#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 4ayk n LEU 2 N 0.00 0.00 -4.85 6.55 4.77 -1.26 -4.69 117.00 117.52 4ayk n LEU 2 Ca 0.00 0.38 -0.37 0.00 -0.03 0.00 0.00 56.01 55.99 4ayk n LEU 2 Cb 0.00 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.03 4ayk n LEU 2 CO 0.00 0.00 -0.12 0.42 -1.33 0.00 0.00 177.39 176.36 4ayk s THR 3 N -0.76 5.41 0.39 -5.08 -4.23 -1.26 -5.08 115.64 105.04 4ayk s THR 3 Ca 0.00 0.33 -0.24 0.00 -1.18 0.00 0.00 61.69 60.60 4ayk s THR 3 Cb 0.00 -3.47 -0.09 0.00 1.34 0.00 0.00 72.50 70.28 4ayk s THR 3 CO 0.00 0.59 1.03 -0.70 -0.54 0.00 0.00 174.62 175.00 4ayk s GLU 4 N -0.86 4.22 3.89 3.99 2.12 -1.26 -4.77 118.70 126.02 4ayk s GLU 4 Ca 0.16 1.48 0.00 0.00 0.36 0.00 0.00 54.97 56.97 4ayk s GLU 4 Cb -0.13 -2.56 0.00 0.00 0.26 0.00 0.00 34.13 31.70 4ayk s GLU 4 CO 0.05 -0.09 0.00 0.41 -0.54 0.00 0.00 175.26 175.10 4ayk n GLY 5 N 0.32 0.50 3.82 -1.50 0.00 -1.26 -4.77 105.19 102.31 4ayk n GLY 5 Ca 0.05 -0.88 -0.33 0.00 0.00 0.00 0.00 46.02 44.85 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 6.95 0.83 1.61 0.02 -1.26 -5.03 114.94 114.06 4ayk s ASN 6 Ca 0.00 1.61 -0.12 0.00 -1.02 0.00 0.00 52.86 53.33 4ayk s ASN 6 Cb 0.00 -2.51 0.10 0.00 0.02 0.00 0.00 41.25 38.86 4ayk s ASN 6 CO 0.00 -0.28 1.18 -2.16 0.02 0.00 0.00 177.10 175.86 4ayk s PRO 7 N -2.98 1.54 0.13 -0.60 0.04 -1.26 -5.00 135.00 126.87 4ayk s PRO 7 Ca 0.58 1.66 -0.08 0.00 0.04 0.00 0.00 61.00 63.20 4ayk s PRO 7 Cb -0.11 -1.78 -0.01 0.00 0.04 0.00 0.00 34.50 32.65 4ayk s PRO 7 CO 0.15 -2.26 0.21 1.03 0.04 0.00 0.00 177.00 176.17 4ayk s ARG 8 N -4.32 0.99 -0.23 4.56 0.52 -1.26 -4.92 118.95 114.29 4ayk s ARG 8 Ca 0.70 -1.12 -0.27 0.00 -0.52 0.00 0.00 55.73 54.52 4ayk s ARG 8 Cb -0.26 0.34 0.00 0.00 0.52 0.00 0.00 34.95 35.55 4ayk s ARG 8 CO 0.52 -0.33 0.94 -1.58 0.02 0.00 0.00 175.30 174.87 4ayk s TRP 9 N -3.93 3.34 -0.75 -0.53 0.52 -1.26 -4.90 118.94 111.43 4ayk s TRP 9 Ca 0.13 1.32 0.26 0.00 0.02 0.00 0.00 56.10 57.82 4ayk s TRP 9 Cb 0.05 -3.16 0.67 0.00 -1.15 0.00 0.00 33.47 29.87 4ayk s TRP 9 CO -0.04 -0.42 1.60 0.39 0.02 0.00 0.00 176.95 178.49 4ayk n GLU 10 N 6.07 0.22 -2.92 4.98 1.02 -1.26 -4.84 120.64 123.90 4ayk