#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ixj n MET 2 N 0.00 0.00 0.00 -1.46 3.85 -1.26 -5.03 117.12 113.22 2ixj n MET 2 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 57.70 56.70 2ixj n MET 2 Cb 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 33.22 32.17 2ixj n MET 2 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 2ixj n ALA 3 N -3.00 0.00 -3.64 3.17 0.00 -1.26 -5.09 120.51 110.70 2ixj n ALA 3 Ca 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.40 2ixj n ALA 3 Cb 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.39 2ixj n ALA 3 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2ixj s MET 4 N 0.00 0.62 0.23 0.00 0.00 -1.26 -4.38 119.30 114.52 2ixj s MET 4 Ca 0.00 1.29 -0.31 0.00 0.00 0.00 0.00 55.69 56.67 2ixj s MET 4 Cb 0.00 0.48 -0.13 0.00 0.00 0.00 0.00 34.83 35.17 2ixj s MET 4 CO 0.00 -0.17 1.44 1.63 0.00 0.00 0.00 175.02 177.93 2ixj n LYS 5 N 4.82 2.10 -4.72 3.16 5.02 -0.28 -4.78 118.16 123.49 2ixj n LYS 5 Ca -0.16 0.75 -0.27 0.00 -2.02 0.00 0.00 58.31 56.61 2ixj n LYS 5 Cb 0.54 -2.43 -0.17 0.00 -0.02 0.00 0.00 35.03 32.95 2ixj n LYS 5 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2ixj s ALA 6 N 0.06 1.57 -0.09 7.82 0.00 -1.26 -0.54 121.76 129.31 2ixj s ALA 6 Ca 0.69 -0.61 -0.00 0.00 0.00 0.00 0.00 51.96 52.04 2ixj s ALA 6 Cb -0.64 -0.68 0.02 0.00 0.00 0.00 0.00 23.12 21.82 2ixj s ALA 6 CO 0.48 0.12 -0.07 0.99 0.00 0.00 0.00 175.76 177.28 2ixj s THR 7 N 0.65 0.91 0.13 0.00 2.01 -0.25 -4.98 115.64 114.11 2ixj s THR 7 Ca -0.14 -0.25 -0.30 0.00 0.31 0.00 0.00 61.69 61.31 2ixj s THR 7 Cb -0.16 -0.93 -0.07 0.00 0.01 0.00 0.00 72.50 71.34 2ixj s THR 7 CO 0.04 0.34 1.24 -0.13 -0.69 0.00 0.00 174.62 175.42 2ixj s ARG 8 N 1.53 4.43 0.65 4.92 0.52 -1.26 -0.99 118.95 128.74 2ixj s ARG 8 Ca 0.01 1.89 -0.04 0.00 -0.52 0.00 0.00 55.73 57.07 2ixj s ARG 8 Cb -0.13 -3.28 0.14 0.00 0.52 0.00 0.00 34.95 32.20 2ixj s ARG 8 CO -0.05 -0.23 0.89 1.28 0.02 0.00 0.00 175.30 177.21 2ixj n LEU 9 N 3.29 0.00 -0.24 2.53 4.77 -0.62 -4.95 117.00 121.78 2ixj n LEU 9 Ca 0.07 -1.57 0.13 0.00 -0.03 0.00 0.00 56.01 54.61 2ixj n LEU 9 Cb 0.45 -0.61 0.41 0.00 -2.33 0.00 0.00 43.42 41.34 2ixj n LEU 9 CO 0.56 -1.00 1.22 0.00 -1.33 0.00 0.00 177.39 176.84 2ixj h ALA 10 N -0.92 1.91 -2.15 -1.18 0.00 -1.96 -3.07 119.26 111.88 2ixj h ALA 10 Ca -0.29 0.01 -0.66 0.00 0.00 0.00 0.00 54.91 53.97 2ixj h ALA 10 Cb 0.99 -0.11 -0.16 0.00 0.00 0.00 0.00 17.79 18.51 2ixj h ALA 10 CO 0.28 -0.14 0.10 0.42 0.00 0.00 0.00 179.25 179.91 2ixj s ILE 11 N -5.61 4.84 0.39 0.00 1.01 -1.26 -4.98 121.20 115.59 2ixj s ILE 11 Ca -0.09 -0.09 0.23 0.00 0.00 0.00 0.00 60.65 60.69 2ixj s ILE 11 Cb 0.22 -4.24 0.24 0.00 0.01 0.00 0.00 42.46 38.69 2ixj s ILE 11 CO 0.78 -0.68 2.00 -0.65 0.00 0.00 0.00 174.94 176.40 2ixj h PRO 12 N 8.93 0.00 0.00 2.79 0.11 -1.91 -0.92 132.00 141.00 2ixj h PRO 12 Ca -0.26 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.85 2ixj h PRO 12 Cb 1.10 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.21 2ixj h PRO 12 CO 0.92 0.18 0.00 -0.44 -0.21 0.00 0.00 178.00 178.44 2ixj h ASP 13 N 0.00 0.00 -3.37 -2.05 3.32 -1.94 -3.40 116.42 108.98 2ixj h ASP 13 Ca -0.00 0.00 -0.58 0.00 0.02 0.00 0.00 57.03 56.47 2ixj h ASP 13 Cb 0.41 0.00 -0.08 0.00 0.22 0.00 0.00 39.33 39.88 2ixj h ASP 13 CO 0.02 0.00 0.18 -0.69 -1.72 0.00 0.00 179.24 177.03 2ixj s VAL 14 N -3.37 5.00 -0.05 -1.35 1.01 -0.35 -4.63 120.40 116.66 2ixj s VAL 14 Ca 0.05 1.37 0.05 0.00 0.00 0.00 0.00 61.98 63.45 2ixj s VAL 14 Cb 0.09 -4.02 -0.01 0.00 0.00 0.00 0.00 36.38 32.44 2ixj s VAL 14 CO 0.55 0.13 -0.20 -0.63 0.00 0.00 0.00 175.10 174.95 2ixj s ILE 15 N 1.64 1.62 -0.26 2.22 1.01 -1.08 -1.58 121.20 124.78 2ixj s ILE 15 Ca 0.33 -0.83 -0.09 0.00 0.00 0.00 0.00 60.65 60.06 2ixj s ILE 15 Cb -0.16 -1.38 -0.04 0.00 0.01 0.00 0.00 42.46 40.88 2ixj s ILE 15 CO 0.13 0.46 0.14 -0.22 0.00 0.00 0.00 174.94 175.45 2ixj s LEU 16 N -0.06 3.83 -0.10 2.97 2.96 -0.16 -0.64 118.68 127.48 2ixj s LEU 16 Ca -0.03 -0.05 -0.04 0.00 -0.22 0.00 0.00 54.13 53.79 2ixj s LEU 16 Cb -0.12 -2.04 -0.04 0.00 0.50 0.00 0.00 46.19 44.49 2ixj s LEU 16 CO 0.02 -0.01 0.08 -0.36 -1.32 0.00 0.00 176.35 174.76 2ixj s PHE 17 N 1.52 3.40 -0.20 5.38 0.40 -0.23 -1.09 117.98 127.15 2ixj s PHE 17 Ca 0.07 0.37 -0.00 0.00 -0.60 0.00 0.00 56.93 56.76 2ixj s PHE 17 Cb -0.15 -1.86 0.05 0.00 0.51 0.00 0.00 43.02 41.57 2ixj s PHE 17 CO 0.07 0.61 -0.03 -2.00 0.70 0.00 0.00 175.22 174.57 2ixj s GLU 18 N -1.04 1.36 0.37 0.44 2.12 0.30 -1.25 118.70 120.99 2ixj s GLU 18 Ca 0.15 -0.72 -0.26 0.00 0.36 0.00 0.00 54.97 54.51 2ixj s GLU 18 Cb -0.12 -2.30 -0.09 0.00 0.26 0.00 0.00 34.13 31.88 2ixj s GLU 18 CO 0.04 -0.55 1.09 -2.14 -0.54 0.00 0.00 175.26 173.16 2ixj s PRO 19 N 1.57 4.27 0.26 4.30 0.02 -1.26 -1.13 135.00 143.02 2ixj s PRO 19 Ca -0.03 1.67 -0.30 0.00 0.02 0.00 0.00 61.00 62.37 2ixj s PRO 19 Cb -0.17 -2.75 -0.10 0.00 0.02 0.00 0.00 34.50 31.50 2ixj s PRO 19 CO -0.07 -0.09 1.36 0.50 -0.33 0.00 0.00 177.00 178.37 2ixj s ARG 20 N -2.16 4.33 -0.09 5.54 3.52 -1.26 -4.92 118.95 123.91 2ixj s ARG 20 Ca 0.54 2.20 -0.03 0.00 -0.13 0.00 0.00 55.73 58.31 2ixj s ARG 20 Cb -0.27 -3.13 -0.03 0.00 -1.56 0.00 0.00 34.95 29.96 2ixj s ARG 20 CO 0.34 -0.30 0.03 0.08 -0.81 0.00 0.00 175.30 174.64 2ixj s VAL 21 N -0.28 4.58 -0.18 7.11 1.01 -1.26 -4.42 120.40 126.96 2ixj s VAL 21 Ca 0.56 -0.16 0.01 0.00 0.00 0.00 0.00 61.98 62.39 2ixj s VAL 21 Cb -0.40 -2.95 0.02 0.00 0.00 0.00 0.00 36.38 33.06 2ixj s VAL 21 CO 0.44 0.60 -0.19 -0.36 0.00 0.00 0.00 175.10 175.59 2ixj s PHE 22 N -0.93 2.75 0.00 5.22 0.40 0.23 -4.98 117.98 120.67 2ixj s PHE 22 Ca 0.14 -1.64 0.00 0.00 -0.60 0.00 0.00 56.93 54.83 2ixj s PHE 22 Cb -0.11 -1.89 0.00 0.00 0.51 0.00 0.00 43.02 41.53 2ixj s PHE 22 CO 0.03 -0.80 0.00 0.41 0.70 0.00 0.00 175.22 175.56 2ixj n GLY 23 N 4.63 -0.98 0.00 4.36 0.00 -1.26 0.40 105.19 112.33 2ixj n GLY 23 Ca -0.20 -2.11 0.00 0.00 0.00 0.00 0.00 46.02 43.71 2ixj n GLY 23 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2ixj n ASP 24 N 0.00 0.11 -0.00 1.61 5.68 -0.88 -4.91 