#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 0.05 7.83 9.92 -1.26 -3.10 116.55 129.99 2axl n ASP 2 Ca 0.00 0.26 -0.10 0.00 -0.53 0.00 0.00 54.79 54.42 2axl n ASP 2 Cb 0.00 -0.41 0.03 0.00 -0.64 0.00 0.00 41.12 40.10 2axl n ASP 2 CO 0.00 0.00 0.00 0.44 0.13 0.00 0.00 177.20 177.77 2axl h ASP 3 N 0.00 0.46 -3.50 -2.24 3.32 -2.05 -3.41 116.42 109.00 2axl h ASP 3 Ca 0.00 -0.30 -0.61 0.00 0.02 0.00 0.00 57.03 56.13 2axl h ASP 3 Cb 0.34 -0.14 -0.12 0.00 0.22 0.00 0.00 39.33 39.64 2axl h ASP 3 CO 0.00 1.04 0.25 -0.55 -1.72 0.00 0.00 179.24 178.26 2axl s SER 4 N -6.97 6.55 0.08 6.45 0.15 -1.18 -5.04 113.70 113.74 2axl s SER 4 Ca -0.05 0.47 -0.12 0.00 0.70 0.00 0.00 55.95 56.95 2axl s SER 4 Cb 0.11 -2.36 -0.06 0.00 -1.71 0.00 0.00 66.02 61.99 2axl s SER 4 CO 0.84 -0.56 0.44 -1.61 1.20 0.00 0.00 173.24 173.55 2axl s GLU 5 N 2.77 3.84 0.00 5.44 8.01 -1.26 -5.02 118.70 132.48 2axl s GLU 5 Ca 0.28 0.29 0.00 0.00 0.01 0.00 0.00 54.97 55.55 2axl s GLU 5 Cb -0.14 -3.02 0.00 0.00 -4.31 0.00 0.00 34.13 26.66 2axl s GLU 5 CO 0.13 0.56 0.00 -0.25 0.01 0.00 0.00 175.26 175.71 2axl n ASP 6 N 1.03 0.00 -4.24 -0.19 8.00 -1.25 -5.00 116.55 114.90 2axl n ASP 6 Ca -0.08 -0.41 -0.26 0.00 0.71 0.00 0.00 54.79 54.74 2axl n ASP 6 Cb 0.52 0.00 -0.15 0.00 -0.02 0.00 0.00 41.12 41.47 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 -0.18 1.68 -0.30 -3.53 -1.32 -1.19 -4.47 115.64 106.33 2axl s THR 7 Ca 0.00 -1.08 -0.04 0.00 -1.21 0.00 0.00 61.69 59.37 2axl s THR 7 Cb 0.00 -1.43 0.19 0.00 -1.51 0.00 0.00 72.50 69.75 2axl s THR 7 CO 0.00 0.32 0.74 -0.44 -2.21 0.00 0.00 174.62 173.04 2axl s SER 8 N -0.89 -1.13 0.00 8.08 0.01 -0.41 0.33 113.70 119.69 2axl s SER 8 Ca 0.08 0.55 0.00 0.00 1.31 0.00 0.00 55.95 57.89 2axl s SER 8 Cb -0.09 1.88 0.00 0.00 0.21 0.00 0.00 66.02 68.03 2axl s SER 8 CO 0.01 -0.21 0.00 -2.67 0.41 0.00 0.00 173.24 170.78 2axl n TRP 9 N 5.42 0.00 -2.75 2.43 4.27 -1.21 -4.74 117.44 120.86 2axl n TRP 9 Ca -0.01 0.00 -0.43 0.00 -3.89 0.00 0.00 57.50 53.17 2axl n TRP 9 Cb 0.53 0.00 -0.03 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 6.53 -0.36 -0.67 -1.08 -1.26 -1.21 116.67 118.63 2axl s ASP 10 Ca 0.00 0.21 0.15 0.00 -0.52 0.00 0.00 52.55 52.38 2axl s ASP 10 Cb 0.00 -2.48 0.43 0.00 -1.46 0.00 0.00 42.92 39.41 2axl s ASP 10 CO 0.00 -1.12 0.93 0.33 0.52 0.00 0.00 175.17 175.83 2axl n PHE 11 N 7.39 1.38 -0.18 -5.34 7.35 -1.24 -4.92 117.46 121.91 2axl n PHE 11 Ca 0.08 -3.09 -0.07 0.00 -0.76 0.00 0.00 57.45 53.60 2axl n PHE 11 Cb 0.49 -0.35 0.02 0.00 0.35 0.00 0.00 39.48 39.98 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 2.94 0.75 0.00 7.13 0.00 -1.89 -3.18 103.07 108.82 2axl h GLY 12 Ca 0.00 -0.32 0.00 0.00 0.00 0.00 0.00 47.33 47.01 2axl h GLY 12 CO 0.56 0.31 0.00 -1.05 0.00 0.00 0.00 176.54 176.36 2axl n PRO 13 N -4.67 0.00 0.27 4.80 -0.02 -1.26 0.28 135.00 134.40 2axl n PRO 13 Ca 0.02 0.56 0.15 0.00 -2.02 0.00 0.00 63.50 62.22 2axl n PRO 13 Cb 0.07 -0.89 0.89 0.00 -0.02 0.00 0.00 33.50 33.54 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 0.24 -0.52 4.20 -1.96 1.51 115.11 118.58 2axl h GLN 14 Ca 0.00 0.00 -0.33 0.00 0.06 0.00 0.00 58.65 58.38 2axl h GLN 14 Cb 0.00 0.00 0.03 0.00 0.30 0.00 0.00 27.48 27.81 2axl h GLN 14 CO 0.00 0.00 -1.49 0.00 -0.67 0.00 0.00 178.83 176.67 2axl h ALA 15 N 1.94 -0.11 -0.07 3.87 0.00 0.40 0.35 119.26 125.64 2axl h ALA 15 Ca 0.02 -0.90 -0.13 0.00 0.00 0.00 0.00 54.91 53.90 2axl h ALA 15 Cb 0.12 0.23 0.01 0.00 0.00 0.00 0.00 17.79 18.15 2axl h ALA 15 CO -0.00 0.73 -0.46 0.74 0.00 0.00 0.00 179.25 180.26 2axl h PHE 16 N 0.11 0.60 -0.01 0.00 0.04 0.33 -2.66 116.94 115.34 2axl h PHE 16 Ca -0.27 -0.27 -0.03 0.00 2.80 0.00 0.00 57.97 60.20 2axl h PHE 16 Cb 2.13 -0.09 -0.00 0.00 2.20 0.00 0.00 35.95 40.19 2axl h PHE 16 CO 0.13 1.05 -0.13 0.87 -0.60 0.00 0.00 178.31 179.62 2axl h LYS 17 N -0.02 0.02 -0.64 1.51 1.57 0.21 -1.06 116.57 118.16 2axl h LYS 17 Ca -0.04 -0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.73 2axl h LYS 17 Cb 1.12 -0.00 -0.03 0.00 0.08 0.00 0.00 32.23 33.39 2axl h LYS 17 CO 0.09 0.15 0.37 1.25 -0.57 0.00 0.00 179.45 180.74 2axl h LEU 18 N 0.02 0.78 -0.42 2.94 6.46 0.05 -2.47 115.31 122.66 2axl h LEU 18 Ca 0.00 -0.08 0.04 0.00 -0.12 0.00 0.00 57.88 57.73 2axl h LEU 18 Cb 0.25 -0.20 -0.04 0.00 -0.73 0.00 0.00 40.66 39.94 2axl h LEU 18 CO 0.02 0.63 0.18 -0.07 -0.62 0.00 0.00 178.44 178.58 2axl h LEU 19 N 0.86 0.23 -0.86 2.25 3.38 -0.98 -2.21 115.31 117.99 2axl h LEU 19 Ca 0.23 0.04 -0.12 0.00 0.09 0.00 0.00 57.88 58.11 2axl h LEU 19 Cb 0.01 -0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 