#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 2.46 0.71 4.03 1.02 -1.26 -4.07 118.68 121.56 1axj s LEU 2 Ca 0.00 -0.91 -0.14 0.00 0.02 0.00 0.00 54.13 53.10 1axj s LEU 2 Cb 0.00 -0.10 0.03 0.00 0.02 0.00 0.00 46.19 46.14 1axj s LEU 2 CO 0.00 -0.41 1.14 -2.16 0.02 0.00 0.00 176.35 174.94 1axj s PRO 3 N -3.34 2.42 0.29 1.29 0.04 -1.26 -4.94 135.00 129.49 1axj s PRO 3 Ca 0.07 1.47 -0.02 0.00 0.04 0.00 0.00 61.00 62.56 1axj s PRO 3 Cb 0.02 -1.90 0.43 0.00 0.04 0.00 0.00 34.50 33.10 1axj s PRO 3 CO -0.04 -1.56 1.94 0.78 0.04 0.00 0.00 177.00 178.16 1axj h GLY 4 N -0.35 1.29 0.35 0.56 0.00 -2.01 -2.07 103.07 100.85 1axj h GLY 4 Ca -0.46 -0.45 0.16 0.00 0.00 0.00 0.00 47.33 46.57 1axj h GLY 4 CO 0.52 0.40 0.61 -0.84 0.00 0.00 0.00 176.54 177.22 1axj h THR 5 N 1.14 0.81 -0.18 4.70 2.02 -1.99 -0.51 112.91 118.90 1axj h THR 5 Ca 0.35 -0.28 0.05 0.00 0.77 0.00 0.00 66.41 67.31 1axj h THR 5 Cb -0.00 -0.07 -0.07 0.00 -1.74 0.00 0.00 68.15 66.27 1axj h THR 5 CO -0.10 0.15 -0.29 0.15 0.37 0.00 0.00 175.52 175.80 1axj h PHE 6 N 0.81 -0.78 -0.31 3.16 3.57 -1.74 -0.39 116.94 121.25 1axj h PHE 6 Ca 0.51 0.04 0.04 0.00 3.53 0.00 0.00 57.97 62.09 1axj h PHE 6 Cb 0.73 0.37 -0.04 0.00 2.79 0.00 0.00 35.95 39.80 1axj h PHE 6 CO -0.00 -0.36 0.08 0.74 -2.23 0.00 0.00 178.31 176.53 1axj h PHE 7 N -0.33 0.13 -0.59 0.41 -1.00 -1.22 -1.04 116.94 113.30 1axj h PHE 7 Ca 0.11 0.02 0.04 0.00 2.81 0.00 0.00 57.97 60.95 1axj h PHE 7 Cb 0.51 -0.01 -0.03 0.00 3.61 0.00 0.00 35.95 40.02 1axj h PHE 7 CO -0.40 0.04 0.39 0.93 -1.61 0.00 0.00 178.31 177.66 1axj h GLU 8 N 0.20 0.65 -0.28 1.51 4.39 -0.92 0.63 114.58 120.75 1axj h GLU 8 Ca 0.14 -0.04 -0.10 0.00 0.34 0.00 0.00 59.36 59.71 1axj h GLU 8 Cb 0.14 -0.15 -0.01 0.00 -0.10 0.00 0.00 28.75 28.64 1axj h GLU 8 CO -0.17 0.43 -0.21 0.28 -1.16 0.00 0.00 179.01 178.18 1axj h VAL 9 N 0.67 1.30 -0.75 3.13 2.07 -0.21 -3.07 116.25 119.39 1axj h VAL 9 Ca 0.24 -1.35 0.07 0.00 0.82 0.00 0.00 66.70 66.49 1axj h VAL 9 Cb 0.13 1.56 -0.06 0.00 -1.52 0.00 0.00 31.29 31.40 1axj h VAL 9 CO -0.07 0.43 0.42 -0.07 0.02 0.00 0.00 177.57 178.30 1axj h LEU 10 N 0.37 0.61 -1.83 2.57 -0.00 -0.33 -0.64 115.31 116.07 1axj h LEU 10 Ca 0.05 0.04 0.03 0.00 -0.00 0.00 0.00 57.88 58.00 1axj h LEU 10 Cb 0.75 -0.08 -0.00 0.00 -0.00 0.00 0.00 40.66 41.33 1axj h LEU 10 CO 0.06 0.38 0.42 0.11 -0.00 0.00 0.00 178.44 179.40 1axj h LYS 11 N 0.74 0.00 -5.94 1.13 1.57 -0.82 -3.43 116.57 109.82 1axj h LYS 11 Ca 0.34 0.00 -0.56 0.00 -1.87 0.00 0.00 60.65 58.56 1axj h LYS 11 Cb 0.26 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 32.51 1axj h LYS 11 CO -0.21 0.00 -0.39 -0.80 -0.57 0.00 0.00 179.45 177.48 1axj s ASN 12 N -4.49 4.64 0.06 0.86 0.01 -0.25 -5.10 114.94 110.68 1axj s ASN 12 Ca -0.03 -1.10 -0.31 0.00 -0.71 0.00 0.00 52.86 50.71 1axj s ASN 12 Cb 0.10 -0.07 -0.06 0.00 0.41 0.00 0.00 41.25 41.63 1axj s ASN 12 CO 0.32 -0.82 1.24 -0.70 -1.51 0.00 0.00 177.10 175.62 1axj s GLU 13 N -4.12 4.40 0.20 -0.60 2.12 -1.26 -4.73 118.70 114.72 1axj s GLU 13 Ca 0.38 1.82 -0.22 0.00 0.36 0.00 0.00 54.97 57.30 1axj s GLU 13 Cb -0.00 -3.36 0.05 0.00 0.26 0.00 0.00 34.13 31.08 1axj s GLU 13 CO 0.22 -0.31 0.67 0.20 -0.54 0.00 0.00 175.26 175.50 1axj s GLY 14 N 1.14 -0.39 -0.02 -1.50 0.00 -1.26 -4.28 107.32 101.01 1axj s GLY 14 Ca 0.60 0.18 -0.03 0.00 0.00 0.00 0.00 44.72 45.46 1axj s GLY 14 CO 0.29 0.06 0.17 0.14 0.00 0.00 0.00 173.10 173.76 1axj s VAL 15 N -3.78 5.36 0.23 1.40 1.01 -0.47 -1.15 120.40 122.99 1axj s VAL 15 Ca 0.05 -0.15 0.04 0.00 0.00 0.00 0.00 61.98 61.92 1axj s VAL 15 Cb -0.03 -3.49 -0.05 0.00 0.00 0.00 0.00 36.38 32.81 1axj s VAL 15 CO -0.04 0.35 -0.02 -0.69 0.00 0.00 0.00 175.10 174.70 1axj s VAL 16 N -1.28 1.12 0.11 2.92 1.01 0.38 -0.85 120.40 123.81 1axj s VAL 16 Ca 0.26 -2.05 -0.12 0.00 0.00 0.00 0.00 61.98 60.07 1axj s VAL 16 Cb -0.12 -2.31 0.01 0.00 0.00 0.00 0.00 36.38 33.96 1axj s VAL 16 CO 0.17 -0.36 0.29 0.00 0.00 0.00 0.00 175.10 175.19 