#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 0.01 0.03 3.17 8.00 -1.26 -3.38 116.55 123.11 2axl n ASP 2 Ca 0.00 -0.60 0.06 0.00 0.71 0.00 0.00 54.79 54.97 2axl n ASP 2 Cb 0.00 -0.13 0.28 0.00 -0.02 0.00 0.00 41.12 41.25 2axl n ASP 2 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 2axl n ASP 3 N -1.13 0.14 -4.64 -2.24 8.00 -1.26 -4.34 116.55 111.08 2axl n ASP 3 Ca 0.19 0.54 -0.46 0.00 0.71 0.00 0.00 54.79 55.78 2axl n ASP 3 Cb 0.17 -0.57 -0.04 0.00 -0.02 0.00 0.00 41.12 40.66 2axl n ASP 3 CO 0.00 0.00 0.00 -0.24 -0.39 0.00 0.00 177.20 176.57 2axl n SER 4 N -1.67 3.55 -4.75 -2.24 2.88 -1.22 -4.81 113.62 105.37 2axl n SER 4 Ca 0.02 0.77 -0.41 0.00 -1.33 0.00 0.00 58.87 57.91 2axl n SER 4 Cb 0.13 -1.45 -0.03 0.00 -0.75 0.00 0.00 64.21 62.11 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 4.80 4.35 0.33 -1.46 2.02 -1.26 -4.85 118.70 122.63 2axl s GLU 5 Ca 0.94 2.15 -0.04 0.00 0.02 0.00 0.00 54.97 58.05 2axl s GLU 5 Cb -0.56 -3.15 0.07 0.00 0.10 0.00 0.00 34.13 30.60 2axl s GLU 5 CO 0.45 -0.28 0.45 -0.25 0.02 0.00 0.00 175.26 175.66 2axl n ASP 6 N 2.18 0.24 -4.29 -0.19 8.00 -1.26 -4.92 116.55 116.31 2axl n ASP 6 Ca 0.05 -1.29 -0.25 0.00 0.71 0.00 0.00 54.79 54.01 2axl n ASP 6 Cb 0.42 -0.33 -0.13 0.00 -0.02 0.00 0.00 41.12 41.06 2axl n ASP 6 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 2axl s THR 7 N -1.65 1.75 -0.28 -3.53 -1.32 -1.26 -3.75 115.64 105.60 2axl s THR 7 Ca 0.27 -1.50 -0.23 0.00 -1.21 0.00 0.00 61.69 59.02 2axl s THR 7 Cb -0.01 -1.57 0.11 0.00 -1.51 0.00 0.00 72.50 69.51 2axl s THR 7 CO 0.19 0.00 0.92 -0.44 -2.21 0.00 0.00 174.62 173.08 2axl s SER 8 N -1.78 -0.57 -0.30 8.08 0.01 -1.24 -2.98 113.70 114.92 2axl s SER 8 Ca 0.07 1.05 -0.25 0.00 1.31 0.00 0.00 55.95 58.13 2axl s SER 8 Cb -0.10 1.10 0.19 0.00 0.21 0.00 0.00 66.02 67.42 2axl s SER 8 CO 0.04 -0.18 1.44 -1.66 0.41 0.00 0.00 173.24 173.29 2axl s TRP 9 N 0.50 -0.05 -0.51 2.43 1.48 -1.22 -4.69 118.94 116.87 2axl s TRP 9 Ca 0.00 0.13 -0.28 0.00 -1.06 0.00 0.00 56.10 54.89 2axl s TRP 9 Cb -0.05 0.49 0.01 0.00 -1.16 0.00 0.00 33.47 32.76 2axl s TRP 9 CO -0.06 -0.03 1.38 0.34 -4.06 0.00 0.00 176.95 174.52 2axl s ASP 10 N -0.06 6.24 -0.04 -2.66 -1.08 -1.26 -1.68 116.67 116.13 2axl s ASP 10 Ca 0.08 0.45 0.08 0.00 -0.52 0.00 0.00 52.55 52.64 2axl s ASP 10 Cb -0.05 -2.54 0.15 0.00 -1.46 0.00 0.00 42.92 39.02 2axl s ASP 10 CO -0.15 -1.59 1.07 0.33 0.52 0.00 0.00 175.17 175.35 2axl n PHE 11 N 9.18 0.00 0.46 -5.34 7.35 -1.25 -4.89 117.46 122.96 2axl n PHE 11 Ca 0.13 -0.37 -0.20 0.00 -0.76 0.00 0.00 57.45 56.25 2axl n PHE 11 Cb 0.49 -0.10 -0.10 0.00 0.35 0.00 0.00 39.48 40.12 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 0.19 -1.38 -0.94 7.13 0.00 -1.70 -1.27 103.07 105.10 2axl h GLY 12 Ca -0.03 0.55 0.09 0.00 0.00 0.00 0.00 47.33 47.94 2axl h GLY 12 CO 0.01 -0.47 -0.53 -1.05 0.00 0.00 0.00 176.54 174.50 2axl n PRO 13 N -5.64 -0.39 0.31 4.80 -0.02 -1.26 0.31 135.00 133.10 2axl n PRO 13 Ca -0.15 1.43 0.20 0.00 -2.02 0.00 0.00 63.50 62.96 2axl n PRO 13 Cb 0.52 -2.11 0.96 0.00 -0.02 0.00 0.00 33.50 32.85 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 0.00 0.13 -0.52 4.20 -1.91 0.18 115.11 117.19 2axl h GLN 14 Ca 0.17 0.00 -0.34 0.00 0.06 0.00 0.00 58.65 58.54 2axl h GLN 14 Cb 0.41 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.18 2axl h GLN 14 CO -0.89 0.00 -1.79 0.00 -0.67 0.00 0.00 178.83 175.47 2axl h ALA 15 N 2.00 0.31 -0.48 3.87 0.00 0.60 -2.90 119.26 122.67 2axl h ALA 15 Ca 0.00 -1.27 -0.06 0.00 0.00 0.00 0.00 54.91 53.59 2axl h ALA 15 Cb 0.25 0.61 -0.02 0.00 0.00 0.00 0.00 17.79 18.62 2axl h ALA 15 CO 0.00 1.12 0.06 0.74 0.00 0.00 0.00 179.25 181.17 2axl h PHE 16 N -0.05 0.78 -0.63 0.00 0.04 0.18 0.10 116.94 117.37 2axl h PHE 16 Ca -0.38 -0.08 0.00 0.00 2.80 0.00 0.00 57.97 60.31 2axl h PHE 16 Cb 1.96 -0.22 -0.03 0.00 2.20 0.00 0.00 35.95 39.86 2axl h PHE 16 CO 0.09 0.69 0.40 0.87 -0.60 0.00 0.00 178.31 179.77 2axl h LYS 17 N 0.71 0.83 -0.74 1.51 1.57 -0.71 -0.40 116.57 119.34 2axl h LYS 17 Ca 0.15 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.88 2axl h LYS 17 Cb 0.35 -0.18 -0.04 0.00 0.08 0.00 0.00 32.23 32.44 2axl h LYS 17 CO 0.01 0.56 0.48 1.25 -0.57 0.00 0.00 179.45 181.18 2axl h LEU 18 N 0.85 0.86 -0.44 2.94 5.85 -0.76 -2.56 115.31 122.05 2axl h LEU 18 Ca 0.23 -0.03 0.08 0.00 0.84 0.00 0.00 57.88 59.00 2axl h LEU 18 Cb -0.08 -0.22 -0.10 0.00 0.37 0.00 0.00 40.66 40.64 2axl h LEU 18 CO -0.05 0.64 -0.35 -0.07 -0.34 0.00 0.00 178.44 178.27 2axl h LEU 19 N 1.01 -1.18 -1.08 2.25 3.38 -0.78 0.20 115.31 119.12 2axl h LEU 19 Ca 0.27 0.20 0.00 0.00 0.09 0.00 0.00 57.88 