n GLU 10 Ca 0.09 0.13 -0.33 0.00 -0.02 0.00 0.00 57.16 57.02 4ayk n GLU 10 Cb 0.47 -1.70 -0.07 0.00 -0.02 0.00 0.00 31.44 30.12 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 -3.10 4.20 0.00 3.49 -0.21 -1.26 -4.95 119.66 117.82 4ayk s GLN 11 Ca 0.09 0.99 0.25 0.00 0.02 0.00 0.00 55.36 56.72 4ayk s GLN 11 Cb 0.14 -2.34 0.43 0.00 1.00 0.00 0.00 33.01 32.23 4ayk s GLN 11 CO 0.64 0.07 1.37 0.25 -2.12 0.00 0.00 175.29 175.50 4ayk n THR 12 N -0.38 0.00 -4.88 -0.19 -2.24 -1.26 -4.84 114.28 100.48 4ayk n THR 12 Ca 0.05 -0.23 -0.27 0.00 -2.27 0.00 0.00 64.05 61.33 4ayk n THR 12 Cb 0.53 0.86 -0.16 0.00 -2.10 0.00 0.00 70.33 69.46 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 -2.39 1.81 0.09 4.78 3.76 -1.26 -2.51 115.29 119.56 4ayk s HIS 13 Ca 0.24 -0.55 0.06 0.00 -0.15 0.00 0.00 55.06 54.65 4ayk s HIS 13 Cb 0.19 -1.22 -0.03 0.00 1.11 0.00 0.00 32.58 32.63 4ayk s HIS 13 CO 0.50 -0.20 -0.15 -0.51 -0.85 0.00 0.00 174.74 173.54 4ayk s LEU 14 N 0.09 2.32 0.21 0.89 1.43 -0.80 -4.99 118.68 117.83 4ayk s LEU 14 Ca -0.06 -0.68 0.11 0.00 -1.03 0.00 0.00 54.13 52.47 4ayk s LEU 14 Cb -0.12 -0.55 -0.05 0.00 0.03 0.00 0.00 46.19 45.50 4ayk s LEU 14 CO 0.03 -0.09 -0.22 0.42 0.23 0.00 0.00 176.35 176.72 4ayk s THR 15 N -1.55 2.28 0.07 5.49 -4.23 -1.26 -2.17 115.64 114.28 4ayk s THR 15 Ca 0.02 -2.11 -0.07 0.00 -1.18 0.00 0.00 61.69 58.35 4ayk s THR 15 Cb -0.08 -2.12 -0.01 0.00 1.34 0.00 0.00 72.50 71.63 4ayk s THR 15 CO 0.03 -0.23 0.13 -0.72 -0.54 0.00 0.00 174.62 173.29 4ayk s TYR 16 N -1.97 0.23 -0.15 3.99 -0.85 -1.02 -2.21 117.35 115.37 4ayk s TYR 16 Ca 0.22 -0.66 -0.10 0.00 -0.52 0.00 0.00 57.07 56.01 4ayk s TYR 16 Cb -0.07 -0.14 0.05 0.00 0.38 0.00 0.00 41.96 42.19 4ayk s TYR 16 CO 0.10 -0.49 0.39 0.50 -1.52 0.00 0.00 175.55 174.53 4ayk s ARG 17 N -3.68 0.40 -0.26 -3.49 3.52 -1.05 -2.30 118.95 112.08 4ayk s ARG 17 Ca 0.04 0.67 -0.19 0.00 -0.13 0.00 0.00 55.73 56.12 4ayk s ARG 17 Cb 0.05 0.06 -0.02 0.00 -1.56 0.00 0.00 34.95 33.47 4ayk s ARG 17 CO -0.10 -0.12 0.58 0.42 -0.81 0.00 0.00 175.30 175.27 4ayk s ILE 18 N 0.93 5.02 0.18 4.11 1.01 -1.26 -2.26 121.20 128.94 4ayk s ILE 18 Ca -0.06 1.02 -0.09 0.00 0.00 0.00 0.00 60.65 