#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 2.44 0.79 4.03 2.01 -1.26 -4.06 118.68 122.63 1axj s LEU 2 Ca 0.00 -0.89 -0.11 0.00 0.01 0.00 0.00 54.13 53.14 1axj s LEU 2 Cb 0.00 -0.07 0.07 0.00 0.01 0.00 0.00 46.19 46.19 1axj s LEU 2 CO 0.00 -0.41 1.09 -2.16 1.01 0.00 0.00 176.35 175.88 1axj s PRO 3 N -3.26 2.14 0.29 1.29 0.04 -1.26 -4.95 135.00 129.29 1axj s PRO 3 Ca 0.06 0.92 -0.02 0.00 0.04 0.00 0.00 61.00 61.99 1axj s PRO 3 Cb 0.02 -1.90 0.42 0.00 0.04 0.00 0.00 34.50 33.07 1axj s PRO 3 CO -0.04 -1.65 1.94 0.78 0.04 0.00 0.00 177.00 178.07 1axj h GLY 4 N -1.12 1.29 0.08 0.56 0.00 -2.01 -1.69 103.07 100.16 1axj h GLY 4 Ca -0.46 -0.46 0.20 0.00 0.00 0.00 0.00 47.33 46.61 1axj h GLY 4 CO 0.55 0.41 0.58 -0.84 0.00 0.00 0.00 176.54 177.24 1axj h THR 5 N 1.16 0.67 -0.07 4.70 2.02 -1.99 -1.05 112.91 118.36 1axj h THR 5 Ca 0.35 -0.24 0.04 0.00 0.77 0.00 0.00 66.41 67.33 1axj h THR 5 Cb -0.04 -0.10 -0.06 0.00 -1.74 0.00 0.00 68.15 66.22 1axj h THR 5 CO -0.09 0.13 -0.38 0.15 0.37 0.00 0.00 175.52 175.69 1axj h PHE 6 N 0.70 -1.07 -0.19 3.16 3.04 -1.67 -0.92 116.94 119.99 1axj h PHE 6 Ca 0.58 0.04 0.01 0.00 3.98 0.00 0.00 57.97 62.58 1axj h PHE 6 Cb 0.93 0.48 -0.02 0.00 2.56 0.00 0.00 35.95 39.91 1axj h PHE 6 CO -0.02 -0.46 0.09 0.74 -2.02 0.00 0.00 178.31 176.65 1axj h PHE 7 N -0.50 0.17 -0.98 0.41 -1.00 -1.30 -1.07 116.94 112.67 1axj h PHE 7 Ca 0.07 0.01 0.07 0.00 2.81 0.00 0.00 57.97 60.93 1axj h PHE 7 Cb 0.61 -0.05 -0.07 0.00 3.61 0.00 0.00 35.95 40.05 1axj h PHE 7 CO -0.42 0.10 0.63 0.93 -1.61 0.00 0.00 178.31 177.94 1axj h GLU 8 N 0.20 1.09 -0.41 1.51 4.39 -1.07 0.85 114.58 121.13 1axj h GLU 8 Ca 0.08 -0.07 -0.13 0.00 0.34 0.00 0.00 59.36 59.58 1axj h GLU 8 Cb 0.02 -0.25 -0.01 0.00 -0.10 0.00 0.00 28.75 28.41 1axj h GLU 8 CO -0.05 0.72 -0.27 0.28 -1.16 0.00 0.00 179.01 178.53 1axj h VAL 9 N 1.12 1.28 -0.50 3.13 2.07 -0.68 -2.90 116.25 119.77 1axj h VAL 9 Ca 0.44 -1.43 0.04 0.00 0.82 0.00 0.00 66.70 66.56 1axj h VAL 9 Cb 0.22 1.29 -0.04 0.00 -1.52 0.00 0.00 31.29 31.24 1axj h VAL 9 CO -0.19 0.48 0.27 -0.07 0.02 0.00 0.00 177.57 178.08 1axj h LEU 10 N 0.73 0.40 -1.80 2.57 -0.00 -0.52 -1.40 115.31 115.29 1axj h LEU 10 Ca 0.08 0.02 0.01 0.00 -0.00 0.00 0.00 57.88 58.00 1axj h LEU 10 Cb 0.85 -0.06 -0.00 0.00 -0.00 0.00 0.00 40.66 41.45 1axj h LEU 10 CO 0.07 0.28 0.42 0.11 -0.00 0.00 0.00 178.44 179.32 1axj h LYS 11 N 0.53 0.00 -6.20 1.13 1.57 -0.66 -3.42 116.57 109.52 1axj h LYS 11 Ca 0.21 0.00 -0.50 0.00 -1.87 0.00 0.00 60.65 58.49 1axj h LYS 11 Cb 0.09 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.36 1axj h LYS 11 CO -0.13 0.00 -0.50 -0.80 -0.57 0.00 0.00 179.45 177.45 1axj s ASN 12 N -4.37 5.45 0.28 0.86 0.01 -0.53 -5.09 114.94 111.54 1axj s ASN 12 Ca -0.03 -0.33 -0.29 0.00 -0.71 0.00 0.00 52.86 51.49 1axj s ASN 12 Cb 0.09 -1.26 -0.09 0.00 0.41 0.00 0.00 41.25 40.39 1axj s ASN 12 CO 0.28 -0.14 1.13 -0.70 -1.51 0.00 0.00 177.10 176.15 1axj s GLU 13 N -3.89 4.60 -0.02 -0.60 -6.30 -1.26 -4.74 118.70 106.49 1axj s GLU 13 Ca 0.36 1.85 -0.30 0.00 -2.50 0.00 0.00 54.97 54.37 1axj s GLU 13 Cb -0.07 -3.18 0.11 0.00 0.00 0.00 0.00 34.13 30.99 1axj s GLU 13 CO 0.25 0.15 1.30 0.20 0.02 0.00 0.00 175.26 177.19 1axj s GLY 14 N -0.76 -0.29 -0.06 -1.50 0.00 -1.26 -4.66 107.32 98.79 1axj s GLY 14 Ca 0.45 0.41 -0.04 0.00 0.00 0.00 0.00 44.72 45.54 1axj s GLY 14 CO 0.42 2.67 0.15 0.14 0.00 0.00 0.00 173.10 176.47 1axj s VAL 15 N -2.20 5.34 0.21 1.40 1.01 -0.73 -0.91 120.40 124.52 1axj s VAL 15 Ca 0.21 -0.04 0.03 0.00 0.00 0.00 0.00 61.98 62.19 1axj s VAL 15 Cb 0.03 -3.41 -0.05 0.00 0.00 0.00 0.00 36.38 32.95 1axj s VAL 15 CO -0.03 0.46 -0.01 -0.69 0.00 0.00 0.00 175.10 174.84 1axj s VAL 16 N -1.17 0.94 0.10 2.92 1.01 0.42 -1.22 120.40 123.40 1axj s VAL 16 Ca 0.21 -2.02 -0.14 0.00 0.00 0.00 0.00 61.98 60.02 1axj s VAL 16 Cb -0.12 -2.24 0.03 0.00 0.00 