58.44 2axl h LEU 19 Cb -0.10 0.55 0.00 0.00 0.09 0.00 0.00 40.66 41.20 2axl h LEU 19 CO -0.06 -0.33 0.00 -1.28 0.09 0.00 0.00 178.44 176.87 2axl h SER 20 N -0.25 0.00 0.04 -0.43 0.87 -1.41 -3.13 113.55 109.24 2axl h SER 20 Ca 0.18 0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 60.74 2axl h SER 20 Cb 0.55 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.51 2axl h SER 20 CO -0.58 0.00 -0.02 0.00 -0.53 0.00 0.00 176.83 175.71 2axl h ALA 21 N 2.14 -0.05 -0.66 6.23 0.00 -0.33 0.70 119.26 127.28 2axl h ALA 21 Ca 0.00 -0.22 -0.00 0.00 0.00 0.00 0.00 54.91 54.68 2axl h ALA 21 Cb 0.43 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.21 2axl h ALA 21 CO 0.00 -0.30 0.39 -0.39 0.00 0.00 0.00 179.25 178.95 2axl h VAL 22 N -0.51 1.19 -0.59 0.00 -1.51 -1.51 -1.63 116.25 111.70 2axl h VAL 22 Ca -0.01 -0.44 -0.03 0.00 -1.23 0.00 0.00 66.70 65.00 2axl h VAL 22 Cb 0.47 0.29 -0.03 0.00 -2.13 0.00 0.00 31.29 29.89 2axl h VAL 22 CO 0.01 0.20 0.26 -0.78 -1.23 0.00 0.00 177.57 176.03 2axl h ASP 23 N 0.90 0.79 -0.66 4.19 3.58 -1.50 0.87 116.42 124.58 2axl h ASP 23 Ca 0.24 -0.15 0.10 0.00 0.42 0.00 0.00 57.03 57.64 2axl h ASP 23 Cb -0.02 -0.20 -0.04 0.00 1.72 0.00 0.00 39.33 40.79 2axl h ASP 23 CO -0.04 0.72 0.44 0.40 -2.88 0.00 0.00 179.24 177.88 2axl h ILE 24 N 0.80 0.90 -0.00 2.25 1.08 0.13 2.25 117.51 124.92 2axl h ILE 24 Ca 0.20 -0.17 0.00 0.00 -0.39 0.00 0.00 64.86 64.50 2axl h ILE 24 Cb 0.16 0.36 0.00 0.00 -3.07 0.00 0.00 36.82 34.28 2axl h ILE 24 CO -0.02 0.09 -0.02 0.18 -0.69 0.00 0.00 178.15 177.69 2axl n LEU 25 N -4.48 0.26 -0.48 1.44 4.77 -0.39 -4.86 117.00 113.26 2axl n LEU 25 Ca 0.11 -0.01 -0.06 0.00 -0.03 0.00 0.00 56.01 56.02 2axl n LEU 25 Cb 0.37 -0.08 -0.03 0.00 -2.33 0.00 0.00 43.42 41.35 2axl n LEU 25 CO 0.33 0.05 -0.06 0.61 -1.33 0.00 0.00 177.39 176.99 2axl n GLY 26 N 1.12 0.86 2.49 -0.72 0.00 0.76 -3.35 105.19 106.35 2axl n GLY 26 Ca 0.20 -0.57 -0.20 0.00 0.00 0.00 0.00 46.02 45.44 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 -2.56 -1.51 -1.47 1.61 1.02 0.28 -4.89 120.64 113.13 2axl n GLU 27 Ca -0.06 1.10 -0.29 0.00 -0.02 0.00 0.00 57.16 57.89 2axl n GLU 27 Cb 0.24 -5.59 0.08 0.00 -0.02 0.00 0.00 31.44 26.15 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 -2.67 2.84 -3.83 3.49 4.76 -1.21 -4.92 118.16 116.62 2axl n LYS 28 Ca -0.22 -3.49 -0.09 0.00 -2.87 0.00 0.00 58.31 51.63 2axl n LYS 28 Cb 0.67 -2.25 -0.07 0.00 -1.84 0.00 0.00 35.03 31.55 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 -3.69 0.10 0.50 2.13 0.40 -1.26 -5.06 117.98 111.09 2axl s PHE 29 Ca 0.59 -0.49 -0.04 0.00 -0.60 0.00 0.00 56.93 56.39 2axl s PHE 29 Cb 0.48 -0.02 0.11 0.00 0.51 0.00 0.00 43.02 44.10 2axl s PHE 29 CO 0.01 -0.55 0.68 0.41 0.70 0.00 0.00 175.22 176.47 2axl n GLY 30 N -0.01 -0.17 0.23 4.36 0.00 -1.26 -3.87 105.19 104.47 2axl n GLY 30 Ca -0.16 -1.87 0.09 0.00 0.00 0.00 0.00 46.02 44.08 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 -0.92 0.83 -0.36 -0.61 2.10 -1.80 -3.29 117.51 113.46 2axl h ILE 31 Ca -0.22 -0.83 0.04 0.00 1.08 0.00 0.00 64.86 64.92 2axl h ILE 31 Cb 0.73 1.49 -0.04 0.00 -1.09 0.00 0.00 36.82 37.91 2axl h ILE 31 CO 0.20 0.21 0.15 1.23 -1.08 0.00 0.00 178.15 178.85 2axl h GLY 32 N 1.04 0.47 0.62 8.18 0.00 -1.94 -1.12 103.07 110.34 2axl h GLY 32 Ca -0.00 -0.09 -0.03 0.00 0.00 0.00 0.00 47.33 47.20 2axl h GLY 32 CO 0.03 0.05 -0.09 -2.00 0.00 0.00 0.00 176.54 174.53 2axl h LEU 33 N 0.31 0.21 -0.85 3.11 5.85 -1.96 -3.18 115.31 118.80 2axl h LEU 33 Ca 0.16 -0.50 -0.12 0.00 0.84 0.00 0.00 57.88 58.26 2axl h LEU 33 Cb 0.11 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.07 2axl h LEU 33 CO -0.14 0.67 -0.47 1.55 -0.34 0.00 0.00 178.44 179.71 2axl h PRO 34 N -0.25 0.25 -0.39 5.25 0.13 -1.70 -2.82 132.00 132.47 2axl h PRO 34 Ca 0.01 -0.13 -0.04 0.00 -0.87 0.00 0.00 66.00 64.96 2axl h PRO 34 Cb 0.62 0.01 -0.02 0.00 0.13 0.00 0.00 31.00 31.74 2axl h PRO 34 CO 0.02 0.67 0.07 0.97 -0.23 0.00 0.00 178.00 179.50 2axl h ILE 35 N 0.20 1.24 -0.39 -3.56 2.10 -1.29 -0.84 117.51 114.98 2axl h ILE 35 Ca 0.01 -0.84 0.03 0.00 1.08 0.00 0.00 64.86 65.14 2axl h ILE 35 Cb 0.90 1.04 -0.03 0.00 -1.09 0.00 0.00 36.82 37.64 2axl h ILE 35 CO 0.07 0.29 0.19 -0.07 -1.08 0.00 0.00 178.15 177.54 2axl h LEU 36 N 0.48 0.26 -0.48 2.19 3.38 -1.53 -3.02 115.31 116.60 2axl h LEU 36 Ca 0.12 0.02 -0.17 0.00 0.09 0.00 0.00 57.88 57.94 2axl h LEU 36 Cb 0.35 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.06 2axl h LEU 36 CO 0.01 0.19 -0.75 0.15 0.09 0.00 0.00 178.44 178.13 2axl h PHE 37 N 0.38 0.20 -0.99 1.13 3.57 -1.25 -3.19 116.94 116.79 2axl h PHE 37 Ca 0.17 -0.09 0.01 0.00 