#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 0.14 7.83 8.00 -1.26 -3.31 116.55 127.96 2axl n ASP 2 Ca 0.00 -0.48 0.12 0.00 0.71 0.00 0.00 54.79 55.14 2axl n ASP 2 Cb 0.00 -0.17 0.52 0.00 -0.02 0.00 0.00 41.12 41.45 2axl n ASP 2 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 2axl n ASP 3 N -1.17 0.66 -4.55 -2.24 8.00 -1.26 -4.57 116.55 111.41 2axl n ASP 3 Ca 0.18 0.70 -0.28 0.00 0.71 0.00 0.00 54.79 56.10 2axl n ASP 3 Cb 0.19 -0.82 -0.05 0.00 -0.02 0.00 0.00 41.12 40.41 2axl n ASP 3 CO 0.00 0.00 0.00 -0.24 -0.39 0.00 0.00 177.20 176.57 2axl n SER 4 N -2.26 1.99 -4.78 -2.24 2.88 -1.21 -4.90 113.62 103.10 2axl n SER 4 Ca 0.01 -0.83 -0.37 0.00 -1.33 0.00 0.00 58.87 56.34 2axl n SER 4 Cb 0.18 -1.57 -0.04 0.00 -0.75 0.00 0.00 64.21 62.03 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 8.52 4.23 0.00 -1.46 2.56 -1.26 -4.94 118.70 126.34 2axl s GLU 5 Ca 0.98 1.60 0.00 0.00 0.00 0.00 0.00 54.97 57.55 2axl s GLU 5 Cb -0.21 -2.66 0.00 0.00 2.00 0.00 0.00 34.13 33.26 2axl s GLU 5 CO 0.21 -0.11 0.00 -0.25 -0.56 0.00 0.00 175.26 174.56 2axl n ASP 6 N 0.15 0.00 -4.29 -1.70 8.00 -1.26 -5.01 116.55 112.44 2axl n ASP 6 Ca 0.04 -0.65 -0.25 0.00 0.71 0.00 0.00 54.79 54.64 2axl n ASP 6 Cb 0.48 0.00 -0.13 0.00 -0.02 0.00 0.00 41.12 41.45 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 -0.01 1.79 -0.30 -3.53 -1.32 -1.26 -4.39 115.64 106.62 2axl s THR 7 Ca 0.00 -1.45 -0.11 0.00 -1.21 0.00 0.00 61.69 58.92 2axl s THR 7 Cb 0.00 -1.60 0.16 0.00 -1.51 0.00 0.00 72.50 69.56 2axl s THR 7 CO 0.00 0.07 0.85 -0.44 -2.21 0.00 0.00 174.62 172.89 2axl s SER 8 N -1.65 -0.84 0.00 8.08 0.01 -1.17 -0.84 113.70 117.29 2axl s SER 8 Ca 0.08 0.89 0.00 0.00 1.31 0.00 0.00 55.95 58.23 2axl s SER 8 Cb -0.10 1.85 0.00 0.00 0.21 0.00 0.00 66.02 67.98 2axl s SER 8 CO 0.04 -0.16 0.00 -2.67 0.41 0.00 0.00 173.24 170.86 2axl n TRP 9 N 5.26 0.00 -3.25 2.43 4.27 -1.11 -4.73 117.44 120.31 2axl n TRP 9 Ca -0.08 0.00 -0.42 0.00 -3.89 0.00 0.00 57.50 53.11 2axl n TRP 9 Cb 0.52 0.00 -0.08 0.00 -1.36 0.00 0.00 31.31 30.39 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 6.25 -0.41 -0.67 -1.08 -1.26 0.15 116.67 119.65 2axl s ASP 10 Ca 0.00 -0.41 0.11 0.00 -0.52 0.00 0.00 52.55 51.74 2axl s ASP 10 Cb 0.00 -2.26 0.38 0.00 -1.46 0.00 0.00 42.92 39.58 2axl s ASP 10 CO 0.00 -0.59 0.86 0.33 0.52 0.00 0.00 175.17 176.29 2axl n PHE 11 N 5.79 1.52 -0.18 -5.34 7.35 -1.23 -4.87 117.46 120.51 2axl n PHE 11 Ca -0.05 -3.58 -0.09 0.00 -0.76 0.00 0.00 57.45 52.97 2axl n PHE 11 Cb 0.48 -0.39 0.01 0.00 0.35 0.00 0.00 39.48 39.92 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 2.96 0.91 -0.01 7.13 0.00 -1.92 -3.21 103.07 108.92 2axl h GLY 12 Ca 0.08 -0.60 0.00 0.00 0.00 0.00 0.00 47.33 46.82 2axl h GLY 12 CO 0.60 0.55 -0.01 -1.05 0.00 0.00 0.00 176.54 176.64 2axl n PRO 13 N -4.41 -0.01 0.21 4.80 -0.02 -1.26 0.32 135.00 134.64 2axl n PRO 13 Ca 0.01 0.61 0.05 0.00 -2.02 0.00 0.00 63.50 62.16 2axl n PRO 13 Cb 0.25 -0.92 0.51 0.00 -0.02 0.00 0.00 33.50 33.33 2axl n PRO 13 CO 0.00 0.00 0.00 1.96 1.98 0.00 0.00 175.50 179.44 2axl h GLN 14 N 0.00 0.05 0.15 -0.52 4.20 -1.96 1.33 115.11 118.35 2axl h GLN 14 Ca 0.00 -0.01 -0.30 0.00 0.06 0.00 0.00 58.65 58.40 2axl h GLN 14 Cb 0.01 -0.01 0.03 0.00 0.30 0.00 0.00 27.48 27.80 2axl h GLN 14 CO -0.01 0.17 -1.29 0.00 -0.67 0.00 0.00 178.83 177.03 2axl h ALA 15 N 1.83 -0.01 -0.15 3.87 0.00 0.29 1.21 119.26 126.30 2axl h ALA 15 Ca 0.01 -0.81 -0.10 0.00 0.00 0.00 0.00 54.91 54.01 2axl h ALA 15 Cb 0.25 0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.15 2axl h ALA 15 CO 0.02 0.74 -0.30 0.74 0.00 0.00 0.00 179.25 180.45 2axl h PHE 16 N 0.21 0.59 -0.42 0.00 0.04 0.57 -1.49 116.94 116.44 2axl h PHE 16 Ca -0.19 -0.21 -0.08 0.00 2.80 0.00 0.00 57.97 60.28 2axl h PHE 16 Cb 1.97 -0.11 -0.02 0.00 2.20 0.00 0.00 35.95 40.00 2axl h PHE 16 CO 0.11 0.92 -0.08 0.87 -0.60 0.00 0.00 178.31 179.53 2axl h LYS 17 N 0.09 0.73 -0.53 1.51 1.57 0.17 -1.44 116.57 118.67 2axl h LYS 17 Ca 0.01 -0.22 0.00 0.00 -1.87 0.00 0.00 60.65 58.57 2axl h LYS 17 Cb 0.89 -0.07 -0.03 0.00 0.08 0.00 0.00 32.23 33.10 2axl h LYS 17 CO 0.07 0.80 0.35 1.25 -0.57 0.00 0.00 179.45 181.35 2axl h LEU 18 N 0.67 0.62 -0.60 2.94 6.46 0.18 -1.82 115.31 123.75 2axl h LEU 18 Ca 0.12 -0.02 -0.00 0.00 -0.12 0.00 0.00 57.88 57.86 2axl h LEU 18 Cb 0.53 -0.15 -0.03 0.00 -0.73 0.00 0.00 40.66 40.28 2axl h LEU 18 CO 0.03 0.45 0.37 -0.07 -0.62 0.00 0.00 178.44 178.60 2axl h LEU 19 N 0.72 0.71 -0.64 2.25 3.38 -0.55 -2.73 115.31 118.46 2axl h LEU 19 Ca 0.20 -0.05 -0.15 0.00 0.09 0.00 0.00 57.88 57.97 2axl h LEU 19 Cb -0.08 