116.55 118.15 2ixj n ASP 24 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.29 2ixj n ASP 24 Cb 0.00 0.00 0.30 0.00 -1.14 0.00 0.00 41.12 40.28 2ixj n ASP 24 CO 0.00 0.00 0.00 0.44 -1.33 0.00 0.00 177.20 176.31 2ixj h ASP 25 N 0.00 0.50 0.91 -1.12 3.45 -2.01 -2.43 116.42 115.72 2ixj h ASP 25 Ca 0.00 -0.09 0.00 0.00 0.43 0.00 0.00 57.03 57.37 2ixj h ASP 25 Cb 0.00 -0.13 0.00 0.00 -0.56 0.00 0.00 39.33 38.64 2ixj h ASP 25 CO 0.00 0.55 0.00 0.54 -1.57 0.00 0.00 179.24 178.76 2ixj n ARG 26 N -4.30 0.14 0.00 3.56 1.74 -1.26 -4.77 116.66 111.77 2ixj n ARG 26 Ca 0.02 0.26 0.00 0.00 -0.77 0.00 0.00 57.85 57.36 2ixj n ARG 26 Cb 0.23 -1.71 0.00 0.00 -1.02 0.00 0.00 32.46 29.95 2ixj n ARG 26 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2ixj n GLY 27 N 0.57 -0.24 3.22 -0.13 0.00 -0.92 -5.19 105.19 102.50 2ixj n GLY 27 Ca 0.04 0.77 -0.13 0.00 0.00 0.00 0.00 46.02 46.70 2ixj n GLY 27 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2ixj s PHE 28 N 0.00 1.12 -0.01 1.61 -0.12 -1.17 -2.08 117.98 117.34 2ixj s PHE 28 Ca 0.00 -0.93 0.02 0.00 -0.05 0.00 0.00 56.93 55.96 2ixj s PHE 28 Cb 0.00 -0.63 -0.00 0.00 -0.63 0.00 0.00 43.02 41.76 2ixj s PHE 28 CO 0.00 -0.13 -0.06 0.12 -0.05 0.00 0.00 175.22 175.10 2ixj s PHE 29 N -3.58 0.54 0.03 3.49 5.36 0.16 -4.98 117.98 119.00 2ixj s PHE 29 Ca 0.19 -0.10 -0.14 0.00 -0.96 0.00 0.00 56.93 55.92 2ixj s PHE 29 Cb 0.05 -0.36 0.02 0.00 -0.34 0.00 0.00 43.02 42.39 2ixj s PHE 29 CO 0.01 -0.02 0.30 -0.59 -1.46 0.00 0.00 175.22 173.45 2ixj s PHE 30 N -0.08 -0.12 -0.34 10.12 -0.71 -1.26 -0.60 117.98 124.99 2ixj s PHE 30 Ca 0.01 0.04 -0.26 0.00 -1.04 0.00 0.00 56.93 55.68 2ixj s PHE 30 Cb -0.03 0.09 0.01 0.00 -1.21 0.00 0.00 43.02 41.88 2ixj s PHE 30 CO -0.00 -0.46 0.94 -1.21 -1.34 0.00 0.00 175.22 173.15 2ixj s GLU 31 N -2.18 3.93 0.00 1.99 2.02 -1.26 -4.92 118.70 118.28 2ixj s GLU 31 Ca -0.08 0.73 0.28 0.00 0.02 0.00 0.00 54.97 55.92 2ixj s GLU 31 Cb -0.02 -3.77 1.01 0.00 0.10 0.00 0.00 34.13 31.45 2ixj s GLU 31 CO -0.01 -0.88 1.73 -1.13 0.02 0.00 0.00 175.26 174.99 2ixj n SER 32 N 6.70 0.53 -3.64 -0.19 3.41 -1.26 -4.76 113.62 114.40 2ixj n SER 32 Ca 0.08 -0.45 -0.04 0.00 -0.26 0.00 0.00 58.87 58.20 2ixj n SER 32 Cb 0.48 -0.03 -0.07 0.00 -0.26 0.00 0.00 64.21 64.33 2ixj n SER 32 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 175.04 174.41 2ixj s TYR 33 N -2.64 -0.62 -0.12 7.33 5.04 -1.26 -5.08 117.35 120.01 2ixj s TYR 33 Ca 0.23 1.26 -0.03 0.00 -2.44 0.00 0.00 57.07 56.09 2ixj s TYR 33 Cb 0.19 0.38 0.04 0.00 0.35 0.00 0.00 41.96 42.93 2ixj s TYR 33 CO 0.53 -0.30 0.05 1.21 -1.34 0.00 0.00 175.55 175.69 2ixj s ASN 34 N 1.22 1.97 0.23 4.32 3.84 -1.26 -5.05 114.94 120.20 2ixj s ASN 34 Ca -0.07 -0.35 -0.08 0.00 0.21 0.00 0.00 52.86 52.57 2ixj s ASN 34 Cb -0.04 -0.34 0.37 0.00 -0.55 0.00 0.00 41.25 40.69 2ixj s ASN 34 CO -0.14 -0.28 1.70 -0.61 -2.79 0.00 0.00 177.10 174.98 2ixj h GLN 35 N 8.37 0.27 0.42 0.43 4.15 -2.00 0.24 115.11 126.98 2ixj h GLN 35 Ca -0.16 -0.02 -0.02 0.00 0.77 0.00 0.00 58.65 59.23 2ixj h GLN 35 Cb 1.13 -0.06 0.00 0.00 0.21 0.00 0.00 27.48 28.76 2ixj h GLN 35 CO 0.26 0.18 -0.20 0.00 -1.93 0.00 0.00 178.83 177.13 2ixj h ARG 36 N 0.28 -0.54 -0.31 1.69 3.08 -1.98 0.75 114.38 117.34 2ixj h ARG 36 Ca 0.36 0.04 0.05 0.00 0.07 0.00 0.00 59.98 60.49 2ixj h ARG 36 Cb 0.57 0.12 -0.04 0.00 0.08 0.00 0.00 29.97 30.70 2ixj h ARG 36 CO -0.45 -0.29 0.05 0.00 -1.07 0.00 0.00 179.97 178.21 2ixj h ALA 37 N -0.18 0.32 -0.01 0.04 0.00 -1.93 -0.38 119.26 117.12 2ixj h ALA 37 Ca -0.06 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.92 2ixj h ALA 37 Cb 0.50 0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.39 2ixj h ALA 37 CO 0.09 -0.36 -0.01 0.35 0.00 0.00 0.00 179.25 179.32 2ixj h PHE 38 N 0.15 -0.02 -0.21 0.00 3.57 -0.87 -0.49 116.94 119.07 2ixj h PHE 38 Ca 0.15 0.00 -0.07 0.00 3.53 0.00 0.00 57.97 61.58 2ixj h PHE 38 Cb 0.17 0.01 -0.01 0.00 2.79 0.00 0.00 35.95 38.91 2ixj h PHE 38 CO -0.19 -0.01 -0.17 0.93 -2.23 0.00 0.00 178.31 176.64 2ixj h GLU 39 N -0.01 0.37 -0.12 1.11 5.08 -0.75 -1.36 114.58 118.90 2ixj h GLU 39 Ca 0.01 -0.11 -0.10 0.00 -1.00 0.00 0.00 59.36 58.16 2ixj h GLU 39 Cb 0.02 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.22 2ixj h GLU 39 CO -0.02 0.53 -0.38 1.49 -1.00 0.00 0.00 179.01 179.64 2ixj h GLU 40 N 0.34 0.26 -0.03 2.33 4.57 -0.88 -2.26 114.58 118.90 2ixj h GLU 40 Ca 0.06 -0.11 -0.08 0.00 -1.18 0.00 0.00 59.36 58.05 2ixj h GLU 40 Cb 0.50 -0.01 0.00 0.00 -0.16 0.00 0.00 28.75 29.09 2ixj h GLU 40 CO 0.03 0.60 -0.28 0.00 -1.18 0.00 0.00 179.01 178.18 2ixj h ALA 41 N 1.39 0.08 -0.01 2.92 0.00 -0.53 -3.32 119.26 119.79 2ixj h ALA 41 Ca 0.02 -0.45 0.00 0.00 0.00 0.00 0.00 54.91 54.49 2ixj h ALA 41 Cb 0.77 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.57 2ixj h ALA 41 CO 0.06 0.13 -0.36 0.00 0.00 0.00 0.00 179.25 179.07 2ixj n GLY 43 N 1.40 1.04 3.34 0.00 0.00 -0.86 -5.02 105.19 105.09 2ixj n GLY 43 Ca 0.10 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.02 2ixj n GLY 43 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 2ixj s HIS 44 N -3.19 0.65 0.39 1.61 -3.43 -1.19 -5.01 115.29 105.11 2ixj s HIS 44 Ca 0.00 -0.97 -0.25 0.00 -0.80 0.00 0.00 55.06 53.04 2ixj s HIS 44 Cb 0.00 -0.18 -0.09 0.00 -1.43 0.00 0.00 32.58 30.89 2ixj s HIS 44 CO 0.00 -0.75 1.10 -2.14 -2.00 0.00 0.00 174.74 170.96 2ixj s PRO 45 N -4.04 4.17 0.01 -0.38 0.02 -1.26 -4.58 135.00 128.93 2ixj s PRO 45 Ca 0.25 1.68 0.03 0.00 0.02 0.00 0.00 61.00 62.98 2ixj s PRO 45 Cb 0.04 -2.67 -0.01 0.00 0.02 0.00 0.00 34.50 31.88 2ixj s PRO 45 CO 0.06 -0.18 -0.09 0.08 -0.33 0.00 0.00 177.00 176.54 2ixj s VAL 46 N -1.50 0.71 -0.09 3.83 1.01 -1.26 -5.11 120.40 117.98 2ixj s VAL 46 Ca 0.56 -0.55 0.03 0.00 0.00 0.00 0.00 61.98 62.02 2ixj s VAL 46 Cb -0.27 -0.63 0.01 0.00 0.00 0.00 0.00 36.38 35.49 2ixj s VAL 46 CO 0.34 0.08 -0.18 -0.44 0.00 0.00 0.00 175.10 174.90 2ixj s SER 47 N -0.52 2.51 -0.24 3.32 0.01 -1.26 -5.07 113.70 112.45 2ixj s SER 47 Ca 0.01 -0.45 -0.10 0.00 1.31 0.00 0.00 55.95 56.72 2ixj s SER 47 Cb -0.05 -1.15 -0.05 0.00 