3.53 0.00 0.00 57.97 61.58 2axl h PHE 37 Cb 0.08 -0.03 -0.05 0.00 2.79 0.00 0.00 35.95 38.75 2axl h PHE 37 CO -0.11 0.84 0.65 -0.07 -2.23 0.00 0.00 178.31 177.39 2axl h LEU 38 N 0.09 1.13 0.00 0.59 3.38 -1.02 -2.19 115.31 117.29 2axl h LEU 38 Ca -0.02 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.92 2axl h LEU 38 Cb 1.32 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 41.79 2axl h LEU 38 CO 0.11 0.82 0.00 0.54 0.09 0.00 0.00 178.44 180.00 2axl n ARG 39 N -4.39 0.08 -2.92 1.13 1.74 -1.21 -0.99 116.66 110.12 2axl n ARG 39 Ca 0.12 0.20 -0.10 0.00 -0.77 0.00 0.00 57.85 57.30 2axl n ARG 39 Cb 0.01 -1.50 0.03 0.00 -1.02 0.00 0.00 32.46 29.99 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 -0.85 0.29 3.69 -0.13 0.00 -0.82 -4.12 105.19 103.25 2axl n GLY 40 Ca 0.03 -0.29 -0.31 0.00 0.00 0.00 0.00 46.02 45.45 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 -3.10 3.29 -0.29 1.61 1.04 -1.23 -4.86 113.70 110.17 2axl s SER 41 Ca 0.24 2.00 -0.28 0.00 0.48 0.00 0.00 55.95 58.39 2axl s SER 41 Cb -0.10 -2.52 -0.03 0.00 0.10 0.00 0.00 66.02 63.47 2axl s SER 41 CO 0.29 -2.83 1.97 0.21 0.98 0.00 0.00 173.24 173.86 2axl s ASN 42 N -2.92 5.71 -0.31 7.02 3.84 -1.26 -4.86 114.94 122.15 2axl s ASN 42 Ca 0.65 1.53 0.04 0.00 0.21 0.00 0.00 52.86 55.29 2axl s ASN 42 Cb -0.21 -2.52 0.19 0.00 -0.55 0.00 0.00 41.25 38.17 2axl s ASN 42 CO 0.58 -1.82 0.67 -0.55 -2.79 0.00 0.00 177.10 173.19 2axl s SER 43 N 7.00 -1.42 0.18 -4.21 0.15 -1.26 -5.03 113.70 109.11 2axl s SER 43 Ca 0.88 -0.01 0.10 0.00 0.70 0.00 0.00 55.95 57.61 2axl s SER 43 Cb -0.27 1.87 -0.06 0.00 -1.71 0.00 0.00 66.02 65.85 2axl s SER 43 CO 0.34 -0.24 1.36 -0.61 1.20 0.00 0.00 173.24 175.30 2axl h GLN 44 N 7.64 0.00 -0.80 5.44 5.75 -1.98 -3.11 115.11 128.05 2axl h GLN 44 Ca -0.01 0.00 -0.01 0.00 -0.15 0.00 0.00 58.65 58.48 2axl h GLN 44 Cb 1.19 0.00 -0.04 0.00 1.07 0.00 0.00 27.48 29.70 2axl h GLN 44 CO 0.10 0.83 0.46 -0.09 -2.65 0.00 0.00 178.83 177.48 2axl h ARG 45 N 0.00 1.10 -0.00 1.69 2.43 -2.01 -1.93 114.38 115.66 2axl h ARG 45 Ca -0.01 -0.11 0.00 0.00 -0.81 0.00 0.00 59.98 59.05 2axl h ARG 45 Cb 1.59 -0.22 0.00 0.00 -0.42 0.00 0.00 29.97 30.92 2axl h ARG 45 CO 0.11 0.79 -0.34 1.28 -1.51 0.00 0.00 179.97 180.30 2axl n LEU 46 N -4.45 0.77 0.11 3.80 4.77 -1.25 -3.16 117.00 117.59 2axl n LEU 46 Ca 0.08 -0.13 0.09 0.00 -0.03 0.00 0.00 56.01 56.02 2axl n LEU 46 Cb 0.07 -0.18 0.01 0.00 -2.33 0.00 0.00 43.42 40.99 2axl n LEU 46 CO 0.38 0.16 0.09 0.00 -1.33 0.00 0.00 177.39 176.68 2axl h ALA 47 N 3.40 0.60 0.08 -1.18 0.00 -1.32 -2.65 119.26 118.19 2axl h ALA 47 Ca 0.00 -0.17 -0.37 0.00 0.00 0.00 0.00 54.91 54.38 2axl h ALA 47 Cb 0.49 0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.30 2axl h ALA 47 CO 0.00 0.18 -2.10 -0.25 0.00 0.00 0.00 179.25 177.08 2axl n ASP 48 N -2.79 2.06 0.02 0.00 8.00 -0.79 -3.54 116.55 119.51 2axl n ASP 48 Ca -0.01 0.13 -0.02 0.00 0.71 0.00 0.00 54.79 55.60 2axl n ASP 48 Cb 0.61 -0.75 -0.01 0.00 -0.02 0.00 0.00 41.12 40.95 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 -0.06 -0.12 -1.53 -1.24 4.20 -1.70 -3.31 115.11 111.34 2axl h GLN 49 Ca -0.47 0.01 -0.12 0.00 0.06 0.00 0.00 58.65 58.13 2axl h GLN 49 Cb 1.93 0.03 -0.05 0.00 0.30 0.00 0.00 27.48 29.69 2axl h GLN 49 CO 0.00 -0.08 0.15 0.66 -0.67 0.00 0.00 178.83 178.89 2axl n TYR 50 N -3.96 0.59 -0.23 2.96 4.01 -1.00 -4.50 117.16 115.03 2axl n TYR 50 Ca -0.02 -1.16 0.03 0.00 -0.16 0.00 0.00 57.90 56.60 2axl n TYR 50 Cb 0.05 -0.57 0.28 0.00 -0.31 0.00 0.00 39.34 38.78 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 0.84 0.91 -0.12 -0.72 0.11 -1.65 -1.99 114.38 111.76 2axl h ARG 51 Ca 0.11 -0.05 -0.02 0.00 0.10 0.00 0.00 59.98 60.12 2axl h ARG 51 Cb 1.10 -0.21 -0.01 0.00 1.11 0.00 0.00 29.97 31.96 2axl h ARG 51 CO 0.26 0.60 -0.00 0.00 0.10 0.00 0.00 179.97 180.93 2axl h ARG 52 N 0.94 0.17 -5.04 0.08 2.47 -1.89 -3.41 114.38 107.70 2axl h ARG 52 Ca 0.31 -0.02 -0.31 0.00 -1.26 0.00 0.00 59.98 58.71 2axl h ARG 52 Cb 0.07 -0.03 -0.10 0.00 -1.65 0.00 0.00 29.97 28.26 2axl h ARG 52 CO -0.09 0.19 1.77 1.58 0.56 0.00 0.00 179.97 183.98 2axl n HIS 53 N -4.43 0.13 -0.23 3.04 -0.00 -0.75 -4.74 115.22 108.24 2axl n HIS 53 Ca -0.01 -0.00 -0.08 0.00 0.46 0.00 0.00 57.72 58.09 2axl n HIS 53 Cb 0.15 -0.75 0.04 0.00 -0.12 0.00 0.00 29.99 29.31 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 11.12 1.03 0.00 0.26 0.87 -1.88 -2.89 113.55 122.06 2axl h SER 54 Ca 0.03 -0.25 0.00 0.00 -1.23 0.00 0.00 61.79 60.34 2axl h SER 54 Cb 1.11 -0.27 0.00 0.00 -0.44 0.00 0.00 62.40 62.80 2axl h SER 54 CO 1.54 1.02 0.06 0.18 -0.53 0.00 0.00 176.83 179.10 2axl n LEU 