2axl h LEU 19 CO -0.04 0.17 -0.45 -1.28 0.09 0.00 0.00 178.44 176.93 2axl h SER 20 N 0.37 0.27 -0.10 -0.43 0.87 -1.30 -2.78 113.55 110.45 2axl h SER 20 Ca 0.19 -0.12 -0.02 0.00 -1.23 0.00 0.00 61.79 60.61 2axl h SER 20 Cb 0.14 -0.08 -0.00 0.00 -0.44 0.00 0.00 62.40 62.02 2axl h SER 20 CO -0.16 0.69 -0.01 0.00 -0.53 0.00 0.00 176.83 176.82 2axl h ALA 21 N 1.32 0.14 -0.80 6.23 0.00 -1.05 0.23 119.26 125.32 2axl h ALA 21 Ca 0.01 -0.19 0.03 0.00 0.00 0.00 0.00 54.91 54.76 2axl h ALA 21 Cb 0.89 -0.04 -0.05 0.00 0.00 0.00 0.00 17.79 18.59 2axl h ALA 21 CO 0.07 -0.16 0.52 -0.39 0.00 0.00 0.00 179.25 179.29 2axl h VAL 22 N -0.11 1.14 -0.69 0.00 -1.51 -1.45 -0.44 116.25 113.19 2axl h VAL 22 Ca 0.03 -0.35 -0.01 0.00 -1.23 0.00 0.00 66.70 65.14 2axl h VAL 22 Cb 0.38 0.04 -0.03 0.00 -2.13 0.00 0.00 31.29 29.54 2axl h VAL 22 CO 0.01 0.19 0.39 -0.78 -1.23 0.00 0.00 177.57 176.15 2axl h ASP 23 N 1.02 0.85 -0.83 4.19 3.58 -1.31 -1.23 116.42 122.68 2axl h ASP 23 Ca 0.32 -0.08 0.00 0.00 0.42 0.00 0.00 57.03 57.68 2axl h ASP 23 Cb -0.02 -0.22 -0.04 0.00 1.72 0.00 0.00 39.33 40.78 2axl h ASP 23 CO -0.10 0.69 0.53 0.40 -2.88 0.00 0.00 179.24 177.87 2axl h ILE 24 N 0.95 1.22 0.00 2.25 1.08 0.98 0.83 117.51 124.82 2axl h ILE 24 Ca 0.25 -0.45 0.00 0.00 -0.39 0.00 0.00 64.86 64.26 2axl h ILE 24 Cb 0.01 0.03 0.00 0.00 -3.07 0.00 0.00 36.82 33.79 2axl h ILE 24 CO -0.04 0.23 0.00 0.18 -0.69 0.00 0.00 178.15 177.82 2axl n LEU 25 N -4.47 0.00 -1.64 1.44 4.77 -0.34 -4.77 117.00 111.99 2axl n LEU 25 Ca 0.09 0.10 -0.20 0.00 -0.03 0.00 0.00 56.01 55.97 2axl n LEU 25 Cb 0.04 -0.10 -0.08 0.00 -2.33 0.00 0.00 43.42 40.94 2axl n LEU 25 CO 0.37 -0.07 -0.19 0.61 -1.33 0.00 0.00 177.39 176.78 2axl n GLY 26 N -0.31 1.72 4.14 -0.72 0.00 0.29 -3.17 105.19 107.14 2axl n GLY 26 Ca 0.07 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.81 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 -2.36 -2.10 -1.16 1.61 1.02 -0.56 -4.86 120.64 112.23 2axl n GLU 27 Ca -0.20 0.25 -0.19 0.00 -0.02 0.00 0.00 57.16 57.00 2axl n GLU 27 Cb 0.65 -4.04 0.16 0.00 -0.02 0.00 0.00 31.44 28.19 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 -4.50 2.27 -3.91 3.49 4.76 -1.19 -4.93 118.16 114.15 2axl n LYS 28 Ca -0.32 -3.21 -0.08 0.00 -2.87 0.00 0.00 58.31 51.82 2axl n LYS 28 Cb 0.69 -2.07 -0.04 0.00 -1.84 0.00 0.00 35.03 31.77 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 -3.39 0.10 0.00 2.13 0.40 -1.26 -5.10 117.98 110.85 2axl s PHE 29 Ca 0.53 -0.49 0.00 0.00 -0.60 0.00 0.00 56.93 56.38 2axl s PHE 29 Cb 0.45 0.40 0.00 0.00 0.51 0.00 0.00 43.02 44.38 2axl s PHE 29 CO 0.04 -1.06 0.00 0.41 0.70 0.00 0.00 175.22 175.31 2axl n GLY 30 N -0.40 -0.77 0.23 4.36 0.00 -1.26 -3.98 105.19 103.37 2axl n GLY 30 Ca -0.04 -1.67 0.08 0.00 0.00 0.00 0.00 46.02 44.39 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 -0.41 0.93 -0.77 -0.61 2.10 -1.68 -3.24 117.51 113.82 2axl h ILE 31 Ca 0.00 -0.66 0.07 0.00 1.08 0.00 0.00 64.86 65.35 2axl h ILE 31 Cb 0.00 1.38 -0.06 0.00 -1.09 0.00 0.00 36.82 37.04 2axl h ILE 31 CO 0.00 0.18 0.45 1.23 -1.08 0.00 0.00 178.15 178.93 2axl h GLY 32 N 0.71 1.16 0.52 8.18 0.00 -1.92 -1.91 103.07 109.81 2axl h GLY 32 Ca -0.00 -0.32 -0.01 0.00 0.00 0.00 0.00 47.33 47.00 2axl h GLY 32 CO 0.02 0.20 -0.07 -2.00 0.00 0.00 0.00 176.54 174.69 2axl h LEU 33 N 0.82 -0.17 -0.97 3.11 5.85 -1.92 -3.17 115.31 118.86 2axl h LEU 33 Ca 0.35 -0.34 -0.08 0.00 0.84 0.00 0.00 57.88 58.65 2axl h LEU 33 Cb 0.21 0.04 -0.02 0.00 0.37 0.00 0.00 40.66 41.27 2axl h LEU 33 CO -0.19 0.29 -0.10 1.55 -0.34 0.00 0.00 178.44 179.65 2axl h PRO 34 N -0.69 0.63 0.09 5.25 0.13 -1.72 0.66 132.00 136.36 2axl h PRO 34 Ca -0.02 -0.19 -0.00 0.00 -0.87 0.00 0.00 66.00 64.92 2axl h PRO 34 Cb 0.50 -0.06 0.00 0.00 0.13 0.00 0.00 31.00 31.57 2axl h PRO 34 CO 0.03 0.72 -0.04 0.97 -0.23 0.00 0.00 178.00 179.45 2axl h ILE 35 N 0.58 0.98 -0.45 -3.56 2.10 -1.45 -0.95 117.51 114.76 2axl h ILE 35 Ca 0.11 -0.25 -0.03 0.00 1.08 0.00 0.00 64.86 65.77 2axl h ILE 35 Cb 0.52 1.15 -0.02 0.00 -1.09 0.00 0.00 36.82 37.38 2axl h ILE 35 CO 0.03 0.06 0.18 -0.07 -1.08 0.00 0.00 178.15 177.27 2axl h LEU 36 N -0.23 0.62 -0.42 2.19 3.38 -1.51 -3.19 115.31 116.15 2axl h LEU 36 Ca -0.01 -0.17 -0.06 0.00 0.09 0.00 0.00 57.88 57.73 2axl h LEU 36 Cb 0.20 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.77 2axl h LEU 36 CO 0.02 0.62 0.04 0.15 0.09 0.00 0.00 178.44 179.37 2axl h PHE 37 N 0.59 0.76 -0.77 1.13 3.04 -0.63 -2.80 116.94 118.25 2axl h PHE 37 Ca 0.15 -0.12 -0.05 0.00 3.98 0.00 0.00 57.97 61.93 2axl h PHE 37 Cb 0.20 -0.20 -0.03 0.00 2.56 0.00 0.00 35.95 38.47 2axl h PHE 37 CO 0.00 0.75 0.27 -0.07 -2.02 0.00 0.00 178.31 177.24 2axl h LEU 38 N 0.55 1.10 -0.65 0.59 3.38 -1.18 -2.83 115.31 116.26 2axl h LEU 38 Ca 0.12 -0.20 0.00 0.00 0.09 0.00 0.00 57.88 57.90 2axl h LEU 38 Cb 0.42 -0.29 0.00 0.00 0.09 0.00 0.00 40.66 40.88 2axl h LEU 38 CO 0.01 1.00 0.00 0.54 0.09 0.00 0.00 178.44 180.08 2axl n ARG 39 N -4.26 0.21 -2.11 1.13 1.74 -1.07 -1.98 116.66 110.33 2axl n ARG 39 Ca 0.06 0.00 -0.02 0.00 -0.77 0.00 0.00 57.85 57.12 2axl n ARG 39 Cb 0.21 -1.07 0.01 0.00 -1.02 0.00 0.00 32.46 30.59 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 0.16 -0.33 3.75 -0.13 0.00 -1.07 -4.50 105.19 103.07 2axl n GLY 40 Ca 0.00 0.05 -0.35 0.00 0.00 0.00 0.00 46.02 45.71 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 -2.68 4.91 -0.20 1.61 1.04 -1.13 -4.95 113.70 112.29 2axl s SER 41 Ca 0.07 2.37 -0.09 0.00 0.48 0.00 0.00 55.95 58.78 2axl s SER 41 Cb -0.01 -2.59 -0.05 0.00 0.10 0.00 0.00 66.02 63.47 2axl s SER 41 CO 0.28 -1.78 0.10 0.21 0.98 0.00 0.00 173.24 173.03 2axl s ASN 42 N -1.77 5.93 -0.30 7.02 3.84 -1.26 -4.98 114.94 123.42 2axl s ASN 42 Ca 0.76 0.15 -0.11 0.00 0.21 0.00 0.00 52.86 53.87 2axl s ASN 42 Cb -0.30 -2.03 0.18 0.00 -0.55 0.00 0.00 41.25 38.55 2axl s ASN 42 CO 0.37 0.16 0.97 -0.55 -2.79 0.00 0.00 177.10 175.26 2axl s SER 43 N 0.46 -0.63 0.00 -4.21 0.15 -1.26 -5.04 113.70 103.16 2axl s SER 43 Ca 0.06 0.40 0.00 0.00 0.70 0.00 0.00 55.95 57.11 2axl s SER 43 Cb -0.12 1.53 0.00 0.00 -1.71 0.00 0.00 66.02 65.72 2axl s SER 43 CO -0.00 -0.12 0.64 1.67 1.20 0.00 0.00 173.24 176.63 2axl n GLN 44 N 5.46 0.00 -0.32 5.44 -0.06 -1.26 0.26 117.38 126.90 2axl n GLN 44 Ca -0.06 0.56 0.09 0.00 -2.00 0.00 0.00 57.00 55.59 2axl n GLN 44 Cb 0.53 -1.14 0.20 0.00 -4.06 0.00 0.00 30.24 25.77 2axl n GLN 44 CO 0.00 0.00 0.00 -0.09 -0.20 0.00 0.00 177.06 176.77 2axl h ARG 45 N 0.00 0.02 0.00 3.69 2.43 -2.03 2.54 114.38 121.03 2axl h ARG 45 Ca 0.00 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 2axl h ARG 45 Cb 0.00 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.54 2axl h ARG 45 CO 0.00 0.02 0.00 1.28 -1.51 0.00 0.00 179.97 179.76 2axl n LEU 46 N -5.50 0.00 -0.10 3.80 4.77 -0.81 -3.37 117.00 115.78 2axl n LEU 46 Ca 0.18 0.23 -0.05 0.00 -0.03 0.00 0.00 56.01 56.34 2axl n LEU 46 Cb 0.59 -0.23 0.15 0.00 -2.33 0.00 0.00 43.42 41.59 2axl n LEU 46 CO -0.05 -0.01 0.84 0.00 -1.33 0.00 0.00 177.39 176.84 2axl h ALA 47 N 3.48 1.05 0.00 -1.18 0.00 1.98 -2.64 119.26 121.95 2axl h ALA 47 Ca 0.00 -0.29 -0.15 0.00 0.00 0.00 0.00 54.91 54.47 2axl h ALA 47 Cb 0.22 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 2axl h ALA 47 CO 0.00 0.58 -1.47 -0.25 0.00 0.00 0.00 179.25 178.11 2axl n ASP 48 N -4.19 0.74 0.18 0.00 9.92 -1.22 -3.95 116.55 118.03 2axl n ASP 48 Ca 0.02 0.32 0.03 0.00 -0.53 0.00 0.00 54.79 54.63 2axl n ASP 48 Cb 0.33 0.39 0.40 0.00 -0.64 0.00 0.00 41.12 41.60 2axl n ASP 48 CO 0.00 0.00 0.00 1.56 0.13 0.00 0.00 177.20 178.89 2axl h GLN 49 N 0.00 0.05 -1.22 -1.24 4.20 -1.58 -2.81 115.11 112.51 2axl h GLN 49 Ca -0.16 -0.01 0.36 0.00 0.06 0.00 0.00 58.65 58.90 2axl h GLN 49 Cb 1.52 -0.00 -0.10 0.00 0.30 0.00 0.00 27.48 29.19 2axl h GLN 49 CO 0.04 0.33 0.80 1.88 -0.67 0.00 0.00 178.83 181.20 2axl h TYR 50 N 0.04 0.49 -0.73 2.96 0.05 -1.60 -2.65 116.97 115.54 2axl h TYR 50 Ca 0.01 0.02 0.12 0.00 0.05 0.00 0.00 58.73 58.93 2axl h TYR 50 Cb 0.52 -0.13 -0.12 0.00 1.01 0.00 0.00 36.73 38.01 2axl h TYR 50 CO 0.00 -0.06 -0.26 2.89 -1.05 0.00 0.00 178.16 179.68 2axl n ARG 51 N -4.57 -0.14 -0.07 4.88 1.85 -1.06 0.59 116.66 118.14 2axl n ARG 51 Ca 0.31 1.12 -0.15 0.00 -1.00 0.00 0.00 57.85 58.14 2axl n ARG 51 Cb 1.21 -1.67 -0.05 0.00 -1.05 0.00 0.00 32.46 30.89 2axl n ARG 51 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2axl h ARG 52 N 0.00 0.75 -5.89 2.89 2.47 -1.75 -3.40 114.38 109.45 2axl h ARG 52 Ca 0.28 -0.48 -0.41 0.00 -1.26 0.00 0.00 59.98 58.11 2axl h ARG 52 Cb 0.46 0.06 -0.06 0.00 -1.65 0.00 0.00 29.97 28.78 2axl h ARG 52 CO -0.73 1.10 1.03 -1.58 0.56 0.00 0.00 179.97 180.35 2axl s HIS 53 N -4.09 1.93 0.14 3.04 2.46 0.20 -4.83 115.29 114.14 2axl s HIS 53 Ca -0.12 0.37 -0.11 0.00 0.47 0.00 0.00 55.06 55.67 2axl s HIS 53 Cb 0.09 -4.21 -0.02 0.00 -0.13 0.00 0.00 32.58 28.31 2axl s HIS 53 CO 0.86 -1.93 1.52 1.03 -2.47 0.00 0.00 174.74 173.74 2axl h SER 54 N 11.81 0.95 0.00 9.88 0.87 -1.78 -2.93 113.55 132.35 2axl h SER 54 Ca 0.00 -0.41 0.00 0.00 -1.23 0.00 0.00 61.79 60.15 2axl h SER 54 Cb 1.05 -0.26 0.00 0.00 -0.44 0.00 0.00 62.40 62.74 2axl h SER 54 CO 1.25 1.15 