO 0.00 -0.41 0.00 -1.13 -2.27 0.00 0.00 179.45 175.64 2iua n SER 55 N -5.37 0.12 -4.70 4.20 3.41 -0.95 -4.76 113.62 105.57 2iua n SER 55 Ca -0.12 -1.76 -0.42 0.00 -0.26 0.00 0.00 58.87 56.31 2iua n SER 55 Cb 0.27 -0.01 -0.03 0.00 -0.26 0.00 0.00 64.21 64.18 2iua n SER 55 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 2iua s SER 56 N -1.25 7.05 -0.93 4.04 0.15 -1.04 -4.97 113.70 116.75 2iua s SER 56 Ca 0.13 1.94 -0.02 0.00 0.70 0.00 0.00 55.95 58.70 2iua s SER 56 Cb 0.06 -2.57 0.26 0.00 -1.71 0.00 0.00 66.02 62.06 2iua s SER 56 CO 0.10 -0.53 1.00 -0.62 1.20 0.00 0.00 173.24 174.39 2iua n GLU 57 N 4.52 3.20 -4.62 5.44 1.02 -1.26 -5.02 120.64 123.92 2iua n GLU 57 Ca 0.10 -4.53 -0.22 0.00 -0.02 0.00 0.00 57.16 52.49 2iua n GLU 57 Cb 0.46 -2.43 -0.15 0.00 -0.02 0.00 0.00 31.44 29.30 2iua n GLU 57 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2iua s ALA 58 N -1.90 1.15 0.26 0.62 0.00 -1.26 -2.05 121.76 118.57 2iua s ALA 58 Ca 0.31 -0.58 -0.03 0.00 0.00 0.00 0.00 51.96 51.67 2iua s ALA 58 Cb -0.01 -0.31 0.45 0.00 0.00 0.00 0.00 23.12 23.26 2iua s ALA 58 CO -0.05 0.27 1.81 0.78 0.00 0.00 0.00 175.76 178.57 2iua h GLY 59 N 5.88 1.38 -4.53 0.00 0.00 -0.47 -3.43 103.07 101.89 2iua h GLY 59 Ca -0.34 -0.33 -0.13 0.00 0.00 0.00 0.00 47.33 46.53 2iua h GLY 59 CO 0.49 0.11 -0.44 0.00 0.00 0.00 0.00 176.54 176.70 2iua s ALA 60 N -6.00 -0.39 -0.17 3.60 0.00 -0.98 -4.39 121.76 113.42 2iua s ALA 60 Ca -0.12 -0.11 -0.04 0.00 0.00 0.00 0.00 51.96 51.69 2iua s ALA 60 Cb 0.20 0.14 0.06 0.00 0.00 0.00 0.00 23.12 23.52 2iua s ALA 60 CO 0.79 -0.25 0.07 0.42 0.00 0.00 0.00 175.76 176.78 2iua s ILE 61 N -1.65 0.16 -0.05 0.00 1.01 -0.35 -1.59 121.20 118.73 2iua s ILE 61 Ca -0.12 -0.29 -0.30 0.00 0.00 0.00 0.00 60.65 59.94 2iua s ILE 61 Cb -0.06 -0.73 -0.04 0.00 0.01 0.00 0.00 42.46 41.64 2iua s ILE 61 CO 0.01 -0.22 1.22 -0.63 0.00 0.00 0.00 174.94 175.32 2iua s ILE 62 N 2.03 4.19 0.05 2.92 1.01 0.22 -1.20 121.20 130.42 2iua s ILE 62 Ca 0.01 1.52 -0.02 0.00 0.00 0.00 0.00 60.65 62.16 2iua s ILE 62 Cb -0.16 -3.98 -0.03 0.00 0.01 0.00 0.00 42.46 38.30 2iua s ILE 62 CO -0.08 -0.00 -0.00 -0.51 0.00 0.00 0.00 174.94 174.34 2iua s ILE 63 N 2.23 0.20 0.41 2.92 2.07 -0.77 -0.71 121.20 127.56 2iua s ILE 63 Ca 0.57 -1.61 0.03 0.00 -1.41 0.00 0.00 60.65 58.23 2iua s ILE 63 Cb -0.25 -1.33 -0.00 0.00 0.13 0.00 0.00 42.46 41.01 2iua s ILE 63 CO 0.22 -0.89 0.60 -0.94 -1.91 0.00 0.00 174.94 172.02 2iua s SER 64 N -2.70 5.81 0.14 4.50 1.04 -1.26 -1.04 113.70 120.18 2iua s SER 64 Ca 0.04 0.02 -0.19 0.00 0.48 0.00 0.00 55.95 56.29 2iua s SER 64 Cb 0.05 -1.28 -0.00 0.00 0.10 0.00 0.00 66.02 64.89 2iua s SER 64 CO -0.09 -0.65 1.74 0.03 0.98 0.00 0.00 173.24 175.25 2iua h ARG 65 N 0.57 0.14 0.33 4.02 3.08 -1.64 -0.41 114.38 120.47 2iua h ARG 65 Ca -0.45 -0.01 -0.00 0.00 0.07 0.00 0.00 59.98 59.59 2iua h ARG 65 Cb 1.26 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 31.26 2iua h ARG 65 CO 0.54 0.10 -0.32 1.79 -1.07 0.00 0.00 179.97 181.01 2iua h THR 66 N 0.15 0.33 -1.00 2.04 1.35 -1.95 -1.89 112.91 111.94 2iua h THR 66 Ca 0.11 0.00 0.12 0.00 -0.55 0.00 0.00 66.41 66.09 2iua h THR 66 Cb 0.11 0.33 -0.08 0.00 -1.73 0.00 0.00 68.15 66.78 2iua h THR 66 CO -0.15 0.00 0.63 1.56 -0.25 0.00 0.00 175.52 177.31 2iua h GLN 67 N -0.67 0.97 0.21 4.72 4.20 -1.93 -2.42 115.11 120.19 2iua h GLN 67 Ca -0.02 -0.06 0.00 0.00 0.06 0.00 0.00 58.65 58.63 2iua h GLN 67 Cb 0.61 -0.22 -0.01 0.00 0.30 0.00 0.00 27.48 28.16 2iua h GLN 67 CO -0.06 0.64 -0.18 0.35 -0.67 0.00 0.00 178.83 178.92 2iua h PHE 68 N 1.00 -0.46 -1.34 2.96 3.04 -0.43 -1.79 116.94 119.92 2iua h PHE 68 Ca 0.50 0.00 0.44 0.00 3.98 0.00 0.00 57.97 62.88 2iua h PHE 68 Cb 0.49 0.18 -0.11 0.00 2.56 0.00 0.00 35.95 39.07 2iua h PHE 68 CO -0.00 -0.27 0.90 1.04 -2.02 0.00 0.00 178.31 177.96 2iua n GLN 69 N -5.30 -0.02 0.09 1.11 1.13 -0.77 0.56 117.38 114.18 2iua n GLN 69 Ca -0.08 1.05 0.07 0.00 -1.94 0.00 0.00 57.00 56.09 2iua n GLN 69 Cb 0.22 -2.15 -0.01 0.00 0.11 0.00 0.00 30.24 28.40 2iua n GLN 69 CO 0.00 0.00 0.00 0.87 -1.44 0.00 0.00 177.06 176.49 2iua h LYS 70 N 0.00 0.00 0.00 -1.09 1.57 -1.33 -3.37 116.57 112.35 2iua h LYS 70 Ca 0.78 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.56 2iua h LYS 70 Cb 2.69 0.00 0.00 0.00 0.08 0.00 0.00 32.23 35.00 2iua h LYS 70 CO -0.30 0.14 -0.07 0.66 -0.57 0.00 0.00 179.45 179.32 2iua n TYR 71 N -2.84 0.00 -0.33 -1.35 4.02 0.19 -4.79 117.16 112.07 2iua n TYR 71 Ca -0.03 -0.84 0.19 0.00 -0.01 0.00 0.00 57.90 57.21 2iua n TYR 71 Cb 0.66 -0.13 0.38 0.00 -0.02 0.00 0.00 39.34 40.23 2iua n TYR 71 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2iua h ARG 72 N 0.00 0.07 0.00 -0.72 3.08 -1.06 -2.16 114.38 113.59 2iua h ARG 72 Ca 0.00 -0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2iua h ARG 72 Cb 1.04 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 31.07 2iua h ARG 72 CO 0.00 0.05 0.00 -0.40 -1.07 0.00 0.00 179.97 178.55 2iua n ASP 73 N -5.34 0.08 -4.74 7.04 5.68 -1.26 -4.80 116.55 113.20 2iua n ASP 73 Ca 0.27 0.51 -0.40 0.00 -0.50 0.00 0.00 54.79 54.67 2iua n ASP 73 Cb 0.89 -0.53 -0.05 0.00 -1.14 0.00 0.00 41.12 40.29 2iua n ASP 73 CO 0.00 0.00 0.00 -0.76 -1.33 0.00 0.00 177.20 175.11 2iua s LEU 74 N -3.15 4.47 -1.12 -2.12 1.43 -0.81 -4.97 118.68 112.41 2iua s LEU 74 Ca 0.12 1.57 -0.17 0.00 -1.03 0.00 0.00 54.13 54.62 2iua s LEU 74 Cb 0.16 -3.36 0.13 0.00 0.03 0.00 0.00 46.19 43.15 2iua s LEU 74 CO 0.46 -0.01 1.38 0.54 0.23 0.00 0.00 176.35 178.94 2iua s ASN 75 N -0.04 6.85 0.11 2.29 4.22 -1.26 -4.91 114.94 122.20 2iua s ASN 75 Ca 0.42 -2.49 0.04 0.00 -2.14 0.00 0.00 52.86 48.68 2iua s ASN 75 Cb -0.21 -2.44 -0.04 0.00 1.28 0.00 0.00 41.25 39.84 2iua s ASN 75 CO 0.25 -0.97 -0.10 -0.54 -2.04 0.00 0.00 177.10 173.71 2iua s LYS 76 N 2.57 0.90 -0.27 3.55 3.01 -1.26 -5.12 119.74 123.11 2iua s LYS 76 Ca 0.41 -1.23 -0.25 0.00 -1.01 0.00 0.00 55.97 53.89 2iua s LYS 76 Cb -0.02 -0.54 0.00 0.00 -1.01 0.00 0.00 37.83 36.26 2iua s LYS 76 CO -0.03 0.08 0.87 -0.80 0.51 0.00 0.00 175.35 175.98 2iua s ASN 77 N -2.64 6.82 -0.08 2.83 0.01 -1.26 -4.55 114.94 116.07 2iua s ASN 77 Ca 0.08 0.96 0.01 0.00 -0.71 0.00 0.00 52.86 53.20 2iua s ASN 77 Cb -0.01 -2.45 -0.03 0.00 0.41 0.00 0.00 41.25 39.17 2iua s ASN 77 CO -0.00 -0.60 -0.11 -0.36 -1.51 0.00 0.00 177.10 174.52 2iua s PHE 78 N 3.01 2.83 -0.44 2.20 2.99 0.61 -1.22 117.98 127.96 2iua s PHE 78 Ca 0.36 -0.20 -0.07 0.00 0.00 0.00 0.00 56.93 57.03 2iua s PHE 78 Cb -0.14 -1.73 0.11 0.00 0.00 0.00 0.00 43.02 41.26 2iua s PHE 78 CO 0.10 0.15 0.27 -0.51 -0.00 0.00 0.00 175.22 175.23 2iua s LEU 79 N -0.47 5.43 -0.23 -0.37 1.43 -0.34 -1.68 118.68 122.45 2iua s LEU 79 Ca 0.06 -1.90 -0.15 0.00 -1.03 0.00 0.00 54.13 51.12 2iua s LEU 79 Cb -0.12 -1.93 -0.04 0.00 0.03 0.00 0.00 46.19 44.13 2iua s LEU 79 CO 0.02 -0.61 0.35 -0.63 0.23 0.00 0.00 176.35 175.71 2iua s ILE 80 N 1.28 5.22 0.15 -0.59 1.01 -0.67 -1.85 121.20 125.75 2iua s ILE 80 Ca 0.06 0.59 0.08 0.00 0.00 0.00 0.00 60.65 61.38 2iua s ILE 80 Cb -0.24 -3.68 -0.04 0.00 0.01 0.00 0.00 42.46 38.50 2iua s ILE 80 CO -0.02 0.24 -0.17 0.28 0.00 0.00 0.00 174.94 175.27 2iua s THR 81 N 1.49 1.71 -2.17 2.92 -1.32 -0.20 -3.14 115.64 114.92 2iua s THR 81 Ca 0.16 -1.87 0.26 0.00 -1.21 0.00 0.00 61.69 59.03 2iua s THR 81 Cb -0.15 -1.77 0.26 0.00 -1.51 0.00 0.00 72.50 69.33 2iua s THR 81 CO 0.08 -0.33 1.46 -1.54 -2.21 0.00 0.00 174.62 172.07 2iua n SER 82 N 0.36 1.65 -2.95 8.08 3.41 -1.26 -1.55 113.62 121.35 2iua n SER 82 Ca -0.14 -1.34 -0.06 0.00 -0.26 0.00 0.00 58.87 57.07 2iua n SER 82 Cb 0.57 0.16 0.02 0.00 -0.26 0.00 0.00 64.21 64.70 2iua n SER 82 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2iua n GLU 83 N -0.03 0.85 -2.75 4.33 1.02 -1.26 -4.99 120.64 117.82 2iua n GLU 83 Ca 0.13 -1.01 -0.42 0.00 -0.02 0.00 0.00 57.16 55.84 2iua n GLU 83 Cb 0.41 -0.08 -0.03 0.00 -0.02 0.00 0.00 31.44 31.72 2iua n GLU 83 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 2iua s SER 84 N -2.18 7.19 0.27 1.62 0.15 -1.26 -4.82 113.70 114.67 2iua s SER 84 Ca 0.20 1.46 -0.02 0.00 0.70 0.00 0.00 55.95 58.29 2iua s SER 84 Cb -0.02 -2.53 0.57 0.00 -1.71 0.00 0.00 66.02 62.34 2iua s SER 84 CO 0.13 -0.40 1.65 -0.65 1.20 0.00 0.00 173.24 175.17 2iua h PRO 85 N 7.09 0.19 -0.64 5.44 0.11 -1.90 0.12 132.00 142.41 2iua h PRO 85 Ca -0.32 -0.01 0.02 0.00 0.11 0.00 0.00 66.00 65.80 2iua h PRO 85 Cb 1.15 -0.04 -0.04 0.00 0.11 0.00 0.00 31.00 32.18 2iua h PRO 85 CO 0.84 0.13 0.40 1.03 -0.21 0.00 0.00 178.00 180.19 2iua h SER 86 N 0.20 0.67 -0.61 -2.05 0.87 -1.89 0.35 113.55 111.10 2iua h SER 86 Ca 0.48 -0.01 -0.03 0.00 -1.23 0.00 0.00 61.79 61.01 2iua h SER 86 Cb 0.90 -0.15 -0.03 0.00 -0.44 0.00 0.00 62.40 62.68 2iua h SER 86 CO -0.62 0.47 0.28 -0.07 -0.53 0.00 0.00 176.83 176.36 2iua h LEU 87 N 0.80 0.83 -0.10 2.23 3.38 -1.18 0.16 115.31 121.44 2iua h LEU 87 Ca 0.25 -0.10 -0.09 0.00 0.09 0.00 0.00 57.88 58.03 2iua h LEU 87 Cb -0.02 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 40.52 2iua h LEU 87 CO -0.09 0.73 -0.29 0.58 0.09 0.00 0.00 178.44 179.46 2iua h VAL 88 N 0.91 1.40 -0.85 1.22 2.07 -0.80 -2.99 116.25 117.21 2iua h VAL 88 Ca 0.22 -1.64 0.19 0.00 0.82 0.00 0.00 66.70 66.29 2iua h VAL 88 Cb 0.14 2.20 -0.11 0.00 -1.52 0.00 0.00 31.29 32.00 2iua h VAL 88 CO -0.02 0.48 0.35 0.15 0.02 0.00 0.00 177.57 178.54 2iua h PHE 89 N -0.09 0.58 -0.81 1.57 3.57 0.08 -0.96 116.94 120.89 2iua h PHE 89 Ca -0.01 0.04 0.16 0.00 3.53 0.00 0.00 57.97 61.69 2iua h PHE 89 Cb 0.92 -0.13 -0.15 0.00 2.79 0.00 0.00 35.95 39.38 2iua h PHE 89 CO 0.12 -0.01 -0.20 0.37 -2.23 0.00 0.00 178.31 176.36 2iua h GLN 90 N 