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.48 2axl h LEU 19 CO -0.04 0.55 -0.62 -1.28 0.09 0.00 0.00 178.44 177.15 2axl h SER 20 N 0.81 0.25 -0.55 -0.43 0.87 -0.74 -3.11 113.55 110.65 2axl h SER 20 Ca 0.22 -0.15 -0.06 0.00 -1.23 0.00 0.00 61.79 60.57 2axl h SER 20 Cb -0.03 -0.07 -0.02 0.00 -0.44 0.00 0.00 62.40 61.83 2axl h SER 20 CO -0.04 0.81 0.12 0.00 -0.53 0.00 0.00 176.83 177.19 2axl h ALA 21 N 1.19 0.73 -0.76 6.23 0.00 -1.16 -0.21 119.26 125.30 2axl h ALA 21 Ca -0.01 -0.23 0.01 0.00 0.00 0.00 0.00 54.91 54.69 2axl h ALA 21 Cb 1.12 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 18.66 2axl h ALA 21 CO 0.09 0.44 0.50 -0.39 0.00 0.00 0.00 179.25 179.89 2axl h VAL 22 N 0.79 1.17 -0.43 0.00 -1.51 -1.52 0.41 116.25 115.17 2axl h VAL 22 Ca 0.17 -0.34 0.01 0.00 -1.23 0.00 0.00 66.70 65.31 2axl h VAL 22 Cb 0.36 0.08 -0.02 0.00 -2.13 0.00 0.00 31.29 29.58 2axl h VAL 22 CO 0.00 0.18 0.27 -0.78 -1.23 0.00 0.00 177.57 176.02 2axl h ASP 23 N 1.00 0.46 -0.76 4.19 3.58 -1.39 0.57 116.42 124.08 2axl h ASP 23 Ca 0.28 -0.01 -0.00 0.00 0.42 0.00 0.00 57.03 57.72 2axl h ASP 23 Cb -0.08 -0.11 -0.04 0.00 1.72 0.00 0.00 39.33 40.82 2axl h ASP 23 CO -0.07 0.33 0.46 0.40 -2.88 0.00 0.00 179.24 177.48 2axl h ILE 24 N 0.56 1.21 0.00 2.25 1.08 -0.03 0.72 117.51 123.29 2axl h ILE 24 Ca 0.16 -0.47 0.00 0.00 -0.39 0.00 0.00 64.86 64.16 2axl h ILE 24 Cb -0.04 0.16 0.00 0.00 -3.07 0.00 0.00 36.82 33.87 2axl h ILE 24 CO -0.05 0.22 0.00 0.18 -0.69 0.00 0.00 178.15 177.81 2axl n LEU 25 N -4.50 0.00 -1.39 1.44 4.77 0.04 -4.76 117.00 112.59 2axl n LEU 25 Ca 0.07 0.10 -0.15 0.00 -0.03 0.00 0.00 56.01 56.00 2axl n LEU 25 Cb 0.05 -0.10 -0.04 0.00 -2.33 0.00 0.00 43.42 41.01 2axl n LEU 25 CO 0.37 -0.07 -0.16 0.61 -1.33 0.00 0.00 177.39 176.81 2axl n GLY 26 N -0.41 0.68 3.26 -0.72 0.00 0.25 -2.80 105.19 105.45 2axl n GLY 26 Ca 0.07 -0.30 0.00 0.00 0.00 0.00 0.00 46.02 45.79 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 -2.50 -1.28 -0.01 1.61 1.02 0.18 -4.80 120.64 114.86 2axl n GLU 27 Ca -0.16 0.32 0.00 0.00 -0.02 0.00 0.00 57.16 57.30 2axl n GLU 27 Cb 0.55 -4.72 0.01 0.00 -0.02 0.00 0.00 31.44 27.26 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 -0.12 1.05 -4.44 3.49 4.76 -1.12 -4.76 118.16 117.02 2axl n LYS 28 Ca 0.00 -0.05 -0.32 0.00 -2.87 0.00 0.00 58.31 55.07 2axl n LYS 28 Cb 0.32 -1.31 -0.10 0.00 -1.84 0.00 0.00 35.03 32.09 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 -1.40 2.89 0.00 2.13 0.40 -1.26 -5.09 117.98 115.64 2axl s PHE 29 Ca 0.01 -0.04 0.00 0.00 -0.60 0.00 0.00 56.93 56.30 2axl s PHE 29 Cb 0.01 -1.60 0.00 0.00 0.51 0.00 0.00 43.02 41.93 2axl s PHE 29 CO 0.00 0.38 0.00 0.41 0.70 0.00 0.00 175.22 176.71 2axl n GLY 30 N 1.51 1.69 0.14 4.36 0.00 -1.26 -3.78 105.19 107.85 2axl n GLY 30 Ca -0.15 -1.79 -0.21 0.00 0.00 0.00 0.00 46.02 43.87 2axl n GLY 30 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 2axl n ILE 31 N 0.00 1.75 -0.04 -0.61 3.06 0.56 -4.34 119.36 119.73 2axl n ILE 31 Ca 0.00 -0.63 -0.14 0.00 -2.50 0.00 0.00 62.75 59.48 2axl n ILE 31 Cb 0.00 -1.72 -0.08 0.00 0.54 0.00 0.00 39.64 38.38 2axl n ILE 31 CO 0.00 0.00 0.00 1.23 -2.50 0.00 0.00 176.55 175.28 2axl h GLY 32 N 1.10 0.45 0.89 4.50 0.00 -1.88 -2.18 103.07 105.95 2axl h GLY 32 Ca -0.44 -0.54 -0.01 0.00 0.00 0.00 0.00 47.33 46.34 2axl h GLY 32 CO 0.06 0.49 0.08 -2.00 0.00 0.00 0.00 176.54 175.16 2axl h LEU 33 N -0.01 0.26 0.20 3.11 5.85 -1.94 -3.21 115.31 119.58 2axl h LEU 33 Ca -0.00 -0.16 -0.32 0.00 0.84 0.00 0.00 57.88 58.24 2axl h LEU 33 Cb 0.88 -0.07 0.02 0.00 0.37 0.00 0.00 40.66 41.87 2axl h LEU 33 CO 0.06 0.35 -1.46 1.55 -0.34 0.00 0.00 178.44 178.60 2axl h PRO 34 N 0.15 0.43 -0.68 5.25 0.13 -1.76 -3.19 132.00 132.33 2axl h PRO 34 Ca 0.06 -0.73 0.14 0.00 -0.87 0.00 0.00 66.00 64.61 2axl h PRO 34 Cb 0.17 0.27 -0.10 0.00 0.13 0.00 0.00 31.00 31.47 2axl h PRO 34 CO -0.01 1.34 0.15 0.97 -0.23 0.00 0.00 178.00 180.22 2axl h ILE 35 N 0.12 0.55 -0.47 -3.56 2.10 -1.48 0.21 117.51 114.98 2axl h ILE 35 Ca -0.24 -0.09 0.01 0.00 1.08 0.00 0.00 64.86 65.63 2axl h ILE 35 Cb 2.10 0.28 -0.03 0.00 -1.09 0.00 0.00 36.82 38.08 2axl h ILE 35 CO 0.24 0.05 0.30 -0.07 -1.08 0.00 0.00 178.15 177.58 2axl h LEU 36 N 0.26 0.50 -0.48 2.19 3.38 -1.66 -3.11 115.31 116.40 2axl h LEU 36 Ca 0.37 -0.01 -0.17 0.00 0.09 0.00 0.00 57.88 58.17 2axl h LEU 36 Cb 0.61 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.23 2axl h LEU 36 CO -0.48 0.36 -0.72 0.15 0.09 0.00 0.00 178.44 177.84 2axl h PHE 37 N 0.61 0.35 -0.99 1.13 3.57 -0.69 -3.16 116.94 117.76 2axl h PHE 37 Ca 0.18 -0.16 0.01 0.00 3.53 0.00 0.00 57.97 61.54 2axl h