#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1axj s LEU 2 N 0.00 1.95 0.70 4.03 1.43 -1.26 -4.94 118.68 120.59 1axj s LEU 2 Ca 0.00 -1.28 -0.16 0.00 -1.03 0.00 0.00 54.13 51.65 1axj s LEU 2 Cb 0.00 -0.11 -0.00 0.00 0.03 0.00 0.00 46.19 46.11 1axj s LEU 2 CO 0.00 -0.62 1.01 -0.81 0.23 0.00 0.00 176.35 176.16 1axj n PRO 3 N -0.41 0.62 -0.33 1.29 -0.04 -1.26 -4.92 135.00 129.95 1axj n PRO 3 Ca -0.03 0.27 0.01 0.00 -0.04 0.00 0.00 63.50 63.70 1axj n PRO 3 Cb 0.65 -2.26 0.18 0.00 -0.04 0.00 0.00 33.50 32.03 1axj n PRO 3 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 1axj h GLY 4 N -0.08 1.35 0.14 0.55 0.00 -2.01 -2.39 103.07 100.62 1axj h GLY 4 Ca -0.48 -0.47 0.18 0.00 0.00 0.00 0.00 47.33 46.57 1axj h GLY 4 CO 0.48 0.41 0.59 -0.84 0.00 0.00 0.00 176.54 177.18 1axj h THR 5 N 1.19 0.71 -0.09 4.70 2.02 -1.98 -0.34 112.91 119.12 1axj h THR 5 Ca 0.37 -0.26 0.04 0.00 0.77 0.00 0.00 66.41 67.33 1axj h THR 5 Cb -0.00 -0.11 -0.06 0.00 -1.74 0.00 0.00 68.15 66.24 1axj h THR 5 CO -0.11 0.14 -0.37 0.15 0.37 0.00 0.00 175.52 175.70 1axj h PHE 6 N 0.76 -1.03 -0.34 3.16 3.57 -1.79 -0.62 116.94 120.65 1axj h PHE 6 Ca 0.57 0.04 0.05 0.00 3.53 0.00 0.00 57.97 62.16 1axj h PHE 6 Cb 0.87 0.47 -0.04 0.00 2.79 0.00 0.00 35.95 40.03 1axj h PHE 6 CO -0.01 -0.44 0.07 0.74 -2.23 0.00 0.00 178.31 176.43 1axj h PHE 7 N -0.47 0.12 -0.74 0.41 0.04 -1.21 -1.48 116.94 113.61 1axj h PHE 7 Ca 0.08 0.02 0.12 0.00 2.80 0.00 0.00 57.97 60.98 1axj h PHE 7 Cb 0.59 -0.00 -0.05 0.00 2.20 0.00 0.00 35.95 38.69 1axj h PHE 7 CO -0.42 0.02 0.49 0.93 -0.60 0.00 0.00 178.31 178.73 1axj h GLU 8 N 0.19 0.52 -0.15 1.51 4.39 -0.86 -1.06 114.58 119.11 1axj h GLU 8 Ca 0.16 -0.03 -0.05 0.00 0.34 0.00 0.00 59.36 59.78 1axj h GLU 8 Cb 0.17 -0.12 -0.00 0.00 -0.10 0.00 0.00 28.75 28.70 1axj h GLU 8 CO -0.21 0.34 -0.11 0.28 -1.16 0.00 0.00 179.01 178.16 1axj h VAL 9 N 0.53 1.33 -0.91 3.13 2.07 -0.15 -3.18 116.25 119.07 1axj h VAL 9 Ca 0.35 -1.21 0.11 0.00 0.82 0.00 0.00 66.70 66.78 1axj h VAL 9 Cb 0.63 1.80 -0.08 0.00 -1.52 0.00 0.00 31.29 32.12 1axj h VAL 9 CO -0.12 0.35 0.54 -0.07 0.02 0.00 0.00 177.57 178.29 1axj h LEU 10 N -0.02 0.77 -1.51 2.57 -0.00 -0.40 -1.05 115.31 115.67 1axj h LEU 10 Ca 0.03 0.05 0.00 0.00 -0.00 0.00 0.00 57.88 57.96 1axj h LEU 10 Cb 0.61 -0.09 0.00 0.00 -0.00 0.00 0.00 40.66 41.17 1axj h LEU 10 CO 0.03 0.41 0.40 0.11 -0.00 0.00 0.00 178.44 179.38 1axj h LYS 11 N 0.86 0.00 -6.30 1.13 1.57 -1.21 -3.42 116.57 109.19 1axj h LYS 11 Ca 0.45 0.00 -0.62 0.00 -1.87 0.00 0.00 60.65 58.61 1axj h LYS 11 Cb 0.46 0.00 -0.15 0.00 0.08 0.00 0.00 32.23 32.62 1axj h LYS 11 CO -0.27 0.00 -0.77 -0.80 -0.57 0.00 0.00 179.45 177.03 1axj s ASN 12 N -4.02 3.56 0.41 0.86 0.01 -0.40 -5.11 114.94 110.24 1axj s ASN 12 Ca -0.03 -0.99 -0.21 0.00 -0.71 0.00 0.00 52.86 50.92 1axj s ASN 12 Cb 0.07 -0.29 -0.11 0.00 0.41 0.00 0.00 41.25 41.32 1axj s ASN 12 CO 0.21 0.06 0.93 -0.70 -1.51 0.00 0.00 177.10 176.08 1axj s GLU 13 N -3.32 4.25 -0.04 -0.60 2.12 -1.26 -4.82 118.70 115.02 1axj s GLU 13 Ca 0.28 1.10 -0.31 0.00 0.36 0.00 0.00 54.97 56.40 1axj s GLU 13 Cb -0.06 -2.28 0.13 0.00 0.26 0.00 0.00 34.13 32.18 1axj s GLU 13 CO 0.14 0.03 1.32 0.20 -0.54 0.00 0.00 175.26 176.40 1axj s GLY 14 N -2.12 -0.43 0.52 -1.50 0.00 -1.24 -2.02 107.32 100.53 1axj s GLY 14 Ca 0.60 0.78 -0.19 0.00 0.00 0.00 0.00 44.72 45.91 1axj s GLY 14 CO 0.15 0.15 1.05 0.14 0.00 0.00 0.00 173.10 174.59 1axj s VAL 15 N -2.34 3.71 0.08 1.40 1.01 -1.26 -1.51 120.40 121.48 1axj s VAL 15 Ca 0.14 1.01 0.01 0.00 0.00 0.00 0.00 61.98 63.14 1axj s VAL 15 Cb 0.05 -3.41 -0.04 0.00 0.00 0.00 0.00 36.38 32.98 1axj s VAL 15 CO -0.04 -0.29 -0.06 -0.69 0.00 0.00 0.00 175.10 174.02 1axj s VAL 16 N -2.06 0.56 0.09 2.92 1.01 0.72 -1.99 120.40 121.64 1axj s VAL 16 Ca 0.67 -1.86 -0.06 0.00 0.00 0.00 0.00 61.98 60.72 1axj s VAL 16 Cb -0.17 -1.59 -0.01 0.00 0.00 0.00 0.00 36.38 34.60 1axj s VAL 16 CO 0.25 -0.89 0.14 0.00 0.00 0.00 0.00 175.10 174.59 1axj s ALA 17 N -3.61 0.04 -0.15 