#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 4ayk s LEU 2 N 0.00 4.41 0.38 1.34 1.43 -1.26 -5.09 118.68 119.90 4ayk s LEU 2 Ca 0.00 0.69 -0.01 0.00 -1.03 0.00 0.00 54.13 53.78 4ayk s LEU 2 Cb 0.00 -2.33 -0.03 0.00 0.03 0.00 0.00 46.19 43.86 4ayk s LEU 2 CO 0.00 0.34 0.61 0.42 0.23 0.00 0.00 176.35 177.95 4ayk s THR 3 N -0.88 5.02 0.25 5.49 -4.23 -1.26 -5.05 115.64 114.98 4ayk s THR 3 Ca 0.19 -0.30 -0.30 0.00 -1.18 0.00 0.00 61.69 60.10 4ayk s THR 3 Cb -0.14 -3.85 -0.09 0.00 1.34 0.00 0.00 72.50 69.76 4ayk s THR 3 CO 0.08 -0.62 1.19 -0.70 -0.54 0.00 0.00 174.62 174.03 4ayk s GLU 4 N -4.43 4.51 2.17 3.99 2.12 -1.26 -4.75 118.70 121.05 4ayk s GLU 4 Ca 0.42 1.93 0.00 0.00 0.36 0.00 0.00 54.97 57.68 4ayk s GLU 4 Cb -0.10 -3.19 0.00 0.00 0.26 0.00 0.00 34.13 31.11 4ayk s GLU 4 CO 0.38 -0.01 0.00 0.41 -0.54 0.00 0.00 175.26 175.50 4ayk n GLY 5 N 1.58 -1.14 3.81 -1.50 0.00 -1.26 -4.80 105.19 101.89 4ayk n GLY 5 Ca 0.02 -1.24 -0.34 0.00 0.00 0.00 0.00 46.02 44.46 4ayk n GLY 5 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 4ayk s ASN 6 N -4.00 7.02 1.24 1.61 0.01 -1.26 -5.05 114.94 114.50 4ayk s ASN 6 Ca 0.00 1.72 -0.18 0.00 -0.71 0.00 0.00 52.86 53.68 4ayk s ASN 6 Cb 0.00 -2.55 0.27 0.00 0.41 0.00 0.00 41.25 39.39 4ayk s ASN 6 CO 0.00 -0.30 0.94 -0.81 -1.51 0.00 0.00 177.10 175.42 4ayk n PRO 7 N -0.41 -3.03 -3.90 -0.60 -0.04 -1.26 -5.00 135.00 120.75 4ayk n PRO 7 Ca 0.06 -1.52 -0.09 0.00 -0.04 0.00 0.00 63.50 61.91 4ayk n PRO 7 Cb 0.53 -1.46 -0.09 0.00 -0.04 0.00 0.00 33.50 32.45 4ayk n PRO 7 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 4ayk s ARG 8 N -5.15 0.69 -0.24 0.54 0.52 -1.26 -4.80 118.95 109.25 4ayk s ARG 8 Ca 0.62 -0.84 -0.25 0.00 -0.52 0.00 0.00 55.73 54.74 4ayk s ARG 8 Cb -0.06 0.28 -0.00 0.00 0.52 0.00 0.00 34.95 35.68 4ayk s ARG 8 CO 0.48 -0.19 0.85 -1.58 0.02 0.00 0.00 175.30 174.88 4ayk s TRP 9 N -3.12 3.31 -1.01 -0.53 0.52 -1.26 -4.89 118.94 111.96 4ayk s TRP 9 Ca -0.01 1.17 0.28 0.00 0.02 0.00 0.00 56.10 57.56 4ayk s TRP 9 Cb 0.02 -3.07 1.05 0.00 -1.15 0.00 0.00 33.47 30.32 4ayk s TRP 9 CO -0.07 -0.41 1.80 0.39 0.02 0.00 0.00 176.95 178.68 4ayk n GLU 10 N 6.03 0.01 -2.27 4.98 4.71 -1.26 -4.85 120.64 127.99 4ayk n GLU 10 Ca 0.06 -0.00 -0.32 0.00 -0.01 0.00 0.00 57.16 56.89 4ayk n GLU 10 Cb 0.47 -1.50 -0.02 0.00 -1.01 0.00 0.00 31.44 29.38 4ayk n GLU 10 CO 0.00 0.00 0.00 -0.65 0.09 0.00 0.00 177.13 176.57 4ayk s GLN 11 N -2.99 3.87 0.00 3.49 -0.21 -1.26 -4.96 119.66 117.60 4ayk s GLN 11 Ca 0.14 0.91 0.23 0.00 0.02 0.00 0.00 55.36 56.65 4ayk s GLN 11 Cb 0.19 -2.12 0.09 0.00 1.00 0.00 0.00 33.01 32.16 4ayk s GLN 11 CO 0.57 -0.34 1.15 0.25 -2.12 0.00 0.00 175.29 174.80 4ayk n THR 12 N -1.86 0.00 -4.52 -0.19 -2.24 -1.26 -4.90 114.28 99.31 4ayk n THR 12 Ca 0.06 -0.26 -0.21 0.00 -2.27 0.00 0.00 64.05 61.37 4ayk n THR 12 Cb 0.54 1.18 -0.14 0.00 -2.10 0.00 0.00 70.33 69.80 4ayk n THR 12 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 4ayk s HIS 13 N -2.45 1.19 0.10 4.78 3.76 -1.26 -2.71 115.29 118.70 4ayk s HIS 13 Ca 0.20 -0.26 0.03 0.00 -0.15 0.00 0.00 55.06 54.88 4ayk s HIS 13 Cb 0.18 -0.75 -0.04 0.00 1.11 0.00 0.00 32.58 33.09 4ayk s HIS 13 CO 0.55 -0.00 -0.10 -0.51 -0.85 0.00 0.00 174.74 173.83 4ayk s LEU 14 N -0.56 2.42 0.13 0.89 1.43 -0.70 -4.98 118.68 117.32 4ayk s LEU 14 Ca 0.04 -0.84 0.07 0.00 -1.03 0.00 0.00 54.13 52.37 4ayk s LEU 14 Cb -0.06 -0.27 -0.04 0.00 0.03 0.00 0.00 46.19 45.85 4ayk s LEU 14 CO 0.00 -0.29 -0.16 0.42 0.23 0.00 0.00 176.35 176.55 4ayk s THR 15 N -2.62 1.53 0.12 5.49 -4.23 -1.26 -1.99 115.64 112.68 4ayk s THR 15 Ca 0.06 -1.74 -0.08 0.00 -1.18 0.00 0.00 61.69 58.76 4ayk s THR 15 Cb -0.02 -1.61 -0.01 0.00 1.34 0.00 0.00 72.50 72.20 4ayk s THR 15 CO -0.01 -0.33 0.20 -0.72 -0.54 0.00 0.00 174.62 173.23 4ayk s TYR 16 N -1.94 0.32 -0.12 3.99 -0.85 -1.09 -2.26 117.35 115.40 4ayk s TYR 16 Ca 0.10 -0.73 -0.06 0.00 -0.52 0.00 0.00 57.07 55.86 4ayk s TYR 16 Cb -0.06 -0.11 0.05 0.00 0.38 0.00 0.00 41.96 42.22 4ayk s TYR 16 CO 0.04 -0.59 0.29 0.50 -1.52 0.00 0.00 175.55 174.27 4ayk s ARG 17 N -3.92 0.26 -0.25 -3.49 3.52 -1.03 -2.23 118.95 111.81 4ayk s ARG 17 Ca 0.11 0.60 -0.22 0.00 -0.13 0.00 0.00 55.73 56.09 4ayk s ARG 17 Cb 0.05 -0.09 -0.01 0.00 -1.56 0.00 0.00 34.95 33.33 4ayk s ARG 17 CO -0.06 -0.16 0.73 0.42 -0.81 0.00 0.00 175.30 175.41 4ayk s ILE 18 N 1.32 4.91 0.18 4.11 1.01 -1.26 -2.26 121.20 129.21 4ayk s ILE 18 Ca -0.09 1.35 -0.09 0.00 0.00 0.00 0.00 60.65 61.81 4ayk s ILE 18 Cb -0.10 -4.02 0.06 0.00 0.01 0.00 0.00 42.46 38.41 4ayk s ILE 18 CO -0.10 -0.02 1.63 -0.33 0.00 0.00 0.00 174.94 176.13 4ayk h GLU 19 N 7.77 1.07 -2.24 2.79 5.08 -1.35 -3.47 114.58 124.24 4ayk h GLU 19 Ca -0.25 -0.35 0.01 0.00 -1.00 0.00 0.00 59.36 57.77 4ayk h GLU 19 Cb 1.11 -0.09 -0.17 0.00 0.50 0.00 0.00 28.75 30.10 4ayk h GLU 19 CO 0.82 1.05 0.33 0.54 -1.00 0.00 0.00 179.01 180.75 4ayk s ASN 20 N -6.58 -0.52 -0.15 1.42 4.22 -1.26 -5.09 114.94 106.99 4ayk s ASN 20 Ca -0.12 0.31 -0.08 0.00 -2.14 0.00 0.00 52.86 50.83 4ayk s ASN 20 Cb 0.13 0.48 -0.04 0.00 1.28 0.00 0.00 41.25 43.10 4ayk s ASN 20 CO 0.86 -0.66 0.13 -0.31 -2.04 0.00 0.00 177.10 175.08 4ayk s TYR 21 N -2.27 3.51 0.37 1.54 2.02 -1.26 -4.55 117.35 116.71 4ayk s TYR 21 Ca -0.03 0.44 -0.26 0.00 -0.37 0.00 0.00 57.07 56.85 4ayk s TYR 21 Cb -0.01 -2.01 -0.09 0.00 -0.40 0.00 0.00 41.96 39.45 4ayk s TYR 21 CO -0.02 0.56 1.17 -0.08 -1.57 0.00 0.00 175.55 175.62 4ayk s THR 22 N -0.52 3.17 -0.84 -0.71 -1.32 -1.26 -4.88 115.64 109.27 4ayk s THR 22 Ca 0.12 1.03 0.09 0.00 -1.21 0.00 0.00 61.69 61.73 4ayk s THR 22 Cb -0.12 -3.60 0.09 0.00 -1.51 0.00 0.00 