#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 2.74 0.87 4.03 1.43 -1.26 -4.98 118.68 121.51 1axj s LEU 2 Ca 0.00 1.99 -0.11 0.00 -1.03 0.00 0.00 54.13 54.98 1axj s LEU 2 Cb 0.00 -4.44 0.12 0.00 0.03 0.00 0.00 46.19 41.90 1axj s LEU 2 CO 0.00 -2.82 1.16 -2.16 0.23 0.00 0.00 176.35 172.76 1axj s PRO 3 N -4.73 1.27 0.11 1.29 0.04 -1.26 -4.91 135.00 126.81 1axj s PRO 3 Ca 0.65 1.61 -0.21 0.00 0.04 0.00 0.00 61.00 63.09 1axj s PRO 3 Cb -0.21 -1.75 -0.09 0.00 0.04 0.00 0.00 34.50 32.49 1axj s PRO 3 CO 0.58 -2.46 1.74 0.78 0.04 0.00 0.00 177.00 177.69 1axj h GLY 4 N -1.52 0.13 0.37 0.56 0.00 -2.00 -2.80 103.07 97.81 1axj h GLY 4 Ca -0.44 -0.02 0.13 0.00 0.00 0.00 0.00 47.33 47.00 1axj h GLY 4 CO 0.43 0.02 0.54 -0.84 0.00 0.00 0.00 176.54 176.69 1axj h THR 5 N 0.09 0.84 0.13 4.70 2.02 -1.99 0.14 112.91 118.84 1axj h THR 5 Ca 0.05 -0.28 0.01 0.00 0.77 0.00 0.00 66.41 66.96 1axj h THR 5 Cb 0.03 -0.05 -0.04 0.00 -1.74 0.00 0.00 68.15 66.34 1axj h THR 5 CO -0.05 0.15 -0.51 0.15 0.37 0.00 0.00 175.52 175.63 1axj h PHE 6 N 0.82 -1.48 -0.50 3.16 3.04 -1.87 -1.25 116.94 118.87 1axj h PHE 6 Ca 0.48 0.04 0.09 0.00 3.98 0.00 0.00 57.97 62.56 1axj h PHE 6 Cb 0.56 0.63 -0.08 0.00 2.56 0.00 0.00 35.95 39.62 1axj h PHE 6 CO -0.04 -0.58 0.03 0.74 -2.02 0.00 0.00 178.31 176.44 1axj h PHE 7 N -0.74 0.03 -0.93 0.41 0.04 -1.04 -1.12 116.94 113.59 1axj h PHE 7 Ca -0.01 0.03 0.12 0.00 2.80 0.00 0.00 57.97 60.92 1axj h PHE 7 Cb 0.74 0.06 -0.07 0.00 2.20 0.00 0.00 35.95 38.88 1axj h PHE 7 CO -0.44 -0.08 0.59 0.93 -0.60 0.00 0.00 178.31 178.71 1axj h GLU 8 N 0.15 0.83 -0.20 1.51 4.39 -0.66 0.71 114.58 121.30 1axj h GLU 8 Ca 0.25 -0.05 -0.07 0.00 0.34 0.00 0.00 59.36 59.84 1axj h GLU 8 Cb 0.37 -0.19 -0.00 0.00 -0.10 0.00 0.00 28.75 28.83 1axj h GLU 8 CO -0.39 0.55 -0.13 0.28 -1.16 0.00 0.00 179.01 178.16 1axj h VAL 9 N 0.85 1.32 -0.81 3.13 2.07 -0.04 -3.15 116.25 119.61 1axj h VAL 9 Ca 0.45 -1.23 0.06 0.00 0.82 0.00 0.00 66.70 66.80 1axj h VAL 9 Cb 0.54 1.69 -0.06 0.00 -1.52 0.00 0.00 31.29 31.94 1axj h VAL 9 CO -0.22 0.37 0.49 -0.07 0.02 0.00 0.00 177.57 178.17 1axj h LEU 10 N 0.13 0.77 -1.51 2.57 -0.00 -0.60 -1.29 115.31 115.38 1axj h LEU 10 Ca 0.04 0.02 0.00 0.00 -0.00 0.00 0.00 57.88 57.94 1axj h LEU 10 Cb 0.64 -0.14 0.00 0.00 -0.00 0.00 0.00 40.66 41.16 1axj h LEU 10 CO 0.04 0.49 0.39 0.11 -0.00 0.00 0.00 178.44 179.47 1axj h LYS 11 N 0.90 0.00 -6.25 1.13 1.57 -0.84 -3.43 116.57 109.66 1axj h LYS 11 Ca 0.36 0.00 -0.57 0.00 -1.87 0.00 0.00 60.65 58.56 1axj h LYS 11 Cb 0.17 0.00 -0.10 0.00 0.08 0.00 0.00 32.23 32.38 1axj h LYS 11 CO -0.17 0.00 -0.66 -0.80 -0.57 0.00 0.00 179.45 177.25 1axj s ASN 12 N -4.02 4.53 0.47 0.86 0.01 -0.49 -5.09 114.94 111.20 1axj s ASN 12 Ca -0.03 -0.61 -0.21 0.00 -0.71 0.00 0.00 52.86 51.30 1axj s ASN 12 Cb 0.07 -0.84 -0.08 0.00 0.41 0.00 0.00 41.25 40.80 1axj s ASN 12 CO 0.21 0.03 1.06 -0.70 -1.51 0.00 0.00 177.10 176.18 1axj s GLU 13 N -3.48 3.84 0.00 -0.60 2.56 -1.26 -4.83 118.70 114.93 1axj s GLU 13 Ca 0.30 1.45 0.00 0.00 0.00 0.00 0.00 54.97 56.72 1axj s GLU 13 Cb -0.07 -2.21 0.00 0.00 2.00 0.00 0.00 34.13 33.85 1axj s GLU 13 CO 0.19 -0.42 0.00 0.41 -0.56 0.00 0.00 175.26 174.88 1axj n GLY 14 N -0.02 0.39 3.88 -1.50 0.00 -1.26 -1.94 105.19 104.73 1axj n GLY 14 Ca 0.08 -0.88 -0.32 0.00 0.00 0.00 0.00 46.02 44.90 1axj n GLY 14 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1axj s VAL 15 N -2.00 5.02 0.19 1.61 1.01 -1.26 -1.15 120.40 123.83 1axj s VAL 15 Ca 0.00 0.35 0.03 0.00 0.00 0.00 0.00 61.98 62.36 1axj s VAL 15 Cb 0.00 -3.63 -0.05 0.00 0.00 0.00 0.00 36.38 32.70 1axj s VAL 15 CO 0.00 0.03 -0.03 -0.69 0.00 0.00 0.00 175.10 174.40 1axj s VAL 16 N -1.69 0.99 0.03 2.92 1.01 0.40 -2.11 120.40 121.94 1axj s VAL 16 Ca 0.43 -2.03 -0.08 0.00 0.00 0.00 0.00 61.98 60.30 1axj s VAL 16 Cb -0.12 -2.13 0.00 0.00 0.00 0.00 0.00 36.38 34.13 1axj s VAL 16 CO 