5.51 0.00 0.73 -1.17 121.76 123.10 1axj s ALA 17 Ca 0.10 -0.83 -0.04 0.00 0.00 0.00 0.00 51.96 51.18 1axj s ALA 17 Cb 0.05 0.48 0.07 0.00 0.00 0.00 0.00 23.12 23.73 1axj s ALA 17 CO -0.06 -0.48 0.22 0.42 0.00 0.00 0.00 175.76 175.86 1axj s ILE 18 N -3.89 -0.34 -0.47 0.00 1.01 -0.41 -0.46 121.20 116.62 1axj s ILE 18 Ca 0.07 0.13 -0.23 0.00 0.00 0.00 0.00 60.65 60.63 1axj s ILE 18 Cb 0.06 -0.50 0.03 0.00 0.01 0.00 0.00 42.46 42.05 1axj s ILE 18 CO -0.09 -0.01 0.78 0.00 0.00 0.00 0.00 174.94 175.62 1axj s ALA 19 N 2.35 3.28 -0.44 9.38 0.00 0.90 -0.55 121.76 136.69 1axj s ALA 19 Ca 0.04 -1.14 -0.18 0.00 0.00 0.00 0.00 51.96 50.68 1axj s ALA 19 Cb -0.14 -3.49 0.03 0.00 0.00 0.00 0.00 23.12 19.53 1axj s ALA 19 CO -0.09 -2.00 0.49 0.99 0.00 0.00 0.00 175.76 175.15 1axj s THR 20 N 3.30 5.03 0.27 0.00 2.01 -0.54 -1.65 115.64 124.05 1axj s THR 20 Ca 0.28 -0.37 -0.29 0.00 0.31 0.00 0.00 61.69 61.62 1axj s THR 20 Cb -0.13 -4.12 -0.09 0.00 0.01 0.00 0.00 72.50 68.17 1axj s THR 20 CO 0.21 -0.53 0.95 -1.58 -0.69 0.00 0.00 174.62 172.98 1axj s GLN 21 N 2.27 4.76 0.00 4.92 2.00 -0.42 -1.13 119.66 132.05 1axj s GLN 21 Ca 0.13 1.46 0.00 0.00 -2.00 0.00 0.00 55.36 54.96 1axj s GLN 21 Cb -0.18 -3.13 0.00 0.00 0.80 0.00 0.00 33.01 30.51 1axj s GLN 21 CO 0.13 0.42 0.00 0.41 -0.50 0.00 0.00 175.29 175.76 1axj n GLY 22 N 1.19 0.13 2.20 2.59 0.00 -1.26 -4.35 105.19 105.69 1axj n GLY 22 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.01 1axj n GLY 22 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1axj n GLU 23 N -0.85 0.00 -0.76 1.61 2.13 -1.26 -4.54 120.64 116.97 1axj n GLU 23 Ca 0.00 0.00 -0.07 0.00 0.66 0.00 0.00 57.16 57.75 1axj n GLU 23 Cb 0.00 0.00 -0.09 0.00 0.27 0.00 0.00 31.44 31.62 1axj n GLU 23 CO 0.00 0.00 0.00 -0.40 -0.41 0.00 0.00 177.13 176.32 1axj n ASP 24 N -3.35 5.13 -0.03 4.31 5.75 -1.26 -4.87 116.55 122.23 1axj n ASP 24 Ca 0.00 -2.42 0.00 0.00 -0.01 0.00 0.00 54.79 52.37 1axj n ASP 24 Cb 0.00 -1.26 -0.00 0.00 -1.03 0.00 0.00 41.12 38.83 1axj n ASP 24 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1axj n GLY 25 N 2.09 -2.78 3.79 6.12 0.00 -1.26 -4.98 105.19 108.17 1axj n GLY 25 Ca 0.24 -1.32 -0.32 0.00 0.00 0.00 0.00 46.02 44.62 1axj n GLY 25 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1axj s PRO 26 N -3.86 2.80 -0.32 1.61 0.04 -1.26 -4.33 135.00 129.68 1axj s PRO 26 Ca 0.00 1.17 0.03 0.00 0.04 0.00 0.00 61.00 62.24 1axj s PRO 26 Cb 0.00 -1.96 0.09 0.00 0.04 0.00 0.00 34.50 32.67 1axj s PRO 26 CO 0.00 -1.22 0.03 -1.58 0.04 0.00 0.00 177.00 174.26 1axj s HIS 27 N -2.72 3.42 -0.99 0.56 2.46 -0.29 -4.90 115.29 112.84 1axj s HIS 27 Ca 0.62 -2.72 -0.19 0.00 0.47 0.00 0.00 55.06 53.24 1axj s HIS 27 Cb -0.17 -2.59 0.12 0.00 -0.13 0.00 0.00 32.58 29.81 1axj s HIS 27 CO 0.48 -0.92 1.24 -1.17 -2.47 0.00 0.00 174.74 171.90 1axj s LEU 28 N 1.03 4.71 0.99 8.88 0.20 -1.26 -1.47 118.68 131.75 1axj s LEU 28 Ca 0.07 -2.03 -0.14 0.00 0.69 0.00 0.00 54.13 52.71 1axj s LEU 28 Cb -0.19 -2.44 0.18 0.00 -0.43 0.00 0.00 46.19 43.31 1axj s LEU 28 CO -0.09 -1.12 1.16 0.68 -0.29 0.00 0.00 176.35 176.69 1axj s VAL 29 N 3.08 1.92 0.35 1.68 -7.23 0.29 -4.78 120.40 115.71 1axj s VAL 29 Ca 0.37 0.00 0.09 0.00 -1.81 0.00 0.00 61.98 60.63 1axj s VAL 29 Cb -0.03 -2.73 -0.07 0.00 0.56 0.00 0.00 36.38 34.11 1axj s VAL 29 CO -0.08 0.00 -0.07 0.20 -0.31 0.00 0.00 175.10 174.84 1axj s ASN 30 N -4.13 3.79 0.18 4.85 0.02 -1.26 -1.29 114.94 117.09 1axj s ASN 30 Ca 0.67 -1.20 -0.22 0.00 -1.02 0.00 0.00 52.86 51.09 1axj s ASN 30 Cb -0.12 -0.37 0.08 0.00 0.02 0.00 0.00 41.25 40.86 1axj s ASN 30 CO 0.54 -0.24 1.04 0.28 0.02 0.00 0.00 177.10 178.74 1axj s THR 31 N -2.61 0.00 0.01 1.60 -1.32 -0.31 -4.89 115.64 108.11 1axj s THR 31 Ca 0.33 -0.58 0.08 0.00 -1.21 0.00 0.00 61.69 60.31 1axj s THR 31 Cb 0.03 -2.84 -0.02 0.00 -1.51 0.00 0.00 72.50 68.16 1axj s THR 31 CO 0.17 0.00 -0.24 0.26 -2.21 0.00 0.00 174.62 172.60 1axj s TRP 32 N -2.22 2.17 0.51 9.09 0.52 -1.26 -0.20 118.94 127.55 1axj s TRP 32 Ca 