0.21 0.00 0.00 66.02 64.99 2ixj s SER 47 CO 0.00 0.08 0.15 -0.36 0.41 0.00 0.00 173.24 173.52 2ixj s PHE 48 N 0.63 3.28 -0.45 2.43 0.40 -1.26 -4.15 117.98 118.85 2ixj s PHE 48 Ca -0.14 0.15 0.15 0.00 -0.60 0.00 0.00 56.93 56.49 2ixj s PHE 48 Cb -0.16 -2.27 -0.19 0.00 0.51 0.00 0.00 43.02 40.91 2ixj s PHE 48 CO 0.04 0.01 0.52 1.33 0.70 0.00 0.00 175.22 177.82 2ixj n VAL 49 N 4.37 0.00 -3.70 -0.44 0.24 -0.04 -4.98 118.33 113.78 2ixj n VAL 49 Ca -0.15 -0.22 -0.13 0.00 -2.04 0.00 0.00 64.34 61.80 2ixj n VAL 49 Cb 0.52 0.69 -0.09 0.00 -1.47 0.00 0.00 33.84 33.49 2ixj n VAL 49 CO 0.00 0.00 0.00 -1.58 -2.14 0.00 0.00 176.83 173.11 2ixj s GLN 50 N -2.63 0.56 -0.04 7.34 0.74 -1.22 -5.02 119.66 119.39 2ixj s GLN 50 Ca 0.02 0.74 0.06 0.00 0.05 0.00 0.00 55.36 56.23 2ixj s GLN 50 Cb 0.11 0.22 -0.02 0.00 1.10 0.00 0.00 33.01 34.42 2ixj s GLN 50 CO 0.61 -0.09 -0.22 -0.51 -0.55 0.00 0.00 175.29 174.54 2ixj s ASP 51 N 0.53 3.41 -0.04 6.67 1.01 -1.26 -1.38 116.67 125.62 2ixj s ASP 51 Ca -0.02 -0.38 0.03 0.00 0.71 0.00 0.00 52.55 52.89 2ixj s ASP 51 Cb -0.04 -0.60 0.00 0.00 1.01 0.00 0.00 42.92 43.29 2ixj s ASP 51 CO -0.03 0.32 -0.13 0.20 0.21 0.00 0.00 175.17 175.74 2ixj s ASN 52 N -0.58 1.70 -0.07 0.27 0.01 -0.37 -4.98 114.94 110.94 2ixj s ASN 52 Ca 0.08 -0.27 0.04 0.00 -0.71 0.00 0.00 52.86 52.00 2ixj s ASN 52 Cb -0.11 -0.49 -0.00 0.00 0.41 0.00 0.00 41.25 41.06 2ixj s ASN 52 CO 0.00 0.10 -0.20 -2.28 -1.51 0.00 0.00 177.10 173.21 2ixj s HIS 53 N 0.16 2.11 0.03 2.20 2.46 -1.26 -1.48 115.29 119.51 2ixj s HIS 53 Ca -0.04 -0.74 -0.00 0.00 0.47 0.00 0.00 55.06 54.75 2ixj s HIS 53 Cb -0.10 -1.42 -0.03 0.00 -0.13 0.00 0.00 32.58 30.89 2ixj s HIS 53 CO 0.01 -0.28 -0.03 -1.54 -2.47 0.00 0.00 174.74 170.43 2ixj s SER 54 N 0.21 0.37 -0.09 9.88 1.04 0.52 -4.98 113.70 120.64 2ixj s SER 54 Ca -0.11 -0.72 0.02 0.00 0.48 0.00 0.00 55.95 55.62 2ixj s SER 54 Cb -0.15 0.14 0.01 0.00 0.10 0.00 0.00 66.02 66.12 2ixj s SER 54 CO 0.05 -0.43 -0.16 -0.60 0.98 0.00 0.00 173.24 173.08 2ixj s ARG 55 N -2.54 2.27 0.01 4.02 3.52 -1.26 -1.05 118.95 123.92 2ixj s ARG 55 Ca -0.06 -0.60 0.01 0.00 -0.13 0.00 0.00 55.73 54.96 2ixj s ARG 55 Cb -0.02 -1.85 -0.01 0.00 -1.56 0.00 0.00 34.95 31.51 2ixj s ARG 55 CO -0.05 0.02 -0.04 -1.12 -0.81 0.00 0.00 175.30 173.31 2ixj s SER 56 N 0.74 0.39 0.86 -2.12 0.01 -0.71 -4.99 113.70 107.88 2ixj s SER 56 Ca -0.12 -0.18 -0.12 0.00 1.31 0.00 0.00 55.95 56.84 2ixj s SER 56 Cb -0.16 -0.01 0.11 0.00 0.21 0.00 0.00 66.02 66.17 2ixj s SER 56 CO 0.02 -0.04 1.16 0.00 0.41 0.00 0.00 173.24 174.79 2ixj s ALA 57 N -0.43 2.17 0.05 1.44 0.00 -1.26 -0.62 121.76 123.10 2ixj s ALA 57 Ca -0.03 -0.58 -0.35 0.00 0.00 0.00 0.00 51.96 51.00 2ixj s ALA 57 Cb -0.04 -3.00 -0.15 0.00 0.00 0.00 0.00 23.12 19.94 2ixj s ALA 57 CO -0.00 -2.01 1.57 -2.13 0.00 0.00 0.00 175.76 173.18 2ixj n ARG 58 N -3.56 1.73 -0.71 0.00 0.63 -0.79 -2.46 116.66 111.49 2ixj n ARG 58 Ca 0.07 0.63 0.00 0.00 -0.92 0.00 0.00 57.85 57.63 2ixj n ARG 58 Cb 0.60 -2.36 0.00 0.00 0.45 0.00 0.00 32.46 31.15 2ixj n ARG 58 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2ixj n GLY 59 N 3.36 1.03 3.70 5.14 0.00 0.60 -4.85 105.19 114.17 2ixj n GLY 59 Ca 0.19 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.79 2ixj n GLY 59 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2ixj s VAL 60 N -3.49 3.37 -0.14 1.61 1.01 -1.03 -0.26 120.40 121.48 2ixj s VAL 60 Ca 0.00 0.85 0.01 0.00 0.00 0.00 0.00 61.98 62.85 2ixj s VAL 60 Cb 0.00 -3.55 -0.00 0.00 0.00 0.00 0.00 36.38 32.83 2ixj s VAL 60 CO 0.00 0.02 -0.18 -0.22 0.00 0.00 0.00 175.10 174.72 2ixj s LEU 61 N 2.09 2.39 -0.20 3.92 0.20 -1.00 -1.65 118.68 124.43 2ixj s LEU 61 Ca 0.67 -0.48 0.01 0.00 0.69 0.00 0.00 54.13 55.03 2ixj s LEU 61 Cb -0.36 -1.52 0.03 0.00 -0.43 0.00 0.00 46.19 43.91 2ixj s LEU 61 CO 0.29 0.12 -0.16 -0.13 -0.29 0.00 0.00 176.35 176.18 2ixj s ARG 62 N 0.62 2.60 0.00 1.98 0.52 -0.68 -4.55 118.95 119.44 2ixj s ARG 62 Ca -0.10 -0.95 0.00 0.00 -0.52 0.00 0.00 55.73 54.16 2ixj s ARG 62 Cb -0.16 -2.60 0.00 0.00 0.52 0.00 0.00 34.95 32.71 2ixj s ARG 62 CO 0.03 -0.34 0.00 0.41 0.02 0.00 0.00 175.30 175.42 2ixj n GLY 63 N 4.59 -0.23 3.46 -3.53 0.00 -1.26 -1.51 105.19 106.72 2ixj n GLY 63 Ca -0.18 -1.42 -0.42 0.00 0.00 0.00 0.00 46.02 44.00 2ixj n GLY 63 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2ixj s LEU 64 N 0.00 4.90 -0.03 0.99 1.43 -0.56 -4.52 118.68 120.90 2ixj s LEU 64 Ca 0.00 -0.80 -0.04 0.00 -1.03 0.00 0.00 54.13 52.26 2ixj s LEU 64 Cb 0.00 -2.13 -0.04 0.00 0.03 0.00 0.00 46.19 44.05 2ixj s LEU 64 CO 0.00 -0.39 0.18 -1.00 0.23 0.00 0.00 176.35 175.37 2ixj s HIS 65 N 1.67 3.56 -0.04 0.29 3.76 0.66 -1.88 115.29 123.31 2ixj s HIS 65 Ca 0.05 0.41 -0.29 0.00 -0.15 0.00 0.00 55.06 55.08 2ixj s HIS 65 Cb -0.19 -1.86 0.09 0.00 1.11 0.00 0.00 32.58 31.74 2ixj s HIS 65 CO 0.10 0.66 0.81 1.52 -0.85 0.00 0.00 174.74 176.98 2ixj s TYR 66 N -1.27 -0.48 -0.16 1.40 1.13 -1.08 -0.69 117.35 116.19 2ixj s TYR 66 Ca 0.25 0.65 0.01 0.00 -1.41 0.00 0.00 57.07 56.56 2ixj s TYR 66 Cb -0.13 0.47 0.01 0.00 -1.10 0.00 0.00 41.96 41.22 2ixj s TYR 66 CO 0.16 -0.55 -0.17 -0.65 -2.51 0.00 0.00 175.55 171.83 2ixj s GLN 67 N -2.00 3.13 -0.17 -3.49 -0.21 -1.26 0.04 119.66 115.69 2ixj s GLN 67 Ca -0.03 -0.78 -0.25 0.00 0.02 0.00 0.00 55.36 54.32 2ixj s GLN 67 Cb -0.01 -2.60 -0.22 0.00 1.00 0.00 0.00 33.01 31.18 2ixj s GLN 67 CO -0.00 -0.07 0.49 0.82 -2.12 0.00 0.00 175.29 174.41 2ixj h ILE 68 N 5.78 1.34 -3.98 1.08 2.04 -1.97 -3.36 117.51 118.44 2ixj h ILE 68 Ca -0.37 -2.24 -0.46 0.00 1.00 0.00 0.00 64.86 62.80 2ixj h ILE 68 Cb 1.17 2.77 -0.02 0.00 -0.74 0.00 0.00 36.82 40.01 2ixj h ILE 68 CO 0.59 0.46 0.28 -0.13 0.00 0.00 0.00 178.15 179.34 2ixj s ARG 69 N -2.28 4.12 -1.23 2.37 1.81 -1.26 -4.03 118.95 118.45 2ixj s ARG 69 Ca -0.23 0.96 -0.07 0.00 -1.72 0.00 0.00 55.73 54.68 2ixj s ARG 69 Cb 0.01 -2.24 -0.01 0.00 -0.45 0.00 0.00 34.95 32.26 2ixj s ARG 69 CO 0.63 -0.02 0.74 1.04 -0.68 0.00 0.00 175.30 177.01 2ixj n GLN 70 N -0.73 -3.44 -2.06 3.54 6.02 -1.26 -4.90 117.38 114.55 2ixj n GLN 70 Ca 