55 N -4.25 0.00 -4.68 2.23 4.77 -1.26 -4.66 117.00 109.15 2axl n LEU 55 Ca 0.04 0.06 -0.45 0.00 -0.03 0.00 0.00 56.01 55.63 2axl n LEU 55 Cb 0.28 -0.06 -0.04 0.00 -2.33 0.00 0.00 43.42 41.27 2axl n LEU 55 CO 0.43 -0.06 1.25 0.33 -1.33 0.00 0.00 177.39 178.01 2axl n PHE 56 N -0.87 2.40 -1.76 -1.77 -0.00 -1.10 -2.78 117.46 111.58 2axl n PHE 56 Ca 0.00 0.20 -0.10 0.00 -0.00 0.00 0.00 57.45 57.54 2axl n PHE 56 Cb 0.06 -2.58 -0.02 0.00 -0.00 0.00 0.00 39.48 36.93 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 3.59 0.54 0.03 7.13 0.00 -0.16 -4.82 105.19 111.50 2axl n GLY 57 Ca 0.17 -0.50 0.11 0.00 0.00 0.00 0.00 46.02 45.80 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 -3.37 0.15 0.72 2.61 -1.04 -0.95 -3.38 114.28 109.02 2axl n THR 58 Ca -0.11 -0.20 0.07 0.00 -2.04 0.00 0.00 64.05 61.77 2axl n THR 58 Cb 0.47 0.25 0.21 0.00 -1.82 0.00 0.00 70.33 69.44 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 1.39 0.90 0.26 3.41 0.00 -1.11 -4.20 105.19 105.84 2axl n GLY 59 Ca 0.03 -0.46 -0.07 0.00 0.00 0.00 0.00 46.02 45.52 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 2.48 0.85 0.00 1.61 3.64 -1.67 -2.29 116.57 121.18 2axl h LYS 60 Ca 0.00 -0.11 0.00 0.00 -1.27 0.00 0.00 60.65 59.27 2axl h LYS 60 Cb 0.56 -0.16 0.00 0.00 -0.41 0.00 0.00 32.23 32.22 2axl h LYS 60 CO 0.00 0.66 0.00 -0.40 -2.27 0.00 0.00 179.45 177.44 2axl n ASP 61 N -4.56 0.00 -4.72 4.20 5.75 -1.26 -4.77 116.55 111.19 2axl n ASP 61 Ca 0.04 0.00 -0.35 0.00 -0.01 0.00 0.00 54.79 54.47 2axl n ASP 61 Cb 0.10 -0.31 -0.09 0.00 -1.03 0.00 0.00 41.12 39.80 2axl n ASP 61 CO 0.00 0.00 0.00 -1.10 -0.11 0.00 0.00 177.20 175.99 2axl s GLN 62 N -2.61 3.27 0.94 0.11 -0.21 -0.86 -5.10 119.66 115.20 2axl s GLN 62 Ca 0.21 -0.33 -0.12 0.00 0.02 0.00 0.00 55.36 55.14 2axl s GLN 62 Cb 0.16 -2.97 0.15 0.00 1.00 0.00 0.00 33.01 31.35 2axl s GLN 62 CO 0.36 0.65 1.12 0.95 -2.12 0.00 0.00 175.29 176.26 2axl s THR 63 N -0.70 2.03 0.16 -0.19 -4.23 -1.26 -4.94 115.64 106.51 2axl s THR 63 Ca 0.12 0.01 -0.14 0.00 -1.18 0.00 0.00 61.69 60.50 2axl s THR 63 Cb -0.12 -2.69 0.05 0.00 1.34 0.00 0.00 72.50 71.08 2axl s THR 63 CO 0.02 -0.01 1.75 -0.08 -0.54 0.00 0.00 174.62 175.76 2axl h GLU 64 N -1.61 0.74 -0.09 3.99 4.57 -1.99 -3.11 114.58 117.08 2axl h GLU 64 Ca -0.52 -0.10 -0.10 0.00 -1.18 0.00 0.00 59.36 57.46 2axl h GLU 64 Cb 1.33 -0.14 -0.01 0.00 -0.16 0.00 0.00 28.75 29.77 2axl h GLU 64 CO 0.61 0.60 -0.39 0.66 -1.18 0.00 0.00 179.01 179.31 2axl h SER 65 N 0.69 0.20 -0.26 1.04 4.64 -1.97 0.12 113.55 118.00 2axl h SER 65 Ca 0.18 -0.08 -0.01 0.00 -0.47 0.00 0.00 61.79 61.41 2axl h SER 65 Cb 0.10 -0.05 -0.01 0.00 -0.31 0.00 0.00 62.40 62.12 2axl h SER 65 CO -0.02 0.57 0.11 -0.25 -0.87 0.00 0.00 176.83 176.37 2axl h TRP 66 N 0.16 0.39 -0.70 4.77 2.91 -1.92 2.52 115.95 124.08 2axl h TRP 66 Ca 0.02 -0.02 -0.03 0.00 1.13 0.00 0.00 58.89 59.98 2axl h TRP 66 Cb 0.76 -0.12 -0.03 0.00 -0.51 0.00 0.00 29.16 29.26 2axl h TRP 66 CO 0.01 0.38 0.30 -1.49 -1.03 0.00 0.00 178.44 176.62 2axl h TRP 67 N 0.28 1.03 -0.14 2.65 4.06 -1.44 0.94 115.95 123.34 2axl h TRP 67 Ca 0.09 -0.07 0.01 0.00 2.06 0.00 0.00 58.89 60.98 2axl h TRP 67 Cb 0.15 -0.31 -0.01 0.00 -1.00 0.00 0.00 29.16 27.98 2axl h TRP 67 CO -0.01 0.79 0.05 -0.22 -3.56 0.00 0.00 178.44 175.48 2axl h LYS 68 N 0.98 0.12 -0.82 0.49 1.63 0.10 -1.11 116.57 117.96 2axl h LYS 68 Ca 0.24 -0.01 -0.00 0.00 -0.85 0.00 0.00 60.65 60.03 2axl h LYS 68 Cb 0.17 -0.03 -0.04 0.00 -0.60 0.00 0.00 32.23 31.73 2axl h LYS 68 CO -0.02 0.08 0.51 0.00 -3.45 0.00 0.00 179.45 176.57 2axl h ALA 69 N 1.08 1.05 -0.73 5.00 0.00 0.53 -2.50 119.26 123.68 2axl h ALA 69 Ca 0.06 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 2axl h ALA 69 Cb 0.03 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 17.45 2axl h ALA 69 CO -0.06 0.49 0.41 0.35 0.00 0.00 0.00 179.25 180.44 2axl h PHE 70 N 1.12 1.00 -0.91 0.00 3.57 0.17 -2.20 116.94 119.70 2axl h PHE 70 Ca 0.30 -0.02 0.20 0.00 3.53 0.00 0.00 57.97 61.98 2axl h PHE 70 Cb -0.07 -0.32 -0.12 0.00 2.79 0.00 0.00 35.95 38.23 2axl h PHE 70 CO -0.01 0.70 0.45 0.77 -2.23 0.00 0.00 178.31 177.99 2axl h SER 71 N 1.01 0.45 -0.56 0.41 0.02 -0.77 0.97 113.55 115.08 2axl h SER 71 Ca 0.26 0.13 -0.00 0.00 -0.84 0.00 0.00 61.79 61.34 2axl h SER 71 Cb 0.03 0.08 -0.03 0.00 0.14 0.00 0.00 62.40 62.62 2axl h SER 71 CO -0.04 0.08 0.33 -0.09 -1.14 0.00 0.00 176.83 175.97 2axl h ARG 72 N 0.50 0.76 -0.90 3.45 2.43 -1.33 -2.69 114.38 116.60 2axl h ARG 72 Ca 0.55 -0.07 0.11 0.00 -0.81 0.00 0.00 59.98 59.76 2axl h ARG 72 Cb 0.98 -0.16 -0.08 0.00 -0.42 0.00 0.00 29.97 30.29 2axl h ARG 72 CO -0.47 0.55 0.53 