#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 4ayk h LEU 2 N 0.00 1.13-10.05 6.55 3.38 -2.02 -3.42 115.31 110.88 4ayk h LEU 2 Ca 0.00 -0.09 -0.53 0.00 0.09 0.00 0.00 57.88 57.36 4ayk h LEU 2 Cb 0.00 -0.29 -0.02 0.00 0.09 0.00 0.00 40.66 40.45 4ayk h LEU 2 CO 0.00 0.89 -0.13 0.42 0.09 0.00 0.00 178.44 179.71 4ayk s THR 3 N -5.89 4.99 0.35 0.22 -4.23 -1.26 -5.06 115.64 104.76 4ayk s THR 3 Ca -0.13 0.24 -0.27 0.00 -1.18 0.00 0.00 61.69 60.35 4ayk s THR 3 Cb 0.17 -3.68 -0.09 0.00 1.34 0.00 0.00 72.50 70.24 4ayk s THR 3 CO 0.83 -0.22 1.11 -0.70 -0.54 0.00 0.00 174.62 175.10 4ayk s GLU 4 N -3.24 4.33 1.28 3.99 2.12 -1.26 -4.78 118.70 121.14 4ayk s GLU 4 Ca 0.45 1.73 0.00 0.00 0.36 0.00 0.00 54.97 57.52 4ayk s GLU 4 Cb -0.11 -2.85 0.00 0.00 0.26 0.00 0.00 34.13 31.43 4ayk s GLU 4 CO 0.26 -0.05 0.00 0.41 -0.54 0.00 0.00 175.26 175.35 4ayk n GLY 5 N 0.77 -1.69 3.74 -1.50 0.00 -1.26 -4.83 105.19 100.42 4ayk n GLY 5 Ca 0.02 -1.53 -0.41 0.00 0.00 0.00 0.00 46.02 44.10 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 7.57 1.26 1.61 0.02 -1.26 -4.86 114.94 115.28 4ayk s ASN 6 Ca 0.00 1.87 -0.18 0.00 -1.02 0.00 0.00 52.86 53.53 4ayk s ASN 6 Cb 0.00 -2.60 0.28 0.00 0.02 0.00 0.00 41.25 38.95 4ayk s ASN 6 CO 0.00 0.04 0.90 -0.81 0.02 0.00 0.00 177.10 177.26 4ayk n PRO 7 N 2.14 -3.19 -4.05 -0.60 -0.04 -1.26 -5.05 135.00 122.95 4ayk n PRO 7 Ca 0.00 -1.46 -0.08 0.00 -0.04 0.00 0.00 63.50 61.93 4ayk n PRO 7 Cb 0.48 -1.46 -0.09 0.00 -0.04 0.00 0.00 33.50 32.39 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 -5.07 0.71 -0.36 0.54 0.52 -1.26 -4.87 118.95 109.16 4ayk s ARG 8 Ca 0.60 -1.19 -0.25 0.00 -0.52 0.00 0.00 55.73 54.37 4ayk s ARG 8 Cb -0.07 0.25 0.01 0.00 0.52 0.00 0.00 34.95 35.66 4ayk s ARG 8 CO 0.47 -0.17 0.89 -1.58 0.02 0.00 0.00 175.30 174.94 4ayk s TRP 9 N -3.93 3.09 -1.02 -0.53 0.52 -1.26 -4.87 118.94 110.94 4ayk s TRP 9 Ca 0.09 0.73 0.25 0.00 0.02 0.00 0.00 56.10 57.19 4ayk s TRP 9 Cb 0.07 -3.58 0.54 0.00 -1.15 0.00 0.00 33.47 29.35 4ayk s TRP 9 CO -0.08 -0.80 1.44 0.39 0.02 0.00 0.00 176.95 177.92 4ayk n GLU 10 N 6.68 0.02 -2.80 4.98 1.02 -1.26 -4.89 120.64 124.39 4ayk n GLU 10 Ca 0.06 -0.01 -0.33 0.00 -0.02 0.00 0.00 57.16 56.86 4ayk n GLU 10 Cb 0.48 -1.50 -0.06 0.00 -0.02 0.00 0.00 31.44 30.34 4ayk n GLU 10 CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 4ayk s GLN 11 N -2.99 4.15 0.00 3.49 -0.21 -1.26 -4.96 119.66 117.88 4ayk s GLN 11 Ca 0.11 1.02 0.24 0.00 0.02 0.00 0.00 55.36 56.75 4ayk s GLN 11 Cb 0.18 -2.21 0.25 0.00 1.00 0.00 0.00 33.01 32.22 4ayk s GLN 11 CO 0.69 -0.04 1.25 0.25 -2.12 0.00 0.00 175.29 175.32 4ayk n THR 12 N -0.75 0.00 -4.95 -0.19 -2.24 -1.26 -4.86 114.28 100.03 4ayk n THR 12 Ca 0.06 -0.21 -0.28 0.00 -2.27 0.00 0.00 64.05 61.35 4ayk n THR 12 Cb 0.54 0.95 -0.17 0.00 -2.10 0.00 0.00 70.33 69.55 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 -2.50 2.02 0.06 4.78 3.76 -1.26 -2.19 115.29 119.95 4ayk s HIS 13 Ca 0.20 -0.74 0.04 0.00 -0.15 0.00 0.00 55.06 54.41 4ayk s HIS 13 Cb 0.18 -1.38 -0.03 0.00 1.11 0.00 0.00 32.58 32.47 4ayk s HIS 13 CO 0.56 -0.30 -0.11 -0.51 -0.85 0.00 0.00 174.74 173.53 4ayk s LEU 14 N 0.32 2.26 0.16 0.89 1.43 -0.94 -5.00 118.68 117.79 4ayk s LEU 14 Ca -0.13 -0.58 0.08 0.00 -1.03 0.00 0.00 54.13 52.48 4ayk s LEU 14 Cb -0.15 -0.37 -0.04 0.00 0.03 0.00 0.00 46.19 45.65 4ayk s LEU 14 CO 0.05 -0.12 -0.18 0.42 0.23 0.00 0.00 176.35 176.75 4ayk s THR 15 N -1.29 1.78 0.06 5.49 -4.23 -1.26 -2.17 115.64 114.02 4ayk s THR 15 Ca -0.05 -1.87 -0.04 0.00 -1.18 0.00 0.00 61.69 58.55 4ayk s THR 15 Cb -0.10 -1.80 -0.02 0.00 1.34 0.00 0.00 72.50 71.92 4ayk s THR 15 CO 0.01 -0.30 0.06 -0.72 -0.54 0.00 0.00 174.62 173.14 4ayk s TYR 16 N -1.96 0.36 -0.13 3.99 -0.85 -1.06 -1.87 117.35 115.82 4ayk s TYR 16 Ca 0.14 -0.84 -0.09 0.00 -0.52 0.00 0.00 57.07 55.77 4ayk s TYR 16 Cb -0.06 -0.25 0.04 0.00 0.38 0.00 0.00 41.96 42.08 4ayk s TYR 16 CO 0.06 -0.44 0.32 0.50 -1.52 0.00 0.00 175.55 174.47 4ayk s ARG 17 N -3.78 0.32 -0.20 -3.49 3.52 -1.03 -2.34 118.95 111.95 4ayk s ARG 17 Ca 0.05 0.56 -0.20 0.00 -0.13 0.00 0.00 55.73 56.01 4ayk s ARG 17 Cb 0.06 0.03 -0.03 0.00 -1.56 0.00 0.00 34.95 33.45 4ayk s ARG 17 CO -0.10 -0.11 0.60 0.42 -0.81 0.00 0.00 175.30 175.30 4ayk s ILE 18 N 0.86 5.04 0.14 4.11 1.01 -1.26 -2.02 121.20 129.07 4ayk s ILE 18 Ca -0.06 1.13 -0.12 0.00 0.00 0.00 0.00 60.65 61.60 4ayk s ILE 18 Cb -0.07 -3.92 -0.00 0.00 0.01 0.00 0.00 42.46 38.48 4ayk s ILE 18 CO -0.06 0.12 1.56 -0.33 0.00 0.00 0.00 174.94 176.22 4ayk h GLU 19 N 7.52 0.88 -1.98 2.79 5.08 -1.42 -3.47 114.58 123.98 4ayk h GLU 19 Ca -0.31 -0.33 -0.02 0.00 -1.00 0.00 0.00 59.36 57.69 4ayk h GLU 19 Cb 1.14 -0.05 -0.19 0.00 0.50 0.00 0.00 28.75 30.15 4ayk h GLU 19 CO 0.76 0.98 0.28 0.54 -1.00 0.00 0.00 179.01 180.57 4ayk s ASN 20 N -6.49 -0.58 -0.08 1.42 4.22 -1.26 -5.10 114.94 107.07 4ayk s ASN 20 Ca -0.12 0.57 -0.11 0.00 -2.14 0.00 0.00 52.86 51.06 4ayk s ASN 20 Cb 0.11 0.48 -0.05 0.00 1.28 0.00 0.00 41.25 43.08 4ayk s ASN 20 CO 0.84 -0.57 0.26 -0.31 -2.04 0.00 0.00 177.10 175.28 4ayk s TYR 21 N -1.42 3.63 0.38 1.54 2.02 -1.26 -4.60 117.35 117.65 4ayk s TYR 21 Ca -0.07 0.71 -0.25 0.00 -0.37 0.00 0.00 57.07 57.08 4ayk s TYR 21 Cb -0.00 -2.13 -0.09 0.00 -0.40 0.00 0.00 41.96 39.34 4ayk s TYR 21 CO 0.06 0.62 1.11 -0.08 -1.57 0.00 0.00 175.55 175.70 4ayk s THR 22 N -0.81 3.42 -0.72 -0.71 -1.32 -1.26 -4.90 115.64 109.33 4ayk s THR 22 Ca 0.18 1.18 0.14 0.00 -1.21 0.00 0.00 61.69 61.99 4ayk s THR 22 Cb -0.14 -3.66 0.14 0.00 -1.51 0.00 0.00 72.50 67.33 4ayk s THR 22 CO 0.07 0.10 1.44 -0.81 -2.21 0.00 0.00 174.62 173.21 4ayk n PRO 23 N 0.19 0.07 -0.36 7.08 -0.04 -1.26 -2.83 135.00 137.85 4ayk n PRO 23 Ca 0.04 0.43 -0.03 0.00 -0.04 0.00 0.00 63.50 63.90 4ayk n PRO 23 Cb 0.47 -1.68 0.10 0.00 -0.04 0.00 0.00 33.50 32.36 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 1.12 -4.73 3.54 3.32 -1.98 -3.43 116.42 114.25 4ayk h ASP 24 Ca 0.00 -0.04 -0.27 0.00 0.02 0.00 0.00 57.03 56.74 4ayk h ASP 24 Cb 0.16 -0.28 -0.20 0.00 0.22 0.00 0.00 39.33 39.23 4ayk h ASP 24 CO 0.00 0.82 -0.73 -0.76 -1.72 0.00 0.00 179.24 176.85 4ayk s LEU 25 N -10.10 2.29 0.00 1.55 1.43 -1.13 -5.05 118.68 107.67 4ayk s LEU 25 Ca -0.13 -0.61 -0.17 0.00 -1.03 0.00 0.00 54.13 52.19 4ayk s LEU 25 Cb 0.17 -0.17 0.26 0.00 0.03 0.00 0.00 46.19 46.49 4ayk s LEU 25 CO 0.82 -0.23 0.76 -0.81 0.23 0.00 0.00 176.35 177.12 4ayk n PRO 26 N 1.27 -3.34 0.04 1.29 -0.04 -1.26 -4.54 135.00 128.42 4ayk n PRO 26 Ca -0.21 -1.24 -0.16 0.00 -0.04 0.00 0.00 63.50 61.84 4ayk n PRO 26 Cb 0.55 -1.34 -0.14 0.00 -0.04 0.00 0.00 33.50 32.53 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 0.21 -0.70 0.54 0.11 -1.97 -3.16 114.38 109.41 4ayk h ARG 27 Ca -0.31 -0.37 0.03 0.00 0.10 0.00 0.00 59.98 59.43 4ayk h ARG 27 Cb 0.98 0.14 -0.04 0.00 1.11 0.00 0.00 29.97 32.16 4ayk h ARG 27 CO 0.19 1.04 0.44 0.00 0.10 0.00 0.00 179.97 181.75 4ayk h ALA 28 N 0.51 0.92 -0.39 0.08 0.00 -1.99 0.37 119.26 118.74 4ayk h ALA 28 Ca -0.27 -0.03 -0.15 0.00 0.00 0.00 0.00 54.91 54.46 4ayk h ALA 28 Cb 2.01 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 19.56 4ayk h ALA 28 CO 0.14 0.23 -0.35 -0.44 0.00 0.00 0.00 179.25 178.82 4ayk h ASP 29 N 0.87 0.98 -0.31 0.00 3.32 -1.95 -2.78 116.42 116.54 4ayk h ASP 29 Ca 0.28 -0.43 -0.11 0.00 0.02 0.00 0.00 57.03 56.79 4ayk h ASP 29 Cb 0.00 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.27 4ayk h ASP 29 CO -0.10 1.22 -0.23 0.58 -1.72 0.00 0.00 179.24 178.99 4ayk h VAL 30 N 0.76 1.29 -1.01 -1.35 2.07 -1.37 -2.76 116.25 113.89 4ayk h VAL 30 Ca 0.07 -1.37 0.01 0.00 0.82 0.00 0.00 66.70 66.23 4ayk h VAL 30 Cb 0.94 1.49 -0.05 0.00 -1.52 0.00 0.00 31.29 32.15 4ayk h VAL 30 CO 0.09 0.44 0.67 0.44 0.02 0.00 0.00 177.57 179.23 4ayk h ASP 31 N 0.47 1.16 -0.35 0.57 3.32 -0.27 -1.81 116.42 119.51 4ayk h ASP 31 Ca 0.06 -0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.08 4ayk h ASP 31 Cb 0.78 -0.29 -0.02 0.00 0.22 0.00 0.00 39.33 40.03 4ayk h ASP 31 CO 0.06 0.84 0.22 -0.74 -1.72 0.00 0.00 179.24 177.90 4ayk h HIS 32 N 1.37 0.45 -0.65 4.55 2.76 -1.39 0.24 115.15 122.49 4ayk h HIS 32 Ca 0.37 0.00 0.01 0.00 -2.20 0.00 0.00 60.37 58.55 4ayk h HIS 32 Cb -0.16 -0.15 -0.03 0.00 1.55 0.00 0.00 27.41 28.62 4ayk h HIS 32 CO 0.00 0.31 0.43 0.00 -1.30 0.00 0.00 177.93 177.36 4ayk h ALA 33 N 1.11 0.82 -0.31 5.26 0.00 -1.12 0.41 119.26 125.43 4ayk h ALA 33 Ca 0.13 -0.05 -0.18 0.00 0.00 0.00 0.00 54.91 54.81 4ayk h ALA 33 Cb -0.02 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.51 4ayk h ALA 33 CO -0.03 0.25 -0.50 0.82 0.00 0.00 0.00 179.25 179.79 4ayk h ILE 34 N 0.87 1.27 -0.37 0.00 1.08 -1.01 -2.72 117.51 116.63 4ayk h ILE 34 Ca 0.24 -1.68 -0.16 0.00 -0.39 0.00 0.00 64.86 62.86 4ayk h ILE 34 Cb -0.10 1.58 -0.01 0.00 -3.07 0.00 0.00 36.82 35.22 4ayk h ILE 34 CO -0.05 0.55 -0.38 -0.08 -0.69 0.00 0.00 178.15 177.50 4ayk h GLU 35 N 0.68 0.92 -0.86 2.37 4.81 -0.19 -2.93 114.58 119.38 4ayk h GLU 35 Ca 0.02 -0.49 -0.01 0.00 -0.13 0.00 0.00 59.36 58.76 4ayk h GLU 35 Cb 1.11 0.02 -0.04 0.00 0.63 0.00 0.00 28.75 30.47 4ayk h GLU 35 CO 0.12 1.14 0.51 -0.22 -0.73 0.00 0.00 179.01 179.83 4ayk h LYS 36 N 0.73 1.18 -0.27 1.92 1.63 -0.17 -1.31 116.57 120.27 4ayk h LYS 36 Ca 0.06 -0.11 -0.01 0.00 -0.85 0.00 0.00 60.65 59.74 4ayk h LYS 36 Cb 0.98 -0.24 -0.01 0.00 -0.60 0.00 0.00 32.23 32.35 4ayk h LYS 36 CO 0.09 0.83 0.15 0.00 -3.45 0.00 0.00 179.45 177.08 4ayk h ALA 37 N 1.28 0.35 -0.95 5.00 0.00 -1.41 -1.70 119.26 121.83 4ayk h ALA 37 Ca 0.31 -0.07 0.01 0.00 0.00 0.00 0.00 54.91 55.16 4ayk h ALA 37 Cb -0.03 -0.11 -0.05 0.00 0.00 0.00 0.00 17.79 17.60 4ayk h ALA 37 CO -0.06 -0.12 0.63 0.74 0.00 0.00 0.00 179.25 180.45 4ayk h PHE 38 N 0.32 1.19 -0.96 0.00 0.04 -1.28 -2.15 116.94 114.10 4ayk h PHE 38 Ca 0.10 0.03 0.01 0.00 2.80 0.00 0.00 57.97 60.90 4ayk h PHE 38 Cb 0.07 -0.40 -0.05 0.00 2.20 0.00 0.00 35.95 37.77 4ayk h PHE 38 CO -0.03 0.75 0.64 1.96 -0.60 0.00 0.00 178.31 181.03 4ayk h GLN 39 N 1.29 1.26 -0.49 1.51 1.08 -0.73 0.85 115.11 119.88 4ayk h GLN 39 Ca 0.35 -0.08 0.00 0.00 -1.45 0.00 0.00 58.65 57.48 4ayk h GLN 39 Cb -0.15 -0.29 -0.02 0.00 -0.05 0.00 0.00 27.48 26.97 4ayk h GLN 39 CO -0.08 0.84 0.33 -0.07 -0.95 0.00 0.00 178.83 178.90 4ayk h LEU 40 N 1.30 0.56 -0.27 1.46 3.38 -0.66 0.44 115.31 121.53 4ayk h LEU 40 Ca 0.35 -0.01 -0.19 0.00 0.09 0.00 0.00 57.88 58.11 4ayk h LEU 40 Cb -0.15 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.47 4ayk h LEU 40 CO -0.08 0.41 -0.60 -0.50 0.09 0.00 0.00 178.44 177.76 4ayk h TRP 41 N 0.67 1.10 -0.03 1.13 4.06 -1.21 -3.06 115.95 118.60 4ayk h TRP 41 Ca 0.18 -0.41 -0.09 0.00 2.06 0.00 0.00 58.89 60.62 4ayk h TRP 41 Cb -0.08 -0.20 -0.01 0.00 -1.00 0.00 0.00 29.16 27.87 4ayk h TRP 41 CO -0.04 1.25 -0.42 1.03 -3.56 0.00 0.00 178.44 176.70 4ayk h SER 42 N 0.65 0.07 -0.76 -3.49 0.87 -0.52 -2.24 113.55 108.12 4ayk h SER 42 Ca -0.00 -0.03 0.01 0.00 -1.23 0.00 0.00 61.79 60.55 4ayk h SER 42 Cb 1.21 -0.02 -0.04 0.00 -0.44 0.00 0.00 62.40 63.12 