#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1i0l h GLU 6 N 0.00 0.28 0.00 -0.72 9.09 -2.04 -2.44 114.58 118.75 1i0l h GLU 6 Ca 0.00 -0.05 0.00 0.00 0.05 0.00 0.00 59.36 59.36 1i0l h GLU 6 Cb 0.00 -0.05 0.00 0.00 -1.65 0.00 0.00 28.75 27.05 1i0l h GLU 6 CO 0.00 0.35 0.00 1.97 0.05 0.00 0.00 179.01 181.38 1i0l n PHE 7 N -4.33 0.00 -3.82 2.06 1.16 -1.26 -4.84 117.46 106.42 1i0l n PHE 7 Ca -0.00 0.00 -0.37 0.00 -1.87 0.00 0.00 57.45 55.21 1i0l n PHE 7 Cb 0.22 -0.34 -0.06 0.00 -1.61 0.00 0.00 39.48 37.68 1i0l n PHE 7 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 1i0l s ALA 8 N -2.69 3.86 -0.01 1.98 0.00 -0.92 -1.14 121.76 122.84 1i0l s ALA 8 Ca 0.20 -0.58 -0.16 0.00 0.00 0.00 0.00 51.96 51.42 1i0l s ALA 8 Cb 0.16 -2.03 -0.34 0.00 0.00 0.00 0.00 23.12 20.92 1i0l s ALA 8 CO 0.39 0.61 0.89 1.49 0.00 0.00 0.00 175.76 179.13 1i0l h GLU 9 N 4.86 0.45 -2.35 0.00 4.81 -0.83 -3.44 114.58 118.08 1i0l h GLU 9 Ca -0.54 -0.77 0.12 0.00 -0.13 0.00 0.00 59.36 58.04 1i0l h GLU 9 Cb 1.23 0.29 -0.13 0.00 0.63 0.00 0.00 28.75 30.77 1i0l h GLU 9 CO 0.59 1.37 0.47 0.15 -0.73 0.00 0.00 179.01 180.86 1i0l s LYS 10 N -2.55 0.97 -0.20 1.92 1.02 -1.24 -5.00 119.74 114.65 1i0l s LYS 10 Ca -0.12 -0.42 -0.21 0.00 0.02 0.00 0.00 55.97 55.24 1i0l s LYS 10 Cb 0.04 0.40 -0.02 0.00 -0.52 0.00 0.00 37.83 37.72 1i0l s LYS 10 CO 0.90 -0.43 0.64 0.42 -0.92 0.00 0.00 175.35 175.96 1i0l s ILE 11 N -3.21 5.01 -0.10 2.17 -1.09 -1.26 -0.75 121.20 121.96 1i0l s ILE 11 Ca 0.07 1.21 -0.05 0.00 -2.23 0.00 0.00 60.65 59.65 1i0l s ILE 11 Cb -0.01 -3.96 -0.02 0.00 -1.58 0.00 0.00 42.46 36.89 1i0l s ILE 11 CO -0.06 0.10 -0.11 -0.07 -1.23 0.00 0.00 174.94 173.58 1i0l h LEU 12 N 8.22 0.00 -7.91 2.97 3.38 -1.30 -3.48 115.31 117.19 1i0l h LEU 12 Ca -0.31 0.00 -0.35 0.00 0.09 0.00 0.00 57.88 57.31 1i0l h LEU 12 Cb 1.14 0.00 -0.29 0.00 0.09 0.00 0.00 40.66 41.60 1i0l h LEU 12 CO 0.78 0.52 -0.76 -0.36 0.09 0.00 0.00 178.44 178.71 1i0l s PHE 13 N -1.82 0.59 0.61 1.13 0.40 -0.73 -5.01 117.98 113.15 1i0l s PHE 13 Ca -0.09 -0.12 -0.07 0.00 -0.60 0.00 0.00 56.93 56.05 1i0l s PHE 13 Cb 0.01 -0.41 0.00 0.00 0.51 0.00 0.00 43.02 43.14 1i0l s PHE 13 CO 0.13 -0.04 0.95 0.95 0.70 0.00 0.00 175.22 177.91 1i0l s THR 14 N 0.03 3.76 0.32 0.64 -4.23 -1.26 -1.07 115.64 113.83 1i0l s THR 14 Ca 0.00 0.18 0.06 0.00 -1.18 0.00 0.00 61.69 60.75 1i0l s THR 14 Cb -0.04 -3.51 0.31 0.00 1.34 0.00 0.00 72.50 70.59 1i0l s THR 14 CO -0.00 -0.57 1.82 -0.08 -0.54 0.00 0.00 174.62 175.25 1i0l h GLU 15 N -0.27 0.76 -0.30 3.99 4.81 -1.95 -1.10 114.58 120.52 1i0l h GLU 15 Ca -0.45 -0.05 -0.08 0.00 -0.13 0.00 0.00 59.36 58.65 1i0l h GLU 15 Cb 1.25 -0.17 -0.01 0.00 0.63 0.00 0.00 28.75 30.45 1i0l h GLU 15 CO 0.62 0.50 -0.12 0.93 -0.73 0.00 0.00 179.01 180.21 1i0l h GLU 16 N 0.78 0.62 -0.39 1.92 3.07 -1.93 -0.71 114.58 117.94 1i0l h GLU 16 Ca 0.52 -0.26 -0.03 0.00 -0.50 0.00 0.00 59.36 59.09 1i0l h GLU 16 Cb 0.77 -0.02 -0.02 0.00 -0.84 0.00 0.00 28.75 28.63 1i0l h GLU 16 CO -0.29 0.83 0.13 0.93 -1.40 0.00 0.00 179.01 179.21 1i0l h GLU 17 N 0.38 0.61 -0.04 2.33 5.08 -1.81 -1.97 114.58 119.15 1i0l h GLU 17 Ca 0.07 -0.13 0.02 0.00 -1.00 0.00 0.00 59.36 58.32 1i0l h GLU 17 Cb 0.63 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.77 1i0l h GLU 17 CO 0.04 0.60 -0.07 0.82 -1.00 0.00 0.00 179.01 179.40 1i0l h ILE 18 N 0.49 0.81 -0.69 3.13 2.04 -1.17 -1.57 117.51 120.54 1i0l h ILE 18 Ca 0.13 0.00 0.10 0.00 1.00 0.00 0.00 64.86 66.08 1i0l h ILE 18 Cb 0.25 0.81 -0.07 0.00 -0.74 0.00 0.00 36.82 37.06 1i0l h ILE 18 CO -0.01 0.00 0.33 -0.09 0.00 0.00 0.00 178.15 178.38 1i0l h ARG 19 N -0.10 0.54 -0.18 2.37 2.43 -1.01 -1.51 114.38 116.92 1i0l h ARG 19 Ca 0.04 -0.03 -0.02 0.00 -0.81 0.00 0.00 59.98 59.16 1i0l h ARG 19 Cb 0.16 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 29.58 1i0l h ARG 19 CO -0.10 0.36 0.02 1.15 -1.51 0.00 0.00 179.97 179.88 1i0l h THR 20 N 0.56 1.23 -0.52 0.20 2.02 -1.05 -2.81 112.91 112.55 1i0l h THR 20 Ca 0.35 -0.78 0.01 0.00 0.77 0.00 0.00 66.41 66.76 1i0l h THR 20 Cb 0.38 1.39 -0.03 0.00 -1.74 0.00 0.00 68.15 68.16 1i0l h THR 20 CO -0.28 0.24 0.34 0.03 0.37 0.00 0.00 175.52 176.21 1i0l h ARG 21 N 0.09 0.67 -0.81 6.66 3.08 -0.94 -1.66 114.38 121.46 1i0l h ARG 21 Ca 0.05 -0.04 0.06 0.00 0.07 0.00 0.00 59.98 60.13 1i0l h ARG 21 Cb 0.34 -0.15 -0.06 0.00 0.08 0.00 0.00 29.97 30.18 1i0l h ARG 21 CO 0.01 0.44 0.49 0.82 -1.07 0.00 0.00 179.97 180.66 1i0l h ILE 22 N 0.69 1.02 -0.66 2.04 2.04 -1.27 0.63 117.51 121.99 1i0l h ILE 22 Ca 0.19 -0.31 -0.06 0.00 1.00 0.00 0.00 64.86 65.68 1i0l h ILE 22 Cb -0.07 0.04 -0.03 0.00 -0.74 0.00 0.00 36.82 36.02 1i0l h ILE 22 CO -0.05 0.16 0.19 0.11 0.00 0.00 0.00 178.15 178.57 1i0l h LYS 23 N 0.90 1.03 -0.42 2.37 1.57 -1.18 0.14 116.57 120.98 1i0l h LYS 23 Ca 0.36 -0.22 -0.03 0.00 -1.87 0.00 0.00 60.65 58.89 1i0l h LYS 23 Cb 0.18 -0.15 -0.02 0.00 0.08 0.00 0.00 32.23 32.32 1i0l h LYS 23 CO -0.18 0.89 0.13 0.93 -0.57 0.00 0.00 179.45 180.66 1i0l h GLU 24 N 0.99 0.65 -0.52 3.15 5.08 -0.33 -0.05 114.58 123.55 1i0l h GLU 24 Ca 0.21 -0.14 -0.09 0.00 -1.00 0.00 0.00 59.36 58.35 1i0l h GLU 24 Cb 0.31 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.45 1i0l h GLU 24 CO -0.00 0.64 -0.01 0.28 -1.00 0.00 0.00 179.01 178.92 1i0l h VAL 25 N 0.54 1.26 -0.92 3.13 2.07 -0.54 -2.55 116.25 119.24 1i0l h VAL 25 Ca 0.14 -1.11 0.00 0.00 0.82 0.00 0.00 66.70 66.54 1i0l h VAL 25 Cb 0.26 0.95 -0.05 0.00 -1.52 0.00 0.00 31.29 30.93 1i0l h VAL 25 CO -0.00 0.39 0.58 0.00 0.02 0.00 0.00 177.57 178.56 1i0l h ALA 26 N 0.94 1.18 -0.77 1.67 0.00 -0.55 0.96 119.26 122.70 1i0l h ALA 26 Ca 0.15 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 54.97 1i0l h ALA 26 Cb 0.54 -0.37 -0.04 0.00 0.00 0.00 0.00 17.79 17.92 1i0l h ALA 26 CO 0.03 0.61 0.47 1.57 0.00 0.00 0.00 179.25 181.92 1i0l h LYS 27 N 1.26 1.04 0.02 0.00 2.10 -0.76 -0.77 116.57 119.46 1i0l h LYS 27 Ca 0.33 -0.09 -0.00 0.00 -2.00 0.00 0.00 60.65 58.89 1i0l h LYS 27 Cb -0.09 -0.22 0.00 0.00 -0.90 0.00 0.00 32.23 31.02 1i0l h LYS 27 CO -0.07 0.73 -0.01 0.07 -2.00 0.00 0.00 179.45 178.17 1i0l h ARG 28 N 1.05 -0.02 -0.69 0.07 -0.00 -0.91 -2.06 114.38 111.82 1i0l h ARG 28 Ca 0.28 0.00 0.10 0.00 -0.00 0.00 0.00 59.98 60.36 1i0l h ARG 28 Cb -0.04 0.00 -0.07 0.00 -0.00 0.00 0.00 29.97 29.86 1i0l h ARG 28 CO -0.05 0.28 0.31 0.82 -0.00 0.00 0.00 179.97 181.33 1i0l h ILE 29 N -0.32 0.80 -0.71 0.08 2.04 -0.67 -0.32 117.51 118.40 1i0l h ILE 29 Ca -0.00 -0.18 0.02 0.00 1.00 0.00 0.00 64.86 65.69 1i0l h ILE 29 Cb 0.31 0.23 -0.04 0.00 -0.74 0.00 0.00 36.82 36.58 1i0l h ILE 29 CO 0.00 0.10 0.46 0.00 0.00 0.00 0.00 178.15 178.71 1i0l h ALA 30 N 1.44 0.92 -0.25 1.87 0.00 -1.00 -0.43 119.26 121.81 1i0l h ALA 30 Ca 0.35 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 55.16 1i0l h ALA 30 Cb 0.41 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 1i0l h ALA 30 CO -0.30 0.29 -0.06 -0.44 0.00 0.00 0.00 179.25 178.74 1i0l h ASP 31 N 0.93 0.49 -0.11 0.00 3.45 -0.59 -2.68 116.42 117.90 1i0l h ASP 31 Ca 0.27 -0.36 -0.02 0.00 0.43 0.00 0.00 57.03 57.35 1i0l h ASP 31 Cb -0.06 -0.13 -0.01 0.00 -0.56 0.00 0.00 39.33 38.57 1i0l h ASP 31 CO -0.08 0.74 0.03 0.44 -1.57 0.00 0.00 179.24 178.80 1i0l h ASP 32 N 0.23 0.22 0.19 6.45 3.32 -0.61 -1.82 116.42 124.40 1i0l h ASP 32 Ca 0.06 -0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.10 1i0l h ASP 32 Cb 0.52 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 40.02 1i0l h ASP 32 CO 0.02 0.24 -0.15 -1.22 -1.72 0.00 0.00 179.24 176.41 1i0l n TYR 33 N -4.43 0.00 -0.35 4.55 4.02 -0.21 -4.24 117.16 116.51 1i0l n TYR 33 Ca -0.00 0.00 0.11 0.00 -0.01 0.00 0.00 57.90 58.00 1i0l n TYR 33 Cb 0.14 -0.10 0.30 0.00 -0.02 0.00 0.00 39.34 39.66 1i0l n TYR 33 CO 0.00 0.00 0.00 0.87 -1.01 0.00 0.00 176.86 176.72 1i0l h LYS 34 N 1.34 0.76 0.00 -0.72 1.57 -0.98 0.12 116.57 118.65 1i0l h LYS 34 Ca 0.00 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.73 1i0l h LYS 34 Cb 0.46 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 32.59 1i0l h LYS 34 CO 0.00 0.50 0.00 0.41 -0.57 0.00 0.00 179.45 179.79 1i0l n GLY 35 N -1.33 -1.29 0.01 3.86 0.00 -1.26 -3.29 105.19 101.89 1i0l n GLY 35 Ca 0.22 -0.05 0.14 0.00 0.00 0.00 0.00 46.02 46.33 1i0l n GLY 35 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1i0l n LYS 36 N -1.65 0.30 -3.73 1.61 4.76 0.41 -4.95 118.16 114.91 1i0l n LYS 36 Ca 0.05 -0.01 -0.25 0.00 -2.87 0.00 0.00 58.31 55.23 1i0l n LYS 36 Cb 0.27 -1.50 0.05 0.00 -1.84 0.00 0.00 35.03 32.00 1i0l n LYS 36 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1i0l n GLY 37 N 1.36 -0.43 3.75 0.72 0.00 -1.21 -4.92 105.19 104.46 1i0l n GLY 37 Ca 0.12 0.18 -0.41 0.00 0.00 0.00 0.00 46.02 45.90 1i0l n GLY 37 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1i0l s LEU 38 N -7.00 4.37 -0.01 0.99 1.43 -1.26 -4.90 118.68 112.31 1i0l s LEU 38 Ca 0.37 2.75 -0.02 0.00 -1.03 0.00 0.00 54.13 56.20 1i0l s LEU 38 Cb -0.18 -3.63 -0.00 0.00 0.03 0.00 0.00 46.19 42.41 1i0l s LEU 38 CO 0.79 -0.76 0.04 -0.13 0.23 0.00 0.00 176.35 176.52 1i0l s ARG 39 N -0.44 0.18 0.69 1.70 1.81 0.76 -4.83 118.95 118.80 1i0l s ARG 39 Ca 0.60 -0.18 -0.15 0.00 -1.72 0.00 0.00 55.73 54.28 1i0l s ARG 39 Cb -0.44 0.07 0.02 0.00 -0.45 0.00 0.00 34.95 34.15 1i0l s ARG 39 CO 0.45 -0.03 1.16 -1.25 -0.68 0.00 0.00 175.30 174.95 1i0l s PRO 40 N -0.55 2.48 0.00 3.54 0.04 -1.26 -0.56 135.00 138.70 1i0l s PRO 40 Ca -0.06 1.60 0.00 0.00 0.04 0.00 0.00 61.00 62.58 1i0l s PRO 40 Cb -0.04 -1.89 0.00 0.00 0.04 0.00 0.00 34.50 32.61 1i0l s PRO 40 CO -0.00 -1.53 0.00 0.66 0.04 0.00 0.00 177.00 176.16 1i0l n TYR 41 N -2.50 0.00 -0.00 0.56 4.02 -1.26 -4.32 117.16 113.65 1i0l n TYR 41 Ca 0.12 0.00 -0.22 0.00 -0.01 0.00 0.00 57.90 57.79 1i0l n TYR 41 Cb 0.51 0.00 -0.14 0.00 -0.02 0.00 0.00 39.34 39.69 1i0l n TYR 41 CO 0.00 0.00 0.00 -0.39 -1.01 0.00 0.00 176.86 175.46 1i0l h VAL 42 N 0.00 0.71 -2.01 -0.72 -1.51 -2.03 -3.43 116.25 107.26 1i0l h VAL 42 Ca 0.00 -2.33 -0.50 0.00 -1.23 0.00 0.00 66.70 62.64 1i0l h VAL 42 Cb 0.00 2.50 -0.40 0.00 -2.13 0.00 0.00 31.29 31.25 1i0l h VAL 42 CO 0.00 0.80 -1.08 -3.20 -1.23 0.00 0.00 177.57 172.87 1i0l n ASN 43 N -3.65 1.67 -4.90 4.19 5.15 0.28 -4.97 115.26 113.02 1i0l n ASN 43 Ca -0.31 -3.15 -0.28 0.00 -0.60 0.00 0.00 54.58 50.24 1i0l n ASN 43 Cb 0.99 -0.60 0.03 0.00 -0.53 0.00 0.00 39.78 39.67 1i0l n ASN 43 CO 0.00 0.00 0.00 -2.16 1.40 0.00 0.00 177.26 176.50 1i0l s PRO 44 N -2.69 2.98 -0.26 1.20 0.04 -0.54 -0.17 135.00 135.56 1i0l s PRO 44 Ca 0.41 0.24 -0.26 0.00 0.04 0.00 0.00 61.00 61.43 1i0l s PRO 44 Cb 0.34 -2.17 0.00 0.00 0.04 0.00 0.00 34.50 32.71 1i0l s PRO 44 CO -0.09 -0.79 0.93 -1.17 0.04 0.00 0.00 177.00 175.92 1i0l s LEU 45 N -5.13 4.06 -0.24 -3.56 2.96 0.13 -4.38 118.68 112.53 1i0l s LEU 45 Ca 0.55 1.09 -0.22 0.00 -0.22 0.00 0.00 54.13 55.34 1i0l s LEU 45 Cb -0.11 -3.34 -0.02 0.00 0.50 0.00 0.00 46.19 43.23 1i0l s LEU 45 CO 0.48 -0.64 0.68 -0.69 -1.32 0.00 0.00 176.35 174.87 1i0l s VAL 46 N 3.10 4.95 -0.26 1.68 1.01 -0.44 -1.14 120.40 129.30 1i0l s VAL 46 Ca 0.39 1.26 -0.10 0.00 0.00 0.00 0.00 61.98 63.54 1i0l s VAL 46 Cb -0.15 -3.99 -0.04 0.00 0.00 0.00 0.00 36.38 32.20 1i0l s VAL 46 CO 0.09 0.02 0.15 -0.76 0.00 0.00 0.00 175.10 174.60 1i0l s LEU 47 N 2.47 3.88 -0.57 3.92 1.43 -0.35 -0.33 118.68 129.14 1i0l s LEU 47 Ca 0.29 -0.04 -0.14 0.00 -1.03 0.00 0.00 54.13 53.22 1i0l s LEU 47 Cb -0.16 -2.06 0.14 0.00 0.03 0.00 0.00 46.19 44.14 1i0l s LEU 47 CO 0.09 -0.02 0.50 -0.63 0.23 0.00 0.00 176.35 176.51 1i0l s ILE 48 N 1.57 4.99 -0.32 -0.59 1.01 0.15 -1.09 121.20 126.92 1i0l s ILE 48 Ca 0.07 -1.74 -0.25 0.00 0.00 0.00 0.00 60.65 58.73 1i0l s ILE 48 Cb -0.15 -4.20 0.01 0.00 0.01 0.00 0.00 42.46 38.12 1i0l s ILE 48 CO 0.08 -0.87 0.85 -0.55 0.00 0.00 0.00 174.94 174.45 1i0l s SER 49 N 3.11 6.69 -0.42 3.58 0.15 -0.18 -0.40 113.70 126.22 1i0l s SER 49 Ca 0.06 0.67 -0.25 0.00 0.70 0.00 0.00 55.95 57.12 1i0l s SER 49 Cb -0.26 -2.43 0.02 0.00 -1.71 0.00 0.00 66.02 61.64 1i0l s SER 49 CO 0.00 -0.71 0.92 -0.69 1.20 0.00 0.00 173.24 173.97 1i0l s VAL 50 N 3.15 4.52 0.71 4.45 1.01 -0.88 -1.28 120.40 132.08 1i0l s VAL 50 Ca 0.35 0.91 -0.13 0.00 0.00 0.00 0.00 61.98 63.11 1i0l s VAL 50 Cb -0.13 -4.39 0.02 0.00 0.00 0.00 0.00 36.38 31.88 1i0l s VAL 50 CO 0.14 -0.71 1.09 -0.76 0.00 0.00 0.00 175.10 174.86 1i0l s LEU 51 N 3.63 3.21 -0.13 3.92 1.43 -0.29 -3.03 118.68 127.42 1i0l s LEU 51 Ca 0.37 1.88 0.18 0.00 -1.03 0.00 0.00 54.13 55.53 1i0l s LEU 51 Cb -0.11 -4.53 -0.25 0.00 0.03 0.00 0.00 46.19 41.33 1i0l s LEU 51 CO 0.23 -1.78 0.29 0.29 0.23 0.00 0.00 176.35 175.62 1i0l n LYS 52 N -2.95 0.67 -0.32 1.70 5.02 -1.26 -4.63 118.16 116.38 1i0l n LYS 52 Ca 0.09 0.03 0.26 0.00 -2.02 0.00 0.00 58.31 56.67 1i0l n LYS 52 Cb 0.53 -1.59 0.58 0.00 -0.02 0.00 0.00 35.03 34.53 1i0l n LYS 52 CO 0.00 0.00 