#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 3.28 0.37 7.52 2.01 -1.26 -5.05 118.68 125.55 4ayk s LEU 2 Ca 0.00 1.53 -0.06 0.00 0.01 0.00 0.00 54.13 55.61 4ayk s LEU 2 Cb 0.00 -4.49 -0.05 0.00 0.01 0.00 0.00 46.19 41.66 4ayk s LEU 2 CO 0.00 -1.03 0.66 0.42 1.01 0.00 0.00 176.35 177.42 4ayk s THR 3 N -3.00 4.94 0.22 5.49 -4.23 -1.26 -5.04 115.64 112.77 4ayk s THR 3 Ca 0.57 0.21 -0.30 0.00 -1.18 0.00 0.00 61.69 60.99 4ayk s THR 3 Cb -0.12 -3.77 -0.09 0.00 1.34 0.00 0.00 72.50 69.86 4ayk s THR 3 CO 0.50 -0.51 1.20 -0.70 -0.54 0.00 0.00 174.62 174.57 4ayk s GLU 4 N -3.94 4.50 1.09 3.99 2.56 -1.26 -4.76 118.70 120.89 4ayk s GLU 4 Ca 0.46 1.91 0.00 0.00 0.00 0.00 0.00 54.97 57.35 4ayk s GLU 4 Cb -0.10 -3.21 0.00 0.00 2.00 0.00 0.00 34.13 32.82 4ayk s GLU 4 CO 0.34 -0.04 0.00 0.41 -0.56 0.00 0.00 175.26 175.40 4ayk n GLY 5 N 1.82 -2.04 3.83 -1.50 0.00 -1.26 -4.85 105.19 101.20 4ayk n GLY 5 Ca 0.03 -1.41 -0.33 0.00 0.00 0.00 0.00 46.02 44.31 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 6.87 0.78 1.61 0.01 -1.26 -5.06 114.94 113.89 4ayk s ASN 6 Ca 0.00 1.51 0.00 0.00 -0.71 0.00 0.00 52.86 53.66 4ayk s ASN 6 Cb 0.00 -2.46 0.00 0.00 0.41 0.00 0.00 41.25 39.20 4ayk s ASN 6 CO 0.00 -0.28 0.00 -0.81 -1.51 0.00 0.00 177.10 174.50 4ayk n PRO 7 N -0.49 -1.25 -4.10 -0.60 -0.04 -1.26 -5.07 135.00 122.19 4ayk n PRO 7 Ca 0.05 0.00 -0.09 0.00 -0.04 0.00 0.00 63.50 63.42 4ayk n PRO 7 Cb 0.54 0.00 -0.09 0.00 -0.04 0.00 0.00 33.50 33.90 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 -2.33 0.91 -0.34 0.54 0.52 -1.26 -4.96 118.95 112.03 4ayk s ARG 8 Ca 0.00 -1.35 -0.29 0.00 -0.52 0.00 0.00 55.73 53.57 4ayk s ARG 8 Cb 0.00 0.26 0.02 0.00 0.52 0.00 0.00 34.95 35.75 4ayk s ARG 8 CO 0.00 -0.26 1.07 -1.58 0.02 0.00 0.00 175.30 174.55 4ayk s TRP 9 N -4.01 3.11 -0.97 -0.53 0.52 -1.26 -4.87 118.94 110.93 4ayk s TRP 9 Ca 0.20 1.13 0.27 0.00 0.02 0.00 0.00 56.10 57.71 4ayk s TRP 9 Cb 0.07 -3.76 0.87 0.00 -1.15 0.00 0.00 33.47 29.50 4ayk s TRP 9 CO -0.01 -0.82 1.68 0.39 0.02 0.00 0.00 176.95 178.21 4ayk n GLU 10 N 6.96 0.02 -2.93 4.98 1.02 -1.26 -4.86 120.64 124.58 4ayk n GLU 10 Ca 0.12 0.01 -0.33 0.00 -0.02 0.00 0.00 57.16 56.94 4ayk n GLU 10 Cb 0.47 -1.52 -0.07 0.00 -0.02 0.00 0.00 31.44 30.31 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 -3.01 4.18 0.00 3.49 -0.21 -1.26 -4.95 119.66 117.90 4ayk s GLN 11 Ca 0.12 0.98 0.25 0.00 0.02 0.00 0.00 55.36 56.74 4ayk s GLN 11 Cb 0.18 -2.31 0.49 0.00 1.00 0.00 0.00 33.01 32.36 4ayk s GLN 11 CO 0.61 0.06 1.40 0.25 -2.12 0.00 0.00 175.29 175.49 4ayk n THR 12 N -0.45 0.00 -4.77 -0.19 -2.24 -1.26 -4.85 114.28 100.52 4ayk n THR 12 Ca 0.05 -0.23 -0.24 0.00 -2.27 0.00 0.00 64.05 61.36 4ayk n THR 12 Cb 0.53 0.81 -0.15 0.00 -2.10 0.00 0.00 70.33 69.42 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 -2.37 1.48 0.10 4.78 3.76 -1.26 -2.69 115.29 119.09 4ayk s HIS 13 Ca 0.25 -0.30 0.05 0.00 -0.15 0.00 0.00 55.06 54.91 4ayk s HIS 13 Cb 0.19 -0.96 -0.03 0.00 1.11 0.00 0.00 32.58 32.89 4ayk s HIS 13 CO 0.49 -0.04 -0.14 -0.51 -0.85 0.00 0.00 174.74 173.69 4ayk s LEU 14 N -0.32 2.36 0.15 0.89 1.43 -0.59 -4.97 118.68 117.63 4ayk s LEU 14 Ca 0.05 -0.74 0.08 0.00 -1.03 0.00 0.00 54.13 52.49 4ayk s LEU 14 Cb -0.07 -0.50 -0.04 0.00 0.03 0.00 0.00 46.19 45.61 4ayk s LEU 14 CO -0.00 -0.14 -0.17 0.42 0.23 0.00 0.00 176.35 176.69 4ayk s THR 15 N -1.87 1.67 0.06 5.49 -4.23 -1.26 -2.18 115.64 113.33 4ayk s THR 15 Ca 0.04 -1.82 -0.04 0.00 -1.18 0.00 0.00 61.69 58.70 4ayk s THR 15 Cb -0.06 -1.72 -0.03 0.00 1.34 0.00 0.00 72.50 72.03 4ayk s THR 15 CO 0.02 -0.31 0.05 -0.72 -0.54 0.00 0.00 174.62 173.12 4ayk s TYR 16 N -1.96 0.39 -0.13 3.99 1.13 -1.02 -1.48 117.35 118.26 4ayk s TYR 16 Ca 0.13 -0.90 -0.07 0.00 -1.41 0.00 0.00 57.07 54.82 4ayk s TYR 16 Cb -0.06 -0.28 0.05 0.00 -1.10 0.00 0.00 41.96 40.58 4ayk s TYR 16 CO 0.05 -0.44 0.31 0.50 -2.51 0.00 0.00 175.55 173.47 4ayk s ARG 17 N -3.90 0.28 -0.29 -3.49 3.52 -1.04 -2.35 118.95 111.68 4ayk s ARG 17 Ca 0.06 0.63 -0.21 0.00 -0.13 0.00 0.00 55.73 56.08 4ayk s ARG 17 Cb 0.07 -0.08 -0.01 0.00 -1.56 0.00 0.00 34.95 33.37 4ayk s ARG 17 CO -0.10 -0.16 0.69 0.42 -0.81 0.00 0.00 175.30 175.33 4ayk s ILE 18 N 1.32 4.90 0.23 4.11 1.01 -1.26 -2.36 121.20 129.15 4ayk s ILE 18 Ca -0.09 1.07 -0.07 0.00 0.00 0.00 0.00 60.65 61.56 4ayk s ILE 18 Cb -0.10 -4.03 0.19 0.00 0.01 0.00 0.00 42.46 38.54 4ayk s ILE 18 CO -0.10 -0.12 1.84 -0.08 0.00 0.00 0.00 174.94 176.48 4ayk h GLU 19 N 8.05 1.23 -2.16 2.79 4.81 -1.70 -3.46 114.58 124.14 4ayk h GLU 19 Ca -0.26 -0.16 0.02 0.00 -0.13 0.00 0.00 59.36 58.83 4ayk h GLU 19 Cb 1.11 -0.23 -0.18 0.00 0.63 0.00 0.00 28.75 30.08 4ayk h GLU 19 CO 0.82 0.92 0.35 0.54 -0.73 0.00 0.00 179.01 180.90 4ayk s ASN 20 N -6.24 -0.51 -0.11 1.04 4.22 -1.26 -5.11 114.94 106.97 4ayk s ASN 20 Ca -0.13 0.34 -0.09 0.00 -2.14 0.00 0.00 52.86 50.84 4ayk s ASN 20 Cb 0.16 0.46 -0.04 0.00 1.28 0.00 0.00 41.25 43.11 4ayk s ASN 20 CO 0.83 -0.62 0.19 -0.31 -2.04 0.00 0.00 177.10 175.14 4ayk s TYR 21 N -2.12 3.59 0.43 1.54 2.02 -1.26 -4.66 117.35 116.88 4ayk s TYR 21 Ca -0.03 0.58 -0.24 0.00 -0.37 0.00 0.00 57.07 57.01 4ayk s TYR 21 Cb -0.01 -2.04 -0.08 0.00 -0.40 0.00 0.00 41.96 39.43 4ayk s TYR 21 CO -0.01 0.64 1.12 -0.08 -1.57 0.00 0.00 175.55 175.66 4ayk s THR 22 N -0.78 3.34 -0.38 -0.71 -1.32 -1.26 -4.90 115.64 109.62 4ayk s THR 22 Ca 0.16 1.03 0.22 0.00 -1.21 0.00 0.00 61.69 61.89 4ayk s THR 22 Cb -0.13 -3.53 