72.50 67.36 4ayk s THR 22 CO 0.02 0.13 1.29 -0.81 -2.21 0.00 0.00 174.62 173.05 4ayk n PRO 23 N 0.32 0.04 -0.38 7.08 -0.04 -1.26 -2.62 135.00 138.15 4ayk n PRO 23 Ca 0.03 0.44 -0.02 0.00 -0.04 0.00 0.00 63.50 63.91 4ayk n PRO 23 Cb 0.46 -1.60 0.11 0.00 -0.04 0.00 0.00 33.50 32.43 4ayk n PRO 23 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 4ayk h ASP 24 N 0.00 1.15 -4.97 3.54 3.32 -1.97 -3.43 116.42 114.06 4ayk h ASP 24 Ca 0.00 -0.03 -0.18 0.00 0.02 0.00 0.00 57.03 56.84 4ayk h ASP 24 Cb 0.11 -0.29 -0.21 0.00 0.22 0.00 0.00 39.33 39.16 4ayk h ASP 24 CO 0.00 0.83 -0.70 -0.76 -1.72 0.00 0.00 179.24 176.89 4ayk s LEU 25 N -10.11 2.26 0.00 1.55 1.43 -1.08 -4.99 118.68 107.74 4ayk s LEU 25 Ca -0.13 -0.53 -0.17 0.00 -1.03 0.00 0.00 54.13 52.27 4ayk s LEU 25 Cb 0.18 0.08 0.26 0.00 0.03 0.00 0.00 46.19 46.73 4ayk s LEU 25 CO 0.82 -0.31 0.67 -0.81 0.23 0.00 0.00 176.35 176.95 4ayk n PRO 26 N 1.50 -3.63 0.02 1.29 -0.04 -1.26 -4.54 135.00 128.33 4ayk n PRO 26 Ca -0.23 -1.11 -0.13 0.00 -0.04 0.00 0.00 63.50 61.99 4ayk n PRO 26 Cb 0.55 -1.30 -0.14 0.00 -0.04 0.00 0.00 33.50 32.57 4ayk n PRO 26 CO 0.00 0.00 0.00 0.07 -0.04 0.00 0.00 175.50 175.53 4ayk h ARG 27 N 0.00 0.12 -1.01 0.54 0.11 -1.97 -3.17 114.38 109.00 4ayk h ARG 27 Ca -0.29 -0.20 0.04 0.00 0.10 0.00 0.00 59.98 59.64 4ayk h ARG 27 Cb 0.94 0.07 -0.06 0.00 1.11 0.00 0.00 29.97 32.03 4ayk h ARG 27 CO 0.18 0.86 0.66 0.00 0.10 0.00 0.00 179.97 181.76 4ayk h ALA 28 N 0.71 1.35 -0.04 0.08 0.00 -1.99 0.11 119.26 119.48 4ayk h ALA 28 Ca -0.26 -0.04 -0.26 0.00 0.00 0.00 0.00 54.91 54.36 4ayk h ALA 28 Cb 1.98 -0.35 0.02 0.00 0.00 0.00 0.00 17.79 19.44 4ayk h ALA 28 CO 0.11 0.54 -0.97 -0.44 0.00 0.00 0.00 179.25 178.49 4ayk h ASP 29 N 1.26 0.93 0.00 0.00 3.32 -1.94 -2.97 116.42 117.02 4ayk h ASP 29 Ca 0.41 -0.71 -0.00 0.00 0.02 0.00 0.00 57.03 56.75 4ayk h ASP 29 Cb 0.03 -0.28 0.00 0.00 0.22 0.00 0.00 39.33 39.30 4ayk h ASP 29 CO -0.14 1.51 -0.00 0.58 -1.72 0.00 0.00 179.24 179.47 4ayk h VAL 30 N 0.44 1.41 -0.92 -1.35 2.07 -1.42 -2.36 116.25 114.12 4ayk h VAL 30 Ca -0.11 -1.22 0.03 0.00 0.82 0.00 0.00 66.70 66.21 4ayk h VAL 30 Cb 1.62 2.24 -0.05 0.00 -1.52 0.00 0.00 31.29 33.58 4ayk h VAL 30 CO 0.19 0.32 0.61 -2.24 0.02 0.00 0.00 177.57 176.47 4ayk h ASP 31 N -0.52 1.02 -0.10 0.57 2.03 -0.93 -0.27 116.42 118.22 4ayk h ASP 31 Ca -0.00 -0.02 0.00 0.00 -0.73 0.00 0.00 57.03 56.29 4ayk h ASP 31 Cb 0.52 -0.24 -0.01 0.00 -0.83 0.00 0.00 39.33 38.77 4ayk h ASP 31 CO 0.00 0.71 0.05 -0.74 -1.03 0.00 0.00 179.24 178.23 4ayk h HIS 32 N 1.19 0.10 -0.29 4.15 2.76 -1.51 0.92 115.15 122.47 4ayk h HIS 32 Ca 0.36 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.53 4ayk h HIS 32 Cb -0.04 -0.03 -0.01 0.00 1.55 0.00 0.00 27.41 28.88 4ayk h HIS 32 CO -0.00 0.06 0.19 0.00 -1.30 0.00 0.00 177.93 176.88 4ayk h ALA 33 N 1.04 0.37 -0.37 5.26 0.00 -0.80 0.33 119.26 125.09 4ayk h ALA 33 Ca 0.04 -0.02 -0.17 0.00 0.00 0.00 0.00 54.91 54.76 4ayk h ALA 33 Cb -0.00 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 17.67 4ayk h ALA 33 CO -0.02 -0.16 -0.42 0.82 0.00 0.00 0.00 179.25 179.47 4ayk h ILE 34 N 0.39 1.27 -0.55 0.00 1.08 -0.80 -2.68 117.51 116.22 4ayk h ILE 34 Ca 0.11 -1.59 -0.11 0.00 -0.39 0.00 0.00 64.86 62.87 4ayk h ILE 34 Cb -0.04 1.42 -0.02 0.00 -3.07 0.00 0.00 36.82 35.11 4ayk h ILE 34 CO -0.02 0.53 -0.10 -0.08 -0.69 0.00 0.00 178.15 177.79 4ayk h GLU 35 N 0.75 1.03 -0.98 2.37 4.81 0.11 -2.73 114.58 119.96 4ayk h GLU 35 Ca 0.05 -0.37 0.01 0.00 -0.13 0.00 0.00 59.36 58.91 4ayk h GLU 35 Cb 1.02 -0.07 -0.05 0.00 0.63 0.00 0.00 28.75 30.28 4ayk h GLU 35 CO 0.10 1.06 0.63 -0.22 -0.73 0.00 0.00 179.01 179.86 4ayk h LYS 36 N 0.92 1.29 -0.44 1.92 3.64 -0.27 -1.97 116.57 121.67 4ayk h LYS 36 Ca 0.14 -0.09 -0.00 0.00 -1.27 0.00 0.00 60.65 59.43 4ayk h LYS 36 Cb 0.67 -0.29 -0.02 0.00 -0.41 0.00 0.00 32.23 32.18 4ayk h LYS 36 CO 0.05 0.87 0.25 0.00 -2.27 0.00 0.00 179.45 178.35 4ayk h ALA 37 N 1.37 0.56 -1.00 5.00 0.00 -1.18 -1.78 119.26 122.22 4ayk h ALA 37 Ca 0.36 -0.07 0.01 0.00 0.00 0.00 0.00 54.91 55.21 4ayk h ALA 37 Cb -0.13 -0.18 -0.05 0.00 0.00 0.00 0.00 17.79 17.43 4ayk h ALA 37 CO -0.07 0.06 0.66 0.74 0.00 0.00 0.00 179.25 180.64 4ayk h PHE 38 N 0.58 1.26 -1.01 0.00 0.04 -1.20 -1.75 116.94 114.86 4ayk h PHE 38 Ca 0.16 0.03 0.01 0.00 2.80 0.00 0.00 57.97 60.96 4ayk h PHE 38 Cb 0.02 -0.43 -0.05 0.00 2.20 0.00 0.00 35.95 37.69 4ayk h PHE 38 CO -0.03 0.80 0.67 1.96 -0.60 0.00 0.00 178.31 181.11 4ayk h GLN 39 N 1.36 1.33 -0.71 1.51 4.20 -0.69 -0.14 115.11 121.97 4ayk h GLN 39 Ca 0.37 -0.08 0.01 0.00 0.06 0.00 0.00 58.65 59.00 4ayk h GLN 39 Cb -0.16 -0.30 -0.04 0.00 0.30 0.00 0.00 27.48 27.29 4ayk h GLN 39 CO -0.08 0.88 0.47 -0.07 -0.67 0.00 0.00 178.83 179.36 4ayk h LEU 40 N 1.37 0.82 -0.27 1.46 3.38 -0.50 0.48 115.31 122.04 4ayk h LEU 40 Ca 0.37 -0.02 -0.19 0.00 0.09 0.00 0.00 57.88 58.12 4ayk h LEU 40 Cb -0.16 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.39 4ayk h LEU 40 CO -0.08 0.59 -0.58 -0.50 0.09 0.00 0.00 178.44 177.96 4ayk h TRP 41 N 0.96 1.10 -0.14 1.13 4.06 -1.16 -3.14 115.95 118.76 4ayk h TRP 41 Ca 0.26 -0.41 -0.12 0.00 2.06 0.00 0.00 58.89 60.68 4ayk h TRP 41 Cb -0.11 -0.20 -0.01 0.00 -1.00 0.00 0.00 29.16 27.84 4ayk h TRP 41 CO -0.02 1.24 -0.45 1.03 -3.56 0.00 0.00 178.44 176.68 4ayk h SER 42 N 0.65 0.38 0.00 -3.49 0.87 -0.67 -2.70 113.55 108.59 4ayk h SER 42 Ca 0.00 -0.17 -0.00 0.00 -1.23 0.00 0.00 61.79 60.39 4ayk h SER 42 Cb 1.20 -0.11 -0.00 0.00 -0.44 0.00 0.00 62.40 63.05 4ayk h SER 42 CO 0.13 0.78 -0.00 0.78 -0.53 0.00 0.00 176.83 177.99 4ayk h ASN 43 N 0.29 0.00 -0.10 6.23 2.35 0.00 -2.02 