#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 0.73 0.00 7.52 5.85 -2.06 -3.46 115.31 123.88 4ayk h LEU 2 Ca 0.00 -0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.69 4ayk h LEU 2 Cb 0.00 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 40.85 4ayk h LEU 2 CO 0.00 0.53 0.00 0.35 -0.34 0.00 0.00 178.44 178.98 4ayk n THR 3 N -4.64 0.00 -2.08 1.05 -2.24 -1.26 -5.14 114.28 99.97 4ayk n THR 3 Ca 0.05 0.00 -0.33 0.00 -2.27 0.00 0.00 64.05 61.49 4ayk n THR 3 Cb 0.02 0.00 0.01 0.00 -2.10 0.00 0.00 70.33 68.27 4ayk n THR 3 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 4ayk s GLU 4 N 1.99 3.27 0.00 -0.78 2.12 -1.26 -4.84 118.70 119.20 4ayk s GLU 4 Ca 0.00 1.33 0.01 0.00 0.36 0.00 0.00 54.97 56.67 4ayk s GLU 4 Cb 0.00 -2.02 0.07 0.00 0.26 0.00 0.00 34.13 32.44 4ayk s GLU 4 CO 0.00 -0.86 0.29 0.41 -0.54 0.00 0.00 175.26 174.56 4ayk n GLY 5 N -0.60 -0.12 2.42 -1.50 0.00 -1.26 -3.30 105.19 100.83 4ayk n GLY 5 Ca 0.10 -0.01 -0.20 0.00 0.00 0.00 0.00 46.02 45.91 4ayk n GLY 5 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 4ayk n ASN 6 N -0.65 -1.01 -4.72 1.61 3.02 -1.26 -5.13 115.26 107.13 4ayk n ASN 6 Ca 0.01 -2.67 -0.38 0.00 -0.03 0.00 0.00 54.58 51.51 4ayk n ASN 6 Cb 0.00 0.05 0.06 0.00 -0.61 0.00 0.00 39.78 39.28 4ayk n ASN 6 CO 0.00 0.00 0.00 -2.65 -2.62 0.00 0.00 177.26 171.99 4ayk n PRO 7 N 2.23 1.29 -4.01 3.52 -0.02 -1.21 -5.03 135.00 131.77 4ayk n PRO 7 Ca 0.23 0.49 -0.08 0.00 -2.02 0.00 0.00 63.50 62.12 4ayk n PRO 7 Cb 0.53 -2.49 -0.09 0.00 -0.02 0.00 0.00 33.50 31.43 4ayk n PRO 7 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 4ayk s ARG 8 N -3.10 0.69 -0.02 -0.52 0.52 -1.26 -4.71 118.95 110.55 4ayk s ARG 8 Ca 0.78 -1.13 -0.28 0.00 -0.52 0.00 0.00 55.73 54.58 4ayk s ARG 8 Cb -0.40 0.26 -0.03 0.00 0.52 0.00 0.00 34.95 35.29 4ayk s ARG 8 CO 0.44 -0.17 0.89 -1.58 0.02 0.00 0.00 175.30 174.91 4ayk s TRP 9 N -3.90 3.63 -0.79 -0.53 0.52 -1.26 -4.92 118.94 111.69 4ayk s TRP 9 Ca 0.06 1.55 0.26 0.00 0.02 0.00 0.00 56.10 58.00 4ayk s TRP 9 Cb 0.07 -3.02 0.80 0.00 -1.15 0.00 0.00 33.47 30.17 4ayk s TRP 9 CO -0.10 0.02 1.70 0.39 0.02 0.00 0.00 176.95 178.98 4ayk n GLU 10 N 3.86 0.19 -2.92 4.98 1.02 -1.26 -4.83 120.64 121.69 4ayk n GLU 10 Ca 0.04 0.13 -0.33 0.00 -0.02 0.00 0.00 57.16 56.97 4ayk n GLU 10 Cb 0.51 -1.70 -0.07 0.00 -0.02 0.00 0.00 31.44 30.17 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 -3.08 4.19 0.00 3.49 -1.52 -1.26 -4.95 119.66 116.52 4ayk s GLN 11 Ca 0.11 1.00 0.23 0.00 -1.95 0.00 0.00 55.36 54.75 4ayk s GLN 11 Cb 0.14 -2.32 0.14 0.00 -0.22 0.00 0.00 33.01 30.75 4ayk s GLN 11 CO 0.61 0.06 1.17 0.25 -0.25 0.00 0.00 175.29 177.13 4ayk n THR 12 N -0.42 0.00 -4.42 -0.19 -2.24 -1.26 -4.88 114.28 100.87 4ayk n THR 12 Ca 0.05 -0.10 -0.20 0.00 -2.27 0.00 0.00 64.05 61.52 4ayk n THR 12 Cb 0.53 0.85 -0.14 0.00 -2.10 0.00 0.00 70.33 69.47 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 -2.75 1.21 0.10 4.78 3.76 -1.26 -3.14 115.29 117.99 4ayk s HIS 13 Ca 0.15 -0.32 0.03 0.00 -0.15 0.00 0.00 55.06 54.77 4ayk s HIS 13 Cb 0.17 -0.74 -0.04 0.00 1.11 0.00 0.00 32.58 33.09 4ayk s HIS 13 CO 0.69 0.02 -0.08 -0.51 -0.85 0.00 0.00 174.74 174.00 4ayk s LEU 14 N -0.92 2.46 0.14 0.89 1.43 -0.63 -4.97 118.68 117.09 4ayk s LEU 14 Ca 0.02 -0.90 0.07 0.00 -1.03 0.00 0.00 54.13 52.29 4ayk s LEU 14 Cb -0.07 -0.20 -0.04 0.00 0.03 0.00 0.00 46.19 45.91 4ayk s LEU 14 CO 0.01 -0.35 -0.15 0.42 0.23 0.00 0.00 176.35 176.50 4ayk s THR 15 N -2.99 1.52 0.06 5.49 -4.23 -1.26 -2.33 115.64 111.90 4ayk s THR 15 Ca 0.09 -1.85 -0.04 0.00 -1.18 0.00 0.00 61.69 58.71 4ayk s THR 15 Cb 0.01 -1.70 -0.03 0.00 1.34 0.00 0.00 72.50 72.12 4ayk s THR 15 CO -0.02 -0.41 0.05 -0.72 -0.54 0.00 0.00 174.62 172.98 4ayk s TYR 16 N -2.24 0.38 -0.13 3.99 1.13 -1.08 -1.81 117.35 117.60 4ayk s TYR 16 Ca 0.13 -0.89 -0.07 0.00 -1.41 0.00 0.00 57.07 54.84 4ayk s TYR 16 Cb -0.04 -0.27 0.05 0.00 -1.10 0.00 0.00 41.96 40.60 4ayk s TYR 16 CO 0.04 -0.44 0.30 0.50 -2.51 0.00 0.00 175.55 173.45 4ayk s ARG 17 N -3.86 0.26 -0.26 -3.49 3.52 -1.05 -2.46 118.95 111.62 4ayk s ARG 17 Ca 0.06 0.61 -0.21 0.00 -0.13 0.00 0.00 55.73 56.06 4ayk s ARG 17 Cb 0.07 -0.09 -0.02 0.00 -1.56 0.00 0.00 34.95 33.35 4ayk s ARG 17 CO -0.10 -0.16 0.65 0.42 -0.81 0.00 0.00 175.30 175.29 4ayk s ILE 18 N 1.29 4.97 0.18 4.11 1.01 -1.26 -1.99 121.20 129.51 4ayk s ILE 18 Ca -0.09 1.15 -0.09 0.00 0.00 0.00 0.00 60.65 61.61 4ayk s ILE 18 Cb -0.10 -3.95 0.05 0.00 0.01 0.00 0.00 42.46 38.47 4ayk s ILE 18 CO -0.10 0.01 1.61 -0.08 0.00 0.00 0.00 174.94 176.38 4ayk h GLU 19 N 7.90 1.05 -2.25 2.79 4.81 -1.43 -3.46 114.58 124.00 4ayk h GLU 19 Ca -0.26 -0.37 -0.07 0.00 -0.13 0.00 0.00 59.36 58.52 4ayk h GLU 19 Cb 1.12 -0.08 -0.19 0.00 0.63 0.00 0.00 28.75 30.23 4ayk h GLU 19 CO 0.78 1.07 0.08 -0.80 -0.73 0.00 0.00 179.01 179.41 4ayk s ASN 20 N -6.63 -0.55 -0.13 1.04 0.01 -1.26 -5.07 114.94 102.34 4ayk s ASN 20 Ca -0.12 0.57 -0.10 0.00 -0.71 0.00 0.00 52.86 52.50 4ayk s ASN 20 Cb 0.13 0.49 -0.05 0.00 0.41 0.00 0.00 41.25 42.23 4ayk s ASN 20 CO 0.86 -0.57 0.21 -0.31 -1.51 0.00 0.00 177.10 175.78 4ayk s TYR 21 N -1.23 3.54 0.36 2.20 2.02 -1.26 -4.55 117.35 118.42 4ayk s TYR 21 Ca -0.12 0.56 -0.27 0.00 -0.37 0.00 0.00 57.07 56.87 4ayk s TYR 21 Cb -0.01 -2.14 -0.09 0.00 -0.40 0.00 0.00 41.96 39.32 4ayk s TYR 21 CO 0.09 0.50 1.24 -0.08 -1.57 0.00 0.00 175.55 175.72 4ayk s THR 22 N -0.33 2.91 -0.66 -0.71 -1.32 -1.26 -4.88 115.64 109.39 4ayk s THR 22 Ca 0.15 0.85 0.17 0.00 -1.21 0.00 0.00 61.69 