#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2axl n ASP 2 N 0.00 0.00 0.27 7.83 8.00 -1.26 -3.16 116.55 128.23 2axl n ASP 2 Ca 0.00 -0.32 0.17 0.00 0.71 0.00 0.00 54.79 55.34 2axl n ASP 2 Cb 0.00 -0.21 0.63 0.00 -0.02 0.00 0.00 41.12 41.52 2axl n ASP 2 CO 0.00 0.00 0.00 0.44 -0.39 0.00 0.00 177.20 177.25 2axl h ASP 3 N 0.00 0.00 0.00 -2.24 3.32 -2.00 -3.29 116.42 112.21 2axl h ASP 3 Ca 0.00 0.00 -0.06 0.00 0.02 0.00 0.00 57.03 56.99 2axl h ASP 3 Cb 0.20 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.73 2axl h ASP 3 CO 0.00 0.01 0.05 -0.24 -1.72 0.00 0.00 179.24 177.34 2axl n SER 4 N -3.11 2.52 -4.77 6.45 2.88 -1.19 -4.85 113.62 111.56 2axl n SER 4 Ca 0.01 -1.87 -0.37 0.00 -1.33 0.00 0.00 58.87 55.31 2axl n SER 4 Cb 0.33 -0.63 -0.00 0.00 -0.75 0.00 0.00 64.21 63.15 2axl n SER 4 CO 0.00 0.00 0.00 -1.61 -1.23 0.00 0.00 175.04 172.20 2axl s GLU 5 N 1.72 3.67 0.00 -1.46 2.02 -1.24 -4.92 118.70 118.49 2axl s GLU 5 Ca 0.22 1.79 0.00 0.00 0.02 0.00 0.00 54.97 57.00 2axl s GLU 5 Cb 0.10 -2.35 0.00 0.00 0.10 0.00 0.00 34.13 31.98 2axl s GLU 5 CO 0.00 -0.63 0.00 -3.47 0.02 0.00 0.00 175.26 171.18 2axl n ASP 6 N -0.61 0.00 -4.24 -0.19 2.03 -1.19 -4.99 116.55 107.36 2axl n ASP 6 Ca 0.08 0.00 -0.28 0.00 0.52 0.00 0.00 54.79 55.11 2axl n ASP 6 Cb 0.48 0.00 -0.16 0.00 -0.72 0.00 0.00 41.12 40.72 2axl n ASP 6 CO 0.00 0.00 0.00 0.28 -1.92 0.00 0.00 177.20 175.56 2axl s THR 7 N 1.98 1.73 -0.30 5.18 -1.32 -1.17 -4.40 115.64 117.34 2axl s THR 7 Ca 0.00 -0.93 -0.03 0.00 -1.21 0.00 0.00 61.69 59.52 2axl s THR 7 Cb 0.00 -1.44 0.19 0.00 -1.51 0.00 0.00 72.50 69.74 2axl s THR 7 CO 0.00 0.49 0.72 -0.44 -2.21 0.00 0.00 174.62 173.18 2axl s SER 8 N -0.50 -1.19 0.00 8.08 0.01 0.25 0.35 113.70 120.70 2axl s SER 8 Ca 0.08 0.56 0.00 0.00 1.31 0.00 0.00 55.95 57.90 2axl s SER 8 Cb -0.09 1.92 0.00 0.00 0.21 0.00 0.00 66.02 68.07 2axl s SER 8 CO -0.01 -0.22 0.00 -2.67 0.41 0.00 0.00 173.24 170.75 2axl n TRP 9 N 5.42 0.00 -2.77 2.43 4.27 -1.16 -4.72 117.44 120.91 2axl n TRP 9 Ca -0.00 0.00 -0.43 0.00 -3.89 0.00 0.00 57.50 53.18 2axl n TRP 9 Cb 0.53 0.00 -0.04 0.00 -1.36 0.00 0.00 31.31 30.44 2axl n TRP 9 CO 0.00 0.00 0.00 0.34 -2.29 0.00 0.00 177.69 175.74 2axl s ASP 10 N 0.00 6.57 -0.29 -0.67 -1.08 -1.26 0.13 116.67 120.07 2axl s ASP 10 Ca 0.00 0.30 0.18 0.00 -0.52 0.00 0.00 52.55 52.52 2axl s ASP 10 Cb 0.00 -2.47 0.48 0.00 -1.46 0.00 0.00 42.92 39.47 2axl s ASP 10 CO 0.00 -1.04 1.07 0.33 0.52 0.00 0.00 175.17 176.05 2axl n PHE 11 N 7.19 1.57 -0.20 -5.34 7.35 -1.25 -4.90 117.46 121.88 2axl n PHE 11 Ca 0.07 -2.41 -0.01 0.00 -0.76 0.00 0.00 57.45 54.34 2axl n PHE 11 Cb 0.48 -0.28 0.09 0.00 0.35 0.00 0.00 39.48 40.13 2axl n PHE 11 CO 0.00 0.00 0.00 0.78 -0.76 0.00 0.00 176.76 176.78 2axl h GLY 12 N 2.67 0.86 0.00 7.13 0.00 -1.90 -3.20 103.07 108.63 2axl h GLY 12 Ca -0.03 -0.18 0.00 0.00 0.00 0.00 0.00 47.33 47.12 2axl h GLY 12 CO 0.39 0.07 0.00 -1.05 0.00 0.00 0.00 176.54 175.95 2axl n PRO 13 N -4.90 0.00 -0.10 4.80 -0.02 -1.26 0.28 135.00 133.79 2axl n PRO 13 Ca 0.08 0.38 0.23 0.00 -2.02 0.00 0.00 63.50 62.16 2axl n PRO 13 Cb 0.21 -0.66 0.68 0.00 -0.02 0.00 0.00 33.50 33.71 2axl n PRO 13 CO 0.00 0.00 0.00 1.96 1.98 0.00 0.00 175.50 179.44 2axl h GLN 14 N 0.00 0.05 0.07 -0.52 4.20 -1.96 2.59 115.11 119.55 2axl h GLN 14 Ca 0.00 -0.00 -0.09 0.00 0.06 0.00 0.00 58.65 58.61 2axl h GLN 14 Cb 0.00 -0.01 0.01 0.00 0.30 0.00 0.00 27.48 27.78 2axl h GLN 14 CO 0.00 0.04 -0.41 0.00 -0.67 0.00 0.00 178.83 177.79 2axl h ALA 15 N 1.65 -0.05 -0.27 3.87 0.00 0.38 0.71 119.26 125.55 2axl h ALA 15 Ca 0.34 -0.60 -0.03 0.00 0.00 0.00 0.00 54.91 54.62 2axl h ALA 15 Cb 1.29 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 19.12 2axl h ALA 15 CO -0.02 0.19 0.04 0.74 0.00 0.00 0.00 179.25 180.20 2axl h PHE 16 N -0.68 0.47 -0.87 0.00 0.04 0.50 0.17 116.94 116.57 2axl h PHE 16 Ca -0.07 -0.07 0.00 0.00 2.80 0.00 0.00 57.97 60.63 2axl h PHE 16 Cb 1.32 -0.13 -0.04 0.00 2.20 0.00 0.00 35.95 39.30 2axl h PHE 16 CO 0.24 0.55 0.55 0.87 -0.60 0.00 0.00 178.31 179.92 2axl h LYS 17 N 0.26 1.16 -0.76 1.51 1.57 0.44 0.87 116.57 121.63 2axl h LYS 17 Ca 0.08 -0.09 -0.01 0.00 -1.87 0.00 0.00 60.65 58.76 2axl h LYS 17 Cb 0.34 -0.25 -0.04 0.00 0.08 0.00 0.00 32.23 32.36 2axl h LYS 17 CO 0.01 0.80 0.43 1.25 -0.57 0.00 0.00 179.45 181.37 2axl h LEU 18 N 1.19 0.93 -0.57 2.94 6.46 0.13 -2.34 115.31 124.04 2axl h LEU 18 Ca 0.31 -0.08 -0.01 0.00 -0.12 0.00 0.00 57.88 57.98 2axl h LEU 18 Cb -0.09 -0.24 -0.03 0.00 -0.73 0.00 0.00 40.66 39.58 2axl h LEU 18 CO -0.06 0.74 0.31 -0.07 -0.62 0.00 0.00 178.44 178.73 2axl h LEU 19 N 1.04 0.72 -2.04 2.25 3.38 0.97 -2.35 115.31 119.28 2axl h LEU 19 Ca 0.27 -0.10 -0.01 