115.58 122.34 4ayk h ASN 43 Ca 0.02 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.77 4ayk h ASN 43 Cb 0.91 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.28 4ayk h ASN 43 CO 0.08 0.00 0.00 1.33 -1.65 0.00 0.00 177.43 177.19 4ayk n VAL 44 N -3.53 0.33 -3.78 2.81 0.24 -1.11 -5.01 118.33 108.28 4ayk n VAL 44 Ca -0.03 -0.67 -0.12 0.00 -2.04 0.00 0.00 64.34 61.48 4ayk n VAL 44 Cb 0.08 0.95 -0.09 0.00 -1.47 0.00 0.00 33.84 33.32 4ayk n VAL 44 CO 0.00 0.00 0.00 0.42 -2.14 0.00 0.00 176.83 175.11 4ayk s THR 45 N -0.82 0.07 -2.00 3.34 -4.23 -0.76 -4.03 115.64 107.21 4ayk s THR 45 Ca 0.13 -0.59 0.01 0.00 -1.18 0.00 0.00 61.69 60.07 4ayk s THR 45 Cb 0.08 -0.68 0.04 0.00 1.34 0.00 0.00 72.50 73.28 4ayk s THR 45 CO 0.11 -0.32 0.49 -0.81 -0.54 0.00 0.00 174.62 173.55 4ayk n PRO 46 N 1.11 0.40 -2.28 3.99 -0.04 -1.26 -4.51 135.00 132.41 4ayk n PRO 46 Ca -0.21 0.00 -0.35 0.00 -0.04 0.00 0.00 63.50 62.90 4ayk n PRO 46 Cb 0.57 -1.06 -0.00 0.00 -0.04 0.00 0.00 33.50 32.97 4ayk n PRO 46 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 4ayk s LEU 47 N -1.11 3.76 0.05 1.53 1.43 -1.26 -4.94 118.68 118.14 4ayk s LEU 47 Ca 0.02 2.16 0.01 0.00 -1.03 0.00 0.00 54.13 55.29 4ayk s LEU 47 Cb 0.01 -4.58 -0.03 0.00 0.03 0.00 0.00 46.19 41.62 4ayk s LEU 47 CO 0.02 -1.18 -0.06 0.42 0.23 0.00 0.00 176.35 175.77 4ayk s THR 48 N -1.79 0.45 0.16 5.49 -4.23 -1.10 -4.53 115.64 110.09 4ayk s THR 48 Ca 0.72 -1.35 0.05 0.00 -1.18 0.00 0.00 61.69 59.94 4ayk s THR 48 Cb -0.23 -0.92 -0.04 0.00 1.34 0.00 0.00 72.50 72.64 4ayk s THR 48 CO 0.26 -0.61 -0.12 -0.36 -0.54 0.00 0.00 174.62 173.26 4ayk s PHE 49 N -2.28 1.39 -0.22 3.99 0.08 -1.26 -1.71 117.98 117.97 4ayk s PHE 49 Ca -0.04 -0.67 -0.11 0.00 0.12 0.00 0.00 56.93 56.23 4ayk s PHE 49 Cb -0.04 -0.69 0.08 0.00 -0.57 0.00 0.00 43.02 41.80 4ayk s PHE 49 CO -0.02 0.16 0.51 0.99 -0.10 0.00 0.00 175.22 176.76 4ayk s THR 50 N -3.01 -0.27 0.33 0.64 2.01 -0.84 -4.95 115.64 109.56 4ayk s THR 50 Ca 0.16 0.07 -0.26 0.00 0.31 0.00 0.00 61.69 61.98 4ayk s THR 50 Cb 0.00 -0.77 -0.09 0.00 0.01 0.00 0.00 72.50 71.65 4ayk s THR 50 CO 0.02 0.03 1.00 -0.75 -0.69 0.00 0.00 174.62 174.23 4ayk s LYS 51 N 1.90 4.49 -0.02 4.92 2.20 -1.26 -2.67 119.74 129.29 4ayk s LYS 51 Ca -0.08 1.46 0.08 0.00 -0.36 0.00 0.00 55.97 57.07 4ayk s LYS 51 Cb -0.09 -2.81 -0.02 0.00 -1.51 0.00 0.00 37.83 33.40 4ayk s LYS 51 CO -0.15 0.16 -0.25 0.14 -0.36 0.00 0.00 175.35 174.89 4ayk s VAL 52 N -1.53 2.09 -0.90 4.02 -7.23 -0.95 -4.92 120.40 110.99 4ayk s VAL 52 Ca 0.51 -1.09 0.23 0.00 -1.81 0.00 0.00 61.98 59.82 4ayk s VAL 52 Cb -0.22 -1.72 -0.13 0.00 0.56 0.00 0.00 36.38 34.87 4ayk s VAL 52 CO 0.28 0.58 1.10 -0.24 -0.31 0.00 0.00 175.10 176.50 4ayk n SER 53 N 2.49 0.72 -3.83 4.85 2.88 -1.26 -4.72 113.62 114.74 4ayk n SER 53 Ca -0.16 -0.55 -0.10 0.00 -1.33 0.00 0.00 58.87 56.73 4ayk n SER 53 Cb 0.51 0.72 -0.07 0.00 -0.75 0.00 0.00 64.21 64.62 4ayk n SER 53 CO 0.00 0.00 0.00 -1.61 -1.23 0.00 0.00 175.04 172.20 4ayk s GLU 54 N -3.05 0.81 0.00 -1.46 2.02 -1.26 -5.13 118.70 110.64 4ayk s GLU 54 Ca 0.08 -0.82 0.00 0.00 0.02 0.00 0.00 54.97 54.25 4ayk s GLU 54 Cb 0.16 0.34 0.00 0.00 0.10 0.00 0.00 34.13 34.73 4ayk s GLU 54 CO 0.80 -0.26 0.00 0.41 0.02 0.00 0.00 175.26 176.23 4ayk n GLY 55 N 0.18 -1.11 3.88 -1.39 0.00 -1.26 -4.95 105.19 100.55 4ayk n GLY 55 Ca -0.16 -1.63 -0.30 0.00 0.00 0.00 0.00 46.02 43.93 4ayk n GLY 55 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 4ayk s GLN 56 N -1.92 2.95 0.08 1.61 0.00 -1.26 -5.07 119.66 116.06 4ayk s GLN 56 Ca 0.00 0.50 0.05 0.00 -0.00 0.00 0.00 55.36 55.90 4ayk s GLN 56 Cb 0.00 -2.03 -0.03 0.00 0.00 0.00 0.00 33.01 30.95 4ayk s GLN 56 CO 0.00 -0.98 -0.13 0.00 0.00 0.00 0.00 175.29 174.18 4ayk s ALA 57 N -3.34 1.16 0.25 2.60 0.00 -1.26 -5.02 121.76 116.16 4ayk s ALA 57 Ca 0.58 -1.07 -0.06 0.00 0.00 0.00 0.00 51.96 51.41 4ayk s ALA 57 Cb -0.11 -0.06 0.27 0.00 0.00 0.00 0.00 23.12 23.22 4ayk s ALA 57 CO 0.52 0.10 1.93 -0.44 0.00 0.00 0.00 175.76 177.87 4ayk h ASP 58 N 4.03 1.14 -3.21 0.00 3.32 -1.90 -3.39 116.42 116.41 4ayk h ASP 58 Ca -0.39 -0.03 -0.67 0.00 0.02 0.00 0.00 57.03 55.96 4ayk h ASP 58 Cb 1.19 -0.29 -0.32 0.00 0.22 0.00 0.00 39.33 40.14 4ayk h ASP 58 CO 0.44 0.83 -0.80 -0.63 -1.72 0.00 0.00 179.24 177.37 4ayk s ILE 59 N -6.09 2.60 -0.21 0.35 1.01 -0.96 -4.60 121.20 113.31 4ayk s ILE 59 Ca -0.13 -0.77 -0.10 0.00 0.00 0.00 0.00 60.65 59.66 4ayk s ILE 59 Cb 0.18 -2.14 -0.05 0.00 0.01 0.00 0.00 42.46 40.46 4ayk s ILE 59 CO 0.82 0.48 0.13 -0.04 0.00 0.00 0.00 174.94 176.33 4ayk s MET 60 N 1.37 4.13 -0.11 2.79 -1.94 -1.18 -2.48 119.30 121.89 4ayk s MET 60 Ca 0.05 -0.25 0.03 0.00 -1.71 0.00 0.00 55.69 53.81 4ayk s MET 60 Cb -0.14 -3.42 -0.00 0.00 2.01 0.00 0.00 34.83 33.28 4ayk s MET 60 CO -0.09 0.24 -0.22 0.42 -0.01 0.00 0.00 175.02 175.35 4ayk s ILE 61 N 0.54 2.21 0.10 2.53 1.01 -0.96 -0.80 121.20 125.83 4ayk s ILE 61 Ca 0.07 -0.97 -0.12 0.00 0.00 0.00 0.00 60.65 59.64 4ayk s ILE 61 Cb -0.12 -1.85 0.01 0.00 0.01 0.00 0.00 42.46 40.51 4ayk s ILE 61 CO -0.00 0.55 0.28 -0.94 0.00 0.00 0.00 174.94 174.83 4ayk s SER 62 N 0.35 -0.03 -0.09 3.58 1.04 -1.07 -0.75 113.70 116.73 4ayk s SER 62 Ca -0.18 -0.51 -0.01 0.00 0.48 0.00 0.00 55.95 55.73 4ayk s SER 62 Cb -0.18 0.39 -0.03 0.00 0.10 0.00 0.00 66.02 66.31 4ayk s SER 62 CO 0.08 -0.78 -0.03 -0.36 0.98 0.00 0.00 173.24 173.14 4ayk s PHE 63 N -3.82 3.05 0.14 5.02 0.08 -1.26 -2.43 117.98 118.77 4ayk s PHE 63 Ca 0.04 0.05 0.03 0.00 0.12 0.00 0.00 56.93 57.17 4ayk s PHE 63 Cb 0.04 -1.79 -0.04 0.00 -0.57 0.00 0.00 43.02 40.65 4ayk s PHE 63 CO -0.11 0.34 -0.05 0.14 -0.10 0.00 