0.23 0.00 -1.51 0.00 0.00 72.50 67.56 4ayk s THR 22 CO 0.05 0.01 1.68 -0.81 -2.21 0.00 0.00 174.62 173.34 4ayk n PRO 23 N -0.26 0.17 -0.36 7.08 -0.04 -1.26 -2.80 135.00 137.53 4ayk n PRO 23 Ca 0.06 0.50 -0.02 0.00 -0.04 0.00 0.00 63.50 64.00 4ayk n PRO 23 Cb 0.48 -1.90 0.11 0.00 -0.04 0.00 0.00 33.50 32.16 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 1.14 -4.74 3.54 3.32 -1.98 -3.43 116.42 114.27 4ayk h ASP 24 Ca 0.00 -0.04 -0.28 0.00 0.02 0.00 0.00 57.03 56.72 4ayk h ASP 24 Cb 0.22 -0.29 -0.21 0.00 0.22 0.00 0.00 39.33 39.28 4ayk h ASP 24 CO 0.00 0.84 -0.74 -0.76 -1.72 0.00 0.00 179.24 176.86 4ayk s LEU 25 N -10.07 2.26 0.00 1.55 1.43 -1.12 -5.06 118.68 107.67 4ayk s LEU 25 Ca -0.13 -0.56 -0.07 0.00 -1.03 0.00 0.00 54.13 52.34 4ayk s LEU 25 Cb 0.18 -0.19 0.11 0.00 0.03 0.00 0.00 46.19 46.32 4ayk s LEU 25 CO 0.82 -0.20 0.36 -0.81 0.23 0.00 0.00 176.35 176.75 4ayk n PRO 26 N 1.42 -2.00 0.03 1.29 -0.04 -1.26 -4.48 135.00 129.96 4ayk n PRO 26 Ca -0.22 -0.58 -0.19 0.00 -0.04 0.00 0.00 63.50 62.47 4ayk n PRO 26 Cb 0.55 -0.58 -0.14 0.00 -0.04 0.00 0.00 33.50 33.29 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 0.24 -0.82 0.54 0.11 -1.97 -3.13 114.38 109.36 4ayk h ARG 27 Ca -0.14 -0.41 0.03 0.00 0.10 0.00 0.00 59.98 59.55 4ayk h ARG 27 Cb 0.43 0.15 -0.05 0.00 1.11 0.00 0.00 29.97 31.62 4ayk h ARG 27 CO 0.09 1.09 0.53 0.00 0.10 0.00 0.00 179.97 181.78 4ayk h ALA 28 N 0.32 1.06 -0.35 0.08 0.00 -1.98 0.91 119.26 119.31 4ayk h ALA 28 Ca -0.35 -0.04 -0.17 0.00 0.00 0.00 0.00 54.91 54.35 4ayk h ALA 28 Cb 2.04 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 19.54 4ayk h ALA 28 CO 0.12 0.37 -0.44 -0.44 0.00 0.00 0.00 179.25 178.86 4ayk h ASP 29 N 1.04 0.99 -0.10 0.00 3.32 -1.95 -1.94 116.42 117.77 4ayk h ASP 29 Ca 0.32 -0.48 -0.05 0.00 0.02 0.00 0.00 57.03 56.84 4ayk h ASP 29 Cb -0.02 -0.28 -0.00 0.00 0.22 0.00 0.00 39.33 39.25 4ayk h ASP 29 CO -0.10 1.28 -0.13 0.58 -1.72 0.00 0.00 179.24 179.14 4ayk h VAL 30 N 0.73 1.38 -0.90 -1.35 2.07 -1.32 -2.69 116.25 114.16 4ayk h VAL 30 Ca 0.05 -1.35 0.01 0.00 0.82 0.00 0.00 66.70 66.23 4ayk h VAL 30 Cb 1.04 2.03 -0.04 0.00 -1.52 0.00 0.00 31.29 32.80 4ayk h VAL 30 CO 0.10 0.38 0.59 -0.78 0.02 0.00 0.00 177.57 177.89 4ayk h ASP 31 N -0.16 1.03 -0.43 0.57 1.82 0.82 -1.25 116.42 118.82 4ayk h ASP 31 Ca 0.01 -0.03 0.00 0.00 -0.39 0.00 0.00 57.03 56.63 4ayk h ASP 31 Cb 0.68 -0.26 -0.02 0.00 0.68 0.00 0.00 39.33 40.41 4ayk h ASP 31 CO 0.03 0.75 0.28 -0.74 -1.61 0.00 0.00 179.24 177.95 4ayk h HIS 32 N 1.22 0.54 -0.20 0.28 2.76 -1.33 0.98 115.15 119.40 4ayk h HIS 32 Ca 0.33 0.01 0.00 0.00 -2.20 0.00 0.00 60.37 58.51 4ayk h HIS 32 Cb -0.14 -0.18 -0.01 0.00 1.55 0.00 0.00 27.41 28.63 4ayk h HIS 32 CO -0.01 0.34 0.13 0.00 -1.30 0.00 0.00 177.93 177.10 4ayk h ALA 33 N 1.16 0.25 -0.35 5.26 0.00 -1.07 0.67 119.26 125.19 4ayk h ALA 33 Ca 0.16 -0.01 -0.16 0.00 0.00 0.00 0.00 54.91 54.89 4ayk h ALA 33 Cb -0.06 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.64 4ayk h ALA 33 CO -0.03 -0.27 -0.41 0.82 0.00 0.00 0.00 179.25 179.35 4ayk h ILE 34 N 0.27 1.28 -0.34 0.00 1.08 -0.86 -2.68 117.51 116.26 4ayk h ILE 34 Ca 0.07 -1.59 -0.16 0.00 -0.39 0.00 0.00 64.86 62.80 4ayk h ILE 34 Cb -0.03 1.48 -0.01 0.00 -3.07 0.00 0.00 36.82 35.19 4ayk h ILE 34 CO -0.02 0.53 -0.41 -0.08 -0.69 0.00 0.00 178.15 177.48 4ayk h GLU 35 N 0.69 0.83 -0.97 2.37 4.81 0.12 -2.93 114.58 119.50 4ayk h GLU 35 Ca 0.05 -0.44 0.00 0.00 -0.13 0.00 0.00 59.36 58.83 4ayk h GLU 35 Cb 1.01 0.02 -0.05 0.00 0.63 0.00 0.00 28.75 30.36 4ayk h GLU 35 CO 0.10 1.08 0.61 -0.22 -0.73 0.00 0.00 179.01 179.85 4ayk h LYS 36 N 0.67 1.30 -0.67 1.92 3.64 0.40 -2.43 116.57 121.41 4ayk h LYS 36 Ca 0.05 -0.10 -0.05 0.00 -1.27 0.00 0.00 60.65 59.28 4ayk h LYS 36 Cb 0.98 -0.28 -0.03 0.00 -0.41 0.00 0.00 32.23 32.49 4ayk h LYS 36 CO 0.09 0.89 0.23 0.00 -2.27 0.00 0.00 179.45 178.39 4ayk h ALA 37 N 1.33 0.87 -0.99 5.00 0.00 -1.35 -2.56 119.26 121.57 4ayk h ALA 37 Ca 0.35 -0.20 0.01 0.00 0.00 0.00 0.00 54.91 55.07 4ayk h ALA 37 Cb -0.10 -0.26 -0.05 0.00 0.00 0.00 0.00 17.79 17.38 4ayk h ALA 37 CO -0.07 0.53 0.66 0.74 0.00 0.00 0.00 179.25 181.10 4ayk h PHE 38 N 0.96 1.25 -1.00 0.00 0.04 -1.27 -1.84 116.94 115.08 4ayk h PHE 38 Ca 0.22 0.03 0.01 0.00 2.80 0.00 0.00 57.97 61.03 4ayk h PHE 38 Cb 0.26 -0.42 -0.05 0.00 2.20 0.00 0.00 35.95 37.94 4ayk h PHE 38 CO 0.02 0.79 0.66 1.96 -0.60 0.00 0.00 178.31 181.13 4ayk h GLN 39 N 1.35 1.32 -0.95 1.51 7.50 -1.14 0.15 115.11 124.86 4ayk h GLN 39 Ca 0.36 -0.08 0.01 0.00 0.50 0.00 0.00 58.65 59.44 4ayk h GLN 39 Cb -0.16 -0.30 -0.05 0.00 0.05 0.00 0.00 27.48 27.03 4ayk h GLN 39 CO -0.08 0.88 0.62 -0.07 -1.50 0.00 0.00 178.83 178.68 4ayk h LEU 40 N 1.36 1.09 -0.04 1.46 3.38 -1.08 0.56 115.31 122.04 4ayk h LEU 40 Ca 0.37 -0.03 -0.15 0.00 0.09 0.00 0.00 57.88 58.15 4ayk h LEU 40 Cb -0.15 -0.27 0.01 0.00 0.09 0.00 0.00 40.66 40.34 4ayk h LEU 40 CO -0.08 0.80 -0.56 -0.50 0.09 0.00 0.00 178.44 178.19 4ayk h TRP 41 N 1.28 0.64 -0.20 1.13 4.06 -1.02 -3.28 115.95 118.56 4ayk h TRP 41 Ca 0.35 -0.32 -0.13 0.00 2.06 0.00 0.00 58.89 60.85 4ayk h TRP 41 Cb -0.14 -0.08 -0.01 0.00 -1.00 0.00 0.00 29.16 27.93 4ayk h TRP 41 CO -0.00 1.12 -0.41 1.03 -3.56 0.00 0.00 178.44 176.61 4ayk h SER 42 N -0.03 0.49 -0.25 -3.49 0.87 -0.49 -2.19 113.55 108.46 4ayk h SER 42 Ca -0.06 -0.22 0.07 0.00 -1.23 0.00 0.00 61.79 60.36 4ayk h SER 42 Cb 1.25 -0.14 -0.01 0.00 -0.44 0.00 0.00 62.40 63.06 