0.06 0.60 -0.39 0.00 -0.01 0.00 0.00 57.00 57.26 2ixj n GLN 70 Cb 0.54 -4.94 0.00 0.00 1.02 0.00 0.00 30.24 26.86 2ixj n GLN 70 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2ixj s ALA 71 N -3.60 3.09 -0.05 -1.58 0.00 -1.26 -4.77 121.76 113.60 2ixj s ALA 71 Ca 0.19 1.17 0.03 0.00 0.00 0.00 0.00 51.96 53.34 2ixj s ALA 71 Cb -0.05 -3.47 0.01 0.00 0.00 0.00 0.00 23.12 19.60 2ixj s ALA 71 CO 0.82 -0.88 -0.12 -0.65 0.00 0.00 0.00 175.76 174.93 2ixj s GLN 72 N -2.51 1.40 0.29 0.00 -0.21 -1.26 -4.49 119.66 112.88 2ixj s GLN 72 Ca 0.62 -0.39 -0.13 0.00 0.02 0.00 0.00 55.36 55.47 2ixj s GLN 72 Cb -0.36 -1.22 -0.08 0.00 1.00 0.00 0.00 33.01 32.35 2ixj s GLN 72 CO 0.44 0.09 0.68 0.20 -2.12 0.00 0.00 175.29 174.59 2ixj s GLY 73 N 0.40 2.32 -0.03 3.09 0.00 -1.26 -2.90 107.32 108.94 2ixj s GLY 73 Ca -0.08 -0.05 0.01 0.00 0.00 0.00 0.00 44.72 44.60 2ixj s GLY 73 CO 0.02 0.14 -0.02 0.54 0.00 0.00 0.00 173.10 173.79 2ixj s LYS 74 N -2.92 0.45 -0.26 2.90 1.02 -0.07 -2.18 119.74 118.68 2ixj s LYS 74 Ca 0.52 0.01 -0.01 0.00 0.02 0.00 0.00 55.97 56.50 2ixj s LYS 74 Cb -0.11 -0.57 0.03 0.00 -0.52 0.00 0.00 37.83 36.67 2ixj s LYS 74 CO 0.18 -0.10 -0.05 -1.17 -0.92 0.00 0.00 175.35 173.29 2ixj s LEU 75 N 0.90 3.35 0.01 3.17 2.96 -0.11 -0.41 118.68 128.56 2ixj s LEU 75 Ca -0.10 -0.99 0.06 0.00 -0.22 0.00 0.00 54.13 52.88 2ixj s LEU 75 Cb -0.13 -1.66 -0.03 0.00 0.50 0.00 0.00 46.19 44.86 2ixj s LEU 75 CO -0.01 -0.16 -0.17 0.68 -1.32 0.00 0.00 176.35 175.37 2ixj s VAL 76 N 1.29 2.84 0.13 1.68 -7.23 -0.17 -1.39 120.40 117.56 2ixj s VAL 76 Ca -0.02 -1.05 -0.14 0.00 -1.81 0.00 0.00 61.98 58.97 2ixj s VAL 76 Cb -0.17 -2.16 0.02 0.00 0.56 0.00 0.00 36.38 34.62 2ixj s VAL 76 CO -0.04 0.42 0.36 0.00 -0.31 0.00 0.00 175.10 175.53 2ixj s ARG 77 N -1.21 1.06 -0.24 4.82 1.70 -0.09 -1.67 118.95 123.33 2ixj s ARG 77 Ca 0.14 -0.83 -0.09 0.00 -0.47 0.00 0.00 55.73 54.47 2ixj s ARG 77 Cb -0.11 0.44 -0.04 0.00 -0.57 0.00 0.00 34.95 34.67 2ixj s ARG 77 CO 0.04 -0.40 0.13 0.00 -1.08 0.00 0.00 175.30 173.98 2ixj s ALA 78 N -3.84 3.46 -0.10 7.88 0.00 -1.26 -0.89 121.76 127.01 2ixj s ALA 78 Ca 0.06 -0.94 0.22 0.00 0.00 0.00 0.00 51.96 51.30 2ixj s ALA 78 Cb 0.02 -2.21 -0.24 0.00 0.00 0.00 0.00 23.12 20.69 2ixj s ALA 78 CO -0.09 -0.23 0.64 0.25 0.00 0.00 0.00 175.76 176.33 2ixj n THR 79 N 4.38 0.17 -4.33 0.00 -2.24 -0.60 -3.37 114.28 108.30 2ixj n THR 79 Ca -0.15 -0.51 -0.19 0.00 -2.27 0.00 0.00 64.05 60.93 2ixj n THR 79 Cb 0.52 -0.09 -0.15 0.00 -2.10 0.00 0.00 70.33 68.51 2ixj n THR 79 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 2ixj s LEU 80 N -4.74 1.88 0.00 3.22 2.96 -1.13 -4.67 118.68 116.20 2ixj s LEU 80 Ca -0.06 -0.16 0.00 0.00 -0.22 0.00 0.00 54.13 53.69 2ixj s LEU 80 Cb 0.13 -0.47 0.00 0.00 0.50 0.00 0.00 46.19 46.35 2ixj s LEU 80 CO 0.88 0.07 0.00 0.61 -1.32 0.00 0.00 176.35 176.59 2ixj n GLY 81 N 3.12 -0.06 2.79 7.98 0.00 -1.26 -1.03 105.19 116.73 2ixj n GLY 81 Ca -0.16 -1.00 -0.15 0.00 0.00 0.00 0.00 46.02 44.71 2ixj n GLY 81 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2ixj s GLU 82 N 0.00 -0.02 0.29 1.61 2.12 -1.26 -1.88 118.70 119.56 2ixj s GLU 82 Ca 0.00 0.24 0.11 0.00 0.36 0.00 0.00 54.97 55.68 2ixj s GLU 82 Cb 0.00 -0.25 -0.05 0.00 0.26 0.00 0.00 34.13 34.08 2ixj s GLU 82 CO 0.00 -0.18 -0.13 0.14 -0.54 0.00 0.00 175.26 174.55 2ixj s VAL 83 N 1.18 2.60 -0.26 3.70 -7.23 -0.22 -0.80 120.40 119.37 2ixj s VAL 83 Ca -0.08 -2.26 -0.06 0.00 -1.81 0.00 0.00 61.98 57.77 2ixj s VAL 83 Cb -0.13 -2.49 -0.01 0.00 0.56 0.00 0.00 36.38 34.32 2ixj s VAL 83 CO -0.04 -0.34 0.05 0.12 -0.31 0.00 0.00 175.10 174.58 2ixj s PHE 84 N -2.50 3.09 -0.09 2.82 5.36 -0.57 -1.15 117.98 124.95 2ixj s PHE 84 Ca 0.31 -0.77 -0.01 0.00 -0.96 0.00 0.00 56.93 55.50 2ixj s PHE 84 Cb -0.04 -2.22 -0.03 0.00 -0.34 0.00 0.00 43.02 40.39 2ixj s PHE 84 CO 0.16 -0.49 -0.03 0.34 -1.46 0.00 0.00 175.22 173.74 2ixj s ASP 85 N 1.54 4.93 -0.04 6.13 2.15 -0.21 -1.68 116.67 129.48 2ixj s ASP 85 Ca 0.05 0.03 0.03 0.00 0.43 0.00 0.00 52.55 53.08 2ixj s ASP 85 Cb -0.16 -1.41 0.01 0.00 -0.30 0.00 0.00 42.92 41.06 2ixj s ASP 85 CO 0.02 0.33 -0.12 -0.69 -0.17 0.00 0.00 175.17 174.55 2ixj s VAL 86 N -0.63 1.03 -0.08 1.11 1.01 0.12 -1.51 120.40 121.45 2ixj s VAL 86 Ca 0.10 -0.47 0.04 0.00 0.00 0.00 0.00 61.98 61.65 2ixj s VAL 86 Cb -0.12 -0.92 0.00 0.00 0.00 0.00 0.00 36.38 35.35 2ixj s VAL 86 CO 0.02 0.32 -0.21 0.00 0.00 0.00 0.00 175.10 175.23 2ixj s ALA 87 N 0.33 1.91 -0.15 5.51 0.00 -0.51 -1.74 121.76 127.11 2ixj s ALA 87 Ca -0.07 -0.84 0.01 0.00 0.00 0.00 0.00 51.96 51.06 2ixj s ALA 87 Cb -0.12 -0.70 -0.00 0.00 0.00 0.00 0.00 23.12 22.30 2ixj s ALA 87 CO 0.02 0.28 -0.17 0.08 0.00 0.00 0.00 175.76 175.97 2ixj s VAL 88 N 0.27 2.57 -0.26 0.00 1.01 0.12 -1.43 120.40 122.68 2ixj s VAL 88 Ca -0.13 -0.81 -0.29 0.00 0.00 0.00 0.00 61.98 60.75 2ixj s VAL 88 Cb -0.16 -2.07 0.01 0.00 0.00 0.00 0.00 36.38 34.16 2ixj s VAL 88 CO 0.06 0.52 1.12 -0.62 0.00 0.00 0.00 175.10 176.18 2ixj s ASP 89 N 0.76 6.96 -0.13 3.32 -1.08 -0.51 -0.10 116.67 125.88 2ixj s ASP 89 Ca -0.07 1.28 0.17 0.00 -0.52 0.00 0.00 52.55 53.41 2ixj s ASP 89 Cb -0.15 -2.54 0.29 0.00 -1.46 0.00 0.00 42.92 39.06 2ixj s ASP 89 CO 0.00 -0.82 1.15 0.18 0.52 0.00 0.00 175.17 176.21 2ixj n LEU 90 N 6.74 2.25 -4.69 -1.34 4.77 0.34 -0.73 117.00 124.35 2ixj n LEU 90 Ca 0.13 -3.08 -0.42 0.00 -0.03 0.00 0.00 56.01 52.61 2ixj n LEU 90 Cb 0.46 -0.42 -0.03 0.00 -2.33 0.00 0.00 43.42 41.11 2ixj n LEU 90 CO 0.57 0.78 0.68 -0.13 -1.33 0.00 0.00 177.39 177.96 2ixj s ARG 91 N -2.74 4.41 -0.29 3.23 0.52 -1.19 -2.23 118.95 120.67 2ixj s ARG 91 Ca 0.31 1.24 -0.42 0.00 -0.52 0.00 0.00 55.73 56.34 2ixj s ARG 91 Cb 0.28 -3.53 -0.18 0.00 0.52 0.00 0.00 34.95 32.04 2ixj s ARG 91 CO 0.01 -0.23 1.58 -2.13 0.02 0.00 0.00 175.30 174.55 2ixj n ARG 92 N 4.74 0.60 -0.95 3.54 0.63 -0.52 -1.33 116.66 123.37 2ixj n ARG 92 Ca 0.06 0.22 0.00 0.00 -0.92 0.00 0.00 57.85 57.21 2ixj n ARG 92 Cb 0.49 -1.81 0.00 0.00 0.45 0.00 0.00 32.46 31.59 2ixj n ARG 92 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2ixj n GLY 93 