0.00 0.09 0.00 0.00 57.88 58.13 2axl h LEU 19 Cb 0.00 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 40.57 2axl h LEU 19 CO -0.05 0.61 -0.04 -1.28 0.09 0.00 0.00 178.44 177.77 2axl h SER 20 N 0.77 0.00 -0.12 -0.43 0.87 -0.36 -2.96 113.55 111.32 2axl h SER 20 Ca 0.20 0.00 -0.05 0.00 -1.23 0.00 0.00 61.79 60.71 2axl h SER 20 Cb 0.06 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 62.02 2axl h SER 20 CO -0.03 0.04 -0.12 0.00 -0.53 0.00 0.00 176.83 176.19 2axl h ALA 21 N 1.96 0.18 -0.90 6.23 0.00 -1.18 0.21 119.26 125.76 2axl h ALA 21 Ca -0.00 -0.31 -0.00 0.00 0.00 0.00 0.00 54.91 54.60 2axl h ALA 21 Cb 0.32 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.02 2axl h ALA 21 CO 0.01 0.04 0.55 -0.39 0.00 0.00 0.00 179.25 179.46 2axl h VAL 22 N -0.09 1.25 -0.25 0.00 -1.51 -1.51 -1.06 116.25 113.08 2axl h VAL 22 Ca 0.02 -0.52 -0.01 0.00 -1.23 0.00 0.00 66.70 64.96 2axl h VAL 22 Cb 0.64 -0.03 -0.01 0.00 -2.13 0.00 0.00 31.29 29.76 2axl h VAL 22 CO 0.03 0.25 0.12 -0.78 -1.23 0.00 0.00 177.57 175.97 2axl h ASP 23 N 1.24 0.32 -0.05 4.19 3.58 -1.42 1.70 116.42 125.97 2axl h ASP 23 Ca 0.32 -0.11 0.02 0.00 0.42 0.00 0.00 57.03 57.68 2axl h ASP 23 Cb -0.07 -0.08 -0.00 0.00 1.72 0.00 0.00 39.33 40.90 2axl h ASP 23 CO -0.06 0.34 0.05 0.40 -2.88 0.00 0.00 179.24 177.09 2axl h ILE 24 N 0.27 0.62 -0.01 2.25 1.08 0.19 1.70 117.51 123.60 2axl h ILE 24 Ca 0.09 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.56 2axl h ILE 24 Cb 0.10 0.96 0.00 0.00 -3.07 0.00 0.00 36.82 34.81 2axl h ILE 24 CO -0.01 0.00 -0.02 0.18 -0.69 0.00 0.00 178.15 177.61 2axl n LEU 25 N -4.00 1.01 -0.57 1.44 4.77 -0.08 -4.88 117.00 114.69 2axl n LEU 25 Ca -0.02 -0.32 -0.06 0.00 -0.03 0.00 0.00 56.01 55.58 2axl n LEU 25 Cb 0.15 -0.02 -0.02 0.00 -2.33 0.00 0.00 43.42 41.20 2axl n LEU 25 CO 0.29 0.17 -0.07 0.61 -1.33 0.00 0.00 177.39 177.06 2axl n GLY 26 N 1.14 0.65 2.99 -0.72 0.00 0.58 -3.37 105.19 106.46 2axl n GLY 26 Ca 0.20 -0.72 -0.00 0.00 0.00 0.00 0.00 46.02 45.49 2axl n GLY 26 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2axl n GLU 27 N -2.47 -1.98 -0.05 1.61 1.02 0.55 -4.81 120.64 114.52 2axl n GLU 27 Ca -0.07 0.51 -0.00 0.00 -0.02 0.00 0.00 57.16 57.58 2axl n GLU 27 Cb 0.31 -5.00 0.02 0.00 -0.02 0.00 0.00 31.44 26.75 2axl n GLU 27 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 2axl n LYS 28 N 0.90 1.14 -3.98 3.49 4.76 -1.22 -4.76 118.16 118.50 2axl n LYS 28 Ca -0.00 -0.15 -0.09 0.00 -2.87 0.00 0.00 58.31 55.20 2axl n LYS 28 Cb 0.50 -1.35 -0.11 0.00 -1.84 0.00 0.00 35.03 32.23 2axl n LYS 28 CO 0.00 0.00 0.00 -0.06 -1.37 0.00 0.00 177.40 175.97 2axl s PHE 29 N -0.73 0.25 0.00 2.13 0.40 -1.26 -5.06 117.98 113.71 2axl s PHE 29 Ca 0.03 -0.52 0.00 0.00 -0.60 0.00 0.00 56.93 55.84 2axl s PHE 29 Cb 0.02 -0.19 0.00 0.00 0.51 0.00 0.00 43.02 43.36 2axl s PHE 29 CO 0.01 -0.19 0.00 0.41 0.70 0.00 0.00 175.22 176.14 2axl n GLY 30 N 1.59 1.68 0.26 4.36 0.00 -1.26 -3.92 105.19 107.91 2axl n GLY 30 Ca -0.24 -2.02 0.07 0.00 0.00 0.00 0.00 46.02 43.82 2axl n GLY 30 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 2axl h ILE 31 N -0.02 1.05 0.00 -0.61 2.10 -1.79 -3.36 117.51 114.89 2axl h ILE 31 Ca 0.00 -0.17 0.00 0.00 1.08 0.00 0.00 64.86 65.77 2axl h ILE 31 Cb 0.00 0.96 0.00 0.00 -1.09 0.00 0.00 36.82 36.69 2axl h ILE 31 CO 0.00 0.06 0.00 0.61 -1.08 0.00 0.00 178.15 177.74 2axl n GLY 32 N -1.42 -2.72 0.07 8.18 0.00 -1.26 -2.42 105.19 105.63 2axl n GLY 32 Ca -0.02 0.54 -0.12 0.00 0.00 0.00 0.00 46.02 46.43 2axl n GLY 32 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2axl h LEU 33 N 0.00 0.10 -0.91 0.99 5.85 -1.98 -3.23 115.31 116.12 2axl h LEU 33 Ca 0.00 -0.23 0.14 0.00 0.84 0.00 0.00 57.88 58.63 2axl h LEU 33 Cb 0.00 -0.03 -0.15 0.00 0.37 0.00 0.00 40.66 40.86 2axl h LEU 33 CO 0.00 0.30 -0.35 -2.65 -0.34 0.00 0.00 178.44 175.40 2axl n PRO 34 N -4.91 -0.21 -0.14 5.25 -0.02 -1.08 0.19 135.00 134.09 2axl n PRO 34 Ca -0.07 1.40 -0.09 0.00 -2.02 0.00 0.00 63.50 62.73 2axl n PRO 34 Cb 0.15 -2.08 -0.00 0.00 -0.02 0.00 0.00 33.50 31.54 2axl n PRO 34 CO 0.00 0.00 0.00 0.97 1.98 0.00 0.00 175.50 178.45 2axl h ILE 35 N 0.00 1.18 -0.50 4.25 2.10 -1.54 0.91 117.51 123.91 2axl h ILE 35 Ca 0.32 -0.51 -0.01 0.00 1.08 0.00 0.00 64.86 65.74 2axl h ILE 35 Cb 0.55 0.77 -0.02 0.00 -1.09 0.00 0.00 36.82 37.02 2axl h ILE 35 CO -0.90 0.19 0.28 -0.07 -1.08 0.00 0.00 178.15 176.57 2axl h LEU 36 N 0.51 0.62 0.01 2.19 3.38 -0.33 -3.22 115.31 118.47 2axl h LEU 36 Ca 0.14 -0.08 -0.25 0.00 0.09 0.00 0.00 57.88 57.78 2axl h LEU 36 Cb 0.13 -0.16 -0.04 0.00 0.09 0.00 0.00 40.66 40.69 2axl h LEU 36 CO -0.02 0.52 -1.34 0.15 0.09 0.00 0.00 178.44 177.84 2axl h PHE 37 N 0.66 0.06 -0.67 1.13 