0.22 -0.41 0.28 0.00 0.02 0.00 0.00 56.10 56.21 1axj s TRP 32 Cb -0.02 -1.36 1.40 0.00 -1.15 0.00 0.00 33.47 32.34 1axj s TRP 32 CO 0.05 0.02 1.89 -0.91 0.02 0.00 0.00 176.95 178.03 1axj h ASN 33 N 5.25 0.08 0.00 2.95 2.35 -1.57 -0.93 115.58 123.70 1axj h ASN 33 Ca -0.43 0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.33 1axj h ASN 33 Cb 1.13 -0.01 0.00 0.00 0.05 0.00 0.00 38.32 39.50 1axj h ASN 33 CO 0.46 0.03 0.05 -0.24 -1.65 0.00 0.00 177.43 176.08 1axj n SER 34 N -4.33 0.33 -0.08 5.81 2.88 -1.26 -1.57 113.62 115.41 1axj n SER 34 Ca 0.18 0.63 0.01 0.00 -1.33 0.00 0.00 58.87 58.36 1axj n SER 34 Cb 0.88 -0.66 0.01 0.00 -0.75 0.00 0.00 64.21 63.69 1axj n SER 34 CO 0.00 0.00 0.00 -1.22 -1.23 0.00 0.00 175.04 172.59 1axj n TYR 35 N -1.95 0.00 -3.29 0.66 4.01 -0.36 -5.06 117.16 111.18 1axj n TYR 35 Ca -0.01 0.00 -0.19 0.00 -0.16 0.00 0.00 57.90 57.54 1axj n TYR 35 Cb 0.07 0.00 -0.01 0.00 -0.31 0.00 0.00 39.34 39.09 1axj n TYR 35 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 1axj s LEU 36 N -0.41 3.63 -0.05 7.72 1.43 -0.61 -4.25 118.68 126.15 1axj s LEU 36 Ca 0.02 -0.48 -0.00 0.00 -1.03 0.00 0.00 54.13 52.64 1axj s LEU 36 Cb 0.02 -2.47 0.03 0.00 0.03 0.00 0.00 46.19 43.79 1axj s LEU 36 CO 0.03 -0.65 0.00 -1.59 0.23 0.00 0.00 176.35 174.37 1axj s LYS 37 N -4.24 0.45 0.05 1.70 0.00 -0.68 -4.99 119.74 112.03 1axj s LYS 37 Ca 0.51 0.09 0.00 0.00 0.00 0.00 0.00 55.97 56.57 1axj s LYS 37 Cb -0.08 -0.71 -0.04 0.00 0.00 0.00 0.00 37.83 37.00 1axj s LYS 37 CO 0.31 -0.21 0.16 0.08 0.00 0.00 0.00 175.35 175.70 1axj s VAL 38 N 1.46 5.14 0.37 1.79 1.01 -1.26 -0.70 120.40 128.21 1axj s VAL 38 Ca -0.03 -0.44 0.00 0.00 0.00 0.00 0.00 61.98 61.51 1axj s VAL 38 Cb -0.13 -3.47 -0.00 0.00 0.00 0.00 0.00 36.38 32.78 1axj s VAL 38 CO -0.03 0.18 0.02 0.18 0.00 0.00 0.00 175.10 175.45 1axj n LEU 39 N 0.51 0.00 -4.65 3.92 4.77 0.10 -4.99 117.00 116.67 1axj n LEU 39 Ca -0.07 -2.36 -0.30 0.00 -0.03 0.00 0.00 56.01 53.25 1axj n LEU 39 Cb 0.52 0.34 0.23 0.00 -2.33 0.00 0.00 43.42 42.18 1axj n LEU 39 CO 0.48 -0.34 0.66 -0.62 -1.33 0.00 0.00 177.39 176.24 1axj s ASP 40 N -3.04 1.24 -0.88 -1.43 2.15 -1.26 -3.70 116.67 109.75 1axj s ASP 40 Ca 0.02 0.56 0.00 0.00 0.43 0.00 0.00 52.55 53.56 1axj s ASP 40 Cb 0.00 -0.76 0.00 0.00 -0.30 0.00 0.00 42.92 41.86 1axj s ASP 40 CO 0.02 -3.92 0.00 0.61 -0.17 0.00 0.00 175.17 171.71 1axj n GLY 41 N -1.41 -0.23 2.37 2.66 0.00 -1.26 -1.81 105.19 105.50 1axj n GLY 41 Ca 0.14 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.02 1axj n GLY 41 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1axj n ASN 42 N -1.44 -4.17 -4.77 1.61 6.94 -1.24 -4.63 115.26 107.55 1axj n ASN 42 Ca -0.11 0.19 -0.38 0.00 -0.02 0.00 0.00 54.58 54.26 1axj n ASN 42 Cb 0.54 -3.58 -0.03 0.00 -2.36 0.00 0.00 39.78 34.35 1axj n ASN 42 CO 0.00 0.00 0.00 -0.60 -1.03 0.00 0.00 177.26 175.63 1axj s ARG 43 N -4.71 4.19 0.18 -3.83 3.52 -0.75 -3.83 118.95 113.70 1axj s ARG 43 Ca 0.00 1.65 0.06 0.00 -0.13 0.00 0.00 55.73 57.31 1axj s ARG 43 Cb 0.00 -2.67 -0.05 0.00 -1.56 0.00 0.00 34.95 30.68 1axj s ARG 43 CO 0.00 -0.15 -0.13 0.42 -0.81 0.00 0.00 175.30 174.63 1axj s ILE 44 N -1.51 1.48 -0.03 4.11 1.01 -0.05 -0.72 121.20 125.48 1axj s ILE 44 Ca 0.56 -2.12 -0.04 0.00 0.00 0.00 0.00 60.65 59.05 1axj s ILE 44 Cb -0.26 -1.94 0.01 0.00 0.01 0.00 0.00 42.46 40.28 1axj s ILE 44 CO 0.33 -0.65 0.10 -0.69 0.00 0.00 0.00 174.94 174.03 1axj s VAL 45 N -3.07 0.02 -0.01 2.92 1.01 0.13 -0.68 120.40 120.71 1axj s VAL 45 Ca 0.19 -0.14 0.07 0.00 0.00 0.00 0.00 61.98 62.11 1axj s VAL 45 Cb 0.00 -0.20 -0.02 0.00 0.00 0.00 0.00 36.38 36.17 1axj s VAL 45 CO 0.04 -0.07 -0.22 -0.69 0.00 0.00 0.00 175.10 174.15 1axj s VAL 46 N -0.20 1.77 -0.45 2.92 1.01 -0.12 -1.69 120.40 123.65 1axj s VAL 46 Ca -0.03 -0.98 -0.27 0.00 0.00 0.00 0.00 61.98 60.70 1axj s VAL 46 Cb -0.02 -1.48 0.03 0.00 0.00 0.00 0.00 36.38 34.91 1axj s VAL 46 CO 0.00 0.48 1.03 -2.16 0.00 0.00 0.00 175.10 174.45 1axj s PRO 47 N -0.58 3.69 -0.41 2.72 