4ayk h SER 42 CO 0.13 0.48 0.51 0.78 -0.53 0.00 0.00 176.83 178.20 4ayk h ASN 43 N 0.05 0.87 -0.49 6.23 -0.26 -0.01 -2.62 115.58 119.35 4ayk h ASN 43 Ca 0.00 -0.02 0.00 0.00 -0.56 0.00 0.00 56.30 55.72 4ayk h ASN 43 Cb 0.76 -0.21 0.00 0.00 -1.06 0.00 0.00 38.32 37.81 4ayk h ASN 43 CO 0.06 0.62 0.00 1.33 -1.06 0.00 0.00 177.43 178.38 4ayk n VAL 44 N -4.42 1.05 -4.01 2.81 0.24 -1.14 -4.96 118.33 107.89 4ayk n VAL 44 Ca 0.09 -1.02 -0.11 0.00 -2.04 0.00 0.00 64.34 61.25 4ayk n VAL 44 Cb 0.04 0.48 -0.11 0.00 -1.47 0.00 0.00 33.84 32.78 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 -1.06 0.28 -2.00 3.34 -4.23 -0.86 -3.94 115.64 107.17 4ayk s THR 45 Ca 0.33 -0.92 0.06 0.00 -1.18 0.00 0.00 61.69 59.98 4ayk s THR 45 Cb 0.18 -0.39 0.18 0.00 1.34 0.00 0.00 72.50 73.81 4ayk s THR 45 CO 0.22 -0.42 1.00 -0.81 -0.54 0.00 0.00 174.62 174.07 4ayk n PRO 46 N 1.64 0.72 -1.62 3.99 -0.04 -1.26 -4.59 135.00 133.84 4ayk n PRO 46 Ca -0.23 0.00 -0.32 0.00 -0.04 0.00 0.00 63.50 62.92 4ayk n PRO 46 Cb 0.55 -1.14 0.05 0.00 -0.04 0.00 0.00 33.50 32.93 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 -1.27 3.23 0.04 1.53 1.43 -1.26 -4.99 118.68 117.40 4ayk s LEU 47 Ca 0.09 1.79 0.01 0.00 -1.03 0.00 0.00 54.13 55.00 4ayk s LEU 47 Cb 0.04 -4.52 -0.03 0.00 0.03 0.00 0.00 46.19 41.72 4ayk s LEU 47 CO 0.07 -1.58 -0.06 0.42 0.23 0.00 0.00 176.35 175.43 4ayk s THR 48 N -2.74 0.41 0.12 5.49 -4.23 -0.93 -4.67 115.64 109.10 4ayk s THR 48 Ca 0.62 -1.19 0.05 0.00 -1.18 0.00 0.00 61.69 59.98 4ayk s THR 48 Cb -0.17 -0.71 -0.04 0.00 1.34 0.00 0.00 72.50 72.92 4ayk s THR 48 CO 0.49 -0.52 -0.12 -0.36 -0.54 0.00 0.00 174.62 173.56 4ayk s PHE 49 N -1.87 1.28 -0.20 3.99 0.08 -1.26 -2.22 117.98 117.78 4ayk s PHE 49 Ca -0.08 -0.62 -0.13 0.00 0.12 0.00 0.00 56.93 56.22 4ayk s PHE 49 Cb -0.07 -0.67 0.06 0.00 -0.57 0.00 0.00 43.02 41.77 4ayk s PHE 49 CO -0.01 0.10 0.51 0.99 -0.10 0.00 0.00 175.22 176.70 4ayk s THR 50 N -2.45 -0.01 0.14 0.64 2.01 -0.92 -4.97 115.64 110.08 4ayk s THR 50 Ca 0.09 0.05 -0.28 0.00 0.31 0.00 0.00 61.69 61.86 4ayk s THR 50 Cb -0.03 -0.73 -0.07 0.00 0.01 0.00 0.00 72.50 71.68 4ayk s THR 50 CO 0.02 0.02 0.89 -0.75 -0.69 0.00 0.00 174.62 174.10 4ayk s LYS 51 N 1.15 4.68 -0.09 4.92 2.20 -1.26 -2.57 119.74 128.76 4ayk s LYS 51 Ca -0.07 1.34 0.04 0.00 -0.36 0.00 0.00 55.97 56.91 4ayk s LYS 51 Cb -0.06 -3.33 -0.01 0.00 -1.51 0.00 0.00 37.83 32.92 4ayk s LYS 51 CO -0.11 0.37 -0.21 0.14 -0.36 0.00 0.00 175.35 175.18 4ayk s VAL 52 N -0.54 2.35 -2.67 4.02 -7.23 -0.99 -4.93 120.40 110.42 4ayk s VAL 52 Ca 0.42 -0.93 0.25 0.00 -1.81 0.00 0.00 61.98 59.91 4ayk s VAL 52 Cb -0.23 -1.91 0.39 0.00 0.56 0.00 0.00 36.38 35.19 4ayk s VAL 52 CO 0.28 0.56 1.51 -0.24 -0.31 0.00 0.00 175.10 176.90 4ayk n SER 53 N 3.29 2.27 -3.93 4.85 2.88 -1.26 -4.65 113.62 117.07 4ayk n SER 53 Ca -0.18 -1.76 -0.09 0.00 -1.33 0.00 0.00 58.87 55.51 4ayk n SER 53 Cb 0.53 -0.03 -0.09 0.00 -0.75 0.00 0.00 64.21 63.86 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 -1.93 0.69 0.22 -1.46 2.02 -1.26 -5.11 118.70 111.87 4ayk s GLU 54 Ca 0.34 -0.91 0.00 0.00 0.02 0.00 0.00 54.97 54.41 4ayk s GLU 54 Cb 0.20 0.27 0.00 0.00 0.10 0.00 0.00 34.13 34.70 4ayk s GLU 54 CO 0.31 -0.18 0.00 0.41 0.02 0.00 0.00 175.26 175.82 4ayk n GLY 55 N 0.34 -2.44 3.87 -1.39 0.00 -1.26 -4.87 105.19 99.44 4ayk n GLY 55 Ca -0.17 -1.32 -0.31 0.00 0.00 0.00 0.00 46.02 44.23 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 -2.81 3.54 0.25 1.61 -2.07 -1.26 -5.04 119.66 113.88 4ayk s GLN 56 Ca 0.00 0.72 0.11 0.00 -1.82 0.00 0.00 55.36 54.38 4ayk s GLN 56 Cb 0.00 -2.08 -0.05 0.00 -1.09 0.00 0.00 33.01 29.80 4ayk s GLN 56 CO 0.00 -0.61 -0.20 0.00 -1.32 0.00 0.00 175.29 173.16 4ayk s ALA 57 N -3.19 2.62 0.26 2.60 0.00 -1.26 -5.02 121.76 117.76 4ayk s ALA 57 Ca 0.55 -1.80 -0.04 0.00 0.00 0.00 0.00 51.96 50.67 4ayk s ALA 57 Cb -0.11 -0.26 0.33 0.00 0.00 0.00 0.00 23.12 23.08 4ayk s ALA 57 CO 0.54 0.29 1.93 -0.44 0.00 0.00 0.00 175.76 178.08 4ayk h ASP 58 N 2.53 1.09 -3.06 0.00 3.32 -1.76 -3.39 116.42 115.15 4ayk h ASP 58 Ca -0.41 -0.02 -0.67 0.00 0.02 0.00 0.00 57.03 55.95 4ayk h ASP 58 Cb 1.24 -0.26 -0.35 0.00 0.22 0.00 0.00 39.33 40.18 4ayk h ASP 58 CO 0.57 0.77 -0.86 -0.63 -1.72 0.00 0.00 179.24 177.37 4ayk s ILE 59 N -6.06 2.04 -0.15 0.35 1.01 -0.78 -4.68 121.20 112.92 4ayk s ILE 59 Ca -0.13 -0.92 -0.07 0.00 0.00 0.00 0.00 60.65 59.53 4ayk s ILE 59 Cb 0.18 -1.84 -0.04 0.00 0.01 0.00 0.00 42.46 40.77 4ayk s ILE 59 CO 0.81 0.54 0.11 -0.04 0.00 0.00 0.00 174.94 176.36 4ayk s MET 60 N 1.30 3.68 -0.14 2.79 -1.94 -1.25 -2.47 119.30 121.27 4ayk s MET 60 Ca 0.05 -0.21 0.01 0.00 -1.71 0.00 0.00 55.69 53.83 4ayk s MET 60 Cb -0.13 -3.22 -0.00 0.00 2.01 0.00 0.00 34.83 33.49 4ayk s MET 60 CO -0.13 0.57 -0.17 0.42 -0.01 0.00 0.00 175.02 175.71 4ayk s ILE 61 N -0.45 2.58 0.05 2.53 1.01 -0.86 -0.55 121.20 125.51 4ayk s ILE 61 Ca 0.11 -0.81 -0.11 0.00 0.00 0.00 0.00 60.65 59.84 4ayk s ILE 61 Cb -0.12 -2.07 0.01 0.00 0.01 0.00 0.00 42.46 40.29 4ayk s ILE 61 CO 0.02 0.53 0.24 -0.94 0.00 0.00 0.00 174.94 174.78 4ayk s SER 62 N 0.66 -0.03 -0.10 3.58 1.04 -1.07 -0.91 113.70 116.87 4ayk s SER 62 Ca -0.09 -0.32 -0.03 0.00 0.48 0.00 0.00 55.95 56.00 4ayk s SER 62 Cb -0.16 0.32 -0.03 0.00 0.10 0.00 0.00 66.02 66.25 4ayk s SER 62 CO 0.02 -0.59 0.03 -0.36 0.98 0.00 0.00 173.24 173.32 4ayk s PHE 63 N -2.65 3.23 0.21 5.02 0.40 -1.26 -2.32 117.98 120.61 4ayk s PHE 63 Ca -0.04 0.23 0.05 0.00 -0.60 0.00 0.00 56.93 56.56 4ayk s PHE 