1axj s ALA 17 N -3.36 -0.50 -0.06 5.51 0.00 0.42 -0.85 121.76 122.91 1axj s ALA 17 Ca 0.27 -0.40 -0.02 0.00 0.00 0.00 0.00 51.96 51.81 1axj s ALA 17 Cb 0.05 0.60 0.03 0.00 0.00 0.00 0.00 23.12 23.80 1axj s ALA 17 CO 0.08 -0.58 0.05 0.42 0.00 0.00 0.00 175.76 175.73 1axj s ILE 18 N -3.85 0.03 -0.47 0.00 1.01 -0.35 -1.32 121.20 116.25 1axj s ILE 18 Ca 0.05 0.31 -0.23 0.00 0.00 0.00 0.00 60.65 60.78 1axj s ILE 18 Cb 0.03 -0.28 0.03 0.00 0.01 0.00 0.00 42.46 42.26 1axj s ILE 18 CO -0.11 0.18 0.80 0.00 0.00 0.00 0.00 174.94 175.82 1axj s ALA 19 N 2.11 3.27 -0.36 9.38 0.00 0.22 -1.29 121.76 135.10 1axj s ALA 19 Ca 0.05 -1.10 -0.18 0.00 0.00 0.00 0.00 51.96 50.73 1axj s ALA 19 Cb -0.12 -3.52 -0.00 0.00 0.00 0.00 0.00 23.12 19.48 1axj s ALA 19 CO -0.04 -2.02 0.51 0.99 0.00 0.00 0.00 175.76 175.20 1axj s THR 20 N 3.37 5.02 0.06 0.00 2.01 -0.34 -1.11 115.64 124.65 1axj s THR 20 Ca 0.29 0.28 -0.31 0.00 0.31 0.00 0.00 61.69 62.27 1axj s THR 20 Cb -0.13 -3.97 -0.06 0.00 0.01 0.00 0.00 72.50 68.35 1axj s THR 20 CO 0.21 -0.24 1.24 -1.58 -0.69 0.00 0.00 174.62 173.57 1axj s GLN 21 N 2.38 4.40 0.00 4.92 2.00 -0.64 -0.51 119.66 132.21 1axj s GLN 21 Ca 0.18 1.82 0.00 0.00 -2.00 0.00 0.00 55.36 55.36 1axj s GLN 21 Cb -0.15 -3.36 0.00 0.00 0.80 0.00 0.00 33.01 30.30 1axj s GLN 21 CO 0.13 -0.32 0.00 0.41 -0.50 0.00 0.00 175.29 175.02 1axj n GLY 22 N 3.30 0.01 1.74 2.59 0.00 -1.26 -3.96 105.19 107.61 1axj n GLY 22 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.12 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 -1.51 0.00 -0.38 1.61 4.07 -1.26 -4.74 120.64 118.43 1axj n GLU 23 Ca 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.10 1axj n GLU 23 Cb 0.00 -0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.38 1axj n GLU 23 CO 0.00 0.00 0.00 -0.40 -0.06 0.00 0.00 177.13 176.67 1axj n ASP 24 N -2.37 4.59 -0.13 4.31 5.75 -1.26 -4.88 116.55 122.56 1axj n ASP 24 Ca 0.00 -2.24 0.00 0.00 -0.01 0.00 0.00 54.79 52.55 1axj n ASP 24 Cb 0.00 -0.95 -0.00 0.00 -1.03 0.00 0.00 41.12 39.14 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 1.34 -2.85 3.65 6.12 0.00 -1.26 -4.79 105.19 107.40 1axj n GLY 25 Ca 0.00 -1.30 -0.38 0.00 0.00 0.00 0.00 46.02 44.34 1axj n GLY 25 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1axj n PRO 26 N -1.74 1.20 -3.72 1.61 -0.04 -1.26 -4.31 135.00 126.74 1axj n PRO 26 Ca -0.00 0.45 -0.37 0.00 -0.04 0.00 0.00 63.50 63.53 1axj n PRO 26 Cb 0.05 -2.27 -0.11 0.00 -0.04 0.00 0.00 33.50 31.12 1axj n PRO 26 CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 1axj s HIS 27 N -1.41 3.50 -1.02 0.54 2.46 0.33 -4.62 115.29 115.08 1axj s HIS 27 Ca 0.73 -2.16 -0.23 0.00 0.47 0.00 0.00 55.06 53.87 1axj s HIS 27 Cb -0.44 -3.16 0.02 0.00 -0.13 0.00 0.00 32.58 28.88 1axj s HIS 27 CO 0.49 -0.95 1.62 -1.17 -2.47 0.00 0.00 174.74 172.26 1axj s LEU 28 N 1.23 3.43 0.63 8.88 2.96 -1.25 -1.19 118.68 133.37 1axj s LEU 28 Ca 0.06 -1.35 -0.04 0.00 -0.22 0.00 0.00 54.13 52.57 1axj s LEU 28 Cb -0.23 -2.57 0.04 0.00 0.50 0.00 0.00 46.19 43.93 1axj s LEU 28 CO -0.03 -1.85 0.92 0.68 -1.32 0.00 0.00 176.35 174.75 1axj s VAL 29 N 6.43 2.68 0.37 1.68 -7.23 -0.41 -4.83 120.40 119.10 1axj s VAL 29 Ca 0.54 -0.34 0.09 0.00 -1.81 0.00 0.00 61.98 60.46 1axj s VAL 29 Cb -0.01 -3.10 -0.07 0.00 0.56 0.00 0.00 36.38 33.76 1axj s VAL 29 CO -0.05 -0.09 -0.04 0.20 -0.31 0.00 0.00 175.10 174.81 1axj s ASN 30 N -4.44 3.87 0.13 4.85 0.02 -1.26 -1.22 114.94 116.89 1axj s ASN 30 Ca 0.58 -1.21 -0.25 0.00 -1.02 0.00 0.00 52.86 50.95 1axj s ASN 30 Cb -0.11 -0.40 0.08 0.00 0.02 0.00 0.00 41.25 40.84 1axj s ASN 30 CO 0.43 -0.30 1.03 0.28 0.02 0.00 0.00 177.10 178.56 1axj s THR 31 N -2.63 0.00 0.01 1.60 -1.32 -0.03 -4.91 115.64 108.36 1axj s THR 31 Ca 0.34 -0.58 0.08 0.00 -1.21 0.00 0.00 61.69 60.32 1axj s THR 31 Cb 0.04 -2.16 -0.02 0.00 -1.51 0.00 0.00 72.50 68.85 1axj s THR 31 CO 0.18 0.00 -0.25 0.26 -2.21 0.00 0.00 174.62 172.60 1axj s TRP 32 N -2.94 2.19 0.50 9.09 0.52 -1.26 -0.47 118.94 126.58 1axj s TRP 32 Ca 0.14 -0.41 0.24 0.00 0.02 0.00 0.00 56.10 56.10 1axj s TRP 32 Cb -0.01 -1.37 1.32 0.00 -1.15 0.00 0.00 33.47 32.27 1axj s TRP 32 CO 0.02 0.03 1.95 -0.91 0.02 0.00 0.00 176.95 178.06 1axj h ASN 33 N 5.23 0.10 0.00 2.95 2.35 -1.42 -0.80 115.58 123.99 1axj h ASN 33 Ca -0.43 0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.32 1axj h ASN 33 Cb 1.13 -0.01 0.00 0.00 0.05 0.00 0.00 38.32 39.49 1axj h ASN 33 CO 0.46 0.05 0.02 -0.24 -1.65 0.00 0.00 177.43 176.07 1axj n SER 34 N -4.38 0.28 -0.07 5.81 2.88 -1.26 -1.69 113.62 115.18 1axj n SER 34 Ca 0.13 0.62 0.01 0.00 -1.33 0.00 0.00 58.87 58.30 1axj n SER 34 Cb 0.67 -0.65 0.00 0.00 -0.75 0.00 0.00 64.21 63.48 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 -1.87 0.00 -3.32 0.66 4.01 -0.31 -5.03 117.16 111.30 1axj n TYR 35 Ca -0.01 0.00 -0.19 0.00 -0.16 0.00 0.00 57.90 57.55 1axj n TYR 35 Cb 0.04 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.07 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 -0.74 3.87 -0.04 7.72 1.43 -0.68 -4.29 118.68 125.96 1axj s LEU 36 Ca 0.02 -0.21 0.00 0.00 -1.03 0.00 0.00 54.13 52.92 1axj s LEU 36 Cb 0.02 -2.76 0.03 0.00 0.03 0.00 0.00 46.19 43.51 1axj s LEU 36 CO 0.05 -0.54 -0.01 -1.59 0.23 0.00 0.00 176.35 174.49 1axj s LYS 37 N -4.25 0.45 -0.09 1.70 0.00 -0.71 -5.01 119.74 111.84 1axj s LYS 37 Ca 0.48 0.04 -0.05 0.00 0.00 0.00 0.00 55.97 56.43 1axj s LYS 37 Cb -0.10 -0.61 -0.04 0.00 0.00 0.00 0.00 37.83 37.08 1axj s LYS 37 CO 0.32 -0.14 0.12 0.08 0.00 0.00 0.00 175.35 175.73 1axj s VAL 38 N 1.08 5.23 0.40 1.79 1.01 -1.26 -0.64 120.40 128.02 1axj s VAL 38 Ca -0.09 0.02 0.01 0.00 0.00 0.00 0.00 61.98 61.92 1axj s VAL 38 Cb -0.14 -3.30 -0.00 0.00 0.00 0.00 0.00 36.38 32.94 1axj s VAL 38 CO -0.01 0.55 0.02 0.18 0.00 0.00 0.00 175.10 175.84 1axj n LEU 39 N 1.78 0.00 -4.67 3.92 4.32 0.30 -5.00 117.00 117.64 1axj n LEU 39 Ca -0.18 -2.62 -0.30 0.00 -0.02 0.00 0.00 56.01 52.90 1axj n LEU 39 Cb 0.54 0.40 0.21 0.00 -1.62 0.00 0.00 43.42 42.95 1axj n LEU 39 CO 0.33 -0.38 0.66 -0.62 -1.22 0.00 0.00 177.39 176.17 1axj s ASP 40 N -3.26 1.80 -0.96 -1.43 2.15 -1.26 -3.83 116.67 109.88 1axj s ASP 40 Ca 0.03 0.74 0.00 0.00 0.43 0.00 0.00 52.55 53.75 1axj s ASP 40 Cb 0.00 -1.09 0.00 0.00 -0.30 0.00 0.00 42.92 41.53 1axj s ASP 40 CO 0.02 -3.59 0.00 0.61 -0.17 0.00 0.00 175.17 172.04 1axj n GLY 41 N -1.44 -0.22 2.26 2.66 0.00 -1.26 -1.78 105.19 105.41 1axj n GLY 41 Ca 0.11 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.99 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 -1.49 -4.00 -4.70 1.61 2.04 -1.25 -4.89 115.26 102.59 1axj n ASN 42 Ca -0.12 0.25 -0.42 0.00 -0.44 0.00 0.00 54.58 53.84 1axj n ASN 42 Cb 0.55 -3.52 -0.03 0.00 -2.53 0.00 0.00 39.78 34.25 1axj n ASN 42 CO 0.00 0.00 0.00 -0.60 -0.44 0.00 0.00 177.26 176.22 1axj s ARG 43 N -4.15 4.36 0.34 -3.83 3.52 -0.74 -3.79 118.95 114.66 1axj s ARG 43 Ca 0.00 1.79 0.09 0.00 -0.13 0.00 0.00 55.73 57.48 1axj s ARG 43 Cb 0.00 -3.49 -0.05 0.00 -1.56 0.00 0.00 34.95 29.85 1axj s ARG 43 CO 0.00 -0.43 0.04 0.42 -0.81 0.00 0.00 175.30 174.53 1axj s ILE 44 N 1.90 2.73 -0.08 4.11 -1.09 -0.02 -0.54 121.20 128.21 1axj s ILE 44 Ca 0.59 -1.90 -0.13 0.00 -2.23 0.00 0.00 60.65 56.98 1axj s ILE 44 Cb -0.28 -2.84 0.03 0.00 -1.58 0.00 0.00 42.46 37.78 1axj s ILE 44 CO 0.25 -0.20 0.32 -0.69 -1.23 0.00 0.00 174.94 173.39 1axj s VAL 45 N -2.50 0.02 -0.02 2.92 1.01 0.19 -0.35 120.40 121.68 1axj s VAL 45 Ca 0.35 -0.21 0.03 0.00 0.00 0.00 0.00 61.98 62.16 1axj s VAL 45 Cb -0.01 -0.52 -0.00 0.00 0.00 0.00 0.00 36.38 35.85 1axj s VAL 45 CO 0.20 -0.11 -0.11 -0.69 0.00 0.00 0.00 175.10 174.38 1axj s VAL 46 N -0.46 0.94 -0.42 2.92 1.01 -0.28 -1.74 120.40 122.36 1axj s VAL 46 Ca -0.06 -0.47 -0.29 0.00 0.00 0.00 0.00 61.98 61.17 1axj s VAL 46 Cb -0.04 -0.81 0.02 0.00 0.00 0.00 0.00 36.38 35.56 1axj s VAL 46 CO 0.02 0.28 1.10 -2.16 0.00 0.00 0.00 175.10 174.33 1axj s PRO 47 N -0.02 3.83 -0.41 