3.04 0.25 -2.53 116.94 118.88 2axl h PHE 37 Ca 0.18 -0.04 -0.05 0.00 3.98 0.00 0.00 57.97 62.04 2axl h PHE 37 Cb 0.03 -0.00 -0.03 0.00 2.56 0.00 0.00 35.95 38.51 2axl h PHE 37 CO -0.02 1.05 0.24 -0.07 -2.02 0.00 0.00 178.31 177.48 2axl h LEU 38 N 0.01 0.93 0.00 0.59 3.38 0.83 -2.57 115.31 118.48 2axl h LEU 38 Ca -0.15 -0.15 0.00 0.00 0.09 0.00 0.00 57.88 57.67 2axl h LEU 38 Cb 1.90 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 42.40 2axl h LEU 38 CO 0.11 0.86 0.00 0.54 0.09 0.00 0.00 178.44 180.04 2axl n ARG 39 N -4.28 0.41 -2.15 1.13 1.74 -1.22 0.06 116.66 112.34 2axl n ARG 39 Ca 0.06 0.07 -0.04 0.00 -0.77 0.00 0.00 57.85 57.16 2axl n ARG 39 Cb 0.20 -1.50 0.02 0.00 -1.02 0.00 0.00 32.46 30.16 2axl n ARG 39 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2axl n GLY 40 N 0.35 0.30 3.68 -0.13 0.00 -0.97 -4.37 105.19 104.06 2axl n GLY 40 Ca 0.11 -0.17 -0.30 0.00 0.00 0.00 0.00 46.02 45.66 2axl n GLY 40 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2axl s SER 41 N -3.22 3.14 -0.34 1.61 1.04 -0.95 -4.89 113.70 110.08 2axl s SER 41 Ca 0.07 1.61 -0.28 0.00 0.48 0.00 0.00 55.95 57.83 2axl s SER 41 Cb -0.01 -2.27 -0.02 0.00 0.10 0.00 0.00 66.02 63.82 2axl s SER 41 CO 0.20 -2.87 1.87 0.21 0.98 0.00 0.00 173.24 173.62 2axl s ASN 42 N -3.19 5.75 -0.32 7.02 3.84 -1.26 -4.86 114.94 121.91 2axl s ASN 42 Ca 0.64 1.28 0.05 0.00 0.21 0.00 0.00 52.86 55.04 2axl s ASN 42 Cb -0.19 -2.52 0.19 0.00 -0.55 0.00 0.00 41.25 38.17 2axl s ASN 42 CO 0.58 -1.83 0.65 -0.55 -2.79 0.00 0.00 177.10 173.16 2axl s SER 43 N 6.67 -1.48 0.18 -4.21 0.15 -1.26 -5.04 113.70 108.71 2axl s SER 43 Ca 0.82 -0.09 -0.06 0.00 0.70 0.00 0.00 55.95 57.32 2axl s SER 43 Cb -0.23 1.91 0.08 0.00 -1.71 0.00 0.00 66.02 66.08 2axl s SER 43 CO 0.32 -0.24 1.53 -0.61 1.20 0.00 0.00 173.24 175.44 2axl h GLN 44 N 7.60 0.76 -0.54 5.44 5.75 -1.97 -1.35 115.11 130.79 2axl h GLN 44 Ca -0.00 -0.39 -0.08 0.00 -0.15 0.00 0.00 58.65 58.03 2axl h GLN 44 Cb 1.19 0.01 -0.02 0.00 1.07 0.00 0.00 27.48 29.73 2axl h GLN 44 CO 0.11 1.02 0.04 -0.09 -2.65 0.00 0.00 178.83 177.26 2axl h ARG 45 N 0.62 0.93 -0.00 1.69 2.43 -2.00 -2.17 114.38 115.87 2axl h ARG 45 Ca 0.05 -0.27 0.00 0.00 -0.81 0.00 0.00 59.98 58.95 2axl h ARG 45 Cb 0.95 -0.10 0.00 0.00 -0.42 0.00 0.00 29.97 30.41 2axl h ARG 45 CO 0.09 0.92 -0.32 1.28 -1.51 0.00 0.00 179.97 180.43 2axl n LEU 46 N -4.31 0.66 0.09 3.80 4.77 -1.23 -3.14 117.00 117.64 2axl n LEU 46 Ca 0.02 -0.06 0.12 0.00 -0.03 0.00 0.00 56.01 56.05 2axl n LEU 46 Cb 0.30 -0.21 0.02 0.00 -2.33 0.00 0.00 43.42 41.19 2axl n LEU 46 CO 0.42 0.14 0.03 0.00 -1.33 0.00 0.00 177.39 176.65 2axl n ALA 47 N -1.11 2.65 -0.04 -1.18 0.00 -0.51 -2.80 120.51 117.51 2axl n ALA 47 Ca 0.09 -0.26 -0.21 0.00 0.00 0.00 0.00 53.44 53.07 2axl n ALA 47 Cb 0.33 -1.09 -0.13 0.00 0.00 0.00 0.00 19.45 18.56 2axl n ALA 47 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2axl n ASP 48 N -2.54 2.06 0.10 0.00 8.00 -0.84 -3.27 116.55 120.07 2axl n ASP 48 Ca 0.00 0.14 -0.12 0.00 0.71 0.00 0.00 54.79 55.53 2axl n ASP 48 Cb 0.53 -0.75 -0.08 0.00 -0.02 0.00 0.00 41.12 40.80 2axl n ASP 48 CO 0.00 0.00 0.00 1.56 -0.39 0.00 0.00 177.20 178.37 2axl h GLN 49 N -0.08 -0.30 -1.24 -1.24 4.20 -1.71 -3.19 115.11 111.55 2axl h GLN 49 Ca -0.47 0.02 -0.35 0.00 0.06 0.00 0.00 58.65 57.91 2axl h GLN 49 Cb 1.92 0.07 -0.17 0.00 0.30 0.00 0.00 27.48 29.60 2axl h GLN 49 CO -0.00 0.07 0.46 0.66 -0.67 0.00 0.00 178.83 179.34 2axl n TYR 50 N -5.02 1.84 -0.24 2.96 4.01 -1.12 -4.54 117.16 115.05 2axl n TYR 50 Ca -0.08 -1.80 -0.06 0.00 -0.16 0.00 0.00 57.90 55.80 2axl n TYR 50 Cb 0.26 -0.88 0.08 0.00 -0.31 0.00 0.00 39.34 38.48 2axl n TYR 50 CO 0.00 0.00 0.00 0.07 -0.46 0.00 0.00 176.86 176.47 2axl h ARG 51 N 1.15 1.09 0.00 -0.72 0.11 -1.54 -2.67 114.38 111.81 2axl h ARG 51 Ca 0.36 -0.25 0.00 0.00 0.10 0.00 0.00 59.98 60.19 2axl h ARG 51 Cb 1.41 -0.15 0.00 0.00 1.11 0.00 0.00 29.97 32.33 2axl h ARG 51 CO 0.81 0.95 0.00 0.00 0.10 0.00 0.00 179.97 181.83 2axl h ARG 52 N 1.04 0.00 -5.67 0.08 2.47 -1.87 -3.45 114.38 106.99 2axl h ARG 52 Ca 0.22 0.00 -0.65 0.00 -1.26 0.00 0.00 59.98 58.30 2axl h ARG 52 Cb 0.34 0.00 -0.05 0.00 -1.65 0.00 0.00 29.97 28.61 2axl h ARG 52 CO -0.00 0.00 1.50 1.58 0.56 0.00 0.00 179.97 183.61 2axl n HIS 53 N -2.70 1.09 -0.20 3.04 -0.00 -1.01 -4.82 115.22 110.62 2axl n HIS 53 Ca 0.04 0.50 -0.07 0.00 0.46 0.00 0.00 57.72 58.64 2axl n HIS 53 Cb 0.43 -2.39 0.03 0.00 -0.12 0.00 0.00 29.99 27.93 2axl n HIS 53 CO 0.00 0.00 0.00 1.03 0.46 0.00 0.00 176.34 177.83 2axl h SER 54 N 11.38 0.78 0.00 0.26 0.87 -1.89 -2.55 113.55 122.39 2axl h SER 54 Ca -0.13 -0.16 0.00 0.00 -1.23 0.00 0.00 61.79 60.27 2axl h SER 54 Cb 1.36 -0.20 0.00 