0.00 0.00 36.38 34.05 1axj s VAL 16 CO 0.11 -0.40 0.35 0.00 0.00 0.00 0.00 175.10 175.16 1axj s ALA 17 N -3.48 -0.77 -0.07 5.51 0.00 0.32 -1.12 121.76 122.14 1axj s ALA 17 Ca 0.26 -0.13 -0.03 0.00 0.00 0.00 0.00 51.96 52.06 1axj s ALA 17 Cb 0.05 0.58 0.04 0.00 0.00 0.00 0.00 23.12 23.79 1axj s ALA 17 CO 0.07 -0.57 0.14 0.42 0.00 0.00 0.00 175.76 175.81 1axj s ILE 18 N -3.55 -0.23 -0.46 0.00 1.01 -0.50 -0.73 121.20 116.74 1axj s ILE 18 Ca 0.02 0.37 -0.19 0.00 0.00 0.00 0.00 60.65 60.85 1axj s ILE 18 Cb 0.02 -0.26 0.04 0.00 0.01 0.00 0.00 42.46 42.26 1axj s ILE 18 CO -0.10 0.15 0.58 0.00 0.00 0.00 0.00 174.94 175.57 1axj s ALA 19 N 2.27 3.38 -0.23 9.38 0.00 0.84 -0.56 121.76 136.83 1axj s ALA 19 Ca 0.04 -1.48 -0.20 0.00 0.00 0.00 0.00 51.96 50.31 1axj s ALA 19 Cb -0.12 -3.25 -0.02 0.00 0.00 0.00 0.00 23.12 19.73 1axj s ALA 19 CO -0.05 -1.81 0.61 0.99 0.00 0.00 0.00 175.76 175.50 1axj s THR 20 N 2.56 5.01 0.23 0.00 2.01 -0.55 -1.24 115.64 123.66 1axj s THR 20 Ca 0.17 1.11 -0.30 0.00 0.31 0.00 0.00 61.69 62.98 1axj s THR 20 Cb -0.17 -3.92 -0.09 0.00 0.01 0.00 0.00 72.50 68.34 1axj s THR 20 CO 0.15 0.07 1.15 -1.58 -0.69 0.00 0.00 174.62 173.72 1axj s GLN 21 N 2.25 4.56 0.00 4.92 2.00 -0.66 -1.03 119.66 131.69 1axj s GLN 21 Ca 0.26 1.84 0.00 0.00 -2.00 0.00 0.00 55.36 55.46 1axj s GLN 21 Cb -0.16 -3.22 0.00 0.00 0.80 0.00 0.00 33.01 30.44 1axj s GLN 21 CO 0.09 0.04 0.00 0.41 -0.50 0.00 0.00 175.29 175.33 1axj n GLY 22 N 1.73 0.12 2.20 2.59 0.00 -1.26 -3.99 105.19 106.58 1axj n GLY 22 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.04 1axj n GLY 22 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1axj n GLU 23 N -0.88 0.00 -0.45 1.61 4.07 -1.26 -4.70 120.64 119.03 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 -3.35 5.02 0.00 4.31 5.75 -1.26 -4.84 116.55 122.18 1axj n ASP 24 Ca 0.00 -2.34 0.00 0.00 -0.01 0.00 0.00 54.79 52.44 1axj n ASP 24 Cb 0.00 -1.05 0.00 0.00 -1.03 0.00 0.00 41.12 39.04 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 1.45 -1.56 3.78 6.12 0.00 -1.26 -4.98 105.19 108.74 1axj n GLY 25 Ca 0.00 -1.42 -0.35 0.00 0.00 0.00 0.00 46.02 44.25 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 -3.89 3.52 -0.52 1.61 0.04 -1.26 -4.34 135.00 130.16 1axj s PRO 26 Ca 0.00 1.52 -0.16 0.00 0.04 0.00 0.00 61.00 62.40 1axj s PRO 26 Cb 0.00 -2.04 0.11 0.00 0.04 0.00 0.00 34.50 32.61 1axj s PRO 26 CO 0.00 -0.70 0.49 -1.58 0.04 0.00 0.00 177.00 175.25 1axj s HIS 27 N -1.85 3.23 -1.00 0.56 2.46 -0.19 -4.74 115.29 113.75 1axj s HIS 27 Ca 0.71 -1.15 -0.20 0.00 0.47 0.00 0.00 55.06 54.89 1axj s HIS 27 Cb -0.21 -3.63 0.09 0.00 -0.13 0.00 0.00 32.58 28.70 1axj s HIS 27 CO 0.24 -0.98 1.32 -1.17 -2.47 0.00 0.00 174.74 171.68 1axj s LEU 28 N 1.71 4.31 0.86 8.88 0.20 -1.25 -1.49 118.68 131.90 1axj s LEU 28 Ca 0.04 -1.85 -0.12 0.00 0.69 0.00 0.00 54.13 52.89 1axj s LEU 28 Cb -0.28 -2.48 0.11 0.00 -0.43 0.00 0.00 46.19 43.11 1axj s LEU 28 CO 0.04 -1.25 1.13 0.68 -0.29 0.00 0.00 176.35 176.67 1axj s VAL 29 N 3.71 2.27 0.38 1.68 -7.23 0.27 -4.82 120.40 116.66 1axj s VAL 29 Ca 0.40 0.09 0.08 0.00 -1.81 0.00 0.00 61.98 60.74 1axj s VAL 29 Cb -0.02 -2.89 -0.07 0.00 0.56 0.00 0.00 36.38 33.96 1axj s VAL 29 CO -0.08 -0.11 -0.04 0.20 -0.31 0.00 0.00 175.10 174.76 1axj s ASN 30 N -4.11 3.75 0.13 4.85 0.02 -1.26 -1.41 114.94 116.92 1axj s ASN 30 Ca 0.63 -1.29 -0.25 0.00 -1.02 0.00 0.00 52.86 50.92 1axj s ASN 30 Cb -0.14 -0.36 0.08 0.00 0.02 0.00 0.00 41.25 40.84 1axj s ASN 30 CO 0.53 -0.34 1.03 0.28 0.02 0.00 0.00 177.10 178.61 1axj s THR 31 N -2.69 0.00 0.00 1.60 -1.32 -0.28 -4.90 115.64 108.06 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 0.07 -2.21 -0.02 0.00 -1.51 0.00 0.00 72.50 68.82 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 -2.89 2.23 0.51 9.09 0.52 -1.26 -0.43 118.94 126.71 1axj s TRP 32 Ca 0.15 -0.42 0.28 0.00 0.02 