2.72 0.04 -1.26 -0.43 135.00 139.47 1axj s PRO 47 Ca -0.00 0.71 -0.25 0.00 0.04 0.00 0.00 61.00 61.50 1axj s PRO 47 Cb -0.07 -3.85 0.02 0.00 0.04 0.00 0.00 34.50 30.64 1axj s PRO 47 CO 0.00 -1.20 0.89 0.54 0.04 0.00 0.00 177.00 177.27 1axj s VAL 48 N 4.11 4.58 -0.01 -0.36 0.11 -0.59 -4.85 120.40 123.39 1axj s VAL 48 Ca 0.46 0.91 0.05 0.00 -2.93 0.00 0.00 61.98 60.47 1axj s VAL 48 Cb -0.09 -4.35 -0.08 0.00 -1.53 0.00 0.00 36.38 30.33 1axj s VAL 48 CO 0.26 -0.64 0.10 0.61 -3.33 0.00 0.00 175.10 172.10 1axj n GLY 49 N 4.66 -0.24 2.51 6.54 0.00 -1.26 -0.07 105.19 117.33 1axj n GLY 49 Ca 0.06 -0.12 -0.02 0.00 0.00 0.00 0.00 46.02 45.94 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 2.25 1.73 2.71 -0.02 0.00 -1.26 -4.74 105.19 105.87 1axj n GLY 50 Ca -0.02 -0.15 -0.34 0.00 0.00 0.00 0.00 46.02 45.52 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 -1.37 3.20 0.17 1.61 2.81 -1.26 -4.96 117.12 117.32 1axj n MET 51 Ca -0.17 -4.61 -0.14 0.00 -1.81 0.00 0.00 57.70 50.97 1axj n MET 51 Cb 0.84 -2.36 -0.08 0.00 -0.71 0.00 0.00 33.22 30.90 1axj n MET 51 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 1axj h HIS 52 N 4.84 -0.39 -0.92 2.03 3.86 -2.00 -1.08 115.15 121.50 1axj h HIS 52 Ca 0.19 -0.01 0.16 0.00 -1.16 0.00 0.00 60.37 59.56 1axj h HIS 52 Cb 0.66 0.13 -0.10 0.00 1.06 0.00 0.00 27.41 29.16 1axj h HIS 52 CO 0.82 -0.12 0.51 -0.22 0.86 0.00 0.00 177.93 179.78 1axj h LYS 53 N -0.61 0.68 -0.80 2.45 3.64 -1.99 -1.23 116.57 118.70 1axj h LYS 53 Ca -0.04 -0.04 -0.03 0.00 -1.27 0.00 0.00 60.65 59.26 1axj h LYS 53 Cb 0.44 -0.15 -0.04 0.00 -0.41 0.00 0.00 32.23 32.07 1axj h LYS 53 CO 0.07 0.45 0.38 1.15 -2.27 0.00 0.00 179.45 179.23 1axj h THR 54 N 0.70 1.25 -0.15 1.00 2.02 -1.86 0.40 112.91 116.27 1axj h THR 54 Ca 0.51 -0.72 0.04 0.00 0.77 0.00 0.00 66.41 67.01 1axj h THR 54 Cb 0.74 0.23 -0.04 0.00 -1.74 0.00 0.00 68.15 67.34 1axj h THR 54 CO -0.37 0.30 -0.08 -0.08 0.37 0.00 0.00 175.52 175.67 1axj h GLU 55 N 1.15 -0.06 -0.67 6.66 4.81 -0.06 0.26 114.58 126.66 1axj h GLU 55 Ca 0.28 0.00 -0.05 0.00 -0.13 0.00 0.00 59.36 59.46 1axj h GLU 55 Cb 0.13 0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.49 1axj h GLU 55 CO -0.03 -0.04 0.22 0.00 -0.73 0.00 0.00 179.01 178.43 1axj h ALA 56 N 1.07 0.88 -0.43 2.92 0.00 -0.89 -1.90 119.26 120.91 1axj h ALA 56 Ca 0.09 -0.21 -0.10 0.00 0.00 0.00 0.00 54.91 54.69 1axj h ALA 56 Cb 0.19 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 1axj h ALA 56 CO -0.19 0.54 -0.13 -0.91 0.00 0.00 0.00 179.25 178.56 1axj h ASN 57 N 0.98 0.86 -0.14 0.00 4.21 0.21 0.13 115.58 121.83 1axj h ASN 57 Ca 0.22 -0.37 -0.01 0.00 1.21 0.00 0.00 56.30 57.34 1axj h ASN 57 Cb 0.28 -0.24 -0.01 0.00 -1.12 0.00 0.00 38.32 37.24 1axj h ASN 57 CO -0.01 1.04 0.03 0.58 -1.29 0.00 0.00 177.43 177.78 1axj h VAL 58 N 0.68 1.20 -0.16 2.81 2.07 -0.95 0.74 116.25 122.64 1axj h VAL 58 Ca 0.11 -0.62 0.05 0.00 0.82 0.00 0.00 66.70 67.06 1axj h VAL 58 Cb 0.67 1.34 -0.01 0.00 -1.52 0.00 0.00 31.29 31.78 1axj h VAL 58 CO 0.05 0.18 0.25 0.00 0.02 0.00 0.00 177.57 178.07 1axj h ALA 59 N 0.84 1.66 0.06 1.67 0.00 -0.89 -2.90 119.26 119.70 1axj h ALA 59 Ca 0.04 -0.01 -0.17 0.00 0.00 0.00 0.00 54.91 54.77 1axj h ALA 59 Cb 0.25 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.05 1axj h ALA 59 CO 0.00 -0.33 -0.88 0.00 0.00 0.00 0.00 179.25 178.04 1axj h ARG 60 N 0.00 0.14 -2.78 0.00 2.47 0.25 -3.49 114.38 110.97 1axj h ARG 60 Ca 0.08 -0.23 -0.12 0.00 -1.26 0.00 0.00 59.98 58.44 1axj h ARG 60 Cb 0.57 0.09 -0.24 0.00 -1.65 0.00 0.00 29.97 28.74 1axj h ARG 60 CO -0.00 1.11 -0.24 0.34 0.56 0.00 0.00 179.97 181.74 1axj s ASP 61 N -6.76 -0.40 0.39 7.04 2.15 0.16 -5.03 116.67 114.21 1axj s ASP 61 Ca -0.20 0.75 0.21 0.00 0.43 0.00 0.00 52.55 53.74 1axj s ASP 61 Cb 0.02 0.78 0.55 0.00 -0.30 0.00 0.00 42.92 43.96 1axj s ASP 61 CO 0.72 -0.17 1.67 1.05 -0.17 0.00 0.00 175.17 178.27 1axj h GLU 62 N 5.35 0.00 -6.41 4.34 4.11 -1.83 -3.35 114.58 116.78 