61.52 4ayk s ILE 18 Cb -0.06 -3.89 0.07 0.00 0.01 0.00 0.00 42.46 38.59 4ayk s ILE 18 CO -0.07 0.05 1.65 -0.08 0.00 0.00 0.00 174.94 176.49 4ayk h GLU 19 N 7.94 1.08 -1.91 2.79 4.81 -1.63 -3.46 114.58 124.21 4ayk h GLU 19 Ca -0.28 -0.33 -0.03 0.00 -0.13 0.00 0.00 59.36 58.59 4ayk h GLU 19 Cb 1.13 -0.10 -0.20 0.00 0.63 0.00 0.00 28.75 30.21 4ayk h GLU 19 CO 0.75 1.04 0.26 1.21 -0.73 0.00 0.00 179.01 181.54 4ayk s ASN 20 N -6.55 -0.60 -0.12 1.04 2.47 -1.26 -5.10 114.94 104.82 4ayk s ASN 20 Ca -0.12 0.68 -0.14 0.00 0.42 0.00 0.00 52.86 53.70 4ayk s ASN 20 Cb 0.14 0.52 -0.05 0.00 -1.45 0.00 0.00 41.25 40.41 4ayk s ASN 20 CO 0.86 -0.54 0.33 -0.31 -3.72 0.00 0.00 177.10 173.72 4ayk s TYR 21 N -1.11 3.53 0.38 0.43 2.02 -1.26 -4.58 117.35 116.76 4ayk s TYR 21 Ca -0.09 0.72 -0.26 0.00 -0.37 0.00 0.00 57.07 57.07 4ayk s TYR 21 Cb -0.00 -2.33 -0.09 0.00 -0.40 0.00 0.00 41.96 39.14 4ayk s TYR 21 CO 0.08 0.35 1.16 -0.08 -1.57 0.00 0.00 175.55 175.49 4ayk s THR 22 N 0.06 3.20 -1.01 -0.71 -1.32 -1.26 -4.90 115.64 109.71 4ayk s THR 22 Ca 0.19 1.05 0.08 0.00 -1.21 0.00 0.00 61.69 61.80 4ayk s THR 22 Cb -0.14 -3.60 0.07 0.00 -1.51 0.00 0.00 72.50 67.32 4ayk s THR 22 CO 0.07 0.13 1.26 -0.81 -2.21 0.00 0.00 174.62 173.06 4ayk n PRO 23 N 0.30 0.00 -0.38 7.08 -0.04 -1.26 -2.86 135.00 137.84 4ayk n PRO 23 Ca 0.03 0.35 -0.02 0.00 -0.04 0.00 0.00 63.50 63.83 4ayk n PRO 23 Cb 0.46 -1.50 0.11 0.00 -0.04 0.00 0.00 33.50 32.53 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 1.16 -4.83 3.54 3.32 -1.96 -3.43 116.42 114.21 4ayk h ASP 24 Ca 0.00 -0.03 -0.23 0.00 0.02 0.00 0.00 57.03 56.79 4ayk h ASP 24 Cb 0.14 -0.29 -0.21 0.00 0.22 0.00 0.00 39.33 39.19 4ayk h ASP 24 CO 0.00 0.84 -0.72 -0.76 -1.72 0.00 0.00 179.24 176.88 4ayk s LEU 25 N -10.12 2.24 1.43 1.55 1.43 -1.14 -5.00 118.68 109.08 4ayk s LEU 25 Ca -0.13 -0.51 -0.24 0.00 -1.03 0.00 0.00 54.13 52.22 4ayk s LEU 25 Cb 0.18 -0.05 0.37 0.00 0.03 0.00 0.00 46.19 46.72 4ayk s LEU 25 CO 0.82 -0.24 0.95 -2.16 0.23 0.00 0.00 176.35 175.95 4ayk s PRO 26 N -1.48 -2.99 0.00 1.29 0.04 -1.26 -4.57 135.00 126.03 4ayk s PRO 26 Ca -0.12 0.01 0.08 0.00 0.04 0.00 0.00 61.00 61.01 4ayk s PRO 26 Cb -0.10 -1.38 -0.23 0.00 0.04 0.00 0.00 34.50 32.83 4ayk s PRO 26 CO -0.00 -4.89 0.84 0.07 0.04 0.00 0.00 177.00 173.06 4ayk h ARG 27 N -3.42 0.05 -0.21 4.56 0.11 -1.96 -3.09 114.38 110.42 4ayk h ARG 27 Ca -0.41 -0.09 0.02 0.00 0.10 0.00 0.00 59.98 59.60 4ayk h ARG 27 Cb 1.33 0.03 -0.02 0.00 1.11 0.00 0.00 29.97 32.42 4ayk h ARG 27 CO 0.25 0.76 0.07 0.00 0.10 0.00 0.00 179.97 181.15 4ayk h ALA 28 N 0.87 0.23 -0.35 0.08 0.00 -1.98 0.74 119.26 118.84 4ayk h ALA 28 Ca -0.21 0.03 -0.17 0.00 0.00 0.00 0.00 54.91 54.55 4ayk h ALA 28 Cb 1.95 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 19.75 4ayk h ALA 28 CO 0.11 -0.36 -0.45 -0.44 0.00 0.00 0.00 179.25 178.11 4ayk h ASP 29 N 0.16 1.00 -0.32 0.00 3.32 -1.95 -2.57 116.42 116.06 4ayk h ASP 29 Ca 0.09 -0.49 -0.16 0.00 0.02 0.00 0.00 57.03 56.49 4ayk h ASP 29 Cb 0.06 -0.28 -0.00 0.00 0.22 0.00 0.00 39.33 39.33 4ayk h ASP 29 CO -0.10 1.29 -0.42 0.58 -1.72 0.00 0.00 179.24 178.87 4ayk h VAL 30 N 0.73 1.28 -0.96 -1.35 2.07 -1.40 -2.74 116.25 113.87 4ayk h VAL 30 Ca 0.04 -1.60 0.01 0.00 0.82 0.00 0.00 66.70 65.97 4ayk h VAL 30 Cb 1.05 1.55 -0.05 0.00 -1.52 0.00 0.00 31.29 32.33 4ayk h VAL 30 CO 0.11 0.52 0.64 -0.78 0.02 0.00 0.00 177.57 178.08 4ayk h ASP 31 N 0.63 1.11 -0.49 0.57 1.82 0.50 -1.23 116.42 119.32 4ayk h ASP 31 Ca 0.04 -0.03 0.00 0.00 -0.39 0.00 0.00 57.03 56.65 4ayk h ASP 31 Cb 1.02 -0.28 -0.02 0.00 0.68 0.00 0.00 39.33 40.73 4ayk h ASP 31 CO 0.10 0.80 0.31 -0.74 -1.61 0.00 0.00 179.24 178.11 4ayk h HIS 32 N 1.30 0.63 -0.42 0.28 2.76 -1.34 0.40 115.15 118.76 4ayk h HIS 32 Ca 0.35 0.01 0.00 0.00 -2.20 0.00 0.00 60.37 58.54 4ayk h HIS 32 Cb -0.15 -0.21 -0.02 0.00 1.55 0.00 0.00 27.41 28.58 4ayk h HIS 32 CO -0.00 0.41 0.28 0.00 -1.30 0.00 0.00 177.93 177.32 4ayk h ALA 33 N 1.16 0.54 -0.35 5.26 0.00 -1.05 0.67 119.26 125.49 4ayk h ALA 33 Ca 0.18 -0.03 -0.17 0.00 0.00 0.00 0.00 54.91 54.89 4ayk h ALA 33 Cb -0.05 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.56 4ayk h ALA 33 CO -0.04 -0.01 -0.44 0.82 0.00 0.00 0.00 179.25 179.58 4ayk h ILE 34 N 0.57 1.27 -0.38 0.00 1.08 -0.87 -2.55 117.51 116.64 4ayk h ILE 34 Ca 0.16 -1.62 -0.16 0.00 -0.39 0.00 0.00 64.86 62.85 4ayk h ILE 