0.00 -0.44 0.00 0.00 62.40 63.11 2axl h SER 54 CO 1.17 0.72 0.11 -0.07 -0.53 0.00 0.00 176.83 178.23 2axl h LEU 55 N 0.79 0.00 -9.54 2.23 3.38 -1.97 -3.43 115.31 106.77 2axl h LEU 55 Ca 0.19 0.00 -0.56 0.00 0.09 0.00 0.00 57.88 57.60 2axl h LEU 55 Cb 0.17 0.00 0.05 0.00 0.09 0.00 0.00 40.66 40.98 2axl h LEU 55 CO -0.02 0.00 0.90 0.33 0.09 0.00 0.00 178.44 179.74 2axl n PHE 56 N -2.87 2.44 -1.68 1.13 -0.00 -0.96 -2.78 117.46 112.73 2axl n PHE 56 Ca -0.02 0.15 -0.10 0.00 -0.00 0.00 0.00 57.45 57.48 2axl n PHE 56 Cb 0.17 -2.60 -0.03 0.00 -0.00 0.00 0.00 39.48 37.02 2axl n PHE 56 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 2axl n GLY 57 N 3.69 0.65 0.05 7.13 0.00 0.11 -4.84 105.19 111.97 2axl n GLY 57 Ca 0.17 -0.52 0.11 0.00 0.00 0.00 0.00 46.02 45.78 2axl n GLY 57 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2axl n THR 58 N -3.26 0.24 1.88 2.61 -1.04 -0.89 -3.48 114.28 110.34 2axl n THR 58 Ca -0.11 -0.40 0.15 0.00 -2.04 0.00 0.00 64.05 61.66 2axl n THR 58 Cb 0.45 0.02 0.90 0.00 -1.82 0.00 0.00 70.33 69.87 2axl n THR 58 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2axl n GLY 59 N 1.29 -1.00 0.33 3.41 0.00 -1.17 -3.77 105.19 104.29 2axl n GLY 59 Ca -0.00 -0.19 0.01 0.00 0.00 0.00 0.00 46.02 45.84 2axl n GLY 59 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2axl h LYS 60 N 0.00 0.98 0.00 1.61 3.64 -1.71 -1.58 116.57 119.51 2axl h LYS 60 Ca 0.00 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.32 2axl h LYS 60 Cb 0.03 -0.22 0.00 0.00 -0.41 0.00 0.00 32.23 31.63 2axl h LYS 60 CO 0.00 0.65 0.00 0.38 -2.27 0.00 0.00 179.45 178.21 2axl h ASP 61 N 1.01 0.00 -3.16 4.20 2.03 -1.85 -3.44 116.42 115.22 2axl h ASP 61 Ca 0.38 0.00 -0.58 0.00 -0.73 0.00 0.00 57.03 56.10 2axl h ASP 61 Cb 0.16 0.00 -0.04 0.00 -0.83 0.00 0.00 39.33 38.62 2axl h ASP 61 CO -0.17 0.00 -0.19 -1.10 -1.03 0.00 0.00 179.24 176.75 2axl s GLN 62 N -3.69 3.86 0.92 4.15 -0.21 -0.60 -5.08 119.66 119.02 2axl s GLN 62 Ca 0.01 0.32 -0.13 0.00 0.02 0.00 0.00 55.36 55.58 2axl s GLN 62 Cb 0.09 -3.02 0.14 0.00 1.00 0.00 0.00 33.01 31.22 2axl s GLN 62 CO 0.53 0.56 1.15 0.95 -2.12 0.00 0.00 175.29 176.36 2axl s THR 63 N -1.35 1.98 0.13 -0.19 -4.23 -1.26 -4.94 115.64 105.77 2axl s THR 63 Ca 0.33 0.00 -0.18 0.00 -1.18 0.00 0.00 61.69 60.65 2axl s THR 63 Cb -0.15 -2.76 -0.04 0.00 1.34 0.00 0.00 72.50 70.89 2axl s THR 63 CO 0.18 0.00 1.76 -0.08 -0.54 0.00 0.00 174.62 175.94 2axl h GLU 64 N -1.53 0.37 0.00 3.99 4.57 -1.98 -3.06 114.58 116.93 2axl h GLU 64 Ca -0.50 -0.03 -0.08 0.00 -1.18 0.00 0.00 59.36 57.57 2axl h GLU 64 Cb 1.33 -0.08 -0.01 0.00 -0.16 0.00 0.00 28.75 29.83 2axl h GLU 64 CO 0.60 0.27 -0.39 0.66 -1.18 0.00 0.00 179.01 178.97 2axl h SER 65 N 0.35 0.00 -0.23 1.04 4.64 -1.98 -0.66 113.55 116.72 2axl h SER 65 Ca 0.10 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.41 2axl h SER 65 Cb -0.00 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.08 2axl h SER 65 CO -0.02 0.39 0.12 -0.25 -0.87 0.00 0.00 176.83 176.20 2axl h TRP 66 N 0.00 0.33 -0.28 4.77 2.91 -1.85 0.41 115.95 122.23 2axl h TRP 66 Ca -0.00 -0.01 -0.02 0.00 1.13 0.00 0.00 58.89 59.99 2axl h TRP 66 Cb 0.76 -0.10 -0.01 0.00 -0.51 0.00 0.00 29.16 29.30 2axl h TRP 66 CO 0.00 0.31 0.11 -1.49 -1.03 0.00 0.00 178.44 176.34 2axl h TRP 67 N 0.25 0.44 0.00 2.65 4.06 -1.47 0.93 115.95 122.80 2axl h TRP 67 Ca 0.08 -0.03 0.00 0.00 2.06 0.00 0.00 58.89 61.00 2axl h TRP 67 Cb 0.10 -0.13 0.00 0.00 -1.00 0.00 0.00 29.16 28.13 2axl h TRP 67 CO -0.03 0.44 0.00 1.17 -3.56 0.00 0.00 178.44 176.46 2axl n LYS 68 N -4.75 0.00 -0.29 0.49 3.00 -0.27 -0.07 118.16 116.26 2axl n LYS 68 Ca -0.02 0.77 0.14 0.00 -0.00 0.00 0.00 58.31 59.20 2axl n LYS 68 Cb 0.13 -1.43 0.40 0.00 0.00 0.00 0.00 35.03 34.13 2axl n LYS 68 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2axl h ALA 69 N -1.41 1.89 -0.39 3.14 0.00 -0.09 -1.11 119.26 121.29 2axl h ALA 69 Ca 0.00 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 2axl h ALA 69 Cb 0.00 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 2axl h ALA 69 CO 0.00 -0.18 0.23 0.35 0.00 0.00 0.00 179.25 179.65 2axl h PHE 70 N 0.64 0.51 -1.00 0.00 3.57 0.33 -2.14 116.94 118.85 2axl h PHE 70 Ca 0.50 -0.00 0.05 0.00 3.53 0.00 0.00 57.97 62.05 2axl h PHE 70 Cb 0.90 -0.17 -0.06 0.00 2.79 0.00 0.00 35.95 39.41 2axl h PHE 70 CO -0.00 0.37 0.65 0.77 -2.23 0.00 0.00 178.31 177.86 2axl h SER 71 N 0.51 1.06 -0.85 0.41 0.02 0.82 -1.80 113.55 113.72 2axl h SER 71 Ca 0.14 0.00 0.02 0.00 -0.84 0.00 0.00 61.79 61.11 2axl h SER 71 Cb 0.00 -0.23 -0.05 0.00 0.14 0.00 0.00 62.40 62.27 2axl h SER 71 CO -0.03 0.70 0.56 -0.09 -1.14 0.00 0.00 176.83 176.83 2axl h ARG 72 N 1.21 1.07 -0.78 3.45 2.43 -1.03 -2.55 114.38 118.18 2axl h ARG 72 Ca 0.42 -0.06 0.12 0.00 -0.81 0.00 0.00 59.98 59.64 2axl h ARG 72 Cb 0.09 -0.24 -0.08 0.00 -0.42 0.00 0.00 29.97 29.32 2axl h ARG 72 CO -0.15 0.71 0.38 1.96 -1.51 0.00 0.00 179.97 181.36 2axl h GLN 73 N 1.10 0.58 -0.71 0.20 4.20 -0.87 -2.49 115.11 117.12 2axl h GLN 73 Ca 0.33 -0.03 -0.06 0.00 0.06 0.00 0.00 58.65 58.94 2axl h GLN 73 Cb -0.05 -0.13 -0.03 0.00 0.30 0.00 0.00 27.48 27.57 2axl h GLN 73 CO -0.10 0.38 0.20 -0.07 -0.67 0.00 0.00 178.83 178.58 2axl h LEU 74 N 0.60 1.04 -0.36 1.46 3.38 -1.43 -3.00 115.31 117.00 2axl h LEU 74 Ca 0.41 -0.20 -0.01 0.00 0.09 0.00 0.00 57.88 58.16 2axl h LEU 74 Cb 0.51 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.98 2axl h LEU 74 CO -0.32 0.97 0.18 0.40 0.09 0.00 0.00 178.44 179.76 2axl h ILE 75 N 1.06 1.16 -0.42 1.22 2.04 -1.41 -2.73 117.51 118.44 2axl h ILE 75 Ca 0.23 -0.44 -0.10 0.00 1.00 0.00 0.00 64.86 65.55 2axl h ILE 75 Cb 0.32 0.79 -0.01 0.00 -0.74 0.00 0.00 36.82 37.18 2axl h ILE 75 CO -0.00 0.17 -0.12 0.74 0.00 0.00 0.00 178.15 178.94 2axl h THR 76 N 0.45 1.28 -0.07 -0.27 2.02 -1.55 -3.04 112.91 111.72 2axl h THR 76 Ca 0.13 -1.23 0.02 0.00 0.77 0.00 0.00 66.41 66.10 2axl h THR 76 Cb 0.10 1.20 -0.00 0.00 -1.74 0.00 0.00 68.15 67.71 2axl h THR 76 CO -0.02 0.41 0.08 -0.33 0.37 0.00 0.00 175.52 176.04 2axl h GLU 77 N 0.64 0.00 0.00 6.66 5.08 -1.49 -3.45 114.58 122.02 2axl h GLU 77 Ca 0.10 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.46 2axl h GLU 77 Cb 0.65 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.90 2axl h GLU 77 CO 0.04 0.00 0.00 0.41 -1.00 0.00 0.00 179.01 178.46 2axl n GLY 78 N -1.36 3.18 0.34 -3.84 0.00 -1.15 -4.89 105.19 97.46 2axl n GLY 78 Ca -0.01 0.00 0.17 0.00 0.00 0.00 0.00 46.02 46.17 2axl n GLY 78 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 2axl h PHE 79 N 0.00 0.00 -4.04 1.61 -1.00 -1.83 -3.41 116.94 108.28 2axl h PHE 79 Ca 0.00 0.00 -0.47 0.00 2.81 0.00 0.00 57.97 60.31 2axl h PHE 79 Cb 0.00 0.00 -0.30 0.00 3.61 0.00 0.00 35.95 39.26 2axl h PHE 79 CO 0.00 0.00 -0.80 -1.17 -1.61 0.00 0.00 178.31 174.73 2axl s LEU 80 N -8.07 1.95 -0.05 1.54 2.96 -1.03 -4.50 118.68 111.46 2axl s LEU 80 Ca -0.05 -0.24 0.06 0.00 -0.22 0.00 0.00 54.13 53.68 2axl s LEU 80 Cb 0.17 -0.68 -0.01 0.00 0.50 0.00 0.00 46.19 46.17 2axl s LEU 80 CO 0.61 0.13 -0.23 0.54 -1.32 0.00 0.00 176.35 176.08 2axl s VAL 81 N -0.12 1.88 -0.06 1.68 0.11 -1.20 -4.39 120.40 118.30 2axl s VAL 81 Ca 0.02 -0.97 0.04 0.00 -2.93 0.00 0.00 61.98 58.14 2axl s VAL 81 Cb -0.07 -1.60 -0.02 0.00 -1.53 0.00 0.00 36.38 33.16 2axl s VAL 81 CO 0.00 0.53 -0.16 -1.61 -3.33 0.00 0.00 175.10 170.53 2axl s GLU 82 N -0.10 2.56 -0.11 1.54 2.02 -1.26 -1.69 118.70 121.66 2axl s GLU 82 Ca -0.04 -0.73 0.02 0.00 0.02 0.00 0.00 54.97 54.24 2axl s GLU 82 Cb -0.13 -2.36 -0.01 0.00 0.10 0.00 0.00 34.13 31.73 2axl s GLU 82 CO 0.03 0.56 -0.17 0.08 0.02 0.00 0.00 175.26 175.79 2axl s VAL 83 N -0.58 2.69 -0.78 2.63 1.01 -1.10 -4.97 120.40 119.30 2axl s VAL 83 Ca 0.08 -0.80 0.26 0.00 0.00 0.00 0.00 61.98 61.52 2axl s VAL 83 Cb -0.11 -2.09 0.14 0.00 0.00 0.00 0.00 36.38 34.32 2axl s VAL 83 CO 0.01 0.54 1.56 -0.24 0.00 0.00 0.00 175.10 176.97 2axl n SER 84 N 3.44 0.59 -0.30 3.32 2.88 -1.26 -2.23 113.62 120.06 2axl n SER 84 Ca -0.18 0.25 0.04 0.00 -1.33 0.00 0.00 58.87 57.65 2axl n SER 84 Cb 0.53 -0.20 0.13 0.00 -0.75 0.00 0.00 64.21 63.92 2axl n SER 84 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 2axl n ARG 85 N -1.96 1.38 -3.65 -1.46 1.74 -1.26 -4.63 116.66 106.82 2axl n ARG 85 Ca 0.05 -0.58 -0.23 0.00 -0.77 0.00 0.00 57.85 56.31 2axl n ARG 85 Cb 0.40 -1.16 -0.17 0.00 -1.02 0.00 0.00 32.46 30.51 2axl n ARG 85 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 2axl s TYR 86 N -1.80 0.18 0.00 -1.55 1.51 -1.22 -4.99 117.35 109.49 2axl s TYR 86 Ca 0.14 -0.07 0.00 0.00 -1.01 0.00 0.00 57.07 56.13 2axl s TYR 86 Cb 0.07 -0.61 0.00 0.00 -0.11 0.00 0.00 41.96 41.31 2axl s TYR 86 CO 0.10 -0.36 0.00 0.09 -1.11 0.00 0.00 175.55 174.27 2axl n ASN 87 N 5.27 -1.01 0.00 2.29 5.03 -1.26 0.86 115.26 126.45 2axl n ASN 87 Ca -0.05 0.00 0.04 0.00 0.87 0.00 0.00 54.58 55.43 2axl n ASN 87 Cb 0.49 -0.50 0.19 0.00 -1.02 0.00 0.00 39.78 38.94 2axl n ASN 87 CO 0.00 0.00 0.00 1.17 -1.83 0.00 0.00 177.26 176.60 2axl n LYS 88 N 0.09 0.11 0.00 3.52 0.00 -1.26 -2.59 118.16 118.04 2axl n LYS 88 Ca 0.00 0.20 0.00 0.00 0.00 0.00 0.00 58.31 58.51 2axl n LYS 88 Cb 0.00 -1.50 0.00 0.00 0.00 0.00 0.00 35.03 33.53 2axl n LYS 88 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.40 178.59 2axl n PHE 89 N -1.27 0.00 -3.19 5.64 3.72 -1.26 -4.93 117.46 116.18 2axl n PHE 89 Ca 0.04 0.00 0.01 0.00 -0.05 0.00 0.00 57.45 