1axj h GLU 62 Ca -0.27 0.00 -0.53 0.00 0.07 0.00 0.00 59.36 58.63 1axj h GLU 62 Cb 1.18 0.00 0.02 0.00 0.50 0.00 0.00 28.75 30.46 1axj h GLU 62 CO 0.27 0.27 1.15 1.03 0.07 0.00 0.00 179.01 181.80 1axj s ARG 63 N -3.34 4.15 0.05 1.06 3.00 -1.26 -0.79 118.95 121.82 1axj s ARG 63 Ca 0.03 2.54 -0.00 0.00 0.00 0.00 0.00 55.73 58.30 1axj s ARG 63 Cb 0.08 -3.88 -0.03 0.00 0.00 0.00 0.00 34.95 31.12 1axj s ARG 63 CO 0.68 -0.88 -0.04 0.14 0.00 0.00 0.00 175.30 175.20 1axj s VAL 64 N 3.61 0.26 0.16 3.52 -7.23 -0.61 -1.62 120.40 118.49 1axj s VAL 64 Ca 0.83 -1.47 0.05 0.00 -1.81 0.00 0.00 61.98 59.58 1axj s VAL 64 Cb -0.43 -1.06 -0.04 0.00 0.56 0.00 0.00 36.38 35.42 1axj s VAL 64 CO 0.38 -0.78 0.10 -0.22 -0.31 0.00 0.00 175.10 174.27 1axj s LEU 65 N -2.35 3.69 -0.01 1.32 2.96 -0.27 -1.67 118.68 122.35 1axj s LEU 65 Ca -0.01 -0.18 0.00 0.00 -0.22 0.00 0.00 54.13 53.72 1axj s LEU 65 Cb 0.00 -2.32 0.01 0.00 0.50 0.00 0.00 46.19 44.39 1axj s LEU 65 CO -0.06 0.08 -0.01 -0.32 -1.32 0.00 0.00 176.35 174.73 1axj s MET 66 N -3.02 0.13 -0.06 1.98 -2.45 -0.23 -0.61 119.30 115.04 1axj s MET 66 Ca 0.30 -0.01 0.02 0.00 -1.25 0.00 0.00 55.69 54.75 1axj s MET 66 Cb -0.10 -0.18 0.02 0.00 1.25 0.00 0.00 34.83 35.81 1axj s MET 66 CO 0.22 -0.02 -0.09 0.95 1.05 0.00 0.00 175.02 177.14 1axj s THR 67 N 0.25 0.88 0.45 10.11 -4.23 -0.43 -0.23 115.64 122.44 1axj s THR 67 Ca -0.02 -0.32 0.05 0.00 -1.18 0.00 0.00 61.69 60.23 1axj s THR 67 Cb -0.04 -0.84 -0.04 0.00 1.34 0.00 0.00 72.50 72.93 1axj s THR 67 CO -0.01 0.30 0.12 -1.48 -0.54 0.00 0.00 174.62 173.02 1axj s LEU 68 N 0.84 2.79 0.04 4.79 0.05 -0.59 -0.44 118.68 126.17 1axj s LEU 68 Ca -0.12 -1.32 -0.27 0.00 0.05 0.00 0.00 54.13 52.47 1axj s LEU 68 Cb -0.15 -1.09 0.09 0.00 -2.05 0.00 0.00 46.19 42.99 1axj s LEU 68 CO 0.01 -0.68 1.21 -0.83 -0.55 0.00 0.00 176.35 175.52 1axj s GLY 69 N -3.90 -0.08 0.19 -3.48 0.00 -0.03 -0.74 107.32 99.27 1axj s GLY 69 Ca 0.30 -0.02 -0.13 0.00 0.00 0.00 0.00 44.72 44.88 1axj s GLY 69 CO 0.16 4.25 0.40 -0.45 0.00 0.00 0.00 173.10 177.46 1axj s SER 70 N -3.62 -0.09 -0.01 1.64 0.15 -0.60 -1.37 113.70 109.80 1axj s SER 70 Ca 0.26 -0.73 0.22 0.00 0.70 0.00 0.00 55.95 56.39 1axj s SER 70 Cb -0.01 0.51 -0.29 0.00 -1.71 0.00 0.00 66.02 64.52 1axj s SER 70 CO 0.01 -0.98 0.52 0.54 1.20 0.00 0.00 173.24 174.53 1axj n ARG 71 N -0.28 0.66 0.00 5.44 5.12 -1.26 -3.35 116.66 122.99 1axj n ARG 71 Ca -0.08 -0.15 0.12 0.00 -1.93 0.00 0.00 57.85 55.82 1axj n ARG 71 Cb 0.63 -1.56 0.29 0.00 -1.16 0.00 0.00 32.46 30.65 1axj n ARG 71 CO 0.00 0.00 0.00 1.63 -1.93 0.00 0.00 177.63 177.33 1axj n LYS 72 N -2.35 0.68 -5.04 5.56 5.02 -1.26 -4.61 118.16 116.15 1axj n LYS 72 Ca -0.05 -0.43 -0.30 0.00 -2.02 0.00 0.00 58.31 55.51 1axj n LYS 72 Cb 0.61 -1.49 -0.17 0.00 -0.02 0.00 0.00 35.03 33.96 1axj n LYS 72 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1axj s VAL 73 N -2.62 1.78 0.05 -0.18 1.01 -1.26 -5.02 120.40 114.16 1axj s VAL 73 Ca 0.20 -0.87 -0.30 0.00 0.00 0.00 0.00 61.98 61.01 1axj s VAL 73 Cb 0.19 -1.55 -0.04 0.00 0.00 0.00 0.00 36.38 34.98 1axj s VAL 73 CO 0.58 0.50 1.02 0.00 0.00 0.00 0.00 175.10 177.19 1axj s ALA 74 N 0.30 3.23 0.00 5.51 0.00 -1.26 -0.89 121.76 128.64 1axj s ALA 74 Ca -0.14 0.61 0.00 0.00 0.00 0.00 0.00 51.96 52.43 1axj s ALA 74 Cb -0.16 -3.34 0.00 0.00 0.00 0.00 0.00 23.12 19.62 1axj s ALA 74 CO 0.06 -0.21 0.00 0.41 0.00 0.00 0.00 175.76 176.02 1axj n GLY 75 N 2.73 2.43 0.07 0.00 0.00 -1.09 -4.55 105.19 104.78 1axj n GLY 75 Ca 0.05 -1.75 -0.04 0.00 0.00 0.00 0.00 46.02 44.28 1axj n GLY 75 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1axj h ARG 76 N 0.00 0.00 -6.17 1.61 3.08 -1.20 -3.44 114.38 108.27 1axj h ARG 76 Ca 0.00 0.00 -0.57 0.00 0.07 0.00 0.00 59.98 59.48 1axj h ARG 76 Cb 0.00 0.00 -0.10 0.00 0.08 0.00 0.00 29.97 29.95 1axj h ARG 76 CO 0.00 0.11 0.85 0.54 -1.07 0.00 0.00 179.97 180.41 1axj s ASN 77 N -5.76 6.28 0.36 7.04 6.03 -1.16 -4.91 114.94 122.81 1axj s ASN 77 