1.96 -1.51 0.00 0.00 179.97 181.03 2axl h GLN 73 N 0.75 0.83 -0.67 0.20 4.20 -0.71 -2.70 115.11 117.01 2axl h GLN 73 Ca 0.20 -0.05 -0.03 0.00 0.06 0.00 0.00 58.65 58.83 2axl h GLN 73 Cb -0.01 -0.19 -0.03 0.00 0.30 0.00 0.00 27.48 27.56 2axl h GLN 73 CO -0.04 0.55 0.31 -0.07 -0.67 0.00 0.00 178.83 178.91 2axl h LEU 74 N 0.85 0.89 -0.45 1.46 3.38 -1.14 -2.99 115.31 117.31 2axl h LEU 74 Ca 0.44 -0.14 -0.02 0.00 0.09 0.00 0.00 57.88 58.25 2axl h LEU 74 Cb 0.44 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.94 2axl h LEU 74 CO -0.27 0.78 0.21 0.40 0.09 0.00 0.00 178.44 179.66 2axl h ILE 75 N 0.93 1.18 -0.41 1.22 2.04 -1.43 -2.89 117.51 118.16 2axl h ILE 75 Ca 0.23 -0.53 -0.05 0.00 1.00 0.00 0.00 64.86 65.51 2axl h ILE 75 Cb 0.14 0.70 -0.02 0.00 -0.74 0.00 0.00 36.82 36.90 2axl h ILE 75 CO -0.03 0.20 0.05 0.74 0.00 0.00 0.00 178.15 179.11 2axl h THR 76 N 0.58 1.25 0.00 -0.27 2.02 -1.52 -2.94 112.91 112.03 2axl h THR 76 Ca 0.15 -0.92 -0.02 0.00 0.77 0.00 0.00 66.41 66.40 2axl h THR 76 Cb 0.12 1.05 -0.00 0.00 -1.74 0.00 0.00 68.15 67.58 2axl h THR 76 CO -0.02 0.31 -0.09 -0.33 0.37 0.00 0.00 175.52 175.76 2axl h GLU 77 N 0.54 0.00 0.00 6.66 5.08 -1.50 -3.37 114.58 121.98 2axl h GLU 77 Ca 0.12 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.48 2axl h GLU 77 Cb 0.41 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.66 2axl h GLU 77 CO 0.01 0.09 0.00 0.41 -1.00 0.00 0.00 179.01 178.52 2axl n GLY 78 N -0.90 0.31 0.29 -3.84 0.00 -1.11 -4.34 105.19 95.61 2axl n GLY 78 Ca -0.02 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.12 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 -3.97 1.61 -1.00 -1.82 -3.43 116.94 108.33 2axl h PHE 79 Ca 0.00 0.00 -0.24 0.00 2.81 0.00 0.00 57.97 60.54 2axl h PHE 79 Cb 0.00 0.00 -0.21 0.00 3.61 0.00 0.00 35.95 39.35 2axl h PHE 79 CO 0.00 0.00 -0.72 -1.17 -1.61 0.00 0.00 178.31 174.81 2axl s LEU 80 N -8.37 2.26 -0.01 1.54 2.96 -1.10 -4.33 118.68 111.63 2axl s LEU 80 Ca -0.05 -0.54 0.04 0.00 -0.22 0.00 0.00 54.13 53.35 2axl s LEU 80 Cb 0.16 -0.07 -0.01 0.00 0.50 0.00 0.00 46.19 46.78 2axl s LEU 80 CO 0.61 -0.25 -0.12 0.54 -1.32 0.00 0.00 176.35 175.81 2axl s VAL 81 N -1.47 0.96 -0.10 1.68 0.11 -1.15 -4.32 120.40 116.11 2axl s VAL 81 Ca -0.12 -0.52 -0.01 0.00 -2.93 0.00 0.00 61.98 58.41 2axl s VAL 81 Cb -0.10 -0.81 -0.03 0.00 -1.53 0.00 0.00 36.38 33.92 2axl s VAL 81 CO -0.00 0.27 -0.05 -1.61 -3.33 0.00 0.00 175.10 170.38 2axl s GLU 82 N -0.24 3.14 -0.17 1.54 2.02 -1.26 -1.71 118.70 122.01 2axl s GLU 82 Ca 0.04 -0.52 -0.02 0.00 0.02 0.00 0.00 54.97 54.49 2axl s GLU 82 Cb -0.05 -2.73 -0.01 0.00 0.10 0.00 0.00 34.13 31.43 2axl s GLU 82 CO -0.00 0.50 -0.09 0.08 0.02 0.00 0.00 175.26 175.77 2axl s VAL 83 N -0.36 3.17 -0.81 2.63 1.01 -1.07 -4.95 120.40 120.01 2axl s VAL 83 Ca 0.06 -0.59 0.26 0.00 0.00 0.00 0.00 61.98 61.70 2axl s VAL 83 Cb -0.12 -2.38 0.11 0.00 0.00 0.00 0.00 36.38 33.98 2axl s VAL 83 CO 0.02 0.48 1.53 -0.24 0.00 0.00 0.00 175.10 176.89 2axl n SER 84 N 4.10 0.54 -0.34 3.32 2.88 -1.26 -2.16 113.62 120.70 2axl n SER 84 Ca -0.18 0.16 0.05 0.00 -1.33 0.00 0.00 58.87 57.56 2axl n SER 84 Cb 0.52 -0.08 0.16 0.00 -0.75 0.00 0.00 64.21 64.06 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 -1.86 1.44 -3.62 -1.46 1.74 -1.26 -4.62 116.66 107.00 2axl n ARG 85 Ca 0.05 -0.67 -0.24 0.00 -0.77 0.00 0.00 57.85 56.21 2axl n ARG 85 Cb 0.39 -1.19 -0.17 0.00 -1.02 0.00 0.00 32.46 30.47 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 -1.77 0.15 0.00 -1.55 1.51 -1.22 -4.98 117.35 109.48 2axl s TYR 86 Ca 0.17 -0.16 0.00 0.00 -1.01 0.00 0.00 57.07 56.06 2axl s TYR 86 Cb 0.08 -0.63 0.00 0.00 -0.11 0.00 0.00 41.96 41.30 2axl s TYR 86 CO 0.12 -0.43 0.00 0.09 -1.11 0.00 0.00 175.55 174.22 2axl n ASN 87 N 5.29 -1.24 0.00 2.29 5.03 -1.26 0.12 115.26 125.48 2axl n ASN 87 Ca -0.06 0.00 0.04 0.00 0.87 0.00 0.00 54.58 55.43 2axl n ASN 87 Cb 0.49 -0.62 0.22 0.00 -1.02 0.00 0.00 39.78 38.86 2axl n ASN 87 CO 0.00 0.00 0.00 0.29 -1.83 0.00 0.00 177.26 175.72 2axl n LYS 88 N 0.06 0.15 0.00 3.52 4.01 -1.26 -2.79 118.16 121.85 2axl n LYS 88 Ca 0.00 0.16 0.00 0.00 -0.51 0.00 0.00 58.31 57.96 2axl n LYS 88 Cb 0.00 -1.50 0.00 0.00 -0.51 0.00 0.00 35.03 33.02 2axl n LYS 88 CO 0.00 0.00 0.00 1.19 -1.11 0.00 0.00 177.40 177.48 2axl n PHE 89 N -1.23 0.00 -3.12 2.13 3.72 -1.26 -4.89 117.46 112.82 2axl n PHE 89 Ca 0.05 0.00 -0.17 0.00 -0.05 0.00 0.00 57.45 57.28 2axl n PHE 89 Cb 0.06 0.00 -0.05 0.00 -0.94 0.00 0.00 39.48 38.55 2axl n PHE 89 CO 0.00 0.00 0.00 -1.64 -0.05 0.00 0.00 176.76 175.07 2axl s MET 90 N -0.19 0.97 0.00 -1.08 -1.94 -1.12 -5.08 119.30 110.86 2axl