PHE 37 Cb -0.03 -0.05 -0.05 0.00 2.79 0.00 0.00 35.95 38.60 2axl h PHE 37 CO -0.05 0.89 0.66 -0.07 -2.23 0.00 0.00 178.31 177.50 2axl h LEU 38 N 0.17 1.13 0.00 0.59 3.38 -0.84 -2.20 115.31 117.55 2axl h LEU 38 Ca -0.02 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.92 2axl h LEU 38 Cb 1.28 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 41.75 2axl h LEU 38 CO 0.11 0.82 0.00 0.54 0.09 0.00 0.00 178.44 180.00 2axl n ARG 39 N -4.39 0.15 -2.80 1.13 1.74 -1.19 0.30 116.66 111.60 2axl n ARG 39 Ca 0.12 0.00 -0.10 0.00 -0.77 0.00 0.00 57.85 57.09 2axl n ARG 39 Cb 0.02 -1.16 0.05 0.00 -1.02 0.00 0.00 32.46 30.35 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 -0.46 -0.18 3.72 -0.13 0.00 -0.83 -4.35 105.19 102.96 2axl n GLY 40 Ca 0.01 0.02 -0.32 0.00 0.00 0.00 0.00 46.02 45.73 2axl n GLY 40 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2axl s SER 41 N -3.65 3.81 -0.62 1.61 1.04 -1.23 -4.87 113.70 109.79 2axl s SER 41 Ca 0.10 2.12 -0.26 0.00 0.48 0.00 0.00 55.95 58.38 2axl s SER 41 Cb -0.01 -2.56 -0.02 0.00 0.10 0.00 0.00 66.02 63.53 2axl s SER 41 CO 0.46 -2.51 1.86 0.21 0.98 0.00 0.00 173.24 174.25 2axl s ASN 42 N -2.71 5.27 -0.32 7.02 3.84 -1.26 -4.81 114.94 121.97 2axl s ASN 42 Ca 0.67 0.32 0.03 0.00 0.21 0.00 0.00 52.86 54.09 2axl s ASN 42 Cb -0.23 -2.53 0.19 0.00 -0.55 0.00 0.00 41.25 38.14 2axl s ASN 42 CO 0.53 -2.38 0.69 -0.55 -2.79 0.00 0.00 177.10 172.60 2axl s SER 43 N 8.08 -1.38 0.10 -4.21 0.15 -1.26 -5.05 113.70 110.13 2axl s SER 43 Ca 0.67 -0.10 -0.11 0.00 0.70 0.00 0.00 55.95 57.11 2axl s SER 43 Cb -0.12 1.83 -0.16 0.00 -1.71 0.00 0.00 66.02 65.86 2axl s SER 43 CO 0.20 -0.22 1.27 -0.61 1.20 0.00 0.00 173.24 175.09 2axl h GLN 44 N 7.50 0.68 -0.87 5.44 5.75 -1.98 -2.96 115.11 128.67 2axl h GLN 44 Ca -0.01 -0.64 -0.02 0.00 -0.15 0.00 0.00 58.65 57.84 2axl h GLN 44 Cb 1.19 0.16 -0.04 0.00 1.07 0.00 0.00 27.48 29.86 2axl h GLN 44 CO 0.09 1.24 0.48 -0.09 -2.65 0.00 0.00 178.83 177.91 2axl h ARG 45 N 0.43 1.21 -0.00 1.69 2.43 -2.00 -1.59 114.38 116.55 2axl h ARG 45 Ca -0.08 -0.14 0.00 0.00 -0.81 0.00 0.00 59.98 58.95 2axl h ARG 45 Cb 1.53 -0.24 0.00 0.00 -0.42 0.00 0.00 29.97 30.84 2axl h ARG 45 CO 0.17 0.88 -0.12 1.28 -1.51 0.00 0.00 179.97 180.68 2axl n LEU 46 N -4.36 0.32 0.08 3.80 4.77 -1.25 -3.14 117.00 117.21 2axl n LEU 46 Ca 0.09 0.13 0.12 0.00 -0.03 0.00 0.00 56.01 56.32 2axl n LEU 46 Cb 0.09 -0.26 0.04 0.00 -2.33 0.00 0.00 43.42 40.97 2axl n LEU 46 CO 0.39 0.06 0.08 0.00 -1.33 0.00 0.00 177.39 176.59 2axl n ALA 47 N -1.16 2.79 -0.03 -1.18 0.00 -0.64 -2.64 120.51 117.65 2axl n ALA 47 Ca 0.12 -0.27 -0.17 0.00 0.00 0.00 0.00 53.44 53.12 2axl n ALA 47 Cb 0.29 -1.09 -0.14 0.00 0.00 0.00 0.00 19.45 18.51 2axl n ALA 47 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2axl n ASP 48 N -2.39 1.67 -0.02 0.00 8.00 -0.97 -3.67 116.55 119.16 2axl n ASP 48 Ca 0.01 0.20 -0.00 0.00 0.71 0.00 0.00 54.79 55.71 2axl n ASP 48 Cb 0.50 -0.49 -0.00 0.00 -0.02 0.00 0.00 41.12 41.11 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 0.04 -0.03 -1.54 -1.24 1.08 -1.70 -3.32 115.11 108.41 2axl h GLN 49 Ca -0.42 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 56.78 2axl h GLN 49 Cb 2.03 0.01 0.00 0.00 -0.05 0.00 0.00 27.48 29.46 2axl h GLN 49 CO 0.06 -0.02 0.00 0.66 -0.95 0.00 0.00 178.83 178.58 2axl n TYR 50 N -4.06 0.00 -0.02 2.96 4.01 -1.08 -4.36 117.16 114.60 2axl n TYR 50 Ca -0.00 -0.75 0.00 0.00 -0.16 0.00 0.00 57.90 56.99 2axl n TYR 50 Cb 0.01 -0.38 0.31 0.00 -0.31 0.00 0.00 39.34 38.97 2axl n TYR 50 CO 0.00 0.00 0.00 0.07 -0.46 0.00 0.00 176.86 176.47 2axl h ARG 51 N 0.58 0.58 0.00 -0.72 0.11 -1.66 -2.56 114.38 110.70 2axl h ARG 51 Ca 0.00 -0.10 -0.00 0.00 0.10 0.00 0.00 59.98 59.98 2axl h ARG 51 Cb 0.98 -0.10 -0.00 0.00 1.11 0.00 0.00 29.97 31.96 2axl h ARG 51 CO 0.00 0.54 -0.00 0.00 0.10 0.00 0.00 179.97 180.61 2axl h ARG 52 N 0.57 0.00 -5.04 0.08 2.47 -1.90 -3.41 114.38 107.15 2axl h ARG 52 Ca 0.13 0.00 -0.37 0.00 -1.26 0.00 0.00 59.98 58.48 2axl h ARG 52 Cb 0.23 0.00 -0.10 0.00 -1.65 0.00 0.00 29.97 28.45 2axl h ARG 52 CO -0.00 0.00 1.83 1.58 0.56 0.00 0.00 179.97 183.93 2axl n HIS 53 N -4.39 0.25 -0.16 3.04 -0.00 -0.97 -4.76 115.22 108.23 2axl n HIS 53 Ca -0.03 0.10 -0.08 0.00 0.46 0.00 0.00 57.72 58.17 2axl n HIS 53 Cb 0.09 -1.17 0.01 0.00 -0.12 0.00 0.00 29.99 28.80 2axl n HIS 53 CO 0.00 0.00 0.00 1.03 0.46 0.00 0.00 176.34 177.83 2axl h SER 54 N 11.58 0.59 0.07 0.26 0.87 -1.90 -2.17 113.55 122.87 2axl h SER 54 Ca 0.01 -0.11 0.00 0.00 -1.23 0.00 0.00 61.79 60.46 2axl h SER 54 Cb 1.17 -0.15 0.00 0.00 -0.44 0.00 0.00 62.40 62.98 2axl h SER 