57.45 2axl n PHE 89 Cb 0.06 -0.14 -0.01 0.00 -0.94 0.00 0.00 39.48 38.45 2axl n PHE 89 CO 0.00 0.00 0.00 1.41 -0.05 0.00 0.00 176.76 178.12 2axl s MET 90 N -0.60 0.77 0.00 -1.08 0.00 -1.07 -5.08 119.30 112.24 2axl s MET 90 Ca 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 55.69 55.49 2axl s MET 90 Cb 0.00 0.11 0.00 0.00 0.00 0.00 0.00 34.83 34.94 2axl s MET 90 CO 0.00 -1.13 0.00 1.63 0.00 0.00 0.00 175.02 175.52 2axl n LYS 91 N 4.45 -0.13 -1.21 4.11 5.02 -1.23 -4.07 118.16 125.09 2axl n LYS 91 Ca 0.10 0.34 -0.38 0.00 -2.02 0.00 0.00 58.31 56.36 2axl n LYS 91 Cb 0.57 -0.42 0.03 0.00 -0.02 0.00 0.00 35.03 35.20 2axl n LYS 91 CO 0.00 0.00 0.00 1.51 -0.52 0.00 0.00 177.40 178.39 2axl n ILE 92 N 0.88 0.56 -3.30 -0.18 3.06 0.25 -4.50 119.36 116.14 2axl n ILE 92 Ca 0.00 -0.48 -0.38 0.00 -2.50 0.00 0.00 62.75 59.39 2axl n ILE 92 Cb 0.21 -0.22 -0.06 0.00 0.54 0.00 0.00 39.64 40.11 2axl n ILE 92 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 2axl s ALA 94 N 0.61 2.12 0.14 0.00 0.00 -0.68 -4.86 121.76 119.08 2axl s ALA 94 Ca 0.27 -1.00 -0.30 0.00 0.00 0.00 0.00 51.96 50.93 2axl s ALA 94 Cb -0.15 -0.69 -0.07 0.00 0.00 0.00 0.00 23.12 22.21 2axl s ALA 94 CO 0.11 0.38 0.99 -0.51 0.00 0.00 0.00 175.76 176.73 2axl s LEU 95 N -0.03 4.51 0.47 0.00 1.43 -1.26 -3.25 118.68 120.56 2axl s LEU 95 Ca -0.07 1.89 0.08 0.00 -1.03 0.00 0.00 54.13 55.00 2axl s LEU 95 Cb -0.15 -3.59 0.04 0.00 0.03 0.00 0.00 46.19 42.51 2axl s LEU 95 CO 0.05 -0.08 0.65 0.42 0.23 0.00 0.00 176.35 177.62 2axl s THR 96 N -0.20 2.72 0.26 5.49 -4.23 -1.26 -4.86 115.64 113.57 2axl s THR 96 Ca 0.47 -0.99 -0.05 0.00 -1.18 0.00 0.00 61.69 59.95 2axl s THR 96 Cb -0.25 -2.74 0.26 0.00 1.34 0.00 0.00 72.50 71.11 2axl s THR 96 CO 0.31 0.00 1.93 0.11 -0.54 0.00 0.00 174.62 176.43 2axl h LYS 97 N 0.47 1.25 -0.37 3.99 1.79 -1.96 0.33 116.57 122.07 2axl h LYS 97 Ca -0.37 -0.08 -0.01 0.00 -2.18 0.00 0.00 60.65 58.01 2axl h LYS 97 Cb 1.28 -0.28 -0.02 0.00 -1.58 0.00 0.00 32.23 31.63 2axl h LYS 97 CO 0.44 0.83 0.19 1.57 -1.08 0.00 0.00 179.45 181.39 2axl h LYS 98 N 1.29 0.53 0.08 3.15 2.10 -1.94 -2.51 116.57 119.26 2axl h LYS 98 Ca 0.37 -0.07 -0.26 0.00 -2.00 0.00 0.00 60.65 58.69 2axl h LYS 98 Cb -0.09 -0.10 -0.01 0.00 -0.90 0.00 0.00 32.23 31.13 2axl h LYS 98 CO -0.09 0.46 -1.21 0.78 -2.00 0.00 0.00 179.45 177.39 2axl h GLY 99 N 0.47 0.19 1.15 0.07 0.00 -1.69 -3.12 103.07 100.13 2axl h GLY 99 Ca 0.13 -0.48 -0.03 0.00 0.00 0.00 0.00 47.33 46.95 2axl h GLY 99 CO -0.02 0.42 0.38 -0.09 0.00 0.00 0.00 176.54 177.24 2axl h ARG 100 N 0.04 1.10 -0.74 4.80 2.43 -0.30 0.95 114.38 122.67 2axl h ARG 100 Ca -0.11 -0.15 -0.04 0.00 -0.81 0.00 0.00 59.98 58.88 2axl h ARG 100 Cb 1.91 -0.21 -0.03 0.00 -0.42 0.00 0.00 29.97 31.22 2axl h ARG 100 CO 0.17 0.84 0.31 -0.91 -1.51 0.00 0.00 179.97 178.87 2axl h ASN 101 N 1.10 1.01 -1.01 -3.80 2.35 -1.52 0.05 115.58 113.76 2axl h ASN 101 Ca 0.27 -0.16 0.01 0.00 -0.55 0.00 0.00 56.30 55.87 2axl h ASN 101 Cb 0.09 -0.26 -0.05 0.00 0.05 0.00 0.00 38.32 38.15 2axl h ASN 101 CO -0.04 0.89 0.67 -0.25 -1.65 0.00 0.00 177.43 177.05 2axl h TRP 102 N 1.06 1.27 -0.77 1.19 7.01 -1.00 0.62 115.95 125.32 2axl h TRP 102 Ca 0.25 0.03 -0.03 0.00 2.11 0.00 0.00 58.89 61.25 2axl h TRP 102 Cb 0.19 -0.43 -0.04 0.00 -2.10 0.00 0.00 29.16 26.78 2axl h TRP 102 CO 0.02 0.79 0.37 1.25 -2.79 0.00 0.00 178.44 178.08 2axl h LEU 103 N 1.36 1.02 -2.94 0.65 5.85 0.93 -2.80 115.31 119.39 2axl h LEU 103 Ca 0.37 -0.14 0.00 0.00 0.84 0.00 0.00 57.88 58.95 2axl h LEU 103 Cb -0.15 -0.26 0.00 0.00 0.37 0.00 0.00 40.66 40.62 2axl h LEU 103 CO -0.08 0.87 0.00 1.41 -0.34 0.00 0.00 178.44 180.30 2axl n HIS 104 N -4.37 0.90 0.04 1.25 8.25 -0.36 -4.68 115.22 116.25 2axl n HIS 104 Ca 0.07 -0.56 0.00 0.00 -0.26 0.00 0.00 57.72 56.97 2axl n HIS 104 Cb 0.14 -0.10 0.00 0.00 1.12 0.00 0.00 29.99 31.15 2axl n HIS 104 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 2axl n LYS 105 N 0.89 0.00 -0.19 -0.41 5.02 0.17 -4.84 118.16 118.80 2axl n LYS 105 Ca 0.20 0.00 -0.03 0.00 -2.02 0.00 0.00 58.31 56.46 2axl n LYS 105 Cb 0.64 -0.11 0.04 0.00 -0.02 0.00 0.00 35.03 35.57 2axl n LYS 105 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2axl n ALA 106 N -2.90 2.94 0.24 7.82 0.00 -1.06 -4.29 120.51 123.26 2axl n ALA 106 Ca 0.00 -0.44 0.03 0.00 0.00 0.00 0.00 53.44 53.03 2axl n ALA 106 Cb 0.08 -1.06 0.15 0.00 0.00 0.00 0.00 19.45 18.61 2axl n ALA 106 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 2axl n ASN 107 N 0.19 0.00 0.00 0.00 0.23 -1.26 -3.84 115.26 110.58 2axl n ASN 107 Ca 0.09 0.48 0.00 0.00 -0.53 0.00 0.00 54.58 54.62 2axl n ASN 107 Cb 0.62 -0.49 0.00 0.00 -2.08 0.00 0.00 39.78 37.83 2axl n ASN 107 CO 0.00 