0.22 -0.50 0.16 0.00 0.00 0.00 0.00 175.10 174.98 1axj s ALA 17 N -3.45 -0.30 -0.18 5.51 0.00 0.91 -1.01 121.76 123.25 1axj s ALA 17 Ca 0.24 -0.28 -0.04 0.00 0.00 0.00 0.00 51.96 51.88 1axj s ALA 17 Cb 0.05 0.21 0.06 0.00 0.00 0.00 0.00 23.12 23.44 1axj s ALA 17 CO 0.05 -0.30 0.07 0.42 0.00 0.00 0.00 175.76 176.00 1axj s ILE 18 N -2.18 0.09 -0.46 0.00 -1.09 -0.35 -1.11 121.20 116.11 1axj s ILE 18 Ca -0.08 -0.29 -0.22 0.00 -2.23 0.00 0.00 60.65 57.82 1axj s ILE 18 Cb -0.03 -0.72 0.03 0.00 -1.58 0.00 0.00 42.46 40.16 1axj s ILE 18 CO -0.02 -0.27 0.76 0.00 -1.23 0.00 0.00 174.94 174.18 1axj s ALA 19 N 2.05 3.30 -0.45 9.38 0.00 0.60 -0.67 121.76 135.97 1axj s ALA 19 Ca 0.01 -1.13 -0.17 0.00 0.00 0.00 0.00 51.96 50.67 1axj s ALA 19 Cb -0.16 -3.45 0.04 0.00 0.00 0.00 0.00 23.12 19.55 1axj s ALA 19 CO -0.09 -1.95 0.45 0.99 0.00 0.00 0.00 175.76 175.16 1axj s THR 20 N 3.20 5.10 -0.75 0.00 2.01 -0.46 -1.42 115.64 123.32 1axj s THR 20 Ca 0.27 -0.58 -0.25 0.00 0.31 0.00 0.00 61.69 61.44 1axj s THR 20 Cb -0.13 -4.10 0.05 0.00 0.01 0.00 0.00 72.50 68.32 1axj s THR 20 CO 0.21 -0.53 1.21 -1.58 -0.69 0.00 0.00 174.62 173.24 1axj s GLN 21 N 2.08 3.22 0.14 4.92 -0.44 -0.32 -1.22 119.66 128.04 1axj s GLN 21 Ca 0.10 -0.52 0.00 0.00 -2.50 0.00 0.00 55.36 52.44 1axj s GLN 21 Cb -0.19 -4.32 0.00 0.00 -1.64 0.00 0.00 33.01 26.85 1axj s GLN 21 CO 0.11 -2.06 0.00 0.41 0.50 0.00 0.00 175.29 174.25 1axj n GLY 22 N 5.51 -0.10 2.21 2.59 0.00 -1.26 -4.36 105.19 109.78 1axj n GLY 22 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 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 -3.49 0.00 -0.44 1.61 2.13 -1.26 -4.54 120.64 114.65 1axj n GLU 23 Ca 0.00 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.82 1axj n GLU 23 Cb 0.00 0.00 0.00 0.00 0.27 0.00 0.00 31.44 31.71 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 -3.42 4.95 0.00 4.31 5.75 -1.26 -4.84 116.55 122.04 1axj n ASP 24 Ca 0.00 -2.32 0.00 0.00 -0.01 0.00 0.00 54.79 52.46 1axj n ASP 24 Cb 0.00 -1.03 0.00 0.00 -1.03 0.00 0.00 41.12 39.06 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 1.43 -1.79 3.75 6.12 0.00 -1.26 -4.91 105.19 108.52 1axj n GLY 25 Ca 0.00 -1.41 -0.37 0.00 0.00 0.00 0.00 46.02 44.24 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 -3.85 3.04 -0.32 1.61 0.04 -1.26 -4.57 135.00 129.69 1axj s PRO 26 Ca 0.00 2.04 0.03 0.00 0.04 0.00 0.00 61.00 63.12 1axj s PRO 26 Cb 0.00 -2.10 0.09 0.00 0.04 0.00 0.00 34.50 32.53 1axj s PRO 26 CO 0.00 -1.21 0.03 -1.58 0.04 0.00 0.00 177.00 174.28 1axj s HIS 27 N -1.42 3.44 -0.96 0.56 2.46 -0.36 -4.86 115.29 114.17 1axj s HIS 27 Ca 0.75 -2.75 -0.18 0.00 0.47 0.00 0.00 55.06 53.35 1axj s HIS 27 Cb -0.36 -2.63 0.14 0.00 -0.13 0.00 0.00 32.58 29.61 1axj s HIS 27 CO 0.41 -0.93 1.14 -1.17 -2.47 0.00 0.00 174.74 171.72 1axj s LEU 28 N 1.02 5.21 0.93 8.88 0.20 -1.25 -1.36 118.68 132.30 1axj s LEU 28 Ca 0.08 -2.23 -0.14 0.00 0.69 0.00 0.00 54.13 52.53 1axj s LEU 28 Cb -0.19 -2.38 0.15 0.00 -0.43 0.00 0.00 46.19 43.34 1axj s LEU 28 CO -0.09 -0.98 1.20 0.68 -0.29 0.00 0.00 176.35 176.87 1axj s VAL 29 N 2.30 1.96 0.39 1.68 -7.23 0.15 -4.78 120.40 114.88 1axj s VAL 29 Ca 0.33 0.00 0.08 0.00 -1.81 0.00 0.00 61.98 60.57 1axj s VAL 29 Cb -0.05 -2.87 -0.07 0.00 0.56 0.00 0.00 36.38 33.95 1axj s VAL 29 CO -0.08 0.00 -0.02 0.20 -0.31 0.00 0.00 175.10 174.89 1axj s ASN 30 N -4.42 3.85 0.14 4.85 0.02 -1.26 -1.21 114.94 116.91 1axj s ASN 30 Ca 0.67 -1.31 -0.25 0.00 -1.02 0.00 0.00 52.86 50.95 1axj s ASN 30 Cb -0.10 -0.39 0.08 0.00 0.02 0.00 0.00 41.25 40.86 1axj s ASN 30 CO 0.52 -0.38 1.03 0.28 0.02 0.00 0.00 177.10 178.58 1axj s THR 31 N -2.68 0.00 0.01 1.60 -1.32 -0.18 -4.90 115.64 108.17 1axj s THR 31 Ca 0.34 -0.58 0.08 0.00 -1.21 0.00 0.00 61.69 60.33 1axj s THR 31 Cb 0.08 -2.26 -0.02 0.00 -1.51 0.00 0.00 72.50 68.78 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 -2.83 2.22 0.52 9.09 0.52 -1.26 -0.45 118.94 126.75 1axj s TRP 32 Ca 0.15 -0.41 0.29 0.00 0.02 0.00 0.00 56.10 56.15 1axj s TRP 32 Cb -0.01 -1.39 1.42 0.00 -1.15 0.00 0.00 33.47 32.34 1axj s TRP 32 CO 0.02 0.02 1.91 -0.91 0.02 0.00 0.00 176.95 178.02 1axj h ASN 33 N 5.24 0.04 -0.13 2.95 2.35 -1.47 -0.73 115.58 123.84 1axj h ASN 33 Ca -0.44 0.00 0.04 0.00 -0.55 0.00 0.00 56.30 55.36 1axj h ASN 33 Cb 1.13 -0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.49 1axj h ASN 33 CO 0.46 0.02 0.52 -1.28 -1.65 0.00 0.00 177.43 175.49 1axj h SER 34 N 0.04 0.00 -0.00 5.81 0.87 -1.92 -1.52 113.55 116.83 1axj h SER 34 Ca 0.39 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.95 1axj h SER 34 Cb 1.47 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.43 1axj h SER 34 CO -0.02 0.00 -0.05 -1.22 -0.53 0.00 0.00 176.83 175.00 1axj n TYR 35 N -2.99 0.00 -2.54 2.24 4.01 -0.28 -5.06 117.16 112.54 1axj n TYR 35 Ca 0.01 0.00 -0.22 0.00 -0.16 0.00 0.00 57.90 57.53 1axj n TYR 35 Cb 0.59 0.00 0.06 0.00 -0.31 0.00 0.00 39.34 39.68 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 -1.45 3.13 -0.08 7.72 1.43 -0.57 -4.30 118.68 124.55 1axj s LEU 36 Ca 0.01 0.02 -0.01 0.00 -1.03 0.00 0.00 54.13 53.12 1axj s LEU 36 Cb 0.01 -2.76 0.03 0.00 0.03 0.00 0.00 46.19 43.50 1axj s LEU 36 CO 0.05 -1.36 -0.02 -1.59 0.23 0.00 0.00 176.35 173.67 1axj s LYS 37 N -4.92 0.83 -0.18 1.70 -2.85 -0.71 -5.01 119.74 108.59 1axj s LYS 37 Ca 0.59 0.02 -0.08 0.00 -1.00 0.00 0.00 55.97 55.50 1axj s LYS 37 Cb -0.10 -1.13 -0.05 0.00 -2.06 0.00 0.00 37.83 34.50 1axj s LYS 37 CO 0.41 -0.30 0.10 0.08 0.10 0.00 0.00 175.35 175.74 1axj s VAL 38 N 1.91 5.16 0.49 1.79 1.01 -1.26 -1.06 120.40 128.44 1axj s VAL 38 Ca 0.05 0.10 0.02 0.00 0.00 0.00 0.00 61.98 62.14 1axj s VAL 38 Cb -0.12 -3.33 -0.02 0.00 0.00 0.00 0.00 36.38 32.91 1axj s VAL 38 CO -0.06 0.47 0.02 -0.76 0.00 0.00 0.00 175.10 174.77 1axj s LEU 39 N 0.16 2.26 0.00 3.92 1.02 0.15 -5.01 118.68 121.18 1axj s LEU 39 Ca 0.07 -1.65 -0.15 0.00 0.02 0.00 0.00 54.13 52.42 1axj s LEU 39 Cb -0.12 -0.65 0.20 0.00 0.02 0.00 0.00 46.19 45.65 1axj s LEU 39 CO -0.00 -0.85 1.03 -0.67 0.02 0.00 0.00 176.35 175.87 1axj n ASP 40 N -1.26 -0.51 -1.91 2.29 2.03 -1.26 -3.92 116.55 112.01 1axj n ASP 40 Ca -0.17 -1.29 -0.17 0.00 0.52 0.00 0.00 54.79 53.68 1axj n ASP 40 Cb 0.67 -0.83 -0.01 0.00 -0.72 0.00 0.00 41.12 40.23 1axj n ASP 40 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1axj n GLY 41 N -2.50 -0.25 2.54 0.27 0.00 -1.26 -1.79 105.19 102.20 1axj n GLY 41 Ca 0.13 -0.17 -0.04 0.00 0.00 0.00 0.00 46.02 45.94 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 -1.22 -4.10 -4.70 1.61 0.23 -1.26 -4.87 115.26 100.94 1axj n ASN 42 Ca -0.20 0.10 -0.42 0.00 -0.53 0.00 0.00 54.58 53.53 1axj n ASN 42 Cb 0.65 -2.88 -0.03 0.00 -2.08 0.00 0.00 39.78 35.44 1axj n ASN 42 CO 0.00 0.00 0.00 -0.60 -0.93 0.00 0.00 177.26 175.73 1axj s ARG 43 N -1.93 4.51 0.17 -3.83 3.52 -0.74 -3.78 118.95 116.88 1axj s ARG 43 Ca 0.00 1.45 0.09 0.00 -0.13 0.00 0.00 55.73 57.14 1axj s ARG 43 Cb 0.00 -3.47 -0.04 0.00 -1.56 0.00 0.00 34.95 29.88 1axj s ARG 43 CO 0.00 -0.14 -0.19 0.42 -0.81 0.00 0.00 175.30 174.58 1axj s ILE 44 N 1.27 1.90 -0.05 4.11 -1.09 -0.66 -0.67 121.20 126.01 1axj s ILE 44 Ca 0.52 -1.96 -0.07 0.00 -2.23 0.00 0.00 60.65 56.91 1axj s ILE 44 Cb -0.21 -1.90 0.01 0.00 -1.58 0.00 0.00 42.46 38.78 1axj s ILE 44 CO 0.26 -0.31 0.18 -0.69 -1.23 0.00 0.00 174.94 173.15 1axj s VAL 45 N -2.05 0.02 -0.07 2.92 1.01 -0.23 -0.65 120.40 121.35 1axj s VAL 45 Ca 0.17 -0.16 0.05 0.00 0.00 0.00 0.00 61.98 62.03 1axj s VAL 45 Cb -0.06 -0.31 -0.00 0.00 0.00 0.00 0.00 36.38 36.00 1axj s VAL 45 CO 0.07 -0.09 -0.22 -0.69 0.00 0.00 0.00 175.10 174.17 1axj s VAL 46 N -0.27 1.87 -0.49 2.92 1.01 -0.18 -1.74 120.40 123.52 1axj s VAL 46 Ca -0.04 -0.94 -0.29 0.00 0.00 0.00 0.00 61.98 60.72 1axj s VAL 46 Cb -0.03 -1.61 