#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 0.22 3.17 8.00 -1.26 -3.33 116.55 123.36 2axl n ASP 2 Ca 0.00 -0.42 0.15 0.00 0.71 0.00 0.00 54.79 55.24 2axl n ASP 2 Cb 0.00 -0.19 0.68 0.00 -0.02 0.00 0.00 41.12 41.59 2axl n ASP 2 CO 0.00 0.00 0.00 0.44 -0.39 0.00 0.00 177.20 177.25 2axl h ASP 3 N 0.01 0.00 -1.90 -2.24 3.32 -1.81 -3.39 116.42 110.41 2axl h ASP 3 Ca 0.00 0.00 -0.63 0.00 0.02 0.00 0.00 57.03 56.42 2axl h ASP 3 Cb 0.20 0.00 0.01 0.00 0.22 0.00 0.00 39.33 39.76 2axl h ASP 3 CO 0.00 0.00 1.15 -0.24 -1.72 0.00 0.00 179.24 178.43 2axl n SER 4 N -2.65 3.25 -4.77 6.45 2.88 -1.21 -4.90 113.62 112.68 2axl n SER 4 Ca 0.00 0.87 -0.39 0.00 -1.33 0.00 0.00 58.87 58.02 2axl n SER 4 Cb 0.20 -1.36 -0.01 0.00 -0.75 0.00 0.00 64.21 62.29 2axl n SER 4 CO 0.00 0.00 0.00 -0.70 -1.23 0.00 0.00 175.04 173.11 2axl s GLU 5 N 4.45 3.91 0.00 -1.46 2.56 -1.26 -4.92 118.70 121.98 2axl s GLU 5 Ca 0.95 1.99 0.00 0.00 0.00 0.00 0.00 54.97 57.91 2axl s GLU 5 Cb -0.70 -2.64 0.00 0.00 2.00 0.00 0.00 34.13 32.79 2axl s GLU 5 CO 0.51 -0.49 0.00 -0.25 -0.56 0.00 0.00 175.26 174.47 2axl n ASP 6 N -0.07 0.00 -4.27 -1.70 9.92 -1.26 -5.00 116.55 114.17 2axl n ASP 6 Ca 0.05 -0.35 -0.28 0.00 -0.53 0.00 0.00 54.79 53.67 2axl n ASP 6 Cb 0.45 0.00 -0.15 0.00 -0.64 0.00 0.00 41.12 40.78 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 1.09 1.82 -0.30 -3.53 -1.32 -1.26 -4.40 115.64 107.75 2axl s THR 7 Ca 0.00 -1.05 -0.14 0.00 -1.21 0.00 0.00 61.69 59.29 2axl s THR 7 Cb 0.00 -1.53 0.17 0.00 -1.51 0.00 0.00 72.50 69.64 2axl s THR 7 CO 0.00 0.46 1.03 -0.44 -2.21 0.00 0.00 174.62 173.46 2axl s SER 8 N -0.69 -0.50 -0.30 8.08 0.01 -1.08 -1.29 113.70 117.93 2axl s SER 8 Ca 0.09 0.55 -0.19 0.00 1.31 0.00 0.00 55.95 57.70 2axl s SER 8 Cb -0.09 1.51 0.21 0.00 0.21 0.00 0.00 66.02 67.86 2axl s SER 8 CO -0.00 -0.10 1.36 -1.66 0.41 0.00 0.00 173.24 173.25 2axl s TRP 9 N 2.56 -0.02 -0.26 2.43 1.48 -1.08 -4.83 118.94 119.22 2axl s TRP 9 Ca -0.01 0.05 -0.12 0.00 -1.06 0.00 0.00 56.10 54.96 2axl s TRP 9 Cb -0.07 0.19 -0.05 0.00 -1.16 0.00 0.00 33.47 32.39 2axl s TRP 9 CO -0.16 -0.01 0.23 0.34 -4.06 0.00 0.00 176.95 173.29 2axl s ASP 10 N 0.64 6.12 -0.44 -2.66 -1.08 -1.26 0.15 116.67 118.14 2axl s ASP 10 Ca -0.02 0.12 0.08 0.00 -0.52 0.00 0.00 52.55 52.21 2axl s ASP 10 Cb -0.03 -2.14 0.27 0.00 -1.46 0.00 0.00 42.92 39.56 2axl s ASP 10 CO -0.12 -0.04 0.61 0.33 0.52 0.00 0.00 175.17 176.48 2axl n PHE 11 N 4.81 0.68 -0.11 -5.34 -0.00 -1.23 -4.90 117.46 111.38 2axl n PHE 11 Ca -0.13 -3.73 -0.05 0.00 -0.00 0.00 0.00 57.45 53.54 2axl n PHE 11 Cb 0.52 -0.41 0.02 0.00 -0.00 0.00 0.00 39.48 39.61 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 3.85 0.35 -0.96 7.13 0.00 -1.83 -2.08 103.07 109.53 2axl h GLY 12 Ca 0.10 0.06 0.32 0.00 0.00 0.00 0.00 47.33 47.80 2axl h GLY 12 CO 0.56 -0.10 0.21 -1.05 0.00 0.00 0.00 176.54 176.16 2axl n PRO 13 N -5.20 -0.07 -0.24 4.80 -0.02 -1.26 0.16 135.00 133.17 2axl n PRO 13 Ca 0.02 1.39 -0.06 0.00 -2.02 0.00 0.00 63.50 62.83 2axl n PRO 13 Cb 0.19 -2.31 0.08 0.00 -0.02 0.00 0.00 33.50 31.44 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 1.10 -0.27 -0.52 4.20 -1.79 0.21 115.11 118.04 2axl h GLN 14 Ca 0.67 -0.24 -0.09 0.00 0.06 0.00 0.00 58.65 59.05 2axl h GLN 14 Cb 1.56 -0.16 -0.01 0.00 0.30 0.00 0.00 27.48 29.16 2axl h GLN 14 CO -0.84 0.95 -0.22 0.00 -0.67 0.00 0.00 178.83 178.05 2axl h ALA 15 N 1.16 1.12 -0.41 3.87 0.00 0.15 0.58 119.26 125.73 2axl h ALA 15 Ca 0.23 -0.33 -0.04 0.00 0.00 0.00 0.00 54.91 54.77 2axl h ALA 15 Cb 0.32 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 2axl h ALA 15 CO -0.00 0.55 0.10 0.74 0.00 0.00 0.00 179.25 180.64 2axl h PHE 16 N 0.44 0.69 -0.35 0.00 0.04 -0.59 1.69 116.94 118.87 2axl h PHE 16 Ca 0.07 -0.08 0.03 0.00 2.80 0.00 0.00 57.97 60.79 2axl h PHE 16 Cb 0.63 -0.20 -0.03 0.00 2.20 0.00 0.00 35.95 38.55 2axl h PHE 16 CO 0.02 0.66 0.14 0.87 -0.60 0.00 0.00 178.31 179.40 2axl h LYS 17 N 0.53 0.30 -0.02 1.51 1.57 0.52 3.16 116.57 124.13 2axl h LYS 17 Ca 0.13 -0.02 -0.03 0.00 -1.87 0.00 0.00 60.65 58.86 2axl h LYS 17 Cb 0.31 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.56 2axl h LYS 17 CO 0.00 0.20 -0.11 1.25 -0.57 0.00 0.00 179.45 180.21 2axl h LEU 18 N 0.30 0.13 -0.39 2.94 5.85 -0.37 -2.69 115.31 121.09 2axl h LEU 18 Ca 0.15 -0.69 -0.01 0.00 0.84 0.00 0.00 57.88 58.17 2axl h LEU 18 Cb 0.10 -0.04 -0.02 0.00 0.37 0.00 0.00 40.66 41.08 2axl h LEU 18 CO -0.14 0.80 0.22 -0.07 -0.34 0.00 0.00 178.44 178.91 2axl h LEU 19 N -0.54 0.48 -0.83 2.25 3.38 0.29 -2.78 115.31 117.56 2axl h LEU 19 Ca -0.01 -0.08 -0.12 0.00 0.09 0.00 0.00 