0.00 175.22 175.43 4ayk s VAL 64 N -0.65 0.84 0.01 -0.44 -7.23 -1.13 -4.93 120.40 106.86 4ayk s VAL 64 Ca 0.10 -1.99 0.05 0.00 -1.81 0.00 0.00 61.98 58.33 4ayk s VAL 64 Cb -0.12 -1.89 -0.02 0.00 0.56 0.00 0.00 36.38 34.92 4ayk s VAL 64 CO 0.02 -0.70 -0.15 -0.13 -0.31 0.00 0.00 175.10 173.83 4ayk s ARG 65 N -3.84 1.10 0.79 4.82 0.52 -1.26 -2.04 118.95 119.05 4ayk s ARG 65 Ca 0.17 -0.66 0.00 0.00 -0.52 0.00 0.00 55.73 54.73 4ayk s ARG 65 Cb 0.05 -1.09 0.00 0.00 0.52 0.00 0.00 34.95 34.42 4ayk s ARG 65 CO -0.00 0.29 0.00 0.41 0.02 0.00 0.00 175.30 176.02 4ayk n GLY 66 N 2.31 1.27 3.72 -3.53 0.00 -1.26 -4.30 105.19 103.39 4ayk n GLY 66 Ca -0.16 -0.40 -0.42 0.00 0.00 0.00 0.00 46.02 45.04 4ayk n GLY 66 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 4ayk s ASP 67 N -4.00 6.95 -0.39 1.61 -1.08 -1.26 -3.57 116.67 114.93 4ayk s ASP 67 Ca 0.00 2.21 0.12 0.00 -0.52 0.00 0.00 52.55 54.36 4ayk s ASP 67 Cb 0.00 -2.59 0.41 0.00 -1.46 0.00 0.00 42.92 39.28 4ayk s ASP 67 CO 0.00 -0.55 0.93 0.00 0.52 0.00 0.00 175.17 176.07 4ayk n HIS 68 N 3.73 1.78 -3.68 -5.34 1.44 -1.26 -4.94 115.22 106.95 4ayk n HIS 68 Ca 0.10 -3.25 -0.22 0.00 -2.01 0.00 0.00 57.72 52.33 4ayk n HIS 68 Cb 0.44 -0.34 0.04 0.00 0.12 0.00 0.00 29.99 30.25 4ayk n HIS 68 CO 0.00 0.00 0.00 0.54 -2.81 0.00 0.00 176.34 174.07 4ayk n ARG 69 N -0.10 -4.61 -4.15 -1.40 1.74 -1.26 -4.99 116.66 101.89 4ayk n ARG 69 Ca 0.22 0.62 -0.10 0.00 -0.77 0.00 0.00 57.85 57.83 4ayk n ARG 69 Cb 0.69 -5.15 -0.10 0.00 -1.02 0.00 0.00 32.46 26.88 4ayk n ARG 69 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 4ayk s ASP 70 N -4.28 0.29 0.00 0.55 -1.08 -1.26 -5.03 116.67 105.86 4ayk s ASP 70 Ca 0.05 -1.23 0.12 0.00 -0.52 0.00 0.00 52.55 50.96 4ayk s ASP 70 Cb -0.01 0.31 0.35 0.00 -1.46 0.00 0.00 42.92 42.11 4ayk s ASP 70 CO 0.81 -0.74 1.29 0.59 0.52 0.00 0.00 175.17 177.63 4ayk n ASN 71 N -0.11 1.80 -3.28 -0.34 5.03 -1.26 -4.37 115.26 112.73 4ayk n ASN 71 Ca -0.05 -1.97 -0.25 0.00 0.87 0.00 0.00 54.58 53.19 4ayk n ASN 71 Cb 0.64 -0.21 -0.08 0.00 -1.02 0.00 0.00 39.78 39.11 4ayk n ASN 71 CO 0.00 0.00 0.00 -1.20 -1.83 0.00 0.00 177.26 174.23 4ayk n SER 72 N 0.47 0.87 -4.77 6.41 7.64 -1.26 -5.11 113.62 117.87 4ayk n SER 72 Ca 0.12 -2.82 -0.40 0.00 1.01 0.00 0.00 58.87 56.78 4ayk n SER 72 Cb 0.29 -0.64 -0.01 0.00 -1.01 0.00 0.00 64.21 62.84 4ayk n SER 72 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 4ayk s PRO 73 N -1.30 4.13 0.30 1.43 0.05 -1.26 -4.95 135.00 133.39 4ayk s PRO 73 Ca 0.35 2.28 -0.28 0.00 0.05 0.00 0.00 61.00 63.40 4ayk s PRO 73 Cb 0.15 -2.91 -0.09 0.00 0.05 0.00 0.00 34.50 31.69 4ayk s PRO 73 CO -0.10 -0.41 1.07 -0.06 0.05 0.00 0.00 177.00 177.55 4ayk s PHE 74 N -1.18 3.56 -0.87 0.56 0.40 -1.23 -4.94 117.98 114.28 4ayk s PHE 74 Ca 0.53 1.71 0.00 0.00 -0.60 0.00 0.00 56.93 58.58 4ayk s PHE 74 Cb -0.41 -3.21 0.25 0.00 0.51 0.00 0.00 43.02 40.16 4ayk s PHE 74 CO 0.54 -0.44 0.96 -3.47 0.70 0.00 0.00 175.22 173.51 4ayk n ASP 75 N 0.95 4.67 -1.18 1.36 -0.08 -1.26 -4.61 116.55 116.39 4ayk n ASP 75 Ca 0.00 -3.31 0.14 0.00 -1.51 0.00 0.00 54.79 50.12 4ayk n ASP 75 Cb 0.46 -0.99 -0.04 0.00 2.34 0.00 0.00 41.12 42.89 4ayk n ASP 75 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 4ayk n GLY 76 N 1.58 -1.84 0.29 0.27 0.00 -1.26 -3.25 105.19 100.98 4ayk n GLY 76 Ca 0.25 -1.19 0.11 0.00 0.00 0.00 0.00 46.02 45.19 4ayk n GLY 76 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 4ayk h PRO 77 N 0.00 0.00 -7.74 1.61 0.11 -1.96 -3.41 132.00 120.61 4ayk h PRO 77 Ca 0.02 0.00 -0.45 0.00 0.11 0.00 0.00 66.00 65.68 4ayk h PRO 77 Cb 0.97 0.00 0.14 0.00 0.11 0.00 0.00 31.00 32.22 4ayk h PRO 77 CO 0.01 0.00 0.41 0.20 -0.21 0.00 0.00 178.00 178.41 4ayk s GLY 78 N -3.47 1.71 0.00 -0.55 0.00 -1.20 -4.90 107.32 98.91 4ayk s GLY 78 Ca -0.02 -1.01 0.00 0.00 0.00 0.00 0.00 44.72 43.69 4ayk s GLY 78 CO 0.19 -0.35 0.00 0.61 0.00 0.00 0.00 173.10 173.55 4ayk n GLY 79 N -3.59 -1.71 3.82 0.20 0.00 -1.26 -4.26 105.19 98.39 4ayk n GLY 79 Ca 0.13 -1.64 -0.31 0.00 0.00 0.00 0.00 46.02 44.19 4ayk n GLY 79 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 4ayk s ASN 80 N -4.00 5.37 0.10 1.61 4.22 -1.26 -4.97 114.94 116.00 4ayk s ASN 80 Ca 0.00 1.61 0.22 0.00 -2.14 0.00 0.00 52.86 52.54 4ayk s ASN 80 Cb 0.00 -2.48 -0.13 0.00 1.28 0.00 0.00 41.25 39.91 4ayk s ASN 80 CO 0.00 -1.45 0.80 0.18 -2.04 0.00 0.00 177.10 174.59 4ayk n LEU 81 N -3.14 0.55 -3.80 3.54 4.77 -1.26 -4.97 117.00 112.69 4ayk n LEU 81 Ca 0.07 0.22 0.00 0.00 -0.03 0.00 0.00 56.01 56.28 4ayk n LEU 81 Cb 0.54 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.62 4ayk n LEU 81 CO 0.56 -0.07 0.99 0.00 -1.33 0.00 0.00 177.39 177.54 4ayk s ALA 82 N -3.34 -2.13 0.28 -1.18 0.00 -1.26 -1.99 121.76 112.14 4ayk s ALA 82 Ca -0.04 0.23 -0.20 0.00 0.00 0.00 0.00 51.96 51.95 4ayk s ALA 82 Cb 0.11 0.64 0.06 0.00 0.00 0.00 0.00 23.12 23.92 4ayk s ALA 82 CO 0.83 -1.09 0.86 -3.38 0.00 0.00 0.00 175.76 172.99 4ayk s HIS 83 N -2.34 0.01 0.18 0.00 -3.43 -1.11 -5.01 115.29 103.60 4ayk s HIS 83 Ca 0.20 -0.52 -0.24 0.00 -0.80 0.00 0.00 55.06 53.70 4ayk s HIS 83 Cb 0.01 0.75 0.05 0.00 -1.43 0.00 0.00 32.58 31.96 4ayk s HIS 83 CO -0.00 -1.24 0.82 0.00 -2.00 0.00 0.00 174.74 172.32 4ayk s ALA 84 N -2.73 -1.50 0.05 -1.38 0.00 -1.26 -1.88 121.76 113.06 4ayk s ALA 84 Ca 0.16 0.10 0.00 0.00 0.00 0.00 0.00 51.96 52.22 4ayk s ALA 84 Cb -0.04 0.73 -0.04 0.00 0.00 0.00 0.00 23.12 23.76 4ayk s ALA 84 CO 0.08 -0.97 0.16 -0.06 0.00 0.00 0.00 175.76 174.97 4ayk s PHE 85 N -3.56 3.42 0.64 0.00 0.40 -0.95 -5.02 117.98 112.92 4ayk s PHE 85 Ca 0.10 0.22 -0.18 0.00 -0.60 0.00 0.00 56.93 56.47 4ayk s