63 Cb -0.01 -1.84 -0.05 0.00 0.51 0.00 0.00 43.02 41.64 4ayk s PHE 63 CO -0.04 0.48 -0.06 0.14 0.70 0.00 0.00 175.22 176.44 4ayk s VAL 64 N -0.79 1.22 -0.04 -0.44 -7.23 -1.05 -4.93 120.40 107.14 4ayk s VAL 64 Ca 0.12 -2.07 0.02 0.00 -1.81 0.00 0.00 61.98 58.24 4ayk s VAL 64 Cb -0.12 -2.16 0.01 0.00 0.56 0.00 0.00 36.38 34.67 4ayk s VAL 64 CO 0.02 -0.49 -0.09 -0.13 -0.31 0.00 0.00 175.10 174.10 4ayk s ARG 65 N -3.79 1.21 1.80 4.82 0.52 -1.26 -2.52 118.95 119.73 4ayk s ARG 65 Ca 0.24 -0.31 0.00 0.00 -0.52 0.00 0.00 55.73 55.14 4ayk s ARG 65 Cb 0.04 -1.08 0.00 0.00 0.52 0.00 0.00 34.95 34.43 4ayk s ARG 65 CO 0.06 0.05 0.00 0.41 0.02 0.00 0.00 175.30 175.85 4ayk n GLY 66 N 3.60 2.15 3.69 -3.53 0.00 -1.26 -4.28 105.19 105.57 4ayk n GLY 66 Ca -0.21 -0.19 -0.42 0.00 0.00 0.00 0.00 46.02 45.20 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 6.90 -0.35 1.61 -1.08 -1.26 -4.20 116.67 114.28 4ayk s ASP 67 Ca 0.00 2.08 0.14 0.00 -0.52 0.00 0.00 52.55 54.25 4ayk s ASP 67 Cb 0.00 -2.56 0.45 0.00 -1.46 0.00 0.00 42.92 39.35 4ayk s ASP 67 CO 0.00 -0.67 1.00 0.00 0.52 0.00 0.00 175.17 176.02 4ayk n HIS 68 N 5.12 1.83 -3.44 -5.34 1.44 -1.26 -4.97 115.22 108.60 4ayk n HIS 68 Ca 0.12 -2.87 -0.18 0.00 -2.01 0.00 0.00 57.72 52.78 4ayk n HIS 68 Cb 0.44 -0.29 0.07 0.00 0.12 0.00 0.00 29.99 30.33 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 -0.20 -4.91 -4.14 -1.40 1.74 -1.26 -5.02 116.66 101.47 4ayk n ARG 69 Ca 0.18 0.79 -0.09 0.00 -0.77 0.00 0.00 57.85 57.96 4ayk n ARG 69 Cb 0.77 -5.65 -0.10 0.00 -1.02 0.00 0.00 32.46 26.46 4ayk n ARG 69 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 4ayk s ASP 70 N -4.07 0.49 0.00 0.55 1.01 -1.26 -5.02 116.67 108.37 4ayk s ASP 70 Ca 0.14 -1.13 0.13 0.00 0.71 0.00 0.00 52.55 52.40 4ayk s ASP 70 Cb -0.02 0.24 0.38 0.00 1.01 0.00 0.00 42.92 44.53 4ayk s ASP 70 CO 0.75 -0.66 1.31 -3.20 0.21 0.00 0.00 175.17 173.58 4ayk n ASN 71 N -0.04 1.98 -3.23 0.27 2.85 -1.26 -4.39 115.26 111.45 4ayk n ASN 71 Ca -0.09 -1.97 -0.25 0.00 -0.11 0.00 0.00 54.58 52.17 4ayk n ASN 71 Cb 0.63 -0.23 -0.08 0.00 1.24 0.00 0.00 39.78 41.34 4ayk n ASN 71 CO 0.00 0.00 0.00 -1.20 -2.11 0.00 0.00 177.26 173.95 4ayk n SER 72 N 0.57 0.12 -4.82 1.20 7.64 -1.26 -5.13 113.62 111.95 4ayk n SER 72 Ca 0.13 -2.65 -0.31 0.00 1.01 0.00 0.00 58.87 57.05 4ayk n SER 72 Cb 0.32 -0.63 0.04 0.00 -1.01 0.00 0.00 64.21 62.94 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 -1.00 2.99 0.41 1.43 0.04 -1.26 -5.02 135.00 132.59 4ayk s PRO 73 Ca 0.35 0.99 -0.23 0.00 0.04 0.00 0.00 61.00 62.15 4ayk s PRO 73 Cb 0.15 -2.00 -0.09 0.00 0.04 0.00 0.00 34.50 32.60 4ayk s PRO 73 CO -0.12 -1.06 1.02 -0.06 0.04 0.00 0.00 177.00 176.82 4ayk s PHE 74 N -2.96 3.28 -0.98 0.56 0.40 -1.26 -4.97 117.98 112.05 4ayk s PHE 74 Ca 0.59 1.64 -0.01 0.00 -0.60 0.00 0.00 56.93 58.56 4ayk s PHE 74 Cb -0.14 -3.04 0.32 0.00 0.51 0.00 0.00 43.02 40.66 4ayk s PHE 74 CO 0.52 -0.46 1.63 -3.47 0.70 0.00 0.00 175.22 174.14 4ayk n ASP 75 N -0.25 6.74 -0.25 1.36 -0.08 -1.25 -4.84 116.55 117.98 4ayk n ASP 75 Ca 0.06 -3.63 0.00 0.00 -1.51 0.00 0.00 54.79 49.71 4ayk n ASP 75 Cb 0.51 -1.10 0.00 0.00 2.34 0.00 0.00 41.12 42.87 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 0.22 -1.17 0.35 0.27 0.00 -1.26 -3.40 105.19 100.20 4ayk n GLY 76 Ca 0.40 -1.19 0.18 0.00 0.00 0.00 0.00 46.02 45.41 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 -7.40 1.61 0.11 -1.96 -3.42 132.00 120.94 4ayk h PRO 77 Ca 0.00 0.00 -0.46 0.00 0.11 0.00 0.00 66.00 65.65 4ayk h PRO 77 Cb 0.00 0.00 0.12 0.00 0.11 0.00 0.00 31.00 31.23 4ayk h PRO 77 CO 0.00 0.00 0.24 0.20 -0.21 0.00 0.00 178.00 178.23 4ayk s GLY 78 N -3.86 1.77 0.00 -0.55 0.00 -1.22 -4.96 107.32 98.50 4ayk s GLY 78 Ca -0.04 -1.51 0.00 0.00 0.00 0.00 0.00 44.72 43.17 4ayk s GLY 78 CO 0.40 -0.86 0.00 0.61 0.00 0.00 0.00 173.10 173.25 4ayk n GLY 79 N -3.21 -1.80 3.80 0.20 0.00 -1.26 -3.88 105.19 99.03 4ayk n GLY 79 Ca 0.15 -1.84 -0.34 0.00 0.00 0.00 0.00 46.02 43.99 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 6.32 0.06 1.61 6.03 -1.26 -4.95 114.94 118.75 4ayk s ASN 80 Ca 0.00 1.91 0.24 0.00 -1.03 0.00 0.00 52.86 53.98 4ayk s ASN 80 Cb 0.00 -2.56 0.25 0.00 -3.03 0.00 0.00 41.25 35.92 4ayk s ASN 80 CO 0.00 -0.80 1.22 0.18 -2.03 0.00 0.00 177.10 175.67 4ayk n LEU 81 N -1.04 0.62 -3.66 3.54 4.77 -1.26 -4.93 117.00 115.04 4ayk n LEU 81 Ca 0.09 0.04 -0.03 0.00 -0.03 0.00 0.00 56.01 56.08 4ayk n LEU 81 Cb 0.53 -0.16 -0.01 0.00 -2.33 0.00 0.00 43.42 41.44 4ayk n LEU 81 CO 0.40 0.04 0.82 0.00 -1.33 0.00 0.00 177.39 177.32 4ayk s ALA 82 N -3.13 -1.86 0.32 -1.18 0.00 -1.26 -2.25 121.76 112.41 4ayk s ALA 82 Ca 0.07 0.54 -0.17 0.00 0.00 0.00 0.00 51.96 52.39 4ayk s ALA 82 Cb 0.15 0.47 0.07 0.00 0.00 0.00 0.00 23.12 23.81 4ayk s ALA 82 CO 0.75 -0.95 0.89 -3.38 0.00 0.00 0.00 175.76 173.07 4ayk s HIS 83 N -2.98 0.13 0.15 0.00 -3.43 -1.08 -5.01 115.29 103.07 4ayk s HIS 83 Ca 0.11 -0.74 -0.25 0.00 -0.80 0.00 0.00 55.06 53.39 4ayk s HIS 83 Cb 0.00 0.81 0.06 0.00 -1.43 0.00 0.00 32.58 32.02 4ayk s HIS 83 CO -0.02 -1.38 0.95 0.00 -2.00 0.00 0.00 174.74 172.29 4ayk s ALA 84 N -2.09 -1.65 0.22 -1.38 0.00 -1.26 -1.40 121.76 114.20 4ayk s ALA 84 Ca 0.18 0.16 0.02 0.00 0.00 0.00 0.00 51.96 52.32 4ayk s ALA 84 Cb -0.04 0.64 -0.04 0.00 0.00 0.00 0.00 23.12 23.68 4ayk s ALA 84 CO 0.10 -1.02 0.38 -0.06 0.00 0.00 0.00 175.76 175.16 4ayk s PHE 85 N -3.30 3.48 0.63 0.00 0.40 -1.06 -5.01 117.98 113.12 4ayk s PHE 85 Ca 0.12 0.19 -0.18 0.00 -0.60 0.00 0.00 56.93 