#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2axl h ASP 2 N 0.00 0.00 0.51 7.83 3.32 -1.86 -2.37 116.42 123.85 2axl h ASP 2 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2axl h ASP 2 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 2axl h ASP 2 CO 0.00 0.00 -0.05 0.47 -1.72 0.00 0.00 179.24 177.94 2axl n ASP 3 N -3.01 0.17 -4.39 6.45 8.00 -1.26 -4.61 116.55 117.90 2axl n ASP 3 Ca 0.01 -0.27 -0.45 0.00 0.71 0.00 0.00 54.79 54.80 2axl n ASP 3 Cb 0.33 -0.20 -0.06 0.00 -0.02 0.00 0.00 41.12 41.17 2axl n ASP 3 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 2axl s SER 4 N -2.57 6.19 0.29 -2.24 0.15 -0.89 -5.04 113.70 109.58 2axl s SER 4 Ca 0.28 -1.31 -0.28 0.00 0.70 0.00 0.00 55.95 55.34 2axl s SER 4 Cb 0.20 -2.26 -0.09 0.00 -1.71 0.00 0.00 66.02 62.16 2axl s SER 4 CO 0.48 -0.91 0.96 -1.61 1.20 0.00 0.00 173.24 173.35 2axl s GLU 5 N 2.28 4.70 0.00 5.44 0.41 -1.26 -4.93 118.70 125.33 2axl s GLU 5 Ca 0.10 1.44 0.00 0.00 -0.41 0.00 0.00 54.97 56.09 2axl s GLU 5 Cb -0.24 -3.03 0.00 0.00 -1.78 0.00 0.00 34.13 29.08 2axl s GLU 5 CO 0.08 0.37 0.00 -0.25 -0.49 0.00 0.00 175.26 174.96 2axl n ASP 6 N 1.00 -0.04 -4.29 -0.19 9.92 -1.26 -4.95 116.55 116.73 2axl n ASP 6 Ca 0.00 -0.18 -0.30 0.00 -0.53 0.00 0.00 54.79 53.78 2axl n ASP 6 Cb 0.48 0.00 -0.16 0.00 -0.64 0.00 0.00 41.12 40.80 2axl n ASP 6 CO 0.00 0.00 0.00 0.28 0.13 0.00 0.00 177.20 177.61 2axl s THR 7 N -0.20 1.97 -0.30 -3.53 -1.32 -1.26 -4.41 115.64 106.60 2axl s THR 7 Ca 0.00 -1.06 -0.15 0.00 -1.21 0.00 0.00 61.69 59.27 2axl s THR 7 Cb 0.00 -1.64 0.17 0.00 -1.51 0.00 0.00 72.50 69.52 2axl s THR 7 CO 0.00 0.56 1.03 -0.44 -2.21 0.00 0.00 174.62 173.55 2axl s SER 8 N -0.53 -0.52 0.00 8.08 0.01 -1.16 -1.22 113.70 118.36 2axl s SER 8 Ca 0.08 0.62 0.00 0.00 1.31 0.00 0.00 55.95 57.96 2axl s SER 8 Cb -0.10 1.55 0.00 0.00 0.21 0.00 0.00 66.02 67.68 2axl s SER 8 CO -0.00 -0.10 0.00 -2.67 0.41 0.00 0.00 173.24 170.88 2axl n TRP 9 N 5.02 0.00 -3.59 2.43 4.27 -1.13 -4.82 117.44 119.62 2axl n TRP 9 Ca -0.08 0.00 -0.37 0.00 -3.89 0.00 0.00 57.50 53.16 2axl n TRP 9 Cb 0.53 0.00 -0.10 0.00 -1.36 0.00 0.00 31.31 30.38 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 6.12 -0.45 -0.67 -1.08 -1.26 0.75 116.67 120.09 2axl s ASP 10 Ca 0.00 0.12 0.08 0.00 -0.52 0.00 0.00 52.55 52.23 2axl s ASP 10 Cb 0.00 -2.13 0.26 0.00 -1.46 0.00 0.00 42.92 39.59 2axl s ASP 10 CO 0.00 -0.01 0.59 0.33 0.52 0.00 0.00 175.17 176.60 2axl n PHE 11 N 4.65 0.61 -0.10 -5.34 -0.00 -1.23 -4.90 117.46 111.15 2axl n PHE 11 Ca -0.14 -3.71 -0.06 0.00 -0.00 0.00 0.00 57.45 53.55 2axl n PHE 11 Cb 0.52 -0.40 0.00 0.00 -0.00 0.00 0.00 39.48 39.60 2axl n PHE 11 CO 0.00 0.00 0.00 0.78 -0.00 0.00 0.00 176.76 177.54 2axl h GLY 12 N 3.98 0.24 -0.87 7.13 0.00 -1.83 -2.45 103.07 109.27 2axl h GLY 12 Ca 0.10 0.13 0.16 0.00 0.00 0.00 0.00 47.33 47.72 2axl h GLY 12 CO 0.55 -0.14 -0.27 -1.05 0.00 0.00 0.00 176.54 175.63 2axl n PRO 13 N -5.29 -0.13 -0.34 4.80 -0.02 -1.26 0.20 135.00 132.96 2axl n PRO 13 Ca 0.01 1.34 0.07 0.00 -2.02 0.00 0.00 63.50 62.91 2axl n PRO 13 Cb 0.20 -2.00 0.26 0.00 -0.02 0.00 0.00 33.50 31.94 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 0.93 -0.43 -0.52 4.20 -1.86 0.44 115.11 117.87 2axl h GLN 14 Ca 0.37 -0.06 -0.08 0.00 0.06 0.00 0.00 58.65 58.94 2axl h GLN 14 Cb 0.58 -0.21 -0.02 0.00 0.30 0.00 0.00 27.48 28.13 2axl h GLN 14 CO -0.88 0.62 -0.07 0.00 -0.67 0.00 0.00 178.83 177.83 2axl h ALA 15 N 1.54 1.07 -0.41 3.87 0.00 0.23 0.19 119.26 125.74 2axl h ALA 15 Ca 0.47 -0.29 -0.02 0.00 0.00 0.00 0.00 54.91 55.07 2axl h ALA 15 Cb 0.47 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 2axl h ALA 15 CO -0.23 0.58 0.19 0.74 0.00 0.00 0.00 179.25 180.53 2axl h PHE 16 N 0.69 0.60 -0.39 0.00 0.04 -0.06 2.35 116.94 120.17 2axl h PHE 16 Ca 0.12 -0.03 0.03 0.00 2.80 0.00 0.00 57.97 60.89 2axl h PHE 16 Cb 0.52 -0.18 -0.03 0.00 2.20 0.00 0.00 35.95 38.46 2axl h PHE 16 CO 0.03 0.50 0.21 0.87 -0.60 0.00 0.00 178.31 179.32 2axl h LYS 17 N 0.52 0.41 0.00 1.51 1.57 0.92 2.30 116.57 123.80 2axl h LYS 17 Ca 0.14 -0.02 -0.00 0.00 -1.87 0.00 0.00 60.65 58.89 2axl h LYS 17 Cb 0.13 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.35 2axl h LYS 17 CO -0.02 0.27 -0.01 1.25 -0.57 0.00 0.00 179.45 180.37 2axl h LEU 18 N 0.42 0.01 -0.27 2.94 5.85 0.06 -2.74 115.31 121.58 2axl h LEU 18 Ca 0.16 -0.85 -0.00 0.00 0.84 0.00 0.00 57.88 58.03 2axl h LEU 18 Cb 0.06 -0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.07 2axl h LEU 18 CO -0.10 0.86 0.16 -0.07 -0.34 0.00 0.00 178.44 178.95 2axl h LEU 19 N -0.84 0.33 -0.68 2.25 3.38 0.42 -2.19 115.31 117.97 2axl h LEU 19 Ca -0.00 -0.06 -0.14 0.00 0.09 0.00 0.00 57.88 57.77 2axl h LEU 19 Cb 0.86 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.51 2axl h LEU 19 CO 0.00 0.29 -0.65 -1.28 0.09 0.00 0.00 178.44 176.89 2axl h SER 20 N 0.34 0.04 -0.20 -0.43 0.87 0.38 -2.94 113.55 111.60 2axl h SER 20 Ca 0.10 -0.03 -0.07 0.00 -1.23 0.00 0.00 61.79 60.56 2axl h SER 20 Cb 0.03 -0.01 -0.00 0.00 -0.44 0.00 0.00 62.40 61.97 2axl h SER 20 CO -0.02 0.68 -0.16 0.00 -0.53 0.00 0.00 176.83 176.80 2axl h ALA 21 N 1.32 0.29 -0.24 6.23 0.00 -1.32 -2.52 119.26 123.01 2axl h ALA 21 Ca -0.01 -0.33 -0.02 0.00 0.00 0.00 0.00 54.91 54.55 2axl h ALA 21 Cb 1.16 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.87 2axl h ALA 21 CO 0.09 0.19 0.07 -0.39 0.00 0.00 0.00 179.25 179.21 2axl h VAL 22 N 0.15 1.11 -0.23 0.00 -1.51 -1.45 -1.65 116.25 112.67 2axl h VAL 22 Ca 0.04 -0.37 0.02 0.00 -1.23 0.00 0.00 66.70 65.15 2axl h VAL 22 Cb 0.69 0.85 -0.02 0.00 -2.13 0.00 0.00 31.29 30.68 2axl h VAL 22 CO 0.04 0.14 0.09 -0.78 -1.23 0.00 0.00 177.57 175.83 2axl h ASP 23 N 0.34 0.12 -0.67 4.19 3.58 -1.31 1.34 116.42 124.01 2axl h ASP 23 Ca 0.08 0.02 -0.00 0.00 0.42 0.00 0.00 57.03 57.55 2axl h ASP 23 Cb 0.11 -0.00 -0.03 0.00 1.72 0.00 0.00 39.33 41.13 2axl h ASP 23 CO -0.01 0.10 0.41 0.40 -2.88 0.00 0.00 179.24 177.26 2axl h ILE 24 N 0.21 1.19 0.00 2.25 1.08 -0.89 0.58 117.51 121.93 2axl h ILE 24 Ca 0.10 -0.42 0.00 0.00 -0.39 0.00 0.00 64.86 64.15 2axl h ILE 24 Cb 0.05 0.26 0.00 0.00 -3.07 0.00 0.00 36.82 34.06 2axl h ILE 24 CO -0.09 0.20 0.00 0.18 -0.69 0.00 0.00 178.15 177.75 2axl n LEU 25 N -4.57 0.00 -2.36 1.44 4.77 -0.62 -4.82 117.00 110.84 2axl n LEU 25 Ca 0.05 0.14 -0.18 0.00 -0.03 0.00 0.00 56.01 56.00 2axl n LEU 25 Cb 0.05 -0.14 -0.01 0.00 -2.33 0.00 0.00 43.42 40.99 2axl n LEU 25 CO 0.36 -0.05 -0.22 0.61 -1.33 0.00 0.00 177.39 176.76 2axl n GLY 26 N 0.38 -0.37 3.28 -0.72 0.00 0.40 -2.21 105.19 105.96 2axl n GLY 26 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.15 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 -2.89 -0.63 -0.53 1.61 1.02 0.22 -4.78 120.64 114.66 2axl n GLU 27 Ca -0.21 0.12 -0.03 0.00 -0.02 0.00 0.00 57.16 57.03 2axl n GLU 27 Cb 0.65 -3.90 0.01 0.00 -0.02 0.00 0.00 31.44 28.18 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 -0.64 1.13 -3.91 3.49 4.76 -0.94 -4.71 118.16 117.34 2axl n LYS 28 Ca 0.00 -0.25 -0.10 0.00 -2.87 0.00 0.00 58.31 55.09 2axl n LYS 28 Cb 0.12 -1.10 -0.09 0.00 -1.84 0.00 0.00 35.03 32.12 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 -0.29 0.17 1.10 2.13 0.40 -1.26 -5.13 117.98 115.10 2axl s PHE 29 Ca 0.05 -0.47 -0.18 0.00 -0.60 0.00 0.00 56.93 55.73 2axl s PHE 29 Cb 0.04 -0.12 0.26 0.00 0.51 0.00 0.00 43.02 43.71 2axl s PHE 29 CO -0.00 -0.38 1.26 0.20 0.70 0.00 0.00 175.22 176.99 2axl s GLY 30 N -2.14 1.73 0.31 4.36 0.00 -1.26 -3.92 107.32 106.39 2axl s GLY 30 Ca -0.05 -1.22 0.09 0.00 0.00 0.00 0.00 44.72 43.55 2axl s GLY 30 CO -0.05 -0.35 1.71 1.19 0.00 0.00 0.00 173.10 175.61 2axl h ILE 31 N -2.16 1.33 -0.84 0.90 2.10 -1.80 -3.30 117.51 113.75 2axl h ILE 31 Ca -0.43 -1.61 0.06 0.00 1.08 0.00 0.00 64.86 63.95 2axl h ILE 31 Cb 1.24 1.82 -0.06 0.00 -1.09 0.00 0.00 36.82 38.73 2axl h ILE 31 CO 0.31 0.47 0.52 1.23 -1.08 0.00 0.00 178.15 179.60 2axl h GLY 32 N 1.36 1.27 0.57 8.18 0.00 -1.93 -1.79 103.07 110.72 2axl h GLY 32 Ca 0.00 -0.38 -0.01 0.00 0.00 0.00 0.00 47.33 46.94 2axl h GLY 32 CO 0.06 0.26 -0.11 -2.00 0.00 0.00 0.00 176.54 174.75 2axl h LEU 33 N 0.96 -0.27 -1.06 3.11 5.85 -1.95 -3.16 115.31 118.79 2axl h LEU 33 Ca 0.37 -0.25 -0.09 0.00 0.84 0.00 0.00 57.88 58.75 2axl h LEU 33 Cb 0.16 0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.25 2axl h LEU 33 CO -0.17 0.16 -0.29 1.55 -0.34 0.00 0.00 178.44 179.35 2axl h PRO 34 N -0.75 0.31 -0.29 5.25 0.13 -1.71 -2.37 132.00 132.57 2axl h PRO 34 Ca -0.03 -0.12 -0.03 0.00 -0.87 0.00 0.00 66.00 64.95 2axl h PRO 34 Cb 0.50 -0.02 -0.01 0.00 0.13 0.00 0.00 31.00 31.60 2axl h PRO 34 CO 0.05 0.58 0.08 0.97 -0.23 0.00 0.00 178.00 179.45 2axl h ILE 35 N 0.28 1.21 -0.48 -3.56 2.10 -1.42 -1.80 117.51 113.84 2axl h ILE 35 Ca 0.04 -0.70 0.00 0.00 1.08 0.00 0.00 64.86 65.28 2axl h ILE 35 Cb 0.65 1.12 -0.02 0.00 -1.09 0.00 0.00 36.82 37.48 2axl h ILE 35 CO 0.05 0.23 0.32 -0.07 -1.08 0.00 0.00 178.15 177.60 2axl h LEU 36 N 0.31 0.55 -0.52 2.19 3.38 -1.50 -3.11 115.31 116.61 2axl h LEU 36 Ca 0.09 -0.02 -0.15 0.00 0.09 0.00 0.00 57.88 57.90 2axl h LEU 36 Cb 0.28 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 2axl h LEU 36 CO 0.00 0.40 -0.40 0.15 0.09 0.00 0.00 