34 Cb -0.07 1.47 -0.01 0.00 -3.07 0.00 0.00 36.82 35.15 4ayk h ILE 34 CO -0.03 0.54 -0.40 -0.08 -0.69 0.00 0.00 178.15 177.48 4ayk h GLU 35 N 0.73 0.93 -0.89 2.37 4.57 0.09 -2.84 114.58 119.54 4ayk h GLU 35 Ca 0.04 -0.50 -0.02 0.00 -1.18 0.00 0.00 59.36 57.70 4ayk h GLU 35 Cb 1.04 0.02 -0.04 0.00 -0.16 0.00 0.00 28.75 29.61 4ayk h GLU 35 CO 0.10 1.16 0.47 -0.22 -1.18 0.00 0.00 179.01 179.34 4ayk h LYS 36 N 0.75 1.26 -0.54 1.92 3.64 0.39 -2.38 116.57 121.61 4ayk h LYS 36 Ca 0.06 -0.16 -0.08 0.00 -1.27 0.00 0.00 60.65 59.20 4ayk h LYS 36 Cb 1.00 -0.24 -0.02 0.00 -0.41 0.00 0.00 32.23 32.55 4ayk h LYS 36 CO 0.10 0.93 0.04 0.00 -2.27 0.00 0.00 179.45 178.25 4ayk h ALA 37 N 1.26 0.72 -0.96 5.00 0.00 -1.37 -2.49 119.26 121.42 4ayk h ALA 37 Ca 0.31 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.95 4ayk h ALA 37 Cb 0.05 -0.20 -0.05 0.00 0.00 0.00 0.00 17.79 17.60 4ayk h ALA 37 CO -0.05 0.51 0.61 0.74 0.00 0.00 0.00 179.25 181.06 4ayk h PHE 38 N 0.81 1.24 -0.86 0.00 0.04 -1.25 -1.99 116.94 114.92 4ayk h PHE 38 Ca 0.16 0.01 0.01 0.00 2.80 0.00 0.00 57.97 60.95 4ayk h PHE 38 Cb 0.48 -0.41 -0.04 0.00 2.20 0.00 0.00 35.95 38.17 4ayk h PHE 38 CO 0.04 0.80 0.57 1.96 -0.60 0.00 0.00 178.31 181.08 4ayk h GLN 39 N 1.31 1.13 -0.86 1.51 1.08 -1.09 0.32 115.11 118.52 4ayk h GLN 39 Ca 0.35 -0.07 0.00 0.00 -1.45 0.00 0.00 58.65 57.48 4ayk h GLN 39 Cb -0.10 -0.26 -0.04 0.00 -0.05 0.00 0.00 27.48 27.03 4ayk h GLN 39 CO -0.07 0.75 0.55 -0.07 -0.95 0.00 0.00 178.83 179.04 4ayk h LEU 40 N 1.17 1.00 -0.06 1.46 3.38 -0.94 0.38 115.31 121.71 4ayk h LEU 40 Ca 0.32 -0.04 -0.20 0.00 0.09 0.00 0.00 57.88 58.05 4ayk h LEU 40 Cb -0.13 -0.25 0.01 0.00 0.09 0.00 0.00 40.66 40.38 4ayk h LEU 40 CO -0.07 0.74 -0.73 -0.50 0.09 0.00 0.00 178.44 177.98 4ayk h TRP 41 N 1.17 0.85 -0.22 1.13 4.06 -1.12 -3.25 115.95 118.56 4ayk h TRP 41 Ca 0.31 -0.42 -0.12 0.00 2.06 0.00 0.00 58.89 60.73 4ayk h TRP 41 Cb -0.10 -0.11 -0.01 0.00 -1.00 0.00 0.00 29.16 27.93 4ayk h TRP 41 CO -0.01 1.24 -0.36 1.03 -3.56 0.00 0.00 178.44 176.78 4ayk h SER 42 N 0.22 0.49 -0.28 -3.49 0.87 -0.73 -2.51 113.55 108.12 4ayk h SER 42 Ca -0.07 -0.20 0.02 0.00 -1.23 0.00 0.00 61.79 60.31 