PHE 85 Cb -0.03 -1.73 -0.01 0.00 0.51 0.00 0.00 43.02 41.75 4ayk s PHE 85 CO 0.01 0.58 1.30 1.04 0.70 0.00 0.00 175.22 178.85 4ayk n GLN 86 N 0.53 1.15 -1.68 0.44 6.02 -1.26 -3.41 117.38 119.17 4ayk n GLN 86 Ca -0.08 0.45 -0.48 0.00 -0.01 0.00 0.00 57.00 56.88 4ayk n GLN 86 Cb 0.52 -2.54 -0.05 0.00 1.02 0.00 0.00 30.24 29.19 4ayk n GLN 86 CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 177.06 175.70 4ayk n PRO 87 N -1.87 2.20 -3.80 -1.09 -0.04 -1.26 -2.93 135.00 126.21 4ayk n PRO 87 Ca 0.16 0.81 0.02 0.00 -0.04 0.00 0.00 63.50 64.45 4ayk n PRO 87 Cb 0.48 -2.65 0.00 0.00 -0.04 0.00 0.00 33.50 31.29 4ayk n PRO 87 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 4ayk s GLY 88 N 3.94 -0.28 1.11 0.55 0.00 -1.26 -4.75 107.32 106.64 4ayk s GLY 88 Ca 0.92 0.38 -0.15 0.00 0.00 0.00 0.00 44.72 45.87 4ayk s GLY 88 CO 0.51 2.94 1.09 2.56 0.00 0.00 0.00 173.10 180.19 4ayk s PRO 89 N -2.18 -0.45 7.55 2.90 0.04 -1.26 -3.24 135.00 138.36 4ayk s PRO 89 Ca 0.22 0.30 0.00 0.00 0.04 0.00 0.00 61.00 61.56 4ayk s PRO 89 Cb 0.02 -1.65 0.00 0.00 0.04 0.00 0.00 34.50 32.91 4ayk s PRO 89 CO -0.03 -3.27 0.00 0.41 0.04 0.00 0.00 177.00 174.15 4ayk n GLY 90 N -0.79 2.75 0.00 0.56 0.00 -1.26 -2.06 105.19 104.39 4ayk n GLY 90 Ca 0.08 -0.25 0.14 0.00 0.00 0.00 0.00 46.02 45.99 4ayk n GLY 90 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 4ayk n ILE 91 N 0.00 0.00 -1.67 -0.61 3.06 -1.26 -4.87 119.36 114.01 4ayk n ILE 91 Ca 0.00 -0.00 -0.41 0.00 -2.50 0.00 0.00 62.75 59.84 4ayk n ILE 91 Cb 0.00 -0.49 0.02 0.00 0.54 0.00 0.00 39.64 39.71 4ayk n ILE 91 CO 0.00 0.00 0.00 0.61 -2.50 0.00 0.00 176.55 174.66 4ayk n GLY 92 N 1.46 0.28 2.07 4.50 0.00 -0.87 -1.51 105.19 111.12 4ayk n GLY 92 Ca 0.08 0.13 0.00 0.00 0.00 0.00 0.00 46.02 46.24 4ayk n GLY 92 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 4ayk n GLY 93 N 0.95 2.95 3.76 -0.02 0.00 -1.15 -4.28 105.19 107.39 4ayk n GLY 93 Ca 0.08 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.76 4ayk n GLY 93 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 4ayk s ASP 94 N -1.36 5.02 -0.12 1.61 1.11 -0.57 -3.07 116.67 119.29 4ayk s ASP 94 Ca 0.00 2.20 -0.05 0.00 0.18 0.00 0.00 52.55 54.88 4ayk s ASP 94 Cb 0.00 -2.58 0.06 0.00 1.07 0.00 0.00 42.92 41.47 4ayk s ASP 94 CO 0.00 -1.70 0.24 0.00 1.18 0.00 0.00 175.17 174.90 4ayk s ALA 95 N -1.99 -0.49 -0.08 5.23 0.00 0.02 -2.23 121.76 122.22 4ayk s ALA 95 Ca 0.72 0.88 -0.04 0.00 0.00 0.00 0.00 51.96 53.52 4ayk s ALA 95 Cb -0.25 -0.93 -0.04 0.00 0.00 0.00 0.00 23.12 21.90 4ayk s ALA 95 CO 0.38 -0.57 0.09 -1.01 0.00 0.00 0.00 175.76 174.65 4ayk s HIS 96 N 2.24 3.40 -0.08 0.00 3.76 -0.79 -2.61 115.29 121.22 4ayk s HIS 96 Ca 0.00 0.35 0.02 0.00 -0.15 0.00 0.00 55.06 55.29 4ayk s HIS 96 Cb -0.12 -1.85 -0.02 0.00 1.11 0.00 0.00 32.58 31.70 4ayk s HIS 96 CO -0.08 0.62 -0.13 -0.06 -0.85 0.00 0.00 174.74 174.23 4ayk s PHE 97 N -1.04 2.76 -0.15 1.40 0.40 -1.02 -2.74 117.98 117.59 4ayk s PHE 97 Ca 0.17 -0.30 -0.29 0.00 -0.60 0.00 0.00 56.93 55.90 4ayk s PHE 97 Cb -0.12 -1.71 -0.05 0.00 0.51 0.00 0.00 43.02 41.66 4ayk s PHE 97 CO 0.06 0.06 1.80 0.34 0.70 0.00 0.00 175.22 178.19 4ayk s ASP 98 N -0.37 6.25 0.00 1.36 2.15 -0.84 -2.85 116.67 122.37 4ayk s ASP 98 Ca 0.04 1.95 0.24 0.00 0.43 0.00 0.00 52.55 55.21 4ayk s ASP 98 Cb -0.12 -2.53 0.28 0.00 -0.30 0.00 0.00 42.92 40.25 4ayk s ASP 98 CO 0.02 -1.31 1.30 1.21 -0.17 0.00 0.00 175.17 176.22 4ayk n GLU 99 N 7.78 1.99 0.25 4.34 2.13 -0.86 -4.12 120.64 132.14 4ayk n GLU 99 Ca 0.21 -1.59 0.14 0.00 0.66 0.00 0.00 57.16 56.58 4ayk n GLU 99 Cb 0.44 -1.47 0.42 0.00 0.27 0.00 0.00 31.44 31.10 4ayk n GLU 99 CO 0.00 0.00 0.00 -0.44 -0.41 0.00 0.00 177.13 176.28 4ayk h ASP 100 N 3.89 0.00 -2.40 4.31 3.32 -1.88 -3.44 116.42 120.21 4ayk h ASP 100 Ca 0.00 0.00 -0.47 0.00 0.02 0.00 0.00 57.03 56.58 4ayk h ASP 100 Cb 0.88 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.42 4ayk h ASP 100 CO 0.00 0.02 -0.36 -1.61 -1.72 0.00 0.00 179.24 175.57 4ayk s GLU 101 N -3.43 3.46 -0.21 3.56 2.02 -1.26 -4.84 118.70 118.00 4ayk s GLU 101 Ca 0.04 -0.62 -0.23 0.00 0.02 0.00 0.00 54.97 54.19 4ayk s GLU 101 Cb 0.07 -2.83 -0.02 0.00 0.10 0.00 0.00 34.13 31.45 4ayk s GLU 101 CO 0.61 0.35 0.72 0.50 0.02 0.00 0.00 175.26 177.46 4ayk s ARG 102 N -4.01 4.22 0.24 1.61 3.52 -1.26 -5.05 118.95 118.21 4ayk s ARG 102 Ca 0.36 0.77 -0.10 0.00 -0.13 0.00 0.00 55.73 56.63 4ayk s ARG 102 Cb -0.09 -3.60 -0.07 0.00 -1.56 0.00 0.00 34.95 29.62 4ayk s ARG 102 CO 0.31 -0.34 0.57 -1.58 -0.81 0.00 0.00 175.30 173.46 4ayk s TRP 103 N 2.22 3.42 0.19 5.12 0.52 -1.26 -4.62 118.94 124.52 4ayk s TRP 103 Ca 0.32 0.92 0.07 0.00 0.02 0.00 0.00 56.10 57.43 4ayk s TRP 103 Cb -0.16 -2.29 -0.05 0.00 -1.15 0.00 0.00 33.47 29.82 4ayk s TRP 103 CO 0.10 0.25 -0.14 0.95 0.02 0.00 0.00 176.95 178.13 4ayk s THR 104 N -1.84 1.62 -0.33 2.01 -4.23 -1.05 -4.88 115.64 106.94 4ayk s THR 104 Ca 0.48 -2.16 0.08 0.00 -1.18 0.00 0.00 61.69 58.91 4ayk s THR 104 Cb -0.11 -1.98 0.55 0.00 1.34 0.00 0.00 72.50 72.30 4ayk s THR 104 CO 0.21 -0.61 1.58 0.59 -0.54 0.00 0.00 174.62 175.85 4ayk n ASN 105 N -0.29 2.87 -0.50 3.99 3.02 -1.26 -3.57 115.26 119.52 4ayk n ASN 105 Ca -0.09 -3.71 0.00 0.00 -0.03 0.00 0.00 54.58 50.75 4ayk n ASN 105 Cb 0.60 -0.69 0.00 0.00 -0.61 0.00 0.00 39.78 39.08 4ayk n ASN 105 CO 0.00 0.00 0.00 -0.46 -2.62 0.00 0.00 177.26 174.18 4ayk n ASN 106 N -1.09 0.00 -1.24 6.41 2.04 -1.26 -5.01 115.26 115.11 4ayk n ASN 106 Ca 0.40 -0.50 0.00 0.00 -0.44 0.00 0.00 54.58 54.04 4ayk n ASN 106 Cb 1.20 0.00 0.00 0.00 -2.53 0.00 0.00 39.78 38.45 4ayk n ASN 106 CO 0.00 0.00 0.00 0.49 -0.44 0.00 0.00 