178.44 178.68 2axl h PHE 37 N 0.65 0.92 -1.01 1.13 3.04 -1.18 -3.01 116.94 117.48 2axl h PHE 37 Ca 0.18 -0.27 0.01 0.00 3.98 0.00 0.00 57.97 61.86 2axl h PHE 37 Cb -0.07 -0.19 -0.05 0.00 2.56 0.00 0.00 35.95 38.20 2axl h PHE 37 CO -0.04 1.04 0.67 -0.07 -2.02 0.00 0.00 178.31 177.89 2axl h LEU 38 N 0.63 1.15 0.00 0.59 3.38 -1.26 -1.99 115.31 117.81 2axl h LEU 38 Ca 0.05 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.99 2axl h LEU 38 Cb 0.95 -0.29 0.00 0.00 0.09 0.00 0.00 40.66 41.42 2axl h LEU 38 CO 0.09 0.83 0.00 0.54 0.09 0.00 0.00 178.44 179.99 2axl n ARG 39 N -4.38 0.26 -2.22 1.13 1.74 -1.14 -0.80 116.66 111.25 2axl n ARG 39 Ca 0.12 0.07 -0.02 0.00 -0.77 0.00 0.00 57.85 57.25 2axl n ARG 39 Cb 0.01 -1.50 0.01 0.00 -1.02 0.00 0.00 32.46 29.96 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 -0.36 -0.53 3.77 -0.13 0.00 -0.75 -4.18 105.19 103.01 2axl n GLY 40 Ca 0.07 0.10 -0.30 0.00 0.00 0.00 0.00 46.02 45.89 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 -2.64 4.17 -0.66 1.61 1.04 -1.21 -4.87 113.70 111.14 2axl s SER 41 Ca 0.05 1.40 -0.27 0.00 0.48 0.00 0.00 55.95 57.61 2axl s SER 41 Cb -0.01 -2.11 0.02 0.00 0.10 0.00 0.00 66.02 64.02 2axl s SER 41 CO 0.33 -2.18 1.41 0.21 0.98 0.00 0.00 173.24 173.99 2axl s ASN 42 N -3.72 6.02 -0.32 7.02 2.47 -1.26 -4.87 114.94 120.28 2axl s ASN 42 Ca 0.62 -0.09 0.06 0.00 0.42 0.00 0.00 52.86 53.87 2axl s ASN 42 Cb -0.16 -2.55 0.19 0.00 -1.45 0.00 0.00 41.25 37.28 2axl s ASN 42 CO 0.55 -1.88 0.58 -0.55 -3.72 0.00 0.00 177.10 172.08 2axl s SER 43 N 4.62 -1.38 0.17 -4.21 0.15 -1.26 -5.04 113.70 106.75 2axl s SER 43 Ca 0.46 -0.12 -0.06 0.00 0.70 0.00 0.00 55.95 56.93 2axl s SER 43 Cb -0.09 1.91 0.05 0.00 -1.71 0.00 0.00 66.02 66.18 2axl s SER 43 CO 0.19 -0.27 1.48 -0.61 1.20 0.00 0.00 173.24 175.22 2axl h GLN 44 N 7.77 0.66 -0.74 5.44 5.75 -1.98 -2.61 115.11 129.40 2axl h GLN 44 Ca -0.00 -0.41 0.00 0.00 -0.15 0.00 0.00 58.65 58.09 2axl h GLN 44 Cb 1.18 0.05 -0.04 0.00 1.07 0.00 0.00 27.48 29.74 2axl h GLN 44 CO 0.15 1.03 0.47 -0.09 -2.65 0.00 0.00 178.83 177.74 2axl h ARG 45 N 0.51 0.99 -0.00 1.69 2.43 -2.01 -1.60 114.38 116.38 2axl h ARG 45 Ca 0.01 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 59.11 2axl h ARG 45 Cb 1.11 -0.22 0.00 0.00 -0.42 0.00 0.00 29.97 30.44 2axl h ARG 45 CO 0.11 0.67 -0.17 1.28 -1.51 0.00 0.00 179.97 180.35 2axl n LEU 46 N -4.55 0.61 0.10 3.80 4.77 -1.23 -3.12 117.00 117.38 2axl n LEU 46 Ca 0.07 -0.05 0.11 0.00 -0.03 0.00 0.00 56.01 56.11 2axl n LEU 46 Cb 0.03 -0.19 -0.00 0.00 -2.33 0.00 0.00 43.42 40.93 2axl n LEU 46 CO 0.36 0.12 0.02 0.00 -1.33 0.00 0.00 177.39 176.55 2axl h ALA 47 N 3.56 0.51 0.08 -1.18 0.00 -0.91 -2.93 119.26 118.39 2axl h ALA 47 Ca 0.00 -0.03 -0.37 0.00 0.00 0.00 0.00 54.91 54.50 2axl h ALA 47 Cb 0.42 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.18 2axl h ALA 47 CO 0.00 0.04 -2.15 -0.25 0.00 0.00 0.00 179.25 176.89 2axl n ASP 48 N -2.69 2.05 0.05 0.00 8.00 -0.86 -3.19 116.55 119.90 2axl n ASP 48 Ca -0.00 0.10 -0.12 0.00 0.71 0.00 0.00 54.79 55.47 2axl n ASP 48 Cb 0.56 -0.70 -0.09 0.00 -0.02 0.00 0.00 41.12 40.88 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 0.05 -0.15 -1.12 -1.24 4.20 -1.71 -3.17 115.11 111.97 2axl h GLN 49 Ca -0.47 0.01 -0.46 0.00 0.06 0.00 0.00 58.65 57.79 2axl h GLN 49 Cb 1.99 0.03 -0.23 0.00 0.30 0.00 0.00 27.48 29.58 2axl h GLN 49 CO 0.03 0.27 0.59 0.66 -0.67 0.00 0.00 178.83 179.72 2axl n TYR 50 N -4.94 2.42 -0.25 2.96 4.01 -1.11 -4.62 117.16 115.63 2axl n TYR 50 Ca -0.09 -2.06 -0.05 0.00 -0.16 0.00 0.00 57.90 55.54 2axl n TYR 50 Cb 0.25 -1.01 0.05 0.00 -0.31 0.00 0.00 39.34 38.32 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 1.28 0.92 -0.15 -0.72 0.11 -1.52 -2.38 114.38 111.91 2axl h ARG 51 Ca 0.48 -0.07 -0.02 0.00 0.10 0.00 0.00 59.98 60.47 2axl h ARG 51 Cb 1.63 -0.20 -0.01 0.00 1.11 0.00 0.00 29.97 32.50 2axl h ARG 51 CO 1.04 0.63 -0.01 0.00 0.10 0.00 0.00 179.97 181.72 2axl h ARG 52 N 0.93 0.22 -5.20 0.08 2.47 -1.87 -3.42 114.38 107.59 2axl h ARG 52 Ca 0.25 -0.03 -0.53 0.00 -1.26 0.00 0.00 59.98 58.41 2axl h ARG 52 Cb -0.07 -0.04 -0.07 0.00 -1.65 0.00 0.00 29.97 28.14 2axl h ARG 52 CO -0.05 0.26 1.69 1.58 0.56 0.00 0.00 179.97 184.01 2axl n HIS 53 N -4.39 0.76 -0.10 3.04 -0.00 -0.90 -4.79 115.22 108.84 2axl n HIS 53 Ca -0.01 0.38 -0.10 0.00 0.46 0.00 0.00 57.72 58.45 2axl n HIS 53 Cb 0.17 -2.41 0.04 0.00 -0.12 0.00 0.00 29.99 27.67 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 12.70 0.88 0.00 0.26 0.87 -1.88 -3.04 113.55 123.34 2axl h SER 54 Ca -0.09 -0.36 0.00 0.00 -1.23 0.00 0.00 61.79 60.11 