0.00 0.18 -0.53 0.00 0.00 176.83 178.89 2axl n LEU 55 N -4.16 0.21 -4.71 2.23 4.77 -1.26 -4.72 117.00 109.36 2axl n LEU 55 Ca -0.01 0.60 -0.43 0.00 -0.03 0.00 0.00 56.01 56.14 2axl n LEU 55 Cb 0.46 -0.62 -0.01 0.00 -2.33 0.00 0.00 43.42 40.91 2axl n LEU 55 CO 0.46 -0.67 1.03 0.33 -1.33 0.00 0.00 177.39 177.21 2axl n PHE 56 N -1.78 2.43 -1.23 -1.77 7.35 -1.11 -2.91 117.46 118.44 2axl n PHE 56 Ca -0.01 0.44 -0.08 0.00 -0.76 0.00 0.00 57.45 57.05 2axl n PHE 56 Cb 0.01 -2.48 -0.03 0.00 0.35 0.00 0.00 39.48 37.33 2axl n PHE 56 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 2axl n GLY 57 N 1.46 1.00 0.04 7.13 0.00 -0.84 -4.87 105.19 109.11 2axl n GLY 57 Ca 0.07 -0.65 0.11 0.00 0.00 0.00 0.00 46.02 45.56 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 -2.76 0.19 1.93 2.61 -1.04 -1.15 -3.42 114.28 110.65 2axl n THR 58 Ca -0.08 -0.27 0.10 0.00 -2.04 0.00 0.00 64.05 61.75 2axl n THR 58 Cb 0.27 0.17 0.57 0.00 -1.82 0.00 0.00 70.33 69.51 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 1.35 -0.96 0.32 3.41 0.00 -1.15 -3.67 105.19 104.49 2axl n GLY 59 Ca 0.02 -0.12 -0.02 0.00 0.00 0.00 0.00 46.02 45.89 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 0.94 0.00 1.61 3.64 -1.65 -2.30 116.57 118.81 2axl h LYS 60 Ca 0.00 -0.14 0.00 0.00 -1.27 0.00 0.00 60.65 59.24 2axl h LYS 60 Cb 0.00 -0.17 0.00 0.00 -0.41 0.00 0.00 32.23 31.65 2axl h LYS 60 CO 0.00 0.75 0.00 -0.40 -2.27 0.00 0.00 179.45 177.53 2axl n ASP 61 N -4.32 0.00 -4.80 4.20 5.75 -1.24 -4.78 116.55 111.36 2axl n ASP 61 Ca 0.06 0.20 -0.35 0.00 -0.01 0.00 0.00 54.79 54.68 2axl n ASP 61 Cb 0.16 -0.38 -0.07 0.00 -1.03 0.00 0.00 41.12 39.79 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 -2.77 3.22 1.01 0.11 -0.21 -0.86 -5.09 119.66 115.06 2axl s GLN 62 Ca 0.18 -0.31 -0.12 0.00 0.02 0.00 0.00 55.36 55.12 2axl s GLN 62 Cb 0.16 -2.99 0.20 0.00 1.00 0.00 0.00 33.01 31.38 2axl s GLN 62 CO 0.40 0.72 1.09 0.95 -2.12 0.00 0.00 175.29 176.33 2axl s THR 63 N -1.05 2.04 0.09 -0.19 -4.23 -1.26 -4.94 115.64 106.11 2axl s THR 63 Ca 0.17 0.01 -0.20 0.00 -1.18 0.00 0.00 61.69 60.49 2axl s THR 63 Cb -0.12 -2.49 -0.09 0.00 1.34 0.00 0.00 72.50 71.14 2axl s THR 63 CO 0.07 -0.02 1.64 -0.08 -0.54 0.00 0.00 174.62 175.69 2axl h GLU 64 N -1.95 0.26 0.00 3.99 4.57 -1.98 -3.11 114.58 116.36 2axl h GLU 64 Ca -0.55 -0.04 -0.03 0.00 -1.18 0.00 0.00 59.36 57.56 2axl h GLU 64 Cb 1.33 -0.04 -0.00 0.00 -0.16 0.00 0.00 28.75 29.87 2axl h GLU 64 CO 0.57 0.32 -0.12 0.66 -1.18 0.00 0.00 179.01 179.26 2axl h SER 65 N 0.14 0.00 -0.16 1.04 4.64 -1.98 -2.05 113.55 115.18 2axl h SER 65 Ca 0.06 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.36 2axl h SER 65 Cb 0.15 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.24 2axl h SER 65 CO -0.01 0.12 0.01 -0.25 -0.87 0.00 0.00 176.83 175.83 2axl h TRP 66 N 0.00 0.30 -0.39 4.77 2.91 -1.91 0.71 115.95 122.35 2axl h TRP 66 Ca -0.00 -0.05 -0.01 0.00 1.13 0.00 0.00 58.89 59.96 2axl h TRP 66 Cb 0.67 -0.08 -0.02 0.00 -0.51 0.00 0.00 29.16 29.23 2axl h TRP 66 CO 0.00 0.48 0.19 -1.49 -1.03 0.00 0.00 178.44 176.59 2axl h TRP 67 N 0.04 0.56 -0.06 2.65 4.06 -1.54 2.49 115.95 124.16 2axl h TRP 67 Ca 0.05 -0.02 0.02 0.00 2.06 0.00 0.00 58.89 60.99 2axl h TRP 67 Cb 0.36 -0.17 -0.05 0.00 -1.00 0.00 0.00 29.16 28.29 2axl h TRP 67 CO 0.03 0.46 -0.43 -0.22 -3.56 0.00 0.00 178.44 174.72 2axl h LYS 68 N 0.49 -0.48 -0.85 0.49 1.63 -0.60 0.57 116.57 117.82 2axl h LYS 68 Ca 0.13 0.03 -0.00 0.00 -0.85 0.00 0.00 60.65 59.96 2axl h LYS 68 Cb 0.11 0.11 -0.04 0.00 -0.60 0.00 0.00 32.23 31.81 2axl h LYS 68 CO -0.02 -0.32 0.52 0.00 -3.45 0.00 0.00 179.45 176.18 2axl h ALA 69 N -0.58 1.31 -0.41 5.00 0.00 0.86 -2.46 119.26 122.97 2axl h ALA 69 Ca 0.02 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 2axl h ALA 69 Cb 0.56 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 2axl h ALA 69 CO -0.32 0.60 0.22 0.35 0.00 0.00 0.00 179.25 180.10 2axl h PHE 70 N 1.17 0.56 -0.95 0.00 3.57 0.62 -2.23 116.94 119.69 2axl h PHE 70 Ca 0.31 -0.01 0.05 0.00 3.53 0.00 0.00 57.97 61.84 2axl h PHE 70 Cb -0.06 -0.18 -0.06 0.00 2.79 0.00 0.00 35.95 38.44 2axl h PHE 70 CO 0.00 0.43 0.61 0.77 -2.23 0.00 0.00 178.31 177.90 2axl h SER 71 N 0.53 1.00 -0.69 0.41 0.02 0.41 -2.05 113.55 113.17 2axl h SER 71 Ca 0.14 0.00 0.02 0.00 -0.84 0.00 0.00 61.79 61.12 2axl h SER 71 Cb 0.06 -0.21 -0.04 0.00 0.14 0.00 0.00 62.40 62.34 2axl h SER 71 CO -0.02 0.66 0.44 -0.09 -1.14 0.00 0.00 176.83 176.68 2axl h ARG 72 N 1.15 0.85 -0.56 3.45 2.43 -0.97 -2.68 114.38 118.05 2axl h ARG 72 Ca 0.40 -0.05 0.10 0.00 -0.81 0.00 0.00 59.98 