57.88 57.75 2axl h LEU 19 Cb 0.81 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.42 2axl h LEU 19 CO 0.02 0.43 -0.49 -1.28 0.09 0.00 0.00 178.44 177.21 2axl h SER 20 N 0.50 0.24 -0.45 -0.43 0.87 0.57 -2.91 113.55 111.94 2axl h SER 20 Ca 0.14 -0.11 -0.02 0.00 -1.23 0.00 0.00 61.79 60.57 2axl h SER 20 Cb 0.05 -0.07 -0.02 0.00 -0.44 0.00 0.00 62.40 61.92 2axl h SER 20 CO -0.02 0.69 0.21 0.00 -0.53 0.00 0.00 176.83 177.19 2axl h ALA 21 N 1.31 0.58 -0.41 6.23 0.00 -1.27 0.23 119.26 125.92 2axl h ALA 21 Ca 0.01 -0.11 -0.04 0.00 0.00 0.00 0.00 54.91 54.77 2axl h ALA 21 Cb 0.94 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.53 2axl h ALA 21 CO 0.08 0.14 0.10 -0.39 0.00 0.00 0.00 179.25 179.18 2axl h VAL 22 N 0.58 1.18 0.20 0.00 -1.51 -1.50 0.34 116.25 115.54 2axl h VAL 22 Ca 0.15 -0.65 -0.01 0.00 -1.23 0.00 0.00 66.70 64.96 2axl h VAL 22 Cb 0.12 0.76 0.00 0.00 -2.13 0.00 0.00 31.29 30.04 2axl h VAL 22 CO -0.02 0.24 -0.09 -0.78 -1.23 0.00 0.00 177.57 175.69 2axl h ASP 23 N 0.60 -0.22 -0.57 4.19 1.82 -1.17 2.80 116.42 123.87 2axl h ASP 23 Ca 0.14 -0.09 -0.02 0.00 -0.39 0.00 0.00 57.03 56.67 2axl h ASP 23 Cb 0.22 0.06 -0.03 0.00 0.68 0.00 0.00 39.33 40.26 2axl h ASP 23 CO -0.00 -0.05 0.27 0.40 -1.61 0.00 0.00 179.24 178.24 2axl h ILE 24 N -0.38 1.21 0.00 2.25 1.08 -0.53 0.37 117.51 121.51 2axl h ILE 24 Ca -0.03 -0.59 0.00 0.00 -0.39 0.00 0.00 64.86 63.85 2axl h ILE 24 Cb 0.30 0.55 0.00 0.00 -3.07 0.00 0.00 36.82 34.60 2axl h ILE 24 CO 0.04 0.24 0.00 0.18 -0.69 0.00 0.00 178.15 177.92 2axl n LEU 25 N -4.54 0.00 -4.06 1.44 4.77 0.07 -4.88 117.00 109.80 2axl n LEU 25 Ca 0.03 0.00 -0.41 0.00 -0.03 0.00 0.00 56.01 55.60 2axl n LEU 25 Cb 0.13 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.22 2axl n LEU 25 CO 0.38 0.00 -0.21 0.61 -1.33 0.00 0.00 177.39 176.84 2axl n GLY 26 N 0.63 -0.70 2.04 -0.72 0.00 0.86 -0.09 105.19 107.22 2axl n GLY 26 Ca 0.19 0.31 -0.02 0.00 0.00 0.00 0.00 46.02 46.51 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 -4.83 -1.75 0.00 1.61 1.02 0.30 -4.71 120.64 112.28 2axl n GLU 27 Ca -0.16 0.20 0.00 0.00 -0.02 0.00 0.00 57.16 57.18 2axl n GLU 27 Cb 0.60 -3.55 0.00 0.00 -0.02 0.00 0.00 31.44 28.47 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 -0.19 0.88 -4.05 3.49 4.76 0.87 -4.77 118.16 119.15 2axl n LYS 28 Ca -0.02 0.00 -0.10 0.00 -2.87 0.00 0.00 58.31 55.32 2axl n LYS 28 Cb 0.15 -1.40 -0.07 0.00 -1.84 0.00 0.00 35.03 31.88 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 -1.09 0.58 0.00 2.13 0.40 -1.26 -5.14 117.98 113.60 2axl s PHE 29 Ca 0.00 -0.90 0.00 0.00 -0.60 0.00 0.00 56.93 55.43 2axl s PHE 29 Cb 0.00 -0.03 0.00 0.00 0.51 0.00 0.00 43.02 43.50 2axl s PHE 29 CO 0.00 -0.88 0.00 0.41 0.70 0.00 0.00 175.22 175.45 2axl n GLY 30 N -0.34 3.41 0.17 4.36 0.00 -1.26 -4.09 105.19 107.43 2axl n GLY 30 Ca -0.01 -2.13 -0.10 0.00 0.00 0.00 0.00 46.02 43.78 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 0.35 1.21 0.00 -0.61 2.10 -1.19 -3.38 117.51 115.99 2axl h ILE 31 Ca 0.00 -0.70 0.00 0.00 1.08 0.00 0.00 64.86 65.24 2axl h ILE 31 Cb 0.00 1.08 0.00 0.00 -1.09 0.00 0.00 36.82 36.81 2axl h ILE 31 CO 0.00 0.23 0.00 0.61 -1.08 0.00 0.00 178.15 177.91 2axl n GLY 32 N -0.59 -2.06 0.40 8.18 0.00 -1.25 -2.17 105.19 107.71 2axl n GLY 32 Ca -0.02 0.44 -0.07 0.00 0.00 0.00 0.00 46.02 46.37 2axl n GLY 32 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2axl h LEU 33 N 0.00 -1.82 -0.80 0.99 5.85 -1.93 -1.05 115.31 116.55 2axl h LEU 33 Ca 0.00 0.32 0.25 0.00 0.84 0.00 0.00 57.88 59.29 2axl h LEU 33 Cb 0.00 0.86 -0.15 0.00 0.37 0.00 0.00 40.66 41.74 2axl h LEU 33 CO 0.00 -0.26 0.14 -2.65 -0.34 0.00 0.00 178.44 175.33 2axl n PRO 34 N -5.35 -0.06 -0.19 5.25 -0.02 -0.92 0.10 135.00 133.81 2axl n PRO 34 Ca 0.05 1.17 -0.07 0.00 -2.02 0.00 0.00 63.50 62.64 2axl n PRO 34 Cb 0.33 -1.93 0.02 0.00 -0.02 0.00 0.00 33.50 31.90 2axl n PRO 34 CO 0.00 0.00 0.00 0.97 1.98 0.00 0.00 175.50 178.45 2axl h ILE 35 N 0.00 1.16 -0.63 4.25 2.10 -1.04 0.80 117.51 124.15 2axl h ILE 35 Ca 0.54 -0.36 -0.02 0.00 1.08 0.00 0.00 64.86 66.10 2axl h ILE 35 Cb 1.24 0.42 -0.03 0.00 -1.09 0.00 0.00 36.82 37.36 2axl h ILE 35 CO -0.71 0.17 0.33 -0.07 -1.08 0.00 0.00 178.15 176.78 2axl h LEU 36 N 0.73 0.80 0.05 2.19 3.38 0.64 -3.22 115.31 119.89 2axl h LEU 36 Ca 0.20 -0.11 -0.30 0.00 0.09 0.00 0.00 57.88 57.76 2axl h LEU 36 Cb -0.02 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.50 2axl h LEU 36 CO -0.04 0.68 -1.62 0.15 0.09 0.00 0.00 178.44 177.71 2axl h PHE 37 N 0.86 0.19 -0.53 1.13 3.04 -0.66 -2.59 116.94 118.39 2axl h PHE 37 Ca 0.22 -0.14 -0.02 0.00 3.98 