2axl h SER 54 Cb 1.32 -0.24 0.00 0.00 -0.44 0.00 0.00 62.40 63.03 2axl h SER 54 CO 1.32 1.12 0.29 0.18 -0.53 0.00 0.00 176.83 179.21 2axl n LEU 55 N -4.08 0.29 -4.69 2.23 4.77 -1.26 -4.62 117.00 109.64 2axl n LEU 55 Ca -0.01 0.51 -0.44 0.00 -0.03 0.00 0.00 56.01 56.04 2axl n LEU 55 Cb 0.49 -0.47 -0.04 0.00 -2.33 0.00 0.00 43.42 41.08 2axl n LEU 55 CO 0.47 -0.61 1.34 0.33 -1.33 0.00 0.00 177.39 177.58 2axl n PHE 56 N -1.94 2.48 -1.29 -1.77 -0.00 -1.15 -2.72 117.46 111.07 2axl n PHE 56 Ca -0.01 0.08 -0.10 0.00 -0.00 0.00 0.00 57.45 57.43 2axl n PHE 56 Cb 0.31 -2.63 -0.04 0.00 -0.00 0.00 0.00 39.48 37.11 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 3.85 1.13 0.17 7.13 0.00 0.02 -4.82 105.19 112.67 2axl n GLY 57 Ca 0.18 -0.50 0.12 0.00 0.00 0.00 0.00 46.02 45.82 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 -2.67 0.00 1.16 2.61 -1.04 -0.97 -3.09 114.28 110.27 2axl n THR 58 Ca -0.10 -0.09 0.11 0.00 -2.04 0.00 0.00 64.05 61.93 2axl n THR 58 Cb 0.34 0.43 0.36 0.00 -1.82 0.00 0.00 70.33 69.64 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 1.41 0.40 0.25 3.41 0.00 -1.02 -4.15 105.19 105.49 2axl n GLY 59 Ca 0.09 -0.45 -0.06 0.00 0.00 0.00 0.00 46.02 45.60 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 2.44 0.83 0.00 1.61 3.64 -1.67 -2.02 116.57 121.39 2axl h LYS 60 Ca 0.00 -0.07 0.00 0.00 -1.27 0.00 0.00 60.65 59.31 2axl h LYS 60 Cb 0.53 -0.18 0.00 0.00 -0.41 0.00 0.00 32.23 32.17 2axl h LYS 60 CO 0.00 0.58 0.00 -0.40 -2.27 0.00 0.00 179.45 177.36 2axl n ASP 61 N -4.63 0.00 -4.69 4.20 5.75 -1.26 -4.74 116.55 111.19 2axl n ASP 61 Ca 0.04 0.25 -0.35 0.00 -0.01 0.00 0.00 54.79 54.72 2axl n ASP 61 Cb 0.04 -0.39 -0.09 0.00 -1.03 0.00 0.00 41.12 39.65 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 -2.78 3.51 0.95 0.11 -0.21 -0.76 -5.09 119.66 115.38 2axl s GLN 62 Ca 0.14 -0.33 -0.12 0.00 0.02 0.00 0.00 55.36 55.07 2axl s GLN 62 Cb 0.13 -3.04 0.16 0.00 1.00 0.00 0.00 33.01 31.26 2axl s GLN 62 CO 0.33 0.52 1.10 0.95 -2.12 0.00 0.00 175.29 176.07 2axl s THR 63 N -0.35 2.31 0.14 -0.19 -4.23 -1.26 -4.92 115.64 107.14 2axl s THR 63 Ca 0.08 0.10 -0.18 0.00 -1.18 0.00 0.00 61.69 60.51 2axl s THR 63 Cb -0.12 -2.62 -0.03 0.00 1.34 0.00 0.00 72.50 71.07 2axl s THR 63 CO 0.02 -0.13 1.76 -0.08 -0.54 0.00 0.00 174.62 175.64 2axl h GLU 64 N -1.71 0.23 0.00 3.99 4.57 -1.98 -2.89 114.58 116.80 2axl h GLU 64 Ca -0.52 -0.01 -0.06 0.00 -1.18 0.00 0.00 59.36 57.59 2axl h GLU 64 Cb 1.31 -0.05 -0.01 0.00 -0.16 0.00 0.00 28.75 29.84 2axl h GLU 64 CO 0.57 0.15 -0.27 0.66 -1.18 0.00 0.00 179.01 178.94 2axl h SER 65 N 0.24 0.00 -0.47 1.04 4.64 -1.97 0.87 113.55 117.91 2axl h SER 65 Ca 0.11 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.41 2axl h SER 65 Cb 0.06 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.13 2axl h SER 65 CO -0.10 0.27 0.19 -0.25 -0.87 0.00 0.00 176.83 176.07 2axl h TRP 66 N 0.00 0.71 -0.18 4.77 2.91 -1.85 2.91 115.95 125.22 2axl h TRP 66 Ca -0.00 -0.05 -0.05 0.00 1.13 0.00 0.00 58.89 59.92 2axl h TRP 66 Cb 0.56 -0.21 -0.01 0.00 -0.51 0.00 0.00 29.16 28.99 2axl h TRP 66 CO 0.00 0.60 -0.06 -1.49 -1.03 0.00 0.00 178.44 176.46 2axl h TRP 67 N 0.61 0.42 -0.30 2.65 4.06 -1.41 0.48 115.95 122.46 2axl h TRP 67 Ca 0.16 -0.10 0.05 0.00 2.06 0.00 0.00 58.89 61.06 2axl h TRP 67 Cb 0.19 -0.10 -0.04 0.00 -1.00 0.00 0.00 29.16 28.20 2axl h TRP 67 CO 0.00 0.65 0.02 -0.22 -3.56 0.00 0.00 178.44 175.33 2axl h LYS 68 N 0.07 0.11 -0.57 0.49 1.63 0.22 -0.44 116.57 118.09 2axl h LYS 68 Ca 0.04 -0.01 0.01 0.00 -0.85 0.00 0.00 60.65 59.85 2axl h LYS 68 Cb 0.52 -0.02 -0.03 0.00 -0.60 0.00 0.00 32.23 32.10 2axl h LYS 68 CO 0.02 0.07 0.37 0.00 -3.45 0.00 0.00 179.45 176.46 2axl h ALA 69 N 1.25 0.72 -0.61 5.00 0.00 0.55 -2.17 119.26 124.00 2axl h ALA 69 Ca 0.14 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.02 2axl h ALA 69 Cb 0.18 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 2axl h ALA 69 CO -0.22 0.13 0.40 0.35 0.00 0.00 0.00 179.25 179.91 2axl h PHE 70 N 0.75 0.77 -0.86 0.00 3.57 0.13 -2.04 116.94 119.26 2axl h PHE 70 Ca 0.21 0.01 0.05 0.00 3.53 0.00 0.00 57.97 61.78 2axl h PHE 70 Cb -0.06 -0.26 -0.06 0.00 2.79 0.00 0.00 35.95 38.36 2axl h PHE 70 CO -0.04 0.49 0.54 0.77 -2.23 0.00 0.00 178.31 177.84 2axl h SER 71 N 0.82 0.85 -0.65 0.41 0.02 -0.72 -1.93 113.55 112.35 2axl h SER 71 Ca 0.22 0.01 0.01 0.00 -0.84 0.00 0.00 61.79 61.19 2axl h SER 71 Cb -0.08 -0.17 -0.03 0.00 0.14 0.00 0.00 62.40 62.25 2axl h SER 71 CO -0.05 0.56 0.42 -0.09 -1.14 0.00 0.00 176.83 176.54 2axl h ARG 72 N 0.99 0.84 -0.83 3.45 2.43 -0.76 -2.55 114.38 117.94 