4ayk h SER 42 CO 0.11 0.85 0.21 0.78 -0.53 0.00 0.00 176.83 178.25 4ayk h ASN 43 N 0.38 0.00 -0.19 6.23 -0.26 0.06 -1.30 115.58 120.51 4ayk h ASN 43 Ca 0.03 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.77 4ayk h ASN 43 Cb 0.89 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 38.15 4ayk h ASN 43 CO 0.07 0.00 0.00 1.33 -1.06 0.00 0.00 177.43 177.77 4ayk n VAL 44 N -4.17 0.53 -3.91 2.81 0.24 -1.09 -4.93 118.33 107.81 4ayk n VAL 44 Ca 0.03 -0.76 -0.11 0.00 -2.04 0.00 0.00 64.34 61.46 4ayk n VAL 44 Cb 0.36 0.84 -0.12 0.00 -1.47 0.00 0.00 33.84 33.45 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 -0.96 0.06 -2.00 3.34 -4.23 -0.49 -4.20 115.64 107.16 4ayk s THR 45 Ca 0.18 -0.52 0.03 0.00 -1.18 0.00 0.00 61.69 60.21 4ayk s THR 45 Cb 0.11 -0.22 0.10 0.00 1.34 0.00 0.00 72.50 73.82 4ayk s THR 45 CO 0.15 -0.29 0.67 -0.81 -0.54 0.00 0.00 174.62 173.80 4ayk n PRO 46 N 2.13 0.48 -1.80 3.99 -0.04 -1.26 -4.53 135.00 133.97 4ayk n PRO 46 Ca -0.19 0.00 -0.32 0.00 -0.04 0.00 0.00 63.50 62.95 4ayk n PRO 46 Cb 0.57 -1.11 0.03 0.00 -0.04 0.00 0.00 33.50 32.95 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 -1.22 3.33 0.06 1.53 1.43 -1.26 -4.96 118.68 117.59 4ayk s LEU 47 Ca 0.05 1.77 0.03 0.00 -1.03 0.00 0.00 54.13 54.95 4ayk s LEU 47 Cb 0.02 -4.52 -0.03 0.00 0.03 0.00 0.00 46.19 41.69 4ayk s LEU 47 CO 0.04 -1.37 -0.09 0.42 0.23 0.00 0.00 176.35 175.58 4ayk s THR 48 N -2.67 0.72 0.08 5.49 -4.23 -1.10 -4.67 115.64 109.26 4ayk s THR 48 Ca 0.62 -1.28 0.05 0.00 -1.18 0.00 0.00 61.69 59.90 4ayk s THR 48 Cb -0.16 -0.90 -0.03 0.00 1.34 0.00 0.00 72.50 72.75 4ayk s THR 48 CO 0.45 -0.42 -0.14 -0.36 -0.54 0.00 0.00 174.62 173.61 4ayk s PHE 49 N -1.72 1.21 -0.22 3.99 0.40 -1.26 -1.54 117.98 118.84 4ayk s PHE 49 Ca -0.04 -0.49 -0.16 0.00 -0.60 0.00 0.00 56.93 55.64 4ayk s PHE 49 Cb -0.08 -0.67 0.06 0.00 0.51 0.00 0.00 43.02 42.84 4ayk s PHE 49 CO 0.00 0.06 0.56 0.99 0.70 0.00 0.00 175.22 177.53 4ayk s THR 50 N -1.46 -0.01 0.39 0.64 2.01 -0.93 -4.97 115.64 111.32 4ayk s THR 50 Ca -0.01 0.02 -0.24 0.00 0.31 0.00 0.00 61.69 61.78 4ayk s THR 50 Cb -0.09 -0.80 -0.09 0.00 0.01 0.00 0.00 72.50 71.53 4ayk s THR 50 CO 0.02 0.01 1.01 -0.75 -0.69 0.00 0.00 174.62 174.22 4ayk s LYS 51 N 0.88 4.24 -0.06 4.92 2.20 -1.26 -2.44 119.74 128.22 4ayk s LYS 51 Ca -0.05 1.40 0.06 0.00 -0.36 0.00 0.00 55.97 57.02 4ayk s LYS 51 Cb -0.05 -2.51 -0.01 0.00 -1.51 0.00 0.00 37.83 33.75 4ayk s LYS 51 CO -0.07 -0.05 -0.24 0.14 -0.36 0.00 0.00 175.35 174.76 4ayk s VAL 52 N -1.76 1.98 -2.09 4.02 -7.23 -0.99 -4.89 120.40 109.45 4ayk s VAL 52 Ca 0.57 -1.03 0.24 0.00 -1.81 0.00 0.00 61.98 59.96 4ayk s VAL 52 Cb -0.19 -1.68 0.09 0.00 0.56 0.00 0.00 36.38 35.17 4ayk s VAL 52 CO 0.24 0.55 1.23 -0.24 -0.31 0.00 0.00 175.10 176.57 4ayk n SER 53 N 2.96 1.89 -3.86 4.85 2.88 -1.26 -4.76 113.62 116.33 4ayk n SER 53 Ca -0.17 -1.43 -0.11 0.00 -1.33 0.00 0.00 58.87 55.82 4ayk n SER 53 Cb 0.52 0.34 -0.10 0.00 -0.75 0.00 0.00 64.21 64.23 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 -2.42 0.52 0.00 -1.46 2.02 -1.26 -5.12 118.70 110.99 4ayk s GLU 54 Ca 0.21 -0.40 0.00 0.00 0.02 0.00 0.00 54.97 54.80 4ayk s GLU 54 Cb 0.19 0.22 0.00 0.00 0.10 0.00 0.00 34.13 34.64 4ayk s GLU 54 CO 0.53 -0.13 0.00 0.41 0.02 0.00 0.00 175.26 176.09 4ayk n GLY 55 N 1.35 -1.89 3.84 -1.39 0.00 -1.26 -4.90 105.19 100.94 4ayk n GLY 55 Ca -0.22 -1.51 -0.32 0.00 0.00 0.00 0.00 46.02 43.97 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 -2.04 4.01 0.18 1.61 0.00 -1.26 -5.04 119.66 117.12 4ayk s GLN 56 Ca 0.00 0.91 0.07 0.00 -0.00 0.00 0.00 55.36 56.34 4ayk s GLN 56 Cb 0.00 -2.21 -0.04 0.00 0.00 0.00 0.00 33.01 30.76 4ayk s GLN 56 CO 0.00 -0.14 0.05 0.00 0.00 0.00 0.00 175.29 175.20 4ayk s ALA 57 N -2.42 3.32 0.25 2.60 0.00 -1.26 -5.02 121.76 119.23 4ayk s ALA 57 Ca 0.58 -1.35 -0.06 0.00 0.00 0.00 0.00 51.96 51.13 4ayk s ALA 57 Cb -0.10 -1.10 0.25 0.00 0.00 0.00 0.00 23.12 22.17 4ayk s ALA 57 CO 0.25 0.46 1.92 -0.44 0.00 0.00 0.00 175.76 177.95 4ayk h ASP 58 N 2.49 1.13 -3.35 0.00 3.32 -1.63 -3.39 116.42 114.98 4ayk h ASP 58 Ca -0.47 -0.03 -0.67 0.00 0.02 0.00 0.00 57.03 55.88 4ayk h ASP 58 Cb 1.21 -0.28 -0.36 0.00 0.22 0.00 0.00 39.33 40.12 4ayk h ASP 58 CO 0.60 0.82 -0.84 -0.63 -1.72 0.00 0.00 179.24 177.47 4ayk s ILE 59 N -6.12 2.06 -0.16 0.35 1.01 -0.68 -4.69 121.20 112.96 4ayk s ILE 59 Ca -0.13 -1.17 -0.09 0.00 0.00 0.00 0.00 60.65 59.27 4ayk s ILE 59 Cb 0.18 -1.98 -0.05 0.00 0.01 0.00 0.00 42.46 40.62 4ayk s ILE 59 CO 0.82 0.33 0.14 -0.04 0.00 0.00 0.00 174.94 176.18 4ayk s MET 60 N 1.24 3.86 -0.11 2.79 -1.94 -1.23 -2.51 119.30 121.40 4ayk s MET 60 Ca 0.00 -0.18 0.04 0.00 -1.71 0.00 0.00 55.69 53.84 4ayk s MET 60 Cb -0.15 -3.32 0.00 0.00 2.01 0.00 0.00 34.83 33.37 4ayk s MET 60 CO -0.10 0.51 -0.23 0.42 -0.01 0.00 0.00 175.02 175.61 4ayk s ILE 61 N -0.25 2.09 0.05 2.53 1.01 -0.99 -0.33 121.20 125.30 4ayk s ILE 61 Ca 0.11 -1.00 -0.10 0.00 0.00 0.00 0.00 60.65 59.66 4ayk s ILE 61 Cb -0.11 -1.80 0.01 0.00 0.01 0.00 0.00 42.46 40.56 4ayk s ILE 61 CO 0.01 0.56 0.21 -0.94 0.00 0.00 0.00 174.94 174.78 4ayk s SER 62 N 0.42 0.03 -0.10 3.58 1.04 -1.00 -1.58 113.70 116.08 4ayk s SER 62 Ca -0.17 -0.40 -0.03 0.00 0.48 0.00 0.00 55.95 55.83 4ayk s SER 62 Cb -0.18 0.31 -0.04 0.00 0.10 0.00 0.00 66.02 66.22 4ayk s SER 62 CO 0.07 -0.60 0.04 -0.36 0.98 0.00 0.00 173.24 173.36 4ayk s PHE 63 N -2.84 3.27 0.16 5.02 0.08 -1.26 -2.51 117.98 119.89 4ayk s PHE 