#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 3.10 0.78 4.03 1.43 -1.26 -5.00 118.68 121.76 1axj s LEU 2 Ca 0.00 2.21 -0.11 0.00 -1.03 0.00 0.00 54.13 55.20 1axj s LEU 2 Cb 0.00 -4.57 0.06 0.00 0.03 0.00 0.00 46.19 41.71 1axj s LEU 2 CO 0.00 -2.54 1.09 -2.16 0.23 0.00 0.00 176.35 172.97 1axj s PRO 3 N -4.34 2.20 0.26 1.29 0.04 -1.26 -4.94 135.00 128.24 1axj s PRO 3 Ca 0.69 1.16 -0.05 0.00 0.04 0.00 0.00 61.00 62.85 1axj s PRO 3 Cb -0.25 -1.89 0.30 0.00 0.04 0.00 0.00 34.50 32.70 1axj s PRO 3 CO 0.52 -1.69 1.90 0.78 0.04 0.00 0.00 177.00 178.55 1axj h GLY 4 N -1.16 1.28 0.32 0.56 0.00 -2.01 -2.50 103.07 99.55 1axj h GLY 4 Ca -0.44 -0.55 0.16 0.00 0.00 0.00 0.00 47.33 46.51 1axj h GLY 4 CO 0.51 0.53 0.61 -0.84 0.00 0.00 0.00 176.54 177.35 1axj h THR 5 N 1.21 0.79 -0.34 4.70 2.02 -1.98 -0.74 112.91 118.57 1axj h THR 5 Ca 0.31 -0.27 0.07 0.00 0.77 0.00 0.00 66.41 67.30 1axj h THR 5 Cb -0.02 -0.05 -0.08 0.00 -1.74 0.00 0.00 68.15 66.26 1axj h THR 5 CO -0.06 0.14 -0.19 0.15 0.37 0.00 0.00 175.52 175.94 1axj h PHE 6 N 0.78 -0.48 -0.16 3.16 3.57 -1.81 -0.07 116.94 121.91 1axj h PHE 6 Ca 0.52 0.04 0.00 0.00 3.53 0.00 0.00 57.97 62.06 1axj h PHE 6 Cb 0.78 0.26 -0.01 0.00 2.79 0.00 0.00 35.95 39.78 1axj h PHE 6 CO -0.00 -0.27 0.11 0.74 -2.23 0.00 0.00 178.31 176.65 1axj h PHE 7 N -0.14 0.20 -0.87 0.41 0.04 -1.27 -1.62 116.94 113.69 1axj h PHE 7 Ca 0.17 0.00 0.12 0.00 2.80 0.00 0.00 57.97 61.07 1axj h PHE 7 Cb 0.41 -0.07 -0.07 0.00 2.20 0.00 0.00 35.95 38.42 1axj h PHE 7 CO -0.40 0.13 0.56 0.93 -0.60 0.00 0.00 178.31 178.94 1axj h GLU 8 N 0.22 0.72 -0.22 1.51 4.39 -0.66 0.71 114.58 121.25 1axj h GLU 8 Ca 0.06 -0.04 -0.07 0.00 0.34 0.00 0.00 59.36 59.64 1axj h GLU 8 Cb -0.02 -0.16 -0.00 0.00 -0.10 0.00 0.00 28.75 28.46 1axj h GLU 8 CO -0.01 0.48 -0.16 0.28 -1.16 0.00 0.00 179.01 178.44 1axj h VAL 9 N 0.74 1.32 -0.65 3.13 2.07 -0.77 -3.22 116.25 118.86 1axj h VAL 9 Ca 0.42 -1.28 0.05 0.00 0.82 0.00 0.00 66.70 66.72 1axj h VAL 9 Cb 0.59 1.68 -0.05 0.00 -1.52 0.00 0.00 31.29 31.99 1axj h VAL 9 CO -0.18 0.39 0.37 -0.07 0.02 0.00 0.00 177.57 178.10 1axj h LEU 10 N 0.18 0.56 -1.59 2.57 3.38 -0.23 -0.96 115.31 119.22 1axj h LEU 10 Ca 0.04 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.04 1axj h LEU 10 Cb 0.68 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.34 1axj h LEU 10 CO 0.04 0.37 0.39 0.11 0.09 0.00 0.00 178.44 179.44 1axj h LYS 11 N 0.70 0.00 -6.21 1.13 1.57 -0.92 -3.42 116.57 109.41 1axj h LYS 11 Ca 0.29 0.00 -0.54 0.00 -1.87 0.00 0.00 60.65 58.53 1axj h LYS 11 Cb 0.15 0.00 -0.07 0.00 0.08 0.00 0.00 32.23 32.39 1axj h LYS 11 CO -0.16 0.00 -0.57 -0.80 -0.57 0.00 0.00 179.45 177.35 1axj s ASN 12 N -4.09 5.26 0.42 0.86 0.01 -0.37 -5.10 114.94 111.92 1axj s ASN 12 Ca -0.03 -0.32 -0.23 0.00 -0.71 0.00 0.00 52.86 51.58 1axj s ASN 12 Cb 0.07 -1.26 -0.09 0.00 0.41 0.00 0.00 41.25 40.37 1axj s ASN 12 CO 0.22 0.00 1.01 -0.70 -1.51 0.00 0.00 177.10 176.12 1axj s GLU 13 N -3.57 4.15 0.00 -0.60 2.12 -1.26 -4.78 118.70 114.76 1axj s GLU 13 Ca 0.32 1.35 0.00 0.00 0.36 0.00 0.00 54.97 57.00 1axj s GLU 13 Cb -0.08 -2.38 0.00 0.00 0.26 0.00 0.00 34.13 31.92 1axj s GLU 13 CO 0.23 -0.12 0.00 0.41 -0.54 0.00 0.00 175.26 175.24 1axj n GLY 14 N -0.00 1.33 3.80 -1.50 0.00 -1.26 -4.28 105.19 103.28 1axj n GLY 14 Ca 0.06 -0.94 -0.34 0.00 0.00 0.00 0.00 46.02 44.80 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 4.03 0.13 1.61 1.01 -1.23 -1.10 120.40 122.85 1axj s VAL 15 Ca 0.00 1.33 0.02 0.00 0.00 0.00 0.00 61.98 63.33 1axj s VAL 15 Cb 0.00 -3.57 -0.04 0.00 0.00 0.00 0.00 36.38 32.76 1axj s VAL 15 CO 0.00 -0.21 -0.04 -0.69 0.00 0.00 0.00 175.10 174.17 1axj s VAL 16 N -1.98 0.70 0.07 2.92 1.01 0.58 -1.66 120.40 122.04 1axj s VAL 16 Ca 0.63 -1.96 -0.11 0.00 0.00 0.00 0.00 61.98 60.54 1axj s VAL 16 Cb -0.15 -1.89 0.01 0.00 0.00 0.00 0.00 36.38 34.36 1axj s VAL 