56.46 4ayk s PHE 85 Cb -0.01 -1.74 -0.02 0.00 0.51 0.00 0.00 43.02 41.75 4ayk s PHE 85 CO 0.02 0.39 1.20 1.04 0.70 0.00 0.00 175.22 178.57 4ayk n GLN 86 N -1.00 1.09 -1.56 0.44 6.02 -1.26 -3.09 117.38 118.03 4ayk n GLN 86 Ca -0.06 0.42 -0.39 0.00 -0.01 0.00 0.00 57.00 56.96 4ayk n GLN 86 Cb 0.55 -2.43 -0.04 0.00 1.02 0.00 0.00 30.24 29.35 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 -1.58 1.24 -3.83 -1.09 -0.04 -1.26 -1.90 135.00 126.53 4ayk n PRO 87 Ca 0.15 0.15 -0.07 0.00 -0.04 0.00 0.00 63.50 63.69 4ayk n PRO 87 Cb 0.48 -3.27 -0.01 0.00 -0.04 0.00 0.00 33.50 30.66 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 10.88 0.03 1.18 0.55 0.00 -1.25 -4.73 107.32 113.98 4ayk s GLY 88 Ca 1.01 -0.38 -0.19 0.00 0.00 0.00 0.00 44.72 45.17 4ayk s GLY 88 CO 0.30 -0.01 1.12 2.56 0.00 0.00 0.00 173.10 177.07 4ayk s PRO 89 N -3.30 -1.05 7.76 2.90 0.04 -1.26 -3.12 135.00 136.96 4ayk s PRO 89 Ca 0.13 -0.05 0.00 0.00 0.04 0.00 0.00 61.00 61.12 4ayk s PRO 89 Cb -0.05 -1.61 0.00 0.00 0.04 0.00 0.00 34.50 32.88 4ayk s PRO 89 CO 0.08 -3.60 0.00 0.41 0.04 0.00 0.00 177.00 173.92 4ayk n GLY 90 N -1.08 3.36 0.00 0.56 0.00 -1.26 -1.34 105.19 105.42 4ayk n GLY 90 Ca 0.13 -0.12 0.14 0.00 0.00 0.00 0.00 46.02 46.16 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 0.07 -1.84 -0.61 3.06 -1.26 -4.84 119.36 113.94 4ayk n ILE 91 Ca 0.00 0.02 -0.41 0.00 -2.50 0.00 0.00 62.75 59.85 4ayk n ILE 91 Cb 0.00 -0.54 -0.02 0.00 0.54 0.00 0.00 39.64 39.63 4ayk n ILE 91 CO 0.00 0.00 0.00 -0.83 -2.50 0.00 0.00 176.55 173.22 4ayk s GLY 92 N -2.95 2.30 0.00 4.50 0.00 -0.45 -2.00 107.32 108.72 4ayk s GLY 92 Ca 0.15 1.52 0.00 0.00 0.00 0.00 0.00 44.72 46.39 4ayk s GLY 92 CO 0.50 2.44 0.00 0.61 0.00 0.00 0.00 173.10 176.65 4ayk n GLY 93 N 1.89 2.60 3.67 0.20 0.00 -0.80 -3.94 105.19 108.82 4ayk n GLY 93 Ca 0.07 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.66 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 -1.53 6.59 -0.18 1.61 1.01 -0.85 -3.82 116.67 119.50 4ayk s ASP 94 Ca 0.00 2.42 -0.09 0.00 0.71 0.00 0.00 52.55 55.59 4ayk s ASP 94 Cb 0.00 -2.54 -0.05 0.00 1.01 0.00 0.00 42.92 41.34 4ayk s ASP 94 CO 0.00 -0.94 0.13 0.00 0.21 0.00 0.00 175.17 174.57 4ayk s ALA 95 N 3.65 3.71 -0.10 5.23 0.00 0.29 -2.55 121.76 131.99 4ayk s ALA 95 Ca 0.77 -0.68 0.01 0.00 0.00 0.00 0.00 51.96 52.05 4ayk s ALA 95 Cb -0.38 -2.12 -0.02 0.00 0.00 0.00 0.00 23.12 20.60 4ayk s ALA 95 CO 0.33 0.24 -0.11 -1.01 0.00 0.00 0.00 175.76 175.22 4ayk s HIS 96 N 0.11 2.83 -0.12 0.00 3.76 -0.49 -2.61 115.29 118.77 4ayk s HIS 96 Ca 0.09 -0.32 0.01 0.00 -0.15 0.00 0.00 55.06 54.69 4ayk s HIS 96 Cb -0.11 -1.77 -0.01 0.00 1.11 0.00 0.00 32.58 31.80 4ayk s HIS 96 CO -0.01 0.04 -0.14 -0.06 -0.85 0.00 0.00 174.74 173.72 4ayk s PHE 97 N -0.21 2.77 -0.03 1.40 0.40 -0.98 -2.64 117.98 118.69 4ayk s PHE 97 Ca 0.01 -0.64 -0.30 0.00 -0.60 0.00 0.00 56.93 55.41 4ayk s PHE 97 Cb -0.13 -1.81 -0.05 0.00 0.51 0.00 0.00 43.02 41.54 4ayk s PHE 97 CO 0.03 -0.19 1.50 0.34 0.70 0.00 0.00 175.22 177.59 4ayk s ASP 98 N 0.24 6.77 0.00 1.36 -1.08 -0.95 -2.54 116.67 120.47 4ayk s ASP 98 Ca -0.10 2.14 0.23 0.00 -0.52 0.00 0.00 52.55 54.31 4ayk s ASP 98 Cb -0.16 -2.55 0.41 0.00 -1.46 0.00 0.00 42.92 39.17 4ayk s ASP 98 CO 0.06 -0.82 1.40 1.21 0.52 0.00 0.00 175.17 177.53 4ayk n GLU 99 N 6.20 2.48 0.14 4.34 4.07 -1.05 -4.18 120.64 132.63 4ayk n GLU 99 Ca 0.15 -2.22 0.13 0.00 -0.06 0.00 0.00 57.16 55.16 4ayk n GLU 99 Cb 0.43 -1.51 0.47 0.00 -0.06 0.00 0.00 31.44 30.77 4ayk n GLU 99 CO 0.00 0.00 0.00 -0.44 -0.06 0.00 0.00 177.13 176.63 4ayk h ASP 100 N 4.46 0.00 -2.82 4.31 3.32 -1.90 -3.43 116.42 120.37 4ayk h ASP 100 Ca 0.00 0.00 -0.59 0.00 0.02 0.00 0.00 57.03 56.46 4ayk h ASP 100 Cb 0.98 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 40.47 4ayk h ASP 100 CO 0.00 0.00 -0.53 -1.61 -1.72 0.00 0.00 179.24 175.38 4ayk s GLU 101 N -3.27 3.18 -0.26 3.56 8.01 -1.26 -5.04 118.70 123.63 4ayk s GLU 101 Ca 0.06 -0.65 -0.24 0.00 0.01 0.00 0.00 54.97 54.15 4ayk s GLU 101 Cb 0.10 -2.85 -0.01 0.00 -4.31 0.00 0.00 34.13 27.07 4ayk s GLU 101 CO 0.48 0.54 0.80 0.50 0.01 0.00 0.00 175.26 177.59 4ayk s ARG 102 N -2.84 4.13 0.33 1.61 3.52 -1.26 -5.04 118.95 119.41 4ayk s ARG 102 Ca 0.33 0.83 -0.15 0.00 -0.13 0.00 0.00 55.73 56.61 4ayk s ARG 102 Cb -0.12 -3.66 -0.09 0.00 -1.56 0.00 0.00 34.95 29.52 4ayk s ARG 102 CO 0.26 -0.54 0.75 -1.58 -0.81 0.00 0.00 175.30 173.37 4ayk s TRP 103 N 2.84 3.37 0.21 5.12 0.52 -1.26 -4.52 118.94 125.22 4ayk s TRP 103 Ca 0.34 1.23 0.05 0.00 0.02 0.00 0.00 56.10 57.73 4ayk s TRP 103 Cb -0.15 -2.54 -0.05 0.00 -1.15 0.00 0.00 33.47 29.58 4ayk s TRP 103 CO 0.09 0.07 -0.06 0.95 0.02 0.00 0.00 176.95 178.02 4ayk s THR 104 N -2.02 1.26 -0.34 2.01 -4.23 -0.76 -4.94 115.64 106.62 4ayk s THR 104 Ca 0.54 -2.08 0.07 0.00 -1.18 0.00 0.00 61.69 59.04 4ayk s THR 104 Cb -0.10 -2.18 0.48 0.00 1.34 0.00 0.00 72.50 72.04 4ayk s THR 104 CO 0.18 -0.48 1.44 0.59 -0.54 0.00 0.00 174.62 175.81 4ayk n ASN 105 N -0.37 4.01 -0.50 3.99 3.02 -1.26 -3.50 115.26 120.64 4ayk n ASN 105 Ca -0.07 -3.79 0.00 0.00 -0.03 0.00 0.00 54.58 50.69 4ayk n ASN 105 Cb 0.62 -0.58 0.00 0.00 -0.61 0.00 0.00 39.78 39.21 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 -0.96 0.00 -1.09 6.41 0.23 -1.26 -5.00 115.26 113.59 4ayk n ASN 106 Ca 0.40 -0.50 -0.00 0.00 -0.53 0.00 0.00 54.58 53.95 4ayk n ASN 106 Cb 0.94 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.64 4ayk n ASN 106 CO 0.00 0.00 0.00 0.49 -0.93 0.00 0.00 177.26 