0.02 0.00 0.00 0.00 0.00 36.38 34.77 1axj s VAL 46 CO 0.01 0.52 1.28 -2.16 0.00 0.00 0.00 175.10 174.74 1axj s PRO 47 N 0.14 3.57 -0.42 2.72 0.04 -1.26 -0.71 135.00 139.07 1axj s PRO 47 Ca -0.10 0.60 -0.25 0.00 0.04 0.00 0.00 61.00 61.29 1axj s PRO 47 Cb -0.15 -4.00 0.02 0.00 0.04 0.00 0.00 34.50 30.41 1axj s PRO 47 CO 0.05 -1.58 0.89 0.54 0.04 0.00 0.00 177.00 176.94 1axj s VAL 48 N 5.11 4.56 -0.01 -0.36 0.11 -0.48 -4.84 120.40 124.48 1axj s VAL 48 Ca 0.52 0.84 0.06 0.00 -2.93 0.00 0.00 61.98 60.47 1axj s VAL 48 Cb -0.10 -4.36 -0.09 0.00 -1.53 0.00 0.00 36.38 30.30 1axj s VAL 48 CO 0.30 -0.69 0.12 0.61 -3.33 0.00 0.00 175.10 172.11 1axj n GLY 49 N 4.74 -0.28 2.66 6.54 0.00 -1.26 -0.47 105.19 117.13 1axj n GLY 49 Ca 0.05 -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 2.20 1.96 2.70 -0.02 0.00 -1.26 -4.73 105.19 106.03 1axj n GLY 50 Ca -0.02 -0.16 -0.31 0.00 0.00 0.00 0.00 46.02 45.53 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 -1.45 3.47 -0.03 1.61 2.00 -1.26 -4.92 117.12 116.53 1axj n MET 51 Ca -0.16 -4.41 -0.14 0.00 0.00 0.00 0.00 57.70 52.99 1axj n MET 51 Cb 0.87 -2.28 -0.10 0.00 0.00 0.00 0.00 33.22 31.72 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 2.94 0.20 -0.97 2.03 3.86 -1.98 -0.14 115.15 121.08 1axj h HIS 52 Ca 0.34 -0.08 0.19 0.00 -1.16 0.00 0.00 60.37 59.66 1axj h HIS 52 Cb 0.57 -0.04 -0.09 0.00 1.06 0.00 0.00 27.41 28.92 1axj h HIS 52 CO 0.95 0.71 0.61 -0.22 0.86 0.00 0.00 177.93 180.85 1axj h LYS 53 N -0.37 0.66 -0.64 2.45 3.11 -2.00 0.55 116.57 120.32 1axj h LYS 53 Ca -0.00 -0.04 -0.06 0.00 -2.81 0.00 0.00 60.65 57.74 1axj h LYS 53 Cb 0.71 -0.15 -0.03 0.00 -1.00 0.00 0.00 32.23 31.76 1axj h LYS 53 CO 0.02 0.43 0.14 1.15 -2.81 0.00 0.00 179.45 178.39 1axj h THR 54 N 0.68 1.25 -0.42 1.00 2.02 -1.94 0.12 112.91 115.62 1axj h THR 54 Ca 0.53 -0.94 0.06 0.00 0.77 0.00 0.00 66.41 66.84 1axj h THR 54 Cb 0.94 0.60 -0.05 0.00 -1.74 0.00 0.00 68.15 67.90 1axj h THR 54 CO -0.30 0.35 0.10 -0.08 0.37 0.00 0.00 175.52 175.97 1axj h GLU 55 N 0.97 0.23 -0.32 6.66 4.81 1.00 0.16 114.58 128.09 1axj h GLU 55 Ca 0.20 -0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.41 1axj h GLU 55 Cb 0.36 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.67 1axj h GLU 55 CO 0.00 0.16 0.16 0.00 -0.73 0.00 0.00 179.01 178.60 1axj h ALA 56 N 1.30 0.41 -0.88 2.92 0.00 -0.88 -0.80 119.26 121.33 1axj h ALA 56 Ca 0.20 -0.09 0.06 0.00 0.00 0.00 0.00 54.91 55.09 1axj h ALA 56 Cb 0.23 -0.13 -0.06 0.00 0.00 0.00 0.00 17.79 17.83 1axj h ALA 56 CO -0.25 -0.04 0.55 -0.91 0.00 0.00 0.00 179.25 178.60 1axj h ASN 57 N 0.38 0.86 -0.10 0.00 2.35 -0.07 0.12 115.58 119.13 1axj h ASN 57 Ca 0.11 0.02 -0.02 0.00 -0.55 0.00 0.00 56.30 55.86 1axj h ASN 57 Cb 0.10 -0.16 -0.00 0.00 0.05 0.00 0.00 38.32 38.30 1axj h ASN 57 CO -0.02 0.55 -0.02 0.58 -1.65 0.00 0.00 177.43 176.88 1axj h VAL 58 N 1.00 1.28 -0.29 2.81 2.07 -0.56 -0.40 116.25 122.17 1axj h VAL 58 Ca 0.39 -0.91 0.08 0.00 0.82 0.00 0.00 66.70 67.08 1axj h VAL 58 Cb 0.18 1.69 -0.01 0.00 -1.52 0.00 0.00 31.29 31.63 1axj h VAL 58 CO -0.18 0.26 0.30 0.00 0.02 0.00 0.00 177.57 177.96 1axj h ALA 59 N 0.70 1.98 0.07 1.67 0.00 -0.68 -2.81 119.26 120.18 1axj h ALA 59 Ca 0.03 -0.01 -0.12 0.00 0.00 0.00 0.00 54.91 54.81 1axj h ALA 59 Cb 0.41 0.02 0.01 0.00 0.00 0.00 0.00 17.79 18.23 1axj h ALA 59 CO 0.01 -0.44 -0.55 0.00 0.00 0.00 0.00 179.25 178.27 1axj h ARG 60 N 0.00 0.15 -2.68 0.00 2.47 -0.27 -3.48 114.38 110.56 1axj h ARG 60 Ca 0.14 -0.25 -0.11 0.00 -1.26 0.00 0.00 59.98 58.50 1axj h ARG 60 Cb 0.72 0.09 -0.23 0.00 -1.65 0.00 0.00 29.97 28.91 1axj h ARG 60 CO -0.00 1.12 -0.19 0.34 0.56 0.00 0.00 179.97 181.80 1axj s ASP 61 N -6.65 -0.44 0.18 7.04 -1.08 -0.20 -5.02 116.67 110.51 1axj s ASP 61 Ca -0.18 0.78 0.20 0.00 -0.52 0.00 0.00 52.55 52.84 1axj s ASP 61 Cb -0.00 0.81 0.86 0.00 -1.46 0.00 0.00 42.92 43.13 1axj s ASP 