0.00 0.00 0.35 -0.93 0.00 0.00 177.26 176.68 2axl n THR 108 N -1.49 0.00 -2.63 5.53 -2.24 -1.26 -4.57 114.28 107.61 2axl n THR 108 Ca 0.02 0.43 -0.42 0.00 -2.27 0.00 0.00 64.05 61.80 2axl n THR 108 Cb 0.08 -0.90 -0.03 0.00 -2.10 0.00 0.00 70.33 67.38 2axl n THR 108 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 2axl s GLU 109 N -0.61 3.53 -1.21 -0.78 2.02 -1.25 -4.93 118.70 115.46 2axl s GLU 109 Ca 0.00 0.23 -0.16 0.00 0.02 0.00 0.00 54.97 55.06 2axl s GLU 109 Cb 0.00 -4.00 0.13 0.00 0.10 0.00 0.00 34.13 30.36 2axl s GLU 109 CO 0.00 -1.57 1.52 -1.12 0.02 0.00 0.00 175.26 174.10 2axl s SER 110 N 2.81 6.94 -0.32 -0.19 0.01 -1.26 -4.68 113.70 117.02 2axl s SER 110 Ca 0.42 -2.69 -0.10 0.00 1.31 0.00 0.00 55.95 54.89 2axl s SER 110 Cb -0.08 -2.47 0.20 0.00 0.21 0.00 0.00 66.02 63.88 2axl s SER 110 CO 0.26 -0.94 1.10 0.00 0.41 0.00 0.00 173.24 174.07 2axl s GLN 111 N 2.66 0.12 -0.46 12.44 -2.07 -1.26 -4.53 119.66 126.56 2axl s GLN 111 Ca 0.46 -0.07 0.07 0.00 -1.82 0.00 0.00 55.36 54.00 2axl s GLN 111 Cb -0.01 0.01 0.18 0.00 -1.09 0.00 0.00 33.01 32.11 2axl s GLN 111 CO 0.02 -0.17 0.68 -1.12 -1.32 0.00 0.00 175.29 173.38 2axl s SER 112 N 1.62 -1.49 -0.30 12.60 0.01 -1.26 -5.00 113.70 119.87 2axl s SER 112 Ca 0.17 -1.24 -0.18 0.00 1.31 0.00 0.00 55.95 56.02 2axl s SER 112 Cb 0.07 1.93 0.17 0.00 0.21 0.00 0.00 66.02 68.41 2axl s SER 112 CO -0.14 -0.11 1.24 -0.22 0.41 0.00 0.00 173.24 174.42 2axl s LEU 113 N 1.38 -0.04 -0.04 2.44 2.96 -1.26 -4.93 118.68 119.18 2axl s LEU 113 Ca 0.23 0.02 -0.25 0.00 -0.22 0.00 0.00 54.13 53.91 2axl s LEU 113 Cb -0.02 1.04 -0.04 0.00 0.50 0.00 0.00 46.19 47.67 2axl s LEU 113 CO -0.06 -0.01 0.78 -0.63 -1.32 0.00 0.00 176.35 175.11 2axl s ILE 114 N 3.00 4.97 0.45 6.68 1.01 -1.26 -3.74 121.20 132.31 2axl s ILE 114 Ca -0.07 1.62 0.08 0.00 0.00 0.00 0.00 60.65 62.28 2axl s ILE 114 Cb -0.07 -4.12 0.02 0.00 0.01 0.00 0.00 42.46 38.30 2axl s ILE 114 CO -0.08 0.24 0.58 -0.76 0.00 0.00 0.00 174.94 174.93 2axl s LEU 115 N 0.76 3.49 0.09 2.97 1.43 0.12 -3.13 118.68 124.41 2axl s LEU 115 Ca 0.41 -0.57 -0.31 0.00 -1.03 0.00 0.00 54.13 52.63 2axl s LEU 115 Cb -0.19 -2.33 -0.08 0.00 0.03 0.00 0.00 46.19 43.62 2axl s LEU 115 CO 0.21 -0.87 1.47 -1.58 0.23 0.00 0.00 176.35 175.80 2axl s GLN 116 N -4.38 4.27 0.33 1.70 0.74 -1.25 0.85 119.66 121.92 2axl s GLN 116 Ca 0.55 2.14 -0.28 0.00 0.05 0.00 0.00 55.36 57.82 2axl s GLN 116 Cb -0.08 -3.36 -0.10 0.00 1.10 0.00 0.00 33.01 30.57 2axl s GLN 116 CO 0.33 -0.54 1.21 0.00 -0.55 0.00 0.00 175.29 175.74 2axl s ALA 117 N 1.65 3.39 0.03 1.58 0.00 1.08 -4.50 121.76 124.99 2axl s ALA 117 Ca 0.67 1.08 -0.30 0.00 0.00 0.00 0.00 51.96 53.41 2axl s ALA 117 Cb -0.37 -3.41 -0.07 0.00 0.00 0.00 0.00 23.12 19.27 2axl s ALA 117 CO 0.30 -0.47 1.46 0.54 0.00 0.00 0.00 175.76 177.59 2axl s ASN 118 N -0.76 6.79 0.14 0.00 2.20 -1.26 -4.85 114.94 117.20 2axl s ASN 118 Ca 0.49 2.23 -0.15 0.00 -0.94 0.00 0.00 52.86 54.49 2axl s ASN 118 Cb -0.35 -2.56 0.01 0.00 -2.00 0.00 0.00 41.25 36.34 2axl s ASN 118 CO 0.46 -0.75 1.69 1.05 -2.94 0.00 0.00 177.10 176.61 2axl h GLU 119 N 7.80 0.64 -6.02 3.55 4.11 -1.92 -3.34 114.58 119.40 2axl h GLU 119 Ca -0.40 -0.11 -0.62 0.00 0.07 0.00 0.00 59.36 58.30 2axl h GLU 119 Cb 1.19 -0.10 -0.09 0.00 0.50 0.00 0.00 28.75 30.24 2axl h GLU 119 CO 0.90 0.59 1.72 -1.21 0.07 0.00 0.00 179.01 181.08 2axl s GLU 120 N -5.56 3.70 0.03 1.06 2.02 -1.26 -4.72 118.70 113.97 2axl s GLU 120 Ca -0.13 -1.40 0.23 0.00 0.02 0.00 0.00 54.97 53.68 2axl s GLU 120 Cb 0.10 -5.41 -0.01 0.00 0.10 0.00 0.00 34.13 28.91 2axl s GLU 120 CO 0.76 -2.26 0.97 1.28 0.02 0.00 0.00 175.26 176.03 2axl n LEU 121 N 8.84 0.62 -2.84 1.80 4.77 -1.26 -4.64 117.00 124.30 2axl n LEU 121 Ca 0.39 -0.10 -0.11 0.00 -0.03 0.00 0.00 56.01 56.15 2axl n LEU 121 Cb 0.49 -0.08 0.05 0.00 -2.33 0.00 0.00 43.42 41.56 2axl n LEU 121 CO 0.70 0.08 0.17 0.00 -1.33 0.00 0.00 177.39 177.01 2axl h PRO 123 N 3.31 -0.05 -0.44 0.00 0.13 -1.96 -3.38 132.00 129.60 2axl h PRO 123 Ca -0.07 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.06 2axl h PRO 123 Cb 1.05 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.19 2axl h PRO 123 CO 0.26 -0.04 0.00 1.63 -0.23 0.00 0.00 178.00 179.62 2axl n LYS 124 N -2.33 2.30 0.00 0.86 5.02 -1.26 -4.19 118.16 118.56 2axl n LYS 124 Ca -0.01 -1.99 0.10 0.00 -2.02 0.00 0.00 58.31 54.39 2axl n LYS 124 Cb 0.02 -1.47 0.59 0.00 -0.02 0.00 0.00 35.03 34.16 2axl n LYS 124 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2axl n LYS 125 N 1.16 0.61 -2.03 1.97 5.02 -1.26 -4.73 118.16 118.90 2axl n LYS 125 Ca 0.19 0.01 -0.43 0.00 -2.02 0.00 0.00 58.31 56.06 2axl n LYS 125 Cb 0.51 -1.50 -0.03 0.00 -0.02 0.00 0.00 35.03 