N 3.66 0.75 3.76 5.14 0.00 -1.26 -5.00 105.19 112.24 2ixj n GLY 93 Ca 0.27 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.87 2ixj n GLY 93 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2ixj n SER 94 N -0.04 3.75 0.02 1.61 2.88 -0.44 -4.89 113.62 116.52 2ixj n SER 94 Ca 0.00 1.21 0.10 0.00 -1.33 0.00 0.00 58.87 58.84 2ixj n SER 94 Cb 0.02 -1.61 0.41 0.00 -0.75 0.00 0.00 64.21 62.28 2ixj n SER 94 CO 0.00 0.00 0.00 -2.65 -1.23 0.00 0.00 175.04 171.16 2ixj n PRO 95 N 0.82 0.03 -0.06 -1.46 -0.02 -1.26 -2.63 135.00 130.43 2ixj n PRO 95 Ca 0.03 0.21 0.08 0.00 -2.02 0.00 0.00 63.50 61.79 2ixj n PRO 95 Cb 0.38 -1.56 0.11 0.00 -0.02 0.00 0.00 33.50 32.41 2ixj n PRO 95 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 2ixj n THR 96 N -1.62 1.67 -1.61 3.45 -2.24 -1.26 -5.05 114.28 107.63 2ixj n THR 96 Ca 0.04 -1.96 -0.52 0.00 -2.27 0.00 0.00 64.05 59.35 2ixj n THR 96 Cb 0.23 -0.07 -0.06 0.00 -2.10 0.00 0.00 70.33 68.34 2ixj n THR 96 CO 0.00 0.00 0.00 0.33 -0.57 0.00 0.00 175.07 174.83 2ixj n PHE 97 N -1.21 1.63 -0.65 4.78 7.35 -1.08 -0.87 117.46 127.41 2ixj n PHE 97 Ca 0.12 0.59 0.00 0.00 -0.76 0.00 0.00 57.45 57.40 2ixj n PHE 97 Cb 0.56 -2.36 0.00 0.00 0.35 0.00 0.00 39.48 38.02 2ixj n PHE 97 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 2ixj n GLY 98 N 2.72 1.06 3.90 7.13 0.00 0.10 -5.02 105.19 115.07 2ixj n GLY 98 Ca 0.19 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.91 2ixj n GLY 98 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2ixj s GLN 99 N -0.25 3.68 0.16 1.61 -0.21 -0.05 -4.80 119.66 119.80 2ixj s GLN 99 Ca 0.00 0.06 0.09 0.00 0.02 0.00 0.00 55.36 55.53 2ixj s GLN 99 Cb 0.00 -2.67 -0.04 0.00 1.00 0.00 0.00 33.01 31.29 2ixj s GLN 99 CO 0.00 0.28 -0.19 1.67 -2.12 0.00 0.00 175.29 174.93 2ixj s TRP 100 N -1.95 1.85 0.08 0.91 1.48 -1.26 -1.43 118.94 118.61 2ixj s TRP 100 Ca 0.44 -0.46 0.04 0.00 -1.06 0.00 0.00 56.10 55.06 2ixj s TRP 100 Cb -0.11 -0.93 -0.03 0.00 -1.16 0.00 0.00 33.47 31.24 2ixj s TRP 100 CO 0.27 0.33 -0.11 0.14 -4.06 0.00 0.00 176.95 173.53 2ixj s VAL 101 N -1.97 0.89 -0.08 -0.66 -7.23 -0.51 -4.93 120.40 105.90 2ixj s VAL 101 Ca 0.15 -1.41 -0.07 0.00 -1.81 0.00 0.00 61.98 58.84 2ixj s VAL 101 Cb -0.06 -1.10 0.02 0.00 0.56 0.00 0.00 36.38 35.80 2ixj s VAL 101 CO 0.07 -0.43 0.21 -0.83 -0.31 0.00 0.00 175.10 173.81 2ixj s GLY 102 N -2.04 -0.15 0.02 2.32 0.00 -1.26 -1.43 107.32 104.78 2ixj s GLY 102 Ca -0.00 0.60 0.01 0.00 0.00 0.00 0.00 44.72 45.33 2ixj s GLY 102 CO 0.01 0.55 -0.05 -0.54 0.00 0.00 0.00 173.10 173.06 2ixj s GLU 103 N 0.19 0.40 -0.14 2.90 0.41 -0.57 -4.96 118.70 116.93 2ixj s GLU 103 Ca -0.01 -0.51 -0.28 0.00 -0.41 0.00 0.00 54.97 53.76 2ixj s GLU 103 Cb -0.02 -0.19 -0.01 0.00 -1.78 0.00 0.00 34.13 32.13 2ixj s GLU 103 CO -0.00 0.04 0.97 1.03 -0.49 0.00 0.00 175.26 176.80 2ixj s ARG 104 N -1.05 4.37 -0.04 1.61 0.52 -1.26 -1.04 118.95 122.05 2ixj s ARG 104 Ca -0.08 1.30 0.05 0.00 -0.52 0.00 0.00 55.73 56.49 2ixj s ARG 104 Cb -0.07 -3.56 -0.02 0.00 0.52 0.00 0.00 34.95 31.81 2ixj s ARG 104 CO -0.00 -0.37 -0.19 -0.51 0.02 0.00 0.00 175.30 174.25 2ixj s LEU 105 N 2.22 2.46 0.33 2.53 1.43 -0.30 -4.91 118.68 122.45 2ixj s LEU 105 Ca 0.45 -0.31 -0.06 0.00 -1.03 0.00 0.00 54.13 53.18 2ixj s LEU 105 Cb -0.17 -1.47 0.01 0.00 0.03 0.00 0.00 46.19 44.59 2ixj s LEU 105 CO 0.15 0.33 0.53 -0.94 0.23 0.00 0.00 176.35 176.65 2ixj s SER 106 N -0.66 0.59 0.16 2.29 1.04 -1.26 -1.06 113.70 114.81 2ixj s SER 106 Ca 0.10 -1.34 0.09 0.00 0.48 0.00 0.00 55.95 55.28 2ixj s SER 106 Cb -0.11 0.68 -0.11 0.00 0.10 0.00 0.00 66.02 66.59 2ixj s SER 106 CO 0.00 -1.34 1.34 0.00 0.98 0.00 0.00 173.24 174.22 2ixj h ALA 107 N 2.12 0.46 0.52 5.32 0.00 -1.38 -2.31 119.26 123.99 2ixj h ALA 107 Ca -0.29 -0.80 -0.03 0.00 0.00 0.00 0.00 54.91 53.80 2ixj h ALA 107 Cb 1.24 -0.14 0.01 0.00 0.00 0.00 0.00 17.79 18.90 2ixj h ALA 107 CO 0.39 1.10 -0.25 0.93 0.00 0.00 0.00 179.25 181.41 2ixj h GLU 108 N 0.00 -0.68 0.00 0.00 3.07 -1.88 -3.32 114.58 111.77 2ixj h GLU 108 Ca -0.01 0.05 0.00 0.00 -0.50 0.00 0.00 59.36 58.90 2ixj h GLU 108 Cb 1.64 0.15 0.00 0.00 -0.84 0.00 0.00 28.75 29.71 2ixj h GLU 108 CO 0.11 -0.42 0.00 0.27 -1.40 0.00 0.00 179.01 177.58 2ixj n ASN 109 N -5.25 0.49 -1.06 1.42 0.23 -1.25 -4.89 115.26 104.95 2ixj n ASN 109 Ca -0.09 0.58 -0.11 0.00 -0.53 0.00 0.00 54.58 54.43 2ixj n ASN 109 Cb 0.30 -0.70 -0.05 0.00 -2.08 0.00 0.00 39.78 37.25 2ixj n ASN 109 CO 0.00 0.00 0.00 0.29 -0.93 0.00 0.00 177.26 176.62 2ixj n LYS 110 N -2.00 -1.51 -2.14 -3.83 5.02 -0.87 -4.87 118.16 107.96 2ixj n LYS 110 Ca 0.04 0.76 -0.33 0.00 -2.02 0.00 0.00 58.31 56.76 2ixj n LYS 110 Cb 0.30 -4.95 0.00 0.00 -0.02 0.00 0.00 35.03 30.36 2ixj n LYS 110 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 2ixj s ARG 111 N -2.80 3.36 0.07 1.97 0.52 -1.26 -4.35 118.95 116.47 2ixj s ARG 111 Ca 0.00 1.30 0.01 0.00 -0.52 0.00 0.00 55.73 56.53 2ixj s ARG 111 Cb 0.00 -2.03 -0.04 0.00 0.52 0.00 0.00 34.95 33.40 2ixj s ARG 111 CO 0.00 -0.79 -0.06 -0.65 0.02 0.00 0.00 175.30 173.82 2ixj s GLN 112 N -3.81 0.69 -0.05 3.54 -0.21 -0.38 -4.45 119.66 114.98 2ixj s GLN 112 Ca 0.66 -1.13 0.04 0.00 0.02 0.00 0.00 55.36 54.95 2ixj s GLN 112 Cb -0.17 -0.14 -0.00 0.00 1.00 0.00 0.00 33.01 33.69 2ixj s GLN 112 CO 0.33 -0.02 -0.18 -1.64 -2.12 0.00 0.00 175.29 171.65 2ixj s MET 113 N -3.15 1.97 -0.27 2.91 -1.94 -0.67 -1.07 119.30 117.08 2ixj s MET 113 Ca 0.04 -0.66 -0.15 0.00 -1.71 0.00 0.00 55.69 53.21 2ixj s MET 113 Cb 0.01 -1.68 -0.04 0.00 2.01 0.00 0.00 34.83 35.14 2ixj s MET 113 CO -0.04 0.24 0.39 -0.46 -0.01 0.00 0.00 175.02 175.14 2ixj s TRP 114 N 0.07 3.25 -0.35 -0.03 -0.11 0.18 -1.00 118.94 120.96 2ixj s TRP 114 Ca -0.06 0.44 0.03 0.00 1.22 0.00 0.00 56.10 57.73 2ixj s TRP 114 Cb -0.13 -2.58 0.10 0.00 -1.50 0.00 0.00 33.47 29.36 2ixj s TRP 114 CO 0.03 -0.23 0.07 0.42 -4.62 0.00 0.00 176.95 172.62 2ixj s ILE 115 N 2.07 2.42 0.94 5.86 1.01 0.45 -2.62 121.20 131.34 2ixj s ILE 115 Ca 0.16 -2.29 -0.11 0.00 0.00 0.00 0.00 60.65 58.41 2ixj s ILE 115 Cb -0.16 -2.76 0.16 0.00 0.01 0.00 0.00 42.46 