0.00 0.78 -0.52 0.00 0.00 177.40 177.66 1i0l h GLY 53 N 3.91 0.91 -0.27 0.72 0.00 -1.74 -2.09 103.07 104.52 1i0l h GLY 53 Ca -0.39 -0.15 0.00 0.00 0.00 0.00 0.00 47.33 46.79 1i0l h GLY 53 CO 0.03 -0.12 0.00 -1.14 0.00 0.00 0.00 176.54 175.32 1i0l n SER 54 N -4.52 0.73 -0.25 0.19 3.41 -1.17 -4.28 113.62 107.72 1i0l n SER 54 Ca 0.26 -1.77 -0.03 0.00 -0.26 0.00 0.00 58.87 57.06 1i0l n SER 54 Cb 0.99 -0.07 0.08 0.00 -0.26 0.00 0.00 64.21 64.95 1i0l n SER 54 CO 0.00 0.00 0.00 2.19 -0.16 0.00 0.00 175.04 177.07 1i0l h PHE 55 N 0.87 0.83 -0.01 7.33 -5.15 -1.64 0.76 116.94 119.92 1i0l h PHE 55 Ca 0.00 0.02 -0.12 0.00 -0.20 0.00 0.00 57.97 57.68 1i0l h PHE 55 Cb 0.20 -0.27 0.01 0.00 0.22 0.00 0.00 35.95 36.10 1i0l h PHE 55 CO 0.07 0.46 -0.44 1.98 -2.00 0.00 0.00 178.31 178.38 1i0l h MET 56 N 0.86 0.32 -0.70 6.09 4.05 -1.85 -2.64 114.93 121.06 1i0l h MET 56 Ca 0.29 -0.33 0.04 0.00 -0.28 0.00 0.00 59.70 59.42 1i0l h MET 56 Cb 0.04 0.09 -0.05 0.00 -0.80 0.00 0.00 31.60 30.89 1i0l h MET 56 CO -0.12 1.02 0.43 0.35 0.23 0.00 0.00 176.91 178.81 1i0l h PHE 57 N -0.25 0.79 -0.61 1.39 3.57 -1.76 -2.41 116.94 117.66 1i0l h PHE 57 Ca -0.05 0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.44 1i0l h PHE 57 Cb 1.16 -0.26 -0.03 0.00 2.79 0.00 0.00 35.95 39.62 1i0l h PHE 57 CO 0.16 0.43 0.27 1.15 -2.23 0.00 0.00 178.31 178.09 1i0l h THR 58 N 0.82 1.22 -0.71 4.41 2.02 -0.88 0.98 112.91 120.77 1i0l h THR 58 Ca 0.29 -0.65 -0.03 0.00 0.77 0.00 0.00 66.41 66.79 1i0l h THR 58 Cb 0.07 0.52 -0.03 0.00 -1.74 0.00 0.00 68.15 66.98 1i0l h THR 58 CO -0.13 0.26 0.33 0.00 0.37 0.00 0.00 175.52 176.35 1i0l h ALA 59 N 1.11 0.92 0.01 6.16 0.00 -1.12 -1.39 119.26 124.95 1i0l h ALA 59 Ca 0.21 -0.15 -0.24 0.00 0.00 0.00 0.00 54.91 54.72 1i0l h ALA 59 Cb 0.15 -0.28 0.01 0.00 0.00 0.00 0.00 17.79 17.67 1i0l h ALA 59 CO -0.02 0.49 -1.00 -0.44 0.00 0.00 0.00 179.25 178.28 1i0l h ASP 60 N 0.99 0.66 -0.15 0.00 3.32 -1.29 -3.19 116.42 116.76 1i0l h ASP 60 Ca 0.24 -0.54 -0.02 0.00 0.02 0.00 0.00 57.03 56.74 1i0l h ASP 60 Cb 0.13 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.47 1i0l h ASP 60 CO -0.03 1.34 0.02 0.25 -1.72 0.00 0.00 179.24 179.11 1i0l h LEU 61 N 0.28 0.23 -1.69 1.55 5.85 -0.71 -1.45 115.31 119.37 1i0l h LEU 61 Ca -0.10 -0.26 -0.02 0.00 0.84 0.00 0.00 57.88 58.33 1i0l h LEU 61 Cb 1.65 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 42.61 1i0l h LEU 61 CO 0.18 0.43 -0.06 0.00 -0.34 0.00 0.00 178.44 178.65 1i0l h ARG 63 N 0.11 0.88 -0.55 0.00 3.08 -1.50 -0.77 114.38 115.63 1i0l h ARG 63 Ca 0.03 -0.58 -0.06 0.00 0.07 0.00 0.00 59.98 59.45 1i0l h ARG 63 Cb 0.19 0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.30 1i0l h ARG 63 CO 0.01 1.21 0.13 0.00 -1.07 0.00 0.00 179.97 180.25 1i0l h ALA 64 N 0.66 0.73 -0.79 0.04 0.00 -0.27 -1.62 119.26 118.01 1i0l h ALA 64 Ca 0.01 -0.22 -0.04 0.00 0.00 0.00 0.00 54.91 54.65 1i0l h ALA 64 Cb 1.19 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 18.73 1i0l h ALA 64 CO 0.13 0.43 0.32 -0.07 0.00 0.00 0.00 179.25 180.06 1i0l h LEU 65 N 0.79 1.08 -1.49 0.00 3.38 -0.75 -0.89 115.31 117.42 1i0l h LEU 65 Ca 0.17 -0.16 0.01 0.00 0.09 0.00 0.00 57.88 57.99 1i0l h LEU 65 Cb 0.35 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.79 1i0l h LEU 65 CO 0.00 0.96 0.35 0.00 0.09 0.00 0.00 178.44 179.84 1i0l h ASP 67 N 0.70 0.10 -0.59 0.00 3.32 -0.18 0.18 116.42 119.95 1i0l h ASP 67 Ca 0.20 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.25 1i0l h ASP 67 Cb -0.05 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 39.48 1i0l h ASP 67 CO -0.04 0.07 0.00 0.49 -1.72 0.00 0.00 179.24 178.03 1i0l n PHE 68 N -4.48 1.85 -2.47 4.55 3.01 0.18 -4.95 117.46 115.14 1i0l n PHE 68 Ca 0.02 -0.70 -0.18 0.00 1.01 0.00 0.00 57.45 57.61 1i0l n PHE 68 Cb 0.25 -0.42 -0.01 0.00 -0.01 0.00 0.00 39.48 39.30 1i0l n PHE 68 CO 0.00 0.00 0.00 0.09 1.01 0.00 0.00 176.76 177.86 1i0l n ASN 69 N 0.74 -5.17 -4.59 4.37 3.02 0.64 -4.97 115.26 109.29 1i0l n ASN 69 Ca 0.27 0.03 -0.41 0.00 -0.03 0.00 0.00 54.58 54.44 1i0l n ASN 69 Cb 1.09 -4.32 -0.07 0.00 -0.61 0.00 0.00 39.78 35.87 1i0l n ASN 69 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1i0l s VAL 70 N -2.90 4.95 -0.01 2.41 1.01 -0.81 -5.00 120.40 120.06 1i0l s VAL 70 Ca 0.03 0.76 -0.30 0.00 0.00 0.00 0.00 61.98 62.47 1i0l s VAL 70 Cb -0.01 -3.99 -0.04 0.00 0.00 0.00 0.00 36.38 32.33 1i0l s VAL 70 CO 0.03 -0.15 1.23 -2.16 0.00 0.00 0.00 175.10 174.05 1i0l s PRO 71 N 2.57 4.37 0.29 2.72 0.04 -1.26 -4.28 135.00 139.45 1i0l s PRO 71 Ca 0.24 1.75 0.09 0.00 0.04 0.00 0.00 61.00 63.12 1i0l s PRO 71 Cb -0.15 -3.48 -0.06 0.00 0.04 0.00 0.00 34.50 30.85 1i0l s PRO 71 CO 0.12 -0.40 -0.13 0.14 0.04 0.00 0.00 177.00 176.78 1i0l s VAL 72 N 1.83 2.12 -0.10 -0.36 -7.23 -1.26 -0.69 120.40 114.70 1i0l s VAL 72 Ca 0.58 -2.25 -0.01 0.00 -1.81 0.00 0.00 61.98 58.49 1i0l s VAL 72 Cb -0.27 -2.41 0.03 0.00 0.56 0.00 0.00 36.38 34.29 1i0l s VAL 72 CO 0.25 -0.34 -0.04 -0.60 -0.31 0.00 0.00 175.10 174.06 1i0l s ARG 73 N -3.61 1.14 -0.11 4.82 3.52 -0.29 -4.82 118.95 119.60 1i0l s ARG 73 Ca 0.30 -0.14 -0.22 0.00 -0.13 0.00 0.00 55.73 55.53 1i0l s ARG 73 Cb -0.00 -1.41 -0.03 0.00 -1.56 0.00 0.00 34.95 31.95 1i0l s ARG 73 CO 0.14 -0.31 0.65 -1.64 -0.81 0.00 0.00 175.30 173.33 1i0l s MET 74 N 1.81 4.36 0.01 5.12 -1.94 -1.26 -1.21 119.30 126.18 1i0l s MET 74 Ca 0.04 0.74 0.05 0.00 -1.71 0.00 0.00 55.69 54.82 1i0l s MET 74 Cb -0.13 -3.48 -0.02 0.00 2.01 0.00 0.00 34.83 33.21 1i0l s MET 74 CO -0.07 -0.01 -0.16 -1.21 -0.01 0.00 0.00 175.02 173.56 1i0l s GLU 75 N 1.09 1.22 -0.06 2.03 0.41 -0.25 -4.96 118.70 118.18 1i0l s GLU 75 Ca 0.33 -0.67 0.04 0.00 -0.41 0.00 0.00 54.97 54.26 1i0l s GLU 75 Cb -0.17 -1.21 0.00 0.00 -1.78 0.00 0.00 34.13 30.97 1i0l s GLU 75 CO 0.14 0.32 -0.17 -0.06 -0.49 0.00 0.00 175.26 175.01 1i0l s PHE 76 N -0.55 1.81 0.12 1.61 0.40 -1.26 -1.01 117.98 119.10 1i0l s PHE 76 Ca 0.05 -0.62 0.09 0.00 -0.60 0.00 0.00 56.93 55.85 1i0l s PHE 76 Cb -0.07 -1.24 -0.04 0.00 0.51 0.00 0.00 43.02 42.18 1i0l s PHE 76 CO 0.00 -0.25 -0.21 0.96 0.70 0.00 0.00 175.22 176.42 1i0l s ILE 77 N 0.31 1.82 -0.10 0.64 -4.36 -0.41 -4.60 121.20 114.50 1i0l s ILE 77 Ca -0.10 -1.67 0.02 0.00 -0.26 0.00 0.00 60.65 58.64 1i0l s ILE 77 Cb -0.14 -1.69 0.01 0.00 1.25 0.00 0.00 42.46 41.89 1i0l s ILE 77 CO 0.04 -0.10 -0.15 0.00 0.24 0.00 0.00 174.94 174.97 1i0l s VAL 79 N 0.89 2.24 0.31 0.00 -7.23 -1.26 -0.26 120.40 115.08 1i0l s VAL 79 Ca -0.09 -2.24 0.05 0.00 -1.81 0.00 0.00 61.98 57.89 1i0l s VAL 79 Cb -0.15 -2.16 -0.03 0.00 0.56 0.00 0.00 36.38 34.60 1i0l s VAL 79 CO 0.00 -0.37 0.27 -0.55 -0.31 0.00 0.00 175.10 174.15 1i0l s SER 80 N -3.21 1.31 -0.01 4.85 0.15 0.22 -4.90 113.70 112.11 1i0l s SER 80 Ca 0.25 -1.66 0.00 0.00 0.70 0.00 0.00 55.95 55.24 1i0l s SER 80 Cb -0.05 0.54 -0.04 0.00 -1.71 0.00 0.00 66.02 64.76 1i0l s SER 80 CO 0.11 -1.05 0.04 -0.44 1.20 0.00 0.00 173.24 173.11 1i0l s SER 81 N -3.32 5.41 0.34 5.45 0.01 -1.26 -0.70 113.70 119.63 1i0l s SER 81 Ca 0.39 0.09 0.16 0.00 1.31 0.00 0.00 55.95 57.90 1i0l s SER 81 Cb 0.03 -1.50 0.56 0.00 0.21 0.00 0.00 66.02 65.32 1i0l s SER 81 CO 0.24 0.29 1.68 1.88 0.41 0.00 0.00 173.24 177.74 1i0l h TYR 82 N 4.34 0.00 0.00 2.43 -1.99 -1.95 -3.46 116.97 116.34 1i0l h TYR 82 Ca -0.49 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.24 1i0l h TYR 82 Cb 1.18 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.91 1i0l h TYR 82 CO 0.63 0.45 0.00 0.41 -0.00 0.00 0.00 178.16 179.65 1i0l n GLY 83 N 0.30 -2.14 3.67 3.88 0.00 -1.26 -5.05 105.19 104.60 1i0l n GLY 83 Ca -0.00 -1.41 -0.41 0.00 0.00 0.00 0.00 46.02 44.19 1i0l n GLY 83 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1i0l s GLU 84 N -1.87 4.29 -1.08 1.61 0.41 -1.26 -4.00 118.70 116.81 1i0l s GLU 84 Ca 0.00 0.97 -0.04 0.00 -0.41 0.00 0.00 54.97 55.48 1i0l s GLU 84 Cb 0.00 -3.57 0.00 0.00 -1.78 0.00 0.00 34.13 28.79 1i0l s GLU 84 CO 0.00 -0.30 0.93 0.41 -0.49 0.00 0.00 175.26 175.80 1i0l n GLY 85 N 3.48 -0.27 0.08 -1.39 0.00 -1.26 -4.96 105.19 100.88 1i0l n GLY 85 Ca 0.04 0.06 -0.07 0.00 0.00 0.00 0.00 46.02 46.05 1i0l n GLY 85 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1i0l n LEU 86 N -4.00 0.00 -4.16 0.99 4.77 -1.26 -4.99 117.00 108.35 1i0l n LEU 86 Ca -0.09 0.00 -0.18 0.00 -0.03 0.00 0.00 56.01 55.71 1i0l n LEU 86 Cb 0.59 0.40 -0.12 0.00 -2.33 0.00 0.00 43.42 41.96 1i0l n LEU 86 CO 0.53 0.40 -0.45 0.28 -1.33 0.00 0.00 177.39 176.82 1i0l s THR 87 N -2.57 1.06 -0.13 -5.08 -1.32 -1.26 -5.02 115.64 101.32 1i0l s THR 87 Ca -0.09 -1.26 -0.10 0.00 -1.21 0.00 0.00 61.69 59.03 1i0l s THR 87 Cb 0.06 -1.03 -0.03 0.00 -1.51 0.00 0.00 72.50 70.00 1i0l s THR 87 CO 0.78 -0.22 -0.19 -1.54 -2.21 0.00 0.00 174.62 171.24 1i0l n SER 88 N 1.34 1.65 -0.12 8.08 3.41 -1.26 -4.55 113.62 122.17 1i0l n SER 88 Ca -0.21 0.55 0.00 0.00 -0.26 0.00 0.00 58.87 58.95 1i0l n SER 88 Cb 0.54 -0.82 0.00 0.00 -0.26 0.00 0.00 64.21 63.68 1i0l n SER 88 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1i0l n SER 89 N -4.36 0.00 -1.51 4.04 3.41 -1.26 -4.64 113.62 109.29 1i0l n SER 89 Ca -0.07 0.00 -0.15 0.00 -0.26 0.00 0.00 58.87 58.38 1i0l n SER 89 Cb 0.28 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.19 1i0l n SER 89 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1i0l n GLY 90 N -0.12 0.51 3.77 5.00 0.00 -1.26 -4.53 105.19 108.56 1i0l n GLY 90 Ca 0.00 -0.26 -0.41 0.00 0.00 0.00 0.00 46.02 45.35 1i0l n GLY 90 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1i0l s GLN 91 N -4.15 4.37 0.16 1.61 -0.21 -1.26 -4.07 119.66 116.11 1i0l s GLN 91 Ca 0.00 2.16 0.03 0.00 0.02 0.00 0.00 55.36 57.57 1i0l s GLN 91 Cb 0.00 -3.06 -0.05 0.00 1.00 0.00 0.00 33.01 30.90 1i0l s GLN 91 CO 0.00 -0.16 -0.04 0.14 -2.12 0.00 0.00 175.29 173.11 1i0l s VAL 92 N -1.15 0.88 -0.16 1.09 -7.23 -1.26 -4.76 120.40 107.81 1i0l s VAL 92 Ca 0.49 -2.00 -0.18 0.00 -1.81 0.00 0.00 61.98 58.48 1i0l s VAL 92 Cb -0.39 -2.00 -0.04 0.00 0.56 0.00 0.00 36.38 34.51 1i0l s VAL 92 CO 0.51 -0.60 0.47 -0.60 -0.31 0.00 0.00 175.10 174.57 1i0l s ARG 93 N -3.85 4.27 -0.38 4.82 3.52 0.12 -4.90 118.95 122.55 1i0l s ARG 93 Ca 0.20 0.39 -0.25 0.00 -0.13 0.00 0.00 55.73 55.94 1i0l s ARG 93 Cb 0.05 -3.49 0.02 0.00 -1.56 0.00 0.00 34.95 29.97 1i0l s ARG 93 CO 0.02 0.04 0.91 -1.64 -0.81 0.00 0.00 175.30 173.82 1i0l s MET 94 N 1.02 3.78 -0.08 5.12 -1.94 -1.26 -0.61 119.30 125.33 1i0l s MET 94 Ca 0.24 0.47 0.05 0.00 -1.71 0.00 0.00 55.69 54.75 1i0l s MET 94 Cb -0.15 -3.82 -0.24 0.00 2.01 0.00 0.00 34.83 32.62 1i0l s MET 94 CO 0.09 -0.98 0.54 1.28 -0.01 0.00 0.00 175.02 175.94 1i0l n LEU 95 N 6.79 1.54 -3.70 -0.03 4.77 0.64 -4.87 117.00 122.13 1i0l n LEU 95 Ca 0.06 0.33 -0.14 0.00 -0.03 0.00 0.00 56.01 56.24 1i0l n LEU 95 Cb 0.48 -0.31 -0.14 0.00 -2.33 0.00 0.00 43.42 41.12 1i0l n LEU 95 CO 0.58 0.57 -0.16 -0.22 -1.33 0.00 0.00 177.39 176.83 1i0l s LEU 96 N -6.44 0.12 0.00 2.23 2.96 -1.01 -4.92 118.68 111.62 1i0l s LEU 96 Ca -0.12 0.49 0.03 0.00 -0.22 0.00 0.00 54.13 54.31 1i0l s LEU 96 Cb 0.07 0.59 0.03 0.00 0.50 0.00 0.00 46.19 47.38 1i0l s LEU 96 CO 0.80 -0.20 0.22 -0.67 -1.32 0.00 0.00 176.35 175.18 1i0l n ASP 97 N 4.81 1.91 -4.77 3.68 -0.08 -1.26 -1.13 116.55 119.71 1i0l n ASP 97 Ca -0.15 -1.99 -0.39 0.00 -1.51 0.00 0.00 54.79 50.75 1i0l n ASP 97 Cb 0.51 -0.02 0.01 0.00 2.34 0.00 0.00 41.12 43.95 1i0l n ASP 97 CO 0.00 0.00 0.00 0.42 0.12 0.00 0.00 177.20 177.74 1i0l s THR 98 N -1.42 2.43 0.11 5.18 -4.23 -1.26 -4.79 115.64 111.66 1i0l s THR 98 Ca 0.16 0.38 -0.14 0.00 -1.18 0.00 0.00 61.69 60.92 1i0l s THR 98 Cb -0.01 -3.22 -0.07 0.00 1.34 0.00 0.00 72.50 70.54 1i0l s THR 98 CO 0.10 0.05 1.44 0.08 -0.54 0.00 0.00 174.62 175.75 1i0l h ARG 99 N 2.42 0.78 -6.33 3.99 -0.00 -1.94 -3.45 114.38 109.85 1i0l h ARG 99 Ca -0.50 -0.41 -0.60 0.00 -0.00 0.00 0.00 59.98 58.48 1i0l h ARG 99 Cb 1.26 0.01 -0.12 0.00 -0.00 0.00 0.00 29.97 31.12 1i0l h ARG 99 CO 0.61 1.04 -0.69 -3.38 -0.00 0.00 0.00 179.97 177.55 1i0l s HIS 100 N -4.39 2.66 0.38 4.08 -3.43 -1.26 -5.11 115.29 108.23 1i0l s HIS 100 Ca -0.12 -0.22 -0.27 0.00 -0.80 0.00 0.00 55.06 53.65 1i0l s HIS 100 Cb 0.10 -1.25 -0.09 0.00 -1.43 0.00 0.00 32.58 29.91 1i0l s HIS 100 CO 0.85 0.57 1.29 0.45 -2.00 0.00 0.00 174.74 175.89 1i0l s SER 101 N -3.20 6.48 0.01 7.38 0.15 -1.26 -4.96 113.70 118.30 1i0l s SER 101 Ca 0.28 2.64 0.23 0.00 0.70 0.00 0.00 55.95 59.79 1i0l s SER 101 Cb -0.08 -2.64 0.04 0.00 -1.71 0.00 0.00 66.02 61.63 1i0l s SER 101 CO 0.17 -0.73 1.05 2.30 1.20 0.00 0.00 173.24 177.23 1i0l n ILE 102 N 0.34 0.05 -1.64 6.45 -5.35 -1.26 -4.93 119.36 113.03 1i0l n ILE 102 Ca 0.03 -0.09 -0.49 0.00 -0.27 0.00 0.00 62.75 61.92 1i0l n ILE 102 Cb 0.43 0.53 -0.05 0.00 -1.74 0.00 0.00 39.64 38.81 1i0l n ILE 102 CO 0.00 0.00 0.00 1.21 -1.76 0.00 0.00 176.55 176.00 1i0l n GLU 103 N -1.67 1.68 -1.00 6.28 2.13 -1.24 -0.64 120.64 126.18 1i0l n GLU 103 Ca 0.03 0.61 0.00 0.00 0.66 0.00 0.00 57.16 58.46 1i0l n GLU 103 Cb 0.37 -2.32 0.00 0.00 0.27 0.00 0.00 31.44 29.76 1i0l n GLU 103 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1i0l n GLY 104 N 3.08 0.73 3.66 8.31 0.00 -0.44 -4.83 105.19 115.69 1i0l n GLY 104 Ca 0.18 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.96 1i0l n GLY 104 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1i0l s HIS 105 N -2.93 2.78 -0.26 1.61 3.76 0.18 -4.19 115.29 116.24 1i0l s HIS 105 Ca 0.00 -0.18 -0.18 0.00 -0.15 0.00 0.00 55.06 54.54 1i0l s HIS 105 Cb 0.00 -1.28 -0.03 0.00 1.11 0.00 0.00 32.58 32.38 1i0l s HIS 105 CO 0.00 0.57 0.53 -1.01 -0.85 0.00 0.00 174.74 173.98 1i0l s HIS 106 N -2.06 3.26 0.00 1.40 3.76 -1.26 0.94 115.29 121.34 1i0l s HIS 106 Ca 0.30 0.64 0.07 0.00 -0.15 0.00 0.00 55.06 55.92 1i0l s HIS 106 Cb -0.08 -2.74 -0.03 0.00 1.11 0.00 0.00 32.58 30.85 1i0l s HIS 106 CO 0.19 -0.30 -0.21 0.08 -0.85 0.00 0.00 174.74 173.66 1i0l s VAL 107 N 2.34 2.50 -0.15 -0.90 1.01 -0.66 -1.33 120.40 123.22 1i0l s VAL 107 Ca 0.22 -1.10 -0.02 0.00 0.00 0.00 0.00 61.98 61.08 1i0l s VAL 107 Cb -0.16 -1.97 0.04 0.00 0.00 0.00 0.00 36.38 34.30 1i0l s VAL 107 CO 0.09 0.47 -0.00 -0.22 0.00 0.00 0.00 175.10 175.44 1i0l s LEU 108 N -0.99 1.16 -0.11 3.92 2.96 0.56 -1.40 118.68 124.77 1i0l s LEU 108 Ca 0.12 -0.56 -0.28 0.00 -0.22 0.00 0.00 54.13 53.19 1i0l s LEU 108 Cb -0.10 -0.66 -0.02 0.00 0.50 0.00 0.00 46.19 45.91 1i0l s LEU 108 CO 0.02 -0.23 0.93 -0.63 -1.32 0.00 0.00 176.35 175.11 1i0l s ILE 109 N 1.82 4.84 -0.24 6.68 1.01 0.23 -0.67 121.20 134.87 1i0l s ILE 109 Ca 0.01 1.88 -0.07 0.00 0.00 0.00 0.00 60.65 62.47 1i0l s ILE 109 Cb -0.15 -4.24 -0.03 0.00 0.01 0.00 0.00 42.46 38.05 1i0l s ILE 109 CO -0.07 0.05 0.06 -0.69 0.00 0.00 0.00 174.94 174.29 1i0l s VAL 110 N 1.85 4.32 0.09 2.92 1.01 0.46 -0.44 120.40 130.61 1i0l s VAL 110 Ca 0.45 -0.17 0.04 0.00 0.00 0.00 0.00 61.98 62.30 1i0l s VAL 110 Cb -0.18 -3.01 -0.03 0.00 0.00 0.00 0.00 36.38 33.16 1i0l s VAL 110 CO 0.17 0.36 -0.11 -1.61 0.00 0.00 0.00 175.10 173.91 1i0l s GLU 111 N 1.43 0.83 0.04 2.72 0.41 -0.57 -2.08 118.70 121.48 1i0l s GLU 111 Ca 0.05 -1.10 0.21 0.00 -0.41 0.00 0.00 54.97 53.73 1i0l s GLU 111 Cb -0.15 -0.59 -0.19 0.00 -1.78 0.00 0.00 34.13 31.41 1i0l s GLU 111 CO 0.03 0.10 0.67 -0.40 -0.49 0.00 0.00 175.26 175.18 1i0l n ASP 112 N 0.75 0.40 -3.72 -0.19 5.75 -1.26 -2.04 116.55 116.23 1i0l n ASP 112 Ca -0.17 0.16 -0.13 0.00 -0.01 0.00 0.00 54.79 54.64 1i0l n ASP 112 Cb 0.57 1.13 -0.10 0.00 -1.03 0.00 0.00 41.12 41.68 1i0l n ASP 112 CO 0.00 0.00 0.00 -0.51 -0.11 0.00 0.00 177.20 176.58 1i0l s ILE 113 N -3.28 -0.01 -0.08 2.12 2.07 -1.26 -0.84 121.20 119.93 1i0l s ILE 113 Ca -0.05 0.02 0.02 0.00 -1.41 0.00 0.00 60.65 59.23 1i0l s ILE 113 Cb 0.11 -0.58 0.01 0.00 0.13 0.00 0.00 42.46 42.13 1i0l s ILE 113 CO 0.85 0.01 -0.14 0.54 -1.91 0.00 0.00 174.94 174.29 1i0l s VAL 114 N 0.47 1.29 0.00 4.00 0.11 -0.57 -4.98 120.40 120.72 1i0l s VAL 114 Ca -0.02 -0.55 0.00 0.00 -2.93 0.00 0.00 61.98 58.48 1i0l s VAL 114 Cb -0.04 -1.18 0.00 0.00 -1.53 0.00 0.00 36.38 33.63 1i0l s VAL 114 CO -0.02 0.39 0.00 -3.20 -3.33 0.00 0.00 175.10 168.94 1i0l n ASN 115 N 3.97 0.00 0.15 3.54 5.15 -1.26 -0.95 115.26 125.86 1i0l n ASN 115 Ca -0.21 0.00 0.02 0.00 -0.60 0.00 0.00 54.58 53.79 1i0l n ASN 115 Cb 0.52 0.00 0.36 0.00 -0.53 0.00 0.00 39.78 40.12 1i0l n ASN 115 CO 0.00 0.00 0.00 0.71 1.40 0.00 0.00 177.26 179.37 1i0l h THR 116 N 0.00 1.24 -0.09 -0.44 1.35 -1.88 -2.88 112.91 110.21 1i0l h THR 116 Ca 0.00 -1.12 -0.04 0.00 -0.55 0.00 0.00 66.41 64.71 1i0l h THR 116 Cb 0.00 1.52 -0.01 0.00 -1.73 0.00 0.00 68.15 67.92 1i0l h THR 116 CO 0.00 0.33 -0.03 0.00 -0.25 0.00 0.00 175.52 175.56 1i0l n ALA 117 N -2.48 -0.03 0.20 6.62 0.00 -1.26 -1.32 120.51 122.24 1i0l n ALA 117 Ca -0.02 0.03 -0.15 0.00 0.00 0.00 0.00 53.44 53.31 1i0l n ALA 117 Cb 0.36 -0.96 -0.07 0.00 0.00 0.00 0.00 19.45 18.79 1i0l n ALA 117 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1i0l h LEU 118 N 0.00 -0.88 -0.39 0.00 3.38 -1.90 0.06 115.31 115.58 1i0l h LEU 118 Ca -0.04 0.08 -0.19 0.00 0.09 0.00 0.00 57.88 57.83 1i0l h LEU 118 Cb 0.62 0.30 -0.00 0.00 0.09 0.00 0.00 40.66 41.66 1i0l h LEU 118 CO 0.06 -0.45 -0.73 0.71 0.09 0.00 0.00 178.44 178.11 1i0l h THR 119 N -0.67 1.37 -0.36 0.22 1.35 -1.87 -2.50 112.91 110.46 1i0l h THR 119 Ca -0.01 -2.13 -0.09 0.00 -0.55 0.00 0.00 66.41 63.63 1i0l h THR 119 Cb 0.61 2.10 -0.02 0.00 -1.73 0.00 0.00 68.15 69.11 1i0l h THR 119 CO -0.07 0.64 -0.15 0.25 -0.25 0.00 0.00 175.52 175.94 1i0l h LEU 120 N 0.29 0.64 -0.48 3.87 5.85 -1.85 0.51 115.31 124.14 1i0l h LEU 120 Ca -0.03 -0.19 -0.14 0.00 0.84 0.00 0.00 57.88 58.36 1i0l h LEU 120 Cb 1.31 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 42.15 1i0l h LEU 120 CO 0.13 0.81 -0.25 -1.13 -0.34 0.00 0.00 178.44 177.66 1i0l h ASN 121 N 0.59 1.02 -0.09 1.25 -1.24 -0.90 -0.01 115.58 116.21 1i0l h ASN 121 Ca 0.10 -0.40 -0.00 0.00 0.71 0.00 0.00 56.30 56.70 1i0l h ASN 121 Cb 0.59 -0.28 -0.00 0.00 0.73 0.00 0.00 38.32 39.36 1i0l h ASN 121 CO 0.04 1.21 0.05 0.22 -1.29 0.00 0.00 177.43 177.66 1i0l h TYR 122 N 0.85 0.12 -0.60 0.67 3.20 -1.08 -1.57 116.97 118.55 1i0l h TYR 122 Ca 0.10 -0.00 -0.01 0.00 3.14 0.00 0.00 58.73 61.96 1i0l h TYR 122 Cb 0.83 -0.04 -0.03 0.00 1.54 0.00 0.00 36.73 39.04 1i0l h TYR 122 CO 0.05 0.12 0.33 -0.07 -1.64 0.00 0.00 178.16 176.95 1i0l h LEU 123 N 0.08 0.76 0.03 2.82 3.38 -0.72 -0.83 115.31 120.82 1i0l h LEU 123 Ca 0.03 -0.10 0.02 0.00 0.09 0.00 0.00 57.88 57.93 1i0l h LEU 123 Cb 0.04 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 40.56 1i0l h LEU 123 CO -0.01 0.63 -0.16 0.22 0.09 0.00 0.00 178.44 179.22 1i0l h TYR 124 N 0.82 -0.42 -0.54 1.13 3.20 -0.84 -1.62 116.97 118.70 1i0l h TYR 124 Ca 0.21 0.01 -0.02 0.00 3.14 0.00 0.00 58.73 62.08 1i0l h TYR 124 Cb 0.05 0.18 -0.03 0.00 1.54 0.00 0.00 36.73 38.47 1i0l h TYR 124 CO -0.01 -0.24 0.26 0.45 -1.64 0.00 0.00 178.16 176.98 1i0l h HIS 125 N -0.28 0.75 0.11 -3.82 3.86 -1.06 -0.81 115.15 113.89 1i0l h HIS 125 Ca 0.04 -0.02 -0.01 0.00 -1.16 0.00 0.00 60.37 59.23 1i0l h HIS 125 Cb 0.33 -0.24 0.00 0.00 1.06 0.00 0.00 27.41 28.57 1i0l h HIS 125 CO -0.20 0.55 -0.05 1.98 0.86 0.00 0.00 177.93 181.07 1i0l h MET 126 N 0.76 -0.15 0.00 2.45 1.85 -0.64 -2.34 114.93 116.87 1i0l h MET 126 Ca 0.19 0.01 -0.09 0.00 -0.61 0.00 