0.00 0.00 57.97 62.01 2axl h PHE 37 Cb 0.07 -0.01 -0.03 0.00 2.56 0.00 0.00 35.95 38.55 2axl h PHE 37 CO -0.00 1.22 0.23 -0.07 -2.02 0.00 0.00 178.31 177.67 2axl h LEU 38 N 0.03 0.68 0.00 0.59 3.38 0.57 -2.36 115.31 118.20 2axl h LEU 38 Ca -0.26 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 57.64 2axl h LEU 38 Cb 1.99 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 42.56 2axl h LEU 38 CO 0.11 0.60 0.00 0.54 0.09 0.00 0.00 178.44 179.78 2axl n ARG 39 N -4.35 0.40 -1.57 1.13 1.74 -1.22 -2.32 116.66 110.47 2axl n ARG 39 Ca 0.04 0.06 -0.00 0.00 -0.77 0.00 0.00 57.85 57.18 2axl n ARG 39 Cb 0.14 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.09 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 0.53 0.26 3.81 -0.13 0.00 -0.89 -4.50 105.19 104.27 2axl n GLY 40 Ca 0.12 -0.21 -0.30 0.00 0.00 0.00 0.00 46.02 45.63 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 -2.54 4.55 -0.62 1.61 1.04 -0.98 -4.88 113.70 111.88 2axl s SER 41 Ca 0.01 1.30 -0.28 0.00 0.48 0.00 0.00 55.95 57.46 2axl s SER 41 Cb -0.00 -2.04 0.02 0.00 0.10 0.00 0.00 66.02 64.11 2axl s SER 41 CO 0.03 -1.93 1.32 0.21 0.98 0.00 0.00 173.24 173.84 2axl s ASN 42 N -3.93 6.22 -0.31 7.02 3.84 -1.26 -4.87 114.94 121.65 2axl s ASN 42 Ca 0.61 0.03 0.01 0.00 0.21 0.00 0.00 52.86 53.72 2axl s ASN 42 Cb -0.14 -2.55 0.19 0.00 -0.55 0.00 0.00 41.25 38.20 2axl s ASN 42 CO 0.54 -1.68 0.74 -0.55 -2.79 0.00 0.00 177.10 173.36 2axl s SER 43 N 3.84 -1.23 0.17 -4.21 0.15 -1.26 -5.04 113.70 106.13 2axl s SER 43 Ca 0.45 -0.02 0.04 0.00 0.70 0.00 0.00 55.95 57.12 2axl s SER 43 Cb -0.09 1.73 0.02 0.00 -1.71 0.00 0.00 66.02 65.97 2axl s SER 43 CO 0.22 -0.21 1.40 -0.61 1.20 0.00 0.00 173.24 175.25 2axl h GLN 44 N 7.48 0.13 -0.87 5.44 5.75 -1.98 -3.06 115.11 128.00 2axl h GLN 44 Ca -0.02 -0.15 0.02 0.00 -0.15 0.00 0.00 58.65 58.35 2axl h GLN 44 Cb 1.19 0.04 -0.05 0.00 1.07 0.00 0.00 27.48 29.73 2axl h GLN 44 CO 0.07 0.91 0.57 -0.09 -2.65 0.00 0.00 178.83 177.63 2axl h ARG 45 N 0.07 1.09 -0.00 1.69 2.43 -2.01 -1.46 114.38 116.20 2axl h ARG 45 Ca -0.03 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 59.07 2axl h ARG 45 Cb 1.48 -0.25 0.00 0.00 -0.42 0.00 0.00 29.97 30.78 2axl h ARG 45 CO 0.12 0.72 -0.26 1.28 -1.51 0.00 0.00 179.97 180.32 2axl n LEU 46 N -4.52 0.59 0.12 3.80 4.77 -1.25 -3.11 117.00 117.42 2axl n LEU 46 Ca 0.10 -0.02 0.12 0.00 -0.03 0.00 0.00 56.01 56.18 2axl n LEU 46 Cb 0.06 -0.22 0.06 0.00 -2.33 0.00 0.00 43.42 40.99 2axl n LEU 46 CO 0.35 0.12 0.24 0.00 -1.33 0.00 0.00 177.39 176.77 2axl h ALA 47 N 3.38 0.62 0.01 -1.18 0.00 -1.18 -2.89 119.26 118.01 2axl h ALA 47 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 54.91 54.56 2axl h ALA 47 Cb 0.46 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.20 2axl h ALA 47 CO 0.00 0.00 -1.93 -0.25 0.00 0.00 0.00 179.25 177.07 2axl n ASP 48 N -2.68 1.93 0.24 0.00 8.00 -0.86 -3.29 116.55 119.89 2axl n ASP 48 Ca 0.01 0.33 -0.14 0.00 0.71 0.00 0.00 54.79 55.71 2axl n ASP 48 Cb 0.53 -0.86 -0.08 0.00 -0.02 0.00 0.00 41.12 40.69 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 -0.85 -0.61 -1.23 -1.24 7.50 -1.72 -3.04 115.11 113.93 2axl h GLN 49 Ca -0.52 0.04 -0.34 0.00 0.50 0.00 0.00 58.65 58.33 2axl h GLN 49 Cb 1.53 0.14 -0.17 0.00 0.05 0.00 0.00 27.48 29.03 2axl h GLN 49 CO -0.27 -0.30 0.44 0.66 -1.50 0.00 0.00 178.83 177.86 2axl n TYR 50 N -5.25 1.79 0.19 2.96 4.01 -1.09 -4.56 117.16 115.21 2axl n TYR 50 Ca -0.11 -1.73 0.08 0.00 -0.16 0.00 0.00 57.90 55.98 2axl n TYR 50 Cb 0.30 -0.86 0.61 0.00 -0.31 0.00 0.00 39.34 39.09 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 1.09 0.09 -0.41 -0.72 0.11 -1.52 -2.32 114.38 110.71 2axl h ARG 51 Ca 0.35 -0.01 0.04 0.00 0.10 0.00 0.00 59.98 60.47 2axl h ARG 51 Cb 1.45 -0.02 -0.02 0.00 1.11 0.00 0.00 29.97 32.49 2axl h ARG 51 CO 0.77 0.06 0.27 0.00 0.10 0.00 0.00 179.97 181.18 2axl h ARG 52 N 0.10 0.39 -5.04 0.08 2.47 -1.87 -3.39 114.38 107.12 2axl h ARG 52 Ca 0.05 -0.02 -0.05 0.00 -1.26 0.00 0.00 59.98 58.70 2axl h ARG 52 Cb 0.08 -0.09 -0.02 0.00 -1.65 0.00 0.00 29.97 28.29 2axl h ARG 52 CO -0.01 0.26 0.81 1.58 0.56 0.00 0.00 179.97 183.17 2axl n HIS 53 N -4.48 0.31 -0.28 3.04 -0.00 -0.88 -4.71 115.22 108.23 2axl n HIS 53 Ca 0.04 -0.04 -0.06 0.00 0.46 0.00 0.00 57.72 58.13 2axl n HIS 53 Cb 0.18 -1.20 0.06 0.00 -0.12 0.00 0.00 29.99 28.91 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 10.21 1.02 0.00 0.26 0.87 -1.89 -2.61 113.55 121.41 2axl h SER 54 Ca 0.01 -0.14 0.00 0.00 -1.23 0.00 0.00 61.79 60.43 2axl h SER 54 Cb 1.02 -0.26 0.00 0.00 -0.44 0.00 0.00 62.40 62.71 2axl h SER 54 CO 1.08 0.87 0.00 