39.71 2ixj s ILE 115 CO 0.10 -0.60 1.10 -2.84 0.00 0.00 0.00 174.94 172.71 2ixj s PRO 116 N 0.94 0.85 0.17 2.79 0.02 -1.26 -0.89 135.00 137.61 2ixj s PRO 116 Ca 0.10 1.22 -0.32 0.00 0.02 0.00 0.00 61.00 62.02 2ixj s PRO 116 Cb -0.20 -1.73 -0.16 0.00 0.02 0.00 0.00 34.50 32.43 2ixj s PRO 116 CO -0.07 -2.64 1.00 0.00 -0.33 0.00 0.00 177.00 174.95 2ixj n ALA 117 N -4.21 -1.55 0.00 -1.55 0.00 -1.14 -3.24 120.51 108.82 2ixj n ALA 117 Ca 0.09 0.47 0.00 0.00 0.00 0.00 0.00 53.44 54.00 2ixj n ALA 117 Cb 0.53 -1.90 0.00 0.00 0.00 0.00 0.00 19.45 18.08 2ixj n ALA 117 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2ixj n GLY 118 N 1.84 0.75 3.49 0.00 0.00 -1.26 -4.98 105.19 105.03 2ixj n GLY 118 Ca 0.16 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.91 2ixj n GLY 118 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2ixj s PHE 119 N -2.00 2.47 0.23 1.61 0.08 -1.20 -0.50 117.98 118.66 2ixj s PHE 119 Ca 0.00 -0.29 -0.04 0.00 0.12 0.00 0.00 56.93 56.72 2ixj s PHE 119 Cb 0.00 -1.22 -0.05 0.00 -0.57 0.00 0.00 43.02 41.18 2ixj s PHE 119 CO 0.00 0.50 0.46 0.00 -0.10 0.00 0.00 175.22 176.08 2ixj s ALA 120 N -1.66 3.73 -0.00 5.36 0.00 0.85 -4.67 121.76 125.37 2ixj s ALA 120 Ca 0.22 -0.64 0.01 0.00 0.00 0.00 0.00 51.96 51.56 2ixj s ALA 120 Cb -0.08 -2.16 -0.00 0.00 0.00 0.00 0.00 23.12 20.87 2ixj s ALA 120 CO 0.12 0.41 -0.04 -1.58 0.00 0.00 0.00 175.76 174.67 2ixj s HIS 121 N -1.91 0.35 0.08 0.00 2.46 0.13 -0.70 115.29 115.71 2ixj s HIS 121 Ca 0.42 -0.08 -0.24 0.00 0.47 0.00 0.00 55.06 55.63 2ixj s HIS 121 Cb -0.11 -0.23 0.06 0.00 -0.13 0.00 0.00 32.58 32.17 2ixj s HIS 121 CO 0.28 -0.01 0.57 0.20 -2.47 0.00 0.00 174.74 173.31 2ixj s GLY 122 N -0.13 -0.52 0.05 1.59 0.00 -0.71 -0.24 107.32 107.35 2ixj s GLY 122 Ca 0.01 0.62 -0.07 0.00 0.00 0.00 0.00 44.72 45.27 2ixj s GLY 122 CO -0.00 0.30 0.14 -0.11 0.00 0.00 0.00 173.10 173.43 2ixj s PHE 123 N -2.90 0.15 -0.02 1.90 -0.12 -0.57 0.11 117.98 116.53 2ixj s PHE 123 Ca -0.03 -0.45 0.08 0.00 -0.05 0.00 0.00 56.93 56.48 2ixj s PHE 123 Cb -0.00 -0.10 -0.02 0.00 -0.63 0.00 0.00 43.02 42.27 2ixj s PHE 123 CO -0.05 -0.42 -0.25 0.54 -0.05 0.00 0.00 175.22 174.99 2ixj s VAL 124 N -2.81 2.00 -0.09 -2.49 0.11 -0.68 -1.68 120.40 114.77 2ixj s VAL 124 Ca -0.03 -1.08 -0.27 0.00 -2.93 0.00 0.00 61.98 57.67 2ixj s VAL 124 Cb 0.00 -1.66 -0.02 0.00 -1.53 0.00 0.00 36.38 33.16 2ixj s VAL 124 CO -0.05 0.57 0.87 -0.69 -3.33 0.00 0.00 175.10 172.46 2ixj s VAL 125 N -0.57 4.90 -0.17 2.04 1.01 -0.66 -1.51 120.40 125.45 2ixj s VAL 125 Ca 0.09 1.78 0.11 0.00 0.00 0.00 0.00 61.98 63.96 2ixj s VAL 125 Cb -0.10 -4.19 -0.18 0.00 0.00 0.00 0.00 36.38 31.91 2ixj s VAL 125 CO -0.01 0.12 -0.00 0.18 0.00 0.00 0.00 175.10 175.39 2ixj n LEU 126 N 4.46 0.74 -4.91 3.92 4.77 0.02 -0.29 117.00 125.71 2ixj n LEU 126 Ca 0.04 -0.03 -0.28 0.00 -0.03 0.00 0.00 56.01 55.72 2ixj n LEU 126 Cb 0.50 0.12 0.05 0.00 -2.33 0.00 0.00 43.42 41.76 2ixj n LEU 126 CO 0.50 0.50 0.64 -0.94 -1.33 0.00 0.00 177.39 176.76 2ixj s SER 127 N -5.20 5.22 0.31 -1.43 1.04 -1.17 -4.86 113.70 107.62 2ixj s SER 127 Ca -0.13 0.77 0.04 0.00 0.48 0.00 0.00 55.95 57.11 2ixj s SER 127 Cb 0.05 -1.56 0.80 0.00 0.10 0.00 0.00 66.02 65.42 2ixj s SER 127 CO 0.60 -1.38 1.59 -0.08 0.98 0.00 0.00 173.24 174.96 2ixj h GLU 128 N -0.52 0.05 -3.46 4.02 4.81 -1.94 -3.31 114.58 114.24 2ixj h GLU 128 Ca -0.45 -0.00 -0.14 0.00 -0.13 0.00 0.00 59.36 58.63 2ixj h GLU 128 Cb 1.28 -0.01 -0.21 0.00 0.63 0.00 0.00 28.75 30.44 2ixj h GLU 128 CO 0.62 0.03 -0.47 0.71 -0.73 0.00 0.00 179.01 179.17 2ixj s TYR 129 N -5.94 0.01 -0.02 0.92 1.51 -1.26 -1.89 117.35 110.68 2ixj s TYR 129 Ca -0.12 -0.08 0.03 0.00 -1.01 0.00 0.00 57.07 55.89 2ixj s TYR 129 Cb 0.29 -0.03 -0.00 0.00 -0.11 0.00 0.00 41.96 42.10 2ixj s TYR 129 CO 0.78 -0.29 -0.10 0.00 -1.11 0.00 0.00 175.55 174.82 2ixj s ALA 130 N -1.34 0.90 -0.19 3.71 0.00 0.21 -4.14 121.76 120.91 2ixj s ALA 130 Ca -0.14 -0.41 -0.04 0.00 0.00 0.00 0.00 51.96 51.36 2ixj s ALA 130 Cb -0.07 -0.28 -0.02 0.00 0.00 0.00 0.00 23.12 22.75 2ixj s ALA 130 CO 0.02 0.19 -0.03 -1.21 0.00 0.00 0.00 175.76 174.73 2ixj s GLU 131 N -0.05 3.57 -0.06 0.00 2.02 -0.20 -1.74 118.70 122.25 2ixj s GLU 131 Ca 0.01 -0.55 0.06 0.00 0.02 0.00 0.00 54.97 54.50 2ixj s GLU 131 Cb -0.06 -2.99 -0.01 0.00 0.10 0.00 0.00 34.13 31.17 2ixj s GLU 131 CO 0.00 0.05 -0.24 0.12 0.02 0.00 0.00 175.26 175.21 2ixj s PHE 132 N 0.86 2.34 0.01 1.61 5.36 -0.21 -1.55 117.98 126.40 2ixj s PHE 132 Ca -0.00 -0.71 0.01 0.00 -0.96 0.00 0.00 56.93 55.26 2ixj s PHE 132 Cb -0.14 -1.54 -0.01 0.00 -0.34 0.00 0.00 43.02 40.98 2ixj s PHE 132 CO 0.02 -0.22 -0.03 -0.48 -1.46 0.00 0.00 175.22 173.04 2ixj s LEU 133 N -0.11 2.12 0.06 6.12 0.05 -0.07 -0.36 118.68 126.50 2ixj s LEU 133 Ca -0.05 -0.27 -0.09 0.00 0.05 0.00 0.00 54.13 53.78 2ixj s LEU 133 Cb -0.14 -0.04 0.00 0.00 -2.05 0.00 0.00 46.19 43.96 2ixj s LEU 133 CO 0.04 -0.12 0.20 -0.72 -0.55 0.00 0.00 176.35 175.20 2ixj s TYR 134 N -0.71 0.08 -0.14 3.48 -0.85 -0.55 -0.91 117.35 117.75 2ixj s TYR 134 Ca -0.06 -0.38 -0.01 0.00 -0.52 0.00 0.00 57.07 56.09 2ixj s TYR 134 Cb -0.05 -0.03 -0.02 0.00 0.38 0.00 0.00 41.96 42.24 2ixj s TYR 134 CO -0.00 -0.48 -0.10 0.15 -1.52 0.00 0.00 175.55 173.60 2ixj s LYS 135 N -3.09 3.48 0.22 -3.49 1.02 -0.48 -1.23 119.74 116.17 2ixj s LYS 135 Ca -0.01 -0.63 0.10 0.00 0.02 0.00 0.00 55.97 55.45 2ixj s LYS 135 Cb 0.01 -2.72 -0.04 0.00 -0.52 0.00 0.00 37.83 34.56 2ixj s LYS 135 CO -0.07 0.22 -0.11 0.95 -0.92 0.00 0.00 175.35 175.43 2ixj s THR 136 N 0.35 3.03 -1.24 2.17 -4.23 -0.48 -0.93 115.64 114.32 2ixj s THR 136 Ca -0.09 -1.90 0.24 0.00 -1.18 0.00 0.00 61.69 58.76 2ixj s THR 136 Cb -0.15 -2.55 0.02 0.00 1.34 0.00 0.00 72.50 71.16 2ixj s THR 136 CO 0.05 -0.23 1.33 0.35 -0.54 0.00 0.00 174.62 175.58 2ixj n THR 137 N -0.30 0.00 -3.70 3.99 -2.24 -0.93 -0.86 114.28 110.25 2ixj n THR 137 Ca -0.09 -0.05 -0.10 0.00 -2.27 0.00 0.00 64.05 61.55 2ixj n THR 137 Cb 0.57 0.49 -0.05 0.00 -2.10 0.00 0.00 70.33 69.25 2ixj n THR 137 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2ixj