Ca -0.10 -0.37 0.00 0.00 -1.03 0.00 0.00 52.86 51.36 1axj s ASN 77 Cb 0.01 -2.51 0.00 0.00 -3.03 0.00 0.00 41.25 35.72 1axj s ASN 77 CO 0.18 -1.55 0.00 0.61 -2.03 0.00 0.00 177.10 174.31 1axj n GLY 78 N 5.23 -1.44 3.58 0.45 0.00 -1.26 -4.20 105.19 107.55 1axj n GLY 78 Ca 0.03 -0.93 -0.40 0.00 0.00 0.00 0.00 46.02 44.72 1axj n GLY 78 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1axj s PRO 79 N -1.72 3.66 0.00 1.61 0.04 -1.26 -2.66 135.00 134.67 1axj s PRO 79 Ca 0.00 -1.71 0.00 0.00 0.04 0.00 0.00 61.00 59.33 1axj s PRO 79 Cb 0.00 -5.46 0.00 0.00 0.04 0.00 0.00 34.50 29.08 1axj s PRO 79 CO 0.00 -2.55 0.00 0.41 0.04 0.00 0.00 177.00 174.90 1axj n GLY 80 N 5.70 -0.79 4.00 0.56 0.00 -0.96 -4.76 105.19 108.95 1axj n GLY 80 Ca 0.46 0.90 -0.18 0.00 0.00 0.00 0.00 46.02 47.19 1axj n GLY 80 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1axj s THR 81 N 0.00 3.11 0.15 2.61 -1.32 -0.07 -4.07 115.64 116.05 1axj s THR 81 Ca 0.00 -0.93 -0.16 0.00 -1.21 0.00 0.00 61.69 59.39 1axj s THR 81 Cb 0.00 -3.07 0.03 0.00 -1.51 0.00 0.00 72.50 67.95 1axj s THR 81 CO 0.00 -0.03 0.42 -0.83 -2.21 0.00 0.00 174.62 171.97 1axj s GLY 82 N -4.34 -0.15 0.02 6.08 0.00 -1.26 -1.56 107.32 106.12 1axj s GLY 82 Ca 0.54 -0.18 0.03 0.00 0.00 0.00 0.00 44.72 45.10 1axj s GLY 82 CO 0.34 -0.35 -0.08 -1.36 0.00 0.00 0.00 173.10 171.65 1axj s PHE 83 N -3.84 0.71 -0.18 1.90 0.40 0.08 -1.06 117.98 116.00 1axj s PHE 83 Ca 0.06 -0.32 -0.09 0.00 -0.60 0.00 0.00 56.93 55.98 1axj s PHE 83 Cb 0.01 -0.44 -0.05 0.00 0.51 0.00 0.00 43.02 43.06 1axj s PHE 83 CO -0.08 -0.03 0.11 -1.17 0.70 0.00 0.00 175.22 174.75 1axj s LEU 84 N -0.95 4.13 0.03 -0.37 2.96 -0.44 -1.54 118.68 122.49 1axj s LEU 84 Ca -0.03 0.23 -0.01 0.00 -0.22 0.00 0.00 54.13 54.10 1axj s LEU 84 Cb -0.07 -2.05 -0.02 0.00 0.50 0.00 0.00 46.19 44.55 1axj s LEU 84 CO 0.00 0.21 -0.02 -0.63 -1.32 0.00 0.00 176.35 174.60 1axj s ILE 85 N 0.15 0.13 0.05 6.68 1.01 0.68 -0.73 121.20 129.17 1axj s ILE 85 Ca 0.08 -1.11 0.04 0.00 0.00 0.00 0.00 60.65 59.66 1axj s ILE 85 Cb -0.11 -0.57 -0.02 0.00 0.01 0.00 0.00 42.46 41.76 1axj s ILE 85 CO -0.01 -0.61 -0.11 -0.13 0.00 0.00 0.00 174.94 174.08 1axj s ARG 86 N -2.05 0.70 0.00 2.79 3.00 -0.35 -1.07 118.95 121.97 1axj s ARG 86 Ca -0.10 -0.78 0.00 0.00 0.00 0.00 0.00 55.73 54.85 1axj s ARG 86 Cb -0.06 -0.61 0.00 0.00 0.00 0.00 0.00 34.95 34.28 1axj s ARG 86 CO -0.03 0.14 0.00 0.41 0.00 0.00 0.00 175.30 175.82 1axj n GLY 87 N 1.61 0.76 3.29 -3.53 0.00 -0.67 -1.17 105.19 105.47 1axj n GLY 87 Ca -0.20 -0.80 -0.32 0.00 0.00 0.00 0.00 46.02 44.70 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 -0.45 3.23 0.36 1.61 0.01 -0.32 -1.57 113.70 116.56 1axj s SER 88 Ca 0.00 -0.48 -0.02 0.00 1.31 0.00 0.00 55.95 56.77 1axj s SER 88 Cb 0.00 -0.98 -0.04 0.00 0.21 0.00 0.00 66.02 65.21 1axj s SER 88 CO 0.00 0.24 0.59 0.00 0.41 0.00 0.00 173.24 174.48 1axj s ALA 89 N -0.10 3.63 -0.29 1.44 0.00 0.03 -0.47 121.76 126.01 1axj s ALA 89 Ca -0.05 -0.76 -0.10 0.00 0.00 0.00 0.00 51.96 51.05 1axj s ALA 89 Cb -0.14 -2.24 0.12 0.00 0.00 0.00 0.00 23.12 20.86 1axj s ALA 89 CO 0.04 -0.02 0.62 0.00 0.00 0.00 0.00 175.76 176.41 1axj s ALA 90 N -2.34 -1.92 0.27 0.00 0.00 0.69 -4.67 121.76 113.79 1axj s ALA 90 Ca 0.42 2.25 -0.29 0.00 0.00 0.00 0.00 51.96 54.33 1axj s ALA 90 Cb -0.10 -1.69 -0.09 0.00 0.00 0.00 0.00 23.12 21.23 1axj s ALA 90 CO 0.36 -0.87 1.10 -0.06 0.00 0.00 0.00 175.76 176.30 1axj s PHE 91 N 2.77 3.58 -0.01 0.00 0.08 -1.26 -0.67 117.98 122.47 1axj s PHE 91 Ca -0.06 1.69 -0.01 0.00 0.12 0.00 0.00 56.93 58.67 1axj s PHE 91 Cb -0.12 -3.29 0.00 0.00 -0.57 0.00 0.00 43.02 39.05 1axj s PHE 91 CO -0.18 -0.57 0.03 1.03 -0.10 0.00 0.00 175.22 175.43 1axj s ARG 92 N -1.36 0.08 -0.31 0.44 1.81 -0.18 -4.92 118.95 114.51 1axj s ARG 92 Ca 0.45 -0.04 0.07 0.00 -1.72 0.00 0.00 55.73 54.49 1axj s ARG 92 Cb -0.32 0.03 0.46 0.00 -0.45 0.00 0.00 34.95 34.67 1axj s ARG 92 CO 0.41 -0.01 1.18 0.25 -0.68 0.00 0.00 