16 CO 0.19 -0.69 0.25 0.00 0.00 0.00 0.00 175.10 174.84 1axj s ALA 17 N -3.63 -0.46 -0.04 5.51 0.00 0.59 -1.18 121.76 122.54 1axj s ALA 17 Ca 0.18 -0.29 -0.02 0.00 0.00 0.00 0.00 51.96 51.82 1axj s ALA 17 Cb 0.05 0.41 0.03 0.00 0.00 0.00 0.00 23.12 23.61 1axj s ALA 17 CO -0.01 -0.46 0.05 0.42 0.00 0.00 0.00 175.76 175.77 1axj s ILE 18 N -3.14 -0.04 -0.47 0.00 1.01 -0.53 -0.89 121.20 117.13 1axj s ILE 18 Ca -0.01 0.39 -0.23 0.00 0.00 0.00 0.00 60.65 60.80 1axj s ILE 18 Cb 0.01 -0.20 0.03 0.00 0.01 0.00 0.00 42.46 42.31 1axj s ILE 18 CO -0.07 0.19 0.79 0.00 0.00 0.00 0.00 174.94 175.85 1axj s ALA 19 N 2.13 3.28 -0.38 9.38 0.00 0.41 -0.78 121.76 135.81 1axj s ALA 19 Ca 0.05 -1.14 -0.21 0.00 0.00 0.00 0.00 51.96 50.66 1axj s ALA 19 Cb -0.12 -3.50 0.01 0.00 0.00 0.00 0.00 23.12 19.51 1axj s ALA 19 CO -0.03 -2.01 0.66 0.99 0.00 0.00 0.00 175.76 175.37 1axj s THR 20 N 3.31 4.85 0.11 0.00 2.01 -0.44 -1.36 115.64 124.12 1axj s THR 20 Ca 0.28 0.51 -0.30 0.00 0.31 0.00 0.00 61.69 62.48 1axj s THR 20 Cb -0.13 -4.13 -0.07 0.00 0.01 0.00 0.00 72.50 68.19 1axj s THR 20 CO 0.21 -0.40 1.22 -1.58 -0.69 0.00 0.00 174.62 173.37 1axj s GLN 21 N 2.80 4.44 0.00 4.92 2.00 -0.05 -0.66 119.66 133.11 1axj s GLN 21 Ca 0.25 1.83 0.00 0.00 -2.00 0.00 0.00 55.36 55.44 1axj s GLN 21 Cb -0.14 -3.30 0.00 0.00 0.80 0.00 0.00 33.01 30.37 1axj s GLN 21 CO 0.16 -0.22 0.00 0.41 -0.50 0.00 0.00 175.29 175.15 1axj n GLY 22 N 2.91 0.04 1.72 2.59 0.00 -1.26 -4.01 105.19 107.17 1axj n GLY 22 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.10 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 -1.13 0.00 -0.36 1.61 2.13 -1.26 -4.55 120.64 117.07 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 -0.01 0.00 0.00 0.27 0.00 0.00 31.44 31.70 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 -2.36 4.48 -0.14 4.31 5.75 -1.26 -4.89 116.55 122.44 1axj n ASP 24 Ca 0.00 -2.21 0.00 0.00 -0.01 0.00 0.00 54.79 52.57 1axj n ASP 24 Cb 0.00 -0.92 -0.00 0.00 -1.03 0.00 0.00 41.12 39.17 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 1.31 -2.86 3.72 6.12 0.00 -1.26 -4.86 105.19 107.36 1axj n GLY 25 Ca 0.00 -1.29 -0.38 0.00 0.00 0.00 0.00 46.02 44.35 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 -1.73 1.38 -3.92 1.61 -0.04 -1.26 -4.31 135.00 126.72 1axj n PRO 26 Ca -0.00 0.52 -0.33 0.00 -0.04 0.00 0.00 63.50 63.65 1axj n PRO 26 Cb 0.05 -2.51 -0.14 0.00 -0.04 0.00 0.00 33.50 30.86 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 -1.35 3.63 -1.00 0.54 2.46 0.16 -4.75 115.29 114.99 1axj s HIS 27 Ca 0.76 -2.66 -0.23 0.00 0.47 0.00 0.00 55.06 53.40 1axj s HIS 27 Cb -0.41 -2.91 0.00 0.00 -0.13 0.00 0.00 32.58 29.14 1axj s HIS 27 CO 0.46 -0.94 1.71 -1.17 -2.47 0.00 0.00 174.74 172.32 1axj s LEU 28 N 1.03 3.35 0.83 8.88 2.96 -1.25 -1.33 118.68 133.15 1axj s LEU 28 Ca 0.07 -1.21 -0.12 0.00 -0.22 0.00 0.00 54.13 52.65 1axj s LEU 28 Cb -0.21 -2.57 0.09 0.00 0.50 0.00 0.00 46.19 44.01 1axj s LEU 28 CO -0.06 -2.11 1.15 0.68 -1.32 0.00 0.00 176.35 174.69 1axj s VAL 29 N 7.47 2.24 0.36 1.68 -7.23 0.04 -4.82 120.40 120.14 1axj s VAL 29 Ca 0.58 0.08 0.09 0.00 -1.81 0.00 0.00 61.98 60.92 1axj s VAL 29 Cb -0.03 -2.98 -0.07 0.00 0.56 0.00 0.00 36.38 33.87 1axj s VAL 29 CO -0.03 -0.10 -0.06 0.20 -0.31 0.00 0.00 175.10 174.79 1axj s ASN 30 N -4.34 3.79 0.16 4.85 0.02 -1.26 -1.45 114.94 116.71 1axj s ASN 30 Ca 0.62 -1.24 -0.24 0.00 -1.02 0.00 0.00 52.86 50.99 1axj s ASN 30 Cb -0.12 -0.37 0.08 0.00 0.02 0.00 0.00 41.25 40.85 1axj s ASN 30 CO 0.51 -0.27 1.04 0.28 0.02 0.00 0.00 177.10 178.68 1axj s THR 31 N -2.63 0.00 0.00 1.60 -1.32 -0.32 -4.91 115.64 108.05 1axj s THR 31 Ca 0.33 -0.57 0.08 0.00 -1.21 0.00 0.00 61.69 60.32 1axj s THR 31 Cb 0.04 -2.60 -0.02 0.00 -1.51 0.00 0.00 72.50 68.41 1axj s THR 31 CO 0.17 0.00 -0.25 0.26 -2.21 0.00 0.00 174.62 172.59 1axj s TRP 32 N -2.47 2.18 0.54 9.09 0.52 -1.26 -0.31 118.94 127.23 1axj s TRP 32 Ca 0.19 -0.41 0.32 0.00 0.02 0.00 0.00 56.10 56.22 1axj s TRP 32 Cb -0.02 -1.37 1.49 0.00 -1.15 0.00 0.00 33.47 32.42 1axj s TRP 32 CO 0.04 0.02 1.88 -0.91 0.02 0.00 0.00 176.95 178.00 1axj h ASN 33 N 5.27 0.00 0.00 2.95 2.35 -1.42 -0.10 115.58 124.63 1axj h ASN 33 Ca -0.43 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.32 1axj h ASN 33 Cb 1.13 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.50 1axj h ASN 33 CO 0.46 0.00 0.24 -1.28 -1.65 0.00 0.00 177.43 175.20 1axj h SER 34 N 0.00 0.00 -0.00 5.81 0.87 -1.87 -1.50 113.55 116.86 1axj h SER 34 Ca 0.43 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.99 1axj h SER 34 Cb 1.74 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.70 1axj h SER 34 CO -0.00 0.00 -0.04 -1.22 -0.53 0.00 0.00 176.83 175.04 1axj n TYR 35 N -2.92 0.00 -3.21 2.24 4.01 -0.06 -5.05 117.16 112.18 1axj n TYR 35 Ca -0.02 0.00 -0.19 0.00 -0.16 0.00 0.00 57.90 57.53 1axj n TYR 35 Cb 0.29 0.00 0.01 0.00 -0.31 0.00 0.00 39.34 39.33 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 -0.99 3.78 -0.00 7.72 1.43 -0.57 -4.31 118.68 125.74 1axj s LEU 36 Ca 0.02 -0.21 0.01 0.00 -1.03 0.00 0.00 54.13 52.92 1axj s LEU 36 Cb 0.02 -2.77 -0.00 0.00 0.03 0.00 0.00 46.19 43.47 1axj s LEU 36 CO 0.05 -0.62 -0.04 -1.59 0.23 0.00 0.00 176.35 174.37 1axj s LYS 37 N -4.31 0.36 0.06 1.70 -2.85 -0.71 -4.99 119.74 108.99 1axj s LYS 37 Ca 0.50 -0.18 0.01 0.00 -1.00 0.00 0.00 55.97 55.29 1axj s LYS 37 Cb -0.10 -0.34 -0.04 0.00 -2.06 0.00 0.00 37.83 35.30 1axj s LYS 37 CO 0.33 0.09 0.16 0.08 0.10 0.00 0.00 175.35 176.11 1axj s VAL 38 N -0.17 5.10 0.49 1.79 1.01 -1.26 -0.69 120.40 126.68 1axj s VAL 38 Ca 0.01 -0.49 0.02 0.00 0.00 0.00 0.00 61.98 61.52 1axj s VAL 38 Cb -0.02 -3.46 -0.01 0.00 0.00 0.00 0.00 36.38 32.88 1axj s VAL 38 CO -0.00 0.16 0.03 -0.76 0.00 0.00 0.00 175.10 174.53 1axj s LEU 39 N -2.39 2.20 0.00 3.92 1.43 0.86 -4.95 118.68 119.75 1axj s LEU 39 Ca 0.32 -1.68 -0.17 0.00 -1.03 0.00 0.00 54.13 51.57 1axj s LEU 39 Cb -0.13 -0.58 0.24 0.00 0.03 0.00 0.00 46.19 45.75 1axj s LEU 39 CO 0.25 -0.89 1.14 -0.67 0.23 0.00 0.00 176.35 176.41 1axj n ASP 40 N -1.30 -0.73 -2.48 2.29 2.03 -1.26 -3.79 116.55 111.31 1axj n ASP 40 Ca -0.17 -1.32 -0.21 0.00 0.52 0.00 0.00 54.79 53.61 1axj n ASP 40 Cb 0.66 -0.93 -0.00 0.00 -0.72 0.00 0.00 41.12 40.13 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 -3.48 -0.49 2.53 0.27 0.00 -1.26 -1.68 105.19 101.08 1axj n GLY 41 Ca 0.15 0.01 -0.05 0.00 0.00 0.00 0.00 46.02 46.13 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 -2.05 -4.12 -4.77 1.61 0.23 -1.26 -4.83 115.26 100.07 1axj n ASN 42 Ca -0.22 0.11 -0.39 0.00 -0.53 0.00 0.00 54.58 53.55 1axj n ASN 42 Cb 0.67 -2.91 -0.04 0.00 -2.08 0.00 0.00 39.78 35.43 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 -1.97 4.39 0.25 -3.83 3.52 -0.68 -4.16 118.95 116.48 1axj s ARG 43 Ca 0.00 1.75 0.04 0.00 -0.13 0.00 0.00 55.73 57.39 1axj s ARG 43 Cb 0.00 -2.92 -0.05 0.00 -1.56 0.00 0.00 34.95 30.42 1axj s ARG 43 CO 0.00 0.00 0.01 0.42 -0.81 0.00 0.00 175.30 174.92 1axj s ILE 44 N -1.34 1.08 -0.06 4.11 1.01 -0.06 -0.10 121.20 125.85 1axj s ILE 44 Ca 0.50 -2.04 -0.11 0.00 0.00 0.00 0.00 60.65 59.01 1axj s ILE 44 Cb -0.29 -2.44 0.02 0.00 0.01 0.00 0.00 42.46 39.76 1axj s ILE 44 CO 0.38 -0.26 0.27 -0.69 0.00 0.00 0.00 174.94 174.64 1axj s VAL 45 N -3.39 0.03 -0.04 2.92 1.01 0.14 -0.53 120.40 120.54 1axj s VAL 45 Ca 0.30 -0.28 0.05 0.00 0.00 0.00 0.00 61.98 62.06 1axj s VAL 45 Cb 0.06 -0.48 -0.01 0.00 0.00 0.00 0.00 36.38 35.95 1axj s VAL 45 CO 0.10 -0.15 -0.20 -0.69 0.00 0.00 0.00 175.10 174.16 1axj s VAL 46 N -0.61 1.68 -0.14 2.92 1.01 -0.06 -1.75 120.40 123.45 1axj s VAL 46 Ca -0.07 -0.87 -0.29 0.00 0.00 0.00 0.00 61.98 60.75 1axj s VAL 46 Cb -0.04 -1.43 -0.02 0.00 0.00 0.00 0.00 36.38 34.90 1axj s VAL 46 CO 0.02 0.48 1.23 -2.16 0.00 0.00 0.00 175.10 174.66 1axj s PRO 47 N -0.12 4.26 -0.42 2.72 0.04 -1.26 -0.47 135.00 139.76 1axj s PRO 47 Ca -0.02 1.63 -0.25 0.00 0.04 0.00 0.00 61.00 62.41 1axj s PRO 47 Cb -0.12 -3.70 0.02 0.00 0.04 0.00 0.00 34.50 30.74 1axj s PRO 47 CO 0.02 -0.64 0.89 0.54 0.04 0.00 0.00 177.00 177.86 1axj s VAL 48 N 3.16 4.56 -0.01 -0.36 0.11 -0.36 -4.84 120.40 122.66 1axj s VAL 48 Ca 0.54 0.86 0.06 0.00 -2.93 0.00 0.00 61.98 60.51 1axj s VAL 48 Cb -0.22 -4.36 -0.09 0.00 -1.53 0.00 0.00 36.38 30.18 1axj s VAL 48 CO 0.16 -0.68 0.13 0.61 -3.33 0.00 0.00 175.10 171.99 1axj n GLY 49 N 4.72 -0.28 0.89 6.54 0.00 -1.26 -0.68 105.19 115.11 1axj n GLY 49 Ca 0.06 -0.14 -0.05 0.00 0.00 0.00 0.00 46.02 45.88 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 2.19 0.27 2.70 -0.02 0.00 -1.26 -4.97 105.19 104.10 1axj n GLY 50 Ca -0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.59 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 0.00 5.22 0.19 1.61 2.00 -1.26 -4.87 117.12 120.01 1axj n MET 51 Ca -0.22 -4.58 -0.08 0.00 0.00 0.00 0.00 57.70 52.82 1axj n MET 51 Cb 0.60 -2.49 -0.04 0.00 0.00 0.00 0.00 33.22 31.29 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 4.47 -0.51 -0.90 2.03 3.86 -1.99 -0.14 115.15 121.97 1axj h HIS 52 Ca 0.48 -0.01 0.16 0.00 -1.16 0.00 0.00 60.37 59.84 1axj h HIS 52 Cb 0.38 0.17 -0.10 0.00 1.06 0.00 0.00 27.41 28.92 1axj h HIS 52 CO 1.29 -0.32 0.49 -0.22 0.86 0.00 0.00 177.93 180.04 1axj h LYS 53 N -1.06 0.66 -0.78 2.45 3.64 -1.99 -1.25 116.57 118.25 1axj h LYS 53 Ca -0.06 -0.04 -0.02 0.00 -1.27 0.00 0.00 60.65 59.27 1axj h LYS 53 Cb 0.42 -0.15 -0.04 0.00 -0.41 0.00 0.00 32.23 32.06 1axj h LYS 53 CO 0.09 0.44 0.41 1.15 -2.27 0.00 0.00 179.45 179.27 1axj h THR 54 N 0.68 1.23 -0.55 1.00 2.02 -1.95 0.34 112.91 115.68 1axj h THR 54 Ca 0.49 -0.60 0.02 0.00 0.77 0.00 0.00 66.41 67.10 1axj h THR 54 Cb 0.70 0.20 -0.03 0.00 -1.74 0.00 0.00 68.15 67.28 1axj h THR 54 CO -0.36 0.26 0.34 -0.08 0.37 0.00 0.00 175.52 176.06 1axj h GLU 55 N 1.09 0.67 -0.69 6.66 4.81 0.11 -0.13 114.58 127.10 1axj h GLU 55 Ca 0.27 -0.04 -0.06 0.00 -0.13 0.00 0.00 59.36 59.41 1axj h GLU 55 Cb 0.05 -0.15 -0.03 0.00 0.63 0.00 0.00 28.75 29.25 1axj h GLU 55 CO -0.04 0.44 0.20 0.00 -0.73 0.00 0.00 179.01 178.88 1axj h ALA 56 N 1.23 1.06 -0.73 2.92 0.00 -0.43 -1.83 119.26 121.49 1axj h ALA 56 Ca 0.22 -0.22 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 1axj h ALA 56 Cb -0.01 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.48 1axj h ALA 56 CO -0.08 0.63 0.33 -0.91 0.00 0.00 0.00 179.25 179.23 1axj h ASN 57 N 1.02 0.97 -0.14 0.00 4.21 0.35 0.13 115.58 122.12 1axj h ASN 57 Ca 0.22 -0.14 -0.01 0.00 1.21 0.00 0.00 56.30 57.58 1axj h ASN 57 Cb 0.30 -0.25 -0.01 0.00 -1.12 0.00 0.00 38.32 37.25 1axj h ASN 57 CO -0.01 0.84 0.05 0.58 -1.29 0.00 0.00 177.43 177.60 1axj h VAL 58 N 1.02 1.17 -0.32 2.81 2.07 -0.91 0.99 116.25 123.09 1axj h VAL 58 Ca 0.25 -0.53 0.09 0.00 0.82 0.00 0.00 66.70 67.33 1axj h VAL 58 Cb 0.14 1.26 -0.01 0.00 -1.52 0.00 0.00 31.29 31.16 1axj h VAL 58 CO -0.03 0.16 0.34 0.00 0.02 0.00 0.00 177.57 178.06 1axj h ALA 59 N 0.87 2.00 0.11 1.67 0.00 -0.65 -2.77 119.26 120.50 1axj h ALA 59 Ca 0.05 -0.01 -0.15 0.00 0.00 0.00 0.00 54.91 54.79 1axj h ALA 59 Cb 0.21 0.02 0.02 0.00 0.00 0.00 0.00 17.79 18.04 1axj h ALA 59 CO -0.00 -0.50 -0.67 0.00 0.00 0.00 0.00 179.25 178.07 1axj h ARG 60 N 0.00 0.26 -2.77 0.00 2.47 0.35 -3.48 114.38 111.21 1axj h ARG 60 Ca 0.15 -0.43 -0.12 0.00 -1.26 0.00 0.00 59.98 58.32 1axj h ARG 60 Cb 0.83 0.16 -0.24 0.00 -1.65 0.00 0.00 29.97 29.06 1axj h ARG 60 CO -0.00 1.20 -0.26 0.34 0.56 0.00 0.00 179.97 181.81 1axj s ASP 61 N -6.84 -0.42 0.51 7.04 -1.08 0.24 -4.97 116.67 111.14 1axj s ASP 61 Ca -0.14 0.81 0.30 0.00 -0.52 0.00 0.00 52.55 53.00 1axj s ASP 61 Cb 0.00 0.80 1.06 0.00 -1.46 0.00 0.00 42.92 43.33 1axj s ASP 61 CO 