176.82 4ayk n PHE 107 N 0.00 0.04 -0.43 -2.53 3.72 -1.26 -4.74 117.46 112.26 4ayk n PHE 107 Ca 0.00 -0.59 0.00 0.00 -0.05 0.00 0.00 57.45 56.81 4ayk n PHE 107 Cb 0.00 -0.30 0.00 0.00 -0.94 0.00 0.00 39.48 38.24 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 0.63 0.33 0.45 -1.08 5.12 -1.26 -4.97 116.66 115.88 4ayk n ARG 108 Ca 0.01 0.00 -0.19 0.00 -1.93 0.00 0.00 57.85 55.73 4ayk n ARG 108 Cb 0.51 0.00 -0.09 0.00 -1.16 0.00 0.00 32.46 31.72 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 -1.09 -4.98 5.56 5.08 -1.95 -3.41 114.58 113.79 4ayk h GLU 109 Ca 0.00 0.07 -0.63 0.00 -1.00 0.00 0.00 59.36 57.80 4ayk h GLU 109 Cb 0.00 0.25 -0.17 0.00 0.50 0.00 0.00 28.75 29.33 4ayk h GLU 109 CO 0.00 -0.73 -0.53 0.71 -1.00 0.00 0.00 179.01 177.46 4ayk s TYR 110 N -6.02 3.23 -0.33 4.33 2.02 -1.26 -4.96 117.35 114.35 4ayk s TYR 110 Ca -0.19 0.06 -0.07 0.00 -0.37 0.00 0.00 57.07 56.51 4ayk s TYR 110 Cb 0.03 -2.31 0.03 0.00 -0.40 0.00 0.00 41.96 39.31 4ayk s TYR 110 CO 0.61 -0.11 0.11 -0.80 -1.57 0.00 0.00 175.55 173.79 4ayk s ASN 111 N 1.48 5.33 0.16 2.29 0.02 -1.26 -1.83 114.94 121.12 4ayk s ASN 111 Ca 0.07 -1.04 -0.15 0.00 -1.02 0.00 0.00 52.86 50.72 4ayk s ASN 111 Cb -0.15 -1.89 0.03 0.00 0.02 0.00 0.00 41.25 39.26 4ayk s ASN 111 CO 0.08 -0.31 1.76 0.25 0.02 0.00 0.00 177.10 178.90 4ayk h LEU 112 N 8.25 0.60 -1.00 0.60 5.85 -1.92 -2.90 115.31 124.79 4ayk h LEU 112 Ca -0.25 -0.10 0.01 0.00 0.84 0.00 0.00 57.88 58.38 4ayk h LEU 112 Cb 1.09 -0.15 -0.05 0.00 0.37 0.00 0.00 40.66 41.92 4ayk h LEU 112 CO 0.61 0.53 0.67 -0.74 -0.34 0.00 0.00 178.44 179.17 4ayk h HIS 113 N 0.63 1.26 -0.36 1.25 2.76 -1.89 0.40 115.15 119.19 4ayk h HIS 113 Ca 0.17 0.03 0.01 0.00 -2.20 0.00 0.00 60.37 58.38 4ayk h HIS 113 Cb 0.07 -0.43 -0.02 0.00 1.55 0.00 0.00 27.41 28.58 4ayk h HIS 113 CO -0.02 0.79 0.21 -0.09 -1.30 0.00 0.00 177.93 177.53 4ayk h ARG 114 N 1.36 0.42 -0.35 5.26 2.43 -1.92 0.04 114.38 121.62 4ayk h ARG 114 Ca 0.37 -0.03 -0.16 0.00 -0.81 0.00 0.00 59.98 59.35 4ayk h ARG 114 Cb -0.15 -0.10 -0.00 0.00 -0.42 0.00 0.00 29.97 29.30 4ayk h ARG 114 CO -0.08 0.28 -0.41 0.28 -1.51 0.00 0.00 179.97 178.53 4ayk h VAL 115 N 0.44 1.28 -0.90 0.20 2.07 -1.36 -2.83 116.25 115.14 4ayk h VAL 115 Ca 0.14 -1.58 0.01 0.00 0.82 0.00 0.00 66.70 66.09 4ayk h VAL 115 Cb 0.00 1.46 -0.04 0.00 -1.52 0.00 0.00 31.29 31.19 4ayk h VAL 115 CO -0.06 0.52 0.60 0.00 0.02 0.00 0.00 177.57 178.65 4ayk h ALA 116 N 0.74 1.14 -0.84 1.67 0.00 -0.55 -0.72 119.26 120.70 4ayk h ALA 116 Ca 0.05 -0.06 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 4ayk h ALA 116 Cb 1.00 -0.36 -0.04 0.00 0.00 0.00 0.00 17.79 18.39 4ayk h ALA 116 CO 0.10 0.54 0.39 0.00 0.00 0.00 0.00 179.25 180.28 4ayk h ALA 117 N 1.33 1.08 -0.36 0.00 0.00 -0.90 -2.16 119.26 118.25 4ayk h ALA 117 Ca 0.33 -0.17 -0.15 0.00 0.00 0.00 0.00 54.91 54.92 4ayk h ALA 117 Cb -0.14 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.31 4ayk h ALA 117 CO -0.07 0.66 -0.35 1.25 0.00 0.00 0.00 179.25 180.73 4ayk h HIS 118 N 1.20 1.05 -0.99 0.00 6.17 -1.14 -2.76 115.15 118.67 4ayk h HIS 118 Ca 0.29 -0.31 0.01 0.00 0.71 0.00 0.00 60.37 61.06 4ayk h HIS 118 Cb 0.14 -0.22 -0.05 0.00 2.52 0.00 0.00 27.41 29.80 4ayk h HIS 118 CO 0.02 1.12 0.64 0.93 0.71 0.00 0.00 177.93 181.35 4ayk h GLU 119 N 0.67 1.30 -0.99 5.26 5.08 -0.88 -0.83 114.58 124.19 4ayk h GLU 119 Ca 0.06 -0.09 0.01 0.00 -1.00 0.00 0.00 59.36 58.34 4ayk h GLU 119 Cb 0.94 -0.29 -0.05 0.00 0.50 0.00 0.00 28.75 29.85 4ayk h GLU 119 CO 0.09 0.87 0.65 -0.07 -1.00 0.00 0.00 179.01 179.55 4ayk h LEU 120 N 1.34 1.15 -0.84 1.33 3.38 -1.28 -1.11 115.31 119.29 4ayk h LEU 120 Ca 0.36 -0.04 0.12 0.00 0.09 0.00 0.00 57.88 58.41 4ayk h LEU 120 Cb -0.14 -0.29 -0.08 0.00 0.09 0.00 0.00 40.66 40.24 4ayk h LEU 120 CO -0.08 0.85 0.46 1.23 0.09 0.00 0.00 178.44 180.99 4ayk h GLY 121 N 1.35 1.34 1.11 0.83 0.00 -0.87 0.32 103.07 107.16 4ayk h GLY 121 Ca 0.36 -0.29 -0.05 0.00 0.00 0.00 0.00 47.33 47.36 4ayk h GLY 121 CO -0.08 0.05 0.29 0.45 0.00 0.00 0.00 176.54 177.25 4ayk h HIS 122 N 0.71 1.14 0.00 5.60 3.86 -0.92 -0.70 115.15 124.84 4ayk h HIS 122 Ca 0.43 -0.09 -0.03 0.00 -1.16 0.00 0.00 60.37 59.53 4ayk h HIS 122 Cb 0.52 -0.34 -0.00 0.00 1.06 0.00 0.00 27.41 28.64 4ayk h HIS 122 CO -0.07 0.87 -0.15 0.66 0.86 0.00 0.00 177.93 180.10 4ayk h SER 123 N 1.09 0.00 0.17 2.45 4.64 -0.01 -2.10 113.55 119.79 4ayk h SER 123 Ca 0.25 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.57 4ayk h SER 123 Cb 0.22 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.31 4ayk h SER 123 CO -0.02 0.15 -0.08 0.18 -0.87 0.00 0.00 176.83 176.19 4ayk n LEU 124 N -3.34 0.77 0.00 5.97 4.77 0.80 -4.70 117.00 121.27 4ayk n LEU 124 Ca -0.00 -0.18 0.00 0.00 -0.03 0.00 0.00 56.01 55.80 4ayk n LEU 124 Cb 0.37 -0.09 0.00 0.00 -2.33 0.00 0.00 43.42 41.37 4ayk n LEU 124 CO 0.31 0.13 0.00 0.61 -1.33 0.00 0.00 177.39 177.12 4ayk n GLY 125 N 1.21 0.55 3.72 -0.72 0.00 -0.79 -4.85 105.19 104.30 4ayk n GLY 125 Ca 0.17 -0.40 -0.41 0.00 0.00 0.00 0.00 46.02 45.38 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 4.40 0.66 0.99 1.43 -0.40 -5.01 118.68 120.75 4ayk s LEU 126 Ca 0.00 1.61 -0.04 0.00 -1.03 0.00 0.00 54.13 54.67 4ayk s LEU 126 Cb 0.00 -3.48 0.06 0.00 0.03 0.00 0.00 46.19 42.79 4ayk s LEU 126 CO 0.00 -0.17 0.94 -0.44 0.23 0.00 0.00 176.35 176.91 4ayk s SER 127 N 0.67 4.90 0.80 2.29 0.01 -1.26 -4.37 113.70 116.73 4ayk s SER 127 Ca 0.48 0.26 -0.11 0.00 1.31 0.00 0.00 55.95 57.89 4ayk s SER 127 Cb -0.21 -0.96 0.07 0.00 0.21 0.00 0.00 66.02 65.14 4ayk s SER 127 CO 0.27 -1.49 1.12 -1.00 0.41 0.00 0.00 173.24 172.55 4ayk s HIS 128 N -3.10 2.23 0.15 2.43 0.09 -1.26 -5.01 115.29 110.82 4ayk s HIS 128 Ca 0.60 1.63 0.06 0.00 -0.00 0.00 0.00 55.06 57.35 4ayk s HIS 128 Cb -0.10 -3.20 -0.04 0.00 -0.00 0.00 0.00 32.58 29.23 4ayk s HIS 128 CO 0.43 -2.19 -0.12 0.45 -0.00 0.00 0.00 174.74 173.31 4ayk s SER 129 N -2.91 2.03 -0.09 1.40 0.15 -1.20 -5.04 113.70 108.05 4ayk s SER 129 Ca 0.65 -0.97 0.18 0.00 0.70 0.00 0.00 55.95 56.51 4ayk s SER 129 Cb -0.21 -0.05 0.63 0.00 -1.71 0.00 0.00 66.02 64.68 4ayk s SER 129 CO 0.53 -0.25 1.55 0.35 1.20 0.00 0.00 173.24 176.62 4ayk n THR 130 N -0.07 1.63 -2.93 6.45 -2.24 -1.26 -4.30 114.28 111.57 4ayk n THR 130 Ca -0.11 -1.21 -0.40 0.00 -2.27 0.00 0.00 64.05 60.06 4ayk n THR 130 Cb 0.60 0.20 -0.04 0.00 -2.10 0.00 0.00 70.33 68.99 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 -1.03 7.15 0.20 3.42 -1.08 -1.26 -4.96 116.67 119.12 4ayk s ASP 131 Ca 0.46 1.39 -0.11 0.00 -0.52 0.00 0.00 52.55 53.77 4ayk s ASP 131 Cb 0.29 -2.47 0.14 0.00 -1.46 0.00 0.00 42.92 39.42 4ayk s ASP 131 CO 0.23 -0.13 1.87 0.40 0.52 0.00 0.00 175.17 178.06 4ayk h ILE 132 N 4.64 1.18 0.00 4.11 2.04 -1.99 -1.85 117.51 125.64 4ayk h ILE 132 Ca -0.42 -0.34 0.00 0.00 1.00 0.00 0.00 64.86 65.11 4ayk h ILE 132 Cb 1.21 0.13 0.00 0.00 -0.74 0.00 0.00 36.82 37.42 4ayk h ILE 132 CO 0.74 0.18 0.00 0.61 0.00 0.00 0.00 178.15 179.68 4ayk n GLY 133 N -1.29 -0.83 3.77 5.37 0.00 -1.26 -4.77 105.19 106.17 4ayk n GLY 133 Ca 0.06 -0.16 -0.40 0.00 0.00 0.00 0.00 46.02 45.53 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 -2.00 3.43 0.31 4.61 0.00 -0.70 -4.51 121.76 122.89 4ayk s ALA 134 Ca 0.39 0.38 0.18 0.00 0.00 0.00 0.00 51.96 52.90 4ayk s ALA 134 Cb 0.18 -2.99 0.84 0.00 0.00 0.00 0.00 23.12 21.14 4ayk s ALA 134 CO 0.30 0.25 1.84 -0.07 0.00 0.00 0.00 175.76 178.07 4ayk h LEU 135 N 4.50 0.00 -5.30 0.00 3.38 -1.87 -3.29 115.31 112.74 4ayk h LEU 135 Ca -0.46 0.00 -0.54 0.00 0.09 0.00 0.00 57.88 56.97 4ayk h LEU 135 Cb 1.21 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.98 4ayk h LEU 135 CO 0.67 0.33 3.22 0.23 0.09 0.00 0.00 178.44 182.98 4ayk n MET 136 N -3.80 2.86 -2.17 1.13 2.81 -1.26 -4.92 117.12 111.77 4ayk n MET 136 Ca -0.01 -1.88 -0.41 0.00 -1.81 0.00 0.00 57.70 53.59 4ayk n MET 136 Cb 0.42 -2.67 -0.03 0.00 -0.71 0.00 0.00 33.22 30.23 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 2.88 3.17 -1.75 2.03 5.04 -1.24 -3.22 117.35 124.25 4ayk s TYR 137 Ca 0.55 1.33 0.00 0.00 -2.44 0.00 0.00 57.07 56.50 4ayk s TYR 137 Cb 0.14 -3.63 0.00 0.00 0.35 0.00 0.00 41.96 38.82 4ayk s TYR 137 CO -0.04 -1.85 0.21 -0.35 -1.34 0.00 0.00 175.55 172.18 4ayk n PRO 138 N 1.65 0.00 -3.86 4.97 -0.04 -1.26 -4.64 135.00 131.81 4ayk n PRO 138 Ca 0.03 0.00 -0.08 0.00 -0.04 0.00 0.00 63.50 63.41 4ayk n PRO 138 Cb 0.42 -1.24 -0.01 0.00 -0.04 0.00 0.00 33.50 32.63 4ayk n PRO 138 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 4ayk s SER 139 N -1.81 -0.09 0.03 3.54 1.04 -1.26 -5.15 113.70 110.01 4ayk s SER 139 Ca 0.00 -0.88 -0.24 0.00 0.48 0.00 0.00 55.95 55.31 4ayk s SER 139 Cb 0.00 0.76 -0.05 0.00 0.10 0.00 0.00 66.02 66.83 4ayk s SER 139 CO 0.00 -1.46 0.72 -0.47 0.98 0.00 0.00 173.24 173.01 4ayk s TYR 140 N -3.27 3.72 0.25 5.02 5.04 -1.26 -5.05 117.35 121.79 4ayk s TYR 140 Ca 0.15 1.40 -0.12 0.00 -2.44 0.00 0.00 57.07 56.05 4ayk s TYR 140 Cb -0.05 -2.76 -0.01 0.00 0.35 0.00 0.00 41.96 39.50 4ayk s TYR 140 CO 0.09 0.30 0.46 0.95 -1.34 0.00 0.00 175.55 176.01 4ayk s THR 141 N -0.12 0.00 -0.24 4.34 -4.23 -1.26 -5.14 115.64 108.99 4ayk s THR 141 Ca 0.36 -1.45 -0.14 0.00 -1.18 0.00 0.00 61.69 59.29 4ayk s THR 141 Cb -0.20 -2.24 -0.04 0.00 1.34 0.00 0.00 72.50 71.36 4ayk s THR 141 CO 0.21 0.00 0.30 0.72 -0.54 0.00 0.00 174.62 175.32 4ayk s PHE 142 N -3.99 3.31 0.04 3.99 -0.71 -1.26 -5.07 117.98 114.28 4ayk s PHE 142 Ca 0.24 0.40 0.02 0.00 -1.04 0.00 0.00 56.93 56.55 4ayk s PHE 142 Cb -0.00 -2.45 -0.04 0.00 -1.21 0.00 0.00 43.02 39.32 4ayk s PHE 142 CO 0.10 -0.07 0.03 -1.12 -1.34 0.00 0.00 175.22 172.82 4ayk s SER 143 N 1.29 5.27 0.00 1.98 0.01 -1.26 -5.09 113.70 115.90 4ayk s SER 143 Ca 0.13 -0.03 0.00 0.00 1.31 0.00 0.00 55.95 57.36 4ayk s SER 143 Cb -0.15 -1.38 0.00 0.00 0.21 0.00 0.00 66.02 64.71 4ayk s SER 143 CO 0.08 0.23 0.02 0.61 0.41 0.00 0.00 173.24 174.58 4ayk n GLY 144 N 0.93 0.07 3.76 3.44 0.00 -1.26 -4.82 105.19 107.31 4ayk n GLY 144 Ca -0.12 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.51 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 -1.41 7.01 -0.57 1.61 1.01 -1.26 -5.02 116.67 118.04 4ayk s ASP 145 Ca 0.00 1.20 -0.23 0.00 0.71 0.00 0.00 52.55 54.23 4ayk s ASP 145 Cb 0.00 -2.38 0.05 0.00 1.01 0.00 0.00 42.92 41.61 4ayk s ASP 145 CO 0.00 0.11 0.89 -0.69 0.21 0.00 0.00 175.17 175.68 4ayk s VAL 146 N -0.25 4.46 0.02 -1.27 1.01 -1.26 -5.00 120.40 118.11 4ayk s VAL 146 Ca 0.32 -0.02 -0.02 0.00 0.00 0.00 0.00 61.98 62.25 4ayk s VAL 146 Cb -0.19 -4.53 -0.01 0.00 0.00 0.00 0.00 36.38 31.65 4ayk s VAL 146 CO 0.18 -1.14 0.02 -1.10 0.00 0.00 0.00 175.10 173.05 4ayk s GLN 147 N 3.73 0.37 0.28 2.72 -0.21 -1.26 -5.13 119.66 120.15 4ayk s GLN 147 Ca 0.25 -0.57 -0.29 0.00 0.02 0.00 0.00 55.36 54.77 4ayk s GLN 147 Cb -0.15 0.14 -0.10 0.00 1.00 0.00 0.00 33.01 33.90 4ayk s GLN 147 CO 0.16 -0.07 1.12 -0.51 -2.12 0.00 0.00 175.29 173.87 4ayk s LEU 148 N -1.48 4.54 0.53 2.90 1.43 -1.26 -4.86 118.68 120.48 4ayk s LEU 148 Ca -0.15 