61.65 4ayk s THR 22 Cb -0.13 -3.52 0.17 0.00 -1.51 0.00 0.00 72.50 67.52 4ayk s THR 22 CO 0.04 0.15 1.53 -0.81 -2.21 0.00 0.00 174.62 173.32 4ayk n PRO 23 N 0.49 0.10 -0.38 7.08 -0.04 -1.26 -2.89 135.00 138.10 4ayk n PRO 23 Ca 0.02 0.42 -0.02 0.00 -0.04 0.00 0.00 63.50 63.88 4ayk n PRO 23 Cb 0.44 -1.73 0.11 0.00 -0.04 0.00 0.00 33.50 32.28 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 -4.74 3.54 3.32 -1.96 -3.43 116.42 114.30 4ayk h ASP 24 Ca 0.00 -0.03 -0.27 0.00 0.02 0.00 0.00 57.03 56.75 4ayk h ASP 24 Cb 0.22 -0.29 -0.22 0.00 0.22 0.00 0.00 39.33 39.26 4ayk h ASP 24 CO 0.00 0.83 -0.73 -0.76 -1.72 0.00 0.00 179.24 176.86 4ayk s LEU 25 N -10.12 2.24 0.00 1.55 1.43 -1.14 -5.00 118.68 107.64 4ayk s LEU 25 Ca -0.13 -0.53 -0.24 0.00 -1.03 0.00 0.00 54.13 52.20 4ayk s LEU 25 Cb 0.18 -0.15 0.38 0.00 0.03 0.00 0.00 46.19 46.63 4ayk s LEU 25 CO 0.82 -0.20 0.86 -0.81 0.23 0.00 0.00 176.35 177.25 4ayk n PRO 26 N 1.54 -4.84 0.02 1.29 -0.04 -1.26 -4.57 135.00 127.14 4ayk n PRO 26 Ca -0.22 -1.45 -0.12 0.00 -0.04 0.00 0.00 63.50 61.66 4ayk n PRO 26 Cb 0.55 -1.91 -0.14 0.00 -0.04 0.00 0.00 33.50 31.96 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 0.11 -0.91 0.54 0.11 -1.97 -3.21 114.38 109.05 4ayk h ARG 27 Ca -0.39 -0.19 0.05 0.00 0.10 0.00 0.00 59.98 59.55 4ayk h ARG 27 Cb 1.32 0.07 -0.06 0.00 1.11 0.00 0.00 29.97 32.41 4ayk h ARG 27 CO 0.24 0.87 0.58 0.00 0.10 0.00 0.00 179.97 181.75 4ayk h ALA 28 N 0.73 1.23 -0.38 0.08 0.00 -1.98 0.57 119.26 119.50 4ayk h ALA 28 Ca -0.24 -0.03 -0.16 0.00 0.00 0.00 0.00 54.91 54.48 4ayk h ALA 28 Cb 1.97 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 19.47 4ayk h ALA 28 CO 0.12 0.39 -0.39 -0.44 0.00 0.00 0.00 179.25 178.92 4ayk h ASP 29 N 1.09 1.00 -0.30 0.00 3.32 -1.94 -1.87 116.42 117.73 4ayk h ASP 29 Ca 0.38 -0.46 -0.11 0.00 0.02 0.00 0.00 57.03 56.86 4ayk h ASP 29 Cb 0.09 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.35 4ayk h ASP 29 CO -0.15 1.27 -0.24 0.58 -1.72 0.00 0.00 179.24 178.98 4ayk h VAL 30 N 0.76 1.30 -1.00 -1.35 2.07 -1.34 -2.41 116.25 114.27 4ayk h VAL 30 Ca 0.06 -1.40 0.01 0.00 0.82 0.00 0.00 66.70 66.19 4ayk h VAL 30 Cb 0.99 1.54 -0.05 0.00 -1.52 0.00 0.00 31.29 32.25 4ayk h VAL 30 CO 0.10 0.45 0.67 0.44 0.02 0.00 0.00 177.57 179.24 4ayk h ASP 31 N 0.44 1.15 -0.03 0.57 3.32 0.15 -0.58 116.42 121.44 4ayk h ASP 31 Ca 0.05 -0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.07 4ayk h ASP 31 Cb 0.80 -0.29 -0.00 0.00 0.22 0.00 0.00 39.33 40.06 4ayk h ASP 31 CO 0.06 0.84 0.02 -0.74 -1.72 0.00 0.00 179.24 177.70 4ayk h HIS 32 N 1.36 0.04 -0.41 4.55 2.76 -1.15 1.29 115.15 123.59 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 -0.01 -0.02 0.00 1.55 0.00 0.00 27.41 28.77 4ayk h HIS 32 CO -0.00 0.02 0.27 0.00 -1.30 0.00 0.00 177.93 176.92 4ayk h ALA 33 N 1.01 0.52 -0.18 5.26 0.00 -0.93 2.06 119.26 127.00 4ayk h ALA 33 Ca 0.01 -0.03 -0.09 0.00 0.00 0.00 0.00 54.91 54.80 4ayk h ALA 33 Cb -0.00 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 17.63 4ayk h ALA 33 CO -0.00 -0.04 -0.26 0.82 0.00 0.00 0.00 179.25 179.77 4ayk h ILE 34 N 0.54 1.34 -0.35 0.00 1.08 -0.83 -1.60 117.51 117.69 4ayk h ILE 34 Ca 0.15 -1.47 -0.17 0.00 -0.39 0.00 0.00 64.86 62.99 4ayk h ILE 34 Cb -0.05 1.86 -0.00 0.00 -3.07 0.00 0.00 36.82 35.55 4ayk h ILE 34 CO -0.04 0.44 -0.43 -0.08 -0.69 0.00 0.00 178.15 177.36 4ayk h GLU 35 N 0.15 0.92 -0.82 2.37 4.81 0.19 -2.58 114.58 119.62 4ayk h GLU 35 Ca 0.02 -0.51 -0.04 0.00 -0.13 0.00 0.00 59.36 58.70 4ayk h GLU 35 Cb 0.83 0.03 -0.04 0.00 0.63 0.00 0.00 28.75 30.20 4ayk h GLU 35 CO 0.06 1.16 0.37 -0.22 -0.73 0.00 0.00 179.01 179.65 4ayk h LYS 36 N 0.73 1.19 -0.37 1.92 3.64 0.33 -2.06 116.57 121.95 4ayk h LYS 36 Ca 0.05 -0.19 -0.03 0.00 -1.27 0.00 0.00 60.65 59.21 4ayk h LYS 36 Cb 1.03 -0.21 -0.02 0.00 -0.41 0.00 0.00 32.23 32.63 4ayk h LYS 36 CO 0.10 0.93 0.11 0.00 -2.27 0.00 0.00 179.45 178.32 4ayk h ALA 37 N 1.23 0.48 -0.98 5.00 0.00 -1.17 -2.43 119.26 121.39 4ayk h ALA 37 Ca 0.28 -0.17 0.01 0.00 0.00 0.00 0.00 54.91 55.03 4ayk h ALA 37 Cb 0.15 -0.14 -0.05 0.00 0.00 0.00 0.00 17.79 17.75 4ayk h ALA 37 CO -0.03 0.13 0.65 0.74 0.00 0.00 0.00 179.25 180.74 4ayk h PHE 38 N 0.45 1.23 -0.94 0.00 0.04 -1.16 -1.95 116.94 114.61 4ayk h PHE 38 Ca 0.12 0.03 0.01 0.00 2.80 0.00 0.00 57.97 60.92 4ayk h PHE 38 Cb 0.27 -0.41 -0.05 0.00 2.20 0.00 0.00 35.95 37.95 4ayk h PHE 38 CO 0.01 0.77 0.61 1.96 -0.60 0.00 0.00 178.31 181.06 4ayk h GLN 39 N 1.32 1.24 -0.68 1.51 4.20 -1.06 0.98 115.11 122.61 4ayk h GLN 39 Ca 0.36 -0.08 0.01 0.00 0.06 0.00 0.00 58.65 59.00 4ayk h GLN 39 Cb -0.14 -0.28 -0.03 0.00 0.30 0.00 0.00 27.48 27.33 4ayk h GLN 39 CO -0.08 0.82 0.45 -0.07 -0.67 0.00 0.00 178.83 179.28 4ayk h LEU 40 N 1.27 0.78 -0.15 1.46 3.38 -0.89 0.29 115.31 121.45 4ayk h LEU 40 Ca 0.34 -0.02 -0.18 0.00 0.09 0.00 0.00 57.88 58.11 4ayk h LEU 40 Cb -0.14 -0.19 0.01 0.00 0.09 0.00 0.00 40.66 40.43 4ayk h LEU 40 CO -0.07 0.56 -0.60 -0.50 0.09 0.00 0.00 178.44 177.92 4ayk h TRP 41 N 0.92 0.90 0.00 1.13 4.06 -1.09 -3.17 115.95 118.70 4ayk h TRP 41 Ca 0.25 -0.38 -0.07 0.00 2.06 0.00 0.00 58.89 60.75 4ayk h TRP 41 Cb -0.11 -0.15 -0.01 0.00 -1.00 0.00 0.00 29.16 27.90 4ayk h TRP 41 CO -0.03 1.18 -0.33 1.03 -3.56 0.00 0.00 178.44 176.74 4ayk h SER 42 N 0.36 0.00 -0.61 -3.49 0.87 -0.60 -2.77 113.55 107.32 4ayk h SER 42 Ca -0.03 0.00 0.01 0.00 -1.23 0.00 0.00 61.79 60.53 4ayk h SER 42 Cb 1.23 0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 63.16 4ayk h SER 42 CO 0.13 