0.18 -0.53 0.00 0.00 176.83 178.44 2axl n LEU 55 N -4.37 0.00 -4.68 2.23 4.77 -1.26 -4.72 117.00 108.97 2axl n LEU 55 Ca 0.07 0.00 -0.45 0.00 -0.03 0.00 0.00 56.01 55.60 2axl n LEU 55 Cb 0.14 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.19 2axl n LEU 55 CO 0.39 0.00 1.32 0.33 -1.33 0.00 0.00 177.39 178.11 2axl n PHE 56 N -0.60 2.43 -2.04 -1.77 -0.00 -0.99 -2.93 117.46 111.57 2axl n PHE 56 Ca 0.00 0.11 -0.18 0.00 -0.00 0.00 0.00 57.45 57.37 2axl n PHE 56 Cb 0.00 -2.62 -0.04 0.00 -0.00 0.00 0.00 39.48 36.82 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 3.82 0.44 0.05 7.13 0.00 -0.98 -4.83 105.19 110.82 2axl n GLY 57 Ca 0.18 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.31 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 -3.13 0.25 -0.49 2.61 -1.04 -1.15 -3.57 114.28 107.76 2axl n THR 58 Ca -0.20 -0.30 -0.16 0.00 -2.04 0.00 0.00 64.05 61.35 2axl n THR 58 Cb 0.64 0.06 0.11 0.00 -1.82 0.00 0.00 70.33 69.32 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 1.34 3.70 0.19 3.41 0.00 -1.24 -4.39 105.19 108.19 2axl n GLY 59 Ca 0.02 -0.76 0.02 0.00 0.00 0.00 0.00 46.02 45.29 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 0.72 0.06 0.00 1.61 3.64 -1.74 -2.82 116.57 118.03 2axl h LYS 60 Ca 0.42 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.77 2axl h LYS 60 Cb 2.13 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.95 2axl h LYS 60 CO 0.74 0.42 0.00 -0.40 -2.27 0.00 0.00 179.45 177.95 2axl n ASP 61 N -4.09 0.00 -4.71 4.20 5.75 -1.26 -4.75 116.55 111.69 2axl n ASP 61 Ca -0.02 0.47 -0.41 0.00 -0.01 0.00 0.00 54.79 54.82 2axl n ASP 61 Cb 0.42 -0.49 -0.04 0.00 -1.03 0.00 0.00 41.12 39.98 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 -2.97 4.51 0.98 0.11 -0.21 -1.07 -5.04 119.66 115.96 2axl s GLN 62 Ca 0.09 1.21 -0.12 0.00 0.02 0.00 0.00 55.36 56.55 2axl s GLN 62 Cb 0.12 -3.46 0.17 0.00 1.00 0.00 0.00 33.01 30.84 2axl s GLN 62 CO 0.32 -0.01 1.10 0.95 -2.12 0.00 0.00 175.29 175.52 2axl s THR 63 N 0.96 2.15 0.03 -0.19 -4.23 -1.26 -4.94 115.64 108.16 2axl s THR 63 Ca 0.46 0.05 -0.14 0.00 -1.18 0.00 0.00 61.69 60.88 2axl s THR 63 Cb -0.20 -2.57 -0.07 0.00 1.34 0.00 0.00 72.50 71.00 2axl s THR 63 CO 0.24 -0.06 1.22 -0.08 -0.54 0.00 0.00 174.62 175.39 2axl h GLU 64 N -1.80 -0.45 0.00 3.99 4.57 -1.98 -3.08 114.58 115.83 2axl h GLU 64 Ca -0.53 0.03 0.00 0.00 -1.18 0.00 0.00 59.36 57.68 2axl h GLU 64 Cb 1.32 0.10 0.00 0.00 -0.16 0.00 0.00 28.75 30.02 2axl h GLU 64 CO 0.58 -0.30 0.00 0.66 -1.18 0.00 0.00 179.01 178.77 2axl h SER 65 N -0.46 0.00 -0.94 1.04 4.64 -1.98 -2.18 113.55 113.66 2axl h SER 65 Ca -0.04 0.00 0.01 0.00 -0.47 0.00 0.00 61.79 61.29 2axl h SER 65 Cb 0.38 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.42 2axl h SER 65 CO 0.03 0.00 0.61 -0.25 -0.87 0.00 0.00 176.83 176.35 2axl h TRP 66 N 0.00 1.19 -0.26 4.77 2.91 -1.91 1.95 115.95 124.60 2axl h TRP 66 Ca 0.00 0.02 -0.09 0.00 1.13 0.00 0.00 58.89 59.96 2axl h TRP 66 Cb 0.33 -0.40 -0.01 0.00 -0.51 0.00 0.00 29.16 28.58 2axl h TRP 66 CO 0.00 0.76 -0.18 -1.49 -1.03 0.00 0.00 178.44 176.50 2axl h TRP 67 N 1.28 0.68 -0.41 2.65 4.06 -1.37 0.55 115.95 123.38 2axl h TRP 67 Ca 0.34 -0.18 0.06 0.00 2.06 0.00 0.00 58.89 61.17 2axl h TRP 67 Cb -0.13 -0.15 -0.06 0.00 -1.00 0.00 0.00 29.16 27.82 2axl h TRP 67 CO -0.00 0.86 0.07 -0.22 -3.56 0.00 0.00 178.44 175.59 2axl h LYS 68 N 0.30 0.19 -0.53 0.49 1.63 -0.55 0.43 116.57 118.53 2axl h LYS 68 Ca 0.05 -0.01 -0.04 0.00 -0.85 0.00 0.00 60.65 59.80 2axl h LYS 68 Cb 0.71 -0.04 -0.02 0.00 -0.60 0.00 0.00 32.23 32.27 2axl h LYS 68 CO 0.05 0.13 0.19 0.00 -3.45 0.00 0.00 179.45 176.36 2axl h ALA 69 N 1.31 0.70 -0.44 5.00 0.00 0.33 -2.41 119.26 123.75 2axl h ALA 69 Ca 0.20 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 2axl h ALA 69 Cb 0.24 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 2axl h ALA 69 CO -0.27 0.34 0.22 0.35 0.00 0.00 0.00 179.25 179.89 2axl h PHE 70 N 0.73 0.63 -0.88 0.00 3.57 0.15 -2.39 116.94 118.75 2axl h PHE 70 Ca 0.18 -0.02 0.06 0.00 3.53 0.00 0.00 57.97 61.71 2axl h PHE 70 Cb 0.24 -0.20 -0.06 0.00 2.79 0.00 0.00 35.95 38.72 2axl h PHE 70 CO 0.01 0.50 0.55 0.77 -2.23 0.00 0.00 178.31 177.91 2axl h SER 71 N 0.58 0.87 -0.68 0.41 0.02 -0.81 -1.80 113.55 112.13 2axl h SER 71 Ca 0.15 0.02 0.01 0.00 -0.84 0.00 0.00 61.79 61.13 2axl h SER 71 Cb 0.09 -0.17 -0.04 0.00 0.14 0.00 0.00 62.40 62.43 2axl h SER 71 CO -0.02 0.56 0.44 -0.09 -1.14 0.00 0.00 176.83 176.58 2axl h ARG 72 N 1.00 0.87 -0.86 3.45 2.43 -0.96 -2.52 114.38 117.80 2axl h ARG 72 Ca 0.38 -0.05 0.10 0.00 -0.81 0.00 0.00 59.98 59.61 2axl h ARG 