0.41 -0.00 -0.64 1.11 5.75 -0.53 0.12 115.11 121.32 2iua h GLN 90 Ca 0.50 0.00 -0.06 0.00 -0.15 0.00 0.00 58.65 58.94 2iua h GLN 90 Cb 0.89 0.00 -0.03 0.00 1.07 0.00 0.00 27.48 29.41 2iua h GLN 90 CO -0.49 -0.00 0.16 0.87 -2.65 0.00 0.00 178.83 176.72 2iua h LYS 91 N -0.00 1.01 -0.49 1.69 1.57 -1.18 0.34 116.57 119.50 2iua h LYS 91 Ca 0.39 -0.22 -0.01 0.00 -1.87 0.00 0.00 60.65 58.94 2iua h LYS 91 Cb 0.59 -0.14 -0.02 0.00 0.08 0.00 0.00 32.23 32.74 2iua h LYS 91 CO -0.83 0.89 0.28 0.00 -0.57 0.00 0.00 179.45 179.22 2iua h LEU 93 N 0.65 1.08 0.00 0.00 5.85 0.11 -2.17 115.31 120.83 2iua h LEU 93 Ca 0.17 -0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.87 2iua h LEU 93 Cb 0.02 -0.26 0.00 0.00 0.37 0.00 0.00 40.66 40.78 2iua h LEU 93 CO -0.03 0.77 0.00 -0.62 -0.34 0.00 0.00 178.44 178.22 2iua n GLU 94 N -4.44 0.23 0.02 1.25 1.02 0.02 -1.13 120.64 117.61 2iua n GLU 94 Ca 0.11 0.13 0.12 0.00 -0.02 0.00 0.00 57.16 57.50 2iua n GLU 94 Cb 0.03 -1.50 0.24 0.00 -0.02 0.00 0.00 31.44 30.19 2iua n GLU 94 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 2iua n LEU 95 N -1.30 0.53 -0.03 -4.62 4.77 -0.82 -4.27 117.00 111.27 2iua n LEU 95 Ca 0.08 0.09 -0.04 0.00 -0.03 0.00 0.00 56.01 56.12 2iua n LEU 95 Cb 0.14 -0.24 -0.05 0.00 -2.33 0.00 0.00 43.42 40.94 2iua n LEU 95 CO 0.13 0.06 -0.73 0.49 -1.33 0.00 0.00 177.39 176.02 2iua n PHE 96 N -1.70 0.00 -4.03 -1.77 3.01 -0.28 -4.82 117.46 107.87 2iua n PHE 96 Ca 0.05 0.00 -0.31 0.00 1.01 0.00 0.00 57.45 58.20 2iua n PHE 96 Cb 0.37 -0.33 -0.16 0.00 -0.01 0.00 0.00 39.48 39.34 2iua n PHE 96 CO 0.00 0.00 0.00 0.42 1.01 0.00 0.00 176.76 178.19 2iua s ILE 97 N -2.16 1.72 -0.14 4.37 1.01 -0.77 -4.88 121.20 120.34 2iua s ILE 97 Ca -0.04 -0.89 -0.14 0.00 0.00 0.00 0.00 60.65 59.58 2iua s ILE 97 Cb 0.02 -1.68 -0.05 0.00 0.01 0.00 0.00 42.46 40.76 2iua s ILE 97 CO 0.27 0.33 0.30 0.42 0.00 0.00 0.00 174.94 176.26 2iua s THR 98 N 1.40 5.29 0.54 2.92 -4.23 -1.26 -4.31 115.64 115.98 2iua s THR 98 Ca 0.02 0.57 -0.20 0.00 -1.18 0.00 0.00 61.69 60.90 2iua s THR 98 Cb -0.15 -3.63 -0.08 0.00 1.34 0.00 0.00 72.50 69.98 2iua s THR 98 CO -0.10 0.41 0.85 -2.65 -0.54 0.00 0.00 174.62 172.60 2iua n PRO 99 N 3.34 0.91 -3.94 3.99 -0.02 -1.26 -5.02 135.00 133.00 2iua n PRO 99 Ca -0.12 0.34 -0.21 0.00 -2.02 0.00 0.00 63.50 61.50 2iua n PRO 99 Cb 0.52 -2.00 -0.17 0.00 -0.02 0.00 0.00 33.50 31.84 2iua n PRO 99 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 2iua s VAL 100 N -1.50 0.38 0.00 -1.45 -7.23 -1.26 -5.15 120.40 104.19 2iua s VAL 100 Ca 0.70 0.04 0.00 0.00 -1.81 0.00 0.00 61.98 60.91 2iua s VAL 100 Cb -0.47 -0.48 0.00 0.00 0.56 0.00 0.00 36.38 35.99 2iua s VAL 100 CO 0.52 0.22 0.00 -0.90 -0.31 0.00 0.00 175.10 174.63 2iua n ASP 101 N 4.56 -0.07 0.09 4.85 3.85 -1.26 -5.01 116.55 123.56 2iua n ASP 101 Ca -0.17 -0.95 -0.01 0.00 -0.71 0.00 0.00 54.79 52.95 2iua n ASP 101 Cb 0.50 0.00 -0.04 0.00 -1.35 0.00 0.00 41.12 40.23 2iua n ASP 101 CO 0.00 0.00 0.00 0.77 -1.01 0.00 0.00 177.20 176.96 2iua h SER 102 N -0.07 0.00 0.00 -1.12 4.64 -2.06 -3.48 113.55 111.47 2iua h SER 102 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2iua h SER 102 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 2iua h SER 102 CO 0.00 0.67 0.00 0.61 -0.87 0.00 0.00 176.83 177.24 2iua n GLY 103 N 1.31 1.22 2.84 -0.77 0.00 -1.26 -5.06 105.19 103.47 2iua n GLY 103 Ca -0.02 -0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.70 2iua n GLY 103 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2iua s PHE 104 N -2.00 2.61 0.55 1.61 0.40 -1.26 -5.12 117.98 114.77 2iua s PHE 104 Ca 0.00 -2.68 -0.16 0.00 -0.60 0.00 0.00 56.93 53.49 2iua s PHE 104 Cb 0.00 -2.33 -0.06 0.00 0.51 0.00 0.00 43.02 41.14 2iua s PHE 104 CO 0.00 -0.80 1.02 -2.14 0.70 0.00 0.00 175.22 173.99 2iua s PRO 105 N 0.37 3.67 3.55 0.24 0.02 -1.26 -4.84 135.00 136.76 2iua s PRO 105 Ca 0.15 1.07 0.00 0.00 0.02 0.00 0.00 61.00 62.25 2iua s PRO 105 Cb -0.23 -2.09 0.00 0.00 0.02 0.00 0.00 34.50 32.20 2iua s PRO 105 CO -0.04 -0.51 0.00 0.41 -0.33 0.00 0.00 177.00 176.53 2iua n GLY 106 N -1.29 0.52 3.46 0.52 0.00 -1.26 -4.51 105.19 102.62 2iua n GLY 106 Ca 0.08 -0.79 -0.43 0.00 0.00 0.00 0.00 46.02 44.87 2iua n GLY 106 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2iua s ILE 107 N 0.00 5.07 0.45 -0.61 1.01 -1.24 -1.03 121.20 124.86 2iua s ILE 107 Ca 0.00 -0.51 -0.25 0.00 0.00 0.00 0.00 60.65 59.88 2iua s ILE 107 Cb 0.00 -4.11 -0.08 0.00 0.01 0.00 0.00 42.46 38.28 2iua s ILE 107 CO 0.00 -0.53 1.42 1.57 0.00 0.00 0.00 174.94 177.40 2iua n HIS 108 N 5.65 2.65 -0.19 3.97 -0.00 0.15 -4.90 115.22 122.55 2iua n HIS 108 Ca -0.08 0.44 0.16 0.00 0.46 0.00 0.00 57.72 58.70 2iua n HIS 108 Cb 0.46 -2.45 0.50 0.00 -0.12 0.00 0.00 29.99 28.38 2iua n HIS 108 CO 0.00 0.00 0.00 -1.35 0.46 0.00 0.00 176.34 175.45 2iua h PRO 109 N 2.24 0.42 0.00 1.57 0.11 -1.95 -2.57 132.00 131.82 2iua h PRO 109 Ca -0.51 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.58 2iua h PRO 109 Cb 1.27 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.29 2iua h PRO 109 CO 0.61 0.28 0.00 1.79 -0.21 0.00 0.00 178.00 180.46 2iua h THR 110 N 0.43 0.00 -3.65 -1.15 1.35 -1.91 -3.44 112.91 104.53 2iua h THR 110 Ca 0.40 -0.49 -0.54 0.00 -0.55 0.00 0.00 66.41 65.23 2iua h THR 110 Cb 0.92 1.45 0.10 0.00 -1.73 0.00 0.00 68.15 68.89 2iua h THR 110 CO -0.14 0.00 0.81 0.00 -0.25 0.00 0.00 175.52 175.95 2iua n ALA 111 N -1.83 2.43 -3.22 6.62 0.00 -0.97 -4.02 120.51 119.53 2iua n ALA 111 Ca 0.05 0.35 -0.35 0.00 0.00 0.00 0.00 53.44 53.49 2iua n ALA 111 Cb 0.40 -2.44 -0.13 0.00 0.00 0.00 0.00 19.45 17.29 2iua n ALA 111 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2iua s VAL 112 N -0.68 3.80 -0.23 0.00 1.01 -0.45 -4.97 120.40 118.89 2iua s VAL 112 Ca 0.57 -0.36 -0.00 0.00 0.00 0.00 0.00 61.98 62.19 2iua s VAL 112 Cb -0.48 -2.73 0.06 0.00 0.00 0.00 0.00 36.38 33.23 2iua s VAL 112 CO 0.58 0.41 -0.02 -0.63 0.00 0.00 0.00 175.10 175.44 2iua s ILE 113 N 1.24 1.20 0.06 2.22 1.01 -1.26 -0.75 121.20 124.92 2iua s ILE 113 Ca 0.03 -1.04 -0.36 0.00 0.00 0.00 0.00 60.65 59.28 2iua s ILE 113 Cb -0.15 -1.56 -0.16 0.00 0.01 0.00 0.00 42.46 40.60 2iua s ILE 113 CO 0.01 -0.16 1.44 1.57 0.00 0.00 0.00 174.94 177.80 2iua n HIS 114 N 4.79 1.74 -0.32 3.97 -0.00 -0.77 -4.84 115.22 119.79 2iua n HIS 114 Ca -0.10 0.54 0.29 0.00 -0.00 0.00 0.00 57.72 58.44 2iua n HIS 114 Cb 0.45 -2.40 0.54 0.00 -0.00 0.00 0.00 29.99 28.59 2iua n HIS 114 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.34 175.34 2iua h PRO 115 N 5.23 0.05 0.00 1.57 0.13 -1.95 0.24 132.00 137.27 2iua h PRO 115 Ca -0.47 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 2iua h PRO 115 Cb 1.32 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.43 2iua h PRO 115 CO 0.82 0.03 0.00 0.25 -0.23 0.00 0.00 178.00 178.88 2iua n THR 116 N -5.25 0.24 -3.65 1.56 -2.24 -1.26 -4.81 114.28 98.87 2iua n THR 116 Ca 0.36 0.06 -0.34 0.00 -2.27 0.00 0.00 64.05 61.85 2iua n THR 116 Cb 1.19 -0.68 -0.05 0.00 -2.10 0.00 0.00 70.33 68.69 2iua n THR 116 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2iua s ALA 117 N -2.48 3.77 -0.28 6.98 0.00 0.07 -3.72 121.76 126.11 2iua s ALA 117 Ca 0.24 -0.46 -0.06 0.00 0.00 0.00 0.00 51.96 51.68 2iua s ALA 117 Cb 0.15 -2.19 0.01 0.00 0.00 0.00 0.00 23.12 21.09 2iua s ALA 117 CO 0.34 0.60 0.05 0.42 0.00 0.00 0.00 175.76 177.16 2iua s ILE 118 N -1.37 3.78 -0.27 0.00 1.01 -0.52 -4.94 121.20 118.90 2iua s ILE 118 Ca 0.31 -0.68 -0.08 0.00 0.00 0.00 0.00 60.65 60.20 2iua s ILE 118 Cb -0.14 -2.91 -0.03 0.00 0.01 0.00 0.00 42.46 39.40 2iua s ILE 118 CO 0.18 0.15 0.10 -0.63 0.00 0.00 0.00 174.94 174.74 2iua s ILE 119 N 1.48 4.47 0.33 2.92 -1.09 -1.26 -1.98 121.20 126.07 2iua s ILE 119 Ca 0.03 -0.20 -0.05 0.00 -2.23 0.00 0.00 60.65 58.19 2iua s ILE 119 Cb -0.17 -3.14 0.08 0.00 -1.58 0.00 0.00 42.46 37.65 2iua s ILE 119 CO 0.01 0.27 0.35 -0.62 -1.23 0.00 0.00 174.94 173.71 2iua n GLU 120 N 4.95 -1.11 -2.78 2.79 -0.58 -0.76 -5.01 120.64 118.14 2iua n GLU 120 Ca -0.15 -0.54 -0.32 0.00 -0.42 0.00 0.00 57.16 55.73 2iua n GLU 120 Cb 0.51 -0.44 -0.04 0.00 -0.57 0.00 0.00 31.44 30.89 2iua n GLU 120 CO 0.00 0.00 0.00 0.16 -0.48 0.00 0.00 177.13 176.81 2iua s ASP 121 N -2.38 6.67 -1.44 1.62 -4.77 -1.26 -4.17 116.67 110.94 2iua s ASP 121 Ca 0.21 1.37 -0.01 0.00 -3.30 0.00 0.00 52.55 50.83 2iua s ASP 121 Cb -0.01 -2.42 0.00 0.00 -1.09 0.00 0.00 42.92 39.40 2iua s ASP 121 CO 0.16 -0.41 0.07 1.41 0.70 0.00 0.00 175.17 177.10 2iua n HIS 122 N -1.08 -0.92 -3.54 2.11 8.25 -1.26 -2.17 115.22 116.61 2iua n HIS 122 Ca 0.05 0.06 -0.37 0.00 -0.26 0.00 0.00 57.72 57.19 2iua n HIS 122 Cb 0.54 -3.50 -0.06 0.00 1.12 0.00 0.00 29.99 28.09 2iua n HIS 122 CO 0.00 0.00 0.00 0.14 0.64 0.00 0.00 176.34 177.12 2iua s VAL 123 N -2.88 5.08 -0.40 1.59 -7.23 -1.26 -3.64 120.40 111.66 2iua s VAL 123 Ca 0.03 0.72 -0.14 0.00 -1.81 0.00 0.00 61.98 60.79 2iua s VAL 123 Cb -0.01 -3.67 0.03 0.00 0.56 0.00 0.00 36.38 33.28 2iua s VAL 123 CO 0.04 0.54 0.27 0.00 -0.31 0.00 0.00 175.10 175.64 2iua s ILE 125 N 1.63 2.67 0.83 0.00 1.01 -0.19 0.19 121.20 127.33 2iua s ILE 125 Ca 0.04 -1.20 -0.12 0.00 0.00 0.00 0.00 60.65 59.37 2iua s ILE 125 Cb -0.20 -2.41 0.09 0.00 0.01 0.00 0.00 42.46 39.96 2iua s ILE 125 CO 0.08 0.14 1.17 -1.61 0.00 0.00 0.00 174.94 174.72 2iua s GLU 126 N 1.26 1.83 0.15 2.79 2.02 0.16 -0.67 118.70 126.25 2iua s GLU 126 Ca -0.02 0.13 -0.34 0.00 0.02 0.00 0.00 54.97 54.76 2iua s GLU 126 Cb -0.17 -1.93 -0.15 0.00 0.10 0.00 0.00 34.13 31.97 2iua s GLU 126 CO -0.05 -1.69 1.34 -2.30 0.02 0.00 0.00 175.26 172.57 2iua n PRO 127 N -3.39 1.47 -1.18 0.39 -0.02 -1.26 -3.09 135.00 127.92 2iua n PRO 127 Ca 0.08 0.53 -0.06 0.00 -2.02 0.00 0.00 63.50 62.02 2iua n PRO 127 Cb 0.61 -2.15 -0.03 0.00 -0.02 0.00 0.00 33.50 31.91 2iua n PRO 127 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 2iua n TYR 128 N 2.27 0.00 -3.14 6.00 0.53 -1.26 -1.65 117.16 119.92 2iua n TYR 128 Ca 0.16 0.00 -0.32 0.00 -1.02 0.00 0.00 57.90 56.72 2iua n TYR 128 Cb 0.24 -1.44 -0.05 0.00 -1.03 0.00 0.00 39.34 37.06 2iua n TYR 128 CO 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 176.86 175.84 2iua s ALA 129 N -2.12 3.38 -0.09 -0.72 0.00 -1.18 -3.83 121.76 117.21 2iua s ALA 129 Ca 0.00 -0.09 0.03 0.00 0.00 0.00 0.00 51.96 51.90 2iua s ALA 129 Cb 0.00 -2.68 0.01 0.00 0.00 0.00 0.00 23.12 20.45 2iua s ALA 129 CO 0.00 0.29 -0.19 0.08 0.00 0.00 0.00 175.76 175.94 2iua s VAL 130 N -2.04 1.67 -0.20 0.00 1.01 -0.77 -1.34 120.40 118.72 2iua s VAL 130 Ca 0.52 -0.79 -0.00 0.00 0.00 0.00 0.00 61.98 61.71 2iua s VAL 130 Cb -0.10 -1.46 0.02 0.00 0.00 0.00 0.00 36.38 34.83 2iua s VAL 130 CO 0.21 0.47 -0.14 -0.69 0.00 0.00 0.00 175.10 174.96 2iua s VAL 131 N 0.49 2.45 0.54 2.92 1.01 0.07 -0.62 120.40 127.26 2iua s VAL 131 Ca -0.17 -0.90 -0.04 0.00 0.00 0.00 0.00 61.98 60.87 2iua s VAL 131 Cb -0.17 -2.11 0.11 0.00 0.00 0.00 0.00 36.38 34.21 2iua s VAL 131 CO 0.07 0.43 0.73 0.00 0.00 0.00 0.00 175.10 176.33 2iua s GLN 133 N -4.42 2.99 -0.33 0.00 -2.07 -1.26 -2.50 119.66 112.06 2iua s GLN 133 Ca 0.46 2.14 0.00 0.00 -1.82 0.00 0.00 55.36 56.14 2iua s GLN 133 Cb -0.02 -2.12 0.00 0.00 -1.09 0.00 0.00 33.01 29.78 2iua s GLN 133 CO 0.31 -1.28 0.00 0.72 -1.32 0.00 0.00 175.29 173.72 2iua n HIS 134 N -1.29 -1.42 -1.74 9.60 8.25 -1.24 -0.27 115.22 127.11 2iua n HIS 134 Ca 0.12 0.00 -0.31 0.00 -0.26 0.00 0.00 57.72 57.27 2iua n HIS 134 Cb 0.46 -1.46 0.03 0.00 1.12 0.00 0.00 29.99 30.15 2iua n HIS 134 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2iua s ALA 135 N -1.80 2.77 -0.12 -1.41 0.00 -1.04 -3.80 121.76 116.35 2iua s ALA 135 Ca 0.00 0.12 -0.03 0.00 0.00 0.00 0.00 51.96 52.06 2iua s ALA 135 Cb 0.00 -3.17 0.04 0.00 0.00 0.00 0.00 23.12 20.00 2iua s ALA 135 CO 0.00 -1.02 0.04 -1.58 0.00 0.00 0.00 175.76 173.20 2iua s HIS 136 N -2.93 0.57 -0.23 0.00 2.46 -0.51 -1.43 115.29 113.21 2iua s HIS 136 Ca 0.59 -0.33 -0.07 0.00 0.47 0.00 0.00 55.06 55.71 2iua s HIS 136 Cb -0.14 -0.79 -0.03 0.00 -0.13 0.00 0.00 32.58 31.49 2iua s HIS 136 CO 0.50 -0.43 0.06 0.08 -2.47 0.00 0.00 174.74 172.48 2iua s VAL 137 N 2.01 4.32 0.96 0.89 1.01 -0.84 -1.18 120.40 127.57 2iua s VAL 137 Ca 0.03 -0.18 -0.13 0.00 0.00 0.00 0.00 61.98 61.70 2iua s VAL 137 Cb -0.14 -3.00 0.16 0.00 0.00 0.00 0.00 36.38 33.40 2iua s VAL 137 CO -0.07 0.37 1.13 -0.83 0.00 0.00 0.00 175.10 175.70 2iua s GLY 138 N 1.35 1.58 0.42 4.51 0.00 -0.01 -1.84 107.32 113.33 2iua s GLY 138 Ca 0.05 -0.53 -0.26 0.00 0.00 0.00 0.00 44.72 43.98 2iua s GLY 138 CO 0.03 0.07 1.34 -1.35 0.00 0.00 0.00 173.10 173.19 2iua s SER 139 N -3.89 6.16 -1.34 1.64 1.04 -1.26 -3.47 113.70 112.58 2iua s SER 139 Ca 0.65 2.74 -0.06 0.00 0.48 0.00 0.00 55.95 59.76 2iua s SER 139 Cb -0.15 -2.64 0.02 0.00 0.10 0.00 0.00 66.02 63.35 2iua s SER 139 CO 0.55 -0.96 1.01 0.00 0.98 0.00 0.00 173.24 174.81 2iua n ALA 140 N 0.02 -1.63 -2.71 5.32 0.00 -0.92 -2.10 120.51 118.48 2iua n ALA 140 Ca 0.04 0.13 -0.21 0.00 0.00 0.00 0.00 53.44 53.41 2iua n ALA 140 Cb 0.43 -3.83 -0.01 0.00 0.00 0.00 0.00 19.45 16.04 2iua n ALA 140 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2iua s HIS 142 N -2.15 2.67 -0.45 0.00 5.65 -0.69 -0.81 115.29 119.51 2iua s HIS 142 Ca 0.39 -1.75 -0.13 0.00 0.25 0.00 0.00 55.06 53.83 2iua s HIS 142 Cb -0.09 -1.77 0.08 0.00 -1.18 0.00 0.00 32.58 29.62 2iua s HIS 142 CO 0.32 -0.78 0.35 0.42 -0.65 0.00 0.00 174.74 174.39 2iua s ILE 143 N 1.31 4.83 0.70 0.89 -1.09 0.13 -0.12 121.20 127.85 2iua s ILE 143 Ca -0.01 -1.22 -0.16 0.00 -2.23 0.00 0.00 60.65 57.03 2iua s ILE 143 Cb -0.16 -3.92 -0.03 0.00 -1.58 0.00 0.00 42.46 36.77 2iua s ILE 143 CO -0.09 -0.56 0.69 0.61 -1.23 0.00 0.00 174.94 174.36 2iua n GLY 144 N 5.09 -1.11 3.64 6.18 0.00 0.24 -0.66 105.19 118.57 2iua n GLY 144 Ca -0.11 -0.33 -0.50 0.00 0.00 0.00 0.00 46.02 45.08 2iua n GLY 144 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2iua n SER 145 N -0.68 2.49 0.00 1.61 2.88 -1.26 -1.87 113.62 116.79 2iua n SER 145 Ca 0.11 1.09 0.00 0.00 -1.33 0.00 0.00 58.87 58.74 2iua n SER 145 Cb 0.49 -1.30 0.00 0.00 -0.75 0.00 0.00 64.21 62.65 2iua n SER 145 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2iua n GLY 146 N 3.23 1.81 3.51 0.46 0.00 -0.66 -1.09 105.19 112.45 2iua n GLY 146 Ca 0.19 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.92 2iua n GLY 146 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2iua s SER 147 N -3.27 1.12 -0.04 1.61 0.01 -0.78 -4.30 113.70 108.05 2iua s SER 147 Ca 0.00 1.60 -0.00 0.00 1.31 0.00 0.00 55.95 58.86 2iua s SER 147 Cb 0.00 -2.34 0.03 0.00 0.21 0.00 0.00 66.02 63.91 2iua s SER 147 CO 0.00 -4.13 0.01 -0.69 0.41 0.00 0.00 173.24 168.84 2iua s VAL 148 N -2.47 0.22 -0.35 3.43 1.01 0.40 -1.84 120.40 120.80 2iua s VAL 148 Ca 0.68 0.13 -0.10 0.00 0.00 0.00 0.00 61.98 62.69 2iua s VAL 148 Cb -0.25 -0.35 0.02 0.00 0.00 0.00 0.00 36.38 35.80 2iua s VAL 148 CO 0.64 0.19 0.18 -0.63 0.00 0.00 0.00 175.10 175.48 2iua s ILE 149 N 1.44 4.51 0.82 2.22 -1.09 0.21 -0.86 121.20 128.45 2iua s ILE 149 Ca -0.04 -0.76 -0.12 0.00 -2.23 0.00 0.00 60.65 57.51 2iua s ILE 149 Cb -0.13 -3.46 0.08 0.00 -1.58 0.00 0.00 42.46 37.38 2iua s ILE 149 CO -0.03 -0.14 1.10 -0.83 -1.23 0.00 0.00 174.94 173.81 2iua s GLY 150 N 1.56 1.62 -0.12 6.18 0.00 0.18 -0.57 107.32 116.16 2iua s GLY 150 Ca 0.02 -0.24 -0.39 0.00 0.00 0.00 0.00 44.72 44.11 2iua s GLY 150 CO 0.06 0.20 1.51 0.00 0.00 0.00 0.00 173.10 174.88 2iua n ALA 151 N -3.50 -0.87 -0.95 3.20 0.00 -1.26 -1.69 120.51 115.44 2iua n ALA 151 Ca 0.07 0.47 0.00 0.00 0.00 0.00 0.00 53.44 53.97 2iua n ALA 151 Cb 0.57 -2.11 0.00 0.00 0.00 0.00 0.00 19.45 17.91 2iua n ALA 151 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2iua n TYR 152 N 3.79 0.00 -2.78 0.00 4.01 0.63 -0.72 117.16 122.10 2iua n TYR 152 Ca 0.23 0.00 -0.31 0.00 -0.16 0.00 0.00 57.90 57.66 2iua n TYR 152 Cb 0.14 -0.80 -0.04 0.00 -0.31 0.00 0.00 39.34 38.33 2iua n TYR 152 CO 0.00 0.00 0.00 -1.12 -0.46 0.00 0.00 176.86 175.28 2iua s SER 153 N -2.14 6.62 -0.02 7.72 0.01 -0.68 -4.46 113.70 120.75 2iua s SER 153 Ca 0.00 1.32 0.04 0.00 1.31 0.00 0.00 55.95 58.62 2iua s SER 153 Cb 0.00 -2.40 -0.01 0.00 0.21 0.00 0.00 66.02 63.82 2iua s SER 153 CO 0.00 -0.41 -0.15 0.42 0.41 0.00 0.00 173.24 173.51 2iua s THR 154 N -2.36 1.19 -0.18 1.44 -4.23 0.15 -1.43 115.64 110.23 2iua s THR 154 Ca 0.55 -0.63 -0.00 0.00 -1.18 0.00 0.00 61.69 60.42 2iua s THR 154 Cb -0.10 -1.01 0.01 0.00 1.34 0.00 0.00 72.50 72.74 2iua s THR 154 CO 0.27 0.34 -0.16 -0.69 -0.54 0.00 0.00 174.62 173.85 2iua s VAL 155 N -0.24 2.46 0.89 2.29 1.01 -0.33 0.85 120.40 127.34 2iua s VAL 155 Ca 0.03 -0.81 -0.12 0.00 0.00 0.00 0.00 61.98 61.09 2iua s VAL 155 Cb -0.07 -2.06 0.13 0.00 0.00 0.00 0.00 36.38 34.38 2iua s VAL 155 CO -0.00 0.51 1.09 -0.83 0.00 0.00 0.00 175.10 175.87 2iua s GLY 156 N 1.24 1.61 0.55 4.51 0.00 0.13 -0.83 107.32 114.52 2iua s GLY 156 Ca 0.03 -0.15 -0.20 0.00 0.00 0.00 0.00 44.72 44.40 2iua s GLY 156 CO -0.08 0.35 1.22 -1.83 0.00 0.00 0.00 173.10 172.76 2iua s GLU 157 N -4.99 3.22 -0.63 2.90 -1.05 -1.26 -2.96 118.70 113.93 2iua s GLU 157 Ca 0.63 1.89 0.00 0.00 -0.15 0.00 0.00 54.97 57.34 2iua s GLU 157 Cb -0.17 -2.11 0.00 0.00 -0.44 0.00 0.00 34.13 31.40 2iua s GLU 157 CO 0.56 -1.03 0.00 0.72 0.95 0.00 0.00 175.26 176.47 2iua n HIS 158 N -1.19 0.00 -2.39 4.83 8.25 -0.89 -0.64 115.22 123.19 2iua n HIS 158 Ca 0.11 0.00 -0.39 0.00 -0.26 0.00 0.00 57.72 57.18 2iua n HIS 158 Cb 0.48 -1.86 -0.03 0.00 1.12 0.00 0.00 29.99 29.70 2iua n HIS 158 CO 0.00 0.00 0.00 -1.12 0.64 0.00 0.00 176.34 175.86 2iua s SER 159 N -2.35 6.95 -0.37 0.41 0.01 -1.16 -3.87 113.70 113.33 2iua s SER 159 Ca 0.00 2.31 -0.03 0.00 1.31 0.00 0.00 55.95 59.54 2iua s SER 159 Cb 0.00 -2.62 0.08 0.00 0.21 0.00 0.00 66.02 63.69 2iua s SER 159 CO 0.00 -0.37 0.13 -0.47 0.41 0.00 0.00 173.24 172.94 2iua s TYR 160 N -1.29 3.44 -0.35 2.43 5.04 0.11 -1.70 117.35 125.03 2iua s TYR 160 Ca 0.50 -2.09 -0.15 0.00 -2.44 0.00 0.00 57.07 52.89 2iua s TYR 160 Cb -0.31 -2.77 -0.01 0.00 0.35 0.00 0.00 41.96 39.22 2iua s TYR 160 CO 0.40 -0.89 0.33 0.42 -1.34 0.00 0.00 175.55 174.48 2iua s ILE 161 N 1.22 5.20 1.11 3.14 1.01 0.83 -1.58 121.20 132.12 2iua s ILE 161 Ca 0.03 -0.08 -0.16 0.00 0.00 0.00 0.00 60.65 60.43 2iua s ILE 161 Cb -0.21 -3.82 0.24 0.00 0.01 0.00 0.00 42.46 38.68 2iua s ILE 161 CO -0.02 -0.11 1.12 -1.00 0.00 0.00 0.00 174.94 174.93 2iua s HIS 162 N 1.94 1.23 0.69 3.97 3.76 -0.24 0.83 115.29 127.47 2iua s HIS 162 Ca 0.10 0.68 -0.15 0.00 -0.15 0.00 0.00 55.06 55.54 2iua s HIS 162 Cb -0.17 -3.41 0.02 0.00 1.11 0.00 0.00 32.58 30.13 2iua s HIS 162 CO 0.11 -3.40 1.14 -2.14 -0.85 0.00 0.00 174.74 169.61 2iua s PRO 163 N -5.26 2.50 -1.44 8.40 0.02 -1.26 -3.91 135.00 134.05 2iua s PRO 163 Ca 0.69 1.52 -0.07 0.00 0.02 0.00 0.00 61.00 63.16 2iua s PRO 163 Cb -0.13 -1.90 0.05 0.00 0.02 0.00 0.00 34.50 32.54 2iua s PRO 163 CO 0.56 -1.50 0.83 0.54 -0.33 0.00 0.00 177.00 177.09 2iua n ARG 164 N -2.59 -5.08 -4.22 5.54 5.12 -0.25 -3.38 116.66 111.81 2iua n ARG 164 Ca 0.11 0.59 -0.35 0.00 -1.93 0.00 0.00 57.85 56.27 2iua n ARG 164 Cb 0.51 -5.29 -0.08 0.00 -1.16 0.00 0.00 32.46 26.44 2iua n ARG 164 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 2iua s VAL 165 N -3.50 4.64 -0.28 1.55 1.01 -1.25 -1.96 120.40 120.61 2iua s VAL 165 Ca 0.35 -0.18 -0.04 0.00 0.00 0.00 0.00 61.98 62.11 2iua s VAL 165 Cb -0.18 -3.00 0.02 0.00 0.00 0.00 0.00 36.38 33.23 2iua s VAL 165 CO 0.83 0.56 0.01 -0.69 0.00 0.00 0.00 175.10 175.81 2iua s VAL 166 N -0.97 3.34 -0.33 2.92 1.01 -0.36 -0.46 120.40 125.56 2iua s VAL 166 Ca 0.15 -0.95 -0.12 0.00 0.00 0.00 0.00 61.98 61.07 2iua s VAL 166 Cb -0.12 -2.74 -0.01 0.00 0.00 0.00 0.00 36.38 33.51 2iua s VAL 166 CO 0.05 0.10 0.21 -0.63 0.00 0.00 0.00 175.10 174.83 2iua s ILE 167 N 1.39 5.06 0.45 2.22 1.09 -0.03 -0.37 121.20 131.00 2iua s ILE 167 Ca 0.00 -0.29 -0.08 0.00 -1.10 0.00 0.00 60.65 59.19 2iua s ILE 167 Cb -0.17 -3.60 0.11 0.00 -1.06 0.00 0.00 42.46 37.74 2iua s ILE 167 CO -0.01 0.01 0.50 0.54 -0.10 0.00 0.00 174.94 175.88 2iua n ARG 168 N 5.07 -1.17 -1.44 2.79 5.12 0.52 -0.65 116.66 126.90 2iua n ARG 168 Ca -0.13 -0.78 -0.33 0.00 -1.93 0.00 0.00 57.85 54.68 2iua n ARG 168 Cb 0.49 -0.61 0.08 0.00 -1.16 0.00 0.00 32.46 31.27 2iua n ARG 168 CO 0.00 0.00 0.00 -1.83 -1.93 0.00 0.00 177.63 173.87 2iua s GLU 169 N -4.11 2.26 -1.44 5.56 1.03 -1.26 -3.73 118.70 117.01 2iua s GLU 169 Ca 0.30 1.53 -0.04 0.00 0.03 0.00 0.00 54.97 56.79 2iua s GLU 169 Cb -0.02 -1.87 0.03 0.00 -0.80 0.00 0.00 34.13 31.47 2iua s GLU 169 CO 0.22 -1.69 0.56 0.54 -1.33 0.00 0.00 175.26 173.56 2iua n ARG 170 N -2.89 -3.74 -4.83 -4.83 1.74 0.10 -4.88 116.66 97.33 2iua n ARG 170 Ca 0.12 0.45 -0.33 0.00 -0.77 0.00 0.00 57.85 57.32 2iua n ARG 170 Cb 0.51 -4.80 -0.13 0.00 -1.02 0.00 0.00 32.46 27.02 2iua n ARG 170 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2iua s VAL 171 N -3.77 3.09 -0.29 1.55 1.01 -1.26 -3.68 120.40 117.06 2iua s VAL 171 Ca 0.16 -0.69 -0.06 0.00 0.00 0.00 0.00 61.98 61.39 2iua s VAL 171 Cb -0.08 -2.25 0.01 0.00 0.00 0.00 0.00 36.38 34.06 2iua s VAL 171 CO 0.88 0.57 0.06 -0.55 0.00 0.00 0.00 175.10 176.05 2iua s SER 172 N -0.32 5.02 -0.13 3.32 0.15 -0.47 -0.67 113.70 120.59 2iua s SER 172 Ca 0.03 -0.72 -0.01 0.00 0.70 0.00 0.00 55.95 55.95 2iua s SER 172 Cb -0.13 -1.85 -0.02 0.00 -1.71 0.00 0.00 66.02 62.31 2iua s SER 172 CO 0.02 -0.18 -0.09 -0.63 1.20 0.00 0.00 173.24 173.57 2iua s ILE 173 N 1.48 3.43 0.00 6.45 -1.09 0.25 -0.10 121.20 131.61 2iua s ILE 173 Ca 0.02 -0.53 0.00 0.00 -2.23 0.00 0.00 60.65 57.91 2iua s ILE 173 Cb -0.17 -2.46 0.00 0.00 -1.58 0.00 0.00 42.46 38.25 2iua s ILE 173 CO 0.01 0.52 0.00 0.61 -1.23 0.00 0.00 174.94 174.86 2iua n GLY 174 N 3.32 -0.20 3.83 6.18 0.00 0.04 0.17 105.19 118.53 2iua n GLY 174 Ca -0.18 -1.73 -0.32 0.00 0.00 0.00 0.00 46.02 43.79 2iua n GLY 174 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2iua s LYS 175 N 0.23 3.95 -1.30 1.61 1.02 -1.26 -2.00 119.74 121.99 2iua s LYS 175 Ca 0.00 1.03 -0.06 0.00 0.02 0.00 0.00 55.97 56.96 2iua s LYS 175 Cb 0.00 -2.13 0.04 0.00 -0.52 0.00 0.00 37.83 35.21 2iua s LYS 175 CO 0.00 -0.27 0.38 0.54 -0.92 0.00 0.00 175.35 175.08 2iua n ARG 176 N -1.39 -3.41 -3.42 1.68 1.74 0.19 -2.22 116.66 109.84 2iua n ARG 176 Ca 0.07 0.61 -0.35 0.00 -0.77 0.00 0.00 57.85 57.41 2iua n ARG 176 Cb 0.54 -5.33 -0.06 0.00 -1.02 0.00 0.00 32.46 26.59 2iua n ARG 176 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2iua s VAL 177 N -2.91 4.92 -0.11 1.55 1.01 -1.26 -3.55 120.40 120.06 2iua s VAL 177 Ca 0.27 0.72 0.03 0.00 0.00 0.00 0.00 61.98 63.00 2iua s VAL 177 Cb -0.14 -3.71 -0.01 0.00 0.00 0.00 0.00 36.38 32.53 2iua s VAL 177 CO 0.33 0.25 -0.20 -0.63 0.00 0.00 0.00 175.10 174.85 2iua s ILE 178 N -1.46 2.45 -0.14 2.22 1.01 -0.99 0.06 121.20 124.36 2iua s ILE 178 Ca 0.37 -0.88 0.00 0.00 0.00 0.00 0.00 60.65 60.14 2iua s ILE 178 Cb -0.15 -1.97 0.02 0.00 0.01 0.00 0.00 42.46 40.38 2iua s ILE 178 CO 0.19 0.55 -0.12 -0.63 0.00 0.00 0.00 174.94 174.93 2iua s ILE 179 N 0.31 1.38 0.92 2.92 1.01 -0.61 -1.28 121.20 125.84 2iua s ILE 179 Ca -0.15 -0.52 -0.13 0.00 0.00 0.00 0.00 60.65 59.85 2iua s ILE 179 Cb -0.17 -1.33 0.15 0.00 0.01 0.00 0.00 42.46 41.12 2iua s ILE 179 CO 0.07 0.41 1.14 -1.10 0.00 0.00 0.00 174.94 175.47 2iua s GLN 180 N 1.57 1.04 0.23 2.79 -1.52 -0.50 -1.08 119.66 122.19 2iua s GLN 180 Ca 0.05 0.25 -0.32 0.00 -1.95 0.00 0.00 55.36 53.39 2iua s GLN 180 Cb -0.13 -1.83 -0.14 0.00 -0.22 0.00 0.00 33.01 30.70 2iua s GLN 180 CO -0.10 -2.26 1.42 -2.30 -0.25 0.00 0.00 175.29 171.81 2iua n PRO 181 N -3.80 2.02 -0.28 2.91 -0.02 -1.26 -3.39 135.00 131.18 2iua n PRO 181 Ca 0.07 0.72 0.00 0.00 -2.02 0.00 0.00 63.50 62.27 2iua n PRO 181 Cb 0.59 -2.39 0.00 0.00 -0.02 0.00 0.00 33.50 31.69 2iua n PRO 181 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2iua n GLY 182 N 2.29 1.20 3.70 -1.23 0.00 -0.83 -1.83 105.19 108.49 2iua n GLY 182 Ca 0.12 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.81 2iua n GLY 182 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2iua s ALA 183 N -2.83 1.80 -0.21 4.61 0.00 -1.22 -3.91 121.76 120.02 2iua s ALA 183 Ca 0.00 0.77 -0.01 0.00 0.00 0.00 0.00 51.96 52.71 2iua s ALA 183 Cb 0.00 -3.47 0.06 0.00 0.00 0.00 0.00 23.12 19.71 2iua s ALA 183 CO 0.00 -2.33 -0.00 0.08 0.00 0.00 0.00 175.76 173.51 2iua s VAL 184 N -2.28 0.91 -0.22 0.00 1.01 -0.26 -1.22 120.40 118.35 2iua s VAL 184 Ca 0.71 -0.80 -0.04 0.00 0.00 0.00 0.00 61.98 61.85 2iua s VAL 184 Cb -0.27 -1.32 -0.01 0.00 0.00 0.00 0.00 36.38 34.78 2iua s VAL 184 CO 0.52 -0.15 -0.03 -0.63 0.00 0.00 0.00 175.10 174.80 2iua s ILE 185 N 1.68 3.47 0.00 2.22 -1.09 0.50 -1.09 121.20 126.89 2iua s ILE 185 Ca -0.03 -0.46 0.00 0.00 -2.23 0.00 0.00 60.65 57.93 2iua s ILE 185 Cb -0.18 -2.58 0.00 0.00 -1.58 0.00 0.00 42.46 38.12 2iua s ILE 185 CO -0.07 0.42 0.00 0.61 -1.23 0.00 0.00 174.94 174.67 2iua n GLY 186 N 4.76 1.15 3.76 6.18 0.00 0.15 -0.35 105.19 120.84 2iua n GLY 186 Ca -0.18 -0.39 -0.29 0.00 0.00 0.00 0.00 46.02 45.16 2iua n GLY 186 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2iua s SER 187 N -2.47 3.63 0.20 1.61 1.04 -1.20 -4.54 113.70 111.96 2iua s SER 187 Ca 0.00 1.20 -0.29 0.00 0.48 0.00 0.00 55.95 57.34 2iua s SER 187 Cb 0.00 -1.85 -0.08 0.00 0.10 0.00 0.00 66.02 64.18 2iua s SER 187 CO 0.00 -2.50 0.91 0.00 0.98 0.00 0.00 173.24 172.63 2iua n GLY 189 N 1.67 -1.04 3.38 0.00 0.00 -1.23 -4.81 105.19 103.17 2iua n GLY 189 Ca -0.02 -0.78 -0.44 0.00 0.00 0.00 0.00 46.02 44.77 2iua n GLY 189 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 2iua n PHE 190 N -4.21 5.05 -3.88 1.61 7.35 -1.26 -4.96 117.46 117.16 2iua n PHE 190 Ca 0.09 -3.62 -0.22 0.00 -0.76 0.00 0.00 57.45 52.94 2iua n PHE 190 Cb 0.53 -1.93 -0.17 0.00 0.35 0.00 0.00 39.48 38.26 2iua n PHE 190 CO 0.00 0.00 0.00 0.20 -0.76 0.00 0.00 176.76 176.20 2iua s GLY 191 N 1.93 0.49 0.05 7.13 0.00 -1.26 -5.04 107.32 110.62 2iua s GLY 191 Ca 0.37 -0.14 0.00 0.00 0.00 0.00 0.00 44.72 44.95 2iua s GLY 191 CO -0.04 0.93 -0.05 -0.19 0.00 0.00 0.00 173.10 173.75 2iua s TYR 192 N 1.67 0.56 -0.04 1.90 1.51 -1.26 -3.47 117.35 118.21 2iua s TYR 192 Ca 0.01 -0.81 0.00 0.00 -1.01 0.00 0.00 57.07 55.26 2iua s TYR 192 Cb -0.13 -0.37 -0.03 0.00 -0.11 0.00 0.00 41.96 41.32 2iua s TYR 192 CO -0.04 -0.23 -0.02 0.14 -1.11 0.00 0.00 175.55 174.29 2iua s VAL 193 N -2.82 4.09 -0.26 0.71 -7.23 -0.79 -4.92 120.40 109.18 2iua s VAL 193 Ca -0.00 -0.47 -0.09 0.00 -1.81 0.00 0.00 61.98 59.60 2iua s VAL 193 Cb -0.00 -2.76 -0.04 0.00 0.56 0.00 0.00 36.38 34.14 2iua s VAL 193 CO -0.05 0.50 0.13 -0.89 -0.31 0.00 0.00 175.10 174.48 2iua s THR 194 N -0.96 4.87 0.20 5.32 2.01 -1.26 -0.46 115.64 125.35 2iua s THR 194 Ca 0.16 0.02 -0.04 0.00 0.31 0.00 0.00 61.69 62.14 2iua s THR 194 Cb -0.11 -3.29 -0.03 0.00 0.01 0.00 0.00 72.50 69.07 2iua s THR 194 CO 0.06 0.31 0.19 -0.94 -0.69 0.00 0.00 174.62 173.54 2iua s SER 195 N 1.56 0.12 -1.43 3.53 1.04 0.07 -4.85 113.70 113.75 2iua s SER 195 Ca 0.06 -1.25 -0.05 0.00 0.48 0.00 0.00 55.95 55.20 2iua s SER 195 Cb -0.15 0.41 0.03 0.00 0.10 0.00 0.00 66.02 66.41 2iua s SER 195 CO 0.07 -0.88 0.65 0.00 0.98 0.00 0.00 173.24 174.06 2iua n ALA 196 N -0.26 -1.79 -3.33 5.32 0.00 -1.26 -0.02 120.51 119.16 2iua n ALA 196 Ca -0.00 -0.12 -0.16 0.00 0.00 0.00 0.00 53.44 53.15 2iua n ALA 196 Cb 0.65 -2.40 0.05 0.00 0.00 0.00 0.00 19.45 17.75 2iua n ALA 196 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 2iua n PHE 197 N -4.41 -2.43 -1.45 0.00 0.99 -1.26 -3.93 117.46 104.96 2iua n PHE 197 Ca -0.20 0.82 0.00 0.00 -0.00 0.00 0.00 57.45 58.07 2iua n PHE 197 Cb 0.63 -3.91 0.00 0.00 -1.00 0.00 0.00 39.48 35.20 2iua n PHE 197 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 2iua n GLY 198 N -1.47 0.56 3.86 1.37 0.00 -1.17 -5.07 105.19 103.27 2iua n GLY 198 Ca -0.07 -0.82 -0.35 0.00 0.00 0.00 0.00 46.02 44.78 2iua n GLY 198 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2iua s GLN 199 N -3.01 3.83 -0.23 1.61 -0.21 0.97 -4.90 119.66 117.73 2iua s GLN 199 Ca 0.00 0.28 -0.04 0.00 0.02 0.00 0.00 55.36 55.62 2iua s GLN 199 Cb 0.00 -2.98 -0.01 0.00 1.00 0.00 0.00 33.01 31.02 2iua s GLN 199 CO 0.00 0.54 -0.02 -1.01 -2.12 0.00 0.00 175.29 172.67 2iua s HIS 200 N -1.41 2.99 -0.13 0.91 3.76 -1.26 -0.75 115.29 119.40 2iua s HIS 200 Ca 0.34 -0.95 -0.07 0.00 -0.15 0.00 0.00 55.06 54.23 2iua s HIS 200 Cb -0.14 -2.13 -0.04 0.00 1.11 0.00 0.00 32.58 31.38 2iua s HIS 200 CO 0.18 -0.55 0.13 0.15 -0.85 0.00 0.00 174.74 173.80 2iua s LYS 201 N 1.48 3.55 0.20 1.40 -0.14 0.39 -4.93 119.74 121.68 2iua s LYS 201 Ca 0.05 -0.16 -0.31 0.00 -1.36 0.00 0.00 55.97 54.19 2iua s LYS 201 Cb -0.15 -3.21 -0.10 0.00 -1.68 0.00 0.00 37.83 32.70 2iua s LYS 201 CO -0.02 0.69 1.46 -1.58 -0.76 0.00 0.00 175.35 175.14 2iua s HIS 202 N -0.77 3.08 -0.30 3.18 5.65 -1.26 -1.88 115.29 122.98 2iua s HIS 202 Ca 0.14 