63 Ca -0.03 0.26 0.03 0.00 0.12 0.00 0.00 56.93 57.31 4ayk s PHE 63 Cb 0.00 -1.84 -0.05 0.00 -0.57 0.00 0.00 43.02 40.56 4ayk s PHE 63 CO -0.05 0.51 -0.04 0.14 -0.10 0.00 0.00 175.22 175.68 4ayk s VAL 64 N -0.83 0.84 -0.04 -0.44 -7.23 -1.12 -4.94 120.40 106.63 4ayk s VAL 64 Ca 0.13 -2.00 0.03 0.00 -1.81 0.00 0.00 61.98 58.33 4ayk s VAL 64 Cb -0.12 -1.98 0.00 0.00 0.56 0.00 0.00 36.38 34.85 4ayk s VAL 64 CO 0.03 -0.61 -0.13 -0.13 -0.31 0.00 0.00 175.10 173.94 4ayk s ARG 65 N -3.85 1.42 0.99 4.82 0.52 -1.26 -1.95 118.95 119.64 4ayk s ARG 65 Ca 0.20 -0.44 0.00 0.00 -0.52 0.00 0.00 55.73 54.96 4ayk s ARG 65 Cb 0.05 -1.25 0.00 0.00 0.52 0.00 0.00 34.95 34.27 4ayk s ARG 65 CO 0.02 0.15 0.00 0.41 0.02 0.00 0.00 175.30 175.90 4ayk n GLY 66 N 3.33 1.92 3.68 -3.53 0.00 -1.26 -4.19 105.19 105.14 4ayk n GLY 66 Ca -0.19 -0.19 -0.42 0.00 0.00 0.00 0.00 46.02 45.22 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 6.83 -0.41 1.61 -1.08 -1.26 -4.12 116.67 114.24 4ayk s ASP 67 Ca 0.00 2.11 0.09 0.00 -0.52 0.00 0.00 52.55 54.23 4ayk s ASP 67 Cb 0.00 -2.56 0.28 0.00 -1.46 0.00 0.00 42.92 39.19 4ayk s ASP 67 CO 0.00 -0.74 0.61 0.00 0.52 0.00 0.00 175.17 175.56 4ayk n HIS 68 N 5.59 0.19 -3.59 -5.34 1.44 -1.26 -4.92 115.22 107.33 4ayk n HIS 68 Ca 0.14 -3.69 -0.20 0.00 -2.01 0.00 0.00 57.72 51.95 4ayk n HIS 68 Cb 0.43 -0.39 0.06 0.00 0.12 0.00 0.00 29.99 30.22 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 0.98 -5.94 -3.96 -1.40 1.74 -1.26 -4.99 116.66 101.83 4ayk n ARG 69 Ca 0.23 0.73 -0.09 0.00 -0.77 0.00 0.00 57.85 57.96 4ayk n ARG 69 Cb 0.56 -5.55 -0.10 0.00 -1.02 0.00 0.00 32.46 26.35 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 -4.21 0.23 0.00 0.55 -1.08 -1.26 -5.03 116.67 105.87 4ayk s ASP 70 Ca 0.09 -0.60 0.16 0.00 -0.52 0.00 0.00 52.55 51.68 4ayk s ASP 70 Cb -0.04 0.21 0.46 0.00 -1.46 0.00 0.00 42.92 42.09 4ayk s ASP 70 CO 0.77 -0.51 1.37 -0.46 0.52 0.00 0.00 175.17 176.87 4ayk n ASN 71 N 0.74 2.23 -3.34 -0.34 6.94 -1.26 -4.46 115.26 115.77 4ayk n ASN 71 Ca -0.19 -1.94 -0.26 0.00 -0.02 0.00 0.00 54.58 52.18 4ayk n ASN 71 Cb 0.59 -0.25 -0.09 0.00 -2.36 0.00 0.00 39.78 37.67 4ayk n ASN 71 CO 0.00 0.00 0.00 -1.20 -1.03 0.00 0.00 177.26 175.03 4ayk n SER 72 N 0.71 0.18 -4.65 0.53 7.64 -1.26 -5.13 113.62 111.64 4ayk n SER 72 Ca 0.15 -2.60 -0.30 0.00 1.01 0.00 0.00 58.87 57.13 4ayk n SER 72 Cb 0.37 -0.60 0.17 0.00 -1.01 0.00 0.00 64.21 63.14 4ayk n SER 72 CO 0.00 0.00 0.00 -2.84 -3.01 0.00 0.00 175.04 169.19 4ayk s PRO 73 N -0.66 0.69 0.48 1.43 0.02 -1.26 -5.00 135.00 130.70 4ayk s PRO 73 Ca 0.34 1.16 -0.19 0.00 0.02 0.00 0.00 61.00 62.32 4ayk s PRO 73 Cb 0.09 -1.72 -0.09 0.00 0.02 0.00 0.00 34.50 32.81 4ayk s PRO 73 CO -0.15 -2.73 0.98 -0.06 -0.33 0.00 0.00 177.00 174.71 4ayk s PHE 74 N -2.69 3.28 -0.97 6.54 0.08 -1.26 -4.99 117.98 117.98 4ayk s PHE 74 Ca 0.66 1.55 -0.01 0.00 0.12 0.00 0.00 56.93 59.25 4ayk s PHE 74 Cb -0.22 -2.88 0.30 0.00 -0.57 0.00 0.00 43.02 39.66 4ayk s PHE 74 CO 0.59 -0.39 1.38 -3.47 -0.10 0.00 0.00 175.22 173.24 4ayk n ASP 75 N -1.10 6.01 -0.62 1.36 -0.08 -1.26 -4.87 116.55 115.99 4ayk n ASP 75 Ca 0.07 -3.48 0.00 0.00 -1.51 0.00 0.00 54.79 49.87 4ayk n ASP 75 Cb 0.54 -1.11 0.00 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 0.91 -0.59 0.18 0.27 0.00 -1.26 -2.92 105.19 101.77 4ayk n GLY 76 Ca 0.30 -1.01 0.11 0.00 0.00 0.00 0.00 46.02 45.43 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 0.00 1.61 0.11 -1.96 -3.42 132.00 128.35 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 0.41 -0.21 0.00 0.00 178.00 178.44 4ayk n GLY 78 N -1.28 -0.21 4.51 -0.55 0.00 -1.15 -4.95 105.19 101.57 4ayk n GLY 78 Ca -0.01 -1.91 0.00 0.00 0.00 0.00 0.00 46.02 44.10 4ayk n GLY 78 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 4ayk n GLY 79 N -3.25 -1.76 3.80 -0.02 0.00 -1.26 -4.19 105.19 98.50 4ayk n GLY 79 Ca 0.17 -1.59 -0.34 0.00 0.00 0.00 0.00 46.02 44.26 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 6.26 0.03 1.61 4.22 -1.26 -4.95 114.94 116.85 4ayk s ASN 80 Ca 0.00 1.94 0.24 0.00 -2.14 0.00 0.00 52.86 52.90 4ayk s ASN 80 Cb 0.00 -2.56 0.32 0.00 1.28 0.00 0.00 41.25 40.29 4ayk s ASN 80 CO 0.00 -0.84 1.27 0.18 -2.04 0.00 0.00 177.10 175.68 4ayk n LEU 81 N -1.06 0.60 -3.81 3.54 4.77 -1.26 -4.93 117.00 114.85 4ayk n LEU 81 Ca 0.09 -0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.07 4ayk n LEU 81 Cb 0.52 -0.18 0.00 0.00 -2.33 0.00 0.00 43.42 41.43 4ayk n LEU 81 CO 0.40 0.08 0.96 0.00 -1.33 0.00 0.00 177.39 177.51 4ayk s ALA 82 N -3.07 -2.06 -0.30 -1.18 0.00 -1.26 -2.13 121.76 111.76 4ayk s ALA 82 Ca 0.08 0.17 -0.14 0.00 0.00 0.00 0.00 51.96 52.07 4ayk s ALA 82 Cb 0.16 0.65 0.15 0.00 0.00 0.00 0.00 23.12 24.08 4ayk s ALA 82 CO 0.74 -1.08 0.91 -3.38 0.00 0.00 0.00 175.76 172.95 4ayk s HIS 83 N -2.36 -0.81 0.66 0.00 -3.43 -1.09 -5.01 115.29 103.26 4ayk s HIS 83 Ca 0.20 1.43 -0.04 0.00 -0.80 0.00 0.00 55.06 55.85 4ayk s HIS 83 Cb 0.01 0.48 0.06 0.00 -1.43 0.00 0.00 32.58 31.70 4ayk s HIS 83 CO 0.00 -0.40 0.95 0.00 -2.00 0.00 0.00 174.74 173.29 4ayk s ALA 84 N 2.36 3.39 0.07 -1.38 0.00 -1.26 -2.87 121.76 122.08 4ayk s ALA 84 Ca -0.04 -1.09 0.03 0.00 0.00 0.00 0.00 51.96 50.86 4ayk s ALA 84 Cb -0.07 -2.42 -0.04 0.00 0.00 0.00 0.00 23.12 20.59 4ayk s ALA 84 CO -0.18 -1.16 0.05 -0.06 0.00 0.00 0.00 175.76 174.42 4ayk s PHE 85 N -3.11 3.13 0.62 0.00 0.08 -1.00 -4.97 117.98 112.74 4ayk s PHE 85 Ca 0.60 0.05 -0.19 0.00 0.12 0.00 0.00 56.93 