72 Cb 0.17 -0.20 -0.08 0.00 -0.42 0.00 0.00 29.97 29.44 2axl h ARG 72 CO -0.17 0.58 0.50 1.96 -1.51 0.00 0.00 179.97 181.32 2axl h GLN 73 N 0.90 0.79 -0.54 0.20 4.20 -0.86 -2.53 115.11 117.27 2axl h GLN 73 Ca 0.25 -0.05 -0.06 0.00 0.06 0.00 0.00 58.65 58.86 2axl h GLN 73 Cb -0.08 -0.18 -0.02 0.00 0.30 0.00 0.00 27.48 27.50 2axl h GLN 73 CO -0.06 0.52 0.10 -0.07 -0.67 0.00 0.00 178.83 178.64 2axl h LEU 74 N 0.81 0.79 -0.10 1.46 3.38 -1.28 -2.89 115.31 117.49 2axl h LEU 74 Ca 0.42 -0.16 0.00 0.00 0.09 0.00 0.00 57.88 58.23 2axl h LEU 74 Cb 0.42 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 40.95 2axl h LEU 74 CO -0.26 0.80 0.06 0.40 0.09 0.00 0.00 178.44 179.53 2axl h ILE 75 N 0.80 1.04 -0.51 1.22 2.04 -1.36 -2.56 117.51 118.19 2axl h ILE 75 Ca 0.17 -0.10 -0.11 0.00 1.00 0.00 0.00 64.86 65.82 2axl h ILE 75 Cb 0.35 0.94 -0.02 0.00 -0.74 0.00 0.00 36.82 37.35 2axl h ILE 75 CO 0.00 0.04 -0.10 0.74 0.00 0.00 0.00 178.15 178.83 2axl h THR 76 N 0.11 1.27 0.00 -0.27 2.02 -1.56 -3.05 112.91 111.42 2axl h THR 76 Ca 0.03 -1.24 -0.04 0.00 0.77 0.00 0.00 66.41 65.94 2axl h THR 76 Cb 0.01 1.03 -0.01 0.00 -1.74 0.00 0.00 68.15 67.44 2axl h THR 76 CO -0.01 0.43 -0.19 -0.33 0.37 0.00 0.00 175.52 175.79 2axl h GLU 77 N 0.82 0.00 0.00 6.66 5.08 -1.46 -3.42 114.58 122.26 2axl h GLU 77 Ca 0.13 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.49 2axl h GLU 77 Cb 0.66 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.91 2axl h GLU 77 CO 0.05 0.19 0.00 0.41 -1.00 0.00 0.00 179.01 178.66 2axl n GLY 78 N -0.73 2.39 0.52 -3.84 0.00 -0.99 -4.19 105.19 98.34 2axl n GLY 78 Ca -0.02 0.00 0.37 0.00 0.00 0.00 0.00 46.02 46.37 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 0.35 -3.79 1.61 -1.00 -1.84 -3.41 116.94 108.86 2axl h PHE 79 Ca 0.00 0.01 -0.15 0.00 2.81 0.00 0.00 57.97 60.64 2axl h PHE 79 Cb 0.00 -0.09 -0.20 0.00 3.61 0.00 0.00 35.95 39.27 2axl h PHE 79 CO 0.00 -0.09 -0.60 -1.17 -1.61 0.00 0.00 178.31 174.84 2axl s LEU 80 N -8.99 1.93 -0.02 1.54 2.96 -1.03 -4.13 118.68 110.93 2axl s LEU 80 Ca -0.07 -0.41 0.05 0.00 -0.22 0.00 0.00 54.13 53.48 2axl s LEU 80 Cb 0.27 0.38 -0.01 0.00 0.50 0.00 0.00 46.19 47.33 2axl s LEU 80 CO 0.83 -0.36 -0.16 0.54 -1.32 0.00 0.00 176.35 175.88 2axl s VAL 81 N -1.64 1.30 -0.12 1.68 0.11 -1.15 -3.94 120.40 116.63 2axl s VAL 81 Ca -0.14 -0.69 0.02 0.00 -2.93 0.00 0.00 61.98 58.24 2axl s VAL 81 Cb -0.08 -1.08 -0.01 0.00 -1.53 0.00 0.00 36.38 33.68 2axl s VAL 81 CO -0.01 0.37 -0.19 -1.61 -3.33 0.00 0.00 175.10 170.34 2axl s GLU 82 N -0.31 3.20 -0.27 1.54 2.02 -1.26 -0.72 118.70 122.89 2axl s GLU 82 Ca 0.05 -0.79 -0.18 0.00 0.02 0.00 0.00 54.97 54.07 2axl s GLU 82 Cb -0.07 -2.47 -0.02 0.00 0.10 0.00 0.00 34.13 31.66 2axl s GLU 82 CO -0.00 0.16 0.50 0.08 0.02 0.00 0.00 175.26 176.02 2axl s VAL 83 N 0.43 5.07 -0.67 2.63 1.01 0.14 -4.89 120.40 124.12 2axl s VAL 83 Ca -0.14 0.78 0.25 0.00 0.00 0.00 0.00 61.98 62.87 2axl s VAL 83 Cb -0.17 -3.84 0.12 0.00 0.00 0.00 0.00 36.38 32.49 2axl s VAL 83 CO 0.06 0.05 1.45 -0.24 0.00 0.00 0.00 175.10 176.42 2axl n SER 84 N 5.56 0.74 -0.43 3.32 2.88 -1.26 -1.98 113.62 122.44 2axl n SER 84 Ca -0.05 0.25 0.02 0.00 -1.33 0.00 0.00 58.87 57.77 2axl n SER 84 Cb 0.50 -0.11 0.07 0.00 -0.75 0.00 0.00 64.21 63.92 2axl n SER 84 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 2axl n ARG 85 N -2.16 1.49 -3.58 -1.46 1.74 -1.26 -4.53 116.66 106.90 2axl n ARG 85 Ca 0.04 -0.59 -0.22 0.00 -0.77 0.00 0.00 57.85 56.31 2axl n ARG 85 Cb 0.44 -1.27 -0.16 0.00 -1.02 0.00 0.00 32.46 30.45 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 -1.67 -0.02 -0.34 -1.55 1.51 -1.23 -4.96 117.35 109.09 2axl s TYR 86 Ca 0.11 0.03 -0.09 0.00 -1.01 0.00 0.00 57.07 56.11 2axl s TYR 86 Cb 0.06 -0.51 0.01 0.00 -0.11 0.00 0.00 41.96 41.42 2axl s TYR 86 CO 0.06 -0.48 0.43 0.09 -1.11 0.00 0.00 175.55 174.54 2axl n ASN 87 N 5.30 -6.13 0.00 2.29 3.02 -1.26 0.15 115.26 118.62 2axl n ASN 87 Ca -0.06 0.29 0.02 0.00 -0.03 0.00 0.00 54.58 54.79 2axl n ASN 87 Cb 0.49 -4.06 0.07 0.00 -0.61 0.00 0.00 39.78 35.68 2axl n ASN 87 CO 0.00 0.00 0.00 1.17 -2.62 0.00 0.00 177.26 175.81 2axl n LYS 88 N -0.60 0.03 0.01 3.52 4.81 -1.26 0.16 118.16 124.82 2axl n LYS 88 Ca 0.07 0.32 -0.01 0.00 -0.87 0.00 0.00 58.31 57.82 2axl n LYS 88 Cb 0.36 -1.50 -0.00 0.00 0.02 0.00 0.00 35.03 33.90 2axl n LYS 88 CO 0.00 0.00 0.00 0.74 1.17 0.00 0.00 177.40 179.31 2axl h PHE 89 N 0.00 -0.05 -0.25 5.64 0.04 -1.96 -3.41 116.94 116.95 2axl h PHE 89 Ca 0.00 -0.00 -0.21 0.00 2.80 0.00 0.00 57.97 60.56 2axl h PHE 89 Cb 0.04 0.02 -0.21 0.00 2.20 0.00 0.00 35.95 37.99 2axl h PHE 89 CO 