59.61 2axl h ARG 72 Cb 0.09 -0.19 -0.08 0.00 -0.42 0.00 0.00 29.97 29.37 2axl h ARG 72 CO -0.15 0.56 0.13 1.96 -1.51 0.00 0.00 179.97 180.96 2axl h GLN 73 N 0.88 0.26 -0.47 0.20 4.20 -0.86 -2.42 115.11 116.90 2axl h GLN 73 Ca 0.27 -0.02 -0.07 0.00 0.06 0.00 0.00 58.65 58.90 2axl h GLN 73 Cb -0.02 -0.06 -0.02 0.00 0.30 0.00 0.00 27.48 27.68 2axl h GLN 73 CO -0.09 0.17 0.01 -0.07 -0.67 0.00 0.00 178.83 178.18 2axl h LEU 74 N 0.27 0.72 -0.33 1.46 3.38 -1.42 -3.16 115.31 116.23 2axl h LEU 74 Ca 0.29 -0.17 0.02 0.00 0.09 0.00 0.00 57.88 58.11 2axl h LEU 74 Cb 0.40 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.94 2axl h LEU 74 CO -0.36 0.78 0.18 0.40 0.09 0.00 0.00 178.44 179.54 2axl h ILE 75 N 0.71 1.02 -0.61 1.22 2.04 -1.27 -2.74 117.51 117.89 2axl h ILE 75 Ca 0.14 -0.13 -0.06 0.00 1.00 0.00 0.00 64.86 65.81 2axl h ILE 75 Cb 0.42 0.61 -0.02 0.00 -0.74 0.00 0.00 36.82 37.09 2axl h ILE 75 CO 0.02 0.07 0.13 0.74 0.00 0.00 0.00 178.15 179.10 2axl h THR 76 N 0.38 1.25 0.00 -0.27 2.02 -1.54 -2.84 112.91 111.91 2axl h THR 76 Ca 0.13 -0.94 -0.01 0.00 0.77 0.00 0.00 66.41 66.35 2axl h THR 76 Cb 0.01 0.70 -0.00 0.00 -1.74 0.00 0.00 68.15 67.12 2axl h THR 76 CO -0.07 0.35 -0.06 -0.33 0.37 0.00 0.00 175.52 175.78 2axl h GLU 77 N 0.89 0.00 0.00 6.66 5.08 -1.50 -3.45 114.58 122.26 2axl h GLU 77 Ca 0.19 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.55 2axl h GLU 77 Cb 0.38 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.63 2axl h GLU 77 CO 0.01 0.06 0.00 0.41 -1.00 0.00 0.00 179.01 178.48 2axl n GLY 78 N -1.04 0.74 0.34 -3.84 0.00 -1.07 -4.24 105.19 96.07 2axl n GLY 78 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.00 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 0.89 -3.93 1.61 -1.00 -1.73 -3.44 116.94 109.34 2axl h PHE 79 Ca 0.00 -0.00 -0.32 0.00 2.81 0.00 0.00 57.97 60.46 2axl h PHE 79 Cb 0.00 -0.29 -0.21 0.00 3.61 0.00 0.00 35.95 39.06 2axl h PHE 79 CO 0.00 0.60 -0.75 -1.17 -1.61 0.00 0.00 178.31 175.38 2axl s LEU 80 N -9.71 2.29 0.09 1.54 2.96 -1.08 -4.53 118.68 110.24 2axl s LEU 80 Ca -0.10 -0.61 0.05 0.00 -0.22 0.00 0.00 54.13 53.24 2axl s LEU 80 Cb 0.17 -0.28 -0.03 0.00 0.50 0.00 0.00 46.19 46.55 2axl s LEU 80 CO 0.78 -0.18 -0.13 0.54 -1.32 0.00 0.00 176.35 176.04 2axl s VAL 81 N -1.54 1.10 -0.04 1.68 0.11 -1.19 -4.28 120.40 116.24 2axl s VAL 81 Ca -0.05 -1.48 0.06 0.00 -2.93 0.00 0.00 61.98 57.58 2axl s VAL 81 Cb -0.09 -1.24 -0.01 0.00 -1.53 0.00 0.00 36.38 33.51 2axl s VAL 81 CO 0.01 -0.36 -0.22 -1.61 -3.33 0.00 0.00 175.10 169.58 2axl s GLU 82 N -2.22 2.10 -0.18 1.54 2.02 -1.26 -2.00 118.70 118.69 2axl s GLU 82 Ca 0.02 -0.80 -0.03 0.00 0.02 0.00 0.00 54.97 54.18 2axl s GLU 82 Cb -0.07 -1.87 -0.02 0.00 0.10 0.00 0.00 34.13 32.27 2axl s GLU 82 CO 0.02 0.39 -0.06 0.08 0.02 0.00 0.00 175.26 175.71 2axl s VAL 83 N -0.26 3.49 -0.70 2.63 1.01 -1.04 -4.95 120.40 120.59 2axl s VAL 83 Ca 0.01 -0.48 0.25 0.00 0.00 0.00 0.00 61.98 61.76 2axl s VAL 83 Cb -0.11 -2.54 0.11 0.00 0.00 0.00 0.00 36.38 33.83 2axl s VAL 83 CO 0.02 0.47 1.45 -0.24 0.00 0.00 0.00 175.10 176.79 2axl n SER 84 N 4.11 0.69 -0.41 3.32 2.88 -1.26 -2.09 113.62 120.85 2axl n SER 84 Ca -0.18 0.21 0.04 0.00 -1.33 0.00 0.00 58.87 57.62 2axl n SER 84 Cb 0.52 -0.07 0.14 0.00 -0.75 0.00 0.00 64.21 64.05 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 -2.09 1.52 -3.69 -1.46 1.74 -1.26 -4.66 116.66 106.77 2axl n ARG 85 Ca 0.04 -0.81 -0.23 0.00 -0.77 0.00 0.00 57.85 56.08 2axl n ARG 85 Cb 0.43 -1.20 -0.17 0.00 -1.02 0.00 0.00 32.46 30.49 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 -1.71 0.39 0.00 -1.55 1.51 -1.23 -4.98 117.35 109.78 2axl s TYR 86 Ca 0.17 -0.16 0.00 0.00 -1.01 0.00 0.00 57.07 56.07 2axl s TYR 86 Cb 0.09 -0.70 0.00 0.00 -0.11 0.00 0.00 41.96 41.24 2axl s TYR 86 CO 0.12 -0.37 0.00 0.09 -1.11 0.00 0.00 175.55 174.28 2axl n ASN 87 N 5.22 -1.26 0.00 2.29 5.03 -1.26 0.23 115.26 125.51 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 -0.63 0.19 0.00 -1.02 0.00 0.00 39.78 38.81 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 0.09 0.13 0.00 3.52 5.02 -1.26 -2.65 118.16 123.01 2axl n LYS 88 Ca 0.00 0.17 0.00 0.00 -2.02 0.00 0.00 58.31 56.46 2axl n LYS 88 Cb 0.00 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.51 2axl n LYS 88 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 2axl n PHE 89 N -1.23 0.00 -3.23 2.13 3.72 -1.26 -4.92 117.46 112.67 2axl n PHE 89 Ca 0.04 0.00 -0.04 0.00 -0.05 0.00 0.00 57.45 57.40 2axl n PHE 89 Cb 0.05 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.56 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 -0.26 0.79 0.00 -1.08 -1.94 -1.09 -5.03 119.30 110.69 2axl s MET 90 Ca 0.00 -0.48 0.00 0.00 -1.71 0.00 0.00 55.69 53.50 2axl s MET 90 Cb 0.00 -0.13 0.00 0.00 2.01 0.00 0.00 34.83 36.71 2axl s MET 90 CO 0.00 -1.20 0.00 1.63 -0.01 0.00 0.00 175.02 175.44 2axl n LYS 91 N 4.28 -0.12 -1.54 2.03 4.01 -1.23 -2.38 118.16 123.20 2axl n LYS 91 Ca 0.12 0.27 -0.55 0.00 -0.51 0.00 0.00 58.31 57.64 2axl n LYS 91 Cb 0.54 -0.32 -0.07 0.00 -0.51 0.00 0.00 35.03 34.67 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 0.85 0.07 -2.27 -0.18 0.00 0.14 -4.43 119.36 113.53 2axl n ILE 92 Ca 0.00 -0.02 -0.43 0.00 0.00 0.00 0.00 62.75 62.31 2axl n ILE 92 Cb 0.15 -0.41 -0.02 0.00 0.00 0.00 0.00 39.64 39.35 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 3.61 2.50 0.55 0.00 0.00 -0.85 -4.93 121.76 122.65 2axl s ALA 94 Ca 0.62 -1.00 -0.15 0.00 0.00 0.00 0.00 51.96 51.43 2axl s ALA 94 Cb -0.26 -0.89 -0.06 0.00 0.00 0.00 0.00 23.12 21.91 2axl s ALA 94 CO 0.21 0.49 1.00 -0.51 0.00 0.00 0.00 175.76 176.95 2axl s LEU 95 N -0.50 3.49 0.23 0.00 1.43 -1.26 -3.18 118.68 118.89 2axl s LEU 95 Ca 0.06 1.54 0.05 0.00 -1.03 0.00 0.00 54.13 54.75 2axl s LEU 95 Cb -0.12 -4.50 -0.05 0.00 0.03 0.00 0.00 46.19 41.55 2axl s LEU 95 CO 0.01 -0.72 -0.04 0.42 0.23 0.00 0.00 176.35 176.25 2axl s THR 96 N -2.79 1.27 0.57 5.49 -4.23 -1.26 -4.92 115.64 109.78 2axl s THR 96 Ca 0.58 -2.07 0.15 0.00 -1.18 0.00 0.00 61.69 59.16 2axl s THR 96 Cb -0.11 -2.29 0.15 0.00 1.34 0.00 0.00 72.50 71.58 2axl s THR 96 CO 0.39 -0.39 1.41 0.11 -0.54 0.00 0.00 174.62 175.61 2axl h LYS 97 N 2.46 0.00 -0.10 3.99 1.79 -1.96 0.16 116.57 122.91 2axl h LYS 97 Ca -0.39 0.00 -0.00 0.00 -2.18 0.00 0.00 60.65 58.08 2axl h LYS 97 Cb 1.22 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 31.87 2axl h LYS 97 CO 0.65 0.00 0.05 0.87 -1.08 0.00 0.00 179.45 179.94 2axl h LYS 98 N 0.00 0.14 0.00 3.15 1.79 -1.90 -3.10 116.57 116.65 2axl h LYS 98 Ca 0.00 -0.02 -0.02 0.00 -2.18 0.00 0.00 60.65 58.43 2axl h LYS 98 Cb 1.23 -0.03 -0.00 0.00 -1.58 0.00 0.00 32.23 31.85 2axl h LYS 98 CO 0.00 0.20 -1.20 0.41 -1.08 0.00 0.00 179.45 177.77 2axl n GLY 99 N -0.84 -1.37 0.29 3.86 0.00 0.52 -3.83 105.19 103.81 2axl n GLY 99 Ca -0.05 -0.26 -0.05 0.00 0.00 0.00 0.00 46.02 45.65 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 0.96 -0.69 1.61 2.43 -1.42 1.37 114.38 118.65 2axl h ARG 100 Ca -0.02 -0.08 -0.06 0.00 -0.81 0.00 0.00 59.98 59.01 2axl h ARG 100 Cb 1.08 -0.21 -0.03 0.00 -0.42 0.00 0.00 29.97 30.39 2axl h ARG 100 CO 0.01 0.67 0.19 -2.95 -1.51 0.00 0.00 179.97 176.38 2axl h ASN 101 N 0.97 1.02 0.19 -3.80 7.08 -1.70 0.81 115.58 120.16 2axl h ASN 101 Ca 0.26 -0.22 -0.01 0.00 -3.08 0.00 0.00 56.30 53.25 2axl h ASN 101 Cb -0.05 -0.27 0.00 0.00 -2.08 0.00 0.00 38.32 35.92 2axl h ASN 101 CO -0.05 0.98 -0.09 -0.25 -2.08 0.00 0.00 177.43 175.94 2axl h TRP 102 N 1.02 -0.23 -0.92 4.14 7.01 -1.17 -2.77 115.95 123.03 2axl h TRP 102 Ca 0.22 -0.01 -0.01 0.00 2.11 0.00 0.00 58.89 61.20 2axl h TRP 102 Cb 0.34 0.08 -0.04 0.00 -2.10 0.00 0.00 29.16 27.43 2axl h TRP 102 CO 0.03 -0.03 0.54 1.25 -2.79 0.00 0.00 178.44 177.43 2axl h LEU 103 N -0.40 1.12 -1.00 0.65 5.85 0.23 0.15 115.31 121.91 2axl h LEU 103 Ca -0.03 -0.08 -0.09 0.00 0.84 0.00 0.00 57.88 58.53 2axl h LEU 103 Cb 0.31 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 41.04 2axl h LEU 103 CO 0.04 0.88 -0.23 0.45 -0.34 0.00 0.00 178.44 179.24 2axl h HIS 104 N 1.28 0.49 0.00 1.25 3.86 0.71 -3.40 115.15 119.34 2axl h HIS 104 Ca 0.33 -0.10 0.00 0.00 -1.16 0.00 0.00 60.37 59.44 2axl h HIS 104 Cb -0.02 -0.12 0.00 0.00 1.06 0.00 0.00 27.41 28.32 2axl h HIS 104 CO 0.01 0.65 -0.29 0.36 0.86 0.00 0.00 177.93 179.51 2axl n LYS 105 N -4.14 0.00 0.00 2.45 2.85 -1.05 -4.79 118.16 113.48 2axl n LYS 105 Ca -0.00 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.26 2axl n LYS 105 Cb 0.38 -0.57 0.00 0.00 -0.65 0.00 0.00 35.03 34.20 2axl n LYS 105 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2axl n ALA 106 N -1.93 1.77 0.81 0.58 0.00 0.50 -3.23 120.51 119.01 2axl n ALA 106 Ca 0.00 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.57 2axl n ALA 106 Cb 0.15 -1.00 0.52 0.00 0.00 0.00 0.00 19.45 19.11 2axl n ALA 106 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 2axl n ASN 107 N 0.03 0.36 0.00 0.00 5.15 -1.15 -3.90 115.26 115.76 2axl n ASN 107 Ca 0.00 0.54 0.00 0.00 -0.60 0.00 0.00 54.58 54.52 2axl n ASN 107 Cb 0.08 -0.63 0.00 0.00 -0.53 0.00 0.00 39.78 38.70 2axl n ASN 107 CO 0.00 0.00 0.00 0.41 1.40 0.00 0.00 177.26 179.07 2axl n THR 108 N -1.84 0.00 -3.21 -0.44 -1.04 -1.20 -4.78 114.28 101.77 2axl n THR 108 Ca 0.06 0.46 -0.24 0.00 -2.04 0.00 0.00 64.05 62.29 2axl n THR 108 Cb 0.37 -1.23 -0.07 0.00 -1.82 0.00 0.00 70.33 67.58 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 -0.09 0.59 -4.01 -2.82 1.02 -1.26 -5.08 120.64 108.98 2axl n GLU 109 Ca 0.00 -3.12 -0.25 0.00 -0.02 0.00 0.00 57.16 53.76 2axl n GLU 109 Cb 0.00 -1.33 -0.17 0.00 -0.02 0.00 0.00 31.44 29.92 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 -0.88 1.93 -0.33 1.62 0.01 -1.25 -5.09 113.70 109.71 2axl s SER 110 Ca 0.34 -0.25 -0.01 0.00 1.31 0.00 0.00 55.95 57.34 2axl s SER 110 Cb 0.14 -0.75 0.13 0.00 0.21 0.00 0.00 66.02 65.75 2axl s SER 110 CO -0.14 -0.10 0.18 -1.10 0.41 0.00 0.00 173.24 172.49 2axl s GLN 111 N 1.52 0.47 -0.17 12.44 -0.21 -1.26 -4.94 119.66 127.51 2axl s GLN 111 Ca 0.01 -1.09 -0.06 0.00 0.02 0.00 0.00 55.36 54.24 2axl s GLN 111 Cb -0.13 -1.33 0.08 0.00 1.00 0.00 0.00 33.01 32.63 2axl s GLN 111 CO -0.05 -1.14 0.34 -1.12 -2.12 0.00 0.00 175.29 171.20 2axl s SER 112 N 1.39 0.08 -0.29 5.90 0.01 -1.26 -4.84 113.70 114.69 2axl s SER 112 Ca 0.15 0.75 -0.13 0.00 1.31 0.00 0.00 55.95 58.03 2axl s SER 112 Cb -0.21 1.02 0.13 0.00 0.21 0.00 0.00 66.02 67.17 2axl s SER 112 CO -0.12 -0.24 0.76 -0.22 0.41 0.00 0.00 173.24 173.83 2axl s LEU 113 N 2.52 -0.92 -0.21 2.44 2.96 -1.26 -4.95 118.68 119.26 2axl s LEU 113 Ca 0.00 1.32 -0.14 0.00 -0.22 0.00 0.00 54.13 55.10 2axl s LEU 113 Cb -0.12 2.13 -0.04 0.00 0.50 0.00 0.00 46.19 48.65 2axl s LEU 113 CO -0.11 -0.19 0.31 -0.63 -1.32 0.00 0.00 176.35 174.41 2axl s ILE 114 N 2.38 5.26 0.56 6.68 1.01 -1.26 -3.60 121.20 132.24 2axl s ILE 114 Ca -0.06 0.52 0.09 0.00 0.00 0.00 0.00 60.65 61.20 2axl s ILE 114 Cb -0.08 -3.64 0.08 0.00 0.01 0.00 0.00 42.46 38.82 2axl s ILE 114 CO -0.18 0.30 0.76 -0.76 0.00 0.00 0.00 174.94 175.06 2axl s LEU 115 N 1.14 3.13 0.14 2.97 1.43 -0.35 -3.92 118.68 123.23 2axl s LEU 115 Ca 0.15 -0.83 -0.30 0.00 -1.03 0.00 0.00 54.13 52.12 2axl s LEU 115 Cb -0.14 -1.69 -0.07 0.00 0.03 0.00 0.00 46.19 44.32 2axl s LEU 115 CO 0.06 -1.29 1.09 -1.58 0.23 0.00 0.00 176.35 174.86 2axl s GLN 116 N -4.63 4.58 0.49 1.70 0.74 -1.26 -1.29 119.66 119.99 2axl s GLN 116 Ca 0.61 1.68 -0.20 0.00 0.05 0.00 0.00 55.36 57.49 2axl s GLN 116 Cb -0.06 -3.31 -0.08 0.00 1.10 0.00 0.00 33.01 30.66 2axl s GLN 116 CO 0.38 0.03 1.03 0.00 -0.55 0.00 0.00 175.29 176.19 2axl s ALA 117 N 0.06 2.88 0.47 1.58 0.00 1.00 -4.53 121.76 123.22 2axl s ALA 117 Ca 0.51 0.58 -0.23 0.00 0.00 0.00 0.00 51.96 52.82 2axl s ALA 117 Cb -0.28 -3.24 -0.07 0.00 0.00 0.00 0.00 23.12 19.52 2axl s ALA 117 CO 0.33 -0.30 1.24 -0.80 0.00 0.00 0.00 175.76 176.23 2axl s ASN 118 N -2.03 5.96 0.08 0.00 0.01 -1.26 -4.84 114.94 112.86 2axl s ASN 118 Ca 0.67 2.50 -0.19 0.00 -0.71 0.00 0.00 52.86 55.12 2axl s ASN 118 Cb -0.16 -2.62 -0.09 0.00 0.41 0.00 0.00 41.25 38.79 2axl s ASN 118 CO 0.20 -1.08 1.53 1.05 -1.51 0.00 0.00 177.10 177.30 2axl h GLU 119 N 2.03 0.37 -5.50 -0.60 4.11 -1.94 -3.36 114.58 109.69 2axl h GLU 119 Ca -0.50 -0.11 -0.65 0.00 0.07 0.00 0.00 59.36 58.17 2axl h GLU 119 Cb 1.26 -0.04 -0.14 0.00 0.50 0.00 0.00 28.75 30.33 2axl h GLU 119 CO 0.60 0.54 1.14 -1.21 0.07 0.00 0.00 179.01 180.15 2axl s GLU 120 N -5.08 3.61 0.00 1.06 2.02 -1.26 -4.78 118.70 114.26 2axl s GLU 120 Ca -0.14 -1.50 0.24 0.00 0.02 0.00 0.00 54.97 53.59 2axl s GLU 120 Cb 0.07 -5.12 0.65 0.00 0.10 0.00 0.00 34.13 29.83 2axl s GLU 120 CO 0.73 -1.97 1.51 1.28 0.02 0.00 0.00 175.26 176.84 2axl n LEU 121 N 7.56 2.25 -3.26 1.80 4.77 -1.26 -4.68 117.00 124.18 2axl n LEU 121 Ca 0.28 -0.87 -0.06 0.00 -0.03 0.00 0.00 56.01 55.33 2axl n LEU 121 Cb 0.50 -0.09 -0.04 0.00 -2.33 0.00 0.00 43.42 41.46 2axl n LEU 121 CO 0.58 0.44 -0.01 0.00 -1.33 0.00 0.00 177.39 177.06 2axl n PRO 123 N 4.55 0.00 -0.69 0.00 -0.02 -1.26 -2.82 135.00 134.76 2axl n PRO 123 Ca 0.09 0.00 0.06 0.00 -2.02 0.00 0.00 63.50 61.63 2axl n PRO 123 Cb 0.52 -1.00 0.32 0.00 -0.02 0.00 0.00 33.50 33.32 2axl n PRO 123 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 2axl n LYS 124 N -0.41 3.99 0.00 -0.52 5.02 -1.26 -4.44 118.16 120.55 2axl n LYS 124 Ca 0.00 -2.45 0.00 0.00 -2.02 0.00 0.00 58.31 53.84 2axl n LYS 124 Cb 0.00 -2.08 0.00 0.00 -0.02 0.00 0.00 35.03 32.93 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 0.52 0.40 -2.08 1.97 3.00 -1.13 -4.67 118.16 116.17 2axl n LYS 125 Ca 0.22 0.00 -0.38 0.00 -0.00 0.00 0.00 58.31 58.14 2axl n LYS 125 Cb 0.97 -1.08 -0.03 0.00 0.00 0.00 0.00 35.03 34.90 2axl n LYS 125 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.40 176.23 2axl