4ayk h SER 42 Cb 1.39 -0.14 -0.01 0.00 -0.44 0.00 0.00 62.40 63.20 4ayk h SER 42 CO 0.15 0.81 0.19 0.78 -0.53 0.00 0.00 176.83 178.23 4ayk h ASN 43 N 0.40 0.25 -0.37 6.23 2.35 -0.27 -2.41 115.58 121.76 4ayk h ASN 43 Ca 0.04 -0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.79 4ayk h ASN 43 Cb 0.81 -0.06 0.00 0.00 0.05 0.00 0.00 38.32 39.12 4ayk h ASN 43 CO 0.07 0.18 0.00 1.33 -1.65 0.00 0.00 177.43 177.35 4ayk n VAL 44 N -4.49 1.23 -3.91 2.81 0.24 -1.15 -4.99 118.33 108.08 4ayk n VAL 44 Ca 0.02 -1.14 -0.10 0.00 -2.04 0.00 0.00 64.34 61.07 4ayk n VAL 44 Cb 0.14 0.37 -0.10 0.00 -1.47 0.00 0.00 33.84 32.77 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 -1.31 0.09 -2.00 3.34 -4.23 -0.91 -4.23 115.64 106.38 4ayk s THR 45 Ca 0.29 -0.72 0.13 0.00 -1.18 0.00 0.00 61.69 60.21 4ayk s THR 45 Cb 0.17 -0.36 0.38 0.00 1.34 0.00 0.00 72.50 74.04 4ayk s THR 45 CO 0.16 -0.39 1.30 -0.81 -0.54 0.00 0.00 174.62 174.33 4ayk n PRO 46 N 1.61 0.68 -1.58 3.99 -0.04 -1.26 -4.62 135.00 133.78 4ayk n PRO 46 Ca -0.22 0.00 -0.32 0.00 -0.04 0.00 0.00 63.50 62.92 4ayk n PRO 46 Cb 0.56 -1.31 0.06 0.00 -0.04 0.00 0.00 33.50 32.77 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 -1.61 3.22 0.07 1.53 1.43 -1.26 -4.99 118.68 117.07 4ayk s LEU 47 Ca 0.20 1.82 0.04 0.00 -1.03 0.00 0.00 54.13 55.16 4ayk s LEU 47 Cb 0.09 -4.52 -0.03 0.00 0.03 0.00 0.00 46.19 41.76 4ayk s LEU 47 CO 0.15 -1.66 -0.10 0.42 0.23 0.00 0.00 176.35 175.39 4ayk s THR 48 N -2.72 0.84 0.12 5.49 -4.23 -1.05 -4.70 115.64 109.40 4ayk s THR 48 Ca 0.62 -1.34 0.06 0.00 -1.18 0.00 0.00 61.69 59.86 4ayk s THR 48 Cb -0.17 -1.00 -0.04 0.00 1.34 0.00 0.00 72.50 72.63 4ayk s THR 48 CO 0.49 -0.39 -0.14 -0.36 -0.54 0.00 0.00 174.62 173.67 4ayk s PHE 49 N -1.71 1.42 -0.20 3.99 0.08 -1.26 -1.91 117.98 118.39 4ayk s PHE 49 Ca -0.02 -0.55 -0.12 0.00 0.12 0.00 0.00 56.93 56.36 4ayk s PHE 49 Cb -0.08 -0.74 0.06 0.00 -0.57 0.00 0.00 43.02 41.70 4ayk s PHE 49 CO 0.01 0.15 0.49 0.99 -0.10 0.00 0.00 175.22 176.76 4ayk s THR 50 N -2.08 -0.02 0.15 0.64 2.01 -0.92 -4.97 115.64 110.46 4ayk s THR 50 Ca 0.09 0.06 -0.30 0.00 0.31 0.00 0.00 61.69 61.84 4ayk s THR 50 Cb -0.05 -0.72 -0.07 0.00 0.01 