0.00 -0.03 -0.72 -1.33 -0.60 0.00 0.00 178.31 175.62 2axl n MET 90 N -2.83 1.96 -1.42 1.51 2.81 -0.56 -4.85 117.12 113.73 2axl n MET 90 Ca -0.01 -3.39 0.00 0.00 -1.81 0.00 0.00 57.70 52.50 2axl n MET 90 Cb 0.02 -1.57 0.00 0.00 -0.71 0.00 0.00 33.22 30.96 2axl n MET 90 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 2axl n LYS 91 N -0.72 -0.28 -1.52 0.03 4.76 0.41 -1.02 118.16 119.81 2axl n LYS 91 Ca 0.23 0.39 -0.59 0.00 -2.87 0.00 0.00 58.31 55.47 2axl n LYS 91 Cb 0.85 -0.36 -0.08 0.00 -1.84 0.00 0.00 35.03 33.60 2axl n LYS 91 CO 0.00 0.00 0.00 -0.89 -1.37 0.00 0.00 177.40 175.14 2axl n ILE 92 N 1.16 0.00 -3.34 -0.18 2.08 0.39 -3.88 119.36 115.59 2axl n ILE 92 Ca 0.00 -0.00 -0.38 0.00 0.56 0.00 0.00 62.75 62.93 2axl n ILE 92 Cb 0.11 -0.12 -0.06 0.00 -0.75 0.00 0.00 39.64 38.83 2axl n ILE 92 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 2axl s ALA 94 N 0.42 2.15 -0.07 0.00 0.00 0.10 -4.89 121.76 119.48 2axl s ALA 94 Ca 0.25 -1.24 -0.20 0.00 0.00 0.00 0.00 51.96 50.77 2axl s ALA 94 Cb -0.15 -0.43 -0.04 0.00 0.00 0.00 0.00 23.12 22.49 2axl s ALA 94 CO 0.11 0.50 0.58 -0.51 0.00 0.00 0.00 175.76 176.43 2axl s LEU 95 N -1.32 4.33 0.00 0.00 1.43 -1.26 -2.96 118.68 118.91 2axl s LEU 95 Ca 0.11 1.04 0.01 0.00 -1.03 0.00 0.00 54.13 54.25 2axl s LEU 95 Cb -0.10 -2.88 0.05 0.00 0.03 0.00 0.00 46.19 43.29 2axl s LEU 95 CO 0.02 0.00 0.35 0.35 0.23 0.00 0.00 176.35 177.31 2axl n THR 96 N 3.39 0.00 -0.13 5.49 -2.24 -1.26 -4.71 114.28 114.82 2axl n THR 96 Ca -0.05 -0.60 -0.07 0.00 -2.27 0.00 0.00 64.05 61.05 2axl n THR 96 Cb 0.51 -1.13 0.01 0.00 -2.10 0.00 0.00 70.33 67.62 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 0.49 -0.21 -0.78 1.79 -1.96 0.30 116.57 116.20 2axl h LYS 97 Ca -0.12 -0.03 -0.08 0.00 -2.18 0.00 0.00 60.65 58.24 2axl h LYS 97 Cb 0.45 -0.11 -0.00 0.00 -1.58 0.00 0.00 32.23 30.98 2axl h LYS 97 CO 0.13 0.32 -0.18 1.57 -1.08 0.00 0.00 179.45 180.22 2axl h LYS 98 N 0.51 0.50 -0.35 3.15 2.10 -1.93 -2.40 116.57 118.13 2axl h LYS 98 Ca 0.16 -0.25 -0.13 0.00 -2.00 0.00 0.00 60.65 58.43 2axl h LYS 98 Cb -0.01 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.31 2axl h LYS 98 CO -0.06 0.82 -0.31 0.78 -2.00 0.00 0.00 179.45 178.68 2axl h GLY 99 N 0.18 0.84 0.98 0.07 0.00 -1.66 0.50 103.07 103.98 2axl h GLY 99 Ca 0.04 -0.78 -0.08 0.00 0.00 0.00 0.00 47.33 46.51 2axl h GLY 99 CO 0.05 0.71 -0.05 -0.09 0.00 0.00 0.00 176.54 177.15 2axl h ARG 100 N 0.65 0.79 -0.56 4.80 2.43 -0.42 0.14 114.38 122.22 2axl h ARG 100 Ca 0.07 -0.28 -0.05 0.00 -0.81 0.00 0.00 59.98 58.91 2axl h ARG 100 Cb 0.84 -0.06 -0.03 0.00 -0.42 0.00 0.00 29.97 30.31 2axl h ARG 100 CO 0.07 0.89 0.13 -0.91 -1.51 0.00 0.00 179.97 178.64 2axl h ASN 101 N 0.62 0.80 0.14 -3.80 4.21 -1.36 0.30 115.58 116.48 2axl h ASN 101 Ca 0.11 -0.15 -0.00 0.00 1.21 0.00 0.00 56.30 57.48 2axl h ASN 101 Cb 0.57 -0.21 -0.01 0.00 -1.12 0.00 0.00 38.32 37.55 2axl h ASN 101 CO 0.03 0.79 -0.10 -0.25 -1.29 0.00 0.00 177.43 176.61 2axl h TRP 102 N 0.82 -0.25 -0.44 1.19 7.01 -0.00 0.28 115.95 124.56 2axl h TRP 102 Ca 0.18 -0.00 -0.01 0.00 2.11 0.00 0.00 58.89 61.17 2axl h TRP 102 Cb 0.30 0.09 -0.02 0.00 -2.10 0.00 0.00 29.16 27.44 2axl h TRP 102 CO 0.02 -0.15 0.24 1.25 -2.79 0.00 0.00 178.44 177.00 2axl h LEU 103 N -0.24 0.55 -0.06 0.65 5.85 0.05 -1.16 115.31 120.95 2axl h LEU 103 Ca -0.01 -0.09 -0.07 0.00 0.84 0.00 0.00 57.88 58.55 2axl h LEU 103 Cb 0.21 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.09 2axl h LEU 103 CO 0.00 0.48 -0.35 0.45 -0.34 0.00 0.00 178.44 178.69 2axl h HIS 104 N 0.57 0.00 0.03 1.25 3.86 -0.29 -3.31 115.15 117.27 2axl h HIS 104 Ca 0.15 0.00 -0.38 0.00 -1.16 0.00 0.00 60.37 58.98 2axl h HIS 104 Cb 0.06 0.00 -0.06 0.00 1.06 0.00 0.00 27.41 28.47 2axl h HIS 104 CO -0.02 0.35 -2.34 1.17 0.86 0.00 0.00 177.93 177.95 2axl n LYS 105 N -3.20 0.68 0.00 2.45 4.81 0.97 -4.33 118.16 119.54 2axl n LYS 105 Ca 0.02 0.17 0.13 0.00 -0.87 0.00 0.00 58.31 57.77 2axl n LYS 105 Cb 0.66 -1.57 0.66 0.00 0.02 0.00 0.00 35.03 34.80 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 -3.16 2.33 -0.50 3.14 0.00 -0.45 -3.95 120.51 117.92 2axl n ALA 106 Ca -0.41 -0.12 0.44 0.00 0.00 0.00 0.00 53.44 53.34 2axl n ALA 106 Cb 1.01 -1.43 0.79 0.00 0.00 0.00 0.00 19.45 19.82 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 0.00 0.00 0.00 0.00 -1.24 -1.74 -3.18 115.58 109.42 2axl h ASN 107 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.01 2axl h ASN 107 Cb 0.27 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.32 2axl h ASN 107 CO 0.00 0.00 0.00 0.41 -1.29 0.00 0.00 177.43 176.55 2axl n THR 108 N -4.07 