0.00 0.00 56.10 56.14 1axj s TRP 32 Cb -0.01 -1.40 1.39 0.00 -1.15 0.00 0.00 33.47 32.31 1axj s TRP 32 CO 0.02 0.02 1.88 -0.91 0.02 0.00 0.00 176.95 177.98 1axj h ASN 33 N 5.25 0.10 0.00 2.95 2.35 -1.32 -0.27 115.58 124.64 1axj h ASN 33 Ca -0.44 0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.33 1axj h ASN 33 Cb 1.13 -0.01 0.00 0.00 0.05 0.00 0.00 38.32 39.50 1axj h ASN 33 CO 0.46 0.03 0.08 -0.24 -1.65 0.00 0.00 177.43 176.11 1axj n SER 34 N -4.33 0.47 -0.06 5.81 2.88 -1.26 -1.68 113.62 115.45 1axj n SER 34 Ca 0.19 0.69 0.01 0.00 -1.33 0.00 0.00 58.87 58.43 1axj n SER 34 Cb 0.91 -0.72 0.00 0.00 -0.75 0.00 0.00 64.21 63.65 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 -2.15 0.00 -3.21 0.66 4.01 -0.12 -5.06 117.16 111.29 1axj n TYR 35 Ca -0.01 0.00 -0.22 0.00 -0.16 0.00 0.00 57.90 57.51 1axj n TYR 35 Cb 0.11 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.14 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 -0.86 3.82 -0.00 7.72 1.43 -0.68 -4.27 118.68 125.84 1axj s LEU 36 Ca 0.02 0.21 0.01 0.00 -1.03 0.00 0.00 54.13 53.34 1axj s LEU 36 Cb 0.02 -3.09 -0.00 0.00 0.03 0.00 0.00 46.19 43.14 1axj s LEU 36 CO 0.04 -0.53 -0.05 -1.59 0.23 0.00 0.00 176.35 174.46 1axj s LYS 37 N -4.40 0.37 0.10 1.70 0.00 -0.74 -5.03 119.74 111.74 1axj s LYS 37 Ca 0.45 -0.20 0.02 0.00 0.00 0.00 0.00 55.97 56.24 1axj s LYS 37 Cb -0.10 -0.34 -0.04 0.00 0.00 0.00 0.00 37.83 37.36 1axj s LYS 37 CO 0.36 0.09 0.20 0.08 0.00 0.00 0.00 175.35 176.07 1axj s VAL 38 N -0.20 5.13 0.49 1.79 1.01 -1.26 -0.56 120.40 126.81 1axj s VAL 38 Ca 0.01 -0.60 0.02 0.00 0.00 0.00 0.00 61.98 61.40 1axj s VAL 38 Cb -0.02 -3.55 -0.01 0.00 0.00 0.00 0.00 36.38 32.80 1axj s VAL 38 CO -0.00 0.05 0.02 -0.76 0.00 0.00 0.00 175.10 174.41 1axj s LEU 39 N -2.74 2.25 1.03 3.92 1.43 0.28 -4.92 118.68 119.93 1axj s LEU 39 Ca 0.33 -1.66 -0.17 0.00 -1.03 0.00 0.00 54.13 51.61 1axj s LEU 39 Cb -0.12 -0.64 0.22 0.00 0.03 0.00 0.00 46.19 45.69 1axj s LEU 39 CO 0.27 -0.86 1.23 -0.62 0.23 0.00 0.00 176.35 176.60 1axj s ASP 40 N -3.84 2.45 -1.58 2.29 2.15 -1.26 -3.97 116.67 112.91 1axj s ASP 40 Ca 0.09 0.46 0.00 0.00 0.43 0.00 0.00 52.55 53.52 1axj s ASP 40 Cb 0.02 -0.62 0.00 0.00 -0.30 0.00 0.00 42.92 42.02 1axj s ASP 40 CO 0.05 -3.16 0.00 0.61 -0.17 0.00 0.00 175.17 172.50 1axj n GLY 41 N -2.70 -0.35 2.36 2.66 0.00 -1.26 -1.74 105.19 104.16 1axj n GLY 41 Ca 0.14 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.08 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 -1.89 -3.86 -4.78 1.61 2.04 -1.26 -4.81 115.26 102.31 1axj n ASN 42 Ca -0.21 0.19 -0.37 0.00 -0.44 0.00 0.00 54.58 53.74 1axj n ASN 42 Cb 0.66 -3.01 -0.03 0.00 -2.53 0.00 0.00 39.78 34.86 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 -2.34 4.11 0.31 -3.83 3.52 -0.71 -4.09 118.95 115.92 1axj s ARG 43 Ca 0.00 1.60 0.04 0.00 -0.13 0.00 0.00 55.73 57.24 1axj s ARG 43 Cb 0.00 -2.57 -0.06 0.00 -1.56 0.00 0.00 34.95 30.76 1axj s ARG 43 CO 0.00 -0.21 0.03 0.42 -0.81 0.00 0.00 175.30 174.74 1axj s ILE 44 N -1.59 1.25 -0.06 4.11 -1.09 0.10 -0.56 121.20 123.36 1axj s ILE 44 Ca 0.58 -2.02 -0.09 0.00 -2.23 0.00 0.00 60.65 56.89 1axj s ILE 44 Cb -0.24 -2.69 0.02 0.00 -1.58 0.00 0.00 42.46 37.96 1axj s ILE 44 CO 0.30 -0.09 0.22 -0.69 -1.23 0.00 0.00 174.94 173.46 1axj s VAL 45 N -3.26 0.02 -0.04 2.92 1.01 0.28 -0.40 120.40 120.92 1axj s VAL 45 Ca 0.34 -0.17 0.04 0.00 0.00 0.00 0.00 61.98 62.20 1axj s VAL 45 Cb 0.08 -0.37 -0.00 0.00 0.00 0.00 0.00 36.38 36.08 1axj s VAL 45 CO 0.14 -0.09 -0.17 -0.69 0.00 0.00 0.00 175.10 174.29 1axj s VAL 46 N -0.29 1.40 -0.46 2.92 1.01 0.24 -1.78 120.40 123.43 1axj s VAL 46 Ca -0.04 -0.70 -0.28 0.00 0.00 0.00 0.00 61.98 60.96 1axj s VAL 46 Cb -0.03 -1.20 0.01 0.00 0.00 0.00 0.00 36.38 35.16 1axj s VAL 46 CO 0.01 0.40 1.39 -2.16 0.00 0.00 0.00 175.10 174.74 1axj s PRO 47 N 0.03 3.50 -0.43 2.72 0.04 -1.26 -0.47 135.00 139.13 1axj s PRO 47 Ca -0.03 0.76 -0.25 0.00 0.04 0.00 0.00 61.00 61.51 1axj s PRO 47 Cb -0.11 -4.05 0.02 0.00 0.04 0.00 0.00 34.50 30.41 1axj s PRO 47 CO 0.02 -1.67 0.89 0.54 0.04 0.00 0.00 177.00 176.82 1axj s VAL 48 N 5.56 4.55 -0.02 -0.36 0.11 -0.32 -4.85 120.40 125.06 1axj s VAL 48 Ca 0.57 0.81 0.09 0.00 -2.93 0.00 0.00 61.98 60.52 1axj s VAL 48 Cb -0.12 -4.37 -0.14 0.00 -1.53 0.00 0.00 36.38 30.21 1axj s VAL 48 CO 0.30 -0.72 0.19 0.61 -3.33 0.00 0.00 175.10 172.15 1axj n GLY 49 N 4.79 -0.44 2.46 6.54 0.00 -1.26 -0.42 105.19 116.86 1axj n GLY 49 Ca 0.05 -0.22 -0.02 0.00 0.00 0.00 0.00 46.02 45.84 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 2.02 1.33 2.77 -0.02 0.00 -1.26 -4.66 105.19 105.37 1axj n GLY 50 Ca -0.03 -0.13 -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 -1.14 4.07 -0.03 1.61 2.00 -1.26 -4.91 117.12 117.47 1axj n MET 51 Ca -0.13 -4.59 -0.13 0.00 0.00 0.00 0.00 57.70 52.85 1axj n MET 51 Cb 0.80 -2.33 -0.10 0.00 0.00 0.00 0.00 33.22 31.59 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 3.42 0.13 -0.92 2.03 3.86 -1.99 -0.90 115.15 120.78 1axj h HIS 52 Ca 0.36 -0.05 0.16 0.00 -1.16 0.00 0.00 60.37 59.69 1axj h HIS 52 Cb 0.42 -0.02 -0.10 0.00 1.06 0.00 0.00 27.41 28.77 1axj h HIS 52 CO 1.07 0.66 0.52 -0.22 0.86 0.00 0.00 177.93 180.82 1axj h LYS 53 N -0.43 0.69 -0.96 2.45 3.64 -2.00 -0.40 116.57 119.55 1axj h LYS 53 Ca 0.00 -0.04 0.01 0.00 -1.27 0.00 0.00 60.65 59.35 1axj h LYS 53 Cb 0.65 -0.15 -0.05 0.00 -0.41 0.00 0.00 32.23 32.27 1axj h LYS 53 CO 0.02 0.45 0.64 1.15 -2.27 0.00 0.00 179.45 179.44 1axj h THR 54 N 0.71 1.25 -0.19 1.00 2.02 -1.91 0.27 112.91 116.04 1axj h THR 54 Ca 0.51 -0.45 0.02 0.00 0.77 0.00 0.00 66.41 67.27 1axj h THR 54 Cb 0.73 -0.17 -0.02 0.00 -1.74 0.00 0.00 68.15 66.95 1axj h THR 54 CO -0.36 0.24 0.04 -0.08 0.37 0.00 0.00 175.52 175.72 1axj h GLU 55 N 1.30 0.12 -0.75 6.66 4.81 0.37 0.16 114.58 127.26 1axj h GLU 55 Ca 0.35 -0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 59.56 1axj h GLU 55 Cb -0.15 -0.03 -0.03 0.00 0.63 0.00 0.00 28.75 29.17 1axj h GLU 55 CO -0.08 0.08 0.39 0.00 -0.73 0.00 0.00 179.01 178.67 1axj h ALA 56 N 1.14 0.96 -0.68 2.92 0.00 -0.75 -1.53 119.26 121.32 1axj h ALA 56 Ca 0.09 -0.13 -0.04 0.00 0.00 0.00 0.00 54.91 54.83 1axj h ALA 56 Cb 0.08 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.54 1axj h ALA 56 CO -0.11 0.49 0.27 -0.91 0.00 0.00 0.00 179.25 178.99 1axj h ASN 57 N 1.03 0.93 -0.16 0.00 4.21 -0.05 0.06 115.58 121.61 1axj h ASN 57 Ca 0.26 -0.17 -0.00 0.00 1.21 0.00 0.00 56.30 57.60 1axj h ASN 57 Cb 0.06 -0.24 -0.01 0.00 -1.12 0.00 0.00 38.32 37.01 1axj h ASN 57 CO -0.04 0.85 0.09 0.58 -1.29 0.00 0.00 177.43 177.62 1axj h VAL 58 N 0.96 1.10 -0.40 2.81 2.07 -0.44 0.25 116.25 122.60 1axj h VAL 58 Ca 0.23 -0.26 0.11 0.00 0.82 0.00 0.00 66.70 67.60 1axj h VAL 58 Cb 0.21 0.98 -0.02 0.00 -1.52 0.00 0.00 31.29 30.94 1axj h VAL 58 CO -0.02 0.09 0.30 0.00 0.02 0.00 0.00 177.57 177.96 1axj h ALA 59 N 0.98 2.32 0.06 1.67 0.00 -0.84 -2.81 119.26 120.64 1axj h ALA 59 Ca 0.06 -0.01 -0.11 0.00 0.00 0.00 0.00 54.91 54.84 1axj h ALA 59 Cb 0.07 0.03 0.01 0.00 0.00 0.00 0.00 17.79 17.90 1axj h ALA 59 CO -0.01 -0.50 -0.47 0.00 0.00 0.00 0.00 179.25 178.27 1axj h ARG 60 N 0.00 0.22 -2.66 0.00 2.47 0.18 -3.48 114.38 111.11 1axj h ARG 60 Ca 0.19 -0.31 -0.12 0.00 -1.26 0.00 0.00 59.98 58.48 1axj h ARG 60 Cb 0.79 0.11 -0.27 0.00 -1.65 0.00 0.00 29.97 28.94 1axj h ARG 60 CO -0.00 1.09 -0.31 0.34 0.56 0.00 0.00 179.97 181.65 1axj s ASP 61 N -6.62 -0.49 0.48 7.04 -1.08 0.78 -5.00 116.67 111.77 1axj s ASP 61 Ca -0.15 0.88 0.27 0.00 -0.52 0.00 0.00 52.55 53.02 1axj s ASP 61 Cb 0.00 0.78 1.09 0.00 -1.46 0.00 0.00 42.92 43.33 1axj s ASP 61 CO 0.78 -0.19 1.89 1.05 0.52 0.00 0.00 175.17 179.22 1axj h GLU 62 N 7.18 0.00 -6.47 4.34 -0.00 -1.82 -3.34 114.58 