61 CO 0.75 -0.21 1.61 -1.84 0.52 0.00 0.00 175.17 176.00 1axj n GLU 62 N 2.56 0.13 -1.59 4.34 -0.00 -1.25 -4.00 120.64 120.83 1axj n GLU 62 Ca -0.15 0.40 -0.51 0.00 -0.00 0.00 0.00 57.16 56.90 1axj n GLU 62 Cb 0.57 -1.77 -0.06 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 -2.01 1.48 -3.99 3.44 5.12 -1.26 -0.24 116.66 119.20 1axj n ARG 63 Ca 0.02 0.49 -0.12 0.00 -1.93 0.00 0.00 57.85 56.31 1axj n ARG 63 Cb 0.18 -2.47 -0.13 0.00 -1.16 0.00 0.00 32.46 28.89 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 5.44 0.19 0.08 1.55 -7.23 -0.64 -1.17 120.40 118.62 1axj s VAL 64 Ca 1.01 -0.39 0.06 0.00 -1.81 0.00 0.00 61.98 60.85 1axj s VAL 64 Cb -0.83 -0.22 -0.04 0.00 0.56 0.00 0.00 36.38 35.85 1axj s VAL 64 CO 0.53 -0.13 -0.07 -0.22 -0.31 0.00 0.00 175.10 174.91 1axj s LEU 65 N -0.54 3.18 -0.05 1.32 0.20 -0.51 -1.30 118.68 120.98 1axj s LEU 65 Ca -0.04 -0.27 -0.02 0.00 0.69 0.00 0.00 54.13 54.49 1axj s LEU 65 Cb -0.04 -1.92 0.04 0.00 -0.43 0.00 0.00 46.19 43.83 1axj s LEU 65 CO -0.00 0.20 0.11 -0.32 -0.29 0.00 0.00 176.35 176.05 1axj s MET 66 N -2.03 0.04 -0.16 1.98 -2.45 0.27 -0.29 119.30 116.66 1axj s MET 66 Ca 0.21 0.33 -0.02 0.00 -1.25 0.00 0.00 55.69 54.96 1axj s MET 66 Cb -0.11 -0.22 -0.02 0.00 1.25 0.00 0.00 34.83 35.73 1axj s MET 66 CO 0.13 -0.18 -0.07 0.95 1.05 0.00 0.00 175.02 176.90 1axj s THR 67 N 1.25 3.51 0.37 10.11 -4.23 -0.26 -0.48 115.64 125.90 1axj s THR 67 Ca -0.08 -0.49 0.08 0.00 -1.18 0.00 0.00 61.69 60.03 1axj s THR 67 Cb -0.12 -2.53 -0.06 0.00 1.34 0.00 0.00 72.50 71.13 1axj s THR 67 CO -0.05 0.49 0.03 -1.48 -0.54 0.00 0.00 174.62 173.07 1axj s LEU 68 N 0.55 2.95 0.00 4.79 0.05 -0.48 -0.06 118.68 126.48 1axj s LEU 68 Ca -0.05 -1.11 -0.11 0.00 0.05 0.00 0.00 54.13 52.91 1axj s LEU 68 Cb -0.15 -1.23 0.04 0.00 -2.05 0.00 0.00 46.19 42.80 1axj s LEU 68 CO 0.03 -0.33 0.51 0.61 -0.55 0.00 0.00 176.35 176.62 1axj n GLY 69 N -0.99 0.94 3.19 -3.48 0.00 -0.90 -1.20 105.19 102.75 1axj n GLY 69 Ca -0.04 -1.03 -0.09 0.00 0.00 0.00 0.00 46.02 44.86 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 -2.21 0.09 0.00 1.61 0.15 -0.07 -4.15 113.70 109.13 1axj s SER 70 Ca 0.11 -0.53 0.22 0.00 0.70 0.00 0.00 55.95 56.45 1axj s SER 70 Cb -0.01 0.31 -0.08 0.00 -1.71 0.00 0.00 66.02 64.53 1axj s SER 70 CO 0.03 -0.64 1.01 0.54 1.20 0.00 0.00 173.24 175.38 1axj n ARG 71 N 0.30 0.35 0.00 5.44 1.74 -0.82 -2.80 116.66 120.86 1axj n ARG 71 Ca -0.17 -0.28 0.12 0.00 -0.77 0.00 0.00 57.85 56.75 1axj n ARG 71 Cb 0.61 -1.49 0.27 0.00 -1.02 0.00 0.00 32.46 30.83 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 -1.08 0.51 -4.46 5.56 5.02 -1.26 -4.69 118.16 117.75 1axj n LYS 72 Ca 0.06 -0.32 -0.21 0.00 -2.02 0.00 0.00 58.31 55.82 1axj n LYS 72 Cb 0.37 -1.49 -0.15 0.00 -0.02 0.00 0.00 35.03 33.73 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 -2.71 0.89 0.04 -0.18 1.01 -1.26 -5.05 120.40 113.14 1axj s VAL 73 Ca 0.18 -0.42 -0.30 0.00 0.00 0.00 0.00 61.98 61.44 1axj s VAL 73 Cb 0.18 -0.78 -0.04 0.00 0.00 0.00 0.00 36.38 35.74 1axj s VAL 73 CO 0.61 0.27 1.00 0.00 0.00 0.00 0.00 175.10 176.98 1axj s ALA 74 N 0.14 3.21 0.00 5.51 0.00 -1.26 -0.95 121.76 128.41 1axj s ALA 74 Ca -0.03 0.59 0.00 0.00 0.00 0.00 0.00 51.96 52.52 1axj s ALA 74 Cb -0.09 -3.34 0.00 0.00 0.00 0.00 0.00 23.12 19.70 1axj s ALA 74 CO 0.01 -0.20 0.00 0.41 0.00 0.00 0.00 175.76 175.98 1axj n GLY 75 N 2.74 4.94 0.06 0.00 0.00 -1.09 -4.51 105.19 107.33 1axj n GLY 75 Ca 0.05 -1.63 -0.03 0.00 0.00 0.00 0.00 46.02 44.41 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 -6.47 1.61 2.47 -0.43 -3.43 114.38 108.14 1axj h ARG 76 Ca 0.00 0.00 -0.55 0.00 -1.26 0.00 0.00 59.98 58.17 1axj h ARG 76 Cb 0.00 0.00 -0.08 0.00 -1.65 0.00 0.00 29.97 28.24 1axj h ARG 76 CO 0.00 0.09 1.02 0.54 0.56 0.00 0.00 179.97 182.19 1axj s ASN 77 N -5.71 6.30 0.75 7.04 6.03 -1.25 -4.92 114.94 123.18 1axj s ASN 77 Ca -0.08 -0.18 0.00 0.00 -1.03 0.00 0.00 52.86 51.57 1axj s ASN 77 Cb 0.01 -2.56 0.00 0.00 -3.03 0.00 0.00 41.25 35.67 1axj s ASN 77 CO 0.15 -1.67 0.00 0.61 -2.03 0.00 0.00 177.10 174.16 1axj n GLY 78 N 5.23 -0.50 2.69 0.45 0.00 -1.26 -3.43 105.19 108.36 1axj n GLY 78 Ca 0.06 -0.75 -0.38 0.00 0.00 0.00 0.00 46.02 44.94 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 -1.32 2.61 -3.66 1.61 -0.04 -1.26 -3.00 135.00 129.94 1axj n PRO 79 Ca 0.00 -2.13 -0.05 0.00 -0.04 0.00 0.00 63.50 61.28 1axj n PRO 79 Cb 0.00 -2.94 -0.07 0.00 -0.04 0.00 0.00 33.50 30.45 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 3.41 -0.54 0.41 0.55 0.00 -1.06 -4.45 107.32 105.63 1axj s GLY 80 Ca 0.54 1.92 0.07 0.00 0.00 0.00 0.00 44.72 47.25 1axj s GLY 80 CO -0.03 2.66 0.10 -1.08 0.00 0.00 0.00 173.10 174.75 1axj s THR 81 N 2.62 2.21 -0.01 0.90 -1.32 -0.13 -2.66 115.64 117.25 1axj s THR 81 Ca -0.04 -1.84 -0.22 0.00 -1.21 0.00 0.00 61.69 58.37 1axj s THR 81 Cb -0.11 -2.98 0.07 0.00 -1.51 0.00 0.00 72.50 67.97 1axj s THR 81 CO -0.16 -0.02 1.00 0.61 -2.21 0.00 0.00 174.62 173.84 1axj n GLY 82 N -1.11 0.32 3.12 6.08 0.00 -1.26 -0.89 105.19 111.45 1axj n GLY 82 Ca -0.03 -1.00 -0.18 0.00 0.00 0.00 0.00 46.02 44.81 1axj n GLY 82 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1axj s PHE 83 N -2.27 1.08 -0.20 1.61 0.40 -0.34 -1.49 117.98 116.77 1axj s PHE 83 Ca 0.23 -0.38 -0.09 0.00 -0.60 0.00 0.00 56.93 56.09 1axj s PHE 83 Cb -0.01 -0.63 -0.05 0.00 0.51 0.00 0.00 43.02 42.84 1axj s PHE 83 CO -0.00 0.02 0.12 -1.17 0.70 0.00 0.00 175.22 174.88 1axj s LEU 84 N -1.28 4.11 0.04 -0.37 1.98 -0.02 -1.38 118.68 121.77 1axj s LEU 84 Ca -0.01 0.19 -0.02 0.00 -2.89 0.00 0.00 54.13 51.39 1axj s LEU 84 Cb -0.08 -2.06 -0.03 0.00 0.66 0.00 0.00 46.19 44.68 1axj s LEU 84 CO 0.01 0.17 0.01 -0.63 -1.89 0.00 0.00 176.35 174.02 1axj s ILE 85 N 0.41 0.18 0.05 6.68 1.01 0.37 -1.24 121.20 128.65 1axj s ILE 85 Ca 0.07 -1.45 0.04 0.00 0.00 0.00 0.00 60.65 59.31 1axj s ILE 85 Cb -0.11 -1.14 -0.03 0.00 0.01 0.00 0.00 42.46 41.19 1axj s ILE 85 CO -0.01 -0.80 -0.12 -0.13 0.00 0.00 0.00 174.94 173.88 1axj s ARG 86 N -3.18 0.71 0.06 2.79 0.52 -0.71 -0.57 118.95 118.58 1axj s ARG 86 Ca 0.00 -0.83 -0.10 0.00 -0.52 0.00 0.00 55.73 54.28 1axj s ARG 86 Cb 0.02 -0.63 0.03 0.00 0.52 0.00 0.00 34.95 34.90 1axj s ARG 86 CO -0.07 0.14 0.45 0.41 0.02 0.00 0.00 175.30 176.25 1axj n GLY 87 N 1.48 0.91 3.50 -3.53 0.00 -0.42 -0.73 105.19 106.40 1axj n GLY 87 Ca -0.21 -1.00 -0.32 0.00 0.00 0.00 0.00 46.02 44.49 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 -2.05 4.09 0.31 1.61 0.01 -0.33 -1.62 113.70 115.71 1axj s SER 88 Ca 0.10 -0.28 0.08 0.00 1.31 0.00 0.00 55.95 57.17 1axj s SER 88 Cb -0.01 -0.81 -0.04 0.00 0.21 0.00 0.00 66.02 65.37 1axj s SER 88 CO 0.02 0.29 0.13 0.00 0.41 0.00 0.00 173.24 174.09 1axj s ALA 89 N -0.88 3.46 -0.29 1.44 0.00 0.67 -0.75 121.76 125.41 1axj s ALA 89 Ca 0.14 -1.73 -0.10 0.00 0.00 0.00 0.00 51.96 50.27 1axj s ALA 89 Cb -0.11 -0.84 0.12 0.00 0.00 0.00 0.00 23.12 22.29 1axj s ALA 89 CO 0.04 0.11 0.64 0.00 0.00 0.00 0.00 175.76 176.55 1axj s ALA 90 N -2.36 -1.97 0.24 0.00 0.00 0.33 -4.71 121.76 113.29 1axj s ALA 90 Ca 0.36 2.30 -0.30 0.00 0.00 0.00 0.00 51.96 54.32 1axj s ALA 90 Cb -0.04 -1.71 -0.09 0.00 0.00 0.00 0.00 23.12 21.28 1axj s ALA 90 CO 0.23 -0.86 1.13 -0.06 0.00 0.00 0.00 175.76 176.19 1axj s PHE 91 N 2.74 3.54 -0.01 0.00 0.40 -1.26 -1.02 117.98 122.37 1axj s PHE 91 Ca -0.06 1.62 -0.01 0.00 -0.60 0.00 0.00 56.93 57.87 1axj s PHE 91 Cb -0.11 -3.32 -0.00 0.00 0.51 0.00 0.00 43.02 40.09 1axj s PHE 91 CO -0.19 -0.73 0.02 1.03 0.70 0.00 0.00 175.22 176.05 1axj s ARG 92 N -0.99 0.07 -0.31 0.44 1.81 0.08 -4.94 118.95 115.11 1axj s ARG 92 Ca 0.47 -0.06 0.07 0.00 -1.72 0.00 0.00 55.73 54.50 1axj s ARG 92 Cb -0.32 0.03 0.46 0.00 -0.45 0.00 0.00 34.95 34.68 1axj s ARG 92 CO 0.39 -0.01 1.36 0.25 -0.68 