57.51 4ayk s PHE 85 Cb -0.10 -1.61 -0.03 0.00 -0.57 0.00 0.00 43.02 40.72 4ayk s PHE 85 CO 0.43 0.51 1.24 1.04 -0.10 0.00 0.00 175.22 178.33 4ayk n GLN 86 N 0.58 1.19 -1.70 0.44 6.02 -1.26 -3.75 117.38 118.90 4ayk n GLN 86 Ca -0.10 0.46 -0.38 0.00 -0.01 0.00 0.00 57.00 56.97 4ayk n GLN 86 Cb 0.52 -2.46 -0.03 0.00 1.02 0.00 0.00 30.24 29.29 4ayk n GLN 86 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 177.06 174.80 4ayk s PRO 87 N -3.13 2.49 0.37 -1.09 0.04 -1.26 -2.91 135.00 129.51 4ayk s PRO 87 Ca 0.79 1.37 -0.16 0.00 0.04 0.00 0.00 61.00 63.04 4ayk s PRO 87 Cb -0.40 -4.48 0.06 0.00 0.04 0.00 0.00 34.50 29.73 4ayk s PRO 87 CO 0.44 -2.84 0.81 0.20 0.04 0.00 0.00 177.00 175.65 4ayk s GLY 88 N 10.19 0.37 0.88 0.56 0.00 -1.26 -4.56 107.32 113.50 4ayk s GLY 88 Ca 0.91 -0.74 -0.15 0.00 0.00 0.00 0.00 44.72 44.74 4ayk s GLY 88 CO 0.27 -0.08 0.92 -1.55 0.00 0.00 0.00 173.10 172.66 4ayk n PRO 89 N -0.55 -2.03 0.00 2.90 -0.04 -1.26 -3.51 135.00 130.51 4ayk n PRO 89 Ca -0.08 -1.45 0.00 0.00 -0.04 0.00 0.00 63.50 61.93 4ayk n PRO 89 Cb 0.60 -1.19 0.00 0.00 -0.04 0.00 0.00 33.50 32.87 4ayk n PRO 89 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 4ayk n GLY 90 N -2.62 4.26 0.09 0.55 0.00 -1.26 -0.93 105.19 105.28 4ayk n GLY 90 Ca 0.12 0.15 0.12 0.00 0.00 0.00 0.00 46.02 46.41 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 0.62 -1.70 -0.61 3.06 -1.26 -4.84 119.36 114.62 4ayk n ILE 91 Ca 0.00 -0.03 -0.39 0.00 -2.50 0.00 0.00 62.75 59.83 4ayk n ILE 91 Cb 0.00 -0.79 0.04 0.00 0.54 0.00 0.00 39.64 39.42 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 0.80 0.46 2.46 4.50 0.00 -0.11 -1.81 105.19 111.49 4ayk n GLY 92 Ca 0.04 0.03 0.00 0.00 0.00 0.00 0.00 46.02 46.10 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 0.89 3.01 3.71 -0.02 0.00 -1.15 -4.48 105.19 107.16 4ayk n GLY 93 Ca 0.10 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.82 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 -1.31 3.60 -0.05 1.61 1.01 -0.75 -3.54 116.67 117.24 4ayk s ASP 94 Ca 0.00 1.83 -0.02 0.00 0.71 0.00 0.00 52.55 55.07 4ayk s ASP 94 Cb 0.00 -2.44 0.04 0.00 1.01 0.00 0.00 42.92 41.52 4ayk s ASP 94 CO 0.00 -2.61 0.09 0.00 0.21 0.00 0.00 175.17 172.86 4ayk s ALA 95 N -2.81 0.03 -0.15 5.23 0.00 0.55 -2.36 121.76 122.25 4ayk s ALA 95 Ca 0.64 0.38 -0.07 0.00 0.00 0.00 0.00 51.96 52.90 4ayk s ALA 95 Cb -0.19 -0.59 -0.04 0.00 0.00 0.00 0.00 23.12 22.29 4ayk s ALA 95 CO 0.57 -0.41 0.08 -1.01 0.00 0.00 0.00 175.76 175.00 4ayk s HIS 96 N 1.90 3.34 -0.12 0.00 3.76 -1.14 -2.38 115.29 120.66 4ayk s HIS 96 Ca 0.00 0.24 0.01 0.00 -0.15 0.00 0.00 55.06 55.16 4ayk s HIS 96 Cb -0.12 -2.01 -0.02 0.00 1.11 0.00 0.00 32.58 31.55 4ayk s HIS 96 CO -0.04 0.37 -0.14 -0.06 -0.85 0.00 0.00 174.74 174.02 4ayk s PHE 97 N -0.18 2.77 -0.04 1.40 0.40 -1.04 -2.68 117.98 118.61 4ayk s PHE 97 Ca 0.08 -0.61 -0.30 0.00 -0.60 0.00 0.00 56.93 55.51 4ayk s PHE 97 Cb -0.12 -1.80 -0.07 0.00 0.51 0.00 0.00 43.02 41.54 4ayk s PHE 97 CO 0.01 -0.17 1.83 0.34 0.70 0.00 0.00 175.22 177.92 4ayk s ASP 98 N 0.20 6.46 0.00 1.36 -1.08 -0.90 -2.80 116.67 119.90 4ayk s ASP 98 Ca -0.09 2.34 0.24 0.00 -0.52 0.00 0.00 52.55 54.52 4ayk s ASP 98 Cb -0.15 -2.53 0.22 0.00 -1.46 0.00 0.00 42.92 39.00 4ayk s ASP 98 CO 0.05 -1.09 1.27 1.21 0.52 0.00 0.00 175.17 177.14 4ayk n GLU 99 N 7.48 2.32 0.15 4.34 2.13 -0.82 -4.15 120.64 132.10 4ayk n GLU 99 Ca 0.19 -1.97 0.13 0.00 0.66 0.00 0.00 57.16 56.17 4ayk n GLU 99 Cb 0.42 -1.46 0.47 0.00 0.27 0.00 0.00 31.44 31.14 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 4.63 0.00 -2.54 4.31 3.32 -1.88 -3.44 116.42 120.82 4ayk h ASP 100 Ca 0.00 0.00 -0.55 0.00 0.02 0.00 0.00 57.03 56.50 4ayk h ASP 100 Cb 0.99 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 40.48 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 -3.30 3.03 -0.30 3.56 2.02 -1.26 -4.98 118.70 117.47 4ayk s GLU 101 Ca 0.06 -0.86 -0.25 0.00 0.02 0.00 0.00 54.97 53.94 4ayk s GLU 101 Cb 0.10 -2.70 0.00 0.00 0.10 0.00 0.00 34.13 31.64 4ayk s GLU 101 CO 0.51 0.47 0.87 0.50 0.02 0.00 0.00 175.26 177.62 4ayk s ARG 102 N -3.34 4.02 0.27 1.61 3.52 -1.26 -5.03 118.95 118.74 4ayk s ARG 102 Ca 0.32 0.77 -0.15 0.00 -0.13 0.00 0.00 55.73 56.54 4ayk s ARG 102 Cb -0.10 -3.72 -0.08 0.00 -1.56 0.00 0.00 34.95 29.49 4ayk s ARG 102 CO 0.25 -0.71 0.68 -1.58 -0.81 0.00 0.00 175.30 173.13 4ayk s TRP 103 N 3.10 3.45 0.26 5.12 0.52 -1.26 -4.66 118.94 125.47 4ayk s TRP 103 Ca 0.36 1.17 0.05 0.00 0.02 0.00 0.00 56.10 57.70 4ayk s TRP 103 Cb -0.14 -2.48 -0.06 0.00 -1.15 0.00 0.00 33.47 29.64 4ayk s TRP 103 CO 0.12 0.20 -0.03 0.95 0.02 0.00 0.00 176.95 178.21 4ayk s THR 104 N -1.82 1.35 -0.24 2.01 -4.23 -1.15 -4.91 115.64 106.66 4ayk s THR 104 Ca 0.49 -2.08 0.11 0.00 -1.18 0.00 0.00 61.69 59.03 4ayk s THR 104 Cb -0.12 -2.41 0.45 0.00 1.34 0.00 0.00 72.50 71.76 4ayk s THR 104 CO 0.19 -0.30 1.32 0.59 -0.54 0.00 0.00 174.62 175.87 4ayk n ASN 105 N -0.51 2.09 -0.14 3.99 3.02 -1.26 -2.65 115.26 119.79 4ayk n ASN 105 Ca -0.05 -3.80 0.00 0.00 -0.03 0.00 0.00 54.58 50.70 4ayk n ASN 105 Cb 0.64 -0.57 0.00 0.00 -0.61 0.00 0.00 39.78 39.24 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 -1.13 0.00 -1.26 6.41 2.04 -1.26 -5.01 115.26 115.05 4ayk n ASN 106 Ca 0.24 -0.14 -0.04 0.00 -0.44 0.00 0.00 54.58 54.20 4ayk n ASN 106 Cb 0.83 0.00 0.02 0.00 -2.53 0.00 0.00 39.78 38.10 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 0.47 -0.22 -2.53 3.72 -1.26 -4.69 117.46 112.95 4ayk n PHE 107 Ca 0.00 -0.80 0.00 0.00 -0.05 0.00 0.00 57.45 56.60 4ayk n PHE 107 Cb 0.00 -0.40 0.00 0.00 -0.94 0.00 0.00 39.48 38.14 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 0.40 0.63 0.26 -1.08 1.74 -1.26 -4.95 116.66 112.40 4ayk n ARG 108 Ca 0.09 0.00 -0.16 0.00 -0.77 0.00 0.00 57.85 57.01 4ayk n ARG 108 Cb 0.65 0.00 -0.08 0.00 -1.02 0.00 0.00 32.46 32.01 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 -0.77 -5.25 5.56 5.08 -1.96 -3.41 114.58 113.83 4ayk h GLU 109 Ca 0.00 0.05 -0.63 0.00 -1.00 0.00 0.00 59.36 57.78 4ayk h GLU 109 Cb 0.00 0.18 -0.20 0.00 0.50 0.00 0.00 28.75 29.23 4ayk h GLU 109 CO 0.00 -0.51 -0.63 0.71 -1.00 0.00 0.00 179.01 177.58 4ayk s TYR 110 N -6.00 3.11 -0.33 4.33 2.02 -1.26 -5.08 117.35 114.14 4ayk s TYR 110 Ca -0.17 -0.19 -0.12 0.00 -0.37 0.00 0.00 57.07 56.22 4ayk s TYR 110 Cb 0.05 -2.03 -0.01 0.00 -0.40 0.00 0.00 41.96 39.57 4ayk s TYR 110 CO 0.63 -0.01 0.22 -0.80 -1.57 0.00 0.00 175.55 174.01 4ayk s ASN 111 N 0.52 5.92 0.14 2.29 0.01 -1.26 -2.93 114.94 119.63 4ayk s ASN 111 Ca -0.00 -0.46 -0.11 0.00 -0.71 0.00 0.00 52.86 51.58 4ayk s ASN 111 Cb -0.14 -2.10 -0.05 0.00 0.41 0.00 0.00 41.25 39.37 4ayk s ASN 111 CO 0.02 -0.23 1.47 0.25 -1.51 0.00 0.00 177.10 177.10 4ayk h LEU 112 N 8.45 1.01 -0.53 0.60 5.85 -1.84 -3.18 115.31 125.67 4ayk h LEU 112 Ca -0.31 -0.47 0.00 0.00 0.84 0.00 0.00 57.88 57.93 4ayk h LEU 112 Cb 1.15 -0.28 -0.03 0.00 0.37 0.00 0.00 40.66 41.87 4ayk h LEU 112 CO 0.63 1.28 0.34 -0.74 -0.34 0.00 0.00 178.44 179.61 4ayk h HIS 113 N 0.76 0.69 -0.77 1.25 2.76 -1.90 0.16 115.15 118.09 4ayk h HIS 113 Ca 0.06 0.01 0.01 0.00 -2.20 0.00 0.00 60.37 58.24 4ayk h HIS 113 Cb 1.00 -0.23 -0.04 0.00 1.55 0.00 0.00 27.41 29.70 4ayk h HIS 113 CO 0.06 0.45 0.51 0.00 -1.30 0.00 0.00 177.93 177.65 4ayk h ARG 114 N 0.72 1.01 -0.29 5.26 3.08 -1.96 0.23 114.38 122.43 4ayk h ARG 114 Ca 0.19 -0.06 -0.16 0.00 0.07 0.00 0.00 59.98 60.02 4ayk h ARG 114 Cb -0.06 -0.23 -0.00 0.00 0.08 0.00 0.00 29.97 29.77 4ayk h ARG 114 CO -0.04 0.67 -0.46 0.28 -1.07 0.00 0.00 179.97 179.35 4ayk h VAL 115 N 1.04 1.29 -0.75 2.04 2.07 -1.46 -2.39 116.25 118.10 4ayk h VAL 115 Ca 0.28 -1.65 0.01 0.00 0.82 0.00 0.00 66.70 66.16 4ayk h VAL 115 Cb -0.12 1.63 -0.04 0.00 -1.52 0.00 0.00 31.29 31.25 4ayk h VAL 115 CO -0.06 0.54 0.49 0.00 0.02 0.00 0.00 177.57 178.55 4ayk h ALA 116 N 0.68 0.95 -0.85 1.67 0.00 -0.14 -0.13 119.26 121.44 4ayk h ALA 116 Ca 0.02 -0.06 -0.03 0.00 0.00 0.00 0.00 54.91 54.85 4ayk h ALA 116 Cb 1.07 -0.30 -0.04 0.00 0.00 0.00 0.00 17.79 18.51 4ayk h ALA 116 CO 0.11 0.37 0.43 0.00 0.00 0.00 0.00 179.25 180.15 4ayk h ALA 117 N 1.27 1.15 -0.39 0.00 0.00 -0.45 -2.06 119.26 118.77 4ayk h ALA 117 Ca 0.27 -0.15 -0.16 0.00 0.00 0.00 0.00 54.91 54.87 4ayk h ALA 117 Cb -0.11 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.34 4ayk h ALA 117 CO -0.06 0.66 -0.37 1.25 0.00 0.00 0.00 179.25 180.73 4ayk h HIS 118 N 1.20 1.12 -0.92 0.00 6.17 -0.84 -2.50 115.15 119.38 4ayk h HIS 118 Ca 0.29 -0.33 0.01 0.00 0.71 0.00 0.00 60.37 61.05 4ayk h HIS 118 Cb 0.09 -0.24 -0.05 0.00 2.52 0.00 0.00 27.41 29.74 4ayk h HIS 118 CO 0.01 1.16 0.61 0.93 0.71 0.00 0.00 177.93 181.35 4ayk h GLU 119 N 0.76 1.21 -0.82 5.26 4.39 -0.69 -1.44 114.58 123.26 4ayk h GLU 119 Ca 0.06 -0.07 -0.04 0.00 0.34 0.00 0.00 59.36 59.65 4ayk h GLU 119 Cb 0.96 -0.27 -0.04 0.00 -0.10 0.00 0.00 28.75 29.30 4ayk h GLU 119 CO 0.09 0.80 0.35 -0.07 -1.16 0.00 0.00 179.01 179.02 4ayk h LEU 120 N 1.25 1.11 -1.00 1.33 3.38 -1.25 -2.32 115.31 117.81 4ayk h LEU 120 Ca 0.34 -0.16 0.06 0.00 0.09 0.00 0.00 57.88 58.20 4ayk h LEU 120 Cb -0.14 -0.29 -0.06 0.00 0.09 0.00 0.00 40.66 40.25 4ayk h LEU 120 CO -0.07 0.97 0.65 1.23 0.09 0.00 0.00 178.44 181.31 4ayk h GLY 121 N 1.19 1.51 1.30 0.83 0.00 -0.82 0.27 103.07 107.35 4ayk h GLY 121 Ca 0.28 -0.48 -0.06 0.00 0.00 0.00 0.00 47.33 47.06 4ayk h GLY 121 CO -0.03 0.37 0.10 0.45 0.00 0.00 0.00 176.54 177.43 4ayk h HIS 122 N 1.21 0.91 0.00 5.60 3.86 -0.97 0.57 115.15 126.32 4ayk h HIS 122 Ca 0.42 -0.10 -0.05 0.00 -1.16 0.00 0.00 60.37 59.49 4ayk h HIS 122 Cb 0.11 -0.26 -0.01 0.00 1.06 0.00 0.00 27.41 28.32 4ayk h HIS 122 CO -0.00 0.78 -0.21 0.66 0.86 0.00 0.00 177.93 180.01 4ayk h SER 123 N 0.83 0.00 -0.03 2.45 4.64 -0.68 -1.12 113.55 119.64 4ayk h SER 123 Ca 0.18 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.50 4ayk h SER 123 Cb 0.35 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.44 4ayk h SER 123 CO 0.00 0.21 0.00 0.18 -0.87 0.00 0.00 176.83 176.36 4ayk n LEU 124 N -3.46 0.82 0.00 5.97 4.77 -0.09 -4.87 117.00 120.13 4ayk n LEU 124 Ca -0.00 -0.29 0.00 0.00 -0.03 0.00 0.00 56.01 55.68 4ayk n LEU 124 Cb 0.39 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.47 4ayk n LEU 124 CO 0.33 0.15 0.00 0.61 -1.33 0.00 0.00 177.39 177.14 4ayk n GLY 125 N 1.06 0.45 3.70 -0.72 0.00 -0.42 -4.98 105.19 104.27 4ayk n GLY 125 Ca 0.20 -0.62 -0.42 0.00 0.00 0.00 0.00 46.02 45.18 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 4.32 0.74 0.99 1.43 0.08 -4.99 118.68 121.25 4ayk s LEU 126 Ca 0.00 1.63 -0.05 0.00 -1.03 0.00 0.00 54.13 54.68 4ayk s LEU 126 Cb 0.00 -3.56 0.11 0.00 0.03 0.00 0.00 46.19 42.76 4ayk s LEU 126 CO 0.00 -0.36 1.04 -0.44 0.23 0.00 0.00 176.35 176.82 4ayk s SER 127 N 1.07 4.37 0.78 2.29 0.01 -1.26 -4.30 113.70 116.65 4ayk s SER 127 Ca 0.51 0.07 -0.11 0.00 1.31 0.00 0.00 55.95 57.74 4ayk s SER 127 Cb -0.21 -0.53 0.06 