54 CO 1.52 0.53 0.00 0.18 -0.53 0.00 0.00 176.83 178.53 2axl n LEU 55 N -4.66 0.00 -4.68 2.23 4.77 -1.26 -4.71 117.00 108.69 2axl n LEU 55 Ca 0.01 0.32 -0.47 0.00 -0.03 0.00 0.00 56.01 55.85 2axl n LEU 55 Cb 0.10 -0.32 -0.04 0.00 -2.33 0.00 0.00 43.42 40.82 2axl n LEU 55 CO 0.36 -0.29 1.53 0.33 -1.33 0.00 0.00 177.39 178.00 2axl n PHE 56 N -1.32 2.39 -0.90 -1.77 7.35 -0.82 -2.42 117.46 119.97 2axl n PHE 56 Ca 0.01 -0.12 0.00 0.00 -0.76 0.00 0.00 57.45 56.58 2axl n PHE 56 Cb 0.03 -2.71 0.00 0.00 0.35 0.00 0.00 39.48 37.15 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 4.46 0.66 0.07 7.13 0.00 0.87 -4.75 105.19 113.63 2axl n GLY 57 Ca 0.22 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.36 2axl n GLY 57 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2axl h THR 58 N 0.00 0.00 0.00 2.61 2.02 -1.48 -3.06 112.91 113.00 2axl h THR 58 Ca 0.00 -0.53 0.00 0.00 0.77 0.00 0.00 66.41 66.65 2axl h THR 58 Cb 0.06 1.08 0.00 0.00 -1.74 0.00 0.00 68.15 67.55 2axl h THR 58 CO 0.00 0.00 0.00 0.61 0.37 0.00 0.00 175.52 176.50 2axl n GLY 59 N 1.33 -0.97 0.30 2.16 0.00 -1.24 -3.60 105.19 103.16 2axl n GLY 59 Ca 0.03 -0.19 -0.01 0.00 0.00 0.00 0.00 46.02 45.85 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 0.70 0.00 1.61 3.64 -1.70 -2.17 116.57 118.65 2axl h LYS 60 Ca 0.00 -0.12 0.00 0.00 -1.27 0.00 0.00 60.65 59.26 2axl h LYS 60 Cb 0.00 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 31.70 2axl h LYS 60 CO 0.00 0.62 0.00 -0.40 -2.27 0.00 0.00 179.45 177.40 2axl n ASP 61 N -4.32 0.00 -4.71 4.20 5.75 -1.24 -4.73 116.55 111.51 2axl n ASP 61 Ca 0.03 0.37 -0.33 0.00 -0.01 0.00 0.00 54.79 54.85 2axl n ASP 61 Cb 0.19 -0.44 -0.09 0.00 -1.03 0.00 0.00 41.12 39.76 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 -2.87 2.88 0.86 0.11 -0.21 -0.82 -5.10 119.66 114.51 2axl s GLN 62 Ca 0.10 -0.54 -0.12 0.00 0.02 0.00 0.00 55.36 54.81 2axl s GLN 62 Cb 0.10 -2.74 0.11 0.00 1.00 0.00 0.00 33.01 31.48 2axl s GLN 62 CO 0.27 0.64 1.11 0.95 -2.12 0.00 0.00 175.29 176.14 2axl s THR 63 N -1.07 2.58 0.16 -0.19 -4.23 -1.26 -4.93 115.64 106.69 2axl s THR 63 Ca 0.19 0.19 -0.15 0.00 -1.18 0.00 0.00 61.69 60.74 2axl s THR 63 Cb -0.12 -2.90 0.04 0.00 1.34 0.00 0.00 72.50 70.86 2axl s THR 63 CO 0.10 -0.24 1.79 -0.08 -0.54 0.00 0.00 174.62 175.64 2axl h GLU 64 N -1.32 0.45 0.00 3.99 4.57 -1.98 -2.84 114.58 117.45 2axl h GLU 64 Ca -0.49 -0.03 -0.05 0.00 -1.18 0.00 0.00 59.36 57.62 2axl h GLU 64 Cb 1.30 -0.10 -0.01 0.00 -0.16 0.00 0.00 28.75 29.78 2axl h GLU 64 CO 0.60 0.30 -0.23 0.66 -1.18 0.00 0.00 179.01 179.15 2axl h SER 65 N 0.46 0.00 -0.16 1.04 4.64 -1.97 0.95 113.55 118.51 2axl h SER 65 Ca 0.18 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.46 2axl h SER 65 Cb 0.06 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.14 2axl h SER 65 CO -0.11 0.23 -0.03 -0.25 -0.87 0.00 0.00 176.83 175.80 2axl h TRP 66 N 0.00 0.34 -0.27 4.77 2.91 -1.88 1.47 115.95 123.29 2axl h TRP 66 Ca -0.00 -0.07 -0.02 0.00 1.13 0.00 0.00 58.89 59.93 2axl h TRP 66 Cb 0.59 -0.08 -0.01 0.00 -0.51 0.00 0.00 29.16 29.15 2axl h TRP 66 CO 0.00 0.57 0.08 -1.49 -1.03 0.00 0.00 178.44 176.57 2axl h TRP 67 N 0.01 0.43 -0.16 2.65 4.06 -1.42 2.70 115.95 124.23 2axl h TRP 67 Ca 0.04 -0.05 0.05 0.00 2.06 0.00 0.00 58.89 61.00 2axl h TRP 67 Cb 0.45 -0.12 -0.06 0.00 -1.00 0.00 0.00 29.16 28.42 2axl h TRP 67 CO 0.05 0.47 -0.28 -0.22 -3.56 0.00 0.00 178.44 174.90 2axl h LYS 68 N 0.27 -0.32 -0.50 0.49 1.63 -0.26 0.18 116.57 118.06 2axl h LYS 68 Ca 0.09 0.02 -0.06 0.00 -0.85 0.00 0.00 60.65 59.85 2axl h LYS 68 Cb 0.25 0.07 -0.02 0.00 -0.60 0.00 0.00 32.23 31.93 2axl h LYS 68 CO -0.00 -0.21 0.07 0.00 -3.45 0.00 0.00 179.45 175.85 2axl h ALA 69 N 0.58 1.18 -0.42 5.00 0.00 0.26 -2.79 119.26 123.07 2axl h ALA 69 Ca 0.11 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.78 2axl h ALA 69 Cb 0.50 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 2axl h ALA 69 CO -0.35 0.55 0.22 0.35 0.00 0.00 0.00 179.25 180.02 2axl h PHE 70 N 0.75 0.58 -0.86 0.00 3.57 0.74 -2.14 116.94 119.57 2axl h PHE 70 Ca 0.16 -0.02 0.04 0.00 3.53 0.00 0.00 57.97 61.68 2axl h PHE 70 Cb 0.36 -0.18 -0.05 0.00 2.79 0.00 0.00 35.95 38.87 2axl h PHE 70 CO 0.02 0.45 0.57 0.77 -2.23 0.00 0.00 178.31 177.89 2axl h SER 71 N 0.54 0.91 -0.66 0.41 0.02 -0.59 -1.99 113.55 112.19 2axl h SER 71 Ca 0.15 -0.01 0.02 0.00 -0.84 0.00 0.00 61.79 61.11 2axl h SER 71 Cb 0.07 -0.21 -0.04 0.00 0.14 0.00 0.00 62.40 62.37 2axl h SER 71 CO -0.02 0.62 0.42 -0.09 -1.14 0.00 0.00 176.83 176.61 2axl h ARG 72 N 1.05 0.80 -0.83 3.45 2.43 -1.14 -2.48 114.38 117.67 2axl h ARG 72 Ca 0.35 -0.05 0.13 0.00 -0.81 0.00 0.00 59.98 59.60 2axl h ARG 72 Cb 0.06 -0.18 -0.09 0.00 -0.42 0.00 0.00 29.97 29.34 2axl h ARG 72 CO -0.11 0.53 0.44 1.96 -1.51 0.00 0.00 179.97 181.29 2axl h GLN 73 N 0.83 0.66 -0.58 0.20 4.20 -0.96 -2.28 115.11 117.17 2axl h GLN 73 Ca 0.26 -0.04 -0.06 0.00 0.06 0.00 0.00 58.65 58.87 2axl h GLN 73 Cb -0.01 -0.15 -0.03 0.00 0.30 0.00 0.00 27.48 27.59 2axl h GLN 73 CO -0.09 0.44 0.12 -0.07 -0.67 0.00 0.00 178.83 178.55 2axl h LEU 74 N 0.68 0.87 -0.38 1.46 3.38 -1.40 -3.11 115.31 116.80 2axl h LEU 74 Ca 0.44 -0.17 -0.00 0.00 0.09 0.00 0.00 57.88 58.23 2axl h LEU 74 Cb 0.55 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.05 2axl h LEU 74 CO -0.32 0.86 0.23 0.40 0.09 0.00 0.00 178.44 179.70 2axl h ILE 75 N 0.88 1.12 -0.44 1.22 2.04 -1.31 -2.80 117.51 118.23 2axl h ILE 75 Ca 0.19 -0.28 -0.06 0.00 1.00 0.00 0.00 64.86 65.70 2axl h ILE 75 Cb 0.35 0.62 -0.02 0.00 -0.74 0.00 0.00 36.82 37.04 2axl h ILE 75 CO 0.00 0.12 0.04 0.74 0.00 0.00 0.00 178.15 179.06 2axl h THR 76 N 0.50 1.25 0.00 -0.27 2.02 -1.55 -2.95 112.91 111.91 2axl h THR 76 Ca 0.14 -0.96 -0.01 0.00 0.77 0.00 0.00 66.41 66.34 2axl h THR 76 Cb -0.00 1.02 -0.00 0.00 -1.74 0.00 0.00 68.15 67.43 2axl h THR 76 CO -0.03 0.33 -0.07 -0.33 0.37 0.00 0.00 175.52 175.80 2axl h GLU 77 N 0.60 0.00 0.00 6.66 5.08 -1.48 -3.46 114.58 121.98 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 0.43 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.68 2axl h GLU 77 CO 0.01 0.07 0.00 0.41 -1.00 0.00 0.00 179.01 178.50 2axl n GLY 78 N -1.04 1.22 0.36 -3.84 0.00 -1.12 -4.66 105.19 96.12 2axl n GLY 78 Ca -0.02 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.10 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 0.66 -3.96 1.61 -1.00 -1.81 -3.43 116.94 109.01 2axl h PHE 79 Ca 0.00 0.02 -0.26 0.00 2.81 0.00 0.00 57.97 60.54 2axl h PHE 79 Cb 0.00 -0.21 -0.22 0.00 3.61 0.00 0.00 35.95 39.13 2axl h PHE 79 CO 0.00 0.31 -0.73 -1.17 -1.61 0.00 0.00 178.31 175.11 2axl s LEU 80 N -9.59 2.23 -0.00 1.54 2.96 -1.07 -3.96 118.68 110.78 2axl s LEU 80 Ca -0.09 -0.49 0.05 0.00 -0.22 0.00 0.00 54.13 53.38 2axl s LEU 80 Cb 0.20 -0.11 -0.01 0.00 0.50 0.00 0.00 46.19 46.76 2axl s LEU 80 CO 0.77 -0.20 -0.16 0.54 -1.32 0.00 0.00 176.35 175.98 2axl s VAL 81 N -1.26 1.27 -0.16 1.68 0.11 -1.19 -4.12 120.40 116.72 2axl s VAL 81 Ca -0.10 -0.77 -0.02 0.00 -2.93 0.00 0.00 61.98 58.17 2axl s VAL 81 Cb -0.09 -1.07 -0.01 0.00 -1.53 0.00 0.00 36.38 33.67 2axl s VAL 81 CO 0.00 0.30 -0.09 -1.61 -3.33 0.00 0.00 175.10 170.36 2axl s GLU 82 N -0.54 3.41 -0.29 1.54 2.02 -1.26 -0.93 118.70 122.64 2axl s GLU 82 Ca 0.06 -0.65 -0.18 0.00 0.02 0.00 0.00 54.97 54.22 2axl s GLU 82 Cb -0.07 -2.78 -0.02 0.00 0.10 0.00 0.00 34.13 31.36 2axl s GLU 82 CO -0.00 0.08 0.52 0.08 0.02 0.00 0.00 175.26 175.96 2axl s VAL 83 N 0.72 5.05 -0.78 2.63 1.01 0.10 -4.89 120.40 124.24 2axl s VAL 83 Ca -0.04 0.73 0.26 0.00 0.00 0.00 0.00 61.98 62.92 2axl s VAL 83 Cb -0.15 -3.87 0.14 0.00 0.00 0.00 0.00 36.38 32.50 2axl s VAL 83 CO 0.02 -0.01 1.56 -0.24 0.00 0.00 0.00 175.10 176.43 2axl n SER 84 N 5.61 0.59 -0.47 3.32 2.88 -1.26 -2.18 113.62 122.12 2axl n SER 84 Ca -0.04 0.25 0.03 0.00 -1.33 0.00 0.00 58.87 57.78 2axl n SER 84 Cb 0.49 -0.20 0.10 0.00 -0.75 0.00 0.00 64.21 63.85 2axl n SER 84 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 2axl n ARG 85 N -1.96 1.59 -3.58 -1.46 1.74 -1.26 -4.47 116.66 107.27 2axl n ARG 85 Ca 0.05 -0.80 -0.23 0.00 -0.77 0.00 0.00 57.85 56.10 2axl n ARG 85 Cb 0.40 -1.25 -0.16 0.00 -1.02 0.00 0.00 32.46 30.44 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 -1.68 0.01 -0.48 -1.55 1.51 -1.22 -4.95 117.35 109.00 2axl s TYR 86 Ca 0.15 -0.07 -0.05 0.00 -1.01 0.00 0.00 57.07 56.09 2axl s TYR 86 Cb 0.08 -0.55 0.01 0.00 -0.11 0.00 0.00 41.96 41.38 2axl s TYR 86 CO 0.09 -0.52 0.51 0.09 -1.11 0.00 0.00 175.55 174.61 2axl n ASN 87 N 5.30 -6.50 0.00 2.29 5.03 -1.26 0.14 115.26 120.25 2axl n ASN 87 Ca -0.06 0.13 0.02 0.00 0.87 0.00 0.00 54.58 55.53 2axl n ASN 87 Cb 0.49 -4.34 0.09 0.00 -1.02 0.00 0.00 39.78 35.00 2axl n ASN 87 CO 0.00 0.00 0.00 2.29 -1.83 0.00 0.00 177.26 177.72 2axl n LYS 88 N -1.11 0.05 -0.02 3.52 2.85 -1.26 0.24 118.16 122.42 2axl n LYS 88 Ca 0.04 0.26 -0.12 0.00 -1.05 0.00 0.00 58.31 57.44 2axl n LYS 88 Cb 0.44 -1.50 -0.10 0.00 -0.65 0.00 0.00 35.03 33.22 2axl n LYS 88 CO 0.00 0.00 0.00 0.74 -0.05 0.00 0.00 177.40 178.09 2axl h PHE 89 N 0.00 -0.05 -0.20 5.58 0.04 -1.95 -3.41 116.94 116.95 2axl h PHE 89 Ca 0.00 -0.00 -0.20 0.00 2.80 0.00 0.00 57.97 60.57 2axl h PHE 89 Cb 0.03 0.02 -0.35 0.00 2.20 0.00 0.00 35.95 