0.00 0.00 175.30 176.61 1axj n THR 93 N 2.85 2.58 -3.49 0.02 -2.24 -1.26 -0.51 114.28 112.23 1axj n THR 93 Ca -0.14 -3.49 -0.15 0.00 -2.27 0.00 0.00 64.05 58.00 1axj n THR 93 Cb 0.59 -0.73 -0.04 0.00 -2.10 0.00 0.00 70.33 68.05 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 -3.06 -0.59 0.00 3.42 2.15 -1.26 -5.01 116.67 112.32 1axj s ASP 94 Ca 0.48 0.35 0.00 0.00 0.43 0.00 0.00 52.55 53.81 1axj s ASP 94 Cb 0.41 0.55 0.00 0.00 -0.30 0.00 0.00 42.92 43.59 1axj s ASP 94 CO -0.00 -0.77 0.00 0.61 -0.17 0.00 0.00 175.17 174.84 1axj n GLY 95 N 0.33 -0.55 0.26 2.66 0.00 -1.26 -3.90 105.19 102.73 1axj n GLY 95 Ca -0.18 -1.78 0.18 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 0.35 1.61 0.13 -2.02 -0.49 132.00 131.58 1axj h PRO 96 Ca 0.00 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.11 1axj h PRO 96 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 1axj h PRO 96 CO 0.00 0.00 -0.17 0.93 -0.23 0.00 0.00 178.00 178.53 1axj h GLU 97 N 0.00 -0.45 -0.11 0.86 3.07 -1.99 -1.71 114.58 114.25 1axj h GLU 97 Ca 0.00 0.03 -0.01 0.00 -0.50 0.00 0.00 59.36 58.88 1axj h GLU 97 Cb 0.05 0.10 -0.01 0.00 -0.84 0.00 0.00 28.75 28.06 1axj h GLU 97 CO 0.00 -0.30 0.01 0.35 -1.40 0.00 0.00 179.01 177.68 1axj h PHE 98 N -0.56 0.15 0.45 4.33 3.57 -1.28 -1.63 116.94 121.97 1axj h PHE 98 Ca -0.05 -0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.43 1axj h PHE 98 Cb 0.36 -0.05 0.00 0.00 2.79 0.00 0.00 35.95 39.05 1axj h PHE 98 CO 0.10 0.15 -0.22 0.93 -2.23 0.00 0.00 178.31 177.05 1axj h GLU 99 N 0.16 -0.58 0.00 1.11 5.08 -1.22 0.11 114.58 119.23 1axj h GLU 99 Ca 0.04 0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.43 1axj h GLU 99 Cb 0.09 0.13 -0.00 0.00 0.50 0.00 0.00 28.75 29.47 1axj h GLU 99 CO -0.00 -0.29 -0.04 0.00 -1.00 0.00 0.00 179.01 177.67 1axj h ALA 100 N -0.81 1.47 0.00 3.43 0.00 -1.11 -1.05 119.26 121.19 1axj h ALA 100 Ca -0.06 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1axj h ALA 100 Cb 0.56 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.34 1axj h ALA 100 CO 0.10 0.06 -0.67 -0.84 0.00 0.00 0.00 179.25 177.90 1axj h ILE 101 N 0.00 0.00 -0.91 0.00 -0.00 -1.24 -3.36 117.51 112.00 1axj h ILE 101 Ca -0.00 -0.81 0.26 0.00 -0.00 0.00 0.00 64.86 64.31 1axj h ILE 101 Cb 0.12 1.44 -0.04 0.00 -0.00 0.00 0.00 36.82 38.34 1axj h ILE 101 CO 0.01 0.00 0.78 0.00 -0.00 0.00 0.00 178.15 178.93 1axj h ALA 102 N 2.19 2.78 -0.16 0.16 0.00 0.61 -0.88 119.26 123.95 1axj h ALA 102 Ca 0.00 -0.03 0.05 0.00 0.00 0.00 0.00 54.91 54.92 1axj h ALA 102 Cb 0.91 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.76 1axj h ALA 102 CO 0.00 -1.25 0.58 0.07 0.00 0.00 0.00 179.25 178.66 1axj h ARG 103 N 0.00 0.00 -7.82 0.00 0.11 -1.71 -3.42 114.38 101.54 1axj h ARG 103 Ca 0.43 0.00 -0.45 0.00 0.10 0.00 0.00 59.98 60.07 1axj h ARG 103 Cb 1.98 0.00 0.17 0.00 1.11 0.00 0.00 29.97 33.23 1axj h ARG 103 CO -0.00 0.00 0.41 -0.06 0.10 0.00 0.00 179.97 180.42 1axj s PHE 104 N -4.19 1.47 -0.01 4.08 0.08 -0.34 -5.04 117.98 114.03 1axj s PHE 104 Ca -0.03 0.25 0.01 0.00 0.12 0.00 0.00 56.93 57.29 1axj s PHE 104 Cb 0.08 -4.13 0.02 0.00 -0.57 0.00 0.00 43.02 38.43 1axj s PHE 104 CO 0.28 -2.69 0.80 1.17 -0.10 0.00 0.00 175.22 174.67 1axj n LYS 105 N -3.77 1.32 0.00 0.44 4.81 -1.26 -4.74 118.16 114.96 1axj n LYS 105 Ca 0.16 -1.11 0.00 0.00 -0.87 0.00 0.00 58.31 56.49 1axj n LYS 105 Cb 0.59 -0.78 0.00 0.00 0.02 0.00 0.00 35.03 34.86 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 -0.32 0.00 -2.73 5.64 4.27 -1.26 -5.08 117.44 117.96 1axj n TRP 106 Ca 0.01 -0.17 -0.36 0.00 -3.89 0.00 0.00 57.50 53.08 1axj n TRP 106 Cb 0.43 -0.02 -0.06 0.00 -1.36 0.00 0.00 31.31 30.30 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 -0.35 3.17 0.00 -1.67 0.00 -1.26 -4.19 121.76 117.46 1axj s ALA 107 Ca 0.00 0.55 0.00 0.00 0.00 0.00 0.00 51.96 52.51 1axj s ALA 107 Cb 0.00 -3.20 0.00 0.00 0.00 