0.00 59.70 59.20 1i0l h MET 126 Cb 0.08 0.03 -0.01 0.00 0.43 0.00 0.00 31.60 32.14 1i0l h MET 126 CO -0.03 -0.02 -0.41 1.88 -0.40 0.00 0.00 176.91 177.94 1i0l h TYR 127 N -0.24 0.00 -0.69 1.39 -1.99 -1.21 -2.87 116.97 111.36 1i0l h TYR 127 Ca -0.02 0.00 -0.02 0.00 2.00 0.00 0.00 58.73 60.69 1i0l h TYR 127 Cb 0.20 0.00 -0.03 0.00 2.00 0.00 0.00 36.73 38.89 1i0l h TYR 127 CO -0.04 0.41 0.35 0.35 -0.00 0.00 0.00 178.16 179.23 1i0l h PHE 128 N 0.00 0.96 0.00 4.88 3.57 -0.84 -1.78 116.94 123.73 1i0l h PHE 128 Ca -0.00 -0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.47 1i0l h PHE 128 Cb 0.83 -0.30 0.00 0.00 2.79 0.00 0.00 35.95 39.26 1i0l h PHE 128 CO 0.00 0.69 0.00 0.25 -2.23 0.00 0.00 178.31 177.02 1i0l n THR 129 N -4.35 0.57 0.51 4.41 -2.24 -0.91 -2.61 114.28 109.67 1i0l n THR 129 Ca 0.07 0.14 0.07 0.00 -2.27 0.00 0.00 64.05 62.06 1i0l n THR 129 Cb 0.12 -0.82 0.20 0.00 -2.10 0.00 0.00 70.33 67.72 1i0l n THR 129 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1i0l n ARG 130 N -1.39 2.20 -3.61 -0.78 1.74 -0.67 -4.97 116.66 109.18 1i0l n ARG 130 Ca 0.07 -1.61 -0.20 0.00 -0.77 0.00 0.00 57.85 55.34 1i0l n ARG 130 Cb 0.19 -1.43 0.05 0.00 -1.02 0.00 0.00 32.46 30.24 1i0l n ARG 130 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1i0l n ARG 131 N 0.71 -5.38 -1.39 5.56 1.74 -1.07 -3.60 116.66 113.22 1i0l n ARG 131 Ca 0.15 0.69 -0.29 0.00 -0.77 0.00 0.00 57.85 57.63 1i0l n ARG 131 Cb 0.43 -5.39 0.14 0.00 -1.02 0.00 0.00 32.46 26.63 1i0l n ARG 131 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 1i0l s PRO 132 N -5.78 1.04 0.23 5.56 0.04 -1.26 -1.33 135.00 133.51 1i0l s PRO 132 Ca 0.01 0.45 -0.05 0.00 0.04 0.00 0.00 61.00 61.45 1i0l s PRO 132 Cb -0.00 -1.81 0.24 0.00 0.04 0.00 0.00 34.50 32.97 1i0l s PRO 132 CO 0.79 -2.30 1.74 0.00 0.04 0.00 0.00 177.00 177.27 1i0l h ALA 133 N -1.58 1.04 -2.77 8.56 0.00 0.40 -3.41 119.26 121.51 1i0l h ALA 133 Ca -0.51 -0.26 -0.04 0.00 0.00 0.00 0.00 54.91 54.10 1i0l h ALA 133 Cb 1.32 -0.22 -0.14 0.00 0.00 0.00 0.00 17.79 18.75 1i0l h ALA 133 CO 0.60 0.61 0.06 -1.54 0.00 0.00 0.00 179.25 178.97 1i0l s SER 134 N -6.57 -0.41 -0.06 0.00 1.04 -1.04 -4.94 113.70 101.72 1i0l s SER 134 Ca -0.11 -0.07 -0.02 0.00 0.48 0.00 0.00 55.95 56.23 1i0l s SER 134 Cb 0.15 0.52 0.04 0.00 0.10 0.00 0.00 66.02 66.83 1i0l s SER 134 CO 0.83 -0.86 0.12 -0.22 0.98 0.00 0.00 173.24 174.09 1i0l s LEU 135 N -2.55 0.47 0.25 2.42 2.96 -1.26 -1.65 118.68 119.32 1i0l s LEU 135 Ca -0.00 0.23 0.02 0.00 -0.22 0.00 0.00 54.13 54.16 1i0l s LEU 135 Cb 0.00 0.18 -0.04 0.00 0.50 0.00 0.00 46.19 46.84 1i0l s LEU 135 CO -0.09 -0.19 0.17 -0.54 -1.32 0.00 0.00 176.35 174.38 1i0l s LYS 136 N 1.63 1.40 0.02 1.98 1.02 -0.50 -5.01 119.74 120.28 1i0l s LYS 136 Ca -0.04 -1.77 0.02 0.00 0.02 0.00 0.00 55.97 54.21 1i0l s LYS 136 Cb -0.12 0.24 -0.01 0.00 -0.52 0.00 0.00 37.83 37.42 1i0l s LYS 136 CO -0.05 -0.47 -0.06 0.95 -0.92 0.00 0.00 175.35 174.80 1i0l s THR 137 N -3.90 0.48 -0.06 2.17 -4.23 -1.26 -0.60 115.64 108.24 1i0l s THR 137 Ca 0.39 -0.61 0.02 0.00 -1.18 0.00 0.00 61.69 60.31 1i0l s THR 137 Cb 0.06 -0.47 0.02 0.00 1.34 0.00 0.00 72.50 73.44 1i0l s THR 137 CO 0.17 -0.10 -0.09 0.54 -0.54 0.00 0.00 174.62 174.60 1i0l s VAL 138 N -0.68 0.87 0.01 2.29 0.11 0.41 -2.16 120.40 121.25 1i0l s VAL 138 Ca -0.03 -0.32 0.06 0.00 -2.93 0.00 0.00 61.98 58.76 1i0l s VAL 138 Cb -0.06 -0.83 -0.02 0.00 -1.53 0.00 0.00 36.38 33.94 1i0l s VAL 138 CO 0.00 0.30 -0.19 -0.69 -3.33 0.00 0.00 175.10 171.19 1i0l s VAL 139 N 0.79 1.50 -0.03 2.04 1.01 -0.75 -1.51 120.40 123.45 1i0l s VAL 139 Ca -0.13 -0.92 -0.21 0.00 0.00 0.00 0.00 61.98 60.72 1i0l s VAL 139 Cb -0.15 -1.27 -0.15 0.00 0.00 0.00 0.00 36.38 34.81 1i0l s VAL 139 CO 0.02 0.33 0.93 0.25 0.00 0.00 0.00 175.10 176.63 1i0l h LEU 140 N 5.40 -0.26 -8.52 3.92 5.85 -1.34 -1.52 115.31 118.84 1i0l h LEU 140 Ca -0.39 -0.26 -0.69 0.00 0.84 0.00 0.00 57.88 57.38 1i0l h LEU 140 Cb 1.15 0.07 -0.31 0.00 0.37 0.00 0.00 40.66 41.94 1i0l h LEU 140 CO 0.47 0.23 -0.88 -0.76 -0.34 0.00 0.00 178.44 177.15 1i0l s LEU 141 N -9.13 2.05 -0.13 2.25 1.43 -0.02 -0.88 118.68 114.26 1i0l s LEU 141 Ca -0.12 -0.48 0.01 0.00 -1.03 0.00 0.00 54.13 52.50 1i0l s LEU 141 Cb 0.01 -1.33 0.02 0.00 0.03 0.00 0.00 46.19 44.92 1i0l s LEU 141 CO 0.46 0.27 -0.13 -0.62 0.23 0.00 0.00 176.35 176.56 1i0l s ASP 142 N -0.34 2.54 -1.15 2.29 -1.08 0.08 -1.51 116.67 117.50 1i0l s ASP 142 Ca 0.02 -0.44 -0.11 0.00 -0.52 0.00 0.00 52.55 51.50 1i0l s ASP 142 Cb -0.12 -1.10 0.24 0.00 -1.46 0.00 0.00 42.92 40.48 1i0l s ASP 142 CO 0.02 -0.05 1.24 -0.54 0.52 0.00 0.00 175.17 176.36 1i0l s LYS 143 N 1.41 4.17 0.47 4.34 1.02 -0.13 -0.49 119.74 130.53 1i0l s LYS 143 Ca 0.02 -2.98 0.26 0.00 0.02 0.00 0.00 55.97 53.30 1i0l s LYS 143 Cb -0.13 -4.76 1.31 0.00 -0.52 0.00 0.00 37.83 33.73 1i0l s LYS 143 CO -0.08 -1.45 1.82 0.00 -0.92 0.00 0.00 175.35 174.72 1i0l h ARG 144 N 6.84 0.19 -0.00 1.68 3.08 -1.83 -1.54 114.38 122.81 1i0l h ARG 144 Ca 0.23 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.27 1i0l h ARG 144 Cb 0.87 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.88 1i0l h ARG 144 CO 1.11 0.13 -0.07 0.39 -1.07 0.00 0.00 179.97 180.45 1i0l n GLU 145 N -4.41 0.68 -0.09 0.04 1.02 -1.26 -4.09 120.64 112.53 1i0l n GLU 145 Ca 0.23 -0.17 0.11 0.00 -0.02 0.00 0.00 57.16 57.31 1i0l n GLU 145 Cb 0.98 -1.50 0.35 0.00 -0.02 0.00 0.00 31.44 31.25 1i0l n GLU 145 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1i0l n GLY 146 N 1.25 0.54 3.65 0.62 0.00 -0.58 -4.99 105.19 105.69 1i0l n GLY 146 Ca 0.15 -0.49 -0.46 0.00 0.00 0.00 0.00 46.02 45.23 1i0l n GLY 146 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1i0l n ARG 147 N 0.55 1.88 0.00 1.61 5.12 -1.09 -3.49 116.66 121.25 1i0l n ARG 147 Ca 0.17 0.67 0.04 0.00 -1.93 0.00 0.00 57.85 56.80 1i0l n ARG 147 Cb 0.39 -2.30 -0.03 0.00 -1.16 0.00 0.00 32.46 29.36 1i0l n ARG 147 CO 0.00 0.00 0.00 2.89 -1.93 0.00 0.00 177.63 178.59 1i0l n ARG 148 N 2.03 3.43 -3.70 5.56 1.85 -0.43 -4.95 116.66 120.44 1i0l n ARG 148 Ca 0.12 -0.24 -0.13 0.00 -1.00 0.00 0.00 57.85 56.60 1i0l n ARG 148 Cb 0.30 -0.94 -0.09 0.00 -1.05 0.00 0.00 32.46 30.68 1i0l n ARG 148 CO 0.00 0.00 0.00 0.54 -0.01 0.00 0.00 177.63 178.16 1i0l s VAL 149 N -1.53 -0.00 0.14 8.89 0.11 -1.20 -5.02 120.40 121.79 1i0l s VAL 149 Ca 0.05 0.00 -0.31 0.00 -2.93 0.00 0.00 61.98 58.78 1i0l s VAL 149 Cb 0.06 -0.70 -0.11 0.00 -1.53 