177.26 177.31 4ayk n PHE 107 N 0.00 0.00 -0.43 -2.53 3.72 -1.26 -4.74 117.46 112.22 4ayk n PHE 107 Ca 0.00 -0.73 0.00 0.00 -0.05 0.00 0.00 57.45 56.67 4ayk n PHE 107 Cb 0.00 -0.37 0.00 0.00 -0.94 0.00 0.00 39.48 38.17 4ayk n PHE 107 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 4ayk n ARG 108 N 0.98 0.33 0.35 -1.08 5.12 -1.26 -4.96 116.66 116.14 4ayk n ARG 108 Ca 0.00 0.00 -0.18 0.00 -1.93 0.00 0.00 57.85 55.74 4ayk n ARG 108 Cb 0.49 0.00 -0.09 0.00 -1.16 0.00 0.00 32.46 31.71 4ayk n ARG 108 CO 0.00 0.00 0.00 0.93 -1.93 0.00 0.00 177.63 176.63 4ayk h GLU 109 N 0.00 -0.84 -4.89 5.56 5.08 -1.96 -3.40 114.58 114.12 4ayk h GLU 109 Ca 0.00 0.06 -0.64 0.00 -1.00 0.00 0.00 59.36 57.78 4ayk h GLU 109 Cb 0.00 0.19 -0.17 0.00 0.50 0.00 0.00 28.75 29.27 4ayk h GLU 109 CO 0.00 -0.56 -0.52 0.71 -1.00 0.00 0.00 179.01 177.63 4ayk s TYR 110 N -6.05 3.21 -0.42 4.33 1.51 -1.26 -5.05 117.35 113.62 4ayk s TYR 110 Ca -0.17 0.08 -0.12 0.00 -1.01 0.00 0.00 57.07 55.84 4ayk s TYR 110 Cb 0.04 -2.38 0.05 0.00 -0.11 0.00 0.00 41.96 39.56 4ayk s TYR 110 CO 0.62 -0.18 0.28 -0.80 -1.11 0.00 0.00 175.55 174.37 4ayk s ASN 111 N 1.75 5.86 0.17 2.29 0.01 -1.26 -2.52 114.94 121.24 4ayk s ASN 111 Ca 0.07 -1.22 -0.14 0.00 -0.71 0.00 0.00 52.86 50.86 4ayk s ASN 111 Cb -0.16 -2.07 0.06 0.00 0.41 0.00 0.00 41.25 39.49 4ayk s ASN 111 CO 0.11 -0.51 1.79 0.25 -1.51 0.00 0.00 177.10 177.22 4ayk h LEU 112 N 8.54 0.67 -0.67 0.60 5.85 -1.91 -2.74 115.31 125.65 4ayk h LEU 112 Ca -0.26 -0.08 0.01 0.00 0.84 0.00 0.00 57.88 58.39 4ayk h LEU 112 Cb 1.10 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 41.93 4ayk h LEU 112 CO 0.76 0.56 0.44 -0.74 -0.34 0.00 0.00 178.44 179.11 4ayk h HIS 113 N 0.72 0.83 -0.68 1.25 2.76 -1.88 0.24 115.15 118.40 4ayk h HIS 113 Ca 0.19 0.02 0.01 0.00 -2.20 0.00 0.00 60.37 58.39 4ayk h HIS 113 Cb 0.03 -0.28 -0.03 0.00 1.55 0.00 0.00 27.41 28.67 4ayk h HIS 113 CO -0.02 0.52 0.45 -0.09 -1.30 0.00 0.00 177.93 177.49 4ayk h ARG 114 N 0.90 0.89 -0.38 5.26 2.43 -1.90 -0.39 114.38 121.19 4ayk h ARG 114 Ca 0.25 -0.05 -0.16 0.00 -0.81 0.00 0.00 59.98 59.20 4ayk h ARG 114 Cb -0.10 -0.20 -0.01 0.00 -0.42 0.00 0.00 29.97 29.25 4ayk h ARG 114 CO -0.06 0.59 -0.40 0.28 -1.51 0.00 0.00 179.97 178.87 4ayk h VAL 115 N 0.91 1.27 -0.85 0.20 2.07 -1.18 -2.73 116.25 115.94 4ayk h VAL 115 Ca 0.25 -1.58 0.01 0.00 0.82 0.00 0.00 66.70 66.20 4ayk h VAL 115 Cb -0.10 1.41 -0.04 0.00 -1.52 0.00 0.00 31.29 31.03 4ayk h VAL 115 CO -0.06 0.53 0.57 0.00 0.02 0.00 0.00 177.57 178.63 4ayk h ALA 116 N 0.76 1.08 -0.68 1.67 0.00 -0.45 -0.51 119.26 121.13 4ayk h ALA 116 Ca 0.06 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 4ayk h ALA 116 Cb 1.00 -0.34 -0.03 0.00 0.00 0.00 0.00 17.79 18.42 4ayk h ALA 116 CO 0.10 0.49 0.26 0.00 0.00 0.00 0.00 179.25 180.10 4ayk h ALA 117 N 1.31 1.18 -0.17 0.00 0.00 -0.97 -1.78 119.26 118.83 4ayk h ALA 117 Ca 0.31 -0.18 -0.06 0.00 0.00 0.00 0.00 54.91 54.98 4ayk h ALA 117 Cb -0.13 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 17.38 4ayk h ALA 117 CO -0.07 0.59 -0.14 1.25 0.00 0.00 0.00 179.25 180.88 4ayk h HIS 118 N 0.98 0.47 -1.00 0.00 6.17 -1.03 -2.56 115.15 118.19 4ayk h HIS 118 Ca 0.23 -0.13 0.01 0.00 0.71 0.00 0.00 60.37 61.19 4ayk h HIS 118 Cb 0.20 -0.10 -0.05 0.00 2.52 0.00 0.00 27.41 29.98 4ayk h HIS 118 CO 0.02 0.75 0.66 0.93 0.71 0.00 0.00 177.93 181.00 4ayk h GLU 119 N 0.06 1.30 -0.97 5.26 5.08 -0.93 -1.35 114.58 123.04 4ayk h GLU 119 Ca 0.03 -0.08 -0.00 0.00 -1.00 0.00 0.00 59.36 58.31 4ayk h GLU 119 Cb 0.66 -0.29 -0.05 0.00 0.50 0.00 0.00 28.75 29.56 4ayk h GLU 119 CO 0.04 0.86 0.60 -0.07 -1.00 0.00 0.00 179.01 179.44 4ayk h LEU 120 N 1.34 1.15 -0.85 1.33 3.38 -1.25 -1.87 115.31 118.54 4ayk h LEU 120 Ca 0.37 -0.06 0.09 0.00 0.09 0.00 0.00 57.88 58.37 4ayk h LEU 120 Cb -0.14 -0.29 -0.07 0.00 0.09 0.00 0.00 40.66 40.25 4ayk h LEU 120 CO -0.08 0.86 0.51 1.23 0.09 0.00 0.00 178.44 181.05 4ayk h GLY 121 N 1.33 1.32 1.16 0.83 0.00 -0.83 0.15 103.07 107.04 4ayk h GLY 121 Ca 0.35 -0.35 -0.07 0.00 0.00 0.00 0.00 47.33 47.26 4ayk h GLY 121 CO -0.07 0.18 0.13 0.45 0.00 0.00 0.00 176.54 177.23 4ayk h HIS 122 N 0.87 1.08 0.00 5.60 3.86 -1.11 0.14 115.15 125.60 4ayk h HIS 122 Ca 0.40 -0.13 -0.02 0.00 -1.16 0.00 0.00 60.37 59.46 4ayk h HIS 122 Cb 0.31 -0.30 -0.00 0.00 1.06 0.00 0.00 27.41 28.47 4ayk h HIS 122 CO -0.05 0.90 -0.07 0.66 0.86 0.00 0.00 177.93 180.23 4ayk h SER 123 N 0.98 0.00 0.03 2.45 4.64 -0.52 -1.55 113.55 119.58 4ayk h SER 123 Ca 0.20 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.52 4ayk h SER 123 Cb 0.39 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.48 4ayk h SER 123 CO 0.01 0.07 -0.02 0.18 -0.87 0.00 0.00 176.83 176.20 4ayk n LEU 124 N -3.22 0.99 0.00 5.97 4.77 0.34 -4.71 117.00 121.15 4ayk n LEU 124 Ca 0.00 -0.31 0.00 0.00 -0.03 0.00 0.00 56.01 55.67 4ayk n LEU 124 Cb 0.33 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.40 4ayk n LEU 124 CO 0.29 0.17 0.00 0.61 -1.33 0.00 0.00 177.39 177.13 4ayk n GLY 125 N 1.14 0.67 3.70 -0.72 0.00 -0.58 -4.95 105.19 104.44 4ayk n GLY 125 Ca 0.20 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.80 4ayk n GLY 125 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 4ayk s LEU 126 N 0.00 4.29 0.75 0.99 1.43 -0.07 -4.99 118.68 121.08 4ayk s LEU 126 Ca 0.00 1.50 -0.05 0.00 -1.03 0.00 0.00 54.13 54.55 4ayk s LEU 126 Cb 0.00 -3.47 0.12 0.00 0.03 0.00 0.00 46.19 42.87 4ayk s LEU 126 CO 0.00 -0.34 1.05 -0.44 0.23 0.00 0.00 176.35 176.85 4ayk s SER 127 N 1.04 4.26 0.80 2.29 0.01 -1.26 -4.10 113.70 116.74 4ayk s SER 127 Ca 0.47 -0.02 -0.10 0.00 1.31 0.00 0.00 55.95 57.61 4ayk