2axl h ARG 72 Ca 0.37 -0.05 0.09 0.00 -0.81 0.00 0.00 59.98 59.58 2axl h ARG 72 Cb 0.13 -0.19 -0.07 0.00 -0.42 0.00 0.00 29.97 29.42 2axl h ARG 72 CO -0.16 0.55 0.48 1.96 -1.51 0.00 0.00 179.97 181.30 2axl h GLN 73 N 0.86 0.79 -0.38 0.20 4.20 -0.83 -2.50 115.11 117.44 2axl h GLN 73 Ca 0.24 -0.05 -0.07 0.00 0.06 0.00 0.00 58.65 58.84 2axl h GLN 73 Cb -0.07 -0.18 -0.02 0.00 0.30 0.00 0.00 27.48 27.51 2axl h GLN 73 CO -0.06 0.52 -0.03 -0.07 -0.67 0.00 0.00 178.83 178.51 2axl h LEU 74 N 0.81 0.60 -0.38 1.46 3.38 -1.25 -3.02 115.31 116.91 2axl h LEU 74 Ca 0.40 -0.14 -0.01 0.00 0.09 0.00 0.00 57.88 58.23 2axl h LEU 74 Cb 0.35 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.93 2axl h LEU 74 CO -0.24 0.69 0.21 0.40 0.09 0.00 0.00 178.44 179.59 2axl h ILE 75 N 0.59 1.14 -0.30 1.22 2.04 -1.31 -2.18 117.51 118.70 2axl h ILE 75 Ca 0.12 -0.36 -0.17 0.00 1.00 0.00 0.00 64.86 65.45 2axl h ILE 75 Cb 0.42 0.69 -0.00 0.00 -0.74 0.00 0.00 36.82 37.19 2axl h ILE 75 CO 0.02 0.15 -0.48 0.74 0.00 0.00 0.00 178.15 178.58 2axl h THR 76 N 0.49 1.28 0.00 -0.27 2.02 -1.57 -3.15 112.91 111.71 2axl h THR 76 Ca 0.13 -1.67 -0.03 0.00 0.77 0.00 0.00 66.41 65.62 2axl h THR 76 Cb 0.05 1.55 -0.00 0.00 -1.74 0.00 0.00 68.15 68.01 2axl h THR 76 CO -0.02 0.54 -0.13 -0.33 0.37 0.00 0.00 175.52 175.95 2axl h GLU 77 N 0.65 0.00 0.00 6.66 5.08 -1.48 -3.45 114.58 122.04 2axl h GLU 77 Ca 0.03 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 2axl h GLU 77 Cb 1.06 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.31 2axl h GLU 77 CO 0.11 0.13 0.00 0.41 -1.00 0.00 0.00 179.01 178.66 2axl n GLY 78 N -0.77 1.89 0.32 -3.84 0.00 -1.12 -4.41 105.19 97.25 2axl n GLY 78 Ca -0.02 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.09 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 0.33 -3.96 1.61 -1.00 -1.81 -3.43 116.94 108.69 2axl h PHE 79 Ca 0.00 0.01 -0.32 0.00 2.81 0.00 0.00 57.97 60.47 2axl h PHE 79 Cb 0.00 -0.11 -0.24 0.00 3.61 0.00 0.00 35.95 39.21 2axl h PHE 79 CO 0.00 0.18 -0.75 -1.17 -1.61 0.00 0.00 178.31 174.96 2axl s LEU 80 N -9.28 2.17 0.00 1.54 2.96 -0.84 -4.28 118.68 110.95 2axl s LEU 80 Ca -0.07 -0.39 0.05 0.00 -0.22 0.00 0.00 54.13 53.50 2axl s LEU 80 Cb 0.18 -0.27 -0.01 0.00 0.50 0.00 0.00 46.19 46.59 2axl s LEU 80 CO 0.73 -0.08 -0.15 0.54 -1.32 0.00 0.00 176.35 176.06 2axl s VAL 81 N -0.90 1.21 -0.06 1.68 0.11 -1.10 -4.17 120.40 117.17 2axl s VAL 81 Ca -0.04 -0.74 0.05 0.00 -2.93 0.00 0.00 61.98 58.31 2axl s VAL 81 Cb -0.07 -1.03 -0.02 0.00 -1.53 0.00 0.00 36.38 33.74 2axl s VAL 81 CO 0.00 0.28 -0.20 -1.61 -3.33 0.00 0.00 175.10 170.24 2axl s GLU 82 N -0.53 2.61 -0.12 1.54 2.02 -1.26 -2.37 118.70 120.59 2axl s GLU 82 Ca 0.05 -0.80 0.01 0.00 0.02 0.00 0.00 54.97 54.25 2axl s GLU 82 Cb -0.06 -2.29 -0.01 0.00 0.10 0.00 0.00 34.13 31.86 2axl s GLU 82 CO -0.00 0.46 -0.17 0.08 0.02 0.00 0.00 175.26 175.65 2axl s VAL 83 N -0.32 2.70 -0.88 2.63 1.01 -1.17 -4.96 120.40 119.40 2axl s VAL 83 Ca 0.02 -0.79 0.26 0.00 0.00 0.00 0.00 61.98 61.47 2axl s VAL 83 Cb -0.13 -2.10 0.15 0.00 0.00 0.00 0.00 36.38 34.30 2axl s VAL 83 CO 0.02 0.54 1.65 -0.24 0.00 0.00 0.00 175.10 177.07 2axl n SER 84 N 3.51 0.42 -0.21 3.32 2.88 -1.26 -2.58 113.62 119.70 2axl n SER 84 Ca -0.18 0.24 0.08 0.00 -1.33 0.00 0.00 58.87 57.68 2axl n SER 84 Cb 0.53 -0.23 0.41 0.00 -0.75 0.00 0.00 64.21 64.18 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 -1.75 1.27 -3.76 -1.46 1.74 -1.26 -4.64 116.66 106.80 2axl n ARG 85 Ca 0.06 -0.41 -0.25 0.00 -0.77 0.00 0.00 57.85 56.47 2axl n ARG 85 Cb 0.37 -1.29 -0.17 0.00 -1.02 0.00 0.00 32.46 30.35 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 -1.91 0.87 0.00 -1.55 1.51 -1.21 -4.97 117.35 110.09 2axl s TYR 86 Ca 0.26 -0.52 0.00 0.00 -1.01 0.00 0.00 57.07 55.80 2axl s TYR 86 Cb 0.13 -0.93 0.00 0.00 -0.11 0.00 0.00 41.96 41.05 2axl s TYR 86 CO 0.20 -0.47 0.00 0.09 -1.11 0.00 0.00 175.55 174.26 2axl n ASN 87 N 5.09 -1.29 0.00 2.29 5.03 -1.26 0.82 115.26 125.94 2axl n ASN 87 Ca -0.08 0.00 0.03 0.00 0.87 0.00 0.00 54.58 55.40 2axl n ASN 87 Cb 0.49 -0.65 0.16 0.00 -1.02 0.00 0.00 39.78 38.76 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 0.06 0.10 0.00 3.52 4.81 -1.26 -2.48 118.16 122.91 2axl n LYS 88 Ca 0.00 0.21 0.00 0.00 -0.87 0.00 0.00 58.31 57.65 2axl n LYS 88 Cb 0.00 -1.50 0.00 0.00 0.02 0.00 0.00 35.03 33.55 2axl n LYS 88 CO 0.00 0.00 0.00 1.19 1.17 0.00 0.00 177.40 179.76 2axl n PHE 89 N -1.26 0.00 -3.10 5.64 3.72 -1.26 -4.92 117.46 116.28 2axl n PHE 89 Ca 0.03 0.00 -0.01 0.00 -0.05 0.00 0.00 57.45 57.42 2axl n PHE 89 Cb 0.05 -0.14 -0.01 0.00 -0.94 0.00 