114.47 1axj h GLU 62 Ca -0.36 0.00 -0.53 0.00 -0.00 0.00 0.00 59.36 58.47 1axj h GLU 62 Cb 1.18 0.00 0.03 0.00 -0.00 0.00 0.00 28.75 29.96 1axj h GLU 62 CO 0.29 0.17 1.12 1.03 -0.00 0.00 0.00 179.01 181.61 1axj s ARG 63 N -3.73 4.15 0.05 1.06 0.52 -1.26 -0.54 118.95 119.19 1axj s ARG 63 Ca 0.00 2.55 0.00 0.00 -0.52 0.00 0.00 55.73 57.76 1axj s ARG 63 Cb 0.10 -3.71 -0.03 0.00 0.52 0.00 0.00 34.95 31.83 1axj s ARG 63 CO 0.61 -0.85 -0.04 0.14 0.02 0.00 0.00 175.30 175.18 1axj s VAL 64 N 3.08 0.29 0.09 3.52 -7.23 -0.16 -1.66 120.40 118.33 1axj s VAL 64 Ca 0.81 -1.43 0.04 0.00 -1.81 0.00 0.00 61.98 59.59 1axj s VAL 64 Cb -0.44 -1.01 -0.04 0.00 0.56 0.00 0.00 36.38 35.45 1axj s VAL 64 CO 0.36 -0.73 0.03 -0.22 -0.31 0.00 0.00 175.10 174.23 1axj s LEU 65 N -2.28 3.60 0.00 1.32 0.20 -0.37 -1.24 118.68 119.91 1axj s LEU 65 Ca -0.02 -0.12 0.00 0.00 0.69 0.00 0.00 54.13 54.68 1axj s LEU 65 Cb -0.01 -2.30 -0.00 0.00 -0.43 0.00 0.00 46.19 43.44 1axj s LEU 65 CO -0.05 0.17 -0.01 -0.32 -0.29 0.00 0.00 176.35 175.84 1axj s MET 66 N -2.39 0.13 -0.09 1.98 -2.45 0.12 -0.11 119.30 116.48 1axj s MET 66 Ca 0.27 -0.15 0.03 0.00 -1.25 0.00 0.00 55.69 54.59 1axj s MET 66 Cb -0.12 -0.05 0.01 0.00 1.25 0.00 0.00 34.83 35.92 1axj s MET 66 CO 0.20 0.01 -0.16 0.95 1.05 0.00 0.00 175.02 177.06 1axj s THR 67 N -0.30 1.51 0.28 10.11 -4.23 0.09 -0.10 115.64 122.99 1axj s THR 67 Ca -0.03 -0.68 0.11 0.00 -1.18 0.00 0.00 61.69 59.91 1axj s THR 67 Cb -0.02 -1.35 -0.05 0.00 1.34 0.00 0.00 72.50 72.42 1axj s THR 67 CO -0.00 0.44 -0.10 -1.48 -0.54 0.00 0.00 174.62 172.94 1axj s LEU 68 N 0.68 2.90 0.00 4.79 -0.00 -0.58 -0.52 118.68 125.95 1axj s LEU 68 Ca -0.13 -0.84 0.00 0.00 -0.00 0.00 0.00 54.13 53.16 1axj s LEU 68 Cb -0.16 -1.41 0.00 0.00 -0.00 0.00 0.00 46.19 44.62 1axj s LEU 68 CO 0.03 0.01 0.00 0.61 -0.00 0.00 0.00 176.35 177.00 1axj n GLY 69 N -0.77 -1.36 3.49 -3.48 0.00 -0.36 -0.66 105.19 102.05 1axj n GLY 69 Ca -0.06 -0.97 -0.09 0.00 0.00 0.00 0.00 46.02 44.90 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 -3.11 -0.05 0.00 1.61 0.15 -0.27 -1.77 113.70 110.25 1axj s SER 70 Ca 0.00 -0.92 0.22 0.00 0.70 0.00 0.00 55.95 55.95 1axj s SER 70 Cb 0.00 0.53 -0.10 0.00 -1.71 0.00 0.00 66.02 64.74 1axj s SER 70 CO 0.00 -1.05 1.00 0.54 1.20 0.00 0.00 173.24 174.93 1axj n ARG 71 N -0.33 0.27 0.00 5.44 5.12 -1.26 -2.07 116.66 123.83 1axj n ARG 71 Ca -0.03 -0.22 0.14 0.00 -1.93 0.00 0.00 57.85 55.81 1axj n ARG 71 Cb 0.63 -1.50 0.72 0.00 -1.16 0.00 0.00 32.46 31.15 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 -1.17 0.37 -4.55 5.56 5.02 -1.26 -4.15 118.16 117.97 1axj n LYS 72 Ca 0.05 0.01 -0.21 0.00 -2.02 0.00 0.00 58.31 56.14 1axj n LYS 72 Cb 0.36 -1.50 -0.15 0.00 -0.02 0.00 0.00 35.03 33.72 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 0.99 -0.19 -0.18 1.01 -1.26 -5.02 120.40 113.12 1axj s VAL 73 Ca 0.26 -0.55 -0.29 0.00 0.00 0.00 0.00 61.98 61.39 1axj s VAL 73 Cb 0.19 -0.83 0.00 0.00 0.00 0.00 0.00 36.38 35.75 1axj s VAL 73 CO 0.45 0.26 1.08 0.00 0.00 0.00 0.00 175.10 176.90 1axj s ALA 74 N -0.32 3.63 0.00 5.51 0.00 -1.26 -1.41 121.76 127.91 1axj s ALA 74 Ca 0.05 0.28 0.00 0.00 0.00 0.00 0.00 51.96 52.28 1axj s ALA 74 Cb -0.05 -3.54 0.00 0.00 0.00 0.00 0.00 23.12 19.53 1axj s ALA 74 CO -0.00 -0.99 0.00 0.41 0.00 0.00 0.00 175.76 175.18 1axj n GLY 75 N 3.34 2.14 0.05 0.00 0.00 -1.13 -4.71 105.19 104.87 1axj n GLY 75 Ca 0.12 -0.03 -0.03 0.00 0.00 0.00 0.00 46.02 46.07 1axj n GLY 75 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1axj n ARG 76 N 0.00 0.29 -2.72 1.61 5.12 -1.22 -4.79 116.66 114.95 1axj n ARG 76 Ca 0.00 0.39 -0.42 0.00 -1.93 0.00 0.00 57.85 55.89 1axj n ARG 76 Cb 0.00 -1.32 -0.03 0.00 -1.16 0.00 0.00 32.46 29.95 1axj n ARG 76 CO 0.00 0.00 0.00 0.54 -1.93 0.00 0.00 177.63 176.24 1axj s ASN 77 N -4.96 6.26 0.65 0.55 4.22 -1.26 -4.87 114.94 115.53 1axj