0.91 -0.04 0.00 0.25 0.00 0.00 55.06 56.31 2iua s HIS 202 Cb -0.12 -3.82 0.04 0.00 -1.18 0.00 0.00 32.58 27.50 2iua s HIS 202 CO 0.03 -2.81 0.03 -0.51 -0.65 0.00 0.00 174.74 170.83 2iua s LEU 203 N 0.32 3.89 -0.12 8.88 1.43 -1.23 -4.90 118.68 126.96 2iua s LEU 203 Ca 0.63 -1.10 -0.37 0.00 -1.03 0.00 0.00 54.13 52.26 2iua s LEU 203 Cb -0.41 -1.77 -0.14 0.00 0.03 0.00 0.00 46.19 43.90 2iua s LEU 203 CO 0.37 -0.25 1.74 0.29 0.23 0.00 0.00 176.35 178.74 2iua n LYS 204 N 4.71 1.68 -3.36 1.70 5.02 -1.26 -4.90 118.16 121.74 2iua n LYS 204 Ca -0.14 0.61 -0.39 0.00 -2.02 0.00 0.00 58.31 56.37 2iua n LYS 204 Cb 0.45 -2.37 -0.09 0.00 -0.02 0.00 0.00 35.03 33.00 2iua n LYS 204 CO 0.00 0.00 0.00 -1.01 -0.52 0.00 0.00 177.40 175.87 2iua s HIS 205 N 3.17 3.25 -0.00 2.13 3.76 -1.26 -4.91 115.29 121.42 2iua s HIS 205 Ca 0.93 0.44 0.00 0.00 -0.15 0.00 0.00 55.06 56.28 2iua s HIS 205 Cb -0.86 -2.61 0.00 0.00 1.11 0.00 0.00 32.58 30.22 2iua s HIS 205 CO 0.55 -0.25 0.79 1.28 -0.85 0.00 0.00 174.74 176.26 2iua n LEU 206 N 5.38 1.13 -4.80 0.89 4.77 0.04 -4.97 117.00 119.44 2iua n LEU 206 Ca -0.08 -1.15 -0.30 0.00 -0.03 0.00 0.00 56.01 54.45 2iua n LEU 206 Cb 0.50 -0.01 0.21 0.00 -2.33 0.00 0.00 43.42 41.80 2iua n LEU 206 CO 0.38 0.29 0.78 -0.83 -1.33 0.00 0.00 177.39 176.68 2iua s GLY 207 N -0.60 1.71 0.46 -0.72 0.00 -0.99 -4.80 107.32 102.38 2iua s GLY 207 Ca 0.00 -1.11 0.05 0.00 0.00 0.00 0.00 44.72 43.66 2iua s GLY 207 CO 0.00 -0.30 0.39 0.28 0.00 0.00 0.00 173.10 173.48 2iua n LYS 208 N -4.15 0.79 -4.90 2.90 5.02 -1.23 -4.52 118.16 112.07 2iua n LYS 208 Ca 0.15 -2.81 -0.28 0.00 -2.02 0.00 0.00 58.31 53.35 2iua n LYS 208 Cb 0.59 0.22 -0.17 0.00 -0.02 0.00 0.00 35.03 35.66 2iua n LYS 208 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2iua s VAL 209 N -2.22 1.58 -0.19 -0.18 1.01 -1.24 -2.18 120.40 116.97 2iua s VAL 209 Ca 0.30 -0.76 -0.03 0.00 0.00 0.00 0.00 61.98 61.49 2iua s VAL 209 Cb -0.02 -1.38 -0.02 0.00 0.00 0.00 0.00 36.38 34.96 2iua s VAL 209 CO 0.19 0.45 -0.05 -0.63 0.00 0.00 0.00 175.10 175.06 2iua s ILE 210 N 0.34 3.48 -0.24 2.22 1.09 0.16 -1.37 121.20 126.87 2iua s ILE 210 Ca -0.13 -0.48 -0.03 0.00 -1.10 0.00 0.00 60.65 58.92 2iua s ILE 210 Cb -0.15 -2.55 0.02 0.00 -1.06 0.00 0.00 42.46 38.71 2iua s ILE 210 CO 0.05 0.45 -0.05 -0.63 -0.10 0.00 0.00 174.94 174.67 2iua s ILE 211 N 1.01 3.08 0.92 2.92 -1.09 0.86 -1.47 121.20 127.42 2iua s ILE 211 Ca 0.00 -0.85 -0.14 0.00 -2.23 0.00 0.00 60.65 57.43 2iua s ILE 211 Cb -0.15 -2.51 0.16 0.00 -1.58 0.00 0.00 42.46 38.38 2iua s ILE 211 CO 0.00 0.26 1.24 -1.61 -1.23 0.00 0.00 174.94 173.60 2iua s GLU 212 N 1.38 1.04 0.67 2.79 2.02 -0.08 -0.78 118.70 125.74 2iua s GLU 212 Ca 0.02 -0.14 -0.17 0.00 0.02 0.00 0.00 54.97 54.70 2iua s GLU 212 Cb -0.16 -1.87 0.00 0.00 0.10 0.00 0.00 34.13 32.21 2iua s GLU 212 CO -0.04 -2.19 1.24 -0.25 0.02 0.00 0.00 175.26 174.04 2iua n ASP 213 N -3.67 1.74 -1.33 -0.19 8.00 -1.26 -3.35 116.55 116.48 2iua n ASP 213 Ca 0.12 0.78 -0.17 0.00 0.71 0.00 0.00 54.79 56.22 2iua n ASP 213 Cb 0.60 -1.53 -0.07 0.00 -0.02 0.00 0.00 41.12 40.10 2iua n ASP 213 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 2iua n ASP 214 N -2.02 -5.43 -4.79 -2.24 8.00 -0.94 -0.90 116.55 108.23 2iua n ASP 214 Ca 0.15 0.43 -0.38 0.00 0.71 0.00 0.00 54.79 55.70 2iua n ASP 214 Cb 0.48 -4.47 -0.06 0.00 -0.02 0.00 0.00 41.12 37.06 2iua n ASP 214 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2iua s VAL 215 N -2.53 4.40 -0.04 2.53 1.01 -1.21 -3.57 120.40 120.98 2iua s VAL 215 Ca 0.00 1.61 0.06 0.00 0.00 0.00 0.00 61.98 63.65 2iua s VAL 215 Cb 0.00 -4.05 -0.01 0.00 0.00 0.00 0.00 36.38 32.32 2iua s VAL 215 CO 0.00 0.40 -0.23 -1.61 0.00 0.00 0.00 175.10 173.66 2iua s GLU 216 N -1.47 2.12 -0.13 2.72 2.02 -0.41 -2.34 118.70 121.22 2iua s GLU 216 Ca 0.39 -0.82 0.01 0.00 0.02 0.00 0.00 54.97 54.58 2iua s GLU 216 Cb -0.21 -1.91 0.02 0.00 0.10 0.00 0.00 34.13 32.13 2iua s GLU 216 CO 0.25 0.41 -0.15 0.42 0.02 0.00 0.00 175.26 176.20 2iua s ILE 217 N -0.29 1.58 0.84 -1.63 1.01 -0.40 0.10 121.20 122.41 2iua s ILE 217 Ca 0.02 -0.67 -0.14 0.00 0.00 0.00 0.00 60.65 59.86 2iua s ILE 217 Cb -0.11 -1.45 0.20 0.00 0.01 0.00 0.00 42.46 41.11 2iua s ILE 217 CO 0.01 0.46 1.00 0.61 0.00 0.00 0.00 174.94 177.02 2iua n GLY 218 N 4.39 -1.84 3.75 6.18 0.00 0.26 -1.40 105.19 116.52 2iua n GLY 218 Ca -0.18 -1.63 -0.41 0.00 0.00 0.00 0.00 46.02 43.80 2iua n GLY 218 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2iua s ALA 219 N -3.67 3.43 -1.02 4.61 0.00 -1.26 -3.24 121.76 120.61 2iua s ALA 219 Ca 0.59 0.97 0.00 0.00 0.00 0.00 0.00 51.96 53.52 2iua s ALA 219 Cb -0.03 -3.37 0.00 0.00 0.00 0.00 0.00 23.12 19.72 2iua s ALA 219 CO 0.43 -0.29 0.00 0.09 0.00 0.00 0.00 175.76 175.98 2iua n ASN 220 N 1.47 -3.36 -4.83 0.00 3.02 -0.76 -1.49 115.26 109.32 2iua n ASN 220 Ca 0.00 0.24 -0.35 0.00 -0.03 0.00 0.00 54.58 54.44 2iua n ASN 220 Cb 0.44 -2.98 -0.06 0.00 -0.61 0.00 0.00 39.78 36.57 2iua n ASN 220 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 2iua s THR 221 N -2.34 4.69 -0.10 3.41 2.01 -1.20 -4.11 115.64 118.01 2iua s THR 221 Ca 0.00 1.08 0.04 0.00 0.31 0.00 0.00 61.69 63.12 2iua s THR 221 Cb 0.00 -3.79 -0.00 0.00 0.01 0.00 0.00 72.50 68.72 2iua s THR 221 CO 0.00 0.19 -0.23 0.42 -0.69 0.00 0.00 174.62 174.30 2iua s THR 222 N -1.54 2.12 -0.27 -0.82 -4.23 -0.38 -1.10 115.64 109.43 2iua s THR 222 Ca 0.42 -1.00 0.00 0.00 -1.18 0.00 0.00 61.69 59.93 2iua s THR 222 Cb -0.15 -1.81 0.08 0.00 1.34 0.00 0.00 72.50 71.95 2iua s THR 222 CO 0.20 0.56 0.02 -0.63 -0.54 0.00 0.00 174.62 174.23 2iua s ILE 223 N 0.31 1.31 0.52 2.99 1.01 -0.25 -0.80 121.20 126.28 2iua s ILE 223 Ca -0.18 -1.36 -0.18 0.00 0.00 0.00 0.00 60.65 58.94 2iua s ILE 223 Cb -0.18 -1.79 -0.07 0.00 0.01 0.00 0.00 42.46 40.43 2iua s ILE 223 CO 0.08 -0.37 1.01 -1.81 0.00 0.00 0.00 174.94 173.86 2iua s ASP 224 N 1.45 6.36 0.36 3.58 1.01 0.11 0.30 116.67 129.83 2iua s ASP 224 Ca 0.02 1.74 -0.13 0.00 0.71 0.00 0.00 52.55 54.89 2iua s ASP 224 Cb -0.18 -2.53 -0.08 0.00 1.01 0.00 0.00 42.92 41.14 2iua s ASP 224 CO -0.13 -0.77 0.75 0.00 0.21 0.00 0.00 175.17 175.23 2iua s ARG 225 N -3.77 3.89 1.16 8.23 1.70 0.10 -4.35 118.95 125.91 2iua s ARG 225 Ca 0.62 0.56 -0.14 0.00 -0.47 0.00 0.00 55.73 56.31 2iua s ARG 225 Cb -0.13 -2.42 0.28 0.00 -0.57 0.00 0.00 34.95 32.11 2iua s ARG 225 CO 0.28 0.07 1.03 0.20 -1.08 0.00 0.00 175.30 175.80 2iua s GLY 226 N -2.69 1.53 -0.00 3.88 0.00 -1.23 -3.47 107.32 105.33 2iua s GLY 226 Ca 0.53 -0.30 -0.21 0.00 0.00 0.00 0.00 44.72 44.73 2iua s GLY 226 CO 0.24 0.43 1.12 -0.09 0.00 0.00 0.00 173.10 174.81 2iua h ARG 227 N -2.56 0.35 0.00 2.90 2.43 -1.92 -2.61 114.38 112.97 2iua h ARG 227 Ca -0.59 -0.34 0.00 0.00 -0.81 0.00 0.00 59.98 58.24 2iua h ARG 227 Cb 1.34 0.09 0.00 0.00 -0.42 0.00 0.00 29.97 30.97 2iua h ARG 227 CO 0.50 1.00 0.00 1.97 -1.51 0.00 0.00 179.97 181.94 2iua n PHE 228 N -4.34 0.00 -1.27 2.20 -1.74 -1.26 -0.78 117.46 110.26 2iua n PHE 228 Ca -0.09 0.00 0.00 0.00 -0.56 0.00 0.00 57.45 56.80 2iua n PHE 228 Cb 0.58 0.00 0.00 0.00 1.52 0.00 0.00 39.48 41.58 2iua n PHE 228 CO 0.00 0.00 0.00 1.63 -0.56 0.00 0.00 176.76 177.83 2iua n LYS 229 N -0.53 0.15 -4.42 3.97 4.76 -1.26 -4.22 118.16 116.62 2iua n LYS 229 Ca 0.00 0.00 -0.27 0.00 -2.87 0.00 0.00 58.31 55.17 2iua n LYS 229 Cb 0.00 0.00 -0.13 0.00 -1.84 0.00 0.00 35.03 33.06 2iua n LYS 229 CO 0.00 0.00 0.00 -1.01 -1.37 0.00 0.00 177.40 175.02 2iua s HIS 230 N -0.71 2.05 -0.02 2.13 3.76 -1.26 -3.47 115.29 117.76 2iua s HIS 230 Ca 0.00 -0.40 -0.20 0.00 -0.15 0.00 0.00 55.06 54.32 2iua s HIS 230 Cb 0.00 -1.13 -0.05 0.00 1.11 0.00 0.00 32.58 32.50 2iua s HIS 230 CO 0.00 0.24 0.56 -1.12 -0.85 0.00 0.00 174.74 173.57 2iua s SER 231 N -1.83 6.92 -0.05 1.40 0.01 -0.93 -4.46 113.70 114.76 2iua s SER 231 Ca 0.10 1.09 -0.01 0.00 1.31 0.00 0.00 55.95 58.44 2iua s SER 231 Cb -0.10 -2.34 0.03 0.00 0.21 0.00 0.00 66.02 63.82 2iua s SER 231 CO 0.04 0.11 0.01 -0.69 0.41 0.00 0.00 173.24 173.12 2iua s VAL 232 N -0.14 0.20 -0.32 3.43 1.01 -0.56 0.35 120.40 124.37 2iua s VAL 232 Ca 0.30 0.17 -0.07 0.00 0.00 0.00 0.00 61.98 62.37 2iua s VAL 232 Cb -0.18 -0.35 0.02 0.00 0.00 0.00 0.00 36.38 35.87 2iua s VAL 232 CO 0.16 0.20 0.11 -0.69 0.00 0.00 0.00 175.10 174.87 2iua s VAL 233 N 1.62 4.01 0.73 2.92 1.01 -0.54 0.08 120.40 130.22 2iua s VAL 233 Ca -0.01 -0.83 -0.11 0.00 0.00 0.00 0.00 61.98 61.03 2iua s VAL 233 Cb -0.13 -3.15 0.03 0.00 0.00 0.00 0.00 36.38 33.13 2iua s VAL 233 CO -0.03 -0.03 1.07 -0.13 0.00 0.00 0.00 175.10 175.98 2iua s ARG 234 N 1.48 2.69 -0.01 2.72 1.81 -0.18 -0.91 118.95 126.55 2iua s ARG 234 Ca 0.01 0.83 -0.16 0.00 -1.72 0.00 0.00 55.73 54.70 2iua s ARG 234 Cb -0.18 -1.97 -0.08 0.00 -0.45 0.00 0.00 34.95 32.27 2iua s ARG 234 CO 0.03 -1.24 0.43 -1.91 -0.68 0.00 0.00 175.30 171.93 2iua n GLU 235 N -3.21 0.00 -0.94 3.54 2.13 -1.26 -2.59 120.64 118.31 2iua n GLU 235 Ca 0.07 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.89 2iua n GLU 235 Cb 0.54 -0.58 0.00 0.00 0.27 0.00 0.00 31.44 31.67 2iua n GLU 235 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2iua n GLY 236 N 0.64 0.23 3.80 8.31 0.00 -0.08 -1.20 105.19 116.89 2iua n GLY 236 Ca 0.08 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.74 2iua n GLY 236 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2iua s SER 237 N -2.07 7.20 -0.12 1.61 0.01 -1.07 -3.90 113.70 115.36 2iua s SER 237 Ca 0.00 1.76 0.02 0.00 1.31 0.00 0.00 55.95 59.05 2iua s SER 237 Cb 0.00 -2.56 0.01 0.00 0.21 0.00 0.00 66.02 63.69 2iua s SER 237 CO 0.00 -0.15 -0.18 -0.54 0.41 0.00 0.00 173.24 172.78 2iua s LYS 238 N -2.41 2.53 -0.11 12.44 -0.14 -0.51 -1.28 119.74 130.26 2iua s LYS 238 Ca 0.53 -0.68 0.03 0.00 -1.36 0.00 0.00 55.97 54.50 2iua s LYS 238 Cb -0.15 -2.08 -0.00 0.00 -1.68 0.00 0.00 37.83 33.91 2iua s LYS 238 CO 0.20 -0.03 -0.22 0.42 -0.76 0.00 0.00 175.35 174.97 2iua s ILE 239 N 0.87 2.21 0.00 2.17 1.01 0.29 -1.84 121.20 125.91 2iua s ILE 239 Ca -0.08 -0.96 0.00 0.00 0.00 0.00 0.00 60.65 59.61 2iua s ILE 239 Cb -0.15 -1.86 0.00 0.00 0.01 0.00 0.00 42.46 40.45 2iua s ILE 239 CO -0.01 0.55 0.00 -0.67 0.00 0.00 0.00 174.94 174.81 2iua n ASP 240 N 3.63 0.00 -4.94 3.58 -0.08 0.12 0.91 116.55 119.78 2iua n ASP 240 Ca -0.19 0.00 -0.24 0.00 -1.51 0.00 0.00 54.79 52.85 2iua n ASP 240 Cb 0.53 0.00 -0.02 0.00 2.34 0.00 0.00 41.12 43.97 2iua n ASP 240 CO 0.00 0.00 0.00 0.20 0.12 0.00 0.00 177.20 177.52 2iua s ASN 241 N -1.29 6.32 -1.63 1.67 0.01 -1.26 -1.69 114.94 117.07 2iua s ASN 241 Ca 0.00 0.45 -0.11 0.00 -0.71 0.00 0.00 52.86 52.48 2iua s ASN 241 Cb 0.00 -2.03 0.10 0.00 0.41 0.00 0.00 41.25 39.73 2iua s ASN 241 CO 0.00 -0.25 0.51 0.18 -1.51 0.00 0.00 177.10 176.03 2iua n LEU 242 N -1.59 -1.55 -4.90 0.60 7.99 -0.55 -1.41 117.00 115.59 2iua n LEU 242 Ca -0.05 -1.10 -0.32 0.00 -0.01 0.00 0.00 56.01 54.53 2iua n LEU 242 Cb 0.56 -1.95 -0.04 0.00 -0.11 0.00 0.00 43.42 41.88 2iua n LEU 242 CO 0.48 0.33 -0.16 -0.69 -1.51 0.00 0.00 177.39 175.84 2iua s VAL 243 N -3.66 5.33 -0.27 4.08 1.01 -1.26 -2.33 120.40 123.29 2iua s VAL 243 Ca 0.43 -0.34 -0.06 0.00 0.00 0.00 0.00 61.98 62.01 2iua s VAL 243 Cb -0.24 -3.56 0.01 0.00 0.00 0.00 0.00 36.38 32.58 2iua s VAL 243 CO 0.95 0.20 0.04 -1.58 0.00 0.00 0.00 175.10 174.72 2iua s GLN 244 N -2.30 3.14 -0.30 2.72 2.00 -0.85 -1.25 119.66 122.82 2iua s GLN 244 Ca 0.32 -0.81 -0.09 0.00 -2.00 0.00 0.00 55.36 52.78 2iua s GLN 244 Cb -0.13 -3.27 -0.01 0.00 0.80 0.00 0.00 33.01 30.41 2iua s GLN 244 CO 0.24 -0.38 0.14 0.42 -0.50 0.00 0.00 175.29 175.21 2iua s ILE 245 N 1.48 4.49 0.69 -2.34 -1.09 0.02 -1.82 121.20 122.63 2iua s ILE 245 Ca 0.03 -0.44 -0.07 0.00 -2.23 0.00 0.00 60.65 57.94 2iua s ILE 245 Cb -0.17 -3.28 0.05 0.00 -1.58 0.00 0.00 42.46 37.48 2iua s ILE 245 CO 0.01 0.09 1.01 0.00 -1.23 0.00 0.00 174.94 174.82 2iua s ALA 246 N 1.60 3.11 0.15 9.38 0.00 -1.04 -0.71 121.76 134.25 2iua s ALA 246 Ca 0.04 -0.80 -0.34 0.00 0.00 0.00 0.00 51.96 50.86 2iua s ALA 246 Cb -0.17 -2.67 -0.15 0.00 0.00 0.00 0.00 23.12 20.13 2iua s ALA 246 CO 0.06 -1.22 1.40 -2.39 0.00 0.00 0.00 175.76 173.60 2iua n HIS 247 N -2.90 1.83 -2.61 0.00 1.44 -1.26 -2.49 115.22 109.23 2iua n HIS 247 Ca 0.07 0.49 -0.15 0.00 -2.01 0.00 0.00 57.72 56.13 2iua n HIS 247 Cb 0.60 -2.41 -0.00 0.00 0.12 0.00 0.00 29.99 28.29 2iua n HIS 247 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2iua n GLN 248 N 2.60 -2.52 -2.30 -1.40 10.64 -1.26 -1.54 117.38 121.60 2iua n GLN 248 Ca 0.16 0.61 -0.41 0.00 -1.83 0.00 0.00 57.00 55.54 2iua n GLN 248 Cb 0.25 -5.25 -0.03 0.00 -0.86 0.00 0.00 30.24 24.35 2iua n GLN 248 CO 0.00 0.00 0.00 0.08 -1.83 0.00 0.00 177.06 175.31 2iua s VAL 249 N -2.71 3.21 -0.19 -0.39 1.01 -1.04 -4.12 120.40 116.16 2iua s VAL 249 Ca 0.07 1.13 -0.01 0.00 0.00 0.00 0.00 61.98 63.17 2iua s VAL 249 Cb -0.04 -3.72 0.00 0.00 0.00 0.00 0.00 36.38 32.62 2iua s VAL 249 CO 0.09 0.24 -0.12 -1.61 0.00 0.00 0.00 175.10 173.70 2iua s GLU 250 N -1.11 3.21 -0.14 2.72 2.02 -0.78 -1.49 118.70 123.13 2iua s GLU 250 Ca 0.49 -0.72 -0.03 0.00 0.02 0.00 0.00 54.97 54.73 2iua s GLU 250 Cb -0.35 -2.76 -0.03 0.00 0.10 0.00 0.00 34.13 31.09 2iua s GLU 250 CO 0.43 -0.14 -0.04 0.08 0.02 0.00 0.00 175.26 175.61 2iua s VAL 251 N 1.23 3.85 0.00 2.63 1.01 0.11 -0.16 120.40 129.07 2iua s VAL 251 Ca 0.03 -0.38 0.00 0.00 0.00 0.00 0.00 61.98 61.62 2iua s VAL 251 Cb -0.14 -2.67 0.00 0.00 0.00 0.00 0.00 36.38 33.57 2iua s VAL 251 CO -0.06 0.51 0.00 0.61 0.00 0.00 0.00 175.10 176.17 2iua n GLY 252 N 3.30 -3.14 3.89 4.51 0.00 0.23 -1.01 105.19 112.96 2iua n GLY 252 Ca -0.18 -1.29 -0.30 0.00 0.00 0.00 0.00 46.02 44.25 2iua n GLY 252 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2iua s GLN 253 N -1.74 3.72 -1.52 1.61 -0.21 -1.26 -3.33 119.66 116.94 2iua s GLN 253 Ca 0.00 0.16 -0.06 0.00 0.02 0.00 0.00 55.36 55.49 2iua s GLN 253 Cb 0.00 -2.64 0.05 0.00 1.00 0.00 0.00 33.01 31.42 2iua s GLN 253 CO 0.00 0.26 0.48 0.72 -2.12 0.00 0.00 175.29 174.63 2iua n HIS 254 N -0.52 -1.63 -4.23 0.91 8.25 -0.34 -1.37 115.22 116.28 2iua n HIS 254 Ca -0.00 0.75 -0.23 0.00 -0.26 0.00 0.00 57.72 57.97 2iua n HIS 254 Cb 0.53 -3.38 -0.07 0.00 1.12 0.00 0.00 29.99 28.19 2iua n HIS 254 CO 0.00 0.00 0.00 -1.12 0.64 0.00 0.00 176.34 175.86 2iua s SER 255 N -4.04 4.69 -0.08 0.41 0.01 -1.26 -2.68 113.70 110.76 2iua s SER 255 Ca 0.23 -0.62 0.01 0.00 1.31 0.00 0.00 55.95 56.88 2iua s SER 255 Cb -0.13 -0.89 0.02 0.00 0.21 0.00 0.00 66.02 65.23 2iua s SER 255 CO 0.91 -0.07 -0.09 -0.04 0.41 0.00 0.00 173.24 174.37 2iua s MET 256 N -3.73 1.43 -0.24 12.44 -1.94 0.45 -1.42 119.30 126.29 2iua s MET 256 Ca 0.33 -0.28 -0.04 0.00 -1.71 0.00 0.00 55.69 53.99 2iua s MET 256 Cb -0.06 -1.34 0.00 0.00 2.01 0.00 0.00 34.83 35.44 2iua s MET 256 CO 0.21 -0.11 -0.02 0.42 -0.01 0.00 0.00 175.02 175.51 2iua s ILE 257 N 1.13 3.40 0.68 2.53 1.01 -0.77 -0.43 121.20 128.76 2iua s ILE 257 Ca -0.06 -0.66 -0.08 0.00 0.00 0.00 0.00 60.65 59.84 2iua s ILE 257 Cb -0.14 -2.64 0.04 0.00 0.01 0.00 0.00 42.46 39.72 2iua s ILE 257 CO -0.01 0.29 1.02 -0.69 0.00 0.00 0.00 174.94 175.55 2iua s VAL 258 N 1.45 2.98 0.52 2.92 1.01 0.01 -0.70 120.40 128.59 2iua s VAL 258 Ca 0.04 0.04 -0.22 0.00 0.00 0.00 0.00 61.98 61.84 2iua s VAL 258 Cb -0.15 -3.26 -0.07 0.00 0.00 0.00 0.00 36.38 32.90 2iua s VAL 258 CO -0.02 -0.30 1.15 0.00 0.00 0.00 0.00 175.10 175.93 2iua n ALA 259 N -2.89 0.82 -0.81 5.51 0.00 -1.26 -2.82 120.51 119.06 2iua n ALA 259 Ca 0.07 0.12 0.00 0.00 0.00 0.00 0.00 53.44 53.63 2iua n ALA 259 Cb 0.59 -2.21 0.00 0.00 0.00 0.00 0.00 19.45 17.83 2iua n ALA 259 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2iua n GLN 260 N -0.65 -0.12 -1.56 0.00 6.02 -0.50 -1.26 117.38 119.31 2iua n GLN 260 Ca 0.11 0.03 -0.29 0.00 -0.01 0.00 0.00 57.00 56.83 2iua n GLN 260 Cb 0.44 -3.45 0.16 0.00 1.02 0.00 0.00 30.24 28.41 2iua n GLN 260 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2iua s ALA 261 N -2.52 1.70 -0.27 -1.58 0.00 -1.13 -3.88 121.76 114.08 2iua s ALA 261 Ca 0.00 -0.76 -0.20 0.00 0.00 0.00 0.00 51.96 51.00 2iua s ALA 261 Cb 0.00 -2.94 0.07 0.00 0.00 0.00 0.00 23.12 20.25 2iua s ALA 261 CO 0.00 -2.54 0.70 0.20 0.00 0.00 0.00 175.76 174.12 2iua s GLY 262 N -4.22 -0.59 -0.13 0.00 0.00 -0.17 -2.00 107.32 100.21 2iua s GLY 262 Ca 0.67 2.23 0.01 0.00 0.00 0.00 0.00 44.72 47.63 2iua s GLY 262 CO 0.54 2.09 -0.16 -0.42 0.00 0.00 0.00 173.10 175.15 2iua s ILE 263 N 1.04 2.74 0.75 0.90 1.09 -0.76 -1.14 121.20 125.83 2iua s ILE 263 Ca -0.05 -0.76 -0.09 0.00 -1.10 0.00 0.00 60.65 58.64 2iua s ILE 263 Cb -0.05 -2.14 0.07 0.00 -1.06 0.00 0.00 42.46 39.28 2iua s ILE 263 CO -0.10 0.53 1.10 0.00 -0.10 0.00 0.00 174.94 176.36 2iua s ALA 264 N 0.51 2.90 0.28 9.38 0.00 0.16 -2.48 121.76 132.51 2iua s ALA 264 Ca -0.10 -0.75 -0.30 0.00 0.00 0.00 0.00 51.96 50.81 2iua s ALA 264 Cb -0.16 -2.80 -0.13 0.00 0.00 0.00 0.00 23.12 20.03 2iua s ALA 264 CO 0.04 -1.46 1.26 0.41 0.00 0.00 0.00 175.76 176.02 2iua n GLY 265 N -3.11 0.44 2.19 0.00 0.00 -1.26 -3.66 105.19 99.79 2iua n GLY 265 Ca 0.08 0.40 -0.10 0.00 0.00 0.00 0.00 46.02 46.40 2iua n GLY 265 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2iua n SER 266 N 1.46 -3.36 -4.75 1.61 7.64 -0.59 -1.55 113.62 114.09 2iua n SER 266 Ca 0.09 -0.01 -0.36 0.00 1.01 0.00 0.00 58.87 59.60 2iua n SER 266 Cb 0.33 -2.62 -0.08 0.00 -1.01 0.00 0.00 64.21 60.83 2iua n SER 266 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 2iua s THR 267 N -2.50 4.95 -0.06 0.44 2.01 -1.24 -3.36 115.64 115.89 2iua s THR 267 Ca 0.00 0.01 -0.17 0.00 0.31 0.00 0.00 61.69 61.84 2iua s THR 267 Cb -0.00 -3.16 -0.05 0.00 0.01 0.00 0.00 72.50 69.30 2iua s THR 267 CO 0.00 0.57 0.46 -0.54 -0.69 0.00 0.00 174.62 174.41 2iua s LYS 268 N -0.56 4.18 -0.10 4.92 3.01 -0.24 -1.87 119.74 129.08 2iua s LYS 268 Ca 0.11 0.45 0.01 0.00 -1.01 0.00 0.00 55.97 55.53 2iua s LYS 268 Cb -0.12 -3.34 0.02 0.00 -1.01 0.00 0.00 37.83 33.38 2iua s LYS 268 CO 0.02 0.39 -0.11 0.42 0.51 0.00 0.00 175.35 176.58 2iua s ILE 269 N -0.13 1.20 0.58 2.17 1.01 0.77 -1.55 121.20 125.26 2iua s ILE 269 Ca 0.25 -0.45 -0.10 0.00 0.00 0.00 0.00 60.65 60.35 2iua s ILE 269 Cb -0.16 -1.15 0.13 0.00 0.01 0.00 0.00 42.46 41.30 2iua s ILE 269 CO 0.12 0.39 0.79 0.61 0.00 0.00 0.00 174.94 176.85 2iua n GLY 270 N 4.42 -1.32 3.76 6.18 0.00 -0.22 0.74 105.19 118.74 2iua n GLY 270 Ca -0.18 -1.70 -0.33 0.00 0.00 0.00 0.00 46.02 43.81 2iua n GLY 270 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2iua s ASN 271 N -3.90 4.82 -1.51 1.61 0.01 -1.26 -3.61 114.94 111.10 2iua s ASN 271 Ca 0.45 2.10 0.00 0.00 -0.71 0.00 0.00 52.86 54.70 2iua s ASN 271 Cb -0.01 -2.56 0.00 0.00 0.41 0.00 0.00 41.25 39.09 2iua s ASN 271 CO 0.31 -1.83 0.00 1.41 -1.51 0.00 0.00 177.10 175.48 2iua n HIS 272 N -2.53 -0.98 -3.35 2.20 8.25 -0.47 -1.90 115.22 116.44 2iua n HIS 272 Ca 0.11 0.00 -0.34 0.00 -0.26 0.00 0.00 57.72 57.23 2iua n HIS 272 Cb 0.51 -3.30 -0.06 0.00 1.12 0.00 0.00 29.99 28.27 2iua n HIS 272 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 2iua s VAL 273 N -2.74 4.86 -0.11 1.59 1.01 -1.25 -3.54 120.40 120.21 2iua s VAL 273 Ca 0.00 0.74 0.00 0.00 0.00 0.00 0.00 61.98 62.72 2iua s VAL 273 Cb 0.00 -3.69 0.02 0.00 0.00 0.00 0.00 36.38 32.71 2iua s VAL 273 CO 0.00 0.11 -0.09 -0.63 0.00 0.00 0.00 175.10 174.49 2iua s ILE 274 N -1.62 1.13 -0.41 2.22 1.01 -0.10 -0.41 121.20 123.02 2iua s ILE 274 Ca 0.42 -0.37 -0.12 0.00 0.00 0.00 0.00 60.65 60.58 2iua s ILE 274 Cb -0.13 -1.11 0.05 0.00 0.01 0.00 0.00 42.46 41.28 2iua s ILE 274 CO 0.20 0.38 0.27 -0.63 0.00 0.00 0.00 174.94 175.16 2iua s ILE 275 N 1.51 4.65 0.93 2.92 1.01 0.43 -0.50 121.20 132.15 2iua s ILE 275 Ca 0.02 -1.07 -0.11 0.00 0.00 0.00 0.00 60.65 59.49 2iua s ILE 275 Cb -0.13 -3.72 0.15 0.00 0.01 0.00 0.00 42.46 38.77 2iua s ILE 275 CO -0.07 -0.40 1.09 -0.83 0.00 0.00 0.00 174.94 174.73 2iua s GLY 276 N 1.96 1.62 0.53 6.18 0.00 0.15 -0.81 107.32 116.95 2iua s GLY 276 Ca 0.03 0.01 -0.21 0.00 0.00 0.00 0.00 44.72 44.55 2iua s GLY 276 CO 0.05 0.52 1.12 0.61 0.00 0.00 0.00 173.10 175.40 2iua n GLY 277 N -0.74 0.10 2.98 0.20 0.00 -1.26 -3.54 105.19 102.93 2iua n GLY 277 Ca 0.07 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.87 2iua n GLY 277 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2iua n GLN 278 N -0.64 -4.56 -3.86 1.61 6.02 -0.39 -0.43 117.38 115.14 2iua n GLN 278 Ca 0.11 0.90 -0.21 0.00 -0.01 0.00 0.00 57.00 57.79 2iua n GLN 278 Cb 0.44 -5.74 -0.02 0.00 1.02 0.00 0.00 30.24 25.94 2iua n GLN 278 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2iua s ALA 279 N -3.16 3.93 -0.00 -1.58 0.00 -1.23 -3.41 121.76 116.31 2iua s ALA 279 Ca 0.28 -1.37 0.02 0.00 0.00 0.00 0.00 51.96 50.89 2iua s ALA 279 Cb -0.13 -1.57 -0.01 0.00 0.00 0.00 0.00 23.12 21.42 2iua s ALA 279 CO 0.35 0.15 -0.07 0.20 0.00 0.00 0.00 175.76 176.39 2iua s GLY 280 N -4.00 0.33 -0.09 0.00 0.00 -0.04 -1.00 107.32 102.52 2iua s GLY 280 Ca 0.37 -0.32 0.00 0.00 0.00 0.00 0.00 44.72 44.77 2iua s GLY 280 CO 0.28 -0.29 -0.08 -0.42 0.00 0.00 0.00 173.10 172.60 2iua s ILE 281 N -0.26 0.97 1.03 0.90 1.01 -0.29 0.02 121.20 124.58 2iua s ILE 281 Ca 0.01 -0.30 -0.13 0.00 0.00 0.00 0.00 60.65 60.23 2iua s ILE 281 Cb -0.03 -0.97 0.21 0.00 0.01 0.00 0.00 42.46 41.68 2iua s ILE 281 CO -0.00 0.34 1.08 0.42 0.00 0.00 0.00 174.94 176.79 2iua s THR 282 N 1.34 2.03 0.78 2.92 -4.23 -0.92 0.39 115.64 117.95 2iua s THR 282 Ca -0.02 0.01 -0.12 0.00 -1.18 0.00 0.00 61.69 60.38 2iua s THR 282 Cb -0.14 -2.45 0.06 0.00 1.34 0.00 0.00 72.50 71.32 2iua s THR 282 CO -0.04 -0.01 1.12 -0.83 -0.54 0.00 0.00 174.62 174.32 2iua s GLY 283 N -3.34 1.61 -1.47 3.99 0.00 -1.26 -4.31 107.32 102.54 2iua s GLY 283 Ca 0.66 -0.37 -0.11 0.00 0.00 0.00 0.00 44.72 44.89 2iua s GLY 283 CO 0.59 0.06 1.03 1.42 0.00 0.00 0.00 173.10 176.19 2iua n HIS 284 N -3.30 -2.45 -4.50 1.90 8.25 -0.59 -4.90 115.22 109.63 2iua n HIS 284 Ca 0.07 0.94 -0.26 0.00 -0.26 0.00 0.00 57.72 58.21 2iua n HIS 284 Cb 0.58 -4.32 -0.07 0.00 1.12 0.00 0.00 29.99 27.30 2iua n HIS 284 CO 0.00 0.00 0.00 0.44 0.64 0.00 0.00 176.34 177.42 2iua n ILE 285 N -4.75 0.00 -4.35 1.59 -5.35 -1.26 -4.97 119.36 100.28 2iua n ILE 285 Ca 0.01 -2.47 -0.19 0.00 -0.27 0.00 0.00 62.75 59.82 2iua n ILE 285 Cb 0.55 0.91 -0.14 0.00 -1.74 0.00 0.00 39.64 39.22 2iua n ILE 285 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2iua s ILE 287 N -0.62 2.29 1.05 0.00 -1.09 -0.59 -1.09 121.20 121.13 2iua s ILE 287 Ca 0.01 -1.36 -0.12 0.00 -2.23 0.00 0.00 60.65 56.95 2iua s ILE 287 Cb -0.06 -2.23 0.19 0.00 -1.58 0.00 0.00 42.46 38.78 2iua s ILE 287 CO 0.00 0.14 0.90 0.00 -1.23 0.00 0.00 174.94 174.76 2iua n ALA 288 N 4.52 -2.17 -1.44 9.38 0.00 -0.30 -1.06 120.51 129.44 2iua n ALA 288 Ca -0.16 -0.88 -0.36 0.00 0.00 0.00 0.00 53.44 52.03 2iua n ALA 288 Cb 0.45 -2.01 0.08 0.00 0.00 0.00 0.00 19.45 17.96 2iua n ALA 288 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2iua n ASP 289 N -3.97 0.56 -1.72 0.00 9.92 -1.26 -3.75 116.55 116.33 2iua n ASP 289 Ca 0.07 0.71 -0.16 0.00 -0.53 0.00 0.00 54.79 54.88 2iua n ASP 289 Cb 0.54 -1.40 -0.02 0.00 -0.64 0.00 0.00 41.12 39.60 2iua n ASP 289 CO 0.00 0.00 0.00 1.41 0.13 0.00 0.00 177.20 178.74 2iua n HIS 290 N -2.28 -0.64 -3.56 1.24 8.25 -0.80 -4.30 115.22 113.13 2iua n HIS 290 Ca 0.13 0.00 -0.38 0.00 -0.26 0.00 0.00 57.72 57.22 2iua n HIS 290 Cb 0.49 -3.18 -0.06 0.00 1.12 0.00 0.00 29.99 28.36 2iua n HIS 290 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 2iua s VAL 291 N -2.76 5.17 -0.18 1.59 1.01 -1.25 -2.96 120.40 121.03 2iua s VAL 291 Ca 0.00 0.68 0.00 0.00 0.00 0.00 0.00 61.98 62.67 2iua s VAL 291 Cb 0.00 -3.65 0.01 0.00 0.00 0.00 0.00 36.38 32.74 2iua s VAL 291 CO 0.00 0.54 -0.17 -0.63 0.00 0.00 0.00 175.10 174.84 2iua s ILE 292 N -0.69 2.35 -0.21 2.22 1.01 -0.72 -0.92 121.20 124.25 2iua s ILE 292 Ca 0.21 -0.85 -0.06 0.00 0.00 0.00 0.00 60.65 59.96 2iua s ILE 292 Cb -0.15 -2.00 -0.03 0.00 0.01 0.00 0.00 42.46 40.29 2iua s ILE 292 CO 0.10 0.52 0.02 -0.04 0.00 0.00 0.00 174.94 175.53 2iua s MET 293 N 1.22 3.63 0.84 2.79 -1.94 0.35 0.09 119.30 126.28 2iua s MET 293 Ca 0.03 -0.51 -0.11 0.00 -1.71 0.00 0.00 55.69 53.39 2iua s MET 293 Cb -0.14 -3.13 0.10 0.00 2.01 0.00 0.00 34.83 33.67 2iua s MET 293 CO -0.09 -0.03 1.11 -1.64 -0.01 0.00 0.00 175.02 174.36 2iua s MET 294 N 1.12 1.66 0.43 2.03 -1.94 0.22 0.32 119.30 123.14 2iua s MET 294 Ca 0.03 1.24 -0.23 0.00 -1.71 0.00 0.00 55.69 55.02 2iua s MET 294 Cb -0.14 -1.82 -0.11 0.00 2.01 0.00 0.00 34.83 34.76 2iua s MET 294 CO 0.02 -2.08 0.81 0.00 -0.01 0.00 0.00 175.02 173.75 2iua n ALA 295 N -3.83 -0.56 -1.14 3.03 0.00 -1.26 -2.25 120.51 114.50 2iua n ALA 295 Ca 0.10 0.19 -0.05 0.00 0.00 0.00 0.00 53.44 53.68 2iua n ALA 295 Cb 0.53 -1.95 -0.02 0.00 0.00 0.00 0.00 19.45 18.01 2iua n ALA 295 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2iua n GLN 296 N 0.27 -1.13 -1.96 0.00 6.02 0.43 -4.80 117.38 116.21 2iua n GLN 296 Ca 0.11 0.55 -0.39 0.00 -0.01 0.00 0.00 57.00 57.25 2iua n GLN 296 Cb 0.39 -4.53 0.01 0.00 1.02 0.00 0.00 30.24 27.14 2iua n GLN 296 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.06 177.04 2iua s THR 297 N -1.77 2.42 -0.30 5.09 2.01 -0.95 -4.63 115.64 117.51 2iua s THR 297 Ca 0.00 0.36 0.01 0.00 0.31 0.00 0.00 61.69 62.37 2iua s THR 297 Cb 0.00 -3.20 0.09 0.00 0.01 0.00 0.00 72.50 69.40 2iua s THR 297 CO 0.00 0.04 0.04 -0.83 -0.69 0.00 0.00 174.62 173.18 2iua s GLY 298 N -0.80 1.45 -0.19 4.40 0.00 -0.62 -0.86 107.32 110.70 2iua s GLY 298 Ca 0.62 -1.91 -0.16 0.00 0.00 0.00 0.00 44.72 43.26 2iua s GLY 298 CO 0.49 1.18 0.42 0.14 0.00 0.00 0.00 173.10 175.33 2iua s VAL 299 N 1.29 5.19 -0.04 1.40 1.01 0.10 -1.07 120.40 128.28 2iua s VAL 299 Ca 0.06 0.75 0.11 0.00 0.00 0.00 0.00 61.98 62.90 2iua s VAL 299 Cb -0.18 -3.75 -0.17 0.00 0.00 0.00 0.00 36.38 32.28 2iua s VAL 299 CO -0.14 0.25 0.20 0.35 0.00 0.00 0.00 175.10 175.76 2iua n THR 300 N 4.28 0.18 -4.17 3.92 -2.24 -1.26 -2.16 114.28 112.83 2iua n THR 300 Ca -0.08 -0.31 -0.11 0.00 -2.27 0.00 0.00 64.05 61.29 2iua n THR 300 Cb 0.51 -0.00 -0.10 0.00 -2.10 0.00 0.00 70.33 68.64 2iua n THR 300 CO 0.00 0.00 0.00 -1.59 -0.57 0.00 0.00 175.07 172.91 2iua s LYS 301 N -2.66 1.05 0.69 -0.78 -2.85 -1.26 -4.88 119.74 109.05 2iua s LYS 301 Ca -0.04 -1.52 -0.17 0.00 -1.00 0.00 0.00 55.97 53.24 2iua s LYS 301 Cb 0.06 0.26 -0.01 0.00 -2.06 0.00 0.00 37.83 36.08 2iua s LYS 301 CO 0.46 -0.32 0.99 0.43 0.10 0.00 0.00 175.35 177.01 2iua n SER 302 N -0.17 0.64 -4.23 0.03 7.64 -1.26 -4.88 113.62 111.39 2iua n SER 302 Ca -0.02 0.71 -0.33 0.00 1.01 0.00 0.00 58.87 60.24 2iua n SER 302 Cb 0.65 -1.41 -0.16 0.00 -1.01 0.00 0.00 64.21 62.28 2iua n SER 302 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 2iua s ILE 303 N -1.71 2.51 -0.21 0.44 1.01 -0.25 -4.98 121.20 118.01 2iua s ILE 303 Ca 0.75 -0.82 0.12 0.00 0.00 0.00 0.00 60.65 60.70 2iua s ILE 303 Cb -0.36 -2.05 -0.17 0.00 0.01 0.00 0.00 42.46 39.89 2iua s ILE 303 CO 0.49 0.52 0.35 0.35 0.00 0.00 0.00 174.94 176.65 2iua n THR 304 N 4.15 0.00 -4.41 2.92 -2.24 -1.26 -1.15 114.28 112.28 2iua n THR 304 Ca -0.19 -0.26 -0.25 0.00 -2.27 0.00 0.00 64.05 61.08 2iua n THR 304 Cb 0.51 0.50 -0.13 0.00 -2.10 0.00 0.00 70.33 69.11 2iua n THR 304 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2iua s SER 305 N -2.94 2.55 1.19 3.42 1.04 -1.26 -4.74 113.70 112.96 2iua s SER 305 Ca -0.01 -0.63 -0.16 0.00 0.48 0.00 0.00 55.95 55.62 2iua s SER 305 Cb 0.08 -0.17 0.28 0.00 0.10 0.00 0.00 66.02 66.32 2iua s SER 305 CO 0.50 0.10 1.04 -2.84 0.98 0.00 0.00 173.24 173.02 2iua s PRO 306 N -1.66 -1.11 0.00 4.02 0.02 -1.26 -4.89 135.00 130.12 2iua s PRO 306 Ca 0.07 0.36 0.00 0.00 0.02 0.00 0.00 61.00 61.45 2iua s PRO 306 Cb -0.10 -1.57 0.00 0.00 0.02 0.00 0.00 34.50 32.85 2iua s PRO 306 CO 0.03 -3.73 0.00 0.41 -0.33 0.00 0.00 177.00 173.39 2iua n GLY 307 N -0.02 1.07 3.78 0.52 0.00 -1.15 -4.96 105.19 104.42 2iua n GLY 307 Ca 0.08 -2.29 -0.39 0.00 0.00 0.00 0.00 46.02 43.42 2iua n GLY 307 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2iua s ILE 308 N -1.14 4.75 0.06 -0.61 -1.09 -1.26 -1.75 121.20 120.16 2iua s ILE 308 Ca 0.00 1.34 0.03 0.00 -2.23 0.00 0.00 60.65 59.79 2iua s ILE 308 Cb 0.00 -3.97 -0.03 0.00 -1.58 0.00 0.00 42.46 36.88 2iua s ILE 308 CO 0.00 0.48 -0.10 -0.31 -1.23 0.00 0.00 174.94 173.78 2iua s TYR 309 N -0.67 0.90 0.21 3.97 1.51 0.11 -1.33 117.35 122.05 2iua s TYR 309 Ca 0.32 -0.55 -0.05 0.00 -1.01 0.00 0.00 57.07 55.77 2iua s TYR 309 Cb -0.20 -0.52 0.02 0.00 -0.11 0.00 0.00 41.96 41.16 2iua s TYR 309 CO 0.20 -0.04 0.37 0.41 -1.11 0.00 0.00 175.55 175.38 2iua n GLY 310 N 1.12 1.89 0.42 0.71 0.00 -0.98 -0.61 105.19 107.74 2iua n GLY 310 Ca -0.20 -1.29 0.06 0.00 0.00 0.00 0.00 46.02 44.58 2iua n GLY 310 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2iua n GLY 311 N -0.31 -1.70 2.73 -0.02 0.00 -1.26 -1.76 105.19 102.87 2iua n GLY 311 Ca -0.03 -1.41 -0.19 0.00 0.00 0.00 0.00 46.02 44.39 2iua n GLY 311 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2iua s ALA 312 N -1.71 -0.25 0.61 4.61 0.00 -1.26 -1.59 121.76 122.17 2iua s ALA 312 Ca 0.00 -0.19 -0.16 0.00 0.00 0.00 0.00 51.96 51.61 2iua s ALA 312 Cb 0.00 -1.56 -0.02 0.00 0.00 0.00 0.00 23.12 21.54 2iua s ALA 312 CO 0.00 -1.51 1.09 -2.14 0.00 0.00 0.00 175.76 173.21 2iua s PRO 313 N 2.31 3.08 0.33 0.00 0.02 -1.26 -4.95 135.00 134.53 2iua s PRO 313 Ca 0.08 1.36 -0.29 0.00 0.02 0.00 0.00 61.00 62.17 2iua s PRO 313 Cb -0.15 -1.99 -0.11 0.00 0.02 0.00 0.00 34.50 32.27 2iua s PRO 313 CO -0.25 -1.02 1.49 0.00 -0.33 0.00 0.00 177.00 176.89 2iua s ALA 314 N -2.28 3.63 0.15 -1.55 0.00 -0.23 -4.89 121.76 116.58 2iua s ALA 314 Ca 0.67 1.50 0.01 0.00 0.00 0.00 0.00 51.96 54.13 2iua s ALA 314 Cb -0.19 -3.60 -0.04 0.00 0.00 0.00 0.00 23.12 19.29 2iua s ALA 314 CO 0.37 -0.94 0.01 1.03 0.00 0.00 0.00 175.76 176.24 2iua s ARG 315 N -1.32 1.02 0.70 0.00 1.81 -0.72 -4.87 118.95 115.56 2iua s ARG 315 Ca 0.56 -1.48 -0.16 0.00 -1.72 0.00 0.00 55.73 52.93 2iua s ARG 315 Cb -0.45 -0.10 -0.04 0.00 -0.45 0.00 0.00 34.95 33.92 2iua s ARG 315 CO 0.54 -0.16 0.64 -2.30 -0.68 0.00 0.00 175.30 173.35 2iua n PRO 316 N -0.17 0.40 -0.12 3.54 -0.02 -1.26 -2.32 135.00 135.05 2iua n PRO 316 Ca -0.07 0.18 -0.08 0.00 -2.02 0.00 0.00 63.50 61.51 2iua n PRO 316 Cb 0.63 -1.91 -0.00 0.00 -0.02 0.00 0.00 33.50 32.19 2iua n PRO 316 CO 0.00 0.00 0.00 -0.92 1.98 0.00 0.00 175.50 176.56 2iua h TYR 317 N -0.23 0.51 -0.88 6.00 3.20 -1.55 -2.29 116.97 121.74 2iua h TYR 317 Ca -0.46 0.00 0.19 0.00 3.14 0.00 0.00 58.73 61.60 2iua h TYR 317 Cb 1.35 -0.17 -0.16 0.00 1.54 0.00 0.00 36.73 39.29 2iua h TYR 317 CO 0.35 0.36 -0.15 0.37 -1.64 0.00 0.00 178.16 177.45 2iua h GLN 318 N 0.51 0.01 0.26 1.82 -0.00 -1.90 -1.69 115.11 114.12 2iua h GLN 318 Ca 0.14 -0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.79 2iua h GLN 318 Cb -0.00 -0.00 -0.03 0.00 0.00 0.00 0.00 27.48 27.45 2iua h GLN 318 CO -0.03 0.01 -0.31 1.49 0.00 0.00 0.00 178.83 180.00 2iua h GLU 319 N 0.02 -0.59 0.00 1.69 4.57 -1.76 -2.02 114.58 116.48 2iua h GLU 319 Ca 0.45 0.04 0.00 0.00 -1.18 0.00 0.00 59.36 58.67 2iua h GLU 319 Cb 0.74 0.13 0.00 0.00 -0.16 0.00 0.00 28.75 29.46 2iua h GLU 319 CO -0.87 -0.40 0.00 -0.84 -1.18 0.00 0.00 179.01 175.72 2iua h ILE 320 N -0.62 0.00 -0.05 2.32 -0.00 -1.38 -0.97 117.51 116.82 2iua h ILE 320 Ca -0.00 -0.50 -0.04 0.00 -0.00 0.00 0.00 64.86 64.31 2iua h ILE 320 Cb 0.58 1.43 0.00 0.00 -0.00 0.00 0.00 36.82 38.83 2iua h ILE 320 CO -0.09 0.00 -0.14 -0.74 -0.00 0.00 0.00 178.15 177.18 2iua h HIS 321 N 0.00 0.24 -0.62 0.16 2.76 -1.09 -1.03 115.15 115.58 2iua h HIS 321 Ca 0.00 -0.09 0.00 0.00 -2.20 0.00 0.00 60.37 58.08 2iua h HIS 321 Cb 0.55 -0.04 -0.03 0.00 1.55 0.00 0.00 27.41 29.44 2iua h HIS 321 CO 0.00 0.75 0.40 0.00 -1.30 0.00 0.00 177.93 177.78 2iua h ARG 322 N -0.34 0.82 0.44 5.26 2.47 -1.10 -2.75 114.38 119.18 2iua h ARG 322 Ca -0.00 -0.06 -0.01 0.00 -1.26 0.00 0.00 59.98 58.65 2iua h ARG 322 Cb 0.75 -0.18 -0.02 0.00 -1.65 0.00 0.00 29.97 28.87 2iua h ARG 322 CO 0.03 0.55 -0.38 1.96 0.56 0.00 0.00 179.97 182.69 2iua h GLN 323 N 0.84 -0.79 -1.01 0.04 4.20 -1.19 0.30 115.11 117.50 2iua h GLN 323 Ca 0.23 0.05 0.23 0.00 0.06 0.00 0.00 58.65 59.22 2iua h GLN 323 Cb -0.08 0.18 -0.10 0.00 0.30 0.00 0.00 27.48 27.78 2iua h GLN 323 CO -0.05 -0.53 0.63 0.28 -0.67 0.00 0.00 178.83 178.49 2iua h VAL 324 N -0.82 0.60 -0.08 -0.54 2.07 -1.19 0.73 116.25 117.03 2iua h VAL 324 Ca -0.04 -0.19 -0.06 0.00 0.82 0.00 0.00 66.70 67.23 2iua h VAL 324 Cb 0.72 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.49 2iua h VAL 324 CO -0.03 0.10 -0.18 0.00 0.02 0.00 0.00 177.57 177.48 2iua h ALA 325 N 1.65 0.12 -0.42 1.67 0.00 -1.00 -0.44 119.26 120.85 2iua h ALA 325 Ca 0.59 -0.37 -0.11 0.00 0.00 0.00 0.00 54.91 55.02 2iua h ALA 325 Cb 1.22 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.98 2iua h ALA 325 CO -0.35 0.06 -0.17 0.87 0.00 0.00 0.00 179.25 179.66 2iua h LYS 326 N -0.23 0.80 0.08 0.00 1.79 0.42 0.14 116.57 119.57 2iua h LYS 326 Ca -0.00 -0.30 0.00 0.00 -2.18 0.00 0.00 60.65 58.17 2iua h LYS 326 Cb 0.78 -0.05 -0.01 0.00 -1.58 0.00 0.00 32.23 31.38 2iua h LYS 326 CO 0.04 0.92 -0.08 0.28 -1.08 0.00 0.00 179.45 179.53 2iua h VAL 327 N 0.71 0.83 -0.53 0.50 2.07 -0.90 -2.76 116.25 116.17 2iua h VAL 327 Ca 0.11 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.63 2iua h VAL 327 Cb 0.68 0.83 -0.03 0.00 -1.52 0.00 0.00 31.29 31.25 2iua h VAL 327 CO 0.05 0.00 0.34 -0.09 0.02 0.00 0.00 177.57 177.89 2iua h ARG 328 N -0.17 0.70 -0.54 1.57 2.43 -0.64 -1.64 114.38 116.08 2iua h ARG 328 Ca 0.00 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.13 2iua h ARG 328 Cb 0.17 -0.16 0.00 0.00 -0.42 0.00 0.00 29.97 29.56 2iua h ARG 328 CO -0.02 0.47 0.00 -1.71 -1.51 0.00 0.00 179.97 177.20 2iua n ASN 329 N -4.45 0.96 -0.11 -3.80 5.15 0.45 -4.34 115.26 109.13 2iua n ASN 329 Ca 0.05 -2.05 -0.09 0.00 -0.60 0.00 0.00 54.58 51.88 2iua n ASN 329 Cb 0.05 -0.30 -0.02 0.00 -0.53 0.00 0.00 39.78 38.99 2iua n ASN 329 CO 0.00 0.00 0.00 -0.07 1.40 0.00 0.00 177.26 178.59 2iua h LEU 330 N 0.42 0.45 -0.43 1.20 3.38 -1.06 -1.21 115.31 118.06 2iua h LEU 330 Ca 0.00 -0.15 -0.01 0.00 0.09 0.00 0.00 57.88 57.80 2iua h LEU 330 Cb 0.39 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.00 2iua h LEU 330 CO 0.03 0.48 0.22 -0.65 0.09 0.00 0.00 178.44 178.60 2iua h PRO 331 N 0.40 0.61 0.00 1.13 0.11 -1.84 0.06 132.00 132.47 2iua h PRO 331 Ca 0.11 -0.08 0.00 0.00 0.11 0.00 0.00 66.00 66.14 2iua h PRO 331 Cb 0.16 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 31.16 2iua h PRO 331 CO -0.01 0.51 0.00 -2.13 -0.21 0.00 0.00 178.00 176.16 2iua n ARG 332 N -4.69 0.12 -0.02 1.05 0.63 -1.15 0.25 116.66 112.86 2iua n ARG 332 Ca 0.01 0.44 -0.02 0.00 -0.92 0.00 0.00 57.85 57.35 2iua n ARG 332 Cb 0.10 -1.77 -0.12 0.00 0.45 0.00 0.00 32.46 31.12 2iua n ARG 332 CO 0.00 0.00 0.00 -0.11 -2.51 0.00 0.00 177.63 175.01 2iua n LEU 333 N -2.00 0.50 0.05 6.15 7.94 -0.47 -3.83 117.00 125.35 2iua n LEU 333 Ca 0.01 0.22 -0.08 0.00 -1.11 0.00 0.00 56.01 55.06 2iua n LEU 333 Cb 0.15 0.19 -0.12 0.00 0.53 0.00 0.00 43.42 44.17 2iua n LEU 333 CO 0.14 0.25 0.05 -0.08 -1.11 0.00 0.00 177.39 176.64 2iua h GLU 334 N 0.00 0.01 -0.38 1.96 4.81 0.78 -3.21 114.58 118.56 2iua h GLU 334 Ca -0.26 -0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 58.94 2iua h GLU 334 Cb 1.73 0.01 -0.02 0.00 0.63 0.00 0.00 28.75 31.10 2iua h GLU 334 CO 0.04 0.96 0.19 1.49 -0.73 0.00 0.00 179.01 180.96 2iua h GLU 335 N 0.00 0.51 0.00 1.92 4.57 -0.35 -1.06 114.58 120.17 2iua h GLU 335 Ca -0.05 -0.05 0.00 0.00 -1.18 0.00 0.00 59.36 58.08 2iua h GLU 335 Cb 1.81 -0.11 0.00 0.00 -0.16 0.00 0.00 28.75 30.29 2iua h GLU 335 CO 0.13 0.39 0.00 0.54 -1.18 0.00 0.00 179.01 178.89 2iua n ARG 336 N -4.43 0.17 0.00 1.92 1.74 -1.21 -1.77 116.66 113.07 2iua n ARG 336 Ca 0.02 0.14 0.06 0.00 -0.77 0.00 0.00 57.85 57.30 2iua n ARG 336 Cb 0.10 -1.50 -0.07 0.00 -1.02 0.00 0.00 32.46 29.98 2iua n ARG 336 CO 0.00 0.00 0.00 -0.89 -1.52 0.00 0.00 177.63 175.22 2iua n ILE 337 N -1.37 0.00 0.23 0.55 5.41 -0.47 -2.70 119.36 121.00 2iua n ILE 337 Ca 0.07 -0.22 0.12 0.00 1.00 0.00 0.00 62.75 63.72 2iua n ILE 337 Cb 0.17 1.00 0.38 0.00 -0.71 0.00 0.00 39.64 40.48 2iua n ILE 337 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2iua h ALA 338 N 1.72 0.96 0.00 -1.39 0.00 -0.59 -3.00 119.26 116.96 2iua h ALA 338 Ca 0.00 -0.12 -0.41 0.00 0.00 0.00 0.00 54.91 54.38 2iua h ALA 338 Cb 0.29 -0.02 -0.07 0.00 0.00 0.00 0.00 17.79 17.99 2iua h ALA 338 CO 0.00 0.17 -2.45 0.00 0.00 0.00 0.00 179.25 176.96 2iua n ALA 339 N -2.15 1.38 0.67 0.00 0.00 -0.98 -4.27 120.51 115.16 2iua n ALA 339 Ca 0.02 -1.06 -0.02 0.00 0.00 0.00 0.00 53.44 52.37 2iua n ALA 339 Cb 0.47 0.03 0.04 0.00 0.00 0.00 0.00 19.45 19.98 2iua n ALA 339 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 2iua n LEU 340 N -3.66 3.04 0.00 0.00 7.94 -1.10 -2.29 117.00 120.93 2iua n LEU 340 Ca -0.48 -1.55 0.00 0.00 -1.11 0.00 0.00 56.01 52.87 2iua n LEU 340 Cb 0.93 -0.55 0.00 0.00 0.53 0.00 0.00 43.42 44.33 2iua n LEU 340 CO 0.15 0.50 -0.14 -0.62 -1.11 0.00 0.00 177.39 176.17 2iua n GLU 341 N 0.20 3.28 -0.13 1.96 1.02 -1.13 -4.73 120.64 121.11 2iua n GLU 341 Ca 0.08 0.00 -0.07 0.00 -0.02 0.00 0.00 57.16 57.15 2iua n GLU 341 Cb 0.60 -0.54 0.09 0.00 -0.02 0.00 0.00 31.44 31.57 2iua n GLU 341 CO 0.00 0.00 0.00 -0.22 1.18 0.00 0.00 177.13 178.09 2iua h LYS 342 N 0.00 0.87 -5.44 3.49 3.64 -1.64 -3.34 116.57 114.16 2iua h LYS 342 Ca 0.00 -0.29 -0.48 0.00 -1.27 0.00 0.00 60.65 58.61 2iua h LYS 342 Cb 0.00 -0.07 -0.04 0.00 -0.41 0.00 0.00 32.23 31.71 2iua h LYS 342 CO 0.00 0.93 1.60 1.28 -2.27 0.00 0.00 179.45 180.99 2iua n LEU 343 N -4.16 3.87 -2.46 5.20 4.77 -1.23 -4.54 117.00 118.45 2iua n LEU 343 Ca 0.02 -3.41 -0.06 0.00 -0.03 0.00 0.00 56.01 52.52 2iua n LEU 343 Cb 0.37 -1.69 0.04 0.00 -2.33 0.00 0.00 43.42 39.82 2iua n LEU 343 CO 0.44 -0.99 0.06 0.55 -1.33 0.00 0.00 177.39 176.11 2iua n VAL 344 N 7.12 1.55 -1.76 4.08 3.14 -1.25 -5.04 118.33 126.17 2iua n VAL 344 Ca 0.47 -3.15 -0.35 0.00 -2.96 0.00 0.00 64.34 58.35 2iua n VAL 344 Cb 0.46 0.58 0.06 0.00 -1.06 0.00 0.00 33.84 33.88 2iua n VAL 344 CO 0.00 0.00 0.00 -1.10 -6.46 0.00 0.00 176.83 169.27 2iua s GLN 345 N -3.48 2.65 0.00 1.45 -1.52 -1.26 -5.22 119.66 112.29 2iua s GLN 345 Ca 0.34 1.70 0.00 0.00 -1.95 0.00 0.00 55.36 55.45 2iua s GLN 345 Cb 0.35 -1.90 0.00 0.00 -0.22 0.00 0.00 33.01 31.24 2iua s GLN 345 CO -0.03 -1.43 0.00 1.63 -0.25 0.00 0.00 175.29 175.22