0.00 39.48 38.44 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 -0.62 0.88 0.00 -1.08 0.00 -1.04 -5.08 119.30 112.36 2axl s MET 90 Ca 0.00 -0.49 0.00 0.00 0.00 0.00 0.00 55.69 55.20 2axl s MET 90 Cb 0.00 0.03 0.00 0.00 0.00 0.00 0.00 34.83 34.86 2axl s MET 90 CO 0.00 -1.23 0.00 1.63 0.00 0.00 0.00 175.02 175.42 2axl n LYS 91 N 4.03 -0.18 -1.38 4.11 4.01 -1.22 -3.61 118.16 123.92 2axl n LYS 91 Ca 0.13 0.35 -0.40 0.00 -0.51 0.00 0.00 58.31 57.88 2axl n LYS 91 Cb 0.56 -0.39 0.01 0.00 -0.51 0.00 0.00 35.03 34.70 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 0.97 1.23 -3.09 -0.18 3.06 0.24 -4.56 119.36 117.04 2axl n ILE 92 Ca 0.00 -0.50 -0.39 0.00 -2.50 0.00 0.00 62.75 59.36 2axl n ILE 92 Cb 0.17 -0.33 -0.06 0.00 0.54 0.00 0.00 39.64 39.96 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 -1.12 0.04 0.09 0.00 0.00 -1.00 -4.90 121.76 114.88 2axl s ALA 94 Ca 0.33 0.35 -0.23 0.00 0.00 0.00 0.00 51.96 52.41 2axl s ALA 94 Cb -0.22 -0.27 -0.07 0.00 0.00 0.00 0.00 23.12 22.57 2axl s ALA 94 CO 0.24 -0.11 0.71 -0.51 0.00 0.00 0.00 175.76 176.08 2axl s LEU 95 N 1.06 4.52 0.00 0.00 1.43 -1.26 -2.70 118.68 121.74 2axl s LEU 95 Ca -0.09 1.45 0.00 0.00 -1.03 0.00 0.00 54.13 54.46 2axl s LEU 95 Cb -0.13 -3.15 0.00 0.00 0.03 0.00 0.00 46.19 42.95 2axl s LEU 95 CO -0.03 0.16 0.00 0.35 0.23 0.00 0.00 176.35 177.05 2axl n THR 96 N 2.10 0.00 -0.17 5.49 -2.24 -1.26 -4.62 114.28 113.58 2axl n THR 96 Ca -0.06 0.00 -0.07 0.00 -2.27 0.00 0.00 64.05 61.65 2axl n THR 96 Cb 0.50 -0.98 0.02 0.00 -2.10 0.00 0.00 70.33 67.77 2axl n THR 96 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 2axl h LYS 97 N 0.00 0.67 -0.40 -0.78 1.79 -1.96 2.23 116.57 118.11 2axl h LYS 97 Ca 0.00 -0.05 -0.04 0.00 -2.18 0.00 0.00 60.65 58.37 2axl h LYS 97 Cb 0.00 -0.14 -0.02 0.00 -1.58 0.00 0.00 32.23 30.49 2axl h LYS 97 CO 0.00 0.48 0.09 1.57 -1.08 0.00 0.00 179.45 180.51 2axl h LYS 98 N 0.67 0.65 0.01 3.15 2.10 -1.94 -1.67 116.57 119.54 2axl h LYS 98 Ca 0.18 -0.16 -0.25 0.00 -2.00 0.00 0.00 60.65 58.42 2axl h LYS 98 Cb -0.03 -0.08 -0.03 0.00 -0.90 0.00 0.00 32.23 31.18 2axl h LYS 98 CO -0.04 0.67 -1.29 0.78 -2.00 0.00 0.00 179.45 177.58 2axl h GLY 99 N 0.51 0.03 0.96 0.07 0.00 -1.66 -2.91 103.07 100.06 2axl h GLY 99 Ca 0.13 -0.07 -0.10 0.00 0.00 0.00 0.00 47.33 47.29 2axl h GLY 99 CO 0.00 0.06 -0.17 -0.09 0.00 0.00 0.00 176.54 176.34 2axl h ARG 100 N 0.01 0.71 -0.72 4.80 2.43 0.37 -0.47 114.38 121.51 2axl h ARG 100 Ca -0.13 -0.31 -0.04 0.00 -0.81 0.00 0.00 59.98 58.69 2axl h ARG 100 Cb 1.88 -0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 31.38 2axl h ARG 100 CO 0.12 0.92 0.31 -0.91 -1.51 0.00 0.00 179.97 178.89 2axl h ASN 101 N 0.48 0.96 0.03 -3.80 2.35 -1.42 1.40 115.58 115.58 2axl h ASN 101 Ca 0.07 -0.13 0.02 0.00 -0.55 0.00 0.00 56.30 55.72 2axl h ASN 101 Cb 0.71 -0.25 -0.04 0.00 0.05 0.00 0.00 38.32 38.80 2axl h ASN 101 CO 0.05 0.84 -0.21 -0.25 -1.65 0.00 0.00 177.43 176.21 2axl h TRP 102 N 1.03 -0.55 -0.30 1.19 7.01 -1.19 0.67 115.95 123.82 2axl h TRP 102 Ca 0.24 0.02 -0.10 0.00 2.11 0.00 0.00 58.89 61.16 2axl h TRP 102 Cb 0.17 0.24 -0.01 0.00 -2.10 0.00 0.00 29.16 27.46 2axl h TRP 102 CO 0.01 -0.29 -0.20 1.25 -2.79 0.00 0.00 178.44 176.42 2axl h LEU 103 N -0.35 0.69 0.00 0.65 5.85 -0.13 -0.54 115.31 121.48 2axl h LEU 103 Ca 0.05 -0.43 0.00 0.00 0.84 0.00 0.00 57.88 58.34 2axl h LEU 103 Cb 0.41 -0.19 0.00 0.00 0.37 0.00 0.00 40.66 41.25 2axl h LEU 103 CO -0.17 0.97 0.00 1.41 -0.34 0.00 0.00 178.44 180.31 2axl n HIS 104 N -4.35 0.00 0.00 1.25 8.25 0.47 -3.97 115.22 116.88 2axl n HIS 104 Ca -0.03 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.43 2axl n HIS 104 Cb 0.41 -0.26 0.00 0.00 1.12 0.00 0.00 29.99 31.26 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 -1.26 0.67 -0.03 -0.41 5.02 0.21 -4.77 118.16 117.58 2axl n LYS 105 Ca 0.13 0.00 0.08 0.00 -2.02 0.00 0.00 58.31 56.50 2axl n LYS 105 Cb 0.20 -0.79 0.41 0.00 -0.02 0.00 0.00 35.03 34.83 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 -1.88 2.56 0.24 7.82 0.00 -0.22 -4.16 120.51 124.87 2axl n ALA 106 Ca 0.00 -0.23 0.09 0.00 0.00 0.00 0.00 53.44 53.30 2axl n ALA 106 Cb 0.29 -1.19 0.49 0.00 0.00 0.00 0.00 19.45 19.04 2axl n ALA 106 CO 0.00 0.00 0.00 -2.95 0.00 0.00 0.00 177.50 174.55 2axl h ASN 107 N 0.69 0.00 0.00 0.00 -1.07 -1.73 -3.24 115.58 110.23 2axl h ASN 107 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 56.30 56.37 2axl h ASN 107 Cb 0.15 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 36.40 2axl h ASN 107 CO 0.00 0.00 0.00 0.35 0.07 0.00 0.00 177.43 177.85 2axl n THR 108 N -2.38 0.00 -3.18 6.14 -2.24 -1.26 -4.90 114.28 106.46 2axl n THR 108 Ca -0.01 0.04 -0.23 0.00 -2.27 0.00 0.00 64.05 61.58 2axl n THR 108 Cb 0.41 -0.17 -0.06 0.00 -2.10 0.00 0.00 70.33 68.40 2axl n THR 108 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2axl n GLU 109 N 0.00 0.64 -3.72 -0.78 1.02 -1.24 -5.06 120.64 111.50 2axl n GLU 109 Ca 0.00 -3.10 -0.28 0.00 -0.02 0.00 0.00 57.16 53.76 2axl n GLU 109 Cb 0.00 -1.29 -0.16 0.00 -0.02 0.00 0.00 31.44 29.97 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 -1.03 3.11 -0.33 1.62 0.01 -1.22 -5.09 113.70 110.77 2axl s SER 110 Ca 0.34 -0.97 0.04 0.00 1.31 0.00 0.00 55.95 56.67 2axl s SER 110 Cb 0.15 -0.61 0.10 0.00 0.21 0.00 0.00 66.02 65.87 2axl s SER 110 CO -0.13 -0.33 0.04 0.00 0.41 0.00 0.00 173.24 173.23 2axl s GLN 111 N 1.84 1.50 -0.17 12.44 0.00 -1.26 -4.91 119.66 129.10 2axl s GLN 111 Ca 0.01 -1.79 -0.07 0.00 -0.00 0.00 0.00 55.36 53.51 2axl s GLN 111 Cb -0.17 -3.11 0.07 0.00 0.00 0.00 0.00 33.01 29.80 2axl s GLN 111 CO -0.13 -0.91 0.38 -1.12 0.00 0.00 0.00 175.29 173.51 2axl s SER 112 N 0.96 -0.21 -0.30 12.60 0.01 -1.26 -4.68 113.70 120.81 2axl s SER 112 Ca 0.09 0.86 -0.13 0.00 1.31 0.00 0.00 55.95 58.08 2axl s SER 112 Cb -0.19 1.00 0.18 0.00 0.21 0.00 0.00 66.02 67.22 2axl s SER 112 CO -0.09 -0.22 1.03 -0.22 0.41 0.00 0.00 173.24 174.16 2axl s LEU 113 N 2.15 -0.50 -0.13 2.44 2.96 -1.26 -4.94 118.68 119.39 2axl s LEU 113 Ca -0.04 0.41 -0.25 0.00 -0.22 0.00 0.00 54.13 54.04 2axl s LEU 113 Cb -0.11 1.46 -0.02 0.00 0.50 0.00 0.00 46.19 48.02 2axl s LEU 113 CO -0.12 -0.09 0.80 -0.63 -1.32 0.00 0.00 176.35 174.99 2axl s ILE 114 N 2.77 4.93 0.45 6.68 1.01 -1.26 -3.55 121.20 132.23 2axl s ILE 114 Ca -0.00 1.60 0.07 0.00 0.00 0.00 0.00 60.65 62.32 2axl s ILE 114 Cb -0.09 -4.12 0.02 0.00 0.01 0.00 0.00 42.46 38.28 2axl s ILE 114 CO -0.13 0.10 0.61 -0.76 0.00 0.00 0.00 174.94 174.76 2axl s LEU 115 N 1.69 3.57 0.29 2.97 1.43 0.23 -4.73 118.68 124.13 2axl s LEU 115 Ca 0.39 -0.41 -0.29 0.00 -1.03 0.00 0.00 54.13 52.78 2axl s LEU 115 Cb -0.17 -2.59 -0.10 0.00 0.03 0.00 0.00 46.19 43.36 2axl s LEU 115 CO 0.15 -0.86 1.28 -1.58 0.23 0.00 0.00 176.35 175.57 2axl s GLN 116 N -4.43 4.41 0.52 1.70 0.74 -1.26 -2.84 119.66 118.49 2axl s GLN 116 Ca 0.56 2.12 -0.20 0.00 0.05 0.00 0.00 55.36 57.88 2axl s GLN 116 Cb -0.10 -3.12 -0.06 0.00 1.10 0.00 0.00 33.01 30.83 2axl s GLN 116 CO 0.34 -0.14 1.13 0.00 -0.55 0.00 0.00 175.29 176.07 2axl s ALA 117 N -0.82 2.78 0.35 1.58 0.00 -0.36 -4.64 121.76 120.66 2axl s ALA 117 Ca 0.50 0.83 -0.26 0.00 0.00 0.00 0.00 51.96 53.04 2axl s ALA 117 Cb -0.38 -3.36 -0.09 0.00 0.00 0.00 0.00 23.12 19.29 2axl s ALA 117 CO 0.47 -0.70 1.02 -0.80 0.00 0.00 0.00 175.76 175.76 2axl s ASN 118 N -1.68 7.05 0.12 0.00 -0.87 -1.26 -4.90 114.94 113.40 2axl s ASN 118 Ca 0.70 2.01 -0.21 0.00 -1.57 0.00 0.00 52.86 53.79 2axl s ASN 118 Cb -0.24 -2.59 -0.06 0.00 -0.02 0.00 0.00 41.25 38.34 2axl s ASN 118 CO 0.28 -0.28 1.71 1.05 -2.57 0.00 0.00 177.10 177.29 2axl h GLU 119 N 2.97 -0.02 -4.86 -0.60 4.11 -1.94 -3.33 114.58 110.91 2axl h GLU 119 Ca -0.47 0.00 -0.70 0.00 0.07 0.00 0.00 59.36 58.26 2axl h GLU 119 Cb 1.21 0.00 -0.19 0.00 0.50 0.00 0.00 28.75 30.27 2axl h GLU 119 CO 0.64 -0.01 0.59 -1.21 0.07 0.00 0.00 179.01 179.09 2axl s GLU 120 N -6.20 3.46 0.13 1.06 2.02 -1.26 -4.82 118.70 113.09 2axl s GLU 120 Ca -0.13 -1.68 0.23 0.00 0.02 0.00 0.00 54.97 53.40 2axl s GLU 120 Cb 0.09 -4.67 0.04 0.00 0.10 0.00 0.00 34.13 29.69 2axl s GLU 120 CO 0.68 -1.68 1.03 1.28 0.02 0.00 0.00 175.26 176.59 2axl n LEU 121 N 6.30 0.68 -2.85 1.80 4.77 -1.25 -4.65 117.00 121.80 2axl n LEU 121 Ca 0.14 0.19 -0.11 0.00 -0.03 0.00 0.00 56.01 56.20 2axl n LEU 121 Cb 0.47 -0.09 0.02 0.00 -2.33 0.00 0.00 43.42 41.50 2axl n LEU 121 CO 0.51 -0.09 0.08 0.00 -1.33 0.00 0.00 177.39 176.56 2axl n PRO 123 N 1.74 0.54 0.00 0.00 -0.04 -1.26 -2.87 135.00 133.11 2axl n PRO 123 Ca 0.13 0.00 0.12 0.00 -0.04 0.00 0.00 63.50 63.70 2axl n PRO 123 Cb 0.60 -1.14 0.15 0.00 -0.04 0.00 0.00 33.50 33.07 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 -0.64 1.26 -0.33 0.54 4.76 -1.26 -4.32 118.16 118.17 2axl n LYS 124 Ca 0.04 -0.96 -0.03 0.00 -2.87 0.00 0.00 58.31 54.49 2axl n LYS 124 Cb 0.02 -1.48 0.02 0.00 -1.84 0.00 0.00 35.03 31.74 2axl n LYS 124 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 2axl n LYS 125 N -0.04 1.16 -2.45 1.97 4.76 -1.14 -4.64 118.16 117.79 2axl n LYS 125 Ca 0.11 -0.34 -0.43 0.00 -2.87 0.00 0.00 58.31 54.78 2axl n LYS 125 Cb 0.44 -1.13 0.01 0.00 -1.84 0.00 0.00 35.03 32.50 2axl n LYS 125 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 