s SER 127 Cb -0.19 -0.39 0.08 0.00 0.21 0.00 0.00 66.02 65.73 4ayk s SER 127 CO 0.21 -1.93 1.11 -1.00 0.41 0.00 0.00 173.24 172.03 4ayk s HIS 128 N -3.29 2.35 0.18 2.43 0.09 -1.26 -4.95 115.29 110.83 4ayk s HIS 128 Ca 0.66 1.61 0.03 0.00 -0.00 0.00 0.00 55.06 57.36 4ayk s HIS 128 Cb -0.07 -3.12 -0.05 0.00 -0.00 0.00 0.00 32.58 29.35 4ayk s HIS 128 CO 0.46 -2.04 -0.02 0.45 -0.00 0.00 0.00 174.74 173.58 4ayk s SER 129 N -3.20 1.49 0.00 1.40 0.15 -1.09 -5.03 113.70 107.41 4ayk s SER 129 Ca 0.63 -1.15 0.22 0.00 0.70 0.00 0.00 55.95 56.35 4ayk s SER 129 Cb -0.19 0.06 0.52 0.00 -1.71 0.00 0.00 66.02 64.70 4ayk s SER 129 CO 0.56 -0.50 1.45 0.35 1.20 0.00 0.00 173.24 176.30 4ayk n THR 130 N -0.27 0.75 -2.75 6.45 -2.24 -1.26 -4.49 114.28 110.47 4ayk n THR 130 Ca -0.07 -0.87 -0.42 0.00 -2.27 0.00 0.00 64.05 60.41 4ayk n THR 130 Cb 0.63 0.75 -0.03 0.00 -2.10 0.00 0.00 70.33 69.58 4ayk n THR 130 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 4ayk s ASP 131 N -1.23 7.06 0.50 3.42 -1.08 -1.26 -4.91 116.67 119.17 4ayk s ASP 131 Ca 0.42 1.32 0.15 0.00 -0.52 0.00 0.00 52.55 53.93 4ayk s ASP 131 Cb 0.23 -2.51 1.21 0.00 -1.46 0.00 0.00 42.92 40.39 4ayk s ASP 131 CO 0.32 -0.54 2.11 -0.29 0.52 0.00 0.00 175.17 177.29 4ayk h ILE 132 N 5.31 0.98 -0.00 4.11 2.10 -2.02 -0.04 117.51 127.95 4ayk h ILE 132 Ca -0.24 -0.04 0.00 0.00 1.08 0.00 0.00 64.86 65.66 4ayk h ILE 132 Cb 1.10 0.86 0.00 0.00 -1.09 0.00 0.00 36.82 37.69 4ayk h ILE 132 CO 0.91 0.02 -0.01 0.61 -1.08 0.00 0.00 178.15 178.59 4ayk n GLY 133 N -1.54 -1.26 3.73 8.18 0.00 -1.26 -4.78 105.19 108.26 4ayk n GLY 133 Ca -0.00 -0.15 -0.40 0.00 0.00 0.00 0.00 46.02 45.46 4ayk n GLY 133 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 4ayk s ALA 134 N -2.57 3.30 0.25 4.61 0.00 -0.03 -4.57 121.76 122.74 4ayk s ALA 134 Ca 0.28 0.32 0.24 0.00 0.00 0.00 0.00 51.96 52.81 4ayk s ALA 134 Cb 0.20 -3.09 1.09 0.00 0.00 0.00 0.00 23.12 21.33 4ayk s ALA 134 CO 0.47 -0.06 1.91 -0.07 0.00 0.00 0.00 175.76 178.00 4ayk h LEU 135 N 6.26 0.00 -3.16 0.00 3.38 -1.86 -3.12 115.31 116.81 4ayk h LEU 135 Ca -0.42 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.55 4ayk h LEU 135 Cb 1.21 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.96 4ayk h LEU 135 CO 0.73 0.21 0.00 0.23 0.09 0.00 0.00 178.44 179.70 4ayk n MET 136 N -3.52 0.66 -2.18 1.13 2.81 -1.26 -4.84 117.12 109.92 4ayk n MET 136 Ca -0.01 0.00 -0.42 0.00 -1.81 0.00 0.00 57.70 55.46 4ayk n MET 136 Cb 0.36 -1.17 -0.03 0.00 -0.71 0.00 0.00 33.22 31.68 4ayk n MET 136 CO 0.00 0.00 0.00 -0.47 1.51 0.00 0.00 175.97 177.01 4ayk s TYR 137 N 0.63 3.22 0.03 2.03 6.14 -1.18 -2.67 117.35 125.55 4ayk s TYR 137 Ca 0.00 0.95 -0.08 0.00 0.64 0.00 0.00 57.07 58.58 4ayk s TYR 137 Cb 0.00 -3.67 -0.03 0.00 0.42 0.00 0.00 41.96 38.68 4ayk s TYR 137 CO 0.00 -2.36 1.14 -1.35 0.64 0.00 0.00 175.55 173.62 4ayk h PRO 138 N 6.87 -0.12 -7.49 4.97 0.11 -1.89 -3.42 132.00 131.02 4ayk h PRO 138 Ca -0.42 0.01 -0.47 0.00 0.11 0.00 0.00 66.00 65.23 4ayk h PRO 138 Cb 1.21 0.03 0.09 0.00 0.11 0.00 0.00 31.00 32.44 4ayk h PRO 138 CO 0.86 -0.08 0.35 -1.54 -0.21 0.00 0.00 178.00 177.38 4ayk s SER 139 N -3.19 4.70 0.10 -2.05 1.04 -1.26 -5.04 113.70 108.00 4ayk s SER 139 Ca -0.04 0.70 -0.22 0.00 0.48 0.00 0.00 55.95 56.88 4ayk s SER 139 Cb 0.02 -1.28 -0.07 0.00 0.10 0.00 0.00 66.02 64.79 4ayk s SER 139 CO 0.15 -1.74 0.65 -0.47 0.98 0.00 0.00 173.24 172.81 4ayk s TYR 140 N -3.44 3.83 0.10 5.02 5.04 -1.26 -5.07 117.35 121.57 4ayk s TYR 140 Ca 0.61 1.40 -0.09 0.00 -2.44 0.00 0.00 57.07 56.54 4ayk s TYR 140 Cb -0.11 -2.60 0.00 0.00 0.35 0.00 0.00 41.96 39.60 4ayk s TYR 140 CO 0.48 0.54 0.22 0.95 -1.34 0.00 0.00 175.55 176.39 4ayk s THR 141 N -1.04 0.13 0.50 4.34 -4.23 -1.26 -5.15 115.64 108.93 4ayk s THR 141 Ca 0.32 -1.16 -0.20 0.00 -1.18 0.00 0.00 61.69 59.46 4ayk s THR 141 Cb -0.21 -1.39 -0.08 0.00 1.34 0.00 0.00 72.50 72.17 4ayk s THR 141 CO 0.21 -0.58 1.08 -0.36 -0.54 0.00 0.00 174.62 174.43 4ayk s PHE 142 N -3.87 2.90 0.12 3.99 0.08 -1.26 -5.05 117.98 114.89 4ayk s PHE 142 Ca 0.06 1.57 -0.15 0.00 0.12 0.00 0.00 56.93 58.53 4ayk s PHE 142 Cb 0.04 -3.16 0.03 0.00 -0.57 0.00 0.00 43.02 39.36 4ayk s PHE 142 CO -0.10 -1.11 0.38 -1.54 -0.10 0.00 0.00 175.22 172.75 4ayk s SER 143 N -1.84 -0.19 0.00 1.36 1.04 -1.26 -5.15 113.70 107.65 4ayk s SER 143 Ca 0.68 -0.36 0.00 0.00 0.48 0.00 0.00 55.95 56.75 4ayk s SER 143 Cb -0.20 0.46 0.00 0.00 0.10 0.00 0.00 66.02 66.38 4ayk s SER 143 CO 0.24 -0.84 0.00 0.61 0.98 0.00 0.00 173.24 174.23 4ayk n GLY 144 N -0.21 -1.65 3.88 7.32 0.00 -1.26 -4.94 105.19 108.33 4ayk n GLY 144 Ca -0.16 -0.23 -0.30 0.00 0.00 0.00 0.00 46.02 45.33 4ayk n GLY 144 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 4ayk s ASP 145 N -1.61 6.31 -0.49 1.61 1.01 -1.26 -5.00 116.67 117.25 4ayk s ASP 145 Ca 0.00 1.29 -0.24 0.00 0.71 0.00 0.00 52.55 54.31 4ayk s ASP 145 Cb 0.00 -2.40 0.03 0.00 1.01 0.00 0.00 42.92 41.56 4ayk s ASP 145 CO 0.00 -0.72 0.87 -0.69 0.21 0.00 0.00 175.17 174.84 4ayk s VAL 146 N -2.93 4.52 0.03 -1.27 1.01 -1.26 -5.01 120.40 115.50 4ayk s VAL 146 Ca 0.53 0.45 -0.02 0.00 0.00 0.00 0.00 61.98 62.94 4ayk s VAL 146 Cb -0.11 -4.42 -0.02 0.00 0.00 0.00 0.00 36.38 31.83 4ayk s VAL 146 CO 0.47 -0.88 0.00 -1.10 0.00 0.00 0.00 175.10 173.59 4ayk s GLN 147 N 3.61 0.47 0.40 2.72 -0.21 -1.26 -5.13 119.66 120.26 4ayk s GLN 147 Ca 0.32 -0.83 -0.24 0.00 0.02 0.00 0.00 55.36 54.63 4ayk s GLN 147 Cb -0.12 0.17 -0.09 0.00 1.00 0.00 0.00 33.01 33.97 4ayk s GLN 147 CO 0.22 -0.09 1.06 -0.51 -2.12 0.00 0.00 175.29 173.85 4ayk s LEU 148 N -2.07 4.13 0.31 2.90 1.43 -1.26 -4.81 118.68 119.32 4ayk