0.05 -1.26 -0.66 135.00 138.54 1axj s PRO 47 Ca 0.09 0.44 -0.25 0.00 0.05 0.00 0.00 61.00 61.33 1axj s PRO 47 Cb -0.09 -3.89 0.02 0.00 0.05 0.00 0.00 34.50 30.59 1axj s PRO 47 CO -0.01 -1.24 0.89 0.54 0.05 0.00 0.00 177.00 177.24 1axj s VAL 48 N 4.02 4.56 -0.02 -0.36 0.11 -0.51 -4.86 120.40 123.34 1axj s VAL 48 Ca 0.42 0.90 0.06 0.00 -2.93 0.00 0.00 61.98 60.44 1axj s VAL 48 Cb -0.09 -4.36 -0.09 0.00 -1.53 0.00 0.00 36.38 30.31 1axj s VAL 48 CO 0.27 -0.66 0.12 0.61 -3.33 0.00 0.00 175.10 172.11 1axj n GLY 49 N 4.68 -0.29 2.53 6.54 0.00 -1.26 -0.27 105.19 117.13 1axj n GLY 49 Ca 0.06 -0.14 -0.02 0.00 0.00 0.00 0.00 46.02 45.91 1axj n GLY 49 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1axj n GLY 50 N 2.23 1.55 2.88 -0.02 0.00 -1.26 -4.68 105.19 105.89 1axj n GLY 50 Ca -0.03 -0.14 -0.39 0.00 0.00 0.00 0.00 46.02 45.47 1axj n GLY 50 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1axj n MET 51 N -1.24 3.84 0.18 1.61 2.00 -1.26 -4.96 117.12 117.29 1axj n MET 51 Ca -0.14 -4.58 -0.07 0.00 0.00 0.00 0.00 57.70 52.90 1axj n MET 51 Cb 0.83 -2.44 -0.03 0.00 0.00 0.00 0.00 33.22 31.57 1axj n MET 51 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 175.97 176.42 1axj h HIS 52 N 5.20 -0.44 -0.93 2.03 3.86 -1.98 0.16 115.15 123.05 1axj h HIS 52 Ca 0.20 -0.01 0.17 0.00 -1.16 0.00 0.00 60.37 59.56 1axj h HIS 52 Cb 0.65 0.15 -0.10 0.00 1.06 0.00 0.00 27.41 29.16 1axj h HIS 52 CO 0.91 -0.27 0.52 -0.22 0.86 0.00 0.00 177.93 179.73 1axj h LYS 53 N -0.57 0.68 -0.69 2.45 3.64 -1.99 -0.33 116.57 119.76 1axj h LYS 53 Ca -0.05 -0.04 -0.05 0.00 -1.27 0.00 0.00 60.65 59.24 1axj h LYS 53 Cb 0.36 -0.15 -0.03 0.00 -0.41 0.00 0.00 32.23 32.00 1axj h LYS 53 CO 0.08 0.45 0.23 1.15 -2.27 0.00 0.00 179.45 179.09 1axj h THR 54 N 0.70 1.25 -0.08 1.00 2.02 -1.91 0.18 112.91 116.06 1axj h THR 54 Ca 0.52 -0.82 0.03 0.00 0.77 0.00 0.00 66.41 66.91 1axj h THR 54 Cb 0.77 0.47 -0.03 0.00 -1.74 0.00 0.00 68.15 67.61 1axj h THR 54 CO -0.37 0.32 -0.10 -0.08 0.37 0.00 0.00 175.52 175.66 1axj h GLU 55 N 1.01 -0.13 -0.68 6.66 4.81 0.10 -0.87 114.58 125.47 1axj h GLU 55 Ca 0.23 0.01 -0.07 0.00 -0.13 0.00 0.00 59.36 59.40 1axj h GLU 55 Cb 0.25 0.03 -0.03 0.00 0.63 0.00 0.00 28.75 29.64 1axj h GLU 55 CO -0.01 -0.09 0.15 0.00 -0.73 0.00 0.00 179.01 178.33 1axj h ALA 56 N 0.92 0.98 -0.54 2.92 0.00 -1.19 -1.89 119.26 120.45 1axj h ALA 56 Ca 0.07 -0.25 -0.07 0.00 0.00 0.00 0.00 54.91 54.66 1axj h ALA 56 Cb 0.23 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 1axj h ALA 56 CO -0.17 0.66 0.08 -0.91 0.00 0.00 0.00 179.25 178.91 1axj h ASN 57 N 1.04 0.87 -0.08 0.00 4.21 -0.04 -0.61 115.58 120.98 1axj h ASN 57 Ca 0.21 -0.27 -0.03 0.00 1.21 0.00 0.00 56.30 57.43 1axj h ASN 57 Cb 0.38 -0.23 -0.00 0.00 -1.12 0.00 0.00 38.32 37.35 1axj h ASN 57 CO 0.00 0.92 -0.08 0.58 -1.29 0.00 0.00 177.43 177.57 1axj h VAL 58 N 0.79 1.37 -0.77 2.81 2.07 -1.17 -0.78 116.25 120.57 1axj h VAL 58 Ca 0.16 -1.23 0.22 0.00 0.82 0.00 0.00 66.70 66.68 1axj h VAL 58 Cb 0.43 2.02 -0.03 0.00 -1.52 0.00 0.00 31.29 32.19 1axj h VAL 58 CO 0.01 0.34 0.61 0.00 0.02 0.00 0.00 177.57 178.55 1axj h ALA 59 N 0.56 2.67 0.06 1.67 0.00 -1.15 -2.35 119.26 120.73 1axj h ALA 59 Ca 0.01 -0.03 -0.23 0.00 0.00 0.00 0.00 54.91 54.66 1axj h ALA 59 Cb 0.59 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 1axj h ALA 59 CO 0.02 -1.01 -1.23 0.00 0.00 0.00 0.00 179.25 177.04 1axj h ARG 60 N 0.00 0.13 -2.96 0.00 3.08 -0.81 -3.49 114.38 110.34 1axj h ARG 60 Ca 0.37 -0.23 -0.14 0.00 0.07 0.00 0.00 59.98 60.05 1axj h ARG 60 Cb 1.58 0.09 -0.24 0.00 0.08 0.00 0.00 29.97 31.47 1axj h ARG 60 CO -0.00 1.11 -0.33 0.34 -1.07 0.00 0.00 179.97 180.01 1axj s ASP 61 N -6.87 -0.33 0.19 7.04 2.15 -0.32 -5.07 116.67 113.46 1axj s ASP 61 Ca -0.23 0.61 0.20 0.00 0.43 0.00 0.00 52.55 53.56 1axj s ASP 61 Cb 0.04 0.64 0.86 0.00 -0.30 0.00 0.00 42.92 44.16 1axj s ASP 61 CO 0.70 -0.14 1.61 -1.84 -0.17 0.00 0.00 175.17 175.33 1axj n GLU 62 N 2.78 0.13 -1.54 4.34 -0.00 -1.24 -3.84 120.64 