2axl n LEU 126 N 0.71 6.58 -4.81 -0.35 4.77 -1.26 -4.99 117.00 117.65 2axl n LEU 126 Ca 0.07 -4.72 -0.33 0.00 -0.03 0.00 0.00 56.01 51.00 2axl n LEU 126 Cb 0.58 -1.45 -0.03 0.00 -2.33 0.00 0.00 43.42 40.18 2axl n LEU 126 CO 0.08 1.40 0.70 -1.48 -1.33 0.00 0.00 177.39 176.75 2axl s LEU 127 N -0.45 3.75 -0.35 2.23 2.34 -1.26 -5.01 118.68 119.92 2axl s LEU 127 Ca 0.38 1.79 -0.18 0.00 0.06 0.00 0.00 54.13 56.18 2axl s LEU 127 Cb 0.09 -4.54 -0.00 0.00 -0.56 0.00 0.00 46.19 41.17 2axl s LEU 127 CO 0.02 -0.74 0.53 -0.76 -1.06 0.00 0.00 176.35 174.34 2axl s LEU 128 N -3.74 4.34 0.22 1.48 1.43 -1.26 -5.03 118.68 116.12 2axl s LEU 128 Ca 0.64 -0.01 -0.31 0.00 -1.03 0.00 0.00 54.13 53.42 2axl s LEU 128 Cb -0.13 -2.61 -0.15 0.00 0.03 0.00 0.00 46.19 43.32 2axl s LEU 128 CO 0.24 -0.50 1.10 -2.65 0.23 0.00 0.00 176.35 174.77 2axl n PRO 129 N 5.79 1.24 -1.63 1.29 -0.02 -1.26 -4.95 135.00 135.45 2axl n PRO 129 Ca -0.04 0.44 -0.31 0.00 -2.02 0.00 0.00 63.50 61.56 2axl n PRO 129 Cb 0.49 -1.88 0.04 0.00 -0.02 0.00 0.00 33.50 32.13 2axl n PRO 129 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 2axl s SER 130 N -0.23 5.45 -0.44 2.55 1.04 -1.26 -4.95 113.70 115.86 2axl s SER 130 Ca 0.67 1.63 -0.29 0.00 0.48 0.00 0.00 55.95 58.45 2axl s SER 130 Cb -0.79 -2.50 0.02 0.00 0.10 0.00 0.00 66.02 62.85 2axl s SER 130 CO 0.55 -1.40 1.27 -0.44 0.98 0.00 0.00 173.24 174.20 2axl s SER 131 N -3.69 6.51 0.15 7.02 0.01 -1.26 -5.00 113.70 117.44 2axl s SER 131 Ca 0.58 0.68 -0.23 0.00 1.31 0.00 0.00 55.95 58.29 2axl s SER 131 Cb -0.14 -2.54 -0.08 0.00 0.21 0.00 0.00 66.02 63.47 2axl s SER 131 CO 0.53 -1.32 0.71 -1.59 0.41 0.00 0.00 173.24 171.99 2axl s LYS 132 N 4.64 4.43 -0.08 12.44 -2.85 -1.26 -5.04 119.74 132.01 2axl s LYS 132 Ca 0.54 1.01 -0.24 0.00 -1.00 0.00 0.00 55.97 56.27 2axl s LYS 132 Cb -0.11 -3.20 -0.03 0.00 -2.06 0.00 0.00 37.83 32.43 2axl s LYS 132 CO 0.31 0.56 0.75 0.99 0.10 0.00 0.00 175.35 178.07 2axl s THR 133 N -1.19 5.00 0.03 3.79 2.01 -1.26 -5.03 115.64 118.98 2axl s THR 133 Ca 0.35 1.54 -0.28 0.00 0.31 0.00 0.00 61.69 63.62 2axl s THR 133 Cb -0.21 -4.09 -0.05 0.00 0.01 0.00 0.00 72.50 68.16 2axl s THR 133 CO 0.24 0.20 0.87 -0.69 -0.69 0.00 0.00 174.62 174.55 2axl s VAL 134 N 1.08 4.76 0.31 3.82 1.01 -1.26 -4.95 120.40 125.18 2axl s VAL 134 Ca 0.39 1.84 0.02 0.00 0.00 0.00 0.00 61.98 64.23 2axl s VAL 134 Cb -0.18 -4.22 0.17 0.00 0.00 0.00 0.00 36.38 32.15 2axl s VAL 134 CO 0.18 0.27 1.87 0.77 0.00 0.00 0.00 175.10 178.19 2axl h SER 135 N 6.15 0.64 -3.32 3.32 4.64 -2.07 -3.44 113.55 119.48 2axl h SER 135 Ca -0.42 -0.10 -0.42 0.00 -0.47 0.00 0.00 61.79 60.37 2axl h SER 135 Cb 1.21 -0.17 0.20 0.00 -0.31 0.00 0.00 62.40 63.34 2axl h SER 135 CO 0.73 0.64 0.02 -0.55 -0.87 0.00 0.00 176.83 176.80 2axl s SER 136 N -6.64 0.58 0.00 4.97 0.15 -1.26 -3.99 113.70 107.51 2axl s SER 136 Ca -0.09 1.11 0.00 0.00 0.70 0.00 0.00 55.95 57.67 2axl s SER 136 Cb 0.16 -1.67 0.00 0.00 -1.71 0.00 0.00 66.02 62.80 2axl s SER 136 CO 0.78 -4.39 0.00 0.61 1.20 0.00 0.00 173.24 171.44 2axl n GLY 137 N 0.37 0.75 3.73 9.45 0.00 -1.26 -5.02 105.19 113.21 2axl n GLY 137 Ca 0.07 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.68 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 -2.54 2.91 -0.30 2.61 2.01 -1.26 -4.98 115.64 114.10 2axl s THR 138 Ca 0.00 0.71 -0.05 0.00 0.31 0.00 0.00 61.69 62.67 2axl s THR 138 Cb 0.00 -3.46 0.19 0.00 0.01 0.00 0.00 72.50 69.24 2axl s THR 138 CO 0.00 0.09 0.77 -0.75 -0.69 0.00 0.00 174.62 174.04 2axl s LYS 139 N 0.24 0.42 -0.18 4.92 2.20 -1.26 -5.02 119.74 121.05 2axl s LYS 139 Ca 0.62 0.67 0.16 0.00 -0.36 0.00 0.00 55.97 57.05 2axl s LYS 139 Cb -0.40 0.36 0.47 0.00 -1.51 0.00 0.00 37.83 36.75 2axl s LYS 139 CO 0.37 -0.52 1.36 0.39 -0.36 0.00 0.00 175.35 176.59 2axl n GLU 140 N 5.42 2.34 0.05 4.03 1.02 -1.26 -4.73 120.64 127.51 2axl n GLU 140 Ca -0.01 -2.84 -0.12 0.00 -0.02 0.00 0.00 57.16 54.17 2axl n GLU 140 Cb 0.53 -1.75 -0.07 0.00 -0.02 0.00 0.00 31.44 30.13 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 1.23 -0.07 -0.36 -0.32 2.76 -1.95 -2.86 115.15 113.57 2axl h HIS 141 Ca 0.03 0.00 -0.16 0.00 -2.20 0.00 0.00 60.37 58.04 2axl h HIS 141 Cb 1.36 0.03 -0.01 0.00 1.55 0.00 0.00 27.41 30.34 2axl h HIS 141 CO 0.45 -0.04 -0.40 0.00 -1.30 0.00 0.00 177.93 176.64 2axl n TYR 143 N -4.05 -3.93 0.00 0.00 4.02 -1.08 -5.29 117.16 106.83 2axl n TYR 143 Ca -0.02 -1.01 0.00 0.00 -0.01 0.00 0.00 57.90 56.86 2axl n TYR 143 Cb 0.55 -0.98 0.00 0.00 -0.02 0.00 0.00 39.34 38.89 2axl n TYR 143 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 176.86 175.94