0.00 0.00 36.38 34.11 1i0l s VAL 149 CO 0.28 0.00 1.81 -2.65 -3.33 0.00 0.00 175.10 171.21 1i0l n PRO 150 N 2.83 2.78 -3.68 1.54 -0.02 -1.26 -4.81 135.00 132.38 1i0l n PRO 150 Ca -0.14 1.01 -0.10 0.00 -2.02 0.00 0.00 63.50 62.25 1i0l n PRO 150 Cb 0.57 -2.89 -0.09 0.00 -0.02 0.00 0.00 33.50 31.06 1i0l n PRO 150 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 1i0l s PHE 151 N 2.37 -0.74 -0.10 6.00 5.36 -1.26 -5.04 117.98 124.57 1i0l s PHE 151 Ca 0.80 1.59 0.03 0.00 -0.96 0.00 0.00 56.93 58.39 1i0l s PHE 151 Cb -0.49 0.37 0.01 0.00 -0.34 0.00 0.00 43.02 42.56 1i0l s PHE 151 CO 0.36 -0.39 -0.18 -1.12 -1.46 0.00 0.00 175.22 172.43 1i0l s SER 152 N 1.21 2.55 0.13 6.13 0.01 -1.26 -5.09 113.70 117.38 1i0l s SER 152 Ca -0.07 -0.46 -0.16 0.00 1.31 0.00 0.00 55.95 56.57 1i0l s SER 152 Cb -0.06 -1.16 -0.07 0.00 0.21 0.00 0.00 66.02 64.93 1i0l s SER 152 CO -0.12 0.08 0.57 0.00 0.41 0.00 0.00 173.24 174.18 1i0l s ALA 153 N 0.63 3.57 0.28 1.44 0.00 -1.26 -4.96 121.76 121.46 1i0l s ALA 153 Ca -0.14 -0.06 0.12 0.00 0.00 0.00 0.00 51.96 51.88 1i0l s ALA 153 Cb -0.16 -2.58 0.47 0.00 0.00 0.00 0.00 23.12 20.84 1i0l s ALA 153 CO 0.04 0.43 1.67 -0.44 0.00 0.00 0.00 175.76 177.46 1i0l h ASP 154 N 3.80 0.00 -3.78 0.00 3.32 -1.83 -3.44 116.42 114.50 1i0l h ASP 154 Ca -0.49 0.00 -0.21 0.00 0.02 0.00 0.00 57.03 56.35 1i0l h ASP 154 Cb 1.20 0.00 -0.27 0.00 0.22 0.00 0.00 39.33 40.48 1i0l h ASP 154 CO 0.65 0.54 -0.64 -0.31 -1.72 0.00 0.00 179.24 177.77 1i0l s TYR 155 N -3.73 -0.07 -0.01 4.55 1.51 -0.96 -5.02 117.35 113.61 1i0l s TYR 155 Ca -0.01 0.18 -0.01 0.00 -1.01 0.00 0.00 57.07 56.22 1i0l s TYR 155 Cb 0.13 0.02 0.01 0.00 -0.11 0.00 0.00 41.96 42.01 1i0l s TYR 155 CO 0.75 -0.04 0.03 0.08 -1.11 0.00 0.00 175.55 175.25 1i0l s VAL 156 N 0.01 -0.02 0.03 0.71 1.01 -1.26 -1.81 120.40 119.06 1i0l s VAL 156 Ca -0.00 0.07 -0.16 0.00 0.00 0.00 0.00 61.98 61.89 1i0l s VAL 156 Cb -0.01 -0.05 -0.36 0.00 0.00 0.00 0.00 36.38 35.96 1i0l s VAL 156 CO 0.00 0.03 0.98 0.58 0.00 0.00 0.00 175.10 176.69 1i0l h VAL 157 N 5.49 1.26 -2.16 2.92 2.07 -0.71 -3.48 116.25 121.64 1i0l h VAL 157 Ca -0.31 -2.69 -0.06 0.00 0.82 0.00 0.00 66.70 64.46 1i0l h VAL 157 Cb 1.18 3.03 -0.21 0.00 -1.52 0.00 0.00 31.29 33.77 1i0l h VAL 157 CO 0.49 0.81 0.06 0.00 0.02 0.00 0.00 177.57 178.95 1i0l s ALA 158 N -2.60 -1.61 0.03 1.67 0.00 -0.06 -5.01 121.76 114.18 1i0l s ALA 158 Ca -0.09 1.79 -0.19 0.00 0.00 0.00 0.00 51.96 53.46 1i0l s ALA 158 Cb 0.04 -0.98 -0.06 0.00 0.00 0.00 0.00 23.12 22.12 1i0l s ALA 158 CO 0.94 -0.31 0.55 -0.80 0.00 0.00 0.00 175.76 176.14 1i0l s ASN 159 N 0.22 6.98 0.07 0.00 0.01 -1.26 -0.74 114.94 120.21 1i0l s ASN 159 Ca -0.01 1.16 0.01 0.00 -0.71 0.00 0.00 52.86 53.31 1i0l s ASN 159 Cb -0.04 -2.34 -0.04 0.00 0.41 0.00 0.00 41.25 39.24 1i0l s ASN 159 CO 0.02 0.21 -0.06 0.27 -1.51 0.00 0.00 177.10 176.03 1i0l s ILE 160 N -0.72 0.49 0.83 0.60 -4.36 0.35 -4.87 121.20 113.52 1i0l s ILE 160 Ca 0.29 -1.65 -0.14 0.00 -0.26 0.00 0.00 60.65 58.89 1i0l s ILE 160 Cb -0.18 -1.31 0.20 0.00 1.25 0.00 0.00 42.46 42.41 1i0l s ILE 160 CO 0.17 -0.78 0.97 -0.81 0.24 0.00 0.00 174.94 174.74 1i0l n PRO 161 N 0.43 -1.59 -2.73 0.37 -0.04 -1.26 -4.15 135.00 126.04 1i0l n PRO 161 Ca -0.16 -1.52 -0.42 0.00 -0.04 0.00 0.00 63.50 61.36 1i0l n PRO 161 Cb 0.59 -1.14 -0.03 0.00 -0.04 0.00 0.00 33.50 32.89 1i0l n PRO 161 CO 0.00 0.00 0.00 1.21 -0.04 0.00 0.00 175.50 176.67 1i0l s ASN 162 N -4.45 6.56 -0.02 3.54 3.84 -1.26 -4.89 114.94 118.26 1i0l s ASN 162 Ca 0.58 -1.72 -0.08 0.00 0.21 0.00 0.00 52.86 51.84 1i0l s ASN 162 Cb -0.03 -2.49 0.01 0.00 -0.55 0.00 0.00 41.25 38.19 1i0l s ASN 162 CO 0.42 -1.30 0.18 0.00 -2.79 0.00 0.00 177.10 173.60 1i0l s ALA 163 N 3.92 -0.43 -0.29 1.71 0.00 -1.26 -5.11 121.76 120.31 1i0l s ALA 163 Ca 0.40 0.09 -0.29 0.00 0.00 0.00 0.00 51.96 52.16 1i0l s ALA 163 Cb -0.02 0.00 0.01 0.00 0.00 0.00 0.00 23.12 23.11 1i0l s ALA 163 CO -0.10 -0.19 1.05 0.12 0.00 0.00 0.00 175.76 176.64 1i0l s PHE 164 N -1.02 3.22 0.07 0.00 5.36 -1.26 -5.01 117.98 119.34 1i0l s PHE 164 Ca -0.11 1.28 0.03 0.00 -0.96 0.00 0.00 56.93 57.17 1i0l s PHE 164 Cb -0.06 -3.52 -0.04 0.00 -0.34 0.00 0.00 43.02 39.07 1i0l s PHE 164 CO 0.02 -0.65 0.08 0.14 -1.46 0.00 0.00 175.22 173.34 1i0l s VAL 165 N 3.46 4.56 0.12 3.12 -7.23 -1.26 -1.28 120.40 121.88 1i0l s VAL 165 Ca 0.44 -0.73 -0.00 0.00 -1.81 0.00 0.00 61.98 59.89 1i0l s VAL 165 Cb -0.13 -3.19 -0.04 0.00 0.56 0.00 0.00 36.38 33.58 1i0l s VAL 165 CO 0.12 0.15 0.01 0.27 -0.31 0.00 0.00 175.10 175.33 1i0l s ILE 166 N -1.37 0.34 0.00 -0.62 -4.36 0.02 -4.62 121.20 110.59 1i0l s ILE 166 Ca 0.29 -1.91 0.00 0.00 -0.26 0.00 0.00 60.65 58.77 1i0l s ILE 166 Cb -0.12 -1.90 0.00 0.00 1.25 0.00 0.00 42.46 41.69 1i0l s ILE 166 CO 0.21 -0.64 0.00 0.61 0.24 0.00 0.00 174.94 175.36 1i0l n GLY 167 N -0.08 2.01 3.94 6.27 0.00 0.26 -1.39 105.19 116.21 1i0l n GLY 167 Ca -0.08 -1.93 -0.29 0.00 0.00 0.00 0.00 46.02 43.71 1i0l n GLY 167 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1i0l n TYR 168 N 1.87 -2.05 0.00 1.61 9.36 -0.22 -1.27 117.16 126.46 1i0l n TYR 168 Ca 0.00 0.86 0.00 0.00 3.32 0.00 0.00 57.90 62.08 1i0l n TYR 168 Cb 0.00 -3.82 0.00 0.00 -0.63 0.00 0.00 39.34 34.89 1i0l n TYR 168 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 1i0l n GLY 169 N -1.65 2.84 3.74 2.98 0.00 0.31 -4.52 105.19 108.88 1i0l n GLY 169 Ca -0.05 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.56 1i0l n GLY 169 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1i0l s LEU 170 N 0.00 4.55 0.29 0.99 1.43 -0.40 -4.24 118.68 121.31 1i0l s LEU 170 Ca 0.00 1.78 0.05 0.00 -1.03 0.00 0.00 54.13 54.93 1i0l s LEU 170 Cb 0.00 -3.51 -0.06 0.00 0.03 0.00 0.00 46.19 42.65 1i0l s LEU 170 CO 0.00 0.04 -0.01 1.51 0.23 0.00 0.00 176.35 178.12 1i0l s ASP 171 N -0.49 2.59 -0.21 2.29 -4.77 -1.26 -0.58 116.67 114.25 1i0l s ASP 171 Ca 0.43 -1.26 -0.01 0.00 -3.30 0.00 0.00 52.55 48.41 1i0l s ASP 171 Cb -0.24 -0.13 0.06 0.00 -1.09 0.00 0.00 42.92 41.52 1i0l s ASP 171 CO 0.29 -0.45 -0.01 -0.47 0.70 0.00 0.00 175.17 175.23 1i0l s TYR 172 N -3.13 1.69 -1.31 2.11 5.04 -0.47 -4.80 117.35 116.48 1i0l s TYR 172 Ca 0.32 -1.27 -0.04 0.00 -2.44 0.00 0.00 57.07 53.64 1i0l s TYR 172 Cb 0.06 -1.30 0.01 0.00 0.35 0.00 0.00 41.96 41.09 1i0l s TYR 172 CO 0.13 -0.68 0.97 -3.47 -1.34 0.00 0.00 175.55 171.16 1i0l n ASP 173 N 4.87 -3.23 -1.64 4.32 2.03 -1.26 -1.19 116.55 120.45 