0.00 -3.07 -3.57 -1.04 -1.25 -4.86 114.28 96.42 2axl n THR 108 Ca 0.34 0.19 -0.19 0.00 -2.04 0.00 0.00 64.05 62.34 2axl n THR 108 Cb 1.60 -0.84 -0.04 0.00 -1.82 0.00 0.00 70.33 69.23 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 -3.70 -2.82 1.02 -1.22 -5.07 120.64 109.55 2axl n GLU 109 Ca 0.00 -2.78 -0.28 0.00 -0.02 0.00 0.00 57.16 54.08 2axl n GLU 109 Cb 0.00 -1.31 -0.16 0.00 -0.02 0.00 0.00 31.44 29.95 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 -1.24 3.15 -0.42 1.62 0.01 -1.20 -5.08 113.70 110.54 2axl s SER 110 Ca 0.34 -1.01 0.03 0.00 1.31 0.00 0.00 55.95 56.62 2axl s SER 110 Cb 0.18 -0.59 0.12 0.00 0.21 0.00 0.00 66.02 65.93 2axl s SER 110 CO -0.15 -0.34 0.17 0.00 0.41 0.00 0.00 173.24 173.32 2axl s GLN 111 N 1.86 1.52 -0.16 12.44 -2.07 -1.26 -4.85 119.66 127.13 2axl s GLN 111 Ca 0.02 -2.07 -0.06 0.00 -1.82 0.00 0.00 55.36 51.43 2axl s GLN 111 Cb -0.17 -2.91 0.07 0.00 -1.09 0.00 0.00 33.01 28.91 2axl s GLN 111 CO -0.14 -1.05 0.35 -1.12 -1.32 0.00 0.00 175.29 172.00 2axl s SER 112 N 0.45 -0.09 -0.30 12.60 0.01 -1.26 -4.65 113.70 120.45 2axl s SER 112 Ca 0.14 0.81 -0.07 0.00 1.31 0.00 0.00 55.95 58.14 2axl s SER 112 Cb -0.22 0.96 0.17 0.00 0.21 0.00 0.00 66.02 67.14 2axl s SER 112 CO -0.06 -0.22 0.73 -0.22 0.41 0.00 0.00 173.24 173.88 2axl s LEU 113 N 2.25 -1.09 -0.12 2.44 2.96 -1.26 -4.96 118.68 118.90 2axl s LEU 113 Ca -0.03 0.97 -0.26 0.00 -0.22 0.00 0.00 54.13 54.59 2axl s LEU 113 Cb -0.11 2.03 -0.02 0.00 0.50 0.00 0.00 46.19 48.59 2axl s LEU 113 CO -0.11 -0.21 0.84 -0.63 -1.32 0.00 0.00 176.35 174.92 2axl s ILE 114 N 2.83 4.91 0.43 6.68 1.01 -1.26 -3.51 121.20 132.29 2axl s ILE 114 Ca 0.08 1.68 0.08 0.00 0.00 0.00 0.00 60.65 62.49 2axl s ILE 114 Cb -0.12 -4.15 0.02 0.00 0.01 0.00 0.00 42.46 38.21 2axl s ILE 114 CO -0.19 0.10 0.59 -0.76 0.00 0.00 0.00 174.94 174.68 2axl s LEU 115 N 1.66 3.60 0.28 2.97 1.43 0.39 -4.76 118.68 124.25 2axl s LEU 115 Ca 0.41 -0.47 -0.29 0.00 -1.03 0.00 0.00 54.13 52.75 2axl s LEU 115 Cb -0.18 -2.55 -0.10 0.00 0.03 0.00 0.00 46.19 43.39 2axl s LEU 115 CO 0.16 -0.81 1.31 -1.58 0.23 0.00 0.00 176.35 175.66 2axl s GLN 116 N -4.38 4.38 0.34 1.70 0.74 -1.26 -2.62 119.66 118.57 2axl s GLN 116 Ca 0.55 2.14 -0.26 0.00 0.05 0.00 0.00 55.36 57.85 2axl s GLN 116 Cb -0.09 -3.12 -0.09 0.00 1.10 0.00 0.00 33.01 30.80 2axl s GLN 116 CO 0.33 -0.20 1.02 0.00 -0.55 0.00 0.00 175.29 175.90 2axl s ALA 117 N -0.63 3.20 0.69 1.58 0.00 -0.41 -4.64 121.76 121.55 2axl s ALA 117 Ca 0.52 0.69 -0.15 0.00 0.00 0.00 0.00 51.96 53.02 2axl s ALA 117 Cb -0.38 -3.26 0.02 0.00 0.00 0.00 0.00 23.12 19.50 2axl s ALA 117 CO 0.46 -0.07 1.14 0.54 0.00 0.00 0.00 175.76 177.83 2axl s ASN 118 N -1.41 4.75 0.09 0.00 2.20 -1.26 -4.89 114.94 114.41 2axl s ASN 118 Ca 0.52 2.10 -0.15 0.00 -0.94 0.00 0.00 52.86 54.38 2axl s ASN 118 Cb -0.23 -2.56 -0.09 0.00 -2.00 0.00 0.00 41.25 36.36 2axl s ASN 118 CO 0.30 -1.88 1.41 1.05 -2.94 0.00 0.00 177.10 175.04 2axl h GLU 119 N -0.18 0.66 -4.79 3.55 4.11 -1.95 -3.35 114.58 112.64 2axl h GLU 119 Ca -0.47 -0.35 -0.73 0.00 0.07 0.00 0.00 59.36 57.89 2axl h GLU 119 Cb 1.26 0.01 -0.15 0.00 0.50 0.00 0.00 28.75 30.38 2axl h GLU 119 CO 0.52 0.96 1.73 0.39 0.07 0.00 0.00 179.01 182.68 2axl n GLU 120 N -4.30 3.34 0.11 1.06 1.02 -1.26 -4.75 120.64 115.86 2axl n GLU 120 Ca -0.04 -3.62 -0.03 0.00 -0.02 0.00 0.00 57.16 53.45 2axl n GLU 120 Cb 0.46 -3.14 0.05 0.00 -0.02 0.00 0.00 31.44 28.79 2axl n GLU 120 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 2axl h LEU 121 N 10.10 0.00 -6.53 -4.62 3.38 -1.99 -3.44 115.31 112.21 2axl h LEU 121 Ca 0.37 0.00 0.01 0.00 0.09 0.00 0.00 57.88 58.35 2axl h LEU 121 Cb 0.82 0.00 -0.24 0.00 0.09 0.00 0.00 40.66 41.34 2axl h LEU 121 CO 1.38 0.75 -0.29 0.00 0.09 0.00 0.00 178.44 180.37 2axl n PRO 123 N 5.42 0.71 0.00 0.00 -0.04 -1.26 -3.29 135.00 136.54 2axl n PRO 123 Ca -0.06 0.01 0.14 0.00 -0.04 0.00 0.00 63.50 63.55 2axl n PRO 123 Cb 0.50 -1.50 0.52 0.00 -0.04 0.00 0.00 33.50 32.98 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 -1.06 0.41 -0.07 0.54 5.02 -1.26 -3.61 118.16 118.14 2axl n LYS 124 Ca 0.18 -0.16 0.01 0.00 -2.02 0.00 0.00 58.31 56.33 2axl n LYS 124 Cb 0.11 -1.50 0.05 0.00 -0.02 0.00 0.00 35.03 33.67 2axl n LYS 124 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2axl n LYS 125 N -1.16 1.31 -2.98 1.97 4.01 -1.21 -4.59 118.16 115.52 2axl n LYS 125 Ca 0.11 -0.38 -0.44 0.00 -0.51 0.00 0.00 58.31 57.09 2axl n LYS 125 Cb 0.31 -1.21 -0.01 0.00 -0.51 0.00 0.00 35.03 33.61 2axl n LYS 125 CO 0.00 0.00 0.00 -1.17 -1.11 0.00 0.00 177.40 175.12 2axl s LEU 126 N -0.85 5.18 -0.07 -0.35 