0.33 0.40 0.78 -0.53 0.00 0.00 176.83 177.93 4ayk h ASN 43 N 0.00 0.70 -0.35 6.23 2.35 -0.39 -2.59 115.58 121.53 4ayk h ASN 43 Ca -0.00 -0.02 0.00 0.00 -0.55 0.00 0.00 56.30 55.73 4ayk h ASN 43 Cb 0.76 -0.17 0.00 0.00 0.05 0.00 0.00 38.32 38.96 4ayk h ASN 43 CO 0.04 0.51 0.00 1.33 -1.65 0.00 0.00 177.43 177.66 4ayk n VAL 44 N -4.44 1.43 -3.92 2.81 0.24 -1.17 -4.91 118.33 108.36 4ayk n VAL 44 Ca 0.06 -1.27 -0.10 0.00 -2.04 0.00 0.00 64.34 60.99 4ayk n VAL 44 Cb 0.05 0.26 -0.12 0.00 -1.47 0.00 0.00 33.84 32.56 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 -1.58 0.07 -2.00 3.34 -4.23 -0.98 -3.92 115.64 106.35 4ayk s THR 45 Ca 0.31 -0.58 0.09 0.00 -1.18 0.00 0.00 61.69 60.32 4ayk s THR 45 Cb 0.20 -0.23 0.25 0.00 1.34 0.00 0.00 72.50 74.06 4ayk s THR 45 CO 0.15 -0.32 1.03 -0.81 -0.54 0.00 0.00 174.62 174.13 4ayk n PRO 46 N 2.04 0.61 -2.04 3.99 -0.04 -1.26 -4.58 135.00 133.72 4ayk n PRO 46 Ca -0.20 0.00 -0.33 0.00 -0.04 0.00 0.00 63.50 62.93 4ayk n PRO 46 Cb 0.57 -1.22 0.02 0.00 -0.04 0.00 0.00 33.50 32.82 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 -1.44 3.55 0.05 1.53 1.43 -1.26 -4.97 118.68 117.57 4ayk s LEU 47 Ca 0.13 1.96 0.05 0.00 -1.03 0.00 0.00 54.13 55.24 4ayk s LEU 47 Cb 0.06 -4.55 -0.03 0.00 0.03 0.00 0.00 46.19 41.70 4ayk s LEU 47 CO 0.10 -1.30 -0.13 0.42 0.23 0.00 0.00 176.35 175.66 4ayk s THR 48 N -2.23 1.06 0.09 5.49 -4.23 -1.19 -4.64 115.64 109.99 4ayk s THR 48 Ca 0.67 -1.14 0.07 0.00 -1.18 0.00 0.00 61.69 60.11 4ayk s THR 48 Cb -0.19 -1.00 -0.03 0.00 1.34 0.00 0.00 72.50 72.62 4ayk s THR 48 CO 0.35 -0.13 -0.19 -0.36 -0.54 0.00 0.00 174.62 173.74 4ayk s PHE 49 N -1.08 1.64 -0.19 3.99 0.08 -1.26 -1.60 117.98 119.56 4ayk s PHE 49 Ca -0.01 -0.43 -0.12 0.00 0.12 0.00 0.00 56.93 56.50 4ayk s PHE 49 Cb -0.09 -0.91 0.06 0.00 -0.57 0.00 0.00 43.02 41.51 4ayk s PHE 49 CO 0.02 0.16 0.47 0.99 -0.10 0.00 0.00 175.22 176.76 4ayk s THR 50 N -1.17 -0.02 0.28 0.64 2.01 -0.98 -4.98 115.64 111.42 4ayk s THR 50 Ca 0.04 0.06 -0.28 0.00 0.31 0.00 0.00 61.69 61.82 4ayk s THR 50 Cb -0.10 -0.69 -0.09 0.00 0.01 0.00 0.00 72.50 71.63 4ayk s THR 50 CO 0.04 0.02 0.95 -0.75 -0.69 0.00 0.00 174.62 174.19 4ayk s LYS 51 N 1.21 4.71 -0.05 4.92 2.20 -1.26 -2.63 119.74 128.84 4ayk s LYS 51 Ca -0.08 1.44 0.06 0.00 -0.36 0.00 0.00 55.97 57.02 4ayk s LYS 51 Cb -0.07 -3.05 -0.01 0.00 -1.51 0.00 0.00 37.83 33.19 4ayk s LYS 51 CO -0.11 0.39 -0.22 0.14 -0.36 0.00 0.00 175.35 175.19 4ayk s VAL 52 N -1.38 1.79 -2.26 4.02 -7.23 -1.03 -4.92 120.40 109.40 4ayk s VAL 52 Ca 0.46 -0.92 0.24 0.00 -1.81 0.00 0.00 61.98 59.94 4ayk s VAL 52 Cb -0.23 -1.52 0.16 0.00 0.56 0.00 0.00 36.38 35.36 4ayk s VAL 52 CO 0.29 0.50 1.31 -0.24 -0.31 0.00 0.00 175.10 176.65 4ayk n SER 53 N 2.97 1.98 -3.91 4.85 2.88 -1.26 -4.69 113.62 116.43 4ayk n SER 53 Ca -0.17 -1.49 -0.10 0.00 -1.33 0.00 0.00 58.87 55.77 4ayk n SER 53 Cb 0.52 0.24 -0.10 0.00 -0.75 0.00 0.00 64.21 64.12 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 -2.31 0.52 0.02 -1.46 2.02 -1.26 -5.11 118.70 111.11 4ayk s GLU 54 Ca 0.24 -0.61 0.00 0.00 0.02 0.00 0.00 54.97 54.62 4ayk s GLU 54 Cb 0.19 0.21 0.00 0.00 0.10 0.00 0.00 34.13 34.63 4ayk s GLU 54 CO 0.47 -0.12 0.00 0.41 0.02 0.00 0.00 175.26 176.03 4ayk n GLY 55 N 1.10 -2.17 3.77 -1.39 0.00 -1.26 -4.87 105.19 100.37 4ayk n GLY 55 Ca -0.21 -1.47 -0.40 0.00 0.00 0.00 0.00 46.02 43.94 4ayk n GLY 55 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 4ayk s GLN 56 N -2.35 4.65 0.25 1.61 -0.21 -1.26 -5.05 119.66 117.30 4ayk s GLN 56 Ca 0.00 1.25 0.05 0.00 0.02 0.00 0.00 55.36 56.68 4ayk s GLN 56 Cb 0.00 -3.28 -0.03 0.00 1.00 0.00 0.00 33.01 30.71 4ayk s GLN 56 CO 0.00 0.53 0.35 0.00 -2.12 0.00 0.00 175.29 174.05 4ayk s ALA 57 N -1.06 3.92 0.26 6.09 0.00 -1.26 -5.00 121.76 124.71 4ayk s ALA 57 Ca 0.38 -1.27 -0.05 0.00 0.00 0.00 0.00 51.96 51.01 4ayk s ALA 57 Cb -0.24 -1.68 0.29 0.00 0.00 0.00 0.00 23.12 21.49 4ayk s ALA 57 CO 0.28 0.22 1.93 -0.44 0.00 0.00 0.00 175.76 177.75 4ayk h ASP 58 N 1.18 1.13 -3.28 0.00 3.32 -1.86 -3.39 116.42 113.53 4ayk h ASP 58 Ca -0.51 -0.03 -0.66 0.00 0.02 0.00 0.00 57.03 55.85 4ayk h ASP 58 Cb 1.23 -0.28 -0.30 0.00 0.22 0.00 0.00 39.33 40.20 4ayk h ASP 58 CO 0.60 0.82 -0.77 -0.63 -1.72 0.00 0.00 179.24 177.54 4ayk s ILE 59 N -6.09 2.90 -0.26 0.35 1.01 -0.75 -4.77 121.20 113.58 4ayk s ILE 59 Ca -0.13 -0.65 -0.11 0.00 0.00 0.00 0.00 60.65 59.76 4ayk s ILE 59 Cb 0.18 -2.29 -0.05 0.00 0.01 0.00 0.00 42.46 40.31 4ayk s ILE 59 CO 0.82 0.47 0.18 -0.04 0.00 0.00 0.00 174.94 176.37 4ayk s MET 60 N 1.41 4.00 -0.15 2.79 -1.94 -1.26 -2.53 119.30 121.62 4ayk s MET 60 Ca 0.05 -0.29 -0.03 0.00 -1.71 0.00 0.00 55.69 53.72 4ayk s MET 60 Cb -0.14 -3.61 -0.02 0.00 2.01 0.00 0.00 34.83 33.07 4ayk s MET 60 CO -0.07 -0.08 -0.06 0.42 -0.01 0.00 0.00 175.02 175.23 4ayk s ILE 61 N 1.47 3.73 0.03 2.53 1.01 -0.84 -1.46 121.20 127.67 4ayk s ILE 61 Ca 0.07 -0.42 -0.13 0.00 0.00 0.00 0.00 60.65 60.18 4ayk s ILE 61 Cb -0.15 -2.62 0.02 0.00 0.01 0.00 0.00 42.46 39.71 4ayk s ILE 61 CO 0.08 0.50 0.28 -0.94 0.00 0.00 0.00 174.94 174.86 4ayk s SER 62 N 0.35 -0.10 -0.11 3.58 1.04 -1.10 -0.92 113.70 116.45 4ayk s SER 62 Ca -0.05 -0.18 -0.04 0.00 0.48 0.00 0.00 55.95 56.15 4ayk s SER 62 Cb -0.15 0.33 -0.04 0.00 0.10 0.00 0.00 66.02 66.27 4ayk s SER 62 CO 0.03 -0.57 0.05 -0.36 0.98 0.00 0.00 173.24 173.38 4ayk s PHE 63 N -2.32 3.30 0.23 5.02 0.40 -1.26 -2.16 117.98 121.19 4ayk s PHE 63 Ca -0.07 0.26 0.00 0.00 -0.60 0.00 0.00 56.93 56.53 4ayk s PHE 63 Cb -0.02 -1.89 -0.05 0.00 0.51 0.00 0.00 43.02 41.58 4ayk s PHE 63 CO -0.02 0.48 0.12 0.14 0.70 0.00 0.00 175.22 176.64 4ayk s VAL 64 N -0.68 0.30 0.01 -0.44 -7.23 -1.13 -4.93 120.40 106.30 4ayk s VAL 64 Ca 0.12 -2.00 0.03 0.00 -1.81 0.00 0.00 61.98 58.31 4ayk s VAL 64 Cb -0.12 -2.57 -0.01 0.00 0.56 0.00 0.00 36.38 34.24 4ayk s VAL 64 CO 0.02 0.00 -0.08 -0.13 -0.31 0.00 0.00 175.10 174.60 4ayk s ARG 65 N -4.08 0.60 0.10 4.82 0.52 -1.26 -2.04 118.95 117.61 4ayk s ARG 65 Ca 0.38 -0.46 0.00 0.00 -0.52 0.00 0.00 55.73 55.14 4ayk s ARG 65 Cb 0.07 -0.53 0.00 0.00 0.52 0.00 0.00 34.95 35.02 4ayk s ARG 65 CO 0.13 0.13 0.00 0.41 0.02 0.00 0.00 175.30 175.99 4ayk n GLY 66 N 2.37 0.99 3.71 -3.53 0.00 -1.26 -4.24 105.19 103.22 4ayk n GLY 66 Ca -0.16 -0.49 -0.42 0.00 0.00 0.00 0.00 46.02 44.94 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 6.72 -0.40 1.61 -1.08 -1.26 -4.34 116.67 113.92 4ayk s ASP 67 Ca 0.00 2.41 0.11 0.00 -0.52 0.00 0.00 52.55 54.56 4ayk s ASP 67 Cb 0.00 -2.58 0.36 0.00 -1.46 0.00 0.00 42.92 39.24 4ayk s ASP 67 CO 0.00 -0.75 0.81 0.00 0.52 0.00 0.00 175.17 175.75 4ayk n HIS 68 N 4.37 1.06 -3.56 -5.34 1.44 -1.26 -4.93 115.22 107.00 4ayk n HIS 68 Ca 0.13 -3.71 -0.20 0.00 -2.01 0.00 0.00 57.72 51.93 4ayk n HIS 68 Cb 0.41 -0.42 0.05 0.00 0.12 0.00 0.00 29.99 30.16 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 0.13 -4.70 -4.01 -1.40 1.74 -1.26 -5.00 116.66 102.16 4ayk n ARG 69 Ca 0.25 0.70 -0.08 0.00 -0.77 0.00 0.00 57.85 57.95 4ayk n ARG 69 Cb 0.63 -5.36 -0.09 0.00 -1.02 0.00 0.00 32.46 26.62 4ayk n ARG 69 CO 0.00 0.00 0.00 0.16 -1.52 0.00 0.00 177.63 176.27 4ayk s ASP 70 N -4.16 0.36 -0.00 0.55 -4.77 -1.26 -5.03 116.67 102.36 4ayk s ASP 70 Ca 0.10 -0.88 0.13 0.00 -3.30 0.00 0.00 52.55 48.60 4ayk s ASP 70 Cb -0.02 0.25 0.37 0.00 -1.09 0.00 0.00 42.92 42.42 4ayk s ASP 70 CO 0.78 -0.65 1.31 0.59 0.70 0.00 0.00 175.17 177.90 4ayk n ASN 71 N 0.05 2.23 -3.33 2.11 3.02 -1.26 -4.46 115.26 113.63 4ayk n ASN 71 Ca -0.14 -2.00 -0.26 0.00 -0.03 0.00 0.00 54.58 52.15 4ayk n ASN 71 Cb 0.61 -0.28 -0.09 0.00 -0.61 0.00 0.00 39.78 39.42 4ayk n ASN 71 CO 0.00 0.00 0.00 -0.24 -2.62 0.00 0.00 177.26 174.40 4ayk n SER 72 N 0.72 0.40 -4.78 6.41 2.88 -1.26 -5.12 113.62 112.87 4ayk n SER 72 Ca 0.14 -2.67 -0.35 0.00 -1.33 0.00 0.00 58.87 54.66 4ayk n SER 72 Cb 0.35 -0.62 -0.02 0.00 -0.75 0.00 0.00 64.21 63.18 4ayk n SER 72 CO 0.00 0.00 0.00 -2.16 -1.23 0.00 0.00 175.04 171.65 4ayk s PRO 73 N -0.85 3.71 0.27 -1.46 0.05 -1.26 -5.00 135.00 130.45 4ayk s PRO 73 Ca 0.34 1.53 -0.30 0.00 0.05 0.00 0.00 61.00 62.62 4ayk s PRO 73 Cb 0.11 -2.18 -0.09 0.00 0.05 0.00 0.00 34.50 32.38 4ayk s PRO 73 CO -0.14 -0.54 1.06 -0.06 0.05 0.00 0.00 177.00 177.37 4ayk s PHE 74 N -1.80 3.69 -1.02 0.56 0.40 -1.26 -4.95 117.98 113.60 4ayk s PHE 74 Ca 0.67 1.76 -0.01 0.00 -0.60 0.00 0.00 56.93 58.75 4ayk s PHE 74 Cb -0.21 -3.20 0.32 0.00 0.51 0.00 0.00 43.02 40.43 4ayk s PHE 74 CO 0.25 -0.27 1.76 -3.47 0.70 0.00 0.00 175.22 174.19 4ayk n ASP 75 N 1.28 7.15 0.00 1.36 -0.08 -1.26 -4.83 116.55 120.17 4ayk n ASP 75 Ca -0.01 -3.66 0.00 0.00 -1.51 0.00 0.00 54.79 49.60 4ayk n ASP 75 Cb 0.45 -1.15 0.00 0.00 2.34 0.00 0.00 41.12 42.76 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 0.07 -2.42 0.12 0.27 0.00 -1.26 -3.97 105.19 98.01 4ayk n GLY 76 Ca 0.44 -1.60 0.06 0.00 0.00 0.00 0.00 46.02 44.93 4ayk n GLY 76 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 4ayk n PRO 77 N -0.57 0.08 -2.51 1.61 -0.02 -1.26 -4.59 135.00 127.74 4ayk n PRO 77 Ca 0.00 0.54 -0.23 0.00 -2.02 0.00 0.00 63.50 61.79 4ayk n PRO 77 Cb 0.00 -1.93 0.05 0.00 -0.02 0.00 0.00 33.50 31.60 4ayk n PRO 77 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 4ayk s GLY 78 N -3.15 1.79 0.00 -1.23 0.00 -1.25 -4.94 107.32 98.53 4ayk s GLY 78 Ca -0.01 -1.23 0.00 0.00 0.00 0.00 0.00 44.72 43.48 4ayk s GLY 78 CO 0.11 -0.89 0.00 0.61 0.00 0.00 0.00 173.10 172.93 4ayk n GLY 79 N -2.53 -0.23 3.76 0.20 0.00 -1.26 -4.13 105.19 101.00 4ayk n GLY 79 Ca 0.08 -1.64 -0.39 0.00 0.00 0.00 0.00 46.02 44.07 4ayk n GLY 79 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 4ayk s ASN 80 N -4.00 7.34 0.14 1.61 0.01 -1.26 -4.94 114.94 113.84 4ayk s ASN 80 Ca 0.00 2.01 0.23 0.00 -0.71 0.00 0.00 52.86 54.40 4ayk s ASN 80 Cb 0.00 -2.60 0.18 0.00 0.41 0.00 0.00 41.25 39.23 4ayk s ASN 80 CO 0.00 -0.07 1.18 -0.07 -1.51 0.00 0.00 177.10 176.63 4ayk h LEU 81 N 3.57 0.00 -7.35 0.60 3.38 -1.93 -3.48 115.31 110.10 4ayk h LEU 81 Ca -0.46 -0.17 0.21 0.00 0.09 0.00 0.00 57.88 57.55 4ayk h LEU 81 Cb 1.20 0.00 -0.12 0.00 0.09 0.00 0.00 40.66 41.84 4ayk h LEU 81 CO 0.66 0.08 0.61 0.00 0.09 0.00 0.00 178.44 179.89 4ayk s ALA 82 N -3.24 -1.89 0.30 1.53 0.00 -1.26 -1.86 121.76 115.35 4ayk s ALA 82 Ca 0.03 0.60 -0.14 0.00 0.00 0.00 0.00 51.96 52.46 4ayk s ALA 82 Cb 0.12 0.44 0.05 0.00 0.00 0.00 0.00 23.12 23.74 4ayk s ALA 82 CO 0.76 -0.93 0.71 -2.39 0.00 0.00 0.00 175.76 173.91 4ayk n HIS 83 N -0.39 -2.00 -3.80 0.00 1.44 -1.11 -5.00 115.22 104.37 4ayk n HIS 83 Ca -0.07 -1.49 -0.05 0.00 -2.01 0.00 0.00 57.72 54.10 4ayk n HIS 83 Cb 0.61 0.74 -0.01 0.00 0.12 0.00 0.00 29.99 31.45 4ayk n HIS 83 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 4ayk s ALA 84 N -1.91 -1.47 0.14 1.59 0.00 -1.26 -1.89 121.76 116.95 4ayk s ALA 84 Ca 0.15 -0.07 0.03 0.00 0.00 0.00 0.00 51.96 52.06 4ayk s ALA 84 Cb -0.04 0.72 -0.04 0.00 0.00 0.00 0.00 23.12 23.76 4ayk s ALA 84 CO 0.09 -1.04 0.21 -0.06 0.00 0.00 0.00 175.76 174.96 4ayk s PHE 85 N -3.44 3.36 0.67 0.00 