0.00 0.00 23.12 19.92 1axj s ALA 107 CO 0.00 0.09 0.00 -2.13 0.00 0.00 0.00 175.76 173.72 1axj n ARG 108 N 0.32 0.53 -3.56 0.00 3.00 0.38 -4.92 116.66 112.40 1axj n ARG 108 Ca 0.03 0.00 -0.06 0.00 -0.00 0.00 0.00 57.85 57.82 1axj n ARG 108 Cb 0.50 -0.99 -0.02 0.00 0.00 0.00 0.00 32.46 31.96 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 -1.96 -1.87 -0.38 5.13 0.00 -0.66 -4.89 121.76 117.13 1axj s ALA 109 Ca 0.00 0.98 -0.08 0.00 0.00 0.00 0.00 51.96 52.86 1axj s ALA 109 Cb 0.00 0.34 0.05 0.00 0.00 0.00 0.00 23.12 23.51 1axj s ALA 109 CO 0.00 -0.74 0.18 0.00 0.00 0.00 0.00 175.76 175.20 1axj s ALA 110 N -2.97 3.18 -0.90 0.00 0.00 0.33 -1.38 121.76 120.03 1axj s ALA 110 Ca 0.07 -1.91 -0.25 0.00 0.00 0.00 0.00 51.96 49.88 1axj s ALA 110 Cb -0.01 -2.48 0.03 0.00 0.00 0.00 0.00 23.12 20.67 1axj s ALA 110 CO -0.06 -1.47 1.44 -1.17 0.00 0.00 0.00 175.76 174.49 1axj s LEU 111 N 1.43 3.35 0.03 0.00 2.96 0.11 -0.74 118.68 125.82 1axj s LEU 111 Ca 0.01 -0.97 -0.30 0.00 -0.22 0.00 0.00 54.13 52.65 1axj s LEU 111 Cb -0.21 -2.56 -0.04 0.00 0.50 0.00 0.00 46.19 43.88 1axj s LEU 111 CO 0.03 -1.74 1.01 -0.69 -1.32 0.00 0.00 176.35 173.64 1axj s VAL 112 N 5.76 4.66 -0.10 1.68 1.01 -0.19 -1.01 120.40 132.21 1axj s VAL 112 Ca 0.45 1.96 0.04 0.00 0.00 0.00 0.00 61.98 64.42 1axj s VAL 112 Cb -0.04 -4.25 0.00 0.00 0.00 0.00 0.00 36.38 32.09 1axj s VAL 112 CO 0.01 0.18 -0.22 -0.63 0.00 0.00 0.00 175.10 174.44 1axj s ILE 113 N 0.83 1.91 -0.44 2.22 1.01 0.18 -0.51 121.20 126.40 1axj s ILE 113 Ca 0.52 -0.93 -0.04 0.00 0.00 0.00 0.00 60.65 60.20 1axj s ILE 113 Cb -0.23 -1.67 0.12 0.00 0.01 0.00 0.00 42.46 40.69 1axj s ILE 113 CO 0.29 0.53 0.25 -0.89 0.00 0.00 0.00 174.94 175.11 1axj s THR 114 N 0.44 3.47 0.94 2.92 2.01 0.07 -1.65 115.64 123.84 1axj s THR 114 Ca -0.17 -2.11 -0.10 0.00 0.31 0.00 0.00 61.69 59.61 1axj s THR 114 Cb -0.17 -3.35 0.16 0.00 0.01 0.00 0.00 72.50 69.15 1axj s THR 114 CO 0.07 -0.72 1.13 -0.69 -0.69 0.00 0.00 174.62 173.72 1axj s VAL 115 N 1.05 2.12 0.01 3.82 1.01 -1.25 -1.19 120.40 125.97 1axj s VAL 115 Ca 0.09 0.04 0.00 0.00 0.00 0.00 0.00 61.98 62.11 1axj s VAL 115 Cb -0.23 -2.09 0.00 0.00 0.00 0.00 0.00 36.38 34.06 1axj s VAL 115 CO -0.04 -0.05 0.00 0.52 0.00 0.00 0.00 175.10 175.53 1axj n VAL 116 N -4.30 0.13 -3.74 2.92 0.31 0.09 -4.85 118.33 108.89 1axj n VAL 116 Ca 0.10 0.04 -0.13 0.00 -0.01 0.00 0.00 64.34 64.35 1axj n VAL 116 Cb 0.52 -1.46 -0.10 0.00 -0.91 0.00 0.00 33.84 31.89 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 -5.11 -0.39 0.06 4.52 0.01 -1.16 -5.04 113.70 106.59 1axj s SER 117 Ca 0.00 0.73 0.08 0.00 1.31 0.00 0.00 55.95 58.07 1axj s SER 117 Cb 0.00 0.76 -0.03 0.00 0.21 0.00 0.00 66.02 66.95 1axj s SER 117 CO 0.00 -0.17 -0.20 0.00 0.41 0.00 0.00 173.24 173.28 1axj s ALA 118 N 0.05 2.56 0.01 1.44 0.00 -1.26 -1.74 121.76 122.81 1axj s ALA 118 Ca -0.01 -1.25 0.01 0.00 0.00 0.00 0.00 51.96 50.70 1axj s ALA 118 Cb -0.03 -0.66 -0.01 0.00 0.00 0.00 0.00 23.12 22.42 1axj s ALA 118 CO 0.01 0.57 -0.02 -1.83 0.00 0.00 0.00 175.76 174.49 1axj s GLU 119 N -1.60 0.19 0.07 0.00 -1.05 -0.38 -4.96 118.70 110.98 1axj s GLU 119 Ca 0.15 -0.21 -0.29 0.00 -0.15 0.00 0.00 54.97 54.47 1axj s GLU 119 Cb -0.10 -0.09 -0.05 0.00 -0.44 0.00 0.00 34.13 33.44 1axj s GLU 119 CO 0.06 0.02 0.92 -1.14 0.95 0.00 0.00 175.26 176.07 1axj s GLN 120 N -0.42 4.62 0.04 -4.83 0.74 -1.26 -0.84 119.66 117.70 1axj s GLN 120 Ca -0.03 1.35 0.00 0.00 0.05 0.00 0.00 55.36 56.73 1axj s GLN 120 Cb -0.03 -3.39 0.00 0.00 1.10 0.00 0.00 33.01 30.69 1axj s GLN 120 CO -0.00 0.17 0.00 0.25 -0.55 0.00 0.00 175.29 175.16 1axj n THR 121 N 3.05 0.04 1.58 -0.34 -2.24 -0.55 -4.89 114.28 110.92 1axj n THR 121 Ca 0.02 0.01 0.13 0.00 -2.27 0.00 0.00 64.05 61.94 1axj n THR 121 Cb 0.50 -0.31 0.75 0.00 -2.10 0.00 0.00 70.33 69.16 1axj n THR 121 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50