2.96 -1.24 -5.00 118.68 119.32 2axl s LEU 126 Ca 0.07 -2.79 -0.12 0.00 -0.22 0.00 0.00 54.13 51.07 2axl s LEU 126 Cb 0.04 -2.38 -0.05 0.00 0.50 0.00 0.00 46.19 44.30 2axl s LEU 126 CO 0.04 -0.79 0.30 -1.48 -1.32 0.00 0.00 176.35 173.10 2axl s LEU 127 N 1.63 4.40 -0.40 -0.68 2.34 -1.26 -5.04 118.68 119.67 2axl s LEU 127 Ca 0.39 0.73 0.06 0.00 0.06 0.00 0.00 54.13 55.37 2axl s LEU 127 Cb -0.04 -2.39 0.22 0.00 -0.56 0.00 0.00 46.19 43.42 2axl s LEU 127 CO -0.03 0.31 0.47 0.18 -1.06 0.00 0.00 176.35 176.21 2axl n LEU 128 N 2.21 -0.30 -4.77 1.48 4.77 -1.26 -5.12 117.00 114.01 2axl n LEU 128 Ca -0.15 -4.47 -0.40 0.00 -0.03 0.00 0.00 56.01 50.96 2axl n LEU 128 Cb 0.53 0.61 0.01 0.00 -2.33 0.00 0.00 43.42 42.25 2axl n LEU 128 CO 0.36 1.98 1.09 -2.84 -1.33 0.00 0.00 177.39 176.65 2axl s PRO 129 N -0.56 3.76 -0.25 3.23 0.02 -1.26 -4.99 135.00 134.95 2axl s PRO 129 Ca 0.34 2.46 -0.12 0.00 0.02 0.00 0.00 61.00 63.70 2axl s PRO 129 Cb 0.12 -2.72 -0.05 0.00 0.02 0.00 0.00 34.50 31.87 2axl s PRO 129 CO -0.15 -0.77 0.22 0.45 -0.33 0.00 0.00 177.00 176.42 2axl s SER 130 N -0.42 6.15 -0.32 2.53 0.15 -1.26 -5.02 113.70 115.50 2axl s SER 130 Ca 0.59 0.15 -0.28 0.00 0.70 0.00 0.00 55.95 57.12 2axl s SER 130 Cb -0.45 -2.14 -0.02 0.00 -1.71 0.00 0.00 66.02 61.71 2axl s SER 130 CO 0.58 -0.01 1.83 -0.94 1.20 0.00 0.00 173.24 175.91 2axl s SER 131 N 1.28 5.84 -0.04 5.45 1.04 -1.26 -4.97 113.70 121.04 2axl s SER 131 Ca 0.10 1.33 -0.08 0.00 0.48 0.00 0.00 55.95 57.78 2axl s SER 131 Cb -0.14 -2.52 -0.05 0.00 0.10 0.00 0.00 66.02 63.40 2axl s SER 131 CO 0.07 -1.74 0.25 -1.59 0.98 0.00 0.00 173.24 171.21 2axl s LYS 132 N 5.74 3.60 0.30 4.02 -2.85 -1.26 -5.10 119.74 124.19 2axl s LYS 132 Ca 0.81 0.01 -0.02 0.00 -1.00 0.00 0.00 55.97 55.77 2axl s LYS 132 Cb -0.23 -3.15 -0.04 0.00 -2.06 0.00 0.00 37.83 32.35 2axl s LYS 132 CO 0.33 0.71 0.53 -0.08 0.10 0.00 0.00 175.35 176.94 2axl s THR 133 N -1.16 5.09 -0.11 3.79 -1.32 -1.26 -5.07 115.64 115.61 2axl s THR 133 Ca 0.22 -0.23 -0.21 0.00 -1.21 0.00 0.00 61.69 60.27 2axl s THR 133 Cb -0.13 -3.79 -0.04 0.00 -1.51 0.00 0.00 72.50 67.03 2axl s THR 133 CO 0.11 -0.40 0.60 0.54 -2.21 0.00 0.00 174.62 173.26 2axl s VAL 134 N -2.15 5.10 0.00 5.08 0.11 -1.26 -5.00 120.40 122.28 2axl s VAL 134 Ca 0.41 1.21 0.00 0.00 -2.93 0.00 0.00 61.98 60.67 2axl s VAL 134 Cb -0.10 -3.94 0.00 0.00 -1.53 0.00 0.00 36.38 30.81 2axl s VAL 134 CO 0.33 0.26 0.00 -0.24 -3.33 0.00 0.00 175.10 172.12 2axl n SER 135 N 3.93 0.00 -4.75 3.54 2.88 -1.26 -4.88 113.62 113.07 2axl n SER 135 Ca -0.04 0.14 -0.30 0.00 -1.33 0.00 0.00 58.87 57.35 2axl n SER 135 Cb 0.51 -0.37 0.11 0.00 -0.75 0.00 0.00 64.21 63.71 2axl n SER 135 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2axl s SER 136 N -2.92 4.09 0.00 -3.46 1.04 -1.26 -3.70 113.70 107.48 2axl s SER 136 Ca 0.00 1.58 0.00 0.00 0.48 0.00 0.00 55.95 58.01 2axl s SER 136 Cb 0.00 -2.29 0.00 0.00 0.10 0.00 0.00 66.02 63.83 2axl s SER 136 CO 0.00 -2.26 0.00 0.61 0.98 0.00 0.00 173.24 172.57 2axl n GLY 137 N -1.34 0.70 3.72 7.32 0.00 -1.26 -5.03 105.19 109.30 2axl n GLY 137 Ca 0.08 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.71 2axl n GLY 137 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2axl s THR 138 N -2.36 5.10 -0.24 2.61 -1.32 -1.24 -5.03 115.64 113.16 2axl s THR 138 Ca 0.00 1.24 -0.03 0.00 -1.21 0.00 0.00 61.69 61.69 2axl s THR 138 Cb 0.00 -3.95 0.11 0.00 -1.51 0.00 0.00 72.50 67.16 2axl s THR 138 CO 0.00 0.27 0.27 -0.54 -2.21 0.00 0.00 174.62 172.42 2axl s LYS 139 N 0.78 0.26 -0.22 7.08 -0.14 -1.26 -5.01 119.74 121.24 2axl s LYS 139 Ca 0.33 0.17 0.01 0.00 -1.36 0.00 0.00 55.97 55.11 2axl s LYS 139 Cb -0.17 -0.91 0.23 0.00 -1.68 0.00 0.00 37.83 35.31 2axl s LYS 139 CO 0.15 -0.76 1.65 0.39 -0.76 0.00 0.00 175.35 176.01 2axl n GLU 140 N 5.33 1.57 0.06 1.68 4.71 -1.26 -4.48 120.64 128.25 2axl n GLU 140 Ca -0.04 -1.25 -0.13 0.00 -0.01 0.00 0.00 57.16 55.74 2axl n GLU 140 Cb 0.49 -1.49 -0.08 0.00 -1.01 0.00 0.00 31.44 29.35 2axl n GLU 140 CO 0.00 0.00 0.00 1.25 0.09 0.00 0.00 177.13 178.47 2axl h HIS 141 N 0.83 -0.11 -0.42 -0.32 2.76 -1.95 -3.13 115.15 112.82 2axl h HIS 141 Ca 0.25 -0.00 -0.11 0.00 -2.20 0.00 0.00 60.37 58.31 2axl h HIS 141 Cb 1.39 0.04 -0.01 0.00 1.55 0.00 0.00 27.41 30.38 2axl h HIS 141 CO 0.67 0.11 -0.16 0.00 -1.30 0.00 0.00 177.93 177.24 2axl s TYR 143 N -4.69 3.49 0.00 0.00 1.51 -1.18 -5.29 117.35 111.19 2axl s TYR 143 Ca -0.12 1.24 0.00 0.00 -1.01 0.00 0.00 57.07 57.18 2axl s TYR 143 Cb 0.11 -2.62 0.00 0.00 -0.11 0.00 0.00 41.96 39.34 2axl s TYR 143 CO 0.84 -0.31 0.00 0.09 -1.11 0.00 0.00 175.55 175.06