0.08 -0.97 -5.02 117.98 112.66 4ayk s PHE 85 Ca 0.12 0.09 -0.17 0.00 0.12 0.00 0.00 56.93 57.09 4ayk s PHE 85 Cb -0.03 -1.63 0.00 0.00 -0.57 0.00 0.00 43.02 40.80 4ayk s PHE 85 CO 0.04 0.53 1.27 -0.65 -0.10 0.00 0.00 175.22 176.31 4ayk s GLN 86 N -3.03 2.42 -0.33 0.44 -0.21 -1.26 -3.10 119.66 114.60 4ayk s GLN 86 Ca 0.33 1.99 -0.31 0.00 0.02 0.00 0.00 55.36 57.39 4ayk s GLN 86 Cb -0.11 -1.84 -0.08 0.00 1.00 0.00 0.00 33.01 31.98 4ayk s GLN 86 CO 0.26 -1.68 2.25 -0.35 -2.12 0.00 0.00 175.29 173.66 4ayk n PRO 87 N -2.13 1.45 -3.65 2.91 -0.04 -1.26 -2.39 135.00 129.89 4ayk n PRO 87 Ca 0.15 0.36 -0.09 0.00 -0.04 0.00 0.00 63.50 63.88 4ayk n PRO 87 Cb 0.49 -2.93 -0.02 0.00 -0.04 0.00 0.00 33.50 31.00 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 8.49 -0.35 0.86 0.55 0.00 -1.26 -4.84 107.32 110.77 4ayk s GLY 88 Ca 1.05 0.12 -0.11 0.00 0.00 0.00 0.00 44.72 45.78 4ayk s GLY 88 CO 0.40 0.04 1.10 2.56 0.00 0.00 0.00 173.10 177.20 4ayk s PRO 89 N -3.78 1.50 6.77 2.90 0.04 -1.26 -3.14 135.00 138.03 4ayk s PRO 89 Ca 0.06 1.15 0.00 0.00 0.04 0.00 0.00 61.00 62.25 4ayk s PRO 89 Cb -0.03 -1.81 0.00 0.00 0.04 0.00 0.00 34.50 32.69 4ayk s PRO 89 CO -0.03 -2.17 0.00 0.41 0.04 0.00 0.00 177.00 175.26 4ayk n GLY 90 N -0.73 1.15 0.07 0.56 0.00 -1.26 -3.00 105.19 101.98 4ayk n GLY 90 Ca 0.09 -0.58 0.12 0.00 0.00 0.00 0.00 46.02 45.65 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 0.55 -1.76 -0.61 3.06 -1.26 -4.83 119.36 114.51 4ayk n ILE 91 Ca 0.00 -0.04 -0.41 0.00 -2.50 0.00 0.00 62.75 59.81 4ayk n ILE 91 Cb 0.00 -0.75 0.01 0.00 0.54 0.00 0.00 39.64 39.44 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 0.90 1.06 1.75 4.50 0.00 -1.16 -1.78 105.19 110.46 4ayk n GLY 92 Ca 0.05 0.25 0.00 0.00 0.00 0.00 0.00 46.02 46.32 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 0.54 2.41 3.75 -0.02 0.00 -1.01 -4.12 105.19 106.74 4ayk n GLY 93 Ca 0.03 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.74 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 -1.95 4.36 -0.09 1.61 1.01 -0.73 -4.26 116.67 116.62 4ayk s ASP 94 Ca 0.00 1.91 -0.03 0.00 0.71 0.00 0.00 52.55 55.13 4ayk s ASP 94 Cb 0.00 -2.53 0.05 0.00 1.01 0.00 0.00 42.92 41.44 4ayk s ASP 94 CO 0.00 -2.13 0.17 0.00 0.21 0.00 0.00 175.17 173.42 4ayk s ALA 95 N -2.77 -0.25 0.05 5.23 0.00 -0.54 -2.30 121.76 121.18 4ayk s ALA 95 Ca 0.63 0.65 0.02 0.00 0.00 0.00 0.00 51.96 53.26 4ayk s ALA 95 Cb -0.19 -0.75 -0.04 0.00 0.00 0.00 0.00 23.12 22.15 4ayk s ALA 95 CO 0.54 -0.46 0.09 -1.01 0.00 0.00 0.00 175.76 174.92 4ayk s HIS 96 N 2.00 3.25 -0.08 0.00 3.76 -0.79 -2.71 115.29 120.71 4ayk s HIS 96 Ca -0.01 0.14 0.03 0.00 -0.15 0.00 0.00 55.06 55.07 4ayk s HIS 96 Cb -0.12 -1.67 -0.02 0.00 1.11 0.00 0.00 32.58 31.88 4ayk s HIS 96 CO -0.06 0.54 -0.16 -0.06 -0.85 0.00 0.00 174.74 174.14 4ayk s PHE 97 N -1.33 2.69 -0.14 1.40 0.40 -0.92 -2.73 117.98 117.35 4ayk s PHE 97 Ca 0.27 -0.44 -0.29 0.00 -0.60 0.00 0.00 56.93 55.87 4ayk s PHE 97 Cb -0.12 -1.70 -0.04 0.00 0.51 0.00 0.00 43.02 41.66 4ayk s PHE 97 CO 0.19 -0.03 1.71 0.34 0.70 0.00 0.00 175.22 178.13 4ayk s ASP 98 N -0.24 6.41 0.00 1.36 -1.08 -0.77 -2.82 116.67 119.53 4ayk s ASP 98 Ca 0.01 1.94 0.26 0.00 -0.52 0.00 0.00 52.55 54.23 4ayk s ASP 98 Cb -0.13 -2.53 0.54 0.00 -1.46 0.00 0.00 42.92 39.34 4ayk s ASP 98 CO 0.03 -1.19 1.46 1.21 0.52 0.00 0.00 175.17 177.20 4ayk n GLU 99 N 7.56 2.00 0.18 4.34 2.13 -0.87 -4.07 120.64 131.91 4ayk n GLU 99 Ca 0.19 -1.48 0.13 0.00 0.66 0.00 0.00 57.16 56.66 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 3.62 0.00 -2.21 4.31 3.32 -1.88 -3.45 116.42 120.13 4ayk h ASP 100 Ca 0.00 0.00 -0.48 0.00 0.02 0.00 0.00 57.03 56.57 4ayk h ASP 100 Cb 0.78 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.31 4ayk h ASP 100 CO 0.00 0.00 -0.47 -1.61 -1.72 0.00 0.00 179.24 175.44 4ayk s GLU 101 N -3.30 3.25 -0.24 3.56 2.02 -1.26 -4.96 118.70 117.76 4ayk s GLU 101 Ca 0.06 -0.86 -0.22 0.00 0.02 0.00 0.00 54.97 53.97 4ayk s GLU 101 Cb 0.09 -2.77 -0.02 0.00 0.10 0.00 0.00 34.13 31.53 4ayk s GLU 101 CO 0.56 0.42 0.69 0.50 0.02 0.00 0.00 175.26 177.45 4ayk s ARG 102 N -3.90 4.14 0.25 1.61 3.52 -1.26 -5.05 118.95 118.26 4ayk s ARG 102 Ca 0.34 0.67 -0.13 0.00 -0.13 0.00 0.00 55.73 56.47 4ayk s ARG 102 Cb -0.09 -3.64 -0.08 0.00 -1.56 0.00 0.00 34.95 29.58 4ayk s ARG 102 CO 0.27 -0.42 0.64 -1.58 -0.81 0.00 0.00 175.30 173.40 4ayk s TRP 103 N 2.54 3.46 0.24 5.12 0.52 -1.26 -4.63 118.94 124.93 4ayk s TRP 103 Ca 0.29 1.09 0.08 0.00 0.02 0.00 0.00 56.10 57.58 4ayk s TRP 103 Cb -0.15 -2.42 -0.05 0.00 -1.15 0.00 0.00 33.47 29.70 4ayk s TRP 103 CO 0.08 0.24 -0.14 0.95 0.02 0.00 0.00 176.95 178.11 4ayk s THR 104 N -1.78 1.88 -0.32 2.01 -4.23 -0.56 -4.84 115.64 107.80 4ayk s THR 104 Ca 0.48 -2.23 0.08 0.00 -1.18 0.00 0.00 61.69 58.83 4ayk s THR 104 Cb -0.12 -2.20 0.50 0.00 1.34 0.00 0.00 72.50 72.03 4ayk s THR 104 CO 0.19 -0.49 1.48 0.59 -0.54 0.00 0.00 174.62 175.85 4ayk n ASN 105 N -0.48 2.96 -0.49 3.99 5.03 -1.26 -3.24 115.26 121.76 4ayk n ASN 105 Ca -0.07 -3.80 0.00 0.00 0.87 0.00 0.00 54.58 51.59 4ayk n ASN 105 Cb 0.61 -0.63 0.00 0.00 -1.02 0.00 0.00 39.78 38.74 4ayk n ASN 105 CO 0.00 0.00 0.00 -0.46 -1.83 0.00 0.00 177.26 174.97 4ayk n ASN 106 N -1.08 0.00 -1.03 6.41 0.23 -1.26 -5.00 115.26 113.52 4ayk n ASN 106 Ca 0.36 -0.49 0.00 0.00 -0.53 0.00 0.00 54.58 53.92 4ayk n ASN 106 Cb 1.02 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.72 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 0.00 -0.37 -2.53 3.72 -1.26 -4.73 117.46 112.28 4ayk n PHE 107 Ca 0.00 -0.53 0.00 0.00 -0.05 0.00 0.00 57.45 56.87 4ayk n PHE 107 Cb 0.00 -0.27 0.00 0.00 -0.94 0.00 0.00 39.48 38.27 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 0.57 0.40 0.45 -1.08 1.74 -1.26 -4.97 116.66 112.51 4ayk n ARG 108 Ca 0.00 0.00 -0.19 0.00 -0.77 0.00 0.00 57.85 56.89 4ayk n ARG 108 Cb 0.50 0.00 -0.09 0.00 -1.02 0.00 0.00 32.46 31.84 4ayk n ARG 108 CO 0.00 0.00 0.00 0.93 -1.52 0.00 0.00 177.63 177.04 4ayk h GLU 109 N 0.00 -1.09 -5.00 5.56 3.07 -1.96 -3.42 114.58 111.74 4ayk h GLU 109 Ca 0.00 0.07 -0.65 0.00 -0.50 0.00 0.00 59.36 58.29 4ayk h GLU 109 Cb 0.00 0.25 -0.22 0.00 -0.84 0.00 0.00 28.75 27.94 4ayk h GLU 109 CO 0.00 -0.73 -0.62 0.71 -1.40 0.00 0.00 179.01 176.97 4ayk s TYR 110 N -6.02 3.10 -0.29 4.33 2.02 -1.26 -5.07 117.35 114.16 4ayk s TYR 110 Ca -0.19 -0.37 -0.09 0.00 -0.37 0.00 0.00 57.07 56.05 4ayk s TYR 110 Cb 0.03 -2.20 -0.02 0.00 -0.40 0.00 0.00 41.96 39.36 4ayk s TYR 110 CO 0.61 -0.29 0.14 -0.80 -1.57 0.00 0.00 175.55 173.64 4ayk s ASN 111 N 1.41 5.51 0.18 2.29 0.02 -1.26 -1.50 114.94 121.59 4ayk s ASN 111 Ca 0.05 -0.38 -0.09 0.00 -1.02 0.00 0.00 52.86 51.42 4ayk s ASN 111 Cb -0.15 -2.00 0.07 0.00 0.02 0.00 0.00 41.25 39.19 4ayk s ASN 111 CO 0.03 -0.14 1.64 0.25 0.02 0.00 0.00 177.10 178.91 4ayk h LEU 112 N 8.33 1.05 -0.87 0.60 5.85 -1.92 -3.01 115.31 125.34 4ayk h LEU 112 Ca -0.34 -0.30 0.01 0.00 0.84 0.00 0.00 57.88 58.08 4ayk h LEU 112 Cb 1.16 -0.28 -0.04 0.00 0.37 0.00 0.00 40.66 41.86 4ayk h LEU 112 CO 0.60 1.10 0.57 -0.74 -0.34 0.00 0.00 178.44 179.63 4ayk h HIS 113 N 0.97 1.10 -1.00 1.25 2.76 -1.91 -0.91 115.15 117.41 4ayk h HIS 113 Ca 0.17 0.02 0.01 0.00 -2.20 0.00 0.00 60.37 58.37 4ayk h HIS 113 Cb 0.55 -0.37 -0.05 0.00 1.55 0.00 0.00 27.41 29.09 4ayk h HIS 113 CO 0.04 0.70 0.65 0.00 -1.30 0.00 0.00 177.93 178.02 4ayk h ARG 114 N 1.18 1.32 -0.32 5.26 2.47 -1.94 -1.35 114.38 121.01 4ayk h ARG 114 Ca 0.32 -0.09 -0.15 0.00 -1.26 0.00 0.00 59.98 58.80 4ayk h ARG 114 Cb -0.13 -0.29 -0.00 0.00 -1.65 0.00 0.00 29.97 27.89 4ayk h ARG 114 CO -0.07 0.88 -0.39 0.28 0.56 0.00 0.00 179.97 181.23 4ayk h VAL 115 N 1.36 1.29 -0.59 2.04 2.07 -1.30 -2.70 116.25 118.41 4ayk h VAL 115 Ca 0.36 -1.57 0.00 0.00 0.82 0.00 0.00 66.70 66.32 4ayk h VAL 115 Cb -0.14 1.54 -0.03 0.00 -1.52 0.00 0.00 31.29 31.14 4ayk h VAL 115 CO -0.08 0.51 0.39 0.00 0.02 0.00 0.00 177.57 178.41 4ayk h ALA 116 N 0.71 0.75 -0.85 1.67 0.00 -0.73 -0.20 119.26 120.62 4ayk h ALA 116 Ca 0.04 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 4ayk h ALA 116 Cb 0.98 -0.24 -0.04 0.00 0.00 0.00 0.00 17.79 18.49 4ayk h ALA 116 CO 0.09 0.19 0.50 0.00 0.00 0.00 0.00 179.25 180.04 4ayk h ALA 117 N 1.21 1.29 -0.16 0.00 0.00 -1.21 -1.36 119.26 119.03 4ayk h ALA 117 Ca 0.22 -0.10 -0.06 0.00 0.00 0.00 0.00 54.91 54.97 4ayk h ALA 117 Cb -0.08 -0.34 -0.00 0.00 0.00 0.00 0.00 17.79 17.36 4ayk h ALA 117 CO -0.05 0.61 -0.12 1.25 0.00 0.00 0.00 179.25 180.94 4ayk h HIS 118 N 1.17 0.44 -0.99 0.00 2.76 -1.04 -2.64 115.15 114.85 4ayk h HIS 118 Ca 0.30 -0.12 0.03 0.00 -2.20 0.00 0.00 60.37 58.38 4ayk h HIS 118 Cb -0.04 -0.10 -0.05 0.00 1.55 0.00 0.00 27.41 28.77 4ayk h HIS 118 CO 0.01 0.73 0.65 0.93 -1.30 0.00 0.00 177.93 178.94 4ayk h GLU 119 N 0.03 1.24 -0.92 5.26 5.08 -0.75 -1.37 114.58 123.15 4ayk h GLU 119 Ca 0.03 -0.07 -0.01 0.00 -1.00 0.00 0.00 59.36 58.30 4ayk h GLU 119 Cb 0.64 -0.28 -0.04 0.00 0.50 0.00 0.00 28.75 29.56 4ayk h GLU 119 CO 0.03 0.82 0.53 -0.07 -1.00 0.00 0.00 179.01 179.32 4ayk h LEU 120 N 1.28 1.13 -0.84 1.33 3.38 -1.17 -1.62 115.31 118.81 4ayk h LEU 120 Ca 0.38 -0.09 0.02 0.00 0.09 0.00 0.00 57.88 58.29 4ayk h LEU 120 Cb -0.05 -0.29 -0.05 0.00 0.09 0.00 0.00 40.66 40.37 4ayk h LEU 120 CO -0.11 0.89 0.55 1.23 0.09 0.00 0.00 178.44 181.09 4ayk h GLY 121 N 1.29 1.19 1.39 0.83 0.00 -0.89 0.63 103.07 107.51 4ayk h GLY 121 Ca 0.33 -0.43 -0.07 0.00 0.00 0.00 0.00 47.33 47.16 4ayk h GLY 121 CO -0.06 0.39 -0.03 0.45 0.00 0.00 0.00 176.54 177.30 4ayk h HIS 122 N 1.09 0.79 0.00 5.60 3.86 -0.98 0.28 115.15 125.79 4ayk h HIS 122 Ca 0.32 -0.11 -0.05 0.00 -1.16 0.00 0.00 60.37 59.37 4ayk h HIS 122 Cb -0.07 -0.21 -0.01 0.00 1.06 0.00 0.00 27.41 28.18 4ayk h HIS 122 CO -0.02 0.75 -0.22 0.66 0.86 0.00 0.00 177.93 179.97 4ayk h SER 123 N 0.69 0.00 0.24 2.45 4.64 -0.30 -1.50 113.55 119.76 4ayk h SER 123 Ca 0.13 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.45 4ayk h SER 123 Cb 0.46 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.55 4ayk h SER 123 CO 0.02 0.22 -0.10 0.18 -0.87 0.00 0.00 176.83 176.28 4ayk n LEU 124 N -3.46 0.68 0.00 5.97 4.77 0.09 -4.86 117.00 120.20 4ayk n LEU 124 Ca -0.00 -0.12 0.00 0.00 -0.03 0.00 0.00 56.01 55.85 4ayk n LEU 124 Cb 0.39 -0.12 0.00 0.00 -2.33 0.00 0.00 43.42 41.36 4ayk n LEU 124 CO 0.33 0.12 0.00 0.61 -1.33 0.00 0.00 177.39 177.12 4ayk n GLY 125 N 1.24 0.55 3.72 -0.72 0.00 -0.57 -4.90 105.19 104.52 4ayk n GLY 125 Ca 0.16 -0.30 -0.41 0.00 0.00 0.00 0.00 46.02 45.47 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 4.44 0.71 0.99 1.43 -0.02 -4.99 118.68 121.24 4ayk s LEU 126 Ca 0.00 1.69 -0.05 0.00 -1.03 0.00 0.00 54.13 54.74 4ayk s LEU 126 Cb 0.00 -3.53 0.09 0.00 0.03 0.00 0.00 46.19 42.78 4ayk s LEU 126 CO 0.00 -0.13 1.00 -0.44 0.23 0.00 0.00 176.35 177.01 4ayk s SER 127 N 0.41 4.56 0.79 2.29 0.01 -1.26 -4.27 113.70 116.23 4ayk s SER 127 Ca 0.48 0.13 -0.11 0.00 1.31 0.00 0.00 55.95 57.75 4ayk s SER 127 Cb -0.22 -0.67 0.07 0.00 0.21 0.00 0.00 66.02 65.41 4ayk s