175.30 176.44 1axj n THR 93 N 2.85 2.47 -3.45 0.02 -2.24 -1.26 -0.78 114.28 111.89 1axj n THR 93 Ca -0.14 -4.25 -0.12 0.00 -2.27 0.00 0.00 64.05 57.27 1axj n THR 93 Cb 0.59 -1.07 -0.02 0.00 -2.10 0.00 0.00 70.33 67.72 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 -3.60 -0.54 0.00 3.42 2.15 -1.26 -5.01 116.67 111.83 1axj s ASP 94 Ca 0.50 -0.00 0.00 0.00 0.43 0.00 0.00 52.55 53.48 1axj s ASP 94 Cb 0.41 0.58 0.00 0.00 -0.30 0.00 0.00 42.92 43.61 1axj s ASP 94 CO 0.01 -0.94 0.00 0.61 -0.17 0.00 0.00 175.17 174.68 1axj n GLY 95 N -0.30 -0.58 0.00 2.66 0.00 -1.26 -3.38 105.19 102.32 1axj n GLY 95 Ca -0.17 -1.77 0.04 0.00 0.00 0.00 0.00 46.02 44.12 1axj n GLY 95 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1axj n PRO 96 N -0.60 0.03 0.16 1.61 -0.04 -1.26 -2.13 135.00 132.77 1axj n PRO 96 Ca 0.00 0.32 -0.07 0.00 -0.04 0.00 0.00 63.50 63.71 1axj n PRO 96 Cb 0.00 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 31.93 1axj n PRO 96 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 1axj h GLU 97 N 0.00 -0.41 -0.16 0.54 3.07 -1.99 -1.30 114.58 114.33 1axj h GLU 97 Ca 0.00 0.03 -0.01 0.00 -0.50 0.00 0.00 59.36 58.87 1axj h GLU 97 Cb 0.13 0.09 -0.01 0.00 -0.84 0.00 0.00 28.75 28.12 1axj h GLU 97 CO 0.00 -0.28 0.04 0.35 -1.40 0.00 0.00 179.01 177.73 1axj h PHE 98 N -0.56 0.22 -0.03 4.33 3.57 -1.44 -1.55 116.94 121.48 1axj h PHE 98 Ca -0.04 -0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.43 1axj h PHE 98 Cb 0.33 -0.07 0.00 0.00 2.79 0.00 0.00 35.95 39.00 1axj h PHE 98 CO 0.09 0.20 -0.07 0.93 -2.23 0.00 0.00 178.31 177.23 1axj h GLU 99 N 0.23 0.10 0.00 1.11 4.39 -1.56 0.25 114.58 119.10 1axj h GLU 99 Ca 0.06 -0.07 -0.01 0.00 0.34 0.00 0.00 59.36 59.68 1axj h GLU 99 Cb 0.09 0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 28.75 1axj h GLU 99 CO -0.00 0.67 -0.04 0.00 -1.16 0.00 0.00 179.01 178.48 1axj h ALA 100 N 0.43 1.58 0.00 3.43 0.00 -0.87 -1.48 119.26 122.34 1axj h ALA 100 Ca -0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1axj h ALA 100 Cb 0.67 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.46 1axj h ALA 100 CO 0.02 0.05 -0.94 0.44 0.00 0.00 0.00 179.25 178.82 1axj n ILE 101 N -3.98 0.49 -0.17 0.00 -6.64 -0.62 -4.20 119.36 104.25 1axj n ILE 101 Ca -0.03 -0.45 0.29 0.00 -1.77 0.00 0.00 62.75 60.80 1axj n ILE 101 Cb 0.13 -0.22 0.70 0.00 -1.44 0.00 0.00 39.64 38.82 1axj n ILE 101 CO 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 176.55 174.78 1axj h ALA 102 N 2.19 2.77 -0.27 -1.28 0.00 0.62 -0.51 119.26 122.77 1axj h ALA 102 Ca 0.00 -0.03 0.08 0.00 0.00 0.00 0.00 54.91 54.96 1axj h ALA 102 Cb 0.91 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.75 1axj h ALA 102 CO 0.00 -1.23 0.53 0.07 0.00 0.00 0.00 179.25 178.62 1axj h ARG 103 N 0.00 0.00 -7.77 0.00 0.11 -1.73 -3.42 114.38 101.57 1axj h ARG 103 Ca 0.43 0.00 -0.45 0.00 0.10 0.00 0.00 59.98 60.06 1axj h ARG 103 Cb 1.96 0.00 0.16 0.00 1.11 0.00 0.00 29.97 33.20 1axj h ARG 103 CO -0.00 0.00 0.39 -0.06 0.10 0.00 0.00 179.97 180.40 1axj s PHE 104 N -4.33 1.45 -0.03 4.08 0.08 -0.20 -5.04 117.98 113.98 1axj s PHE 104 Ca -0.03 0.21 0.05 0.00 0.12 0.00 0.00 56.93 57.27 1axj s PHE 104 Cb 0.11 -4.06 0.08 0.00 -0.57 0.00 0.00 43.02 38.58 1axj s PHE 104 CO 0.38 -2.64 1.04 1.17 -0.10 0.00 0.00 175.22 175.06 1axj n LYS 105 N -3.71 0.28 -0.02 0.44 4.81 -1.26 -4.79 118.16 113.91 1axj n LYS 105 Ca 0.16 -1.39 0.00 0.00 -0.87 0.00 0.00 58.31 56.22 1axj n LYS 105 Cb 0.59 -0.70 0.00 0.00 0.02 0.00 0.00 35.03 34.94 1axj n LYS 105 CO 0.00 0.00 0.00 -2.67 1.17 0.00 0.00 177.40 175.90 1axj n TRP 106 N -0.29 0.00 -2.74 5.64 4.27 -1.26 -5.10 117.44 117.96 1axj n TRP 106 Ca 0.04 -0.20 -0.33 0.00 -3.89 0.00 0.00 57.50 53.12 1axj n TRP 106 Cb 0.70 -0.02 -0.06 0.00 -1.36 0.00 0.00 31.31 30.57 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 -0.41 3.01 0.00 -1.67 0.00 -1.26 -4.14 121.76 117.28 1axj s ALA 107 Ca 0.01 0.43 0.00 0.00 0.00 0.00 0.00 51.96 52.39 1axj s