121.26 1axj n GLU 62 Ca -0.14 0.40 -0.53 0.00 -0.00 0.00 0.00 57.16 56.89 1axj n GLU 62 Cb 0.58 -1.77 -0.07 0.00 -0.00 0.00 0.00 31.44 30.18 1axj n GLU 62 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.13 177.67 1axj n ARG 63 N -2.02 1.16 -3.91 3.44 5.12 -1.26 -0.13 116.66 119.06 1axj n ARG 63 Ca 0.02 0.37 -0.11 0.00 -1.93 0.00 0.00 57.85 56.20 1axj n ARG 63 Cb 0.19 -2.32 -0.12 0.00 -1.16 0.00 0.00 32.46 29.05 1axj n ARG 63 CO 0.00 0.00 0.00 0.14 -1.93 0.00 0.00 177.63 175.84 1axj s VAL 64 N 5.75 0.06 0.08 1.55 -7.23 -0.61 -1.30 120.40 118.69 1axj s VAL 64 Ca 1.05 -0.53 0.06 0.00 -1.81 0.00 0.00 61.98 60.75 1axj s VAL 64 Cb -0.94 -0.24 -0.04 0.00 0.56 0.00 0.00 36.38 35.72 1axj s VAL 64 CO 0.55 -0.29 -0.07 -0.22 -0.31 0.00 0.00 175.10 174.77 1axj s LEU 65 N -0.90 3.17 -0.01 1.32 0.20 -0.66 -1.22 118.68 120.59 1axj s LEU 65 Ca -0.10 -0.28 -0.01 0.00 0.69 0.00 0.00 54.13 54.42 1axj s LEU 65 Cb -0.06 -1.92 0.00 0.00 -0.43 0.00 0.00 46.19 43.78 1axj s LEU 65 CO -0.00 0.20 0.03 -0.32 -0.29 0.00 0.00 176.35 175.97 1axj s MET 66 N -2.07 0.07 -0.11 1.98 -2.45 -0.01 -0.07 119.30 116.65 1axj s MET 66 Ca 0.22 -0.01 0.03 0.00 -1.25 0.00 0.00 55.69 54.68 1axj s MET 66 Cb -0.11 0.03 0.01 0.00 1.25 0.00 0.00 34.83 36.01 1axj s MET 66 CO 0.14 -0.01 -0.21 0.95 1.05 0.00 0.00 175.02 176.93 1axj s THR 67 N -0.12 1.89 0.41 10.11 -4.23 0.39 0.13 115.64 124.21 1axj s THR 67 Ca -0.02 -0.90 0.07 0.00 -1.18 0.00 0.00 61.69 59.66 1axj s THR 67 Cb -0.01 -1.66 -0.07 0.00 1.34 0.00 0.00 72.50 72.10 1axj s THR 67 CO 0.00 0.52 0.08 -1.48 -0.54 0.00 0.00 174.62 173.20 1axj s LEU 68 N 0.57 2.99 0.00 4.79 2.34 -0.59 -0.20 118.68 128.58 1axj s LEU 68 Ca -0.14 -1.23 -0.14 0.00 0.06 0.00 0.00 54.13 52.69 1axj s LEU 68 Cb -0.17 -1.15 0.05 0.00 -0.56 0.00 0.00 46.19 44.36 1axj s LEU 68 CO 0.04 -0.48 0.66 0.61 -1.06 0.00 0.00 176.35 176.12 1axj n GLY 69 N -1.08 0.84 3.34 -3.48 0.00 -0.84 -1.22 105.19 102.74 1axj n GLY 69 Ca -0.03 -1.06 -0.09 0.00 0.00 0.00 0.00 46.02 44.83 1axj n GLY 69 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1axj s SER 70 N -2.55 0.01 0.00 1.61 0.15 0.01 -3.73 113.70 109.20 1axj s SER 70 Ca 0.15 -0.77 0.22 0.00 0.70 0.00 0.00 55.95 56.25 1axj s SER 70 Cb -0.02 0.44 -0.05 0.00 -1.71 0.00 0.00 66.02 64.68 1axj s SER 70 CO 0.03 -0.88 1.03 0.54 1.20 0.00 0.00 173.24 175.16 1axj n ARG 71 N -0.21 0.29 0.00 5.44 1.74 -0.86 -2.63 116.66 120.45 1axj n ARG 71 Ca -0.09 -0.23 0.12 0.00 -0.77 0.00 0.00 57.85 56.87 1axj n ARG 71 Cb 0.63 -1.50 0.20 0.00 -1.02 0.00 0.00 32.46 30.77 1axj n ARG 71 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 1axj n LYS 72 N -1.15 0.02 -4.47 5.56 4.76 -1.26 -4.71 118.16 116.90 1axj n LYS 72 Ca 0.06 -0.01 -0.20 0.00 -2.87 0.00 0.00 58.31 55.28 1axj n LYS 72 Cb 0.36 -1.50 -0.15 0.00 -1.84 0.00 0.00 35.03 31.90 1axj n LYS 72 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 1axj s VAL 73 N -2.99 0.87 0.04 -0.18 1.01 -1.26 -5.06 120.40 112.83 1axj s VAL 73 Ca 0.11 -0.46 -0.30 0.00 0.00 0.00 0.00 61.98 61.33 1axj s VAL 73 Cb 0.17 -0.74 -0.04 0.00 0.00 0.00 0.00 36.38 35.77 1axj s VAL 73 CO 0.72 0.25 1.02 0.00 0.00 0.00 0.00 175.10 177.09 1axj s ALA 74 N -0.14 3.22 0.00 5.51 0.00 -1.26 -1.11 121.76 127.98 1axj s ALA 74 Ca 0.02 0.61 0.00 0.00 0.00 0.00 0.00 51.96 52.59 1axj s ALA 74 Cb -0.06 -3.35 0.00 0.00 0.00 0.00 0.00 23.12 19.72 1axj s ALA 74 CO -0.00 -0.23 0.00 0.41 0.00 0.00 0.00 175.76 175.94 1axj n GLY 75 N 2.80 3.27 0.08 0.00 0.00 -1.08 -4.51 105.19 105.74 1axj n GLY 75 Ca 0.06 -1.70 -0.07 0.00 0.00 0.00 0.00 46.02 44.31 1axj n GLY 75 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1axj n ARG 76 N 0.00 0.47 -2.53 1.61 5.12 -1.25 -4.79 116.66 115.29 1axj n ARG 76 Ca 0.00 0.52 -0.42 0.00 -1.93 0.00 0.00 57.85 56.02 1axj n ARG 76 Cb 0.00 -1.69 -0.03 0.00 -1.16 0.00 0.00 32.46 29.58 1axj n ARG 76 CO 0.00 0.00 0.00 0.54 -1.93 0.00 0.00 177.63 176.24 1axj s ASN 77 N -5.91 6.25 0.85 0.55 6.03 -1.26 -4.92 114.94 116.55 1axj s ASN 77 Ca -0.17 -0.12 0.00 0.00 -1.03 0.00 0.00 52.86 51.53 1axj s ASN 77 Cb 0.03 -2.56 0.00 0.00 -3.03 0.00 0.00 41.25 35.69 1axj s ASN 77 CO 0.28 -1.69 0.00 0.61 -2.03 0.00 0.00 177.10 174.27 1axj n GLY 78 N 5.24 -0.56 2.33 0.45 0.00 -1.26 -3.38 105.19 108.01 1axj n GLY 78 Ca 0.07 -0.84 -0.33 0.00 0.00 0.00 0.00 46.02 44.91 1axj n GLY 78 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1axj n PRO 79 N -1.48 3.21 -3.66 1.61 -0.04 -1.26 -2.63 135.00 130.74 1axj n PRO 79 Ca 0.00 -1.92 -0.07 0.00 -0.04 0.00 0.00 63.50 61.48 1axj n PRO 79 Cb 0.00 -2.64 -0.08 0.00 -0.04 0.00 0.00 33.50 30.74 1axj n PRO 79 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 1axj s GLY 80 N 2.38 -0.47 0.40 0.55 0.00 -1.11 -4.43 107.32 104.64 1axj s GLY 80 Ca 0.64 1.76 0.08 0.00 0.00 0.00 0.00 44.72 47.19 1axj s GLY 80 CO -0.05 2.54 0.15 -1.08 0.00 0.00 0.00 173.10 174.66 1axj s THR 81 N 2.58 2.36 0.22 0.90 -1.32 -0.27 -2.79 115.64 117.33 1axj s THR 81 Ca -0.04 -1.75 -0.21 0.00 -1.21 0.00 0.00 61.69 58.49 1axj s THR 81 Cb -0.12 -2.98 0.07 0.00 -1.51 0.00 0.00 72.50 67.97 1axj s THR 81 CO -0.15 -0.03 0.98 -0.83 -2.21 0.00 0.00 174.62 172.39 1axj s GLY 82 N -3.87 0.14 0.04 6.08 0.00 -0.44 -0.81 107.32 108.45 1axj s GLY 82 Ca 0.40 -0.38 0.02 0.00 0.00 0.00 0.00 44.72 44.76 1axj s GLY 82 CO 0.22 1.73 -0.08 -1.36 0.00 0.00 0.00 173.10 173.61 1axj s PHE 83 N -2.28 0.68 -0.18 1.90 0.40 -0.36 -1.23 117.98 116.91 1axj s PHE 83 Ca 0.20 -0.46 -0.09 0.00 -0.60 0.00 0.00 56.93 55.98 1axj s PHE 83 Cb -0.03 -0.41 -0.05 0.00 0.51 0.00 0.00 43.02 43.04 1axj s PHE 83 CO 0.06 -0.07 0.11 -1.17 0.70 0.00 0.00 175.22 174.86 1axj s LEU 84 N -1.46 4.14 0.12 -0.37 0.20 0.10 -1.54 118.68 119.86 1axj s LEU 84 Ca -0.09 0.23 0.05 0.00 0.69 0.00 0.00 54.13 55.01 1axj s LEU 84 Cb -0.09 -2.06 -0.04 0.00 -0.43 0.00 0.00 46.19 43.57 1axj s LEU 84 CO 0.00 0.21 -0.11 -0.63 -0.29 0.00 0.00 176.35 175.53 1axj s ILE 85 N 0.17 1.14 0.02 6.68 -1.09 0.12 -1.03 121.20 127.22 1axj s ILE 85 Ca 0.08 -1.79 0.02 0.00 -2.23 0.00 0.00 60.65 56.73 1axj s ILE 85 Cb -0.11 -1.56 -0.02 0.00 -1.58 0.00 0.00 42.46 39.19 1axj s ILE 85 CO -0.01 -0.57 -0.07 -0.13 -1.23 0.00 0.00 174.94 172.93 1axj s ARG 86 N -3.04 0.52 0.00 2.79 0.52 0.38 -0.83 118.95 119.29 1axj s ARG 86 Ca 0.10 -0.55 0.00 0.00 -0.52 0.00 0.00 55.73 54.76 1axj s ARG 86 Cb -0.02 -0.38 0.00 0.00 0.52 0.00 0.00 34.95 35.07 1axj s ARG 86 CO 0.01 0.09 0.00 0.41 0.02 0.00 0.00 175.30 175.83 1axj n GLY 87 N 2.04 -0.94 3.48 -3.53 0.00 -0.35 -0.86 105.19 105.04 1axj n GLY 87 Ca -0.19 -0.73 -0.30 0.00 0.00 0.00 0.00 46.02 44.81 1axj n GLY 87 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1axj s SER 88 N -4.00 3.89 0.33 1.61 0.01 -0.68 -1.58 113.70 113.28 1axj s SER 88 Ca 0.00 -0.48 0.08 0.00 1.31 0.00 0.00 55.95 56.87 1axj s SER 88 Cb 0.00 -0.61 -0.04 0.00 0.21 0.00 0.00 66.02 65.58 1axj s SER 88 CO 0.00 0.22 0.14 0.00 0.41 0.00 0.00 173.24 174.01 1axj s ALA 89 N -1.04 3.50 -0.30 1.44 0.00 0.81 -0.40 121.76 125.77 1axj s ALA 89 Ca 0.17 -1.78 -0.11 0.00 0.00 0.00 0.00 51.96 50.24 1axj s ALA 89 Cb -0.11 -0.80 0.13 0.00 0.00 0.00 0.00 23.12 22.34 1axj s ALA 89 CO 0.08 0.06 0.69 0.00 0.00 0.00 0.00 175.76 176.59 1axj s ALA 90 N -2.39 -2.09 0.24 0.00 0.00 0.40 -4.71 121.76 113.21 1axj s ALA 90 Ca 0.37 2.33 -0.30 0.00 0.00 0.00 0.00 51.96 54.36 1axj s ALA 90 Cb -0.03 -1.77 -0.09 0.00 0.00 0.00 0.00 23.12 21.23 1axj s ALA 90 CO 0.23 -0.88 1.06 -0.06 0.00 0.00 0.00 175.76 176.10 1axj s PHE 91 N 2.74 3.69 -0.00 0.00 0.08 -1.26 -1.06 117.98 122.16 1axj s PHE 91 Ca -0.06 1.73 -0.01 0.00 0.12 0.00 0.00 56.93 58.71 1axj s PHE 91 Cb -0.11 -3.20 -0.00 0.00 -0.57 0.00 0.00 43.02 39.14 1axj s PHE 91 CO -0.19 -0.29 0.02 1.03 -0.10 0.00 0.00 175.22 175.69 1axj s ARG 92 N -1.04 0.07 -0.34 0.44 1.81 -0.01 -4.95 118.95 114.93 1axj s ARG 92 Ca 0.45 -0.05 0.06 0.00 -1.72 0.00 0.00 55.73 54.47 1axj s ARG 92 Cb -0.29 0.03 0.46 0.00 -0.45 0.00 0.00 34.95 34.69 1axj s ARG 92 CO 0.37 -0.01 1.31 0.25 -0.68 0.00 0.00 175.30 176.54 