2.30 0.01 0.00 -1.03 0.00 0.00 54.13 55.26 4ayk s LEU 148 Cb -0.09 -3.63 0.03 0.00 0.03 0.00 0.00 46.19 42.53 4ayk s LEU 148 CO -0.01 -0.18 0.76 0.00 0.23 0.00 0.00 176.35 177.15 4ayk s ALA 149 N -1.09 3.86 0.24 4.21 0.00 -1.26 -4.89 121.76 122.83 4ayk s ALA 149 Ca 0.45 -1.26 -0.07 0.00 0.00 0.00 0.00 51.96 51.08 4ayk s ALA 149 Cb -0.33 -2.10 0.23 0.00 0.00 0.00 0.00 23.12 20.93 4ayk s ALA 149 CO 0.42 -0.69 1.92 0.37 0.00 0.00 0.00 175.76 177.78 4ayk h GLN 150 N 0.12 1.24 -0.97 0.00 4.15 -1.96 0.39 115.11 118.08 4ayk h GLN 150 Ca -0.43 -0.07 0.02 0.00 0.77 0.00 0.00 58.65 58.94 4ayk h GLN 150 Cb 1.29 -0.28 -0.05 0.00 0.21 0.00 0.00 27.48 28.65 4ayk h GLN 150 CO 0.53 0.82 0.64 0.22 -1.93 0.00 0.00 178.83 179.11 4ayk h ASP 151 N 1.27 1.09 -0.03 -0.69 1.82 -1.95 0.64 116.42 118.57 4ayk h ASP 151 Ca 0.34 -0.02 -0.19 0.00 -0.39 0.00 0.00 57.03 56.77 4ayk h ASP 151 Cb -0.15 -0.26 0.01 0.00 0.68 0.00 0.00 39.33 39.61 4ayk h ASP 151 CO -0.07 0.77 -0.73 0.44 -1.61 0.00 0.00 179.24 178.04 4ayk h ASP 152 N 1.28 0.69 0.05 2.28 3.32 -1.78 -1.53 116.42 120.73 4ayk h ASP 152 Ca 0.37 -0.72 -0.00 0.00 0.02 0.00 0.00 57.03 56.69 4ayk h ASP 152 Cb -0.10 -0.21 0.00 0.00 0.22 0.00 0.00 39.33 39.24 4ayk h ASP 152 CO -0.09 1.32 -0.02 0.40 -1.72 0.00 0.00 179.24 179.12 4ayk h ILE 153 N 0.13 1.12 -0.87 0.35 2.04 -0.55 -1.42 117.51 118.30 4ayk h ILE 153 Ca -0.08 -0.54 -0.01 0.00 1.00 0.00 0.00 64.86 65.22 4ayk h ILE 153 Cb 1.40 1.48 -0.04 0.00 -0.74 0.00 0.00 36.82 38.92 4ayk h ILE 153 CO 0.14 0.14 0.50 0.44 0.00 0.00 0.00 178.15 179.37 4ayk h ASP 154 N -0.30 1.07 0.54 1.72 3.32 0.20 0.42 116.42 123.38 4ayk h ASP 154 Ca -0.01 -0.08 -0.03 0.00 0.02 0.00 0.00 57.03 56.94 4ayk h ASP 154 Cb 0.27 -0.27 0.01 0.00 0.22 0.00 0.00 39.33 39.56 4ayk h ASP 154 CO 0.01 0.84 -0.26 1.23 -1.72 0.00 0.00 179.24 179.34 4ayk h GLY 155 N 1.23 -0.76 1.04 2.75 0.00 -1.10 0.21 103.07 106.45 4ayk h GLY 155 Ca 0.31 0.28 -0.06 0.00 0.00 0.00 0.00 47.33 47.86 4ayk h GLY 155 CO -0.05 -0.28 0.18 1.19 0.00 0.00 0.00 176.54 177.58 4ayk h ILE 156 N -0.89 1.26 -0.62 2.60 6.09 -1.19 -2.73 117.51 122.02 4ayk h ILE 156 Ca -0.07 -0.92 -0.08 0.00 -1.37 0.00 0.00 64.86 62.42 4ayk h ILE 156 Cb 0.62 0.58 -0.02 0.00 0.47 0.00 0.00 36.82 38.46 4ayk h ILE 156 CO 0.12 0.35 0.07 1.56 -3.07 0.00 0.00 178.15 177.19 4ayk h GLN 157 N 0.99 1.02 -0.78 2.19 4.20 -0.88 -2.77 115.11 119.09 4ayk h GLN 157 Ca 0.21 -0.28 0.03 0.00 0.06 0.00 0.00 58.65 58.68 4ayk h GLN 157 Cb 0.34 -0.12 -0.05 0.00 0.30 0.00 0.00 27.48 27.96 4ayk h GLN 157 CO -0.00 0.96 0.50 0.00 -0.67 0.00 0.00 178.83 179.62 4ayk h ALA 158 N 1.11 1.03 -0.06 3.87 0.00 -0.28 2.53 119.26 127.47 4ayk h ALA 158 Ca 0.19 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.07 4ayk h ALA 158 Cb 0.45 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.98 4ayk h ALA 158 CO 0.02 0.31 0.03 0.82 0.00 0.00 0.00 179.25 180.43 4ayk h ILE 159 N 0.97 1.07 0.00 0.00 2.04 -1.25 -3.39 117.51 116.96 4ayk h ILE 159 Ca 0.31 -0.19 0.00 0.00 1.00 0.00 0.00 64.86 65.98 4ayk h ILE 159 Cb 0.01 1.09 0.00 0.00 -0.74 0.00 0.00 36.82 37.17 4ayk h ILE 159 CO -0.11 0.06 -0.21 -1.22 0.00 0.00 0.00 178.15 176.67 4ayk n TYR 160 N -5.01 0.06 0.00 1.37 4.02 -0.97 -5.13 117.16 111.50 4ayk n TYR 160 Ca -0.06 0.03 0.00 0.00 -0.01 0.00 0.00 57.90 57.86 4ayk n TYR 160 Cb 0.06 -0.19 0.00 0.00 -0.02 0.00 0.00 39.34 39.19 4ayk n TYR 160 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 4ayk n GLY 161 N 1.55 -0.90 3.77 2.72 0.00 0.85 -5.05 105.19 108.13 4ayk n GLY 161 Ca -0.03 -1.24 -0.38 0.00 0.00 0.00 0.00 46.02 44.37 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 -2.00 4.21 -1.24 1.61 0.52 -1.26 -4.39 118.95 116.40 4ayk s ARG 162 Ca 0.00 0.49 -0.20 0.00 -0.52 0.00 0.00 55.73 55.51 4ayk s ARG 162 Cb 0.00 -3.35 0.02 0.00 0.52 0.00 0.00 34.95 32.14 4ayk s ARG 162 CO 0.00 0.38 1.79 -1.12 0.02 0.00 0.00 175.30 176.36 4ayk s SER 163 N -0.11 6.24 -1.13 0.23 0.01 -1.25 -4.87 113.70 112.83 4ayk s SER 163 Ca 0.26 -2.13 -0.09 0.00 1.31 0.00 0.00 55.95 55.30 4ayk s SER 163 Cb -0.16 -2.58 0.27 0.00 0.21 0.00 0.00 66.02 63.76 4ayk s SER 163 CO 0.13 -1.79 1.16 0.00 0.41 0.00 0.00 173.24 173.14 4ayk n GLN 164 N 8.40 3.57 0.00 12.44 6.02 -1.26 -4.51 117.38 142.03 4ayk n GLN 164 Ca 0.47 -4.41 0.00 0.00 -0.01 0.00 0.00 57.00 53.05 4ayk n GLN 164 Cb 0.46 -2.59 0.00 0.00 1.02 0.00 0.00 30.24 29.13 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 2.88 0.00 -4.44 1.08 3.02 -1.26 -5.03 115.26 111.51 4ayk n ASN 165 Ca 0.25 0.00 -0.44 0.00 -0.03 0.00 0.00 54.58 54.37 4ayk n ASN 165 Cb 0.39 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.56 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 -1.20 3.32 -3.01 3.52 -0.04 -1.26 -4.98 135.00 131.34 4ayk n PRO 166 Ca 0.00 -3.62 -0.41 0.00 -0.04 0.00 0.00 63.50 59.43 4ayk n PRO 166 Cb 0.00 -3.18 -0.05 0.00 -0.04 0.00 0.00 33.50 30.22 4ayk n PRO 166 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 4ayk s VAL 167 N 2.34 4.91 0.54 0.52 -7.23 -1.26 -5.04 120.40 115.18 4ayk s VAL 167 Ca 0.46 1.27 -0.19 0.00 -1.81 0.00 0.00 61.98 61.71 4ayk s VAL 167 Cb 0.01 -4.03 -0.06 0.00 0.56 0.00 0.00 36.38 32.86 4ayk s VAL 167 CO 0.02 -0.06 1.10 -1.10 -0.31 0.00 0.00 175.10 174.76 4ayk s GLN 168 N 2.69 3.42 0.00 4.82 -0.21 -1.26 -5.31 119.66 123.81 4ayk s GLN 168 Ca 0.30 1.52 0.00 0.00 0.02 0.00 0.00 55.36 57.19 4ayk s GLN 168 Cb -0.15 -2.02 0.00 0.00 1.00 0.00 0.00 33.01 31.83 4ayk s GLN 168 CO 0.09 -0.78 0.17 -2.30 -2.12 0.00 0.00 175.29 170.35