ALA 107 Cb 0.01 -3.17 0.00 0.00 0.00 0.00 0.00 23.12 19.96 1axj s ALA 107 CO 0.00 0.02 0.00 -2.13 0.00 0.00 0.00 175.76 173.65 1axj n ARG 108 N -0.76 0.92 -3.62 0.00 3.00 0.90 -4.92 116.66 112.17 1axj n ARG 108 Ca 0.07 0.00 -0.02 0.00 -0.00 0.00 0.00 57.85 57.91 1axj n ARG 108 Cb 0.54 -0.98 -0.02 0.00 0.00 0.00 0.00 32.46 32.00 1axj n ARG 108 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1axj s ALA 109 N -1.93 -2.21 -0.39 5.13 0.00 -1.11 -4.99 121.76 116.26 1axj s ALA 109 Ca 0.00 1.66 -0.17 0.00 0.00 0.00 0.00 51.96 53.45 1axj s ALA 109 Cb 0.00 -0.22 0.01 0.00 0.00 0.00 0.00 23.12 22.91 1axj s ALA 109 CO 0.00 -0.65 0.45 0.00 0.00 0.00 0.00 175.76 175.56 1axj s ALA 110 N -2.15 3.45 -0.88 0.00 0.00 0.04 -1.55 121.76 120.67 1axj s ALA 110 Ca 0.12 -1.32 -0.25 0.00 0.00 0.00 0.00 51.96 50.51 1axj s ALA 110 Cb 0.00 -3.00 0.03 0.00 0.00 0.00 0.00 23.12 20.15 1axj s ALA 110 CO -0.03 -1.40 1.41 -1.17 0.00 0.00 0.00 175.76 174.57 1axj s LEU 111 N 2.21 3.33 0.04 0.00 0.20 0.43 -1.01 118.68 123.89 1axj s LEU 111 Ca 0.14 -0.93 -0.30 0.00 0.69 0.00 0.00 54.13 53.73 1axj s LEU 111 Cb -0.16 -2.56 -0.04 0.00 -0.43 0.00 0.00 46.19 42.99 1axj s LEU 111 CO 0.13 -1.73 1.02 -0.69 -0.29 0.00 0.00 176.35 174.79 1axj s VAL 112 N 5.67 4.60 -0.10 1.68 1.01 0.15 -1.13 120.40 132.27 1axj s VAL 112 Ca 0.43 1.94 0.04 0.00 0.00 0.00 0.00 61.98 64.38 1axj s VAL 112 Cb -0.04 -4.24 0.00 0.00 0.00 0.00 0.00 36.38 32.10 1axj s VAL 112 CO 0.02 0.19 -0.22 -0.63 0.00 0.00 0.00 175.10 174.46 1axj s ILE 113 N 0.74 1.94 -0.65 2.22 -1.09 0.52 -0.23 121.20 124.65 1axj s ILE 113 Ca 0.52 -0.94 -0.05 0.00 -2.23 0.00 0.00 60.65 57.95 1axj s ILE 113 Cb -0.23 -1.69 0.17 0.00 -1.58 0.00 0.00 42.46 39.13 1axj s ILE 113 CO 0.29 0.53 0.49 -0.89 -1.23 0.00 0.00 174.94 174.13 1axj s THR 114 N 0.47 4.05 0.90 2.92 2.01 0.38 -0.84 115.64 125.53 1axj s THR 114 Ca -0.16 -2.83 -0.10 0.00 0.31 0.00 0.00 61.69 58.90 1axj s THR 114 Cb -0.17 -3.61 0.14 0.00 0.01 0.00 0.00 72.50 68.86 1axj s THR 114 CO 0.07 -0.90 1.15 -0.69 -0.69 0.00 0.00 174.62 173.55 1axj s VAL 115 N 0.03 2.16 0.04 3.82 1.01 -1.25 -1.17 120.40 125.04 1axj s VAL 115 Ca 0.17 0.05 -0.01 0.00 0.00 0.00 0.00 61.98 62.19 1axj s VAL 115 Cb -0.19 -2.13 -0.01 0.00 0.00 0.00 0.00 36.38 34.06 1axj s VAL 115 CO -0.04 -0.07 -0.03 0.52 0.00 0.00 0.00 175.10 175.48 1axj n VAL 116 N -4.14 0.86 -3.77 2.92 0.31 -0.32 -4.66 118.33 109.54 1axj n VAL 116 Ca 0.12 0.24 -0.13 0.00 -0.01 0.00 0.00 64.34 64.56 1axj n VAL 116 Cb 0.52 -1.61 -0.11 0.00 -0.91 0.00 0.00 33.84 31.73 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 -5.72 -0.30 0.03 4.52 0.01 -1.20 0.05 113.70 111.09 1axj s SER 117 Ca -0.03 0.56 0.08 0.00 1.31 0.00 0.00 55.95 57.87 1axj s SER 117 Cb 0.01 0.60 -0.03 0.00 0.21 0.00 0.00 66.02 66.80 1axj s SER 117 CO 0.04 -0.14 -0.22 0.00 0.41 0.00 0.00 173.24 173.32 1axj s ALA 118 N 0.00 2.41 0.01 1.44 0.00 -1.26 -1.22 121.76 123.15 1axj s ALA 118 Ca -0.01 -1.20 0.00 0.00 0.00 0.00 0.00 51.96 50.75 1axj s ALA 118 Cb -0.03 -0.63 -0.01 0.00 0.00 0.00 0.00 23.12 22.45 1axj s ALA 118 CO 0.01 0.55 -0.03 -1.83 0.00 0.00 0.00 175.76 174.46 1axj s GLU 119 N -1.20 0.25 0.25 0.00 -1.05 0.09 -4.43 118.70 112.61 1axj s GLU 119 Ca 0.13 -0.38 -0.30 0.00 -0.15 0.00 0.00 54.97 54.26 1axj s GLU 119 Cb -0.10 -0.04 -0.09 0.00 -0.44 0.00 0.00 34.13 33.46 1axj s GLU 119 CO 0.03 -0.00 0.96 -1.14 0.95 0.00 0.00 175.26 176.06 1axj s GLN 120 N -0.85 4.83 0.16 -4.83 0.74 -1.26 -1.33 119.66 117.11 1axj s GLN 120 Ca -0.08 1.53 0.00 0.00 0.05 0.00 0.00 55.36 56.86 1axj s GLN 120 Cb -0.06 -3.26 0.00 0.00 1.10 0.00 0.00 33.01 30.79 1axj s GLN 120 CO -0.00 0.47 0.00 0.25 -0.55 0.00 0.00 175.29 175.46 1axj n THR 121 N 1.44 0.55 0.77 -0.34 -2.24 -0.22 -4.86 114.28 109.37 1axj n THR 121 Ca -0.02 0.18 0.09 0.00 -2.27 0.00 0.00 64.05 62.04 1axj n THR 121 Cb 0.47 -1.07 0.08 0.00 -2.10 0.00 0.00 70.33 67.70 1axj n THR 121 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50