s LEU 148 Ca -0.06 2.05 -0.03 0.00 -1.03 0.00 0.00 54.13 55.06 4ayk s LEU 148 Cb -0.02 -4.19 -0.04 0.00 0.03 0.00 0.00 46.19 41.96 4ayk s LEU 148 CO -0.05 -0.52 0.55 0.00 0.23 0.00 0.00 176.35 176.57 4ayk s ALA 149 N -1.66 3.65 0.29 4.21 0.00 -1.26 -4.94 121.76 122.05 4ayk s ALA 149 Ca 0.58 -0.70 -0.02 0.00 0.00 0.00 0.00 51.96 51.82 4ayk s ALA 149 Cb -0.22 -2.23 0.43 0.00 0.00 0.00 0.00 23.12 21.11 4ayk s ALA 149 CO 0.28 0.13 1.93 0.37 0.00 0.00 0.00 175.76 178.47 4ayk h GLN 150 N 1.28 1.11 -1.00 0.00 4.15 -1.96 -0.29 115.11 118.41 4ayk h GLN 150 Ca -0.48 -0.07 0.11 0.00 0.77 0.00 0.00 58.65 58.98 4ayk h GLN 150 Cb 1.20 -0.25 -0.08 0.00 0.21 0.00 0.00 27.48 28.56 4ayk h GLN 150 CO 0.64 0.73 0.63 0.22 -1.93 0.00 0.00 178.83 179.13 4ayk h ASP 151 N 1.14 0.94 -0.26 -0.69 1.82 -1.98 0.99 116.42 118.37 4ayk h ASP 151 Ca 0.36 0.04 -0.19 0.00 -0.39 0.00 0.00 57.03 56.85 4ayk h ASP 151 Cb 0.02 -0.15 0.00 0.00 0.68 0.00 0.00 39.33 39.88 4ayk h ASP 151 CO -0.11 0.52 -0.59 0.44 -1.61 0.00 0.00 179.24 177.89 4ayk h ASP 152 N 1.02 0.98 -0.01 2.28 3.32 -1.49 -2.57 116.42 119.96 4ayk h ASP 152 Ca 0.48 -0.55 0.00 0.00 0.02 0.00 0.00 57.03 56.99 4ayk h ASP 152 Cb 0.43 -0.28 -0.00 0.00 0.22 0.00 0.00 39.33 39.70 4ayk h ASP 152 CO -0.25 1.35 0.00 0.40 -1.72 0.00 0.00 179.24 179.03 4ayk h ILE 153 N 0.65 1.01 -0.94 0.35 1.08 0.29 0.16 117.51 120.10 4ayk h ILE 153 Ca 0.00 -0.03 -0.01 0.00 -0.39 0.00 0.00 64.86 64.43 4ayk h ILE 153 Cb 1.21 1.02 -0.05 0.00 -3.07 0.00 0.00 36.82 35.93 4ayk h ILE 153 CO 0.13 0.01 0.56 0.44 -0.69 0.00 0.00 178.15 178.60 4ayk h ASP 154 N -0.00 1.14 0.21 1.72 3.32 -0.91 -0.27 116.42 121.62 4ayk h ASP 154 Ca 0.00 -0.07 -0.01 0.00 0.02 0.00 0.00 57.03 56.97 4ayk h ASP 154 Cb 0.01 -0.29 0.00 0.00 0.22 0.00 0.00 39.33 39.27 4ayk h ASP 154 CO -0.00 0.88 -0.10 1.23 -1.72 0.00 0.00 179.24 179.53 4ayk h GLY 155 N 1.31 -0.29 1.03 2.75 0.00 -1.08 -1.46 103.07 105.32 4ayk h GLY 155 Ca 0.34 0.11 -0.02 0.00 0.00 0.00 0.00 47.33 47.75 4ayk h GLY 155 CO -0.06 -0.11 0.46 1.19 0.00 0.00 0.00 176.54 178.03 4ayk h ILE 156 N -0.82 1.26 -0.64 2.60 6.09 -0.68 -2.11 117.51 123.22 4ayk h ILE 156 Ca -0.03 -0.68 -0.09 0.00 -1.37 0.00 0.00 64.86 62.69 4ayk h ILE 156 Cb 0.51 0.08 -0.02 0.00 0.47 0.00 0.00 36.82 37.86 4ayk h ILE 156 CO 0.05 0.30 0.04 1.56 -3.07 0.00 0.00 178.15 177.03 4ayk h GLN 157 N 1.25 1.10 -0.60 2.19 4.20 -1.10 -2.74 115.11 119.40 4ayk h GLN 157 Ca 0.31 -0.33 0.01 0.00 0.06 0.00 0.00 58.65 58.70 4ayk h GLN 157 Cb 0.06 -0.11 -0.03 0.00 0.30 0.00 0.00 27.48 27.70 4ayk h GLN 157 CO -0.05 1.04 0.40 0.00 -0.67 0.00 0.00 178.83 179.56 4ayk h ALA 158 N 1.01 0.76 0.01 3.87 0.00 -0.75 2.14 119.26 126.30 4ayk h ALA 158 Ca 0.18 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 55.05 4ayk h ALA 158 Cb 0.52 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.07 4ayk h ALA 158 CO 0.03 0.20 -0.00 0.82 0.00 0.00 0.00 179.25 180.29 4ayk h ILE 159 N 0.81 1.00 0.00 0.00 2.04 -1.20 -3.38 117.51 116.78 4ayk h ILE 159 Ca 0.22 -0.01 0.00 0.00 1.00 0.00 0.00 64.86 66.07 4ayk h ILE 159 Cb -0.09 1.00 0.00 0.00 -0.74 0.00 0.00 36.82 36.99 4ayk h ILE 159 CO -0.05 0.00 -0.88 -1.22 0.00 0.00 0.00 178.15 176.01 4ayk n TYR 160 N -5.09 0.00 -1.09 1.37 4.01 -1.05 -5.13 117.16 110.18 4ayk n TYR 160 Ca -0.07 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.67 4ayk n TYR 160 Cb 0.04 -0.44 0.00 0.00 -0.31 0.00 0.00 39.34 38.63 4ayk n TYR 160 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 4ayk n GLY 161 N 1.51 -2.08 3.87 2.72 0.00 0.72 -5.05 105.19 106.89 4ayk n GLY 161 Ca -0.12 -1.37 -0.32 0.00 0.00 0.00 0.00 46.02 44.20 4ayk n GLY 161 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 4ayk s ARG 162 N -1.92 3.81 -1.12 1.61 0.52 -1.26 -4.38 118.95 116.22 4ayk s ARG 162 Ca 0.00 0.29 -0.22 0.00 -0.52 0.00 0.00 55.73 55.28 4ayk s ARG 162 Cb 0.00 -2.68 -0.02 0.00 0.52 0.00 0.00 34.95 32.77 4ayk s ARG 162 CO 0.00 0.34 1.82 -1.12 0.02 0.00 0.00 175.30 176.36 4ayk s SER 163 N -2.29 5.70 -0.32 0.23 0.01 -1.26 -4.74 113.70 111.04 4ayk s SER 163 Ca 0.46 -1.60 0.01 0.00 1.31 0.00 0.00 55.95 56.13 4ayk s SER 163 Cb -0.12 -2.58 0.32 0.00 0.21 0.00 0.00 66.02 63.86 4ayk s SER 163 CO 0.21 -2.32 1.77 0.00 0.41 0.00 0.00 173.24 173.31 4ayk n GLN 164 N 8.53 1.83 -3.15 12.44 6.02 -1.26 -4.48 117.38 137.31 4ayk n GLN 164 Ca 0.43 -1.79 -0.22 0.00 -0.01 0.00 0.00 57.00 55.41 4ayk n GLN 164 Cb 0.47 -1.70 -0.06 0.00 1.02 0.00 0.00 30.24 29.97 4ayk n GLN 164 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 4ayk n ASN 165 N -0.16 -0.53 -3.15 1.08 3.02 -1.26 -5.01 115.26 109.26 4ayk n ASN 165 Ca 0.35 -2.72 -0.35 0.00 -0.03 0.00 0.00 54.58 51.82 4ayk n ASN 165 Cb 0.88 -0.19 -0.04 0.00 -0.61 0.00 0.00 39.78 39.82 4ayk n ASN 165 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 4ayk n PRO 166 N 1.78 3.69 -2.97 3.52 -0.04 -1.26 -4.93 135.00 134.78 4ayk n PRO 166 Ca 0.21 -2.46 -0.42 0.00 -0.04 0.00 0.00 63.50 60.79 4ayk n PRO 166 Cb 0.54 -2.60 -0.05 0.00 -0.04 0.00 0.00 33.50 31.34 4ayk n PRO 166 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 4ayk s VAL 167 N 0.66 4.85 0.44 0.52 1.01 -1.26 -5.04 120.40 121.59 4ayk s VAL 167 Ca 0.64 1.25 -0.22 0.00 0.00 0.00 0.00 61.98 63.65 4ayk s VAL 167 Cb 0.21 -4.09 -0.09 0.00 0.00 0.00 0.00 36.38 32.41 4ayk s VAL 167 CO -0.08 -0.14 1.01 -1.10 0.00 0.00 0.00 175.10 174.80 4ayk s GLN 168 N 2.81 4.05 0.00 2.72 -0.21 -1.26 -5.29 119.66 122.48 4ayk s GLN 168 Ca 0.31 1.33 0.00 0.00 0.02 0.00 0.00 55.36 57.03 4ayk s GLN 168 Cb -0.15 -2.27 0.00 0.00 1.00 0.00 0.00 33.01 31.59 4ayk s GLN 168 CO 0.10 -0.21 0.12 -2.30 -2.12 0.00 0.00 175.29 170.87