s ASN 77 Ca -0.10 -0.48 0.00 0.00 -2.14 0.00 0.00 52.86 50.13 1axj s ASN 77 Cb 0.01 -2.48 0.00 0.00 1.28 0.00 0.00 41.25 40.06 1axj s ASN 77 CO 0.15 -1.50 0.00 0.61 -2.04 0.00 0.00 177.10 174.33 1axj n GLY 78 N 5.24 -0.38 3.56 0.45 0.00 -1.26 -4.04 105.19 108.75 1axj n GLY 78 Ca 0.02 -0.67 -0.26 0.00 0.00 0.00 0.00 46.02 45.10 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 2.40 0.00 1.61 0.04 -1.26 -3.66 135.00 134.13 1axj s PRO 79 Ca 0.00 -0.02 0.00 0.00 0.04 0.00 0.00 61.00 61.02 1axj s PRO 79 Cb 0.00 -4.93 0.00 0.00 0.04 0.00 0.00 34.50 29.61 1axj s PRO 79 CO 0.00 -3.47 0.00 0.41 0.04 0.00 0.00 177.00 173.98 1axj n GLY 80 N 6.69 0.67 3.57 0.56 0.00 -0.50 -4.55 105.19 111.63 1axj n GLY 80 Ca 0.39 0.58 -0.26 0.00 0.00 0.00 0.00 46.02 46.73 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 1.49 -2.19 2.61 -1.32 -0.88 -2.86 115.64 112.49 1axj s THR 81 Ca 0.00 -2.00 0.00 0.00 -1.21 0.00 0.00 61.69 58.48 1axj s THR 81 Cb 0.00 -2.77 0.00 0.00 -1.51 0.00 0.00 72.50 68.22 1axj s THR 81 CO 0.00 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.02 1axj n GLY 82 N -0.90 -0.56 3.22 6.08 0.00 0.80 -1.11 105.19 112.71 1axj n GLY 82 Ca -0.06 -0.74 -0.11 0.00 0.00 0.00 0.00 46.02 45.11 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 -3.24 -0.03 -0.18 1.61 0.40 0.17 -3.57 117.98 113.13 1axj s PHE 83 Ca 0.00 -0.15 -0.09 0.00 -0.60 0.00 0.00 56.93 56.10 1axj s PHE 83 Cb 0.00 0.04 -0.05 0.00 0.51 0.00 0.00 43.02 43.52 1axj s PHE 83 CO 0.00 -0.47 0.10 -1.17 0.70 0.00 0.00 175.22 174.39 1axj s LEU 84 N -2.08 4.08 0.12 -0.37 1.98 -0.29 -1.53 118.68 120.60 1axj s LEU 84 Ca -0.05 0.20 -0.00 0.00 -2.89 0.00 0.00 54.13 51.39 1axj s LEU 84 Cb -0.01 -2.04 -0.04 0.00 0.66 0.00 0.00 46.19 44.76 1axj s LEU 84 CO -0.04 0.21 0.02 -0.63 -1.89 0.00 0.00 176.35 174.02 1axj s ILE 85 N 0.19 0.29 0.06 6.68 1.09 0.85 -0.80 121.20 129.56 1axj s ILE 85 Ca 0.07 -1.90 0.03 0.00 -1.10 0.00 0.00 60.65 57.75 1axj s ILE 85 Cb -0.12 -1.92 -0.03 0.00 -1.06 0.00 0.00 42.46 39.34 1axj s ILE 85 CO -0.01 -0.61 -0.10 -0.13 -0.10 0.00 0.00 174.94 173.99 1axj s ARG 86 N -3.98 0.65 0.06 2.79 0.52 -0.45 -0.70 118.95 117.83 1axj s ARG 86 Ca 0.19 -0.88 -0.14 0.00 -0.52 0.00 0.00 55.73 54.39 1axj s ARG 86 Cb 0.07 -0.44 0.05 0.00 0.52 0.00 0.00 34.95 35.14 1axj s ARG 86 CO -0.01 0.08 0.64 0.41 0.02 0.00 0.00 175.30 176.44 1axj n GLY 87 N 1.24 0.72 3.36 -3.53 0.00 -0.37 -1.38 105.19 105.23 1axj n GLY 87 Ca -0.21 -1.01 -0.33 0.00 0.00 0.00 0.00 46.02 44.46 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 -2.47 4.03 0.46 1.61 0.01 -0.28 -0.99 113.70 116.08 1axj s SER 88 Ca 0.15 -0.34 -0.04 0.00 1.31 0.00 0.00 55.95 57.03 1axj s SER 88 Cb -0.01 -1.62 -0.03 0.00 0.21 0.00 0.00 66.02 64.56 1axj s SER 88 CO 0.02 0.14 0.75 0.00 0.41 0.00 0.00 173.24 174.56 1axj s ALA 89 N 0.48 3.47 -0.30 1.44 0.00 0.29 -0.07 121.76 127.07 1axj s ALA 89 Ca -0.09 -0.63 -0.11 0.00 0.00 0.00 0.00 51.96 51.13 1axj s ALA 89 Cb -0.16 -2.48 0.14 0.00 0.00 0.00 0.00 23.12 20.62 1axj s ALA 89 CO 0.04 -0.33 0.72 0.00 0.00 0.00 0.00 175.76 176.19 1axj s ALA 90 N -2.68 -2.17 0.31 0.00 0.00 0.64 -4.81 121.76 113.06 1axj s ALA 90 Ca 0.47 2.29 -0.27 0.00 0.00 0.00 0.00 51.96 54.45 1axj s ALA 90 Cb -0.10 -1.82 -0.09 0.00 0.00 0.00 0.00 23.12 21.10 1axj s ALA 90 CO 0.43 -0.91 1.02 -0.06 0.00 0.00 0.00 175.76 176.23 1axj s PHE 91 N 2.75 3.61 -0.01 0.00 0.40 -1.26 -0.61 117.98 122.86 1axj s PHE 91 Ca -0.05 1.75 -0.01 0.00 -0.60 0.00 0.00 56.93 58.01 1axj s PHE 91 Cb -0.11 -3.09 0.00 0.00 0.51 0.00 0.00 43.02 40.34 1axj s PHE 91 CO -0.19 -0.18 0.04 1.03 0.70 0.00 0.00 175.22 176.62 1axj s ARG 92 N -1.82 0.07 -0.25 0.44 1.81 0.15 -4.94 118.95 114.41 1axj s ARG 92 Ca 0.49 -0.00 0.10 0.00 -1.72 0.00 0.00 55.73 54.59 1axj s ARG 92 Cb -0.25 0.03 0.45 0.00 -0.45 0.00 0.00 34.95 34.73 1axj s ARG 92 CO 0.31 -0.01 1.20 0.25 -0.68 