37.85 2axl h PHE 89 CO 0.00 0.62 -0.94 -1.33 -0.60 0.00 0.00 178.31 176.05 2axl n MET 90 N -4.76 0.96 -1.52 1.51 2.81 0.80 -4.82 117.12 112.11 2axl n MET 90 Ca -0.08 -2.56 0.00 0.00 -1.81 0.00 0.00 57.70 53.24 2axl n MET 90 Cb 0.34 -0.68 0.00 0.00 -0.71 0.00 0.00 33.22 32.16 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 -0.27 -0.24 -1.50 0.03 5.02 0.64 -0.32 118.16 121.53 2axl n LYS 91 Ca 0.02 0.38 -0.52 0.00 -2.02 0.00 0.00 58.31 56.16 2axl n LYS 91 Cb 0.92 -0.38 -0.05 0.00 -0.02 0.00 0.00 35.03 35.50 2axl n LYS 91 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 2axl n ILE 92 N 1.07 1.01 -3.32 -0.18 2.08 0.36 -4.26 119.36 116.12 2axl n ILE 92 Ca 0.00 -0.25 -0.38 0.00 0.56 0.00 0.00 62.75 62.68 2axl n ILE 92 Cb 0.15 -0.31 -0.06 0.00 -0.75 0.00 0.00 39.64 38.66 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 -0.38 1.76 0.10 0.00 0.00 -0.11 -4.88 121.76 118.26 2axl s ALA 94 Ca 0.27 -0.89 -0.28 0.00 0.00 0.00 0.00 51.96 51.06 2axl s ALA 94 Cb -0.17 -0.48 -0.06 0.00 0.00 0.00 0.00 23.12 22.41 2axl s ALA 94 CO 0.15 0.41 0.89 -0.51 0.00 0.00 0.00 175.76 176.69 2axl s LEU 95 N -0.39 4.50 0.44 0.00 1.43 -1.26 -3.20 118.68 120.20 2axl s LEU 95 Ca 0.05 1.69 0.06 0.00 -1.03 0.00 0.00 54.13 54.90 2axl s LEU 95 Cb -0.09 -3.46 -0.05 0.00 0.03 0.00 0.00 46.19 42.62 2axl s LEU 95 CO 0.00 -0.01 0.09 0.42 0.23 0.00 0.00 176.35 177.08 2axl s THR 96 N -0.18 1.91 0.46 5.49 -4.23 -1.26 -4.84 115.64 112.99 2axl s THR 96 Ca 0.43 -1.87 0.31 0.00 -1.18 0.00 0.00 61.69 59.38 2axl s THR 96 Cb -0.23 -2.78 0.50 0.00 1.34 0.00 0.00 72.50 71.34 2axl s THR 96 CO 0.28 0.00 1.67 0.11 -0.54 0.00 0.00 174.62 176.13 2axl h LYS 97 N 1.52 0.12 -0.16 3.99 1.79 -1.95 0.72 116.57 122.60 2axl h LYS 97 Ca -0.43 -0.01 0.02 0.00 -2.18 0.00 0.00 60.65 58.06 2axl h LYS 97 Cb 1.26 -0.03 -0.02 0.00 -1.58 0.00 0.00 32.23 31.86 2axl h LYS 97 CO 0.75 0.08 0.00 0.87 -1.08 0.00 0.00 179.45 180.07 2axl h LYS 98 N 0.12 0.06 0.00 3.15 1.79 -1.88 -1.78 116.57 118.03 2axl h LYS 98 Ca 0.76 -0.00 -0.22 0.00 -2.18 0.00 0.00 60.65 59.01 2axl h LYS 98 Cb 2.47 -0.01 -0.04 0.00 -1.58 0.00 0.00 32.23 33.07 2axl h LYS 98 CO -0.30 0.04 -1.82 0.41 -1.08 0.00 0.00 179.45 176.70 2axl n GLY 99 N -1.16 -1.09 0.26 3.86 0.00 0.13 -3.58 105.19 103.61 2axl n GLY 99 Ca -0.03 -0.23 -0.10 0.00 0.00 0.00 0.00 46.02 45.66 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 0.90 -0.65 1.61 2.43 0.22 1.18 114.38 120.06 2axl h ARG 100 Ca -0.27 -0.31 -0.04 0.00 -0.81 0.00 0.00 59.98 58.55 2axl h ARG 100 Cb 1.76 -0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 31.21 2axl h ARG 100 CO 0.04 0.95 0.23 -0.91 -1.51 0.00 0.00 179.97 178.77 2axl h ASN 101 N 0.76 0.92 -0.66 -3.80 -0.26 -1.50 -0.38 115.58 110.66 2axl h ASN 101 Ca 0.14 -0.19 -0.08 0.00 -0.56 0.00 0.00 56.30 55.61 2axl h ASN 101 Cb 0.57 -0.24 -0.03 0.00 -1.06 0.00 0.00 38.32 37.56 2axl h ASN 101 CO 0.03 0.86 0.11 -0.25 -1.06 0.00 0.00 177.43 177.13 2axl h TRP 102 N 0.92 1.16 -0.58 1.19 7.01 -1.43 0.67 115.95 124.90 2axl h TRP 102 Ca 0.21 -0.16 0.05 0.00 2.11 0.00 0.00 58.89 61.10 2axl h TRP 102 Cb 0.25 -0.32 -0.05 0.00 -2.10 0.00 0.00 29.16 26.94 2axl h TRP 102 CO 0.02 0.97 0.31 1.25 -2.79 0.00 0.00 178.44 178.20 2axl h LEU 103 N 1.01 0.47 -0.37 0.65 5.85 0.26 -1.36 115.31 121.82 2axl h LEU 103 Ca 0.20 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.95 2axl h LEU 103 Cb 0.43 -0.07 0.00 0.00 0.37 0.00 0.00 40.66 41.40 2axl h LEU 103 CO 0.01 0.32 -0.63 1.41 -0.34 0.00 0.00 178.44 179.21 2axl n HIS 104 N -4.83 0.00 -0.05 1.25 8.25 -0.27 -4.38 115.22 115.20 2axl n HIS 104 Ca 0.06 0.00 -0.10 0.00 -0.26 0.00 0.00 57.72 57.42 2axl n HIS 104 Cb 0.14 -0.07 -0.04 0.00 1.12 0.00 0.00 29.99 31.14 2axl n HIS 104 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 2axl n LYS 105 N -0.94 0.22 -0.03 -0.41 5.02 0.22 -4.64 118.16 117.60 2axl n LYS 105 Ca 0.07 0.09 0.03 0.00 -2.02 0.00 0.00 58.31 56.47 2axl n LYS 105 Cb 0.37 -0.91 0.12 0.00 -0.02 0.00 0.00 35.03 34.59 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 -3.35 2.51 0.16 7.82 0.00 -0.53 -4.00 120.51 123.11 2axl n ALA 106 Ca -0.19 -0.12 0.10 0.00 0.00 0.00 0.00 53.44 53.23 2axl n ALA 106 Cb 0.65 -1.05 0.52 0.00 0.00 0.00 0.00 19.45 19.57 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 -0.38 0.50 0.00 0.00 5.15 -1.24 -3.66 115.26 115.64 2axl n ASN 107 Ca 0.04 0.73 0.00 0.00 -0.60 0.00 0.00 54.58 54.75 2axl n ASN 107 Cb 0.06 -0.80 0.00 0.00 -0.53 0.00 0.00 39.78 38.51 2axl n ASN 107 CO 0.00 0.00 0.00 1.07 1.40 0.00 0.00 177.26 179.73 2axl n THR 108 N -2.17 0.00 -3.18 -0.44 5.66 -1.26 -4.86 114.28 108.03 2axl n