s MET 90 Ca 0.00 -1.60 0.00 0.00 -1.71 0.00 0.00 55.69 52.38 2axl s MET 90 Cb 0.00 -0.79 0.00 0.00 2.01 0.00 0.00 34.83 36.05 2axl s MET 90 CO 0.00 -1.35 0.00 1.63 -0.01 0.00 0.00 175.02 175.29 2axl n LYS 91 N 2.95 -0.15 -1.68 2.03 4.01 -1.19 -3.37 118.16 120.76 2axl n LYS 91 Ca 0.24 0.29 -0.64 0.00 -0.51 0.00 0.00 58.31 57.69 2axl n LYS 91 Cb 0.51 -0.33 -0.09 0.00 -0.51 0.00 0.00 35.03 34.61 2axl n LYS 91 CO 0.00 0.00 0.00 1.51 -1.11 0.00 0.00 177.40 177.80 2axl n ILE 92 N 0.90 0.03 -2.05 -0.18 0.00 0.31 -4.51 119.36 113.88 2axl n ILE 92 Ca 0.00 -0.01 -0.43 0.00 0.00 0.00 0.00 62.75 62.32 2axl n ILE 92 Cb 0.14 -0.47 -0.03 0.00 0.00 0.00 0.00 39.64 39.29 2axl n ILE 92 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2axl s ALA 94 N 4.90 3.24 -0.01 0.00 0.00 -0.69 -4.95 121.76 124.24 2axl s ALA 94 Ca 0.74 -0.82 -0.22 0.00 0.00 0.00 0.00 51.96 51.66 2axl s ALA 94 Cb -0.29 -1.45 -0.05 0.00 0.00 0.00 0.00 23.12 21.34 2axl s ALA 94 CO 0.29 0.58 0.65 -0.51 0.00 0.00 0.00 175.76 176.77 2axl s LEU 95 N -0.85 4.40 0.39 0.00 1.43 -1.26 -2.95 118.68 119.84 2axl s LEU 95 Ca 0.13 1.21 0.08 0.00 -1.03 0.00 0.00 54.13 54.52 2axl s LEU 95 Cb -0.11 -3.01 -0.00 0.00 0.03 0.00 0.00 46.19 43.09 2axl s LEU 95 CO 0.02 0.04 0.49 0.42 0.23 0.00 0.00 176.35 177.55 2axl s THR 96 N 0.05 3.29 0.39 5.49 -4.23 -1.26 -4.91 115.64 114.46 2axl s THR 96 Ca 0.34 -1.09 0.11 0.00 -1.18 0.00 0.00 61.69 59.87 2axl s THR 96 Cb -0.18 -3.13 0.11 0.00 1.34 0.00 0.00 72.50 70.64 2axl s THR 96 CO 0.18 -0.06 1.25 0.11 -0.54 0.00 0.00 174.62 175.56 2axl h LYS 97 N 0.82 0.00 0.04 3.99 1.79 -1.96 0.58 116.57 121.82 2axl h LYS 97 Ca -0.42 0.00 -0.00 0.00 -2.18 0.00 0.00 60.65 58.05 2axl h LYS 97 Cb 1.27 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.92 2axl h LYS 97 CO 0.50 0.00 -0.02 0.87 -1.08 0.00 0.00 179.45 179.72 2axl h LYS 98 N 0.00 -0.05 0.00 3.15 1.79 -1.90 -3.13 116.57 116.43 2axl h LYS 98 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 2axl h LYS 98 Cb 1.15 0.01 0.00 0.00 -1.58 0.00 0.00 32.23 31.81 2axl h LYS 98 CO 0.00 0.04 -1.31 0.41 -1.08 0.00 0.00 179.45 177.51 2axl n GLY 99 N -0.92 -1.22 0.29 3.86 0.00 0.16 -3.84 105.19 103.53 2axl n GLY 99 Ca -0.08 -0.39 -0.07 0.00 0.00 0.00 0.00 46.02 45.48 2axl n GLY 99 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2axl h ARG 100 N 0.00 0.99 -0.28 1.61 2.43 -1.47 0.52 114.38 118.18 2axl h ARG 100 Ca 0.00 -0.17 -0.13 0.00 -0.81 0.00 0.00 59.98 58.87 2axl h ARG 100 Cb 0.88 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 30.26 2axl h ARG 100 CO 0.00 0.82 -0.35 -2.95 -1.51 0.00 0.00 179.97 175.98 2axl h ASN 101 N 0.94 0.65 -0.52 -3.80 7.08 -1.72 -0.31 115.58 117.91 2axl h ASN 101 Ca 0.22 -0.27 -0.01 0.00 -3.08 0.00 0.00 56.30 53.16 2axl h ASN 101 Cb 0.19 -0.18 -0.02 0.00 -2.08 0.00 0.00 38.32 36.22 2axl h ASN 101 CO -0.02 0.95 0.28 -0.25 -2.08 0.00 0.00 177.43 176.31 2axl h TRP 102 N 0.52 0.71 -0.63 4.14 7.01 -1.30 -2.89 115.95 123.51 2axl h TRP 102 Ca 0.05 -0.02 -0.07 0.00 2.11 0.00 0.00 58.89 60.97 2axl h TRP 102 Cb 0.85 -0.23 -0.02 0.00 -2.10 0.00 0.00 29.16 27.66 2axl h TRP 102 CO 0.04 0.52 0.12 1.25 -2.79 0.00 0.00 178.44 177.58 2axl h LEU 103 N 0.69 0.98 -0.96 0.65 5.85 0.55 0.34 115.31 123.41 2axl h LEU 103 Ca 0.18 -0.25 0.00 0.00 0.84 0.00 0.00 57.88 58.65 2axl h LEU 103 Cb 0.05 -0.26 0.00 0.00 0.37 0.00 0.00 40.66 40.82 2axl h LEU 103 CO -0.03 0.98 0.00 0.45 -0.34 0.00 0.00 178.44 179.51 2axl h HIS 104 N 0.94 0.00 0.00 1.25 3.86 -0.87 -3.36 115.15 116.98 2axl h HIS 104 Ca 0.19 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.40 2axl h HIS 104 Cb 0.41 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.88 2axl h HIS 104 CO 0.03 0.00 -0.14 1.17 0.86 0.00 0.00 177.93 179.85 2axl n LYS 105 N -2.41 0.00 -0.22 2.45 4.81 -1.12 -4.85 118.16 116.83 2axl n LYS 105 Ca 0.01 0.00 -0.04 0.00 -0.87 0.00 0.00 58.31 57.41 2axl n LYS 105 Cb 0.22 -0.08 0.03 0.00 0.02 0.00 0.00 35.03 35.22 2axl n LYS 105 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2axl n ALA 106 N -2.68 3.05 0.18 3.14 0.00 0.09 -4.37 120.51 119.92 2axl n ALA 106 Ca 0.00 -0.48 0.10 0.00 0.00 0.00 0.00 53.44 53.06 2axl n ALA 106 Cb 0.07 -1.08 0.62 0.00 0.00 0.00 0.00 19.45 19.07 2axl n ALA 106 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 177.50 176.53 2axl h ASN 107 N 0.19 0.06 0.00 0.00 -0.00 -1.69 -3.38 115.58 110.76 2axl h ASN 107 Ca 0.11 -0.00 0.00 0.00 -0.00 0.00 0.00 56.30 56.40 2axl h ASN 107 Cb 1.30 -0.01 0.00 0.00 -0.00 0.00 0.00 38.32 39.60 2axl h ASN 107 CO 0.19 0.04 0.00 0.41 -0.00 0.00 0.00 177.43 178.07 2axl n THR 108 N -4.50 0.00 -2.98 -3.57 -1.04 -1.26 -4.95 114.28 95.98 2axl n THR 108 Ca 0.00 0.01 -0.16 0.00 -2.04 0.00 0.00 64.05 61.86 2axl n THR 108 Cb 0.18 -0.24 -0.01 0.00 -1.82 0.00 0.00 70.33 68.44 2axl n THR 108 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 2axl n GLU 109 N 0.00 0.70 -3.46 -2.82 1.02 -1.26 -5.04 120.64 109.78 2axl n GLU 109 Ca 0.00 -2.47 -0.27 0.00 -0.02 0.00 0.00 57.16 54.40 2axl n GLU 109 Cb 0.00 -1.37 -0.10 0.00 -0.02 0.00 0.00 31.44 29.94 2axl n GLU 109 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 2axl s SER 110 N -1.19 1.92 -0.27 1.62 0.01 -1.26 -5.09 113.70 109.44 2axl s SER 110 Ca 0.33 -3.14 -0.33 0.00 1.31 0.00 0.00 55.95 54.12 2axl s SER 110 Cb 0.18 -0.59 0.17 0.00 0.21 0.00 0.00 66.02 65.99 2axl s SER 110 CO -0.17 -0.16 1.34 0.00 0.41 0.00 0.00 173.24 174.65 2axl s GLN 111 N -0.10 0.09 -0.27 12.44 0.00 -1.26 -4.83 119.66 125.73 2axl s GLN 111 Ca 0.31 -0.00 -0.01 0.00 -0.00 0.00 0.00 55.36 55.66 2axl s GLN 111 Cb 0.02 0.04 0.15 0.00 0.00 0.00 0.00 33.01 33.21 2axl s GLN 111 CO -0.19 -0.03 0.39 -1.12 0.00 0.00 0.00 175.29 174.34 2axl s SER 112 N -1.47 0.38 -0.41 12.60 0.01 -1.26 -4.88 113.70 118.68 2axl s SER 112 Ca 0.10 -0.08 -0.11 0.00 1.31 0.00 0.00 55.95 57.16 2axl s SER 112 Cb -0.01 1.08 0.05 0.00 0.21 0.00 0.00 66.02 67.36 2axl s SER 112 CO -0.05 -0.33 0.25 -0.22 0.41 0.00 0.00 173.24 173.30 2axl s LEU 113 N 2.54 5.01 -0.02 2.44 2.96 -1.26 -5.03 118.68 125.32 2axl s LEU 113 Ca 0.11 -1.25 -0.22 0.00 -0.22 0.00 0.00 54.13 52.56 2axl s LEU 113 Cb -0.14 -2.03 -0.05 0.00 0.50 0.00 0.00 46.19 44.47 2axl s LEU 113 CO -0.23 -0.48 0.65 -0.63 -1.32 0.00 0.00 176.35 174.34 2axl s ILE 114 N 1.51 4.92 0.59 6.68 1.01 -1.26 -1.99 121.20 132.66 2axl s ILE 114 Ca 0.03 1.36 0.08 0.00 0.00 0.00 0.00 60.65 62.12 2axl s ILE 114 Cb -0.21 -3.99 0.08 0.00 0.01 0.00 0.00 42.46 38.35 2axl s ILE 114 CO 0.05 0.36 0.70 0.18 0.00 0.00 0.00 174.94 176.23 2axl n LEU 115 N 3.05 0.00 -4.72 2.97 4.77 -0.67 -4.88 117.00 117.51 2axl n LEU 115 Ca -0.05 -2.70 -0.43 0.00 -0.03 0.00 0.00 56.01 52.81 2axl n LEU 115 Cb 0.51 -0.31 -0.03 0.00 -2.33 0.00 0.00 43.42 41.26 2axl n LEU 115 CO 0.45 -0.68 1.29 1.67 -1.33 0.00 0.00 177.39 178.79 2axl n GLN 116 N -2.15 2.63 -2.18 3.23 7.27 -1.25 -3.37 117.38 121.56 2axl n GLN 116 Ca 0.11 0.94 -0.37 0.00 0.07 0.00 0.00 57.00 57.75 2axl n GLN 116 Cb 0.63 -2.75 0.00 0.00 2.41 0.00 0.00 30.24 30.53 2axl n GLN 116 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 2axl s ALA 117 N 0.67 2.91 0.64 1.69 0.00 -1.16 -4.74 121.76 121.77 2axl s ALA 117 Ca 0.71 0.99 -0.17 0.00 0.00 0.00 0.00 51.96 53.49 2axl s ALA 117 Cb -0.53 -3.41 -0.01 0.00 0.00 0.00 0.00 23.12 19.17 2axl s ALA 117 CO 0.39 -0.79 1.20 -0.80 0.00 0.00 0.00 175.76 175.76 2axl s ASN 118 N -1.34 4.90 0.16 0.00 0.01 -1.26 -4.87 114.94 112.53 2axl s ASN 118 Ca 0.66 2.35 -0.13 0.00 -0.71 0.00 0.00 52.86 55.03 2axl s ASN 118 Cb -0.30 -2.59 0.05 0.00 0.41 0.00 0.00 41.25 38.82 2axl s ASN 118 CO 0.36 -1.79 1.70 1.05 -1.51 0.00 0.00 177.10 176.91 2axl h GLU 119 N 0.47 0.82 -5.67 -0.60 4.11 -1.93 -3.36 114.58 108.42 2axl h GLU 119 Ca -0.49 -0.16 -0.63 0.00 0.07 0.00 0.00 59.36 58.15 2axl h GLU 119 Cb 1.29 -0.13 -0.13 0.00 0.50 0.00 0.00 28.75 30.29 2axl h GLU 119 CO 0.53 0.73 1.05 -1.21 0.07 0.00 0.00 179.01 180.19 2axl s GLU 120 N -5.49 3.45 -0.81 1.06 2.02 -1.26 -4.88 118.70 112.79 2axl s GLU 120 Ca -0.13 -1.15 0.01 0.00 0.02 0.00 0.00 54.97 53.72 2axl s GLU 120 Cb 0.12 -4.85 0.35 0.00 0.10 0.00 0.00 34.13 29.85 2axl s GLU 120 CO 0.79 -1.99 1.64 1.28 0.02 0.00 0.00 175.26 177.00 2axl n LEU 121 N 7.99 6.55 -2.94 1.80 4.77 -1.26 -4.71 117.00 129.20 2axl n LEU 121 Ca 0.19 -5.23 -0.14 0.00 -0.03 0.00 0.00 56.01 50.81 2axl n LEU 121 Cb 0.49 -0.93 0.03 0.00 -2.33 0.00 0.00 43.42 40.68 2axl n LEU 121 CO 0.61 2.03 0.05 0.00 -1.33 0.00 0.00 177.39 178.76 2axl n PRO 123 N 0.62 0.58 -0.15 0.00 -0.04 -1.26 -3.20 135.00 131.55 2axl n PRO 123 Ca 0.15 0.00 0.07 0.00 -0.04 0.00 0.00 63.50 63.68 2axl n PRO 123 Cb 0.66 -1.22 0.23 0.00 -0.04 0.00 0.00 33.50 33.12 2axl n PRO 123 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2axl n LYS 124 N -0.72 1.80 -0.46 0.54 5.02 -1.26 -4.62 118.16 118.46 2axl n LYS 124 Ca 0.06 -1.23 -0.12 0.00 -2.02 0.00 0.00 58.31 55.00 2axl n LYS 124 Cb 0.03 -1.31 -0.03 0.00 -0.02 0.00 0.00 35.03 33.70 2axl n LYS 124 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05 2axl n LYS 125 N 0.48 1.21 -3.19 1.97 4.81 -1.19 -4.85 118.16 117.40 2axl n LYS 125 Ca 0.13 -0.92 -0.39 0.00 -0.87 0.00 0.00 58.31 56.27 2axl n LYS 125 Cb 0.31 -2.12 -0.05 0.00 0.02 0.00 0.00 35.03 33.18 2axl n LYS 125 CO 0.00 0.00 0.00 -1.17 1.17 0.00 