1axj n THR 93 N 2.87 2.67 -3.49 0.02 -2.24 -1.26 -0.46 114.28 112.39 1axj n THR 93 Ca -0.14 -4.00 -0.14 0.00 -2.27 0.00 0.00 64.05 57.50 1axj n THR 93 Cb 0.59 -1.11 -0.04 0.00 -2.10 0.00 0.00 70.33 67.67 1axj n THR 93 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1axj s ASP 94 N -3.34 -0.56 0.00 3.42 2.15 -1.26 -5.02 116.67 112.06 1axj s ASP 94 Ca 0.53 0.23 0.00 0.00 0.43 0.00 0.00 52.55 53.73 1axj s ASP 94 Cb 0.42 0.56 0.00 0.00 -0.30 0.00 0.00 42.92 43.60 1axj s ASP 94 CO 0.03 -0.81 0.00 0.61 -0.17 0.00 0.00 175.17 174.83 1axj n GLY 95 N 0.15 -0.59 0.24 2.66 0.00 -1.26 -3.42 105.19 102.96 1axj n GLY 95 Ca -0.18 -1.77 0.16 0.00 0.00 0.00 0.00 46.02 44.24 1axj n GLY 95 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1axj h PRO 96 N 0.00 0.00 0.56 1.61 0.13 -2.02 -0.93 132.00 131.34 1axj h PRO 96 Ca 0.00 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 65.10 1axj h PRO 96 Cb 0.00 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.14 1axj h PRO 96 CO 0.00 0.00 -0.27 0.93 -0.23 0.00 0.00 178.00 178.43 1axj h GLU 97 N 0.00 -0.72 -0.12 0.86 3.07 -1.99 -0.50 114.58 115.18 1axj h GLU 97 Ca 0.00 0.05 -0.02 0.00 -0.50 0.00 0.00 59.36 58.89 1axj h GLU 97 Cb 0.12 0.16 -0.01 0.00 -0.84 0.00 0.00 28.75 28.18 1axj h GLU 97 CO 0.00 -0.48 0.00 0.35 -1.40 0.00 0.00 179.01 177.48 1axj h PHE 98 N -0.83 0.16 -0.04 4.33 3.57 -1.32 -1.80 116.94 121.01 1axj h PHE 98 Ca -0.08 -0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.41 1axj h PHE 98 Cb 0.57 -0.05 -0.00 0.00 2.79 0.00 0.00 35.95 39.26 1axj h PHE 98 CO 0.08 0.17 -0.02 0.93 -2.23 0.00 0.00 178.31 177.23 1axj h GLU 99 N 0.16 0.09 -0.56 1.11 5.08 -1.22 0.18 114.58 119.42 1axj h GLU 99 Ca 0.04 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.35 1axj h GLU 99 Cb 0.11 -0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.33 1axj h GLU 99 CO 0.00 0.50 0.31 0.00 -1.00 0.00 0.00 179.01 178.82 1axj h ALA 100 N 0.59 1.49 0.00 3.43 0.00 -0.73 -1.23 119.26 122.82 1axj h ALA 100 Ca 0.01 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1axj h ALA 100 Cb 0.47 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.03 1axj h ALA 100 CO 0.01 0.43 -0.24 -0.84 0.00 0.00 0.00 179.25 178.61 1axj h ILE 101 N 0.78 0.00 -0.87 0.00 -0.00 -1.25 -3.33 117.51 112.84 1axj h ILE 101 Ca 0.20 -0.84 0.25 0.00 -0.00 0.00 0.00 64.86 64.47 1axj h ILE 101 Cb 0.02 1.71 -0.03 0.00 -0.00 0.00 0.00 36.82 38.51 1axj h ILE 101 CO -0.03 0.00 0.74 0.00 -0.00 0.00 0.00 178.15 178.86 1axj h ALA 102 N 2.16 2.74 -0.96 0.16 0.00 0.64 0.59 119.26 124.58 1axj h ALA 102 Ca 0.00 -0.03 0.22 0.00 0.00 0.00 0.00 54.91 55.10 1axj h ALA 102 Cb 0.92 0.07 -0.08 0.00 0.00 0.00 0.00 17.79 18.70 1axj h ALA 102 CO 0.00 -1.19 0.62 0.07 0.00 0.00 0.00 179.25 178.75 1axj h ARG 103 N 0.00 0.44 -7.79 0.00 0.11 -1.67 -3.41 114.38 102.05 1axj h ARG 103 Ca 0.42 -0.03 -0.44 0.00 0.10 0.00 0.00 59.98 60.02 1axj h ARG 103 Cb 1.89 -0.10 0.16 0.00 1.11 0.00 0.00 29.97 33.04 1axj h ARG 103 CO -0.00 0.29 0.40 -0.06 0.10 0.00 0.00 179.97 180.70 1axj s PHE 104 N -5.50 1.54 0.00 4.08 0.08 0.20 -5.04 117.98 113.34 1axj s PHE 104 Ca -0.09 0.34 0.00 0.00 0.12 0.00 0.00 56.93 57.30 1axj s PHE 104 Cb 0.24 -4.06 0.00 0.00 -0.57 0.00 0.00 43.02 38.62 1axj s PHE 104 CO 0.79 -2.72 0.00 1.17 -0.10 0.00 0.00 175.22 174.36 1axj n LYS 105 N -3.83 0.00 -0.30 0.44 3.00 -1.26 -4.71 118.16 111.49 1axj n LYS 105 Ca 0.15 0.00 0.11 0.00 -0.00 0.00 0.00 58.31 58.57 1axj n LYS 105 Cb 0.59 -0.41 0.29 0.00 0.00 0.00 0.00 35.03 35.50 1axj n LYS 105 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 177.40 174.73 1axj n TRP 106 N 0.00 0.80 -2.83 5.64 4.27 -1.26 -4.99 117.44 119.08 1axj n TRP 106 Ca 0.00 -0.40 -0.33 0.00 -3.89 0.00 0.00 57.50 52.88 1axj n TRP 106 Cb 0.22 0.00 -0.06 0.00 -1.36 0.00 0.00 31.31 30.11 1axj n TRP 106 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 1axj s ALA 107 N -1.20 3.11 0.00 -1.67 0.00 -1.26 -4.26 121.76 116.47 1axj s ALA 107 Ca 0.44 0.28 0.00 0.00 0.00 0.00 0.00 51.96 