0.00 0.00 175.30 176.37 1axj n THR 93 N 2.92 2.30 -3.46 0.02 -2.24 -1.26 -0.38 114.28 112.17 1axj n THR 93 Ca -0.13 -3.72 -0.13 0.00 -2.27 0.00 0.00 64.05 57.79 1axj n THR 93 Cb 0.59 -0.65 -0.03 0.00 -2.10 0.00 0.00 70.33 68.14 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 -3.43 -0.56 0.00 3.42 2.15 -1.26 -5.04 116.67 111.95 1axj s ASP 94 Ca 0.45 0.14 0.00 0.00 0.43 0.00 0.00 52.55 53.57 1axj s ASP 94 Cb 0.39 0.57 0.00 0.00 -0.30 0.00 0.00 42.92 43.58 1axj s ASP 94 CO -0.01 -0.87 0.00 0.61 -0.17 0.00 0.00 175.17 174.73 1axj n GLY 95 N -0.05 -0.53 0.00 2.66 0.00 -1.26 -4.14 105.19 101.87 1axj n GLY 95 Ca -0.17 -1.78 0.04 0.00 0.00 0.00 0.00 46.02 44.11 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 -0.56 0.03 0.23 1.61 -0.04 -1.26 -1.79 135.00 133.22 1axj n PRO 96 Ca 0.00 0.31 -0.14 0.00 -0.04 0.00 0.00 63.50 63.63 1axj n PRO 96 Cb 0.00 -1.50 -0.08 0.00 -0.04 0.00 0.00 33.50 31.88 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 -0.59 -0.17 0.54 4.39 -1.99 -0.13 114.58 116.63 1axj h GLU 97 Ca 0.00 0.04 -0.01 0.00 0.34 0.00 0.00 59.36 59.73 1axj h GLU 97 Cb 0.14 0.13 -0.01 0.00 -0.10 0.00 0.00 28.75 28.91 1axj h GLU 97 CO 0.00 -0.28 0.04 0.35 -1.16 0.00 0.00 179.01 177.96 1axj h PHE 98 N -0.91 0.24 -0.03 4.33 3.57 -1.51 -1.42 116.94 121.21 1axj h PHE 98 Ca -0.06 -0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.40 1axj h PHE 98 Cb 0.58 -0.08 0.00 0.00 2.79 0.00 0.00 35.95 39.24 1axj h PHE 98 CO 0.01 0.22 -0.10 0.93 -2.23 0.00 0.00 178.31 177.14 1axj h GLU 99 N 0.24 0.12 -0.08 1.11 4.39 -1.50 0.29 114.58 119.15 1axj h GLU 99 Ca 0.06 -0.09 0.02 0.00 0.34 0.00 0.00 59.36 59.70 1axj h GLU 99 Cb 0.10 0.02 -0.00 0.00 -0.10 0.00 0.00 28.75 28.76 1axj h GLU 99 CO -0.00 0.71 0.07 0.00 -1.16 0.00 0.00 179.01 178.63 1axj h ALA 100 N 0.40 1.84 0.00 3.43 0.00 -0.65 -1.27 119.26 123.01 1axj h ALA 100 Ca -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1axj h ALA 100 Cb 0.72 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.52 1axj h ALA 100 CO 0.02 -0.12 -1.22 0.44 0.00 0.00 0.00 179.25 178.38 1axj n ILE 101 N -4.13 0.35 -0.17 0.00 -6.64 -0.57 -4.48 119.36 103.73 1axj n ILE 101 Ca -0.01 -0.45 0.29 0.00 -1.77 0.00 0.00 62.75 60.81 1axj n ILE 101 Cb 0.18 -0.11 0.71 0.00 -1.44 0.00 0.00 39.64 38.98 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 2.16 2.78 -0.26 -1.28 0.00 0.83 -0.41 119.26 123.08 1axj h ALA 102 Ca 0.00 -0.03 0.08 0.00 0.00 0.00 0.00 54.91 54.95 1axj h ALA 102 Cb 0.92 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.77 1axj h ALA 102 CO 0.00 -1.19 0.51 0.07 0.00 0.00 0.00 179.25 178.64 1axj h ARG 103 N 0.00 0.00 -7.80 0.00 0.11 -1.79 -3.42 114.38 101.48 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 1.88 0.00 0.16 0.00 1.11 0.00 0.00 29.97 33.13 1axj h ARG 103 CO -0.00 0.00 0.41 -0.06 0.10 0.00 0.00 179.97 180.41 1axj s PHE 104 N -4.34 1.49 0.00 4.08 0.08 -0.17 -5.04 117.98 114.08 1axj s PHE 104 Ca -0.03 0.25 0.00 0.00 0.12 0.00 0.00 56.93 57.26 1axj s PHE 104 Cb 0.11 -4.10 0.00 0.00 -0.57 0.00 0.00 43.02 38.46 1axj s PHE 104 CO 0.38 -2.67 0.48 1.17 -0.10 0.00 0.00 175.22 174.49 1axj n LYS 105 N -3.75 0.31 0.00 0.44 0.00 -1.26 -4.72 118.16 109.17 1axj n LYS 105 Ca 0.16 -0.59 0.00 0.00 0.00 0.00 0.00 58.31 57.88 1axj n LYS 105 Cb 0.59 -0.79 0.00 0.00 0.00 0.00 0.00 35.03 34.84 1axj n LYS 105 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 177.40 174.73 1axj n TRP 106 N -0.11 0.00 -2.80 5.64 4.27 -1.26 -5.08 117.44 118.10 1axj n TRP 106 Ca 0.00 -0.09 -0.38 0.00 -3.89 0.00 0.00 57.50 53.14 1axj n TRP 106 Cb 0.20 -0.01 -0.06 0.00 -1.36 0.00 0.00 31.31 30.08 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 -0.18 3.29 0.00 -1.67 0.00 -1.26 -4.20 121.76 117.73 1axj s ALA 107 Ca 0.00 0.53 0.00 0.00 0.00 0.00 0.00 51.96 52.49 1axj s ALA 107 Cb 0.00 -3.16 0.00 0.00 0.00 0.00 0.00 23.12 19.96 