SER 127 CO 0.28 -1.73 1.11 -1.00 0.41 0.00 0.00 173.24 172.31 4ayk s HIS 128 N -3.21 2.37 0.22 2.43 0.09 -1.26 -4.98 115.29 110.95 4ayk s HIS 128 Ca 0.63 1.61 0.06 0.00 -0.00 0.00 0.00 55.06 57.36 4ayk s HIS 128 Cb -0.08 -3.13 -0.05 0.00 -0.00 0.00 0.00 32.58 29.31 4ayk s HIS 128 CO 0.44 -2.02 -0.08 0.45 -0.00 0.00 0.00 174.74 173.53 4ayk s SER 129 N -3.12 2.38 0.00 1.40 0.15 -1.24 -5.04 113.70 108.23 4ayk s SER 129 Ca 0.63 -1.11 0.24 0.00 0.70 0.00 0.00 55.95 56.41 4ayk s SER 129 Cb -0.19 -0.10 0.32 0.00 -1.71 0.00 0.00 66.02 64.34 4ayk s SER 129 CO 0.55 -0.31 1.34 0.35 1.20 0.00 0.00 173.24 176.36 4ayk n THR 130 N -0.43 0.28 -2.82 6.45 -2.24 -1.26 -4.70 114.28 109.57 4ayk n THR 130 Ca -0.07 -0.64 -0.41 0.00 -2.27 0.00 0.00 64.05 60.66 4ayk n THR 130 Cb 0.62 1.22 -0.04 0.00 -2.10 0.00 0.00 70.33 70.03 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 -1.71 7.21 0.48 3.42 -1.08 -1.26 -4.92 116.67 118.80 4ayk s ASP 131 Ca 0.34 1.46 0.14 0.00 -0.52 0.00 0.00 52.55 53.97 4ayk s ASP 131 Cb 0.22 -2.51 1.14 0.00 -1.46 0.00 0.00 42.92 40.30 4ayk s ASP 131 CO 0.31 -0.26 2.09 -0.29 0.52 0.00 0.00 175.17 177.54 4ayk h ILE 132 N 4.86 0.99 0.00 4.11 2.10 -2.02 0.28 117.51 127.84 4ayk h ILE 132 Ca -0.39 -0.07 0.00 0.00 1.08 0.00 0.00 64.86 65.48 4ayk h ILE 132 Cb 1.20 0.77 0.00 0.00 -1.09 0.00 0.00 36.82 37.69 4ayk h ILE 132 CO 0.77 0.04 0.00 0.61 -1.08 0.00 0.00 178.15 178.49 4ayk n GLY 133 N -1.53 -0.94 3.71 8.18 0.00 -1.26 -4.76 105.19 108.59 4ayk n GLY 133 Ca 0.01 -0.17 -0.41 0.00 0.00 0.00 0.00 46.02 45.45 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 -2.07 3.24 0.34 4.61 0.00 0.09 -4.47 121.76 123.49 4ayk s ALA 134 Ca 0.41 0.36 0.18 0.00 0.00 0.00 0.00 51.96 52.92 4ayk s ALA 134 Cb 0.20 -3.17 0.93 0.00 0.00 0.00 0.00 23.12 21.08 4ayk s ALA 134 CO 0.35 -0.17 1.88 -0.07 0.00 0.00 0.00 175.76 177.75 4ayk h LEU 135 N 6.77 0.00 -3.74 0.00 3.38 -1.87 -3.11 115.31 116.75 4ayk h LEU 135 Ca -0.41 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.50 4ayk h LEU 135 Cb 1.21 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.94 4ayk h LEU 135 CO 0.75 0.29 -0.06 0.23 0.09 0.00 0.00 178.44 179.74 4ayk n MET 136 N -3.84 1.02 -2.24 1.13 2.81 -1.26 -4.80 117.12 109.94 4ayk n MET 136 Ca -0.01 -0.31 -0.41 0.00 -1.81 0.00 0.00 57.70 55.15 4ayk n MET 136 Cb 0.37 -1.46 -0.03 0.00 -0.71 0.00 0.00 33.22 31.39 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 1.03 3.28 0.08 2.03 6.14 -1.18 -3.60 117.35 125.14 4ayk s TYR 137 Ca 0.21 1.26 -0.27 0.00 0.64 0.00 0.00 57.07 58.91 4ayk s TYR 137 Cb 0.10 -3.58 -0.11 0.00 0.42 0.00 0.00 41.96 38.79 4ayk s TYR 137 CO 0.00 -1.76 1.44 -1.35 0.64 0.00 0.00 175.55 174.52 4ayk h PRO 138 N 5.27 -0.55 -7.66 4.97 0.11 -1.90 -3.42 132.00 128.82 4ayk h PRO 138 Ca -0.45 0.04 -0.45 0.00 0.11 0.00 0.00 66.00 65.24 4ayk h PRO 138 Cb 1.21 0.13 0.13 0.00 0.11 0.00 0.00 31.00 32.58 4ayk h PRO 138 CO 0.76 -0.37 0.37 -1.54 -0.21 0.00 0.00 178.00 177.02 4ayk s SER 139 N -4.23 3.72 -0.07 -2.05 1.04 -1.26 -5.02 113.70 105.83 4ayk s SER 139 Ca -0.13 0.34 -0.25 0.00 0.48 0.00 0.00 55.95 56.39 4ayk s SER 139 Cb 0.05 -0.58 -0.03 0.00 0.10 0.00 0.00 66.02 65.56 4ayk s SER 139 CO 0.48 -2.35 0.78 -0.47 0.98 0.00 0.00 173.24 172.66 4ayk s TYR 140 N -3.68 3.56 0.30 5.02 5.04 -1.26 -5.03 117.35 121.30 4ayk s TYR 140 Ca 0.69 1.33 -0.07 0.00 -2.44 0.00 0.00 57.07 56.59 4ayk s TYR 140 Cb -0.06 -2.90 0.00 0.00 0.35 0.00 0.00 41.96 39.35 4ayk s TYR 140 CO 0.50 0.01 0.47 0.95 -1.34 0.00 0.00 175.55 176.14 4ayk s THR 141 N 1.09 0.00 0.07 4.34 -4.23 -1.26 -5.17 115.64 110.48 4ayk s THR 141 Ca 0.40 -1.53 0.05 0.00 -1.18 0.00 0.00 61.69 59.43 4ayk s THR 141 Cb -0.18 -2.50 -0.03 0.00 1.34 0.00 0.00 72.50 71.13 4ayk s THR 141 CO 0.19 0.00 -0.14 0.72 -0.54 0.00 0.00 174.62 174.85 4ayk s PHE 142 N -3.41 1.20 -0.11 3.99 -0.71 -1.26 -5.04 117.98 112.65 4ayk s PHE 142 Ca 0.28 -0.45 0.14 0.00 -1.04 0.00 0.00 56.93 55.85 4ayk s PHE 142 Cb -0.00 -0.68 0.27 0.00 -1.21 0.00 0.00 43.02 41.40 4ayk s PHE 142 CO 0.15 0.05 1.14 -1.13 -1.34 0.00 0.00 175.22 174.09 4ayk n SER 143 N 1.32 1.59 0.00 1.98 3.41 -1.26 -5.08 113.62 115.58 4ayk n SER 143 Ca -0.21 -2.93 0.00 0.00 -0.26 0.00 0.00 58.87 55.47 4ayk n SER 143 Cb 0.54 -0.39 0.00 0.00 -0.26 0.00 0.00 64.21 64.10 4ayk n SER 143 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 4ayk n GLY 144 N -0.88 1.50 3.85 5.00 0.00 -1.26 -4.85 105.19 108.55 4ayk n GLY 144 Ca 0.12 -0.43 -0.31 0.00 0.00 0.00 0.00 46.02 45.39 4ayk n GLY 144 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 4ayk s ASP 145 N -4.00 6.56 -0.45 1.61 -1.08 -1.26 -5.01 116.67 113.04 4ayk s ASP 145 Ca 0.00 1.43 -0.23 0.00 -0.52 0.00 0.00 52.55 53.23 4ayk s ASP 145 Cb 0.00 -2.45 0.03 0.00 -1.46 0.00 0.00 42.92 39.03 4ayk s ASP 145 CO 0.00 -0.56 0.78 -0.69 0.52 0.00 0.00 175.17 175.21 4ayk s VAL 146 N -2.61 4.66 0.02 1.11 1.01 -1.26 -5.02 120.40 118.32 4ayk s VAL 146 Ca 0.56 0.41 -0.01 0.00 0.00 0.00 0.00 61.98 62.94 4ayk s VAL 146 Cb -0.10 -4.31 -0.02 0.00 0.00 0.00 0.00 36.38 31.95 4ayk s VAL 146 CO 0.33 -0.71 -0.01 -1.10 0.00 0.00 0.00 175.10 173.62 4ayk s GLN 147 N 3.26 0.35 0.43 2.72 -0.21 -1.26 -5.14 119.66 119.81 4ayk s GLN 147 Ca 0.29 -0.63 -0.23 0.00 0.02 0.00 0.00 55.36 54.82 4ayk s GLN 147 Cb -0.12 0.13 -0.09 0.00 1.00 0.00 0.00 33.01 33.93 4ayk s GLN 147 CO 0.22 -0.06 1.05 -0.51 -2.12 0.00 0.00 175.29 173.87 4ayk s LEU 148 N -1.56 4.03 0.44 2.90 1.43 -1.26 -4.87 118.68 119.80 4ayk s LEU 148 Ca -0.14 2.00 -0.01 0.00 -1.03 0.00 