0.00 177.40 177.40 2axl s LEU 126 N 0.05 4.37 -0.39 3.14 2.96 -1.26 -5.01 118.68 122.54 2axl s LEU 126 Ca 0.26 1.11 -0.29 0.00 -0.22 0.00 0.00 54.13 54.99 2axl s LEU 126 Cb 0.08 -2.92 0.00 0.00 0.50 0.00 0.00 46.19 43.86 2axl s LEU 126 CO -0.02 0.04 1.52 -0.76 -1.32 0.00 0.00 176.35 175.82 2axl s LEU 127 N 0.14 3.56 -0.09 -0.68 1.02 -1.26 -4.99 118.68 116.37 2axl s LEU 127 Ca 0.32 0.96 -0.15 0.00 0.02 0.00 0.00 54.13 55.27 2axl s LEU 127 Cb -0.18 -3.53 -0.05 0.00 0.02 0.00 0.00 46.19 42.45 2axl s LEU 127 CO 0.16 -1.51 0.38 -0.76 0.02 0.00 0.00 176.35 174.64 2axl s LEU 128 N 5.85 4.33 0.53 1.79 1.43 -1.26 -5.06 118.68 126.29 2axl s LEU 128 Ca 0.66 0.75 -0.19 0.00 -1.03 0.00 0.00 54.13 54.32 2axl s LEU 128 Cb -0.16 -2.53 -0.06 0.00 0.03 0.00 0.00 46.19 43.46 2axl s LEU 128 CO 0.33 0.15 1.09 -2.16 0.23 0.00 0.00 176.35 175.99 2axl s PRO 129 N -0.05 3.49 0.41 1.29 0.04 -1.26 -4.99 135.00 133.94 2axl s PRO 129 Ca 0.22 1.48 -0.26 0.00 0.04 0.00 0.00 61.00 62.47 2axl s PRO 129 Cb -0.15 -2.04 -0.09 0.00 0.04 0.00 0.00 34.50 32.27 2axl s PRO 129 CO 0.09 -0.71 1.34 0.45 0.04 0.00 0.00 177.00 178.21 2axl s SER 130 N -1.96 6.27 -0.45 6.66 0.15 -1.26 -4.98 113.70 118.13 2axl s SER 130 Ca 0.70 2.73 0.04 0.00 0.70 0.00 0.00 55.95 60.12 2axl s SER 130 Cb -0.20 -2.64 0.17 0.00 -1.71 0.00 0.00 66.02 61.64 2axl s SER 130 CO 0.26 -0.89 0.37 -1.20 1.20 0.00 0.00 173.24 172.97 2axl n SER 131 N 0.14 -0.03 -4.85 5.45 7.64 -1.26 -5.12 113.62 115.58 2axl n SER 131 Ca 0.03 -2.49 -0.32 0.00 1.01 0.00 0.00 58.87 57.11 2axl n SER 131 Cb 0.43 -0.58 -0.01 0.00 -1.01 0.00 0.00 64.21 63.04 2axl n SER 131 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 2axl s LYS 132 N -0.18 3.77 0.76 1.43 -0.14 -1.26 -5.05 119.74 119.07 2axl s LYS 132 Ca 0.32 0.87 -0.11 0.00 -1.36 0.00 0.00 55.97 55.69 2axl s LYS 132 Cb 0.03 -2.11 0.05 0.00 -1.68 0.00 0.00 37.83 34.13 2axl s LYS 132 CO -0.19 -0.43 1.08 0.95 -0.76 0.00 0.00 175.35 176.00 2axl s THR 133 N -2.88 3.48 -0.35 2.17 -4.23 -1.26 -5.01 115.64 107.57 2axl s THR 133 Ca 0.57 0.48 -0.15 0.00 -1.18 0.00 0.00 61.69 61.41 2axl s THR 133 Cb -0.11 -3.15 -0.01 0.00 1.34 0.00 0.00 72.50 70.58 2axl s THR 133 CO 0.42 -0.63 0.38 -0.69 -0.54 0.00 0.00 174.62 173.56 2axl s VAL 134 N -3.04 5.15 0.19 2.29 1.01 -1.26 -4.95 120.40 119.80 2axl s VAL 134 Ca 0.60 0.06 -0.04 0.00 0.00 0.00 0.00 61.98 62.59 2axl s VAL 134 Cb -0.15 -3.84 -0.04 0.00 0.00 0.00 0.00 36.38 32.35 2axl s VAL 134 CO 0.55 -0.11 1.52 -1.28 0.00 0.00 0.00 175.10 175.78 2axl h SER 135 N 8.47 0.70 -4.20 3.32 0.87 -2.03 -3.45 113.55 117.23 2axl h SER 135 Ca -0.29 -0.34 -0.51 0.00 -1.23 0.00 0.00 61.79 59.42 2axl h SER 135 Cb 1.14 -0.20 0.17 0.00 -0.44 0.00 0.00 62.40 63.07 2axl h SER 135 CO 0.70 1.06 0.25 -0.44 -0.53 0.00 0.00 176.83 177.87 2axl s SER 136 N -6.89 3.47 0.00 6.23 0.01 -1.26 -3.33 113.70 111.93 2axl s SER 136 Ca -0.08 1.92 0.00 0.00 1.31 0.00 0.00 55.95 59.09 2axl s SER 136 Cb 0.12 -2.48 0.00 0.00 0.21 0.00 0.00 66.02 63.86 2axl s SER 136 CO 0.84 -2.71 0.00 0.61 0.41 0.00 0.00 173.24 172.40 2axl n GLY 137 N -0.47 1.34 3.89 3.44 0.00 -1.26 -5.04 105.19 107.08 2axl n GLY 137 Ca 0.10 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.82 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 -2.49 4.81 -0.30 2.61 2.01 -1.21 -5.07 115.64 116.01 2axl s THR 138 Ca 0.00 0.52 -0.06 0.00 0.31 0.00 0.00 61.69 62.46 2axl s THR 138 Cb 0.00 -3.85 0.18 0.00 0.01 0.00 0.00 72.50 68.84 2axl s THR 138 CO 0.00 -0.93 0.81 -1.59 -0.69 0.00 0.00 174.62 172.22 2axl s LYS 139 N -4.81 0.39 -0.00 4.92 -2.85 -1.26 -5.02 119.74 111.11 2axl s LYS 139 Ca 0.51 0.66 0.14 0.00 -1.00 0.00 0.00 55.97 56.27 2axl s LYS 139 Cb -0.11 0.36 -0.16 0.00 -2.06 0.00 0.00 37.83 35.86 2axl s LYS 139 CO 0.47 -0.46 0.52 -1.91 0.10 0.00 0.00 175.35 174.07 2axl n GLU 140 N 5.43 2.10 -0.36 1.78 4.07 -1.26 -4.52 120.64 127.89 2axl n GLU 140 Ca -0.03 -0.03 -0.00 0.00 -0.06 0.00 0.00 57.16 57.04 2axl n GLU 140 Cb 0.53 -1.18 0.15 0.00 -0.06 0.00 0.00 31.44 30.88 2axl n GLU 140 CO 0.00 0.00 0.00 1.25 -0.06 0.00 0.00 177.13 178.32 2axl h HIS 141 N 0.00 1.21 0.08 4.31 2.76 -1.96 -2.85 115.15 118.69 2axl h HIS 141 Ca 0.00 0.03 0.02 0.00 -2.20 0.00 0.00 60.37 58.22 2axl h HIS 141 Cb 0.38 -0.41 -0.05 0.00 1.55 0.00 0.00 27.41 28.89 2axl h HIS 141 CO 0.00 0.73 -0.35 0.00 -1.30 0.00 0.00 177.93 177.00 2axl s TYR 143 N -5.97 3.51 -0.73 0.00 5.04 -1.08 -5.27 117.35 112.85 2axl s TYR 143 Ca -0.16 1.23 0.00 0.00 -2.44 0.00 0.00 57.07 55.70 2axl s TYR 143 Cb 0.08 -2.87 0.00 0.00 0.35 0.00 0.00 41.96 39.52 2axl s TYR 143 CO 0.64 -0.04 0.18 0.27 -1.34 0.00 0.00 175.55 175.27