0.81 -0.14 1.87 1.05 0.52 0.00 0.00 175.17 179.28 1axj h GLU 62 N 5.69 0.00 -6.35 4.34 -0.00 -1.85 -3.36 114.58 113.06 1axj h GLU 62 Ca -0.28 0.00 -0.53 0.00 -0.00 0.00 0.00 59.36 58.55 1axj h GLU 62 Cb 1.18 0.00 0.02 0.00 -0.00 0.00 0.00 28.75 29.95 1axj h GLU 62 CO 0.26 0.00 1.22 1.03 -0.00 0.00 0.00 179.01 181.52 1axj s ARG 63 N -3.52 4.14 0.04 1.06 1.81 -1.26 -1.01 118.95 120.21 1axj s ARG 63 Ca 0.03 2.57 -0.00 0.00 -1.72 0.00 0.00 55.73 56.61 1axj s ARG 63 Cb 0.08 -4.15 -0.03 0.00 -0.45 0.00 0.00 34.95 30.40 1axj s ARG 63 CO 0.58 -0.95 -0.03 0.14 -0.68 0.00 0.00 175.30 174.35 1axj s VAL 64 N 4.44 0.22 0.12 3.52 -7.23 -0.70 -0.87 120.40 119.90 1axj s VAL 64 Ca 0.87 -1.50 0.06 0.00 -1.81 0.00 0.00 61.98 59.60 1axj s VAL 64 Cb -0.42 -1.09 -0.04 0.00 0.56 0.00 0.00 36.38 35.40 1axj s VAL 64 CO 0.40 -0.81 -0.04 -0.22 -0.31 0.00 0.00 175.10 174.13 1axj s LEU 65 N -2.41 3.27 -0.03 1.32 2.96 -0.47 -1.28 118.68 122.06 1axj s LEU 65 Ca -0.01 -0.31 -0.03 0.00 -0.22 0.00 0.00 54.13 53.56 1axj s LEU 65 Cb 0.01 -2.01 0.01 0.00 0.50 0.00 0.00 46.19 44.70 1axj s LEU 65 CO -0.06 0.15 0.08 -0.32 -1.32 0.00 0.00 176.35 174.88 1axj s MET 66 N -2.44 0.13 -0.06 1.98 -2.45 0.23 -0.44 119.30 116.24 1axj s MET 66 Ca 0.25 0.06 0.02 0.00 -1.25 0.00 0.00 55.69 54.77 1axj s MET 66 Cb -0.11 0.06 0.01 0.00 1.25 0.00 0.00 34.83 36.04 1axj s MET 66 CO 0.17 -0.02 -0.11 0.95 1.05 0.00 0.00 175.02 177.06 1axj s THR 67 N -0.09 1.04 0.32 10.11 -4.23 -0.07 0.05 115.64 122.77 1axj s THR 67 Ca -0.01 -0.43 0.10 0.00 -1.18 0.00 0.00 61.69 60.16 1axj s THR 67 Cb -0.01 -0.95 -0.05 0.00 1.34 0.00 0.00 72.50 72.82 1axj s THR 67 CO 0.00 0.33 -0.03 -1.48 -0.54 0.00 0.00 174.62 172.90 1axj s LEU 68 N 0.63 2.92 0.07 4.79 2.34 -0.69 -0.30 118.68 128.45 1axj s LEU 68 Ca -0.13 -0.98 -0.26 0.00 0.06 0.00 0.00 54.13 52.82 1axj s LEU 68 Cb -0.15 -1.32 0.09 0.00 -0.56 0.00 0.00 46.19 44.25 1axj s LEU 68 CO 0.03 -0.17 1.18 -0.83 -1.06 0.00 0.00 176.35 175.50 1axj s GLY 69 N -3.67 -0.01 0.14 -3.48 0.00 -0.66 -1.19 107.32 98.44 1axj s GLY 69 Ca 0.33 -0.14 -0.09 0.00 0.00 0.00 0.00 44.72 44.82 1axj s GLY 69 CO 0.18 4.36 0.26 -0.45 0.00 0.00 0.00 173.10 177.46 1axj s SER 70 N -3.65 0.05 0.00 1.64 0.15 -0.16 -3.54 113.70 108.20 1axj s SER 70 Ca 0.27 -0.79 0.22 0.00 0.70 0.00 0.00 55.95 56.34 1axj s SER 70 Cb -0.01 0.41 -0.10 0.00 -1.71 0.00 0.00 66.02 64.61 1axj s SER 70 CO 0.02 -0.85 1.00 0.54 1.20 0.00 0.00 173.24 175.15 1axj n ARG 71 N -0.17 0.22 0.00 5.44 5.12 -1.26 -2.37 116.66 123.64 1axj n ARG 71 Ca -0.10 -0.18 0.14 0.00 -1.93 0.00 0.00 57.85 55.79 1axj n ARG 71 Cb 0.63 -1.50 0.65 0.00 -1.16 0.00 0.00 32.46 31.09 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 -1.23 0.25 -4.49 5.56 5.02 -1.26 -4.36 118.16 117.64 1axj n LYS 72 Ca 0.05 -0.02 -0.21 0.00 -2.02 0.00 0.00 58.31 56.11 1axj n LYS 72 Cb 0.35 -1.50 -0.15 0.00 -0.02 0.00 0.00 35.03 33.71 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 -2.77 0.92 0.04 -0.18 1.01 -1.26 -5.05 120.40 113.10 1axj s VAL 73 Ca 0.21 -0.45 -0.30 0.00 0.00 0.00 0.00 61.98 61.44 1axj s VAL 73 Cb 0.20 -0.79 -0.04 0.00 0.00 0.00 0.00 36.38 35.74 1axj s VAL 73 CO 0.51 0.27 1.01 0.00 0.00 0.00 0.00 175.10 176.89 1axj s ALA 74 N 0.02 3.22 0.00 5.51 0.00 -1.26 -1.40 121.76 127.85 1axj s ALA 74 Ca -0.01 0.60 0.00 0.00 0.00 0.00 0.00 51.96 52.55 1axj s ALA 74 Cb -0.08 -3.34 0.00 0.00 0.00 0.00 0.00 23.12 19.70 1axj s ALA 74 CO 0.00 -0.22 0.00 0.41 0.00 0.00 0.00 175.76 175.95 1axj n GLY 75 N 2.79 5.22 0.06 0.00 0.00 -1.17 -4.54 105.19 107.54 1axj n GLY 75 Ca 0.06 -1.58 -0.02 0.00 0.00 0.00 0.00 46.02 44.47 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 -6.40 1.61 3.08 -1.22 -3.43 114.38 108.02 1axj h ARG 76 Ca 0.00 0.00 -0.55 0.00 0.07 0.00 0.00 59.98 59.50 1axj h ARG 76 Cb 0.00 0.00 -0.08 0.00 0.08 0.00 0.00 29.97 29.97 1axj h ARG 76 CO 0.00 0.10 1.00 0.54 -1.07 