33.99 2axl n LYS 125 CO 0.00 0.00 0.00 -0.48 -0.52 0.00 0.00 177.40 176.40 2axl s LEU 126 N -2.03 3.93 0.32 -0.35 0.05 -1.26 -4.97 118.68 114.38 2axl s LEU 126 Ca 0.30 1.77 -0.28 0.00 0.05 0.00 0.00 54.13 55.97 2axl s LEU 126 Cb 0.14 -3.53 -0.09 0.00 -2.05 0.00 0.00 46.19 40.65 2axl s LEU 126 CO 0.24 -1.27 1.09 -0.76 -0.55 0.00 0.00 176.35 175.09 2axl s LEU 127 N 5.31 4.41 -0.32 1.48 2.01 -1.26 -5.01 118.68 125.30 2axl s LEU 127 Ca 0.75 2.21 -0.18 0.00 0.01 0.00 0.00 54.13 56.93 2axl s LEU 127 Cb -0.27 -3.81 -0.01 0.00 0.01 0.00 0.00 46.19 42.10 2axl s LEU 127 CO 0.31 -0.29 0.49 -0.76 1.01 0.00 0.00 176.35 177.11 2axl s LEU 128 N -1.87 4.24 0.06 1.79 1.43 -1.26 -5.05 118.68 118.03 2axl s LEU 128 Ca 0.49 0.13 -0.30 0.00 -1.03 0.00 0.00 54.13 53.42 2axl s LEU 128 Cb -0.29 -2.58 -0.05 0.00 0.03 0.00 0.00 46.19 43.30 2axl s LEU 128 CO 0.37 -0.40 1.04 -2.16 0.23 0.00 0.00 176.35 175.43 2axl s PRO 129 N 2.33 4.57 0.50 1.29 0.04 -1.26 -5.04 135.00 137.44 2axl s PRO 129 Ca 0.19 1.54 -0.18 0.00 0.04 0.00 0.00 61.00 62.58 2axl s PRO 129 Cb -0.16 -3.39 -0.08 0.00 0.04 0.00 0.00 34.50 30.91 2axl s PRO 129 CO 0.12 -0.02 1.01 -1.54 0.04 0.00 0.00 177.00 176.61 2axl s SER 130 N 0.64 6.44 -0.07 6.66 1.04 -1.26 -5.02 113.70 122.13 2axl s SER 130 Ca 0.52 1.75 -0.20 0.00 0.48 0.00 0.00 55.95 58.50 2axl s SER 130 Cb -0.24 -2.53 -0.04 0.00 0.10 0.00 0.00 66.02 63.30 2axl s SER 130 CO 0.30 -0.71 0.56 -0.55 0.98 0.00 0.00 173.24 173.81 2axl s SER 131 N -2.51 6.83 -0.02 7.02 0.15 -1.26 -5.06 113.70 118.85 2axl s SER 131 Ca 0.63 1.00 -0.03 0.00 0.70 0.00 0.00 55.95 58.24 2axl s SER 131 Cb -0.13 -2.34 -0.04 0.00 -1.71 0.00 0.00 66.02 61.81 2axl s SER 131 CO 0.25 0.00 0.19 -0.54 1.20 0.00 0.00 173.24 174.34 2axl s LYS 132 N 0.43 3.45 0.38 5.44 1.02 -1.26 -5.08 119.74 124.12 2axl s LYS 132 Ca 0.30 -0.28 -0.26 0.00 0.02 0.00 0.00 55.97 55.75 2axl s LYS 132 Cb -0.17 -3.10 -0.09 0.00 -0.52 0.00 0.00 37.83 33.95 2axl s LYS 132 CO 0.14 0.68 1.17 0.99 -0.92 0.00 0.00 175.35 177.41 2axl s THR 133 N -1.29 3.16 -0.19 2.17 2.01 -1.26 -5.02 115.64 115.22 2axl s THR 133 Ca 0.26 1.01 -0.09 0.00 0.31 0.00 0.00 61.69 63.19 2axl s THR 133 Cb -0.13 -3.58 -0.04 0.00 0.01 0.00 0.00 72.50 68.75 2axl s THR 133 CO 0.17 0.12 0.09 -0.69 -0.69 0.00 0.00 174.62 173.63 2axl s VAL 134 N -1.37 5.09 0.22 3.82 1.01 -1.26 -4.99 120.40 122.92 2axl s VAL 134 Ca 0.55 0.07 -0.08 0.00 0.00 0.00 0.00 61.98 62.52 2axl s VAL 134 Cb -0.31 -3.30 0.18 0.00 0.00 0.00 0.00 36.38 32.94 2axl s VAL 134 CO 0.40 0.46 1.82 0.28 0.00 0.00 0.00 175.10 178.06 2axl h SER 135 N 6.64 1.08 -4.18 3.32 0.02 -2.05 -3.43 113.55 114.94 2axl h SER 135 Ca -0.39 -0.12 -0.52 0.00 -0.84 0.00 0.00 61.79 59.91 2axl h SER 135 Cb 1.16 -0.28 0.12 0.00 0.14 0.00 0.00 62.40 63.55 2axl h SER 135 CO 0.73 0.90 0.38 -0.44 -1.14 0.00 0.00 176.83 177.26 2axl s SER 136 N -6.23 4.75 0.00 3.07 0.01 -1.26 -3.35 113.70 110.68 2axl s SER 136 Ca -0.13 2.16 0.00 0.00 1.31 0.00 0.00 55.95 59.29 2axl s SER 136 Cb 0.16 -2.57 0.00 0.00 0.21 0.00 0.00 66.02 63.82 2axl s SER 136 CO 0.83 -1.88 0.00 0.61 0.41 0.00 0.00 173.24 173.21 2axl n GLY 137 N -0.10 0.46 3.77 3.44 0.00 -1.26 -5.01 105.19 106.48 2axl n GLY 137 Ca 0.12 -0.93 -0.39 0.00 0.00 0.00 0.00 46.02 44.82 2axl n GLY 137 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2axl s THR 138 N -2.00 2.77 -0.28 2.61 2.01 -1.21 -5.01 115.64 114.53 2axl s THR 138 Ca 0.00 0.69 -0.00 0.00 0.31 0.00 0.00 61.69 62.68 2axl s THR 138 Cb 0.00 -3.40 0.17 0.00 0.01 0.00 0.00 72.50 69.28 2axl s THR 138 CO 0.00 0.10 0.51 -1.59 -0.69 0.00 0.00 174.62 172.95 2axl s LYS 139 N -2.22 0.48 0.00 4.92 -2.85 -1.26 -5.00 119.74 113.82 2axl s LYS 139 Ca 0.56 0.73 0.29 0.00 -1.00 0.00 0.00 55.97 56.55 2axl s LYS 139 Cb -0.36 0.12 1.24 0.00 -2.06 0.00 0.00 37.83 36.76 2axl s LYS 139 CO 0.46 -0.71 1.87 0.39 0.10 0.00 0.00 175.35 177.46 2axl n GLU 140 N 5.40 0.60 0.02 1.78 1.02 -1.26 -4.01 120.64 124.19 2axl n GLU 140 Ca -0.01 -0.19 -0.12 0.00 -0.02 0.00 0.00 57.16 56.83 2axl n GLU 140 Cb 0.51 -1.50 -0.07 0.00 -0.02 0.00 0.00 31.44 30.36 2axl n GLU 140 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 2axl h HIS 141 N 0.45 0.05 -0.64 -0.32 2.76 -1.94 -2.91 115.15 112.60 2axl h HIS 141 Ca 0.00 -0.00 -0.09 0.00 -2.20 0.00 0.00 60.37 58.08 2axl h HIS 141 Cb 0.36 -0.01 -0.02 0.00 1.55 0.00 0.00 27.41 29.28 2axl h HIS 141 CO 0.00 0.12 0.04 0.00 -1.30 0.00 0.00 177.93 176.79 2axl s TYR 143 N -5.09 3.12 0.00 0.00 5.04 -1.10 -5.23 117.35 114.09 2axl s TYR 143 Ca -0.12 1.60 0.00 0.00 -2.44 0.00 0.00 57.07 56.11 2axl s TYR 143 Cb 0.14 -3.23 0.00 0.00 0.35 0.00 0.00 41.96 39.21 2axl s TYR 143 CO 0.86 -0.98 0.00 0.09 -1.34 0.00 0.00 175.55 174.18