s ASP 138 N -2.85 -0.20 0.29 3.42 3.68 -1.26 -4.58 116.67 115.16 2ixj s ASP 138 Ca 0.14 -0.42 -0.29 0.00 2.13 0.00 0.00 52.55 54.11 2ixj s ASP 138 Cb 0.18 0.49 -0.09 0.00 -1.45 0.00 0.00 42.92 42.05 2ixj s ASP 138 CO 0.68 -0.91 1.04 -0.36 0.13 0.00 0.00 175.17 175.76 2ixj s PHE 139 N -3.84 3.65 -0.15 -5.34 0.40 -1.26 -4.87 117.98 106.58 2ixj s PHE 139 Ca 0.06 1.76 -0.29 0.00 -0.60 0.00 0.00 56.93 57.86 2ixj s PHE 139 Cb 0.01 -3.15 -0.04 0.00 0.51 0.00 0.00 43.02 40.35 2ixj s PHE 139 CO -0.08 -0.23 1.67 -0.46 0.70 0.00 0.00 175.22 176.82 2ixj s TRP 140 N -1.27 1.98 -0.24 0.36 -0.00 -1.26 -4.98 118.94 113.54 2ixj s TRP 140 Ca 0.46 0.38 0.00 0.00 -0.00 0.00 0.00 56.10 56.95 2ixj s TRP 140 Cb -0.28 -3.95 0.06 0.00 -0.00 0.00 0.00 33.47 29.30 2ixj s TRP 140 CO 0.36 -3.43 -0.04 0.00 -0.00 0.00 0.00 176.95 173.84 2ixj s ALA 141 N 4.89 1.89 0.57 5.86 0.00 -1.26 -5.02 121.76 128.69 2ixj s ALA 141 Ca 0.74 -1.35 0.26 0.00 0.00 0.00 0.00 51.96 51.61 2ixj s ALA 141 Cb -0.29 -1.44 1.61 0.00 0.00 0.00 0.00 23.12 23.00 2ixj s ALA 141 CO 0.30 -1.23 2.16 -1.00 0.00 0.00 0.00 175.76 176.00 2ixj h PRO 142 N 7.97 0.00 -0.00 0.00 0.13 -1.94 -1.68 132.00 136.49 2ixj h PRO 142 Ca -0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.96 2ixj h PRO 142 Cb 1.07 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.20 2ixj h PRO 142 CO 0.41 0.00 -0.00 -0.85 -0.23 0.00 0.00 178.00 177.33 2ixj n GLU 143 N -4.04 0.58 0.00 0.86 0.00 -1.26 -3.19 120.64 113.59 2ixj n GLU 143 Ca -0.01 -0.01 0.00 0.00 0.00 0.00 0.00 57.16 57.15 2ixj n GLU 143 Cb 0.20 -1.50 0.00 0.00 0.00 0.00 0.00 31.44 30.14 2ixj n GLU 143 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.13 177.85 2ixj n HIS 144 N -1.20 0.00 -2.49 -1.84 8.25 -0.70 -5.04 115.22 112.20 2ixj n HIS 144 Ca 0.17 0.00 -0.41 0.00 -0.26 0.00 0.00 57.72 57.22 2ixj n HIS 144 Cb 0.21 0.00 -0.04 0.00 1.12 0.00 0.00 29.99 31.28 2ixj n HIS 144 CO 0.00 0.00 0.00 -2.00 0.64 0.00 0.00 176.34 174.98 2ixj s GLU 145 N -1.19 4.59 0.45 -0.41 2.12 -0.80 -3.90 118.70 119.57 2ixj s GLU 145 Ca 0.00 1.76 0.05 0.00 0.36 0.00 0.00 54.97 57.14 2ixj s GLU 145 Cb 0.00 -3.25 -0.04 0.00 0.26 0.00 0.00 34.13 31.09 2ixj s GLU 145 CO 0.00 0.09 0.09 1.03 -0.54 0.00 0.00 175.26 175.93 2ixj s ARG 146 N -0.62 2.12 -0.19 4.30 1.81 0.11 -4.97 118.95 121.50 2ixj s ARG 146 Ca 0.49 -2.11 -0.12 0.00 -1.72 0.00 0.00 55.73 52.27 2ixj s ARG 146 Cb -0.30 -1.75 0.06 0.00 -0.45 0.00 0.00 34.95 32.51 2ixj s ARG 146 CO 0.37 -0.20 0.48 0.00 -0.68 0.00 0.00 175.30 175.27 2ixj s ILE 148 N 1.17 4.42 0.24 0.00 1.01 -0.79 -0.20 121.20 127.05 2ixj s ILE 148 Ca -0.07 -0.19 -0.31 0.00 0.00 0.00 0.00 60.65 60.07 2ixj s ILE 148 Cb -0.07 -2.90 -0.12 0.00 0.01 0.00 0.00 42.46 39.39 2ixj s ILE 148 CO -0.11 0.56 1.66 0.54 0.00 0.00 0.00 174.94 177.60 2ixj s VAL 149 N -0.49 2.05 0.29 2.92 0.11 0.46 -1.49 120.40 124.26 2ixj s VAL 149 Ca 0.09 0.04 0.04 0.00 -2.93 0.00 0.00 61.98 59.22 2ixj s VAL 149 Cb -0.12 -3.03 0.29 0.00 -1.53 0.00 0.00 36.38 31.99 2ixj s VAL 149 CO 0.02 0.00 1.69 4.11 -3.33 0.00 0.00 175.10 177.60 2ixj h TRP 150 N 5.94 0.62 -0.90 1.54 5.08 -1.81 -2.57 115.95 123.85 2ixj h TRP 150 Ca -0.45 0.04 -0.50 0.00 1.08 0.00 0.00 58.89 59.07 2ixj h TRP 150 Cb 1.21 -0.13 -0.28 0.00 -3.00 0.00 0.00 29.16 26.96 2ixj h TRP 150 CO 0.62 -0.07 0.56 0.27 -1.28 0.00 0.00 178.44 178.53 2ixj n ASN 151 N -5.07 4.18 -4.68 0.11 6.94 -1.26 -4.70 115.26 110.79 2ixj n ASN 151 Ca 0.22 -3.67 -0.46 0.00 -0.02 0.00 0.00 54.58 50.65 2ixj n ASN 151 Cb 0.66 -0.82 -0.04 0.00 -2.36 0.00 0.00 39.78 37.22 2ixj n ASN 151 CO 0.00 0.00 0.00 -0.67 -1.03 0.00 0.00 177.26 175.56 2ixj n ASP 152 N -1.10 3.33 0.30 0.53 -0.08 -0.97 -4.88 116.55 113.67 2ixj n ASP 152 Ca 0.56 1.03 0.19 0.00 -1.51 0.00 0.00 54.79 55.07 2ixj n ASP 152 Cb 1.42 -1.42 0.92 0.00 2.34 0.00 0.00 41.12 44.38 2ixj n ASP 152 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 2ixj h PRO 153 N 7.40 0.00 0.07 -0.67 0.11 -1.94 0.27 132.00 137.24 2ixj h PRO 153 Ca -0.46 0.00 -0.19 0.00 0.11 0.00 0.00 66.00 65.46 2ixj h PRO 153 Cb 1.26 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.36 2ixj h PRO 153 CO 0.92 0.02 -0.97 0.93 -0.21 0.00 0.00 178.00 178.69 2ixj h GLU 154 N 0.00 0.15 -0.33 1.05 5.08 -2.01 -3.33 114.58 115.20 2ixj h GLU 154 Ca -0.00 -0.25 -0.02 0.00 -1.00 0.00 0.00 59.36 58.09 2ixj h GLU 154 Cb 0.28 0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.61 2ixj h GLU 154 CO 0.00 1.12 0.14 -0.07 -1.00 0.00 0.00 179.01 179.20 2ixj h LEU 155 N -0.62 0.44 -2.95 1.33 3.38 -1.87 -3.47 115.31 111.55 2ixj h LEU 155 Ca -0.22 -0.16 -0.42 0.00 0.09 0.00 0.00 57.88 57.18 2ixj h LEU 155 Cb 1.47 -0.11 0.09 0.00 0.09 0.00 0.00 40.66 42.20 2ixj h LEU 155 CO 0.00 0.48 -0.92 1.17 0.09 0.00 0.00 178.44 179.26 2ixj n LYS 156 N -4.73 -1.71 -2.17 1.13 3.00 0.08 -4.90 118.16 108.87 2ixj n LYS 156 Ca -0.01 0.50 -0.41 0.00 -0.00 0.00 0.00 58.31 58.39 2ixj n LYS 156 Cb 0.13 -4.38 -0.02 0.00 0.00 0.00 0.00 35.03 30.75 2ixj n LYS 156 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.40 177.82 2ixj s ILE 157 N -3.51 2.86 -1.18 3.15 1.01 -1.26 -4.96 121.20 117.32 2ixj s ILE 157 Ca 0.41 0.84 -0.09 0.00 0.00 0.00 0.00 60.65 61.81 2ixj s ILE 157 Cb -0.14 -3.53 0.23 0.00 0.01 0.00 0.00 42.46 39.03 2ixj s ILE 157 CO 0.85 0.19 1.50 -0.67 0.00 0.00 0.00 174.94 176.81 2ixj n ASP 158 N 1.13 5.56 -4.69 3.58 2.03 -1.26 -5.00 116.55 117.90 2ixj n ASP 158 Ca 0.01 -3.14 -0.42 0.00 0.52 0.00 0.00 54.79 51.76 2ixj n ASP 158 Cb 0.42 -1.43 -0.03 0.00 -0.72 0.00 0.00 41.12 39.37 2ixj n ASP 158 CO 0.00 0.00 0.00 0.26 -1.92 0.00 0.00 177.20 175.54 2ixj s TRP 159 N -0.48 2.69 -1.33 -0.67 0.52 -1.26 -4.90 118.94 113.51 2ixj s TRP 159 Ca 0.36 0.67 -0.17 0.00 0.02 0.00 0.00 56.10 56.98 2ixj s TRP 159 Cb 0.01 -3.74 0.05 0.00 -1.15 0.00 0.00 33.47 28.64 2ixj s TRP 159 CO 0.01 -2.83 1.90 -0.35 0.02 0.00 0.00 176.95 175.70 2ixj n PRO 160 N 5.61 2.99 -4.35 4.98 -0.04 -1.26 -4.88 135.00 138.05 2ixj n PRO 160 Ca 0.14 -3.01 -0.21 0.00 -0.04 0.00 0.00 63.50 60.38 2ixj n PRO 160 Cb 0.43 -3.43 -0.13 0.00 -0.04 0.00 0.00 