52.67 1axj s ALA 107 Cb 0.23 -3.05 0.00 0.00 0.00 0.00 0.00 23.12 20.30 1axj s ALA 107 CO 0.31 0.11 0.00 -2.13 0.00 0.00 0.00 175.76 174.05 1axj n ARG 108 N -0.74 0.72 -3.58 0.00 0.63 0.63 -4.91 116.66 109.42 1axj n ARG 108 Ca 0.06 0.00 -0.05 0.00 -0.92 0.00 0.00 57.85 56.94 1axj n ARG 108 Cb 0.54 -0.98 -0.02 0.00 0.45 0.00 0.00 32.46 32.45 1axj n ARG 108 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1axj s ALA 109 N -1.92 -1.96 -0.42 5.13 0.00 -0.84 -4.92 121.76 116.84 1axj s ALA 109 Ca 0.00 1.17 -0.13 0.00 0.00 0.00 0.00 51.96 53.00 1axj s ALA 109 Cb 0.00 0.19 0.04 0.00 0.00 0.00 0.00 23.12 23.36 1axj s ALA 109 CO 0.00 -0.71 0.29 0.00 0.00 0.00 0.00 175.76 175.34 1axj s ALA 110 N -2.76 3.42 -0.91 0.00 0.00 0.39 -1.43 121.76 120.48 1axj s ALA 110 Ca 0.08 -1.86 -0.25 0.00 0.00 0.00 0.00 51.96 49.94 1axj s ALA 110 Cb -0.00 -2.82 0.04 0.00 0.00 0.00 0.00 23.12 20.33 1axj s ALA 110 CO -0.06 -1.52 1.41 -1.17 0.00 0.00 0.00 175.76 174.42 1axj s LEU 111 N 1.61 3.36 0.04 0.00 2.96 0.17 -0.83 118.68 125.99 1axj s LEU 111 Ca 0.04 -1.02 -0.30 0.00 -0.22 0.00 0.00 54.13 52.62 1axj s LEU 111 Cb -0.21 -2.57 -0.04 0.00 0.50 0.00 0.00 46.19 43.88 1axj s LEU 111 CO 0.07 -1.69 1.01 -0.69 -1.32 0.00 0.00 176.35 173.74 1axj s VAL 112 N 5.49 4.62 -0.11 1.68 1.01 -0.23 -0.94 120.40 131.93 1axj s VAL 112 Ca 0.43 1.97 0.03 0.00 0.00 0.00 0.00 61.98 64.41 1axj s VAL 112 Cb -0.03 -4.26 0.00 0.00 0.00 0.00 0.00 36.38 32.09 1axj s VAL 112 CO 0.00 0.20 -0.22 -0.63 0.00 0.00 0.00 175.10 174.45 1axj s ILE 113 N 0.70 1.96 -0.68 2.22 1.01 0.14 -0.45 121.20 126.11 1axj s ILE 113 Ca 0.51 -0.95 -0.09 0.00 0.00 0.00 0.00 60.65 60.12 1axj s ILE 113 Cb -0.23 -1.71 0.18 0.00 0.01 0.00 0.00 42.46 40.70 1axj s ILE 113 CO 0.29 0.54 0.56 -0.89 0.00 0.00 0.00 174.94 175.44 1axj s THR 114 N 0.50 4.60 0.78 2.92 2.01 0.46 -0.87 115.64 126.04 1axj s THR 114 Ca -0.15 -2.54 -0.14 0.00 0.31 0.00 0.00 61.69 59.17 1axj s THR 114 Cb -0.17 -3.93 0.07 0.00 0.01 0.00 0.00 72.50 68.48 1axj s THR 114 CO 0.06 -0.92 1.21 -0.69 -0.69 0.00 0.00 174.62 173.58 1axj s VAL 115 N 0.30 2.13 0.00 3.82 1.01 -1.25 -1.69 120.40 124.72 1axj s VAL 115 Ca 0.15 0.06 0.00 0.00 0.00 0.00 0.00 61.98 62.19 1axj s VAL 115 Cb -0.17 -2.52 0.00 0.00 0.00 0.00 0.00 36.38 33.69 1axj s VAL 115 CO -0.05 -0.04 0.00 0.52 0.00 0.00 0.00 175.10 175.53 1axj n VAL 116 N -3.13 0.00 -3.73 2.92 0.31 -0.04 -4.90 118.33 109.76 1axj n VAL 116 Ca 0.13 0.00 -0.13 0.00 -0.01 0.00 0.00 64.34 64.33 1axj n VAL 116 Cb 0.50 -0.62 -0.10 0.00 -0.91 0.00 0.00 33.84 32.72 1axj n VAL 116 CO 0.00 0.00 0.00 -0.44 -1.32 0.00 0.00 176.83 175.07 1axj s SER 117 N -4.10 -0.41 -0.04 4.52 0.01 -0.95 -4.76 113.70 107.98 1axj s SER 117 Ca 0.00 0.75 0.05 0.00 1.31 0.00 0.00 55.95 58.06 1axj s SER 117 Cb 0.00 0.78 -0.02 0.00 0.21 0.00 0.00 66.02 66.98 1axj s SER 117 CO 0.00 -0.17 -0.17 0.00 0.41 0.00 0.00 173.24 173.31 1axj s ALA 118 N 0.06 2.55 -0.01 1.44 0.00 -1.26 -0.47 121.76 124.07 1axj s ALA 118 Ca -0.01 -1.02 0.00 0.00 0.00 0.00 0.00 51.96 50.93 1axj s ALA 118 Cb -0.03 -0.87 0.01 0.00 0.00 0.00 0.00 23.12 22.23 1axj s ALA 118 CO 0.01 0.55 0.00 -1.83 0.00 0.00 0.00 175.76 174.49 1axj s GLU 119 N -0.72 0.07 0.29 0.00 1.03 -0.19 -4.89 118.70 114.28 1axj s GLU 119 Ca 0.11 0.04 -0.29 0.00 0.03 0.00 0.00 54.97 54.86 1axj s GLU 119 Cb -0.10 -0.16 -0.09 0.00 -0.80 0.00 0.00 34.13 32.97 1axj s GLU 119 CO 0.00 -0.05 1.05 -1.14 -1.33 0.00 0.00 175.26 173.80 1axj s GLN 120 N 0.38 4.64 0.00 -4.83 0.74 -1.26 -0.72 119.66 118.60 1axj s GLN 120 Ca -0.03 1.68 0.00 0.00 0.05 0.00 0.00 55.36 57.06 1axj s GLN 120 Cb -0.05 -3.12 0.00 0.00 1.10 0.00 0.00 33.01 30.93 1axj s GLN 120 CO -0.01 0.25 0.00 0.25 -0.55 0.00 0.00 175.29 175.23 1axj n THR 121 N 1.10 0.00 1.96 -0.34 -2.24 -0.37 -4.84 114.28 109.55 1axj n THR 121 Ca -0.01 0.00 0.16 0.00 -2.27 0.00 0.00 64.05 61.93 1axj n THR 121 Cb 0.46 -0.09 0.92 0.00 -2.10 0.00 0.00 70.33 69.52 1axj n THR 121 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50