0.00 0.21 0.00 0.00 66.02 65.55 4ayk s SER 127 CO 0.24 -1.86 1.10 -1.00 0.41 0.00 0.00 173.24 172.12 4ayk s HIS 128 N -3.28 2.52 0.25 2.43 0.09 -1.26 -5.01 115.29 111.03 4ayk s HIS 128 Ca 0.65 1.57 0.08 0.00 -0.00 0.00 0.00 55.06 57.36 4ayk s HIS 128 Cb -0.07 -3.07 -0.05 0.00 -0.00 0.00 0.00 32.58 29.38 4ayk s HIS 128 CO 0.45 -1.86 -0.11 0.45 -0.00 0.00 0.00 174.74 173.67 4ayk s SER 129 N -3.32 2.81 0.00 1.40 0.15 -1.24 -5.04 113.70 108.46 4ayk s SER 129 Ca 0.62 -1.10 0.24 0.00 0.70 0.00 0.00 55.95 56.40 4ayk s SER 129 Cb -0.18 -0.18 0.26 0.00 -1.71 0.00 0.00 66.02 64.22 4ayk s SER 129 CO 0.56 -0.23 1.31 0.35 1.20 0.00 0.00 173.24 176.43 4ayk n THR 130 N -0.51 0.13 -2.73 6.45 -2.24 -1.26 -4.62 114.28 109.49 4ayk n THR 130 Ca -0.06 -0.56 -0.43 0.00 -2.27 0.00 0.00 64.05 60.73 4ayk n THR 130 Cb 0.62 1.35 -0.03 0.00 -2.10 0.00 0.00 70.33 70.17 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 -1.87 6.83 0.60 3.42 -1.08 -1.26 -4.88 116.67 118.42 4ayk s ASP 131 Ca 0.31 0.88 0.31 0.00 -0.52 0.00 0.00 52.55 53.53 4ayk s ASP 131 Cb 0.21 -2.50 1.90 0.00 -1.46 0.00 0.00 42.92 41.07 4ayk s ASP 131 CO 0.31 -0.82 2.27 0.16 0.52 0.00 0.00 175.17 177.60 4ayk h ILE 132 N 5.72 0.47 -0.00 4.11 3.07 -1.97 0.70 117.51 129.60 4ayk h ILE 132 Ca -0.22 0.00 0.00 0.00 1.55 0.00 0.00 64.86 66.19 4ayk h ILE 132 Cb 1.07 1.00 0.00 0.00 -0.27 0.00 0.00 36.82 38.62 4ayk h ILE 132 CO 0.99 0.00 -0.09 0.61 -1.05 0.00 0.00 178.15 178.62 4ayk n GLY 133 N -1.29 -0.91 3.80 0.16 0.00 -1.26 -4.84 105.19 100.85 4ayk n GLY 133 Ca -0.03 -0.26 -0.36 0.00 0.00 0.00 0.00 46.02 45.36 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 -2.41 3.34 0.36 4.61 0.00 0.24 -4.86 121.76 123.04 4ayk s ALA 134 Ca 0.31 0.28 0.04 0.00 0.00 0.00 0.00 51.96 52.59 4ayk s ALA 134 Cb 0.20 -2.93 0.69 0.00 0.00 0.00 0.00 23.12 21.08 4ayk s ALA 134 CO 0.46 0.28 1.99 -0.07 0.00 0.00 0.00 175.76 178.41 4ayk h LEU 135 N 3.31 0.60 -4.96 0.00 3.38 -1.88 -3.13 115.31 112.62 4ayk h LEU 135 Ca -0.48 -0.04 -0.22 0.00 0.09 0.00 0.00 57.88 57.24 4ayk h LEU 135 Cb 1.19 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.78 4ayk h LEU 135 CO 0.65 0.49 1.22 0.23 0.09 0.00 0.00 178.44 181.12 4ayk n MET 136 N -4.41 1.46 -2.23 1.13 2.81 -1.26 -4.88 117.12 109.74 4ayk n MET 136 Ca 0.04 -0.93 -0.42 0.00 -1.81 0.00 0.00 57.70 54.58 4ayk n MET 136 Cb 0.10 -2.08 -0.03 0.00 -0.71 0.00 0.00 33.22 30.50 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 2.72 3.28 0.16 2.03 6.14 -1.19 -3.65 117.35 126.85 4ayk s TYR 137 Ca 0.35 1.15 -0.27 0.00 0.64 0.00 0.00 57.07 58.94 4ayk s TYR 137 Cb 0.13 -3.60 0.01 0.00 0.42 0.00 0.00 41.96 38.92 4ayk s TYR 137 CO -0.02 -1.95 1.57 -1.35 0.64 0.00 0.00 175.55 174.44 4ayk h PRO 138 N 6.03 -0.26 -6.54 4.97 0.11 -1.90 -3.42 132.00 131.00 4ayk h PRO 138 Ca -0.43 0.02 -0.47 0.00 0.11 0.00 0.00 66.00 65.22 4ayk h PRO 138 Cb 1.21 0.06 0.02 0.00 0.11 0.00 0.00 31.00 32.40 4ayk h PRO 138 CO 0.81 -0.17 -0.16 -1.12 -0.21 0.00 0.00 178.00 177.14 4ayk s SER 139 N -5.13 5.24 -0.13 -2.05 0.01 -1.26 -5.07 113.70 105.31 4ayk s SER 139 Ca -0.14 -0.74 -0.25 0.00 1.31 0.00 0.00 55.95 56.13 4ayk s SER 139 Cb 0.12 -0.00 -0.02 0.00 0.21 0.00 0.00 66.02 66.33 4ayk s SER 139 CO 0.65 -1.14 0.80 -0.47 0.41 0.00 0.00 173.24 173.49 4ayk s TYR 140 N -2.57 3.47 0.10 2.43 5.04 -1.26 -5.04 117.35 119.52 4ayk s TYR 140 Ca 0.58 1.27 -0.11 0.00 -2.44 0.00 0.00 57.07 56.37 4ayk s TYR 140 Cb -0.07 -2.96 0.01 0.00 0.35 0.00 0.00 41.96 39.30 4ayk s TYR 140 CO 0.36 -0.14 0.25 0.95 -1.34 0.00 0.00 175.55 175.64 4ayk s THR 141 N 1.71 0.12 -0.28 4.34 -4.23 -1.26 -5.14 115.64 110.91 4ayk s THR 141 Ca 0.38 -1.00 -0.11 0.00 -1.18 0.00 0.00 61.69 59.79 4ayk s THR 141 Cb -0.17 -1.29 -0.05 0.00 1.34 0.00 0.00 72.50 72.33 4ayk s THR 141 CO 0.15 -0.55 0.19 0.72 -0.54 0.00 0.00 174.62 174.59 4ayk s PHE 142 N -3.84 3.23 0.00 3.99 -0.71 -1.26 -5.00 117.98 114.39 4ayk s PHE 142 Ca 0.04 0.13 0.00 0.00 -1.04 0.00 0.00 56.93 56.07 4ayk s PHE 142 Cb 0.04 -2.37 0.00 0.00 -1.21 0.00 0.00 43.02 39.48 4ayk s PHE 142 CO -0.11 -0.14 0.00 0.45 -1.34 0.00 0.00 175.22 174.08 4ayk n SER 143 N 4.99 0.00 0.00 1.98 2.88 -1.26 -5.10 113.62 117.10 4ayk n SER 143 Ca -0.14 0.13 0.00 0.00 -1.33 0.00 0.00 58.87 57.53 4ayk n SER 143 Cb 0.52 -0.23 0.00 0.00 -0.75 0.00 0.00 64.21 63.75 4ayk n SER 143 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 4ayk n GLY 144 N 2.17 -1.04 3.89 0.46 0.00 -1.26 -5.14 105.19 104.27 4ayk n GLY 144 Ca 0.00 0.67 -0.29 0.00 0.00 0.00 0.00 46.02 46.40 4ayk n GLY 144 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 4ayk s ASP 145 N 2.00 6.41 -0.53 1.61 -4.77 -1.26 -5.02 116.67 115.11 4ayk s ASP 145 Ca 0.00 1.04 -0.21 0.00 -3.30 0.00 0.00 52.55 50.08 4ayk s ASP 145 Cb 0.00 -2.29 0.05 0.00 -1.09 0.00 0.00 42.92 39.59 4ayk s ASP 145 CO 0.00 -0.47 0.78 -0.69 0.70 0.00 0.00 175.17 175.49 4ayk s VAL 146 N -2.52 4.64 0.01 2.11 1.01 -1.26 -5.01 120.40 119.39 4ayk s VAL 146 Ca 0.50 -0.14 -0.14 0.00 0.00 0.00 0.00 61.98 62.20 4ayk s VAL 146 Cb -0.10 -4.42 0.02 0.00 0.00 0.00 0.00 36.38 31.88 4ayk s VAL 146 CO 0.37 -0.96 0.29 -1.10 0.00 0.00 0.00 175.10 173.70 4ayk s GLN 147 N 3.26 0.72 0.37 2.72 -0.21 -1.26 -5.14 119.66 120.12 4ayk s GLN 147 Ca 0.22 -0.36 -0.25 0.00 0.02 0.00 0.00 55.36 54.99 4ayk s GLN 147 Cb -0.16 0.31 -0.09 0.00 1.00 0.00 0.00 33.01 34.07 4ayk s GLN 147 CO 0.15 -0.21 1.04 -0.51 -2.12 0.00 0.00 175.29 173.64 4ayk s LEU 148 N -1.69 4.21 0.48 2.90 