1i0l n ASP 173 Ca -0.11 -0.67 -0.20 0.00 0.52 0.00 0.00 54.79 54.33 1i0l n ASP 173 Cb 0.46 -4.68 -0.08 0.00 -0.72 0.00 0.00 41.12 36.09 1i0l n ASP 173 CO 0.00 0.00 0.00 -0.67 -1.92 0.00 0.00 177.20 174.61 1i0l n ASP 174 N -3.05 -5.41 -4.49 1.67 2.03 -1.26 -4.97 116.55 101.07 1i0l n ASP 174 Ca -0.18 0.48 -0.31 0.00 0.52 0.00 0.00 54.79 55.30 1i0l n ASP 174 Cb 0.63 -4.77 -0.12 0.00 -0.72 0.00 0.00 41.12 36.13 1i0l n ASP 174 CO 0.00 0.00 0.00 -0.89 -1.92 0.00 0.00 177.20 174.39 1i0l s THR 175 N -2.75 2.94 0.00 5.18 2.01 -0.33 -4.72 115.64 117.97 1i0l s THR 175 Ca 0.00 -1.18 0.00 0.00 0.31 0.00 0.00 61.69 60.82 1i0l s THR 175 Cb 0.00 -2.27 0.00 0.00 0.01 0.00 0.00 72.50 70.24 1i0l s THR 175 CO 0.00 0.30 0.00 -1.22 -0.69 0.00 0.00 174.62 173.01 1i0l n TYR 176 N 1.40 0.00 0.16 4.92 4.02 -1.26 -1.37 117.16 125.03 1i0l n TYR 176 Ca -0.16 0.00 0.07 0.00 -0.01 0.00 0.00 57.90 57.80 1i0l n TYR 176 Cb 0.52 0.00 0.57 0.00 -0.02 0.00 0.00 39.34 40.41 1i0l n TYR 176 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1i0l h ARG 177 N 2.20 0.19 0.00 -0.72 3.08 -1.84 -2.82 114.38 114.47 1i0l h ARG 177 Ca 0.00 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.04 1i0l h ARG 177 Cb 0.00 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.01 1i0l h ARG 177 CO 0.00 0.12 0.00 -0.85 -1.07 0.00 0.00 179.97 178.17 1i0l n GLU 178 N -4.51 0.38 -1.91 0.04 0.00 -1.26 -0.53 120.64 112.85 1i0l n GLU 178 Ca -0.01 0.06 -0.40 0.00 0.00 0.00 0.00 57.16 56.81 1i0l n GLU 178 Cb 0.09 -1.50 0.00 0.00 0.00 0.00 0.00 31.44 30.04 1i0l n GLU 178 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.13 176.62 1i0l s LEU 179 N -2.50 4.21 0.44 -1.84 1.43 -1.11 -4.82 118.68 114.48 1i0l s LEU 179 Ca 0.24 2.84 0.24 0.00 -1.03 0.00 0.00 54.13 56.43 1i0l s LEU 179 Cb 0.16 -3.85 0.62 0.00 0.03 0.00 0.00 46.19 43.15 1i0l s LEU 179 CO 0.35 -0.96 1.70 0.03 0.23 0.00 0.00 176.35 177.70 1i0l h ARG 180 N 2.66 0.00 -5.99 1.70 3.08 -1.93 -0.55 114.38 113.34 1i0l h ARG 180 Ca -0.50 0.00 -0.54 0.00 0.07 0.00 0.00 59.98 59.00 1i0l h ARG 180 Cb 1.25 0.00 -0.06 0.00 0.08 0.00 0.00 29.97 31.24 1i0l h ARG 180 CO 0.62 0.12 -0.42 -0.51 -1.07 0.00 0.00 179.97 178.72 1i0l s ASP 181 N -6.13 4.68 -0.19 7.04 1.01 -1.26 -3.87 116.67 117.95 1i0l s ASP 181 Ca 0.04 -1.00 -0.03 0.00 0.71 0.00 0.00 52.55 52.27 1i0l s ASP 181 Cb 0.07 -0.32 -0.01 0.00 1.01 0.00 0.00 42.92 43.67 1i0l s ASP 181 CO 0.65 -0.70 -0.07 -0.63 0.21 0.00 0.00 175.17 174.63 1i0l s ILE 182 N -2.59 3.30 0.24 0.77 1.01 -0.23 -3.14 121.20 120.56 1i0l s ILE 182 Ca 0.42 -0.54 0.05 0.00 0.00 0.00 0.00 60.65 60.58 1i0l s ILE 182 Cb 0.00 -2.46 -0.05 0.00 0.01 0.00 0.00 42.46 39.96 1i0l s ILE 182 CO 0.24 0.46 -0.03 0.68 0.00 0.00 0.00 174.94 176.29 1i0l s VAL 183 N 1.07 1.25 -0.24 2.92 -7.23 -0.48 -0.81 120.40 116.88 1i0l s VAL 183 Ca 0.01 -2.07 -0.14 0.00 -1.81 0.00 0.00 61.98 57.97 1i0l s VAL 183 Cb -0.15 -2.34 -0.04 0.00 0.56 0.00 0.00 36.38 34.41 1i0l s VAL 183 CO -0.01 -0.35 0.34 -0.69 -0.31 0.00 0.00 175.10 174.08 1i0l s VAL 184 N -3.27 5.22 0.25 1.32 1.01 0.07 -0.80 120.40 124.20 1i0l s VAL 184 Ca 0.28 0.54 -0.30 0.00 0.00 0.00 0.00 61.98 62.50 1i0l s VAL 184 Cb 0.05 -3.67 -0.09 0.00 0.00 0.00 0.00 36.38 32.67 1i0l s VAL 184 CO 0.09 0.23 1.18 -0.22 0.00 0.00 0.00 175.10 176.39 1i0l s LEU 185 N 1.58 4.48 -0.07 3.92 2.96 -0.41 -0.20 118.68 130.96 1i0l s LEU 185 Ca 0.15 2.33 -0.36 0.00 -0.22 0.00 0.00 54.13 56.04 1i0l s LEU 185 Cb -0.15 -3.62 -0.13 0.00 0.50 0.00 0.00 46.19 42.78 1i0l s LEU 185 CO 0.08 -0.32 1.75 -2.11 -1.32 0.00 0.00 176.35 174.43 1i0l n ARG 186 N 1.72 1.86 -0.35 1.98 1.85 -0.29 -4.60 116.66 118.83 1i0l n ARG 186 Ca 0.02 0.68 0.12 0.00 -1.00 0.00 0.00 57.85 57.66 1i0l n ARG 186 Cb 0.44 -2.46 0.31 0.00 -1.05 0.00 0.00 32.46 29.70 1i0l n ARG 186 CO 0.00 0.00 0.00 -1.35 -0.01 0.00 0.00 177.63 176.27 1i0l h PRO 187 N 7.75 0.79 -0.33 2.89 0.11 -1.91 -0.47 132.00 140.82 1i0l h PRO 187 Ca -0.47 -0.05 0.02 0.00 0.11 0.00 0.00 66.00 65.61 1i0l h PRO 187 Cb 1.28 -0.18 -0.02 0.00 0.11 0.00 0.00 31.00 32.19 1i0l h PRO 187 CO 0.92 0.52 0.19 0.93 -0.21 0.00 0.00 178.00 180.35 1i0l h GLU 188 N 0.81 0.37 -0.38 1.05 3.07 -1.99 0.08 114.58 117.60 1i0l h GLU 188 Ca 0.56 -0.02 0.01 0.00 -0.50 0.00 0.00 59.36 59.41 1i0l h GLU 188 Cb 0.82 -0.08 -0.02 0.00 -0.84 0.00 0.00 28.75 28.62 1i0l h GLU 188 CO -0.36 0.24 0.24 0.28 -1.40 0.00 0.00 179.01 178.01 1i0l h VAL 189 N 0.38 1.07 0.03 3.13 2.07 -1.48 -0.70 116.25 120.75 1i0l h VAL 189 Ca 0.13 -0.16 -0.00 0.00 0.82 0.00 0.00 66.70 67.49 1i0l h VAL 189 Cb 0.02 0.55 0.00 0.00 -1.52 0.00 0.00 31.29 30.34 1i0l h VAL 189 CO -0.07 0.09 -0.01 0.22 0.02 0.00 0.00 177.57 177.81 1i0l h TYR 190 N 0.48 -0.04 -0.14 1.57 3.20 -1.04 -1.69 116.97 119.31 1i0l h TYR 190 Ca 0.14 -0.00 0.03 0.00 3.14 0.00 0.00 58.73 62.04 1i0l h TYR 190 Cb -0.03 0.01 -0.03 0.00 1.54 0.00 0.00 36.73 38.23 1i0l h TYR 190 CO -0.06 -0.02 -0.06 0.00 -1.64 0.00 0.00 178.16 176.38 1i0l h ALA 191 N 0.92 0.07 0.31 1.82 0.00 -0.67 0.17 119.26 121.88 1i0l h ALA 191 Ca -0.00 0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 1i0l h ALA 191 Cb 0.04 0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.97 1i0l h ALA 191 CO 0.01 -0.50 -0.15 1.05 0.00 0.00 0.00 179.25 179.66 1i0l h GLU 192 N -0.04 -0.40 -0.31 0.00 -0.00 -1.10 -2.38 114.58 110.36 1i0l h GLU 192 Ca 0.07 0.03 -0.06 0.00 -0.00 0.00 0.00 59.36 59.40 1i0l h GLU 192 Cb 0.15 0.09 -0.02 0.00 -0.00 0.00 0.00 28.75 28.97 1i0l h GLU 192 CO -0.16 -0.21 -0.07 0.00 -0.00 0.00 0.00 179.01 178.57 1i0l h ARG 193 N -0.50 0.50 -0.14 1.06 3.08 -1.23 -0.73 114.38 116.42 1i0l h ARG 193 Ca -0.04 -0.12 -0.01 0.00 0.07 0.00 0.00 59.98 59.87 1i0l h ARG 193 Cb 0.37 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.35 1i0l h ARG 193 CO 0.07 0.57 0.04 0.93 -1.07 0.00 0.00 179.97 180.52 1i0l h GLU 194 N 0.47 0.21 -0.15 0.04 4.39 -0.59 -2.62 114.58 116.33 1i0l h GLU 194 Ca 0.09 -0.05 -0.07 0.00 0.34 0.00 0.00 59.36 59.68 1i0l h GLU 194 Cb 0.41 -0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 29.02 1i0l h GLU 194 CO 0.02 0.34 -0.22 0.00 -1.16 0.00 0.00 179.01 178.00 1i0l h ALA 195 N 0.86 1.36 0.00 3.43 0.00 -1.17 -3.51 119.26 120.22 1i0l h ALA 195 Ca 0.04 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.68 1i0l h ALA 195 Cb 0.22 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.92 1i0l h ALA 195 CO -0.00 0.44 0.00 0.00 0.00 0.00 0.00 179.25 179.69