0.00 54.13 54.95 4ayk s LEU 148 Cb -0.08 -4.32 -0.01 0.00 0.03 0.00 0.00 46.19 41.80 4ayk s LEU 148 CO -0.01 -0.60 0.68 0.00 0.23 0.00 0.00 176.35 176.65 4ayk s ALA 149 N -1.77 3.66 0.25 4.21 0.00 -1.26 -4.89 121.76 121.95 4ayk s ALA 149 Ca 0.61 -0.92 -0.06 0.00 0.00 0.00 0.00 51.96 51.58 4ayk s ALA 149 Cb -0.20 -2.23 0.25 0.00 0.00 0.00 0.00 23.12 20.94 4ayk s ALA 149 CO 0.25 -0.34 1.93 0.37 0.00 0.00 0.00 175.76 177.97 4ayk h GLN 150 N 0.40 1.31 -0.93 0.00 4.15 -1.96 0.12 115.11 118.19 4ayk h GLN 150 Ca -0.47 -0.08 0.02 0.00 0.77 0.00 0.00 58.65 58.89 4ayk h GLN 150 Cb 1.24 -0.29 -0.05 0.00 0.21 0.00 0.00 27.48 28.58 4ayk h GLN 150 CO 0.59 0.86 0.61 0.22 -1.93 0.00 0.00 178.83 179.19 4ayk h ASP 151 N 1.35 1.04 -0.09 -0.69 1.82 -1.98 0.32 116.42 118.19 4ayk h ASP 151 Ca 0.36 -0.02 -0.24 0.00 -0.39 0.00 0.00 57.03 56.75 4ayk h ASP 151 Cb -0.15 -0.25 0.01 0.00 0.68 0.00 0.00 39.33 39.62 4ayk h ASP 151 CO -0.08 0.74 -0.88 0.44 -1.61 0.00 0.00 179.24 177.85 4ayk h ASP 152 N 1.22 0.93 0.17 2.28 3.32 -1.71 -1.19 116.42 121.44 4ayk h ASP 152 Ca 0.36 -0.67 -0.01 0.00 0.02 0.00 0.00 57.03 56.72 4ayk h ASP 152 Cb -0.08 -0.28 0.00 0.00 0.22 0.00 0.00 39.33 39.20 4ayk h ASP 152 CO -0.10 1.46 -0.08 0.40 -1.72 0.00 0.00 179.24 179.21 4ayk h ILE 153 N 0.47 0.93 -0.96 0.35 2.04 -0.36 0.38 117.51 120.36 4ayk h ILE 153 Ca -0.08 -0.52 -0.00 0.00 1.00 0.00 0.00 64.86 65.25 4ayk h ILE 153 Cb 1.52 1.25 -0.05 0.00 -0.74 0.00 0.00 36.82 38.80 4ayk h ILE 153 CO 0.18 0.12 0.60 0.44 0.00 0.00 0.00 178.15 179.49 4ayk h ASP 154 N -0.49 1.14 0.64 1.72 3.32 -0.46 0.15 116.42 122.44 4ayk h ASP 154 Ca -0.02 -0.06 -0.03 0.00 0.02 0.00 0.00 57.03 56.94 4ayk h ASP 154 Cb 0.37 -0.29 0.01 0.00 0.22 0.00 0.00 39.33 39.64 4ayk h ASP 154 CO 0.04 0.86 -0.31 1.23 -1.72 0.00 0.00 179.24 179.34 4ayk h GLY 155 N 1.32 -0.89 1.06 2.75 0.00 -1.03 0.46 103.07 106.73 4ayk h GLY 155 Ca 0.35 0.33 -0.05 0.00 0.00 0.00 0.00 47.33 47.96 4ayk h GLY 155 CO -0.07 -0.33 0.30 1.19 0.00 0.00 0.00 176.54 177.64 4ayk h ILE 156 N -1.08 1.26 -0.55 2.60 6.09 -0.86 -2.21 117.51 122.77 4ayk h ILE 156 Ca -0.09 -0.85 -0.12 0.00 -1.37 0.00 0.00 64.86 62.44 4ayk h ILE 156 Cb 0.70 0.33 -0.02 0.00 0.47 0.00 0.00 36.82 38.31 4ayk h ILE 156 CO 0.14 0.34 -0.11 1.56 -3.07 0.00 0.00 178.15 177.02 4ayk h GLN 157 N 1.16 1.04 -0.67 2.19 4.20 -0.68 -2.64 115.11 119.71 4ayk h GLN 157 Ca 0.26 -0.39 0.02 0.00 0.06 0.00 0.00 58.65 58.60 4ayk h GLN 157 Cb 0.24 -0.07 -0.04 0.00 0.30 0.00 0.00 27.48 27.91 4ayk h GLN 157 CO -0.02 1.08 0.43 0.00 -0.67 0.00 0.00 178.83 179.65 4ayk h ALA 158 N 0.94 0.86 0.00 3.87 0.00 0.30 2.22 119.26 127.44 4ayk h ALA 158 Ca 0.14 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 4ayk h ALA 158 Cb 0.68 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.24 4ayk h ALA 158 CO 0.05 0.22 -0.00 0.82 0.00 0.00 0.00 179.25 180.34 4ayk h ILE 159 N 0.85 1.00 0.00 0.00 2.04 -1.22 -3.39 117.51 116.79 4ayk h ILE 159 Ca 0.26 -0.00 0.00 0.00 1.00 0.00 0.00 64.86 66.12 4ayk h ILE 159 Cb -0.03 1.00 0.00 0.00 -0.74 0.00 0.00 36.82 37.05 4ayk h ILE 159 CO -0.08 0.00 -0.00 -1.22 0.00 0.00 0.00 178.15 176.85 4ayk n TYR 160 N -5.09 0.00 -3.32 1.37 4.02 -0.99 -5.13 117.16 108.01 4ayk n TYR 160 Ca -0.07 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.82 4ayk n TYR 160 Cb 0.03 -0.06 0.00 0.00 -0.02 0.00 0.00 39.34 39.29 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 1.56 -0.92 3.89 2.72 0.00 0.75 -5.04 105.19 108.15 4ayk n GLY 161 Ca -0.00 -1.34 -0.29 0.00 0.00 0.00 0.00 46.02 44.39 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 3.65 -1.21 1.61 0.52 -1.26 -4.49 118.95 115.78 4ayk s ARG 162 Ca 0.00 0.36 -0.21 0.00 -0.52 0.00 0.00 55.73 55.36 4ayk s ARG 162 Cb 0.00 -2.36 -0.03 0.00 0.52 0.00 0.00 34.95 33.09 4ayk s ARG 162 CO 0.00 -0.16 1.85 -1.12 0.02 0.00 0.00 175.30 175.89 4ayk s SER 163 N -3.69 5.72 -0.02 0.23 0.01 -1.25 -4.73 113.70 109.96 4ayk s SER 163 Ca 0.50 -1.89 0.00 0.00 1.31 0.00 0.00 55.95 55.87 4ayk s SER 163 Cb -0.10 -2.58 0.02 0.00 0.21 0.00 0.00 66.02 63.57 4ayk s SER 163 CO 0.40 -2.34 1.53 0.00 0.41 0.00 0.00 173.24 173.24 4ayk n GLN 164 N 8.37 1.06 -3.32 12.44 6.02 -1.26 -4.40 117.38 136.29 4ayk n GLN 164 Ca 0.46 -0.14 -0.21 0.00 -0.01 0.00 0.00 57.00 57.10 4ayk n GLN 164 Cb 0.47 -1.05 -0.08 0.00 1.02 0.00 0.00 30.24 30.59 4ayk n GLN 164 CO 0.00 0.00 0.00 -0.80 -1.01 0.00 0.00 177.06 175.25 4ayk s ASN 165 N 1.38 1.23 -1.55 1.08 0.01 -1.26 -5.04 114.94 110.79 4ayk s ASN 165 Ca 0.03 -2.18 -0.11 0.00 -0.71 0.00 0.00 52.86 49.88 4ayk s ASN 165 Cb 0.02 0.24 -0.03 0.00 0.41 0.00 0.00 41.25 41.89 4ayk s ASN 165 CO 0.00 -0.21 2.68 -0.81 -1.51 0.00 0.00 177.10 177.25 4ayk n PRO 166 N 3.60 3.47 -3.71 -0.60 -0.04 -1.26 -4.82 135.00 131.63 4ayk n PRO 166 Ca 0.18 -2.41 -0.11 0.00 -0.04 0.00 0.00 63.50 61.12 4ayk n PRO 166 Cb 0.46 -2.95 -0.11 0.00 -0.04 0.00 0.00 33.50 30.85 4ayk n PRO 166 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 4ayk s VAL 167 N 2.32 -0.02 0.53 0.52 0.11 -1.26 -5.15 120.40 117.45 4ayk s VAL 167 Ca 0.61 0.09 -0.19 0.00 -2.93 0.00 0.00 61.98 59.56 4ayk s VAL 167 Cb 0.17 -0.55 -0.06 0.00 -1.53 0.00 0.00 36.38 34.40 4ayk s VAL 167 CO -0.07 0.04 1.10 -1.10 -3.33 0.00 0.00 175.10 171.74 4ayk s GLN 168 N 1.18 3.45 0.00 1.54 -0.21 -1.26 -5.21 119.66 119.15 4ayk s GLN 168 Ca -0.08 1.53 0.00 0.00 0.02 0.00 0.00 55.36 56.83 4ayk s GLN 168 Cb -0.08 -2.03 0.00 0.00 1.00 0.00 0.00 33.01 31.90 4ayk s GLN 168 CO -0.10 -0.76 0.49 -0.35 -2.12 0.00 0.00 175.29 172.46