THR 108 Ca -0.01 0.10 -0.24 0.00 -3.05 0.00 0.00 64.05 60.85 2axl n THR 108 Cb 0.04 -0.59 -0.07 0.00 -1.55 0.00 0.00 70.33 68.16 2axl n THR 108 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40 2axl n GLU 109 N 0.00 0.71 -3.81 1.09 1.02 -1.26 -5.07 120.64 113.32 2axl n GLU 109 Ca 0.00 -3.19 -0.26 0.00 -0.02 0.00 0.00 57.16 53.69 2axl n GLU 109 Cb 0.00 -1.22 -0.17 0.00 -0.02 0.00 0.00 31.44 30.03 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 -1.18 2.38 -0.40 1.62 0.01 -1.24 -5.08 113.70 109.80 2axl s SER 110 Ca 0.35 -0.48 0.01 0.00 1.31 0.00 0.00 55.95 57.14 2axl s SER 110 Cb 0.17 -0.67 0.13 0.00 0.21 0.00 0.00 66.02 65.86 2axl s SER 110 CO -0.11 -0.21 0.21 -1.58 0.41 0.00 0.00 173.24 171.95 2axl s GLN 111 N 1.81 1.04 -0.20 12.44 0.74 -1.26 -4.92 119.66 129.31 2axl s GLN 111 Ca 0.02 -1.72 -0.12 0.00 0.05 0.00 0.00 55.36 53.59 2axl s GLN 111 Cb -0.14 -2.06 0.06 0.00 1.10 0.00 0.00 33.01 31.97 2axl s GLN 111 CO -0.07 -1.15 0.49 -1.12 -0.55 0.00 0.00 175.29 172.89 2axl s SER 112 N 0.70 -0.61 -0.30 6.67 0.01 -1.26 -4.93 113.70 113.98 2axl s SER 112 Ca 0.17 1.05 -0.09 0.00 1.31 0.00 0.00 55.95 58.39 2axl s SER 112 Cb -0.23 0.95 0.16 0.00 0.21 0.00 0.00 66.02 67.10 2axl s SER 112 CO -0.03 -0.20 0.73 -0.22 0.41 0.00 0.00 173.24 173.93 2axl s LEU 113 N 1.27 -1.06 -0.11 2.44 2.96 -1.26 -4.95 118.68 117.98 2axl s LEU 113 Ca -0.08 1.16 -0.22 0.00 -0.22 0.00 0.00 54.13 54.78 2axl s LEU 113 Cb -0.07 2.09 -0.04 0.00 0.50 0.00 0.00 46.19 48.67 2axl s LEU 113 CO -0.12 -0.20 0.63 -0.63 -1.32 0.00 0.00 176.35 174.71 2axl s ILE 114 N 2.81 5.07 0.51 6.68 1.01 -1.26 -3.50 121.20 132.53 2axl s ILE 114 Ca 0.02 1.28 0.09 0.00 0.00 0.00 0.00 60.65 62.03 2axl s ILE 114 Cb -0.12 -3.97 0.05 0.00 0.01 0.00 0.00 42.46 38.43 2axl s ILE 114 CO -0.19 0.24 0.64 -0.76 0.00 0.00 0.00 174.94 174.87 2axl s LEU 115 N 1.00 3.23 0.13 2.97 1.43 0.40 -4.84 118.68 123.00 2axl s LEU 115 Ca 0.33 -0.78 -0.30 0.00 -1.03 0.00 0.00 54.13 52.35 2axl s LEU 115 Cb -0.17 -1.89 -0.07 0.00 0.03 0.00 0.00 46.19 44.09 2axl s LEU 115 CO 0.14 -1.09 1.19 -1.58 0.23 0.00 0.00 176.35 175.25 2axl s GLN 116 N -4.48 4.48 0.44 1.70 0.74 -1.26 -2.74 119.66 118.54 2axl s GLN 116 Ca 0.55 1.82 -0.22 0.00 0.05 0.00 0.00 55.36 57.56 2axl s GLN 116 Cb -0.06 -3.29 -0.09 0.00 1.10 0.00 0.00 33.01 30.67 2axl s GLN 116 CO 0.34 -0.14 1.02 0.00 -0.55 0.00 0.00 175.29 175.96 2axl s ALA 117 N 0.40 2.98 0.54 1.58 0.00 -0.02 -4.65 121.76 122.58 2axl s ALA 117 Ca 0.55 0.59 -0.20 0.00 0.00 0.00 0.00 51.96 52.90 2axl s ALA 117 Cb -0.31 -3.23 -0.06 0.00 0.00 0.00 0.00 23.12 19.52 2axl s ALA 117 CO 0.33 -0.17 1.14 -0.80 0.00 0.00 0.00 175.76 176.26 2axl s ASN 118 N -1.89 5.73 0.10 0.00 0.01 -1.26 -4.82 114.94 112.81 2axl s ASN 118 Ca 0.63 2.21 -0.21 0.00 -0.71 0.00 0.00 52.86 54.78 2axl s ASN 118 Cb -0.16 -2.58 -0.10 0.00 0.41 0.00 0.00 41.25 38.81 2axl s ASN 118 CO 0.21 -1.21 1.71 1.05 -1.51 0.00 0.00 177.10 177.34 2axl h GLU 119 N 1.27 0.19 -5.59 -0.60 4.11 -1.95 -3.35 114.58 108.66 2axl h GLU 119 Ca -0.50 -0.02 -0.64 0.00 0.07 0.00 0.00 59.36 58.27 2axl h GLU 119 Cb 1.26 -0.04 -0.14 0.00 0.50 0.00 0.00 28.75 30.34 2axl h GLU 119 CO 0.57 0.19 1.11 -1.21 0.07 0.00 0.00 179.01 179.75 2axl s GLU 120 N -5.93 3.54 0.00 1.06 2.02 -1.26 -4.79 118.70 113.34 2axl s GLU 120 Ca -0.13 -1.35 0.22 0.00 0.02 0.00 0.00 54.97 53.73 2axl s GLU 120 Cb 0.07 -5.03 0.56 0.00 0.10 0.00 0.00 34.13 29.84 2axl s GLU 120 CO 0.69 -1.98 1.46 1.28 0.02 0.00 0.00 175.26 176.72 2axl n LEU 121 N 7.78 2.59 -3.21 1.80 4.77 -1.26 -4.67 117.00 124.80 2axl n LEU 121 Ca 0.25 -1.08 -0.05 0.00 -0.03 0.00 0.00 56.01 55.10 2axl n LEU 121 Cb 0.50 -0.17 -0.03 0.00 -2.33 0.00 0.00 43.42 41.39 2axl n LEU 121 CO 0.59 0.54 0.02 0.00 -1.33 0.00 0.00 177.39 177.21 2axl n PRO 123 N 4.19 0.00 0.00 0.00 -0.02 -1.26 -3.48 135.00 134.43 2axl n PRO 123 Ca 0.12 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.60 2axl n PRO 123 Cb 0.54 -1.01 0.00 0.00 -0.02 0.00 0.00 33.50 33.00 2axl n PRO 123 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 2axl n LYS 124 N -0.50 0.89 0.00 -0.52 3.00 -1.26 -4.03 118.16 115.73 2axl n LYS 124 Ca 0.00 0.00 0.03 0.00 -0.00 0.00 0.00 58.31 58.34 2axl n LYS 124 Cb 0.00 -1.43 0.16 0.00 0.00 0.00 0.00 35.03 33.76 2axl n LYS 124 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.40 177.76 2axl n LYS 125 N 0.07 0.48 -3.01 1.64 2.85 -1.23 -4.35 118.16 114.62 2axl n LYS 125 Ca 0.00 0.00 -0.44 0.00 -1.05 0.00 0.00 58.31 56.82 2axl n LYS 125 Cb 0.23 -1.17 -0.01 0.00 -0.65 0.00 0.00 35.03 33.43 2axl n LYS 125 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 177.40 