0.00 0.00 179.97 180.54 1axj s ASN 77 N -5.65 6.28 0.48 7.04 6.03 -1.26 -4.86 114.94 122.99 1axj s ASN 77 Ca -0.04 -0.24 0.00 0.00 -1.03 0.00 0.00 52.86 51.55 1axj s ASN 77 Cb 0.00 -2.55 0.00 0.00 -3.03 0.00 0.00 41.25 35.67 1axj s ASN 77 CO 0.10 -1.67 0.00 0.61 -2.03 0.00 0.00 177.10 174.11 1axj n GLY 78 N 5.24 -0.29 3.56 0.45 0.00 -1.26 -3.82 105.19 109.08 1axj n GLY 78 Ca 0.05 -0.52 -0.29 0.00 0.00 0.00 0.00 46.02 45.26 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 0.00 2.71 0.00 1.61 0.04 -1.26 -3.49 135.00 134.61 1axj s PRO 79 Ca 0.00 -0.64 0.00 0.00 0.04 0.00 0.00 61.00 60.40 1axj s PRO 79 Cb 0.00 -5.15 0.00 0.00 0.04 0.00 0.00 34.50 29.39 1axj s PRO 79 CO 0.00 -3.34 0.00 0.41 0.04 0.00 0.00 177.00 174.11 1axj n GLY 80 N 6.58 0.65 3.79 0.56 0.00 -0.99 -4.55 105.19 111.23 1axj n GLY 80 Ca 0.41 0.60 -0.30 0.00 0.00 0.00 0.00 46.02 46.72 1axj n GLY 80 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1axj n THR 81 N 0.00 0.00 -1.88 2.61 5.66 -0.49 -3.05 114.28 117.13 1axj n THR 81 Ca 0.00 -2.35 0.00 0.00 -3.05 0.00 0.00 64.05 58.65 1axj n THR 81 Cb 0.00 0.27 0.00 0.00 -1.55 0.00 0.00 70.33 69.05 1axj n THR 81 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1axj n GLY 82 N -1.44 -0.63 3.28 1.09 0.00 -1.26 -0.98 105.19 105.24 1axj n GLY 82 Ca -0.13 -0.57 -0.11 0.00 0.00 0.00 0.00 46.02 45.21 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 -3.42 -0.12 -0.19 1.61 0.08 -0.34 -4.68 117.98 110.93 1axj s PHE 83 Ca 0.00 -0.11 -0.09 0.00 0.12 0.00 0.00 56.93 56.85 1axj s PHE 83 Cb 0.00 0.14 -0.05 0.00 -0.57 0.00 0.00 43.02 42.55 1axj s PHE 83 CO 0.00 -0.59 0.11 -1.17 -0.10 0.00 0.00 175.22 173.47 1axj s LEU 84 N -2.44 4.11 0.05 -0.37 1.98 -0.28 -1.70 118.68 120.02 1axj s LEU 84 Ca -0.01 0.21 0.02 0.00 -2.89 0.00 0.00 54.13 51.46 1axj s LEU 84 Cb 0.01 -2.05 -0.03 0.00 0.66 0.00 0.00 46.19 44.78 1axj s LEU 84 CO -0.07 0.20 -0.06 -0.63 -1.89 0.00 0.00 176.35 173.90 1axj s ILE 85 N 0.21 0.47 -0.01 6.68 1.01 0.11 -0.64 121.20 129.02 1axj s ILE 85 Ca 0.07 -1.24 0.08 0.00 0.00 0.00 0.00 60.65 59.57 1axj s ILE 85 Cb -0.11 -0.78 -0.02 0.00 0.01 0.00 0.00 42.46 41.55 1axj s ILE 85 CO -0.01 -0.53 -0.25 -0.13 0.00 0.00 0.00 174.94 174.02 1axj s ARG 86 N -2.08 2.08 0.03 2.79 0.52 0.03 -0.60 118.95 121.72 1axj s ARG 86 Ca -0.06 -0.95 -0.02 0.00 -0.52 0.00 0.00 55.73 54.18 1axj s ARG 86 Cb -0.06 -2.05 0.01 0.00 0.52 0.00 0.00 34.95 33.36 1axj s ARG 86 CO -0.01 0.56 0.11 0.41 0.02 0.00 0.00 175.30 176.38 1axj n GLY 87 N 2.31 1.53 3.36 -3.53 0.00 -0.40 -0.81 105.19 107.65 1axj n GLY 87 Ca -0.16 -0.99 -0.28 0.00 0.00 0.00 0.00 46.02 44.59 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 -1.26 3.12 0.34 1.61 0.01 0.17 -1.72 113.70 115.96 1axj s SER 88 Ca 0.02 -0.71 0.08 0.00 1.31 0.00 0.00 55.95 56.65 1axj s SER 88 Cb -0.00 -0.21 -0.03 0.00 0.21 0.00 0.00 66.02 65.98 1axj s SER 88 CO 0.01 0.17 0.26 0.00 0.41 0.00 0.00 173.24 174.09 1axj s ALA 89 N -1.04 3.77 -0.30 1.44 0.00 -0.18 -0.71 121.76 124.75 1axj s ALA 89 Ca 0.12 -1.69 -0.15 0.00 0.00 0.00 0.00 51.96 50.24 1axj s ALA 89 Cb -0.10 -1.08 0.16 0.00 0.00 0.00 0.00 23.12 22.10 1axj s ALA 89 CO 0.05 0.01 0.96 0.00 0.00 0.00 0.00 175.76 176.78 1axj s ALA 90 N -2.33 -2.59 0.48 0.00 0.00 0.86 -4.81 121.76 113.37 1axj s ALA 90 Ca 0.40 2.10 -0.20 0.00 0.00 0.00 0.00 51.96 54.26 1axj s ALA 90 Cb -0.05 -1.98 -0.09 0.00 0.00 0.00 0.00 23.12 21.01 1axj s ALA 90 CO 0.26 -0.85 1.01 -0.06 0.00 0.00 0.00 175.76 176.12 1axj s PHE 91 N 2.30 3.10 -0.01 0.00 0.08 -1.26 -0.88 117.98 121.30 1axj s PHE 91 Ca -0.04 1.57 -0.01 0.00 0.12 0.00 0.00 56.93 58.57 1axj s PHE 91 Cb -0.06 -2.99 0.01 0.00 -0.57 0.00 0.00 43.02 39.41 1axj s PHE 91 CO -0.17 -0.65 0.03 1.03 -0.10 0.00 0.00 175.22 175.36 1axj s ARG 92 N -3.35 0.03 -0.18 0.44 3.00 0.37 -4.91 118.95 114.35 1axj s ARG 92 Ca 0.65 0.06 0.13 0.00 0.00 0.00 0.00 55.73 