1axj s ALA 107 CO 0.00 0.20 0.00 -2.13 0.00 0.00 0.00 175.76 173.83 1axj n ARG 108 N 0.99 5.98 -3.56 0.00 0.63 0.44 -4.90 116.66 116.24 1axj n ARG 108 Ca -0.00 0.00 -0.06 0.00 -0.92 0.00 0.00 57.85 56.87 1axj n ARG 108 Cb 0.49 -0.50 -0.02 0.00 0.45 0.00 0.00 32.46 32.88 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 -0.99 -1.88 -0.37 5.13 0.00 -0.42 -4.94 121.76 118.29 1axj s ALA 109 Ca 0.00 1.01 -0.06 0.00 0.00 0.00 0.00 51.96 52.91 1axj s ALA 109 Cb 0.00 0.32 0.06 0.00 0.00 0.00 0.00 23.12 23.50 1axj s ALA 109 CO 0.00 -0.74 0.15 0.00 0.00 0.00 0.00 175.76 175.18 1axj s ALA 110 N -2.94 3.11 -0.76 0.00 0.00 0.49 -1.18 121.76 120.49 1axj s ALA 110 Ca 0.07 -1.98 -0.25 0.00 0.00 0.00 0.00 51.96 49.80 1axj s ALA 110 Cb -0.01 -2.37 0.04 0.00 0.00 0.00 0.00 23.12 20.79 1axj s ALA 110 CO -0.06 -1.49 1.22 -1.17 0.00 0.00 0.00 175.76 174.26 1axj s LEU 111 N 1.36 3.53 -0.09 0.00 2.96 0.39 -0.68 118.68 126.15 1axj s LEU 111 Ca 0.01 -0.73 -0.26 0.00 -0.22 0.00 0.00 54.13 52.92 1axj s LEU 111 Cb -0.21 -2.52 -0.03 0.00 0.50 0.00 0.00 46.19 43.93 1axj s LEU 111 CO 0.01 -1.69 0.83 -0.69 -1.32 0.00 0.00 176.35 173.49 1axj s VAL 112 N 5.18 4.93 -0.13 1.68 1.01 0.22 -0.59 120.40 132.70 1axj s VAL 112 Ca 0.33 1.68 0.01 0.00 0.00 0.00 0.00 61.98 64.00 1axj s VAL 112 Cb -0.09 -4.15 -0.01 0.00 0.00 0.00 0.00 36.38 32.13 1axj s VAL 112 CO 0.10 0.13 -0.16 -0.63 0.00 0.00 0.00 175.10 174.55 1axj s ILE 113 N 1.43 2.77 -0.90 2.22 -1.09 0.46 -0.26 121.20 125.83 1axj s ILE 113 Ca 0.42 -0.76 -0.13 0.00 -2.23 0.00 0.00 60.65 57.95 1axj s ILE 113 Cb -0.18 -2.15 0.22 0.00 -1.58 0.00 0.00 42.46 38.78 1axj s ILE 113 CO 0.18 0.53 0.87 -0.89 -1.23 0.00 0.00 174.94 174.40 1axj s THR 114 N 0.44 5.63 0.74 2.92 2.01 0.90 -0.72 115.64 127.56 1axj s THR 114 Ca -0.11 -2.61 -0.15 0.00 0.31 0.00 0.00 61.69 59.13 1axj s THR 114 Cb -0.16 -4.53 0.04 0.00 0.01 0.00 0.00 72.50 67.87 1axj s THR 114 CO 0.05 -1.10 1.24 -0.69 -0.69 0.00 0.00 174.62 173.43 1axj s VAL 115 N 0.07 2.08 0.16 3.82 1.01 -1.26 -1.12 120.40 125.16 1axj s VAL 115 Ca 0.22 0.04 0.00 0.00 0.00 0.00 0.00 61.98 62.24 1axj s VAL 115 Cb -0.10 -2.68 0.00 0.00 0.00 0.00 0.00 36.38 33.61 1axj s VAL 115 CO -0.09 -0.02 0.00 0.52 0.00 0.00 0.00 175.10 175.51 1axj n VAL 116 N -2.72 0.79 -3.76 2.92 0.31 -0.48 -4.70 118.33 110.71 1axj n VAL 116 Ca 0.14 0.26 -0.13 0.00 -0.01 0.00 0.00 64.34 64.60 1axj n VAL 116 Cb 0.50 -1.22 -0.10 0.00 -0.91 0.00 0.00 33.84 32.10 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 -5.64 -0.34 0.27 4.52 0.01 -1.20 0.40 113.70 111.72 1axj s SER 117 Ca 0.00 0.62 0.12 0.00 1.31 0.00 0.00 55.95 58.00 1axj s SER 117 Cb 0.00 0.66 -0.05 0.00 0.21 0.00 0.00 66.02 66.84 1axj s SER 117 CO 0.00 -0.16 -0.20 0.00 0.41 0.00 0.00 173.24 173.29 1axj s ALA 118 N -0.00 2.67 0.00 1.44 0.00 -1.26 -1.35 121.76 123.26 1axj s ALA 118 Ca -0.02 -1.84 -0.01 0.00 0.00 0.00 0.00 51.96 50.09 1axj s ALA 118 Cb -0.03 -0.25 -0.01 0.00 0.00 0.00 0.00 23.12 22.84 1axj s ALA 118 CO 0.01 0.27 0.02 -1.83 0.00 0.00 0.00 175.76 174.23 1axj s GLU 119 N -3.45 0.20 0.15 0.00 1.03 0.02 -4.97 118.70 111.67 1axj s GLU 119 Ca 0.29 -0.28 -0.30 0.00 0.03 0.00 0.00 54.97 54.71 1axj s GLU 119 Cb -0.05 0.08 -0.07 0.00 -0.80 0.00 0.00 34.13 33.29 1axj s GLU 119 CO 0.14 -0.03 1.09 -1.14 -1.33 0.00 0.00 175.26 173.98 1axj s GLN 120 N -0.75 4.59 0.21 -4.83 2.00 -1.26 -1.13 119.66 118.48 1axj s GLN 120 Ca -0.08 1.67 0.00 0.00 -2.00 0.00 0.00 55.36 54.95 1axj s GLN 120 Cb -0.05 -3.31 0.00 0.00 0.80 0.00 0.00 33.01 30.45 1axj s GLN 120 CO -0.00 0.05 0.00 0.25 -0.50 0.00 0.00 175.29 175.09 1axj n THR 121 N 2.66 0.34 0.46 -0.34 -2.24 -1.23 -4.89 114.28 109.05 1axj n THR 121 Ca 0.03 0.11 0.06 0.00 -2.27 0.00 0.00 64.05 61.98 1axj n THR 121 Cb 0.47 -0.84 0.05 0.00 -2.10 0.00 0.00 70.33 67.90 1axj n THR 121 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50