s LEU 126 N -0.63 3.28 0.33 3.14 0.20 -1.26 -4.96 118.68 118.77 2axl s LEU 126 Ca 0.00 0.25 -0.23 0.00 0.69 0.00 0.00 54.13 54.83 2axl s LEU 126 Cb 0.00 -2.53 -0.10 0.00 -0.43 0.00 0.00 46.19 43.13 2axl s LEU 126 CO 0.00 -2.35 0.90 -0.76 -0.29 0.00 0.00 176.35 173.85 2axl s LEU 127 N 8.85 4.25 -0.41 -0.68 1.43 -1.26 -5.01 118.68 125.85 2axl s LEU 127 Ca 0.65 1.71 0.09 0.00 -1.03 0.00 0.00 54.13 55.55 2axl s LEU 127 Cb -0.12 -4.05 0.32 0.00 0.03 0.00 0.00 46.19 42.37 2axl s LEU 127 CO 0.20 -0.11 0.83 -0.11 0.23 0.00 0.00 176.35 177.38 2axl n LEU 128 N 0.31 -0.43 -4.78 1.79 7.94 -1.26 -5.13 117.00 115.44 2axl n LEU 128 Ca 0.02 -4.48 -0.34 0.00 -1.11 0.00 0.00 56.01 50.10 2axl n LEU 128 Cb 0.51 0.78 0.00 0.00 0.53 0.00 0.00 43.42 45.24 2axl n LEU 128 CO 0.43 2.18 0.76 -2.16 -1.11 0.00 0.00 177.39 177.49 2axl s PRO 129 N -1.29 3.38 0.76 1.96 0.04 -1.26 -5.04 135.00 133.56 2axl s PRO 129 Ca 0.34 1.51 -0.12 0.00 0.04 0.00 0.00 61.00 62.77 2axl s PRO 129 Cb 0.30 -2.02 0.05 0.00 0.04 0.00 0.00 34.50 32.87 2axl s PRO 129 CO -0.09 -0.81 1.11 -1.54 0.04 0.00 0.00 177.00 175.71 2axl s SER 130 N -1.98 4.90 0.61 6.66 1.04 -1.26 -5.00 113.70 118.67 2axl s SER 130 Ca 0.70 1.17 -0.18 0.00 0.48 0.00 0.00 55.95 58.12 2axl s SER 130 Cb -0.21 -1.91 -0.03 0.00 0.10 0.00 0.00 66.02 63.97 2axl s SER 130 CO 0.28 -1.70 1.19 -0.94 0.98 0.00 0.00 173.24 173.06 2axl s SER 131 N -4.17 5.10 1.42 7.02 1.04 -1.26 -4.99 113.70 117.85 2axl s SER 131 Ca 0.60 2.34 -0.22 0.00 0.48 0.00 0.00 55.95 59.14 2axl s SER 131 Cb -0.13 -2.59 0.37 0.00 0.10 0.00 0.00 66.02 63.77 2axl s SER 131 CO 0.53 -1.65 0.92 -1.59 0.98 0.00 0.00 173.24 172.43 2axl s LYS 132 N -3.46 -2.90 -0.15 4.02 0.00 -1.26 -4.96 119.74 111.02 2axl s LYS 132 Ca 0.76 0.22 -0.18 0.00 0.00 0.00 0.00 55.97 56.77 2axl s LYS 132 Cb -0.29 -1.37 -0.04 0.00 0.00 0.00 0.00 37.83 36.13 2axl s LYS 132 CO 0.35 -4.88 0.49 0.99 0.00 0.00 0.00 175.35 172.30 2axl s THR 133 N -2.23 5.16 0.13 3.79 2.01 -1.26 -5.04 115.64 118.19 2axl s THR 133 Ca 0.68 0.96 -0.30 0.00 0.31 0.00 0.00 61.69 63.34 2axl s THR 133 Cb -0.15 -3.83 -0.07 0.00 0.01 0.00 0.00 72.50 68.47 2axl s THR 133 CO 0.59 0.27 1.20 0.54 -0.69 0.00 0.00 174.62 176.53 2axl s VAL 134 N 1.00 3.77 -0.27 3.82 0.11 -1.26 -4.92 120.40 122.64 2axl s VAL 134 Ca 0.25 1.38 0.21 0.00 -2.93 0.00 0.00 61.98 60.89 2axl s VAL 134 Cb -0.15 -3.88 0.10 0.00 -1.53 0.00 0.00 36.38 30.91 2axl s VAL 134 CO 0.10 0.17 1.26 0.28 -3.33 0.00 0.00 175.10 173.58 2axl h SER 135 N 5.97 0.00 -4.41 3.54 0.02 -2.06 -3.47 113.55 113.14 2axl h SER 135 Ca -0.43 0.00 -0.46 0.00 -0.84 0.00 0.00 61.79 60.05 2axl h SER 135 Cb 1.21 0.00 0.12 0.00 0.14 0.00 0.00 62.40 63.87 2axl h SER 135 CO 0.78 0.16 0.36 -0.94 -1.14 0.00 0.00 176.83 176.04 2axl s SER 136 N -5.86 3.96 0.00 3.07 1.04 -1.26 -4.10 113.70 110.55 2axl s SER 136 Ca 0.02 0.84 0.00 0.00 0.48 0.00 0.00 55.95 57.29 2axl s SER 136 Cb 0.08 -1.35 0.00 0.00 0.10 0.00 0.00 66.02 64.85 2axl s SER 136 CO 0.75 -2.26 0.00 0.61 0.98 0.00 0.00 173.24 173.32 2axl n GLY 137 N -2.81 0.76 3.74 7.32 0.00 -1.26 -5.03 105.19 107.91 2axl n GLY 137 Ca 0.08 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.69 2axl n GLY 137 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2axl s THR 138 N -2.77 3.80 -0.30 2.61 -4.23 -1.26 -5.00 115.64 108.49 2axl s THR 138 Ca 0.00 1.58 -0.14 0.00 -1.18 0.00 0.00 61.69 61.95 2axl s THR 138 Cb 0.00 -4.01 0.18 0.00 1.34 0.00 0.00 72.50 70.01 2axl s THR 138 CO 0.00 0.29 1.06 -0.75 -0.54 0.00 0.00 174.62 174.68 2axl s LYS 139 N -0.52 0.19 0.00 3.99 2.20 -1.26 -4.99 119.74 119.34 2axl s LYS 139 Ca 0.49 0.37 0.06 0.00 -0.36 0.00 0.00 55.97 56.53 2axl s LYS 139 Cb -0.30 0.21 0.35 0.00 -1.51 0.00 0.00 37.83 36.58 2axl s LYS 139 CO 0.36 -0.17 0.74 -1.91 -0.36 0.00 0.00 175.35 174.01 2axl n GLU 140 N 5.32 0.32 -0.13 4.03 4.07 -1.26 -3.42 120.64 129.56 2axl n GLU 140 Ca -0.07 0.00 -0.06 0.00 -0.06 0.00 0.00 57.16 56.97 2axl n GLU 140 Cb 0.54 -1.29 0.03 0.00 -0.06 0.00 0.00 31.44 30.65 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 0.37 -0.40 4.31 -0.00 -1.94 -2.48 115.15 115.01 2axl h HIS 141 Ca 0.00 0.02 -0.06 0.00 -0.00 0.00 0.00 60.37 60.33 2axl h HIS 141 Cb 0.00 -0.10 -0.01 0.00 -0.00 0.00 0.00 27.41 27.29 2axl h HIS 141 CO 0.00 0.18 0.03 0.00 -0.00 0.00 0.00 177.93 178.13 2axl s TYR 143 N -5.08 3.22 -0.83 0.00 5.04 -0.93 -5.23 117.35 113.53 2axl s TYR 143 Ca -0.13 0.87 0.00 0.00 -2.44 0.00 0.00 57.07 55.37 2axl s TYR 143 Cb 0.10 -3.09 0.00 0.00 0.35 0.00 0.00 41.96 39.32 2axl s TYR 143 CO 0.79 -1.23 0.21 0.09 -1.34 0.00 0.00 175.55 174.06