56.57 1axj s ARG 92 Cb -0.14 -0.01 0.41 0.00 0.00 0.00 0.00 34.95 35.22 1axj s ARG 92 CO 0.20 -0.02 1.21 0.25 0.00 0.00 0.00 175.30 176.94 1axj n THR 93 N 3.17 1.96 -3.48 0.02 -2.24 -1.26 -0.06 114.28 112.39 1axj n THR 93 Ca -0.14 -2.96 -0.12 0.00 -2.27 0.00 0.00 64.05 58.57 1axj n THR 93 Cb 0.59 -0.11 -0.03 0.00 -2.10 0.00 0.00 70.33 68.68 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 -3.09 -0.48 0.00 3.42 2.15 -1.26 -5.02 116.67 112.40 1axj s ASP 94 Ca 0.37 -0.09 0.00 0.00 0.43 0.00 0.00 52.55 53.26 1axj s ASP 94 Cb 0.37 0.57 0.00 0.00 -0.30 0.00 0.00 42.92 43.56 1axj s ASP 94 CO -0.07 -0.95 0.00 0.61 -0.17 0.00 0.00 175.17 174.59 1axj n GLY 95 N -0.34 -0.60 0.20 2.66 0.00 -1.26 -3.01 105.19 102.84 1axj n GLY 95 Ca -0.16 -1.76 0.14 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 0.26 1.61 0.13 -2.03 -0.88 132.00 131.09 1axj h PRO 96 Ca 0.00 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.12 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 -0.12 0.93 -0.23 0.00 0.00 178.00 178.58 1axj h GLU 97 N 0.00 -0.33 -0.11 0.86 3.07 -1.99 -1.68 114.58 114.40 1axj h GLU 97 Ca 0.00 0.02 -0.01 0.00 -0.50 0.00 0.00 59.36 58.87 1axj h GLU 97 Cb 0.12 0.08 -0.01 0.00 -0.84 0.00 0.00 28.75 28.10 1axj h GLU 97 CO 0.00 -0.22 0.02 0.35 -1.40 0.00 0.00 179.01 177.75 1axj h PHE 98 N -0.42 0.15 0.56 4.33 3.57 -1.25 -1.33 116.94 122.55 1axj h PHE 98 Ca -0.04 -0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.44 1axj h PHE 98 Cb 0.26 -0.05 0.01 0.00 2.79 0.00 0.00 35.95 38.96 1axj h PHE 98 CO 0.12 0.15 -0.27 0.93 -2.23 0.00 0.00 178.31 177.01 1axj h GLU 99 N 0.16 -0.72 0.00 1.11 5.08 -1.28 0.58 114.58 119.51 1axj h GLU 99 Ca 0.04 0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.45 1axj h GLU 99 Cb 0.09 0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.50 1axj h GLU 99 CO -0.00 -0.46 0.00 0.00 -1.00 0.00 0.00 179.01 177.55 1axj h ALA 100 N -1.11 1.00 0.00 3.43 0.00 -1.08 -0.60 119.26 120.89 1axj h ALA 100 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1axj h ALA 100 Cb 0.60 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.39 1axj h ALA 100 CO 0.13 0.00 -1.08 0.44 0.00 0.00 0.00 179.25 178.74 1axj n ILE 101 N -2.99 0.41 -0.16 0.00 -6.64 -0.52 -4.37 119.36 105.09 1axj n ILE 101 Ca -0.02 -0.44 0.29 0.00 -1.77 0.00 0.00 62.75 60.81 1axj n ILE 101 Cb 0.10 -0.15 0.70 0.00 -1.44 0.00 0.00 39.64 38.86 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 2.76 -0.99 -1.28 0.00 0.79 0.00 119.26 122.73 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 0.90 0.07 -0.10 0.00 0.00 0.00 0.00 17.79 18.67 1axj h ALA 102 CO 0.00 -1.25 0.62 0.07 0.00 0.00 0.00 179.25 178.70 1axj h ARG 103 N 0.00 0.55 -7.64 0.00 0.11 -1.76 -3.41 114.38 102.23 1axj h ARG 103 Ca 0.43 -0.03 -0.43 0.00 0.10 0.00 0.00 59.98 60.04 1axj h ARG 103 Cb 1.99 -0.12 0.18 0.00 1.11 0.00 0.00 29.97 33.12 1axj h ARG 103 CO -0.00 0.36 0.30 -0.06 0.10 0.00 0.00 179.97 180.67 1axj s PHE 104 N -5.65 1.11 0.00 4.08 0.08 -0.02 -5.03 117.98 112.56 1axj s PHE 104 Ca -0.10 0.40 0.00 0.00 0.12 0.00 0.00 56.93 57.35 1axj s PHE 104 Cb 0.25 -3.83 0.00 0.00 -0.57 0.00 0.00 43.02 38.87 1axj s PHE 104 CO 0.80 -3.19 0.00 1.17 -0.10 0.00 0.00 175.22 173.90 1axj n LYS 105 N -4.20 0.00 -0.21 0.44 4.81 -1.26 -4.73 118.16 113.01 1axj n LYS 105 Ca 0.14 0.00 0.09 0.00 -0.87 0.00 0.00 58.31 57.67 1axj n LYS 105 Cb 0.59 -0.42 0.25 0.00 0.02 0.00 0.00 35.03 35.47 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 0.00 0.55 -3.26 5.64 4.27 -1.26 -4.90 117.44 118.48 1axj n TRP 106 Ca 0.00 -0.27 -0.38 0.00 -3.89 0.00 0.00 57.50 52.95 1axj n TRP 106 Cb 0.23 0.00 -0.06 0.00 -1.36 0.00 0.00 31.31 30.12 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 -1.45 3.45 -0.43 -1.67 0.00 -1.26 -4.00 121.76 116.40 1axj s ALA 107 Ca 0.34 -0.14 0.22 0.00 0.00 0.00 0.00 51.96 52.38 1axj s ALA 107 Cb 0.18 -2.71 -0.25 0.00 0.00 0.00 0.00 23.12 20.34 1axj s ALA 107 CO 0.24 -0.04 0.70 -2.13 0.00 0.00 0.00 175.76 174.53 1axj n ARG 108 N 3.75 0.39 -3.55 0.00 0.63 0.14 -4.97 116.66 113.05 1axj n ARG 108 Ca -0.06 -0.10 -0.07 0.00 -0.92 0.00 0.00 57.85 56.70 1axj n ARG 108 Cb 0.51 -1.53 -0.02 0.00 0.45 0.00 0.00 32.46 31.88 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 -3.30 -1.84 -0.40 5.13 0.00 -1.25 -4.89 121.76 115.20 1axj s ALA 109 Ca -0.01 0.95 -0.14 0.00 0.00 0.00 0.00 51.96 52.76 1axj s ALA 109 Cb 0.15 0.38 0.02 0.00 0.00 0.00 0.00 23.12 23.67 1axj s ALA 109 CO 0.88 -0.74 0.28 0.00 0.00 0.00 0.00 175.76 176.18 1axj s ALA 110 N -3.03 3.45 -0.88 0.00 0.00 0.91 -1.22 121.76 120.98 1axj s ALA 110 Ca 0.07 -1.70 -0.24 0.00 0.00 0.00 0.00 51.96 50.09 1axj s ALA 110 Cb -0.01 -2.82 0.05 0.00 0.00 0.00 0.00 23.12 20.34 1axj s ALA 110 CO -0.07 -1.41 1.33 -1.17 0.00 0.00 0.00 175.76 174.44 1axj s LEU 111 N 1.66 3.53 -0.02 0.00 2.96 0.39 -0.48 118.68 126.71 1axj s LEU 111 Ca 0.05 -1.07 -0.26 0.00 -0.22 0.00 0.00 54.13 52.63 1axj s LEU 111 Cb -0.19 -2.55 -0.04 0.00 0.50 0.00 0.00 46.19 43.92 1axj s LEU 111 CO 0.09 -1.60 0.80 -0.69 -1.32 0.00 0.00 176.35 173.62 1axj s VAL 112 N 5.07 4.92 0.00 1.68 1.01 -0.06 -0.88 120.40 132.14 1axj s VAL 112 Ca 0.39 1.66 0.07 0.00 0.00 0.00 0.00 61.98 64.11 1axj s VAL 112 Cb -0.05 -4.14 -0.03 0.00 0.00 0.00 0.00 36.38 32.17 1axj s VAL 112 CO 0.01 0.25 -0.21 -0.63 0.00 0.00 0.00 175.10 174.53 1axj s ILE 113 N 0.64 2.53 -0.33 2.22 -1.09 0.31 -0.10 121.20 125.39 1axj s ILE 113 Ca 0.42 -1.10 0.04 0.00 -2.23 0.00 0.00 60.65 57.78 1axj s ILE 113 Cb -0.19 -1.99 0.09 0.00 -1.58 0.00 0.00 42.46 38.79 1axj s ILE 113 CO 0.22 0.47 0.03 -0.89 -1.23 0.00 0.00 174.94 173.53 1axj s THR 114 N -0.77 2.22 0.83 2.92 2.01 0.11 -0.88 115.64 122.07 1axj s THR 114 Ca 0.12 -2.21 -0.12 0.00 0.31 0.00 0.00 61.69 59.79 1axj s THR 114 Cb -0.10 -2.59 0.10 0.00 0.01 0.00 0.00 72.50 69.91 1axj s THR 114 CO 0.02 -0.51 1.19 -0.69 -0.69 0.00 0.00 174.62 173.94 1axj s VAL 115 N 0.95 2.03 0.00 3.82 1.01 -1.26 -0.66 120.40 126.30 1axj s VAL 115 Ca 0.08 0.01 0.00 0.00 0.00 0.00 0.00 61.98 62.07 1axj s VAL 115 Cb -0.19 -2.32 0.00 0.00 0.00 0.00 0.00 36.38 33.87 1axj s VAL 115 CO -0.08 -0.01 0.00 0.52 0.00 0.00 0.00 175.10 175.53 1axj n VAL 116 N -3.54 0.00 -3.73 2.92 0.31 0.01 -4.85 118.33 109.44 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 0.51 -1.33 -0.10 0.00 -0.91 0.00 0.00 33.84 32.01 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 -4.94 -0.41 -0.05 4.52 0.01 -1.04 -5.02 113.70 106.77 1axj s SER 117 Ca 0.00 0.77 0.03 0.00 1.31 0.00 0.00 55.95 58.06 1axj s SER 117 Cb 0.00 0.79 -0.03 0.00 0.21 0.00 0.00 66.02 66.99 1axj s SER 117 CO 0.00 -0.17 -0.14 0.00 0.41 0.00 0.00 173.24 173.34 1axj s ALA 118 N 0.09 2.66 0.11 1.44 0.00 -1.26 -0.79 121.76 124.01 1axj s ALA 118 Ca -0.01 -0.97 -0.03 0.00 0.00 0.00 0.00 51.96 50.94 1axj s ALA 118 Cb -0.03 -0.98 -0.03 0.00 0.00 0.00 0.00 23.12 22.08 1axj s ALA 118 CO 0.01 0.54 0.09 -1.83 0.00 0.00 0.00 175.76 174.57 1axj s GLU 119 N -0.68 0.86 0.09 0.00 1.03 0.19 -4.89 118.70 115.30 1axj s GLU 119 Ca 0.10 -1.28 -0.15 0.00 0.03 0.00 0.00 54.97 53.67 1axj s GLU 119 Cb -0.11 0.27 -0.06 0.00 -0.80 0.00 0.00 34.13 33.42 1axj s GLU 119 CO 0.01 -0.25 0.51 -1.14 -1.33 0.00 0.00 175.26 173.06 1axj s GLN 120 N -3.98 4.01 0.16 -4.83 2.00 -1.26 -1.13 119.66 114.64 1axj s GLN 120 Ca 0.16 0.52 0.00 0.00 -2.00 0.00 0.00 55.36 54.04 1axj s GLN 120 Cb 0.07 -3.09 0.00 0.00 0.80 0.00 0.00 33.01 30.78 1axj s GLN 120 CO -0.03 0.58 0.00 0.25 -0.50 0.00 0.00 175.29 175.59 1axj n THR 121 N 1.31 0.49 1.38 -0.34 -2.24 -1.26 -4.88 114.28 108.74 1axj n THR 121 Ca -0.09 0.16 0.14 0.00 -2.27 0.00 0.00 64.05 61.99 1axj n THR 121 Cb 0.52 -1.03 0.42 0.00 -2.10 0.00 0.00 70.33 68.14 1axj n THR 121 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50