1.43 -1.26 -4.86 118.68 119.90 4ayk s LEU 148 Ca -0.09 2.03 -0.02 0.00 -1.03 0.00 0.00 54.13 55.01 4ayk s LEU 148 Cb -0.03 -4.10 -0.01 0.00 0.03 0.00 0.00 46.19 42.08 4ayk s LEU 148 CO 0.00 -0.38 0.74 0.00 0.23 0.00 0.00 176.35 176.94 4ayk s ALA 149 N -1.60 3.59 0.25 4.21 0.00 -1.26 -4.92 121.76 122.03 4ayk s ALA 149 Ca 0.55 -0.89 -0.06 0.00 0.00 0.00 0.00 51.96 51.56 4ayk s ALA 149 Cb -0.22 -2.31 0.26 0.00 0.00 0.00 0.00 23.12 20.84 4ayk s ALA 149 CO 0.28 -0.46 1.93 0.37 0.00 0.00 0.00 175.76 177.88 4ayk h GLN 150 N 0.25 1.31 -0.94 0.00 4.15 -1.98 -1.15 115.11 116.75 4ayk h GLN 150 Ca -0.46 -0.08 0.03 0.00 0.77 0.00 0.00 58.65 58.90 4ayk h GLN 150 Cb 1.25 -0.30 -0.05 0.00 0.21 0.00 0.00 27.48 28.59 4ayk h GLN 150 CO 0.59 0.87 0.62 0.22 -1.93 0.00 0.00 178.83 179.20 4ayk h ASP 151 N 1.35 1.05 -0.21 -0.69 1.82 -1.98 0.17 116.42 117.92 4ayk h ASP 151 Ca 0.37 -0.02 -0.20 0.00 -0.39 0.00 0.00 57.03 56.79 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 0.73 -0.67 0.44 -1.61 0.00 0.00 179.24 178.05 4ayk h ASP 152 N 1.22 0.95 -0.01 2.28 3.32 -1.75 -1.38 116.42 121.05 4ayk h ASP 152 Ca 0.36 -0.59 -0.00 0.00 0.02 0.00 0.00 57.03 56.82 4ayk h ASP 152 Cb -0.05 -0.28 -0.00 0.00 0.22 0.00 0.00 39.33 39.22 4ayk h ASP 152 CO -0.10 1.37 0.00 0.40 -1.72 0.00 0.00 179.24 179.19 4ayk h ILE 153 N 0.58 1.23 -0.95 0.35 2.04 -0.81 -0.68 117.51 119.27 4ayk h ILE 153 Ca -0.02 -0.69 -0.01 0.00 1.00 0.00 0.00 64.86 65.14 4ayk h ILE 153 Cb 1.29 1.68 -0.05 0.00 -0.74 0.00 0.00 36.82 39.00 4ayk h ILE 153 CO 0.14 0.18 0.57 0.44 0.00 0.00 0.00 178.15 179.48 4ayk h ASP 154 N -0.26 1.14 0.28 1.72 3.32 -0.72 0.28 116.42 122.17 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 0.29 -0.29 0.00 0.00 0.22 0.00 0.00 39.33 39.56 4ayk h ASP 154 CO 0.00 0.87 -0.13 1.23 -1.72 0.00 0.00 179.24 179.49 4ayk h GLY 155 N 1.31 -0.39 1.07 2.75 0.00 -1.09 0.22 103.07 106.93 4ayk h GLY 155 Ca 0.34 0.15 -0.05 0.00 0.00 0.00 0.00 47.33 47.76 4ayk h GLY 155 CO -0.06 -0.14 0.27 1.19 0.00 0.00 0.00 176.54 177.79 4ayk h ILE 156 N -0.71 1.26 -0.35 2.60 6.09 -1.06 -2.29 117.51 123.06 4ayk h ILE 156 Ca -0.04 -0.88 -0.11 0.00 -1.37 0.00 0.00 64.86 62.46 4ayk h ILE 156 Cb 0.48 0.39 -0.01 0.00 0.47 0.00 0.00 36.82 38.14 4ayk h ILE 156 CO 0.06 0.35 -0.24 1.56 -3.07 0.00 0.00 178.15 176.81 4ayk h GLN 157 N 1.13 0.71 -0.76 2.19 1.08 -0.93 -2.76 115.11 115.76 4ayk h GLN 157 Ca 0.25 -0.29 0.01 0.00 -1.45 0.00 0.00 58.65 57.17 4ayk h GLN 157 Cb 0.27 -0.03 -0.04 0.00 -0.05 0.00 0.00 27.48 27.63 4ayk h GLN 157 CO -0.01 0.88 0.50 0.00 -0.95 0.00 0.00 178.83 179.25 4ayk h ALA 158 N 1.11 0.97 -0.02 3.87 0.00 -0.06 2.60 119.26 127.73 4ayk h ALA 158 Ca 0.08 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.94 4ayk h ALA 158 Cb 0.74 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 18.22 4ayk h ALA 158 CO 0.06 0.39 0.01 0.82 0.00 0.00 0.00 179.25 180.53 4ayk h ILE 159 N 1.04 1.01 0.00 0.00 2.04 -1.18 -3.38 117.51 117.04 4ayk h ILE 159 Ca 0.28 -0.03 0.00 0.00 1.00 0.00 0.00 64.86 66.11 4ayk h ILE 159 Cb -0.11 1.00 0.00 0.00 -0.74 0.00 0.00 36.82 36.96 4ayk h ILE 159 CO -0.06 0.01 -0.82 -1.22 0.00 0.00 0.00 178.15 176.06 4ayk n TYR 160 N -5.07 0.09 -1.50 1.37 4.02 -1.03 -5.13 117.16 109.90 4ayk n TYR 160 Ca -0.07 0.04 0.00 0.00 -0.01 0.00 0.00 57.90 57.86 4ayk n TYR 160 Cb 0.03 -0.46 0.00 0.00 -0.02 0.00 0.00 39.34 38.89 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 1.48 -2.01 3.84 2.72 0.00 0.87 -5.05 105.19 107.04 4ayk n GLY 161 Ca -0.11 -1.19 -0.38 0.00 0.00 0.00 0.00 46.02 44.33 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 -1.78 3.92 -0.82 1.61 0.52 -1.26 -4.25 118.95 116.88 4ayk s ARG 162 Ca 0.00 0.41 -0.25 0.00 -0.52 0.00 0.00 55.73 55.37 4ayk s ARG 162 Cb 0.00 -3.21 -0.04 0.00 0.52 0.00 0.00 34.95 32.22 4ayk s ARG 162 CO 0.00 0.69 1.92 -1.12 0.02 0.00 0.00 175.30 176.81 4ayk s SER 163 N -1.10 5.18 0.00 0.23 0.01 -1.26 -4.78 113.70 111.99 4ayk s SER 163 Ca 0.24 -0.41 0.00 0.00 1.31 0.00 0.00 55.95 57.09 4ayk s SER 163 Cb -0.17 -2.55 0.00 0.00 0.21 0.00 0.00 66.02 63.51 4ayk s SER 163 CO 0.14 -2.64 0.23 0.00 0.41 0.00 0.00 173.24 171.37 4ayk n GLN 164 N 8.95 0.16 -2.93 12.44 6.02 -1.26 -3.70 117.38 137.05 4ayk n GLN 164 Ca 0.35 0.00 -0.13 0.00 -0.01 0.00 0.00 57.00 57.21 4ayk n GLN 164 Cb 0.48 -1.42 -0.01 0.00 1.02 0.00 0.00 30.24 30.32 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 1.34 -2.10 -4.04 1.08 5.03 -1.26 -5.06 115.26 110.26 4ayk n ASN 165 Ca 0.00 -2.95 -0.42 0.00 0.87 0.00 0.00 54.58 52.07 4ayk n ASN 165 Cb 0.08 0.99 0.00 0.00 -1.02 0.00 0.00 39.78 39.83 4ayk n ASN 165 CO 0.00 0.00 0.00 -0.81 -1.83 0.00 0.00 177.26 174.62 4ayk n PRO 166 N 2.11 2.99 -3.14 3.52 -0.04 -1.24 -4.95 135.00 134.24 4ayk n PRO 166 Ca 0.17 -2.86 -0.40 0.00 -0.04 0.00 0.00 63.50 60.36 4ayk n PRO 166 Cb 0.57 -3.36 -0.06 0.00 -0.04 0.00 0.00 33.50 30.61 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 3.51 5.02 0.60 0.52 1.01 -1.26 -5.05 120.40 124.76 4ayk s VAL 167 Ca 0.49 1.11 -0.18 0.00 0.00 0.00 0.00 61.98 63.40 4ayk s VAL 167 Cb 0.10 -3.92 -0.03 0.00 0.00 0.00 0.00 36.38 32.54 4ayk s VAL 167 CO -0.03 0.09 1.16 -1.10 0.00 0.00 0.00 175.10 175.22 4ayk s GLN 168 N 2.13 2.98 0.00 2.72 1.11 -1.26 -5.13 119.66 122.20 4ayk s GLN 168 Ca 0.26 1.66 0.00 0.00 0.01 0.00 0.00 55.36 57.29 4ayk s GLN 168 Cb -0.16 -1.95 0.00 0.00 -1.01 0.00 0.00 33.01 29.89 4ayk s GLN 168 CO 0.09 -1.16 0.15 -2.30 0.01 0.00 0.00 175.29 172.09