33.50 30.33 2ixj n PRO 160 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2ixj s LEU 161 N 3.84 2.22 -0.02 1.53 1.43 -1.26 -5.02 118.68 121.39 2ixj s LEU 161 Ca 0.53 -0.55 0.07 0.00 -1.03 0.00 0.00 54.13 53.15 2ixj s LEU 161 Cb 0.07 -0.70 -0.10 0.00 0.03 0.00 0.00 46.19 45.48 2ixj s LEU 161 CO 0.03 0.04 0.12 1.67 0.23 0.00 0.00 176.35 178.44 2ixj n GLN 162 N 1.59 0.91 -4.42 1.70 7.27 -1.26 -5.03 117.38 118.15 2ixj n GLN 162 Ca -0.19 -0.05 -0.26 0.00 0.07 0.00 0.00 57.00 56.57 2ixj n GLN 162 Cb 0.54 -1.17 -0.11 0.00 2.41 0.00 0.00 30.24 31.91 2ixj n GLN 162 CO 0.00 0.00 0.00 -0.51 0.07 0.00 0.00 177.06 176.62 2ixj s ASP 163 N -3.08 3.59 0.47 1.69 1.01 -1.26 -5.12 116.67 113.97 2ixj s ASP 163 Ca -0.03 -0.87 -0.23 0.00 0.71 0.00 0.00 52.55 52.13 2ixj s ASP 163 Cb 0.04 -0.33 -0.09 0.00 1.01 0.00 0.00 42.92 43.55 2ixj s ASP 163 CO 0.29 0.10 1.09 0.00 0.21 0.00 0.00 175.17 176.86 2ixj n ALA 164 N 0.00 0.57 -1.77 5.23 0.00 -1.26 -4.99 120.51 118.30 2ixj n ALA 164 Ca -0.10 0.18 -0.31 0.00 0.00 0.00 0.00 53.44 53.21 2ixj n ALA 164 Cb 0.57 -2.15 0.04 0.00 0.00 0.00 0.00 19.45 17.91 2ixj n ALA 164 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2ixj s PRO 165 N -2.29 3.02 -0.43 0.00 0.05 -1.26 -4.99 135.00 129.11 2ixj s PRO 165 Ca 0.66 0.68 -0.15 0.00 0.05 0.00 0.00 61.00 62.24 2ixj s PRO 165 Cb -0.50 -2.02 0.04 0.00 0.05 0.00 0.00 34.50 32.07 2ixj s PRO 165 CO 0.54 -0.97 0.32 -0.51 0.05 0.00 0.00 177.00 176.44 2ixj s LEU 166 N -5.39 5.24 0.12 -3.56 1.02 0.65 -4.93 118.68 111.82 2ixj s LEU 166 Ca 0.57 -1.04 0.05 0.00 0.02 0.00 0.00 54.13 53.73 2ixj s LEU 166 Cb -0.12 -2.16 -0.04 0.00 0.02 0.00 0.00 46.19 43.89 2ixj s LEU 166 CO 0.54 -0.51 0.05 -0.76 0.02 0.00 0.00 176.35 175.69 2ixj s LEU 167 N 1.66 3.60 0.69 1.79 1.43 -1.26 -2.37 118.68 124.21 2ixj s LEU 167 Ca 0.04 -0.17 -0.12 0.00 -1.03 0.00 0.00 54.13 52.85 2ixj s LEU 167 Cb -0.21 -2.27 0.01 0.00 0.03 0.00 0.00 46.19 43.75 2ixj s LEU 167 CO 0.09 0.13 1.07 -0.94 0.23 0.00 0.00 176.35 176.93 2ixj s SER 168 N -2.64 5.24 0.25 2.29 1.04 -1.26 -4.88 113.70 113.74 2ixj s SER 168 Ca 0.28 1.75 -0.03 0.00 0.48 0.00 0.00 55.95 58.43 2ixj s SER 168 Cb -0.11 -2.52 0.46 0.00 0.10 0.00 0.00 66.02 63.95 2ixj s SER 168 CO 0.20 -1.54 1.78 -0.08 0.98 0.00 0.00 173.24 174.58 2ixj h GLU 169 N -0.47 0.63 -0.81 4.02 4.57 -1.99 -1.37 114.58 119.16 2ixj h GLU 169 Ca -0.45 -0.04 0.05 0.00 -1.18 0.00 0.00 59.36 57.74 2ixj h GLU 169 Cb 1.22 -0.14 -0.06 0.00 -0.16 0.00 0.00 28.75 29.61 2ixj h GLU 169 CO 0.55 0.42 0.51 0.87 -1.18 0.00 0.00 179.01 180.18 2ixj h LYS 170 N 0.65 0.92 0.00 1.92 1.57 -1.96 -1.24 116.57 118.44 2ixj h LYS 170 Ca 0.42 -0.06 -0.19 0.00 -1.87 0.00 0.00 60.65 58.96 2ixj h LYS 170 Cb 0.53 -0.21 -0.02 0.00 0.08 0.00 0.00 32.23 32.60 2ixj h LYS 170 CO -0.32 0.61 -0.89 -0.44 -0.57 0.00 0.00 179.45 177.84 2ixj h ASP 171 N 0.95 0.03 -0.63 0.86 3.32 -1.75 -2.87 116.42 116.33 2ixj h ASP 171 Ca 0.34 -0.03 -0.00 0.00 0.02 0.00 0.00 57.03 57.36 2ixj h ASP 171 Cb 0.10 -0.01 -0.03 0.00 0.22 0.00 0.00 39.33 39.61 2ixj h ASP 171 CO -0.15 0.90 0.39 0.03 -1.72 0.00 0.00 179.24 178.70 2ixj h ARG 172 N 0.01 0.86 -0.61 3.56 2.47 -0.86 -2.37 114.38 117.43 2ixj h ARG 172 Ca -0.02 -0.07 0.00 0.00 -1.26 0.00 0.00 59.98 58.64 2ixj h ARG 172 Cb 1.56 -0.19 0.00 0.00 -1.65 0.00 0.00 29.97 29.70 2ixj h ARG 172 CO 0.12 0.60 0.00 1.04 0.56 0.00 0.00 179.97 182.29 2ixj n GLN 173 N -4.41 2.61 -1.59 0.04 6.02 -0.50 -4.98 117.38 114.57 2ixj n GLN 173 Ca 0.06 -1.60 -0.39 0.00 -0.01 0.00 0.00 57.00 55.06 2ixj n GLN 173 Cb 0.07 -1.66 0.04 0.00 1.02 0.00 0.00 30.24 29.71 2ixj n GLN 173 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2ixj n GLY 174 N 0.69 -0.48 3.76 1.08 0.00 -0.89 -4.95 105.19 104.39 2ixj n GLY 174 Ca 0.14 -0.05 -0.37 0.00 0.00 0.00 0.00 46.02 45.74 2ixj n GLY 174 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ixj s LYS 175 N -2.40 3.20 0.39 1.61 -0.14 0.72 -4.08 119.74 119.04 2ixj s LYS 175 Ca 0.70 1.93 -0.26 0.00 -1.36 0.00 0.00 55.97 56.98 2ixj s LYS 175 Cb -0.47 -2.13 -0.09 0.00 -1.68 0.00 0.00 37.83 33.47 2ixj s LYS 175 CO 0.51 -1.05 1.25 0.00 -0.76 0.00 0.00 175.35 175.30 2ixj s ALA 176 N -1.50 3.25 0.18 5.17 0.00 -1.26 -0.40 121.76 127.20 2ixj s ALA 176 Ca 0.73 1.13 -0.19 0.00 0.00 0.00 0.00 51.96 53.62 2ixj s ALA 176 Cb -0.33 -3.44 0.12 0.00 0.00 0.00 0.00 23.12 19.47 2ixj s ALA 176 CO 0.37 -0.68 1.61 0.35 0.00 0.00 0.00 175.76 177.42 2ixj h PHE 177 N 2.79 -0.68 -0.99 0.00 3.57 -1.94 -0.33 116.94 119.35 2ixj h PHE 177 Ca -0.49 0.06 0.31 0.00 3.53 0.00 0.00 57.97 61.37 2ixj h PHE 177 Cb 1.24 0.37 -0.18 0.00 2.79 0.00 0.00 35.95 40.17 2ixj h PHE 177 CO 0.54 -0.33 0.16 0.00 -2.23 0.00 0.00 178.31 176.45 2ixj h ALA 178 N 1.09 1.42 -0.01 2.41 0.00 -2.03 -0.73 119.26 121.42 2ixj h ALA 178 Ca 0.22 0.32 0.00 0.00 0.00 0.00 0.00 54.91 55.45 2ixj h ALA 178 Cb 0.50 0.52 0.00 0.00 0.00 0.00 0.00 17.79 18.81 2ixj h ALA 178 CO -0.58 -0.66 -0.30 -0.25 0.00 0.00 0.00 179.25 177.46 2ixj n ASP 179 N -5.42 0.80 -4.73 0.00 8.00 -0.19 -4.96 116.55 110.05 2ixj n ASP 179 Ca 0.27 -0.65 -0.41 0.00 0.71 0.00 0.00 54.79 54.70 2ixj n ASP 179 Cb 0.89 0.13 -0.03 0.00 -0.02 0.00 0.00 41.12 42.09 2ixj n ASP 179 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2ixj s ALA 180 N -2.64 3.45 0.14 2.24 0.00 -0.28 -4.95 121.76 119.71 2ixj s ALA 180 Ca 0.21 0.96 -0.30 0.00 0.00 0.00 0.00 51.96 52.83 2ixj s ALA 180 Cb 0.19 -3.44 -0.07 0.00 0.00 0.00 0.00 23.12 19.80 2ixj s ALA 180 CO 0.56 -0.43 1.15 -0.51 0.00 0.00 0.00 175.76 176.53 2ixj s ASP 181 N 0.46 7.17 0.12 0.00 1.01 -1.26 -5.04 116.67 119.14 2ixj s ASP 181 Ca 0.56 2.08 0.01 0.00 0.71 0.00 0.00 52.55 55.90 2ixj s ASP 181 Cb -0.33 -2.60 0.01 0.00 1.01 0.00 0.00 42.92 41.01 2ixj s ASP 181 CO 0.34 -0.33 0.05 0.00 0.21 0.00 0.00 175.17 175.44 2ixj s PHE 183 N -0.98 3.61 -2.00 0.00 0.40 -0.95 -5.00 117.98 113.07 2ixj s PHE 183 Ca 0.04 1.06 0.02 0.00 -0.60 0.00 0.00 56.93 57.45 2ixj s PHE 183 Cb -0.00 -2.57 0.13 0.00 0.51 0.00 0.00 43.02 41.08 2ixj s PHE 183 CO 0.03 0.28 0.61 -2.30 0.70 0.00 0.00 175.22 174.54