176.84 2axl s LEU 126 N -1.35 5.30 -0.22 -5.58 1.43 -1.26 -4.99 118.68 112.03 2axl s LEU 126 Ca 0.08 -2.91 -0.18 0.00 -1.03 0.00 0.00 54.13 50.10 2axl s LEU 126 Cb 0.04 -2.37 -0.03 0.00 0.03 0.00 0.00 46.19 43.86 2axl s LEU 126 CO 0.06 -0.73 0.49 -1.48 0.23 0.00 0.00 176.35 174.93 2axl s LEU 127 N 1.31 4.12 -0.44 1.79 2.34 -1.26 -4.96 118.68 121.58 2axl s LEU 127 Ca 0.38 0.60 0.08 0.00 0.06 0.00 0.00 54.13 55.25 2axl s LEU 127 Cb -0.04 -2.66 0.32 0.00 -0.56 0.00 0.00 46.19 43.25 2axl s LEU 127 CO -0.03 -0.19 0.98 -0.11 -1.06 0.00 0.00 176.35 175.94 2axl n LEU 128 N 4.92 -1.47 -4.78 1.48 7.94 -1.26 -5.14 117.00 118.69 2axl n LEU 128 Ca -0.05 -4.05 -0.35 0.00 -1.11 0.00 0.00 56.01 50.44 2axl n LEU 128 Cb 0.50 0.86 -0.01 0.00 0.53 0.00 0.00 43.42 45.31 2axl n LEU 128 CO 0.41 2.13 0.77 -2.16 -1.11 0.00 0.00 177.39 177.43 2axl s PRO 129 N -0.46 3.52 0.40 1.96 0.04 -1.26 -5.01 135.00 134.19 2axl s PRO 129 Ca 0.28 1.55 -0.24 0.00 0.04 0.00 0.00 61.00 62.64 2axl s PRO 129 Cb 0.30 -2.06 -0.09 0.00 0.04 0.00 0.00 34.50 32.68 2axl s PRO 129 CO -0.08 -0.70 1.04 -1.54 0.04 0.00 0.00 177.00 175.76 2axl s SER 130 N -1.80 6.77 0.19 6.66 1.04 -1.26 -5.01 113.70 120.30 2axl s SER 130 Ca 0.70 2.00 -0.30 0.00 0.48 0.00 0.00 55.95 58.84 2axl s SER 130 Cb -0.22 -2.58 -0.08 0.00 0.10 0.00 0.00 66.02 63.24 2axl s SER 130 CO 0.25 -0.48 0.94 -0.44 0.98 0.00 0.00 173.24 174.49 2axl s SER 131 N -1.63 7.58 -0.12 7.02 0.01 -1.26 -5.04 113.70 120.27 2axl s SER 131 Ca 0.58 1.88 -0.04 0.00 1.31 0.00 0.00 55.95 59.68 2axl s SER 131 Cb -0.21 -2.60 -0.03 0.00 0.21 0.00 0.00 66.02 63.39 2axl s SER 131 CO 0.26 0.09 0.01 -1.59 0.41 0.00 0.00 173.24 172.42 2axl s LYS 132 N -0.79 3.33 0.25 12.44 -2.85 -1.26 -5.08 119.74 125.78 2axl s LYS 132 Ca 0.43 -0.40 -0.30 0.00 -1.00 0.00 0.00 55.97 54.70 2axl s LYS 132 Cb -0.25 -2.92 -0.09 0.00 -2.06 0.00 0.00 37.83 32.51 2axl s LYS 132 CO 0.31 0.54 1.25 0.99 0.10 0.00 0.00 175.35 178.54 2axl s THR 133 N -0.42 3.15 -0.07 3.79 2.01 -1.26 -4.97 115.64 117.87 2axl s THR 133 Ca 0.08 1.05 -0.30 0.00 0.31 0.00 0.00 61.69 62.83 2axl s THR 133 Cb -0.12 -3.67 -0.03 0.00 0.01 0.00 0.00 72.50 68.70 2axl s THR 133 CO 0.02 0.21 1.14 0.68 -0.69 0.00 0.00 174.62 175.98 2axl s VAL 134 N -0.55 4.42 -0.18 3.82 -7.23 -1.26 -4.92 120.40 114.50 2axl s VAL 134 Ca 0.51 1.73 0.07 0.00 -1.81 0.00 0.00 61.98 62.48 2axl s VAL 134 Cb -0.36 -4.11 -0.22 0.00 0.56 0.00 0.00 36.38 32.25 2axl s VAL 134 CO 0.43 -0.00 0.13 -1.20 -0.31 0.00 0.00 175.10 174.15 2axl n SER 135 N 5.14 1.20 -4.77 4.85 7.64 -1.26 -4.89 113.62 121.53 2axl n SER 135 Ca 0.10 0.06 -0.33 0.00 1.01 0.00 0.00 58.87 59.72 2axl n SER 135 Cb 0.47 0.00 0.05 0.00 -1.01 0.00 0.00 64.21 63.73 2axl n SER 135 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 2axl s SER 136 N -6.22 5.02 -0.39 6.43 1.04 -1.26 -3.19 113.70 115.13 2axl s SER 136 Ca -0.20 1.97 0.00 0.00 0.48 0.00 0.00 55.95 58.20 2axl s SER 136 Cb 0.07 -2.55 0.00 0.00 0.10 0.00 0.00 66.02 63.65 2axl s SER 136 CO 0.74 -1.69 0.00 0.61 0.98 0.00 0.00 173.24 173.88 2axl n GLY 137 N -0.65 0.66 3.82 7.32 0.00 -1.26 -5.00 105.19 110.07 2axl n GLY 137 Ca 0.10 -0.56 -0.37 0.00 0.00 0.00 0.00 46.02 45.19 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 -2.05 4.71 -0.25 2.61 -1.32 -1.19 -5.05 115.64 113.09 2axl s THR 138 Ca 0.00 1.16 -0.02 0.00 -1.21 0.00 0.00 61.69 61.62 2axl s THR 138 Cb 0.00 -3.87 0.13 0.00 -1.51 0.00 0.00 72.50 67.26 2axl s THR 138 CO 0.00 0.41 0.35 -0.54 -2.21 0.00 0.00 174.62 172.63 2axl s LYS 139 N -1.49 0.34 0.00 7.08 1.02 -1.26 -4.99 119.74 120.43 2axl s LYS 139 Ca 0.34 0.32 0.15 0.00 0.02 0.00 0.00 55.97 56.80 2axl s LYS 139 Cb -0.18 -0.57 0.35 0.00 -0.52 0.00 0.00 37.83 36.91 2axl s LYS 139 CO 0.20 -0.77 1.27 -0.85 -0.92 0.00 0.00 175.35 174.27 2axl n GLU 140 N 5.35 2.45 -0.25 1.68 0.00 -1.26 -4.58 120.64 124.02 2axl n GLU 140 Ca -0.03 -2.07 -0.03 0.00 0.00 0.00 0.00 57.16 55.03 2axl n GLU 140 Cb 0.49 -1.35 0.08 0.00 0.00 0.00 0.00 31.44 30.66 2axl n GLU 140 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.13 178.38 2axl h HIS 141 N 2.82 0.84 -0.03 -1.84 2.76 -1.94 -2.73 115.15 115.02 2axl h HIS 141 Ca 0.00 0.02 -0.00 0.00 -2.20 0.00 0.00 60.37 58.19 2axl h HIS 141 Cb 0.78 -0.28 -0.00 0.00 1.55 0.00 0.00 27.41 29.46 2axl h HIS 141 CO 0.25 0.49 0.02 0.00 -1.30 0.00 0.00 177.93 177.38 2axl s TYR 143 N -5.74 3.97 0.00 0.00 1.51 -1.03 -5.28 117.35 110.79 2axl s TYR 143 Ca -0.14 1.88 0.00 0.00 -1.01 0.00 0.00 57.07 57.80 2axl s TYR 143 Cb 0.05 -2.95 0.00 0.00 -0.11 0.00 0.00 41.96 38.95 2axl s TYR 143 CO 0.67 0.46 0.00 0.09 -1.11 0.00 0.00 175.55 175.66