0.00 0.00 72.50 71.67 4ayk s THR 50 CO 0.03 0.02 1.03 -0.75 -0.69 0.00 0.00 174.62 174.26 4ayk s LYS 51 N 1.33 4.66 -0.10 4.92 2.20 -1.26 -2.43 119.74 129.06 4ayk s LYS 51 Ca -0.09 1.58 0.04 0.00 -0.36 0.00 0.00 55.97 57.15 4ayk s LYS 51 Cb -0.07 -3.32 -0.00 0.00 -1.51 0.00 0.00 37.83 32.93 4ayk s LYS 51 CO -0.13 0.17 -0.24 0.14 -0.36 0.00 0.00 175.35 174.93 4ayk s VAL 52 N -0.20 2.04 -1.71 4.02 -7.23 -0.97 -4.92 120.40 111.42 4ayk s VAL 52 Ca 0.48 -1.01 0.21 0.00 -1.81 0.00 0.00 61.98 59.84 4ayk s VAL 52 Cb -0.26 -1.76 0.66 0.00 0.56 0.00 0.00 36.38 35.57 4ayk s VAL 52 CO 0.32 0.56 1.55 -0.24 -0.31 0.00 0.00 175.10 176.98 4ayk n SER 53 N 3.50 4.11 -3.91 4.85 2.88 -1.26 -4.69 113.62 119.09 4ayk n SER 53 Ca -0.19 -2.15 -0.10 0.00 -1.33 0.00 0.00 58.87 55.10 4ayk n SER 53 Cb 0.53 -0.51 -0.09 0.00 -0.75 0.00 0.00 64.21 63.38 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 -1.32 0.57 0.42 -1.46 0.41 -1.26 -5.11 118.70 110.94 4ayk s GLU 54 Ca 0.49 -0.67 0.00 0.00 -0.41 0.00 0.00 54.97 54.38 4ayk s GLU 54 Cb 0.27 0.23 0.00 0.00 -1.78 0.00 0.00 34.13 32.85 4ayk s GLU 54 CO 0.30 -0.14 0.00 0.41 -0.49 0.00 0.00 175.26 175.33 4ayk n GLY 55 N 0.92 -2.65 3.81 -1.39 0.00 -1.26 -4.80 105.19 99.83 4ayk n GLY 55 Ca -0.20 -1.17 -0.35 0.00 0.00 0.00 0.00 46.02 44.31 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 -3.21 4.29 0.24 1.61 -0.21 -1.26 -5.05 119.66 116.08 4ayk s GLN 56 Ca 0.00 1.05 0.05 0.00 0.02 0.00 0.00 55.36 56.49 4ayk s GLN 56 Cb 0.00 -2.52 -0.03 0.00 1.00 0.00 0.00 33.01 31.46 4ayk s GLN 56 CO 0.00 0.16 0.32 0.00 -2.12 0.00 0.00 175.29 173.66 4ayk s ALA 57 N -1.87 3.85 0.25 6.09 0.00 -1.26 -5.01 121.76 123.81 4ayk s ALA 57 Ca 0.54 -1.27 -0.06 0.00 0.00 0.00 0.00 51.96 51.16 4ayk s ALA 57 Cb -0.13 -1.63 0.25 0.00 0.00 0.00 0.00 23.12 21.61 4ayk s ALA 57 CO 0.18 0.24 1.92 -0.44 0.00 0.00 0.00 175.76 177.67 4ayk h ASP 58 N 1.24 1.15 -3.14 0.00 3.32 -1.91 -3.39 116.42 113.69 4ayk h ASP 58 Ca -0.51 -0.04 -0.67 0.00 0.02 0.00 0.00 57.03 55.83 4ayk h ASP 58 Cb 1.23 -0.29 -0.35 0.00 0.22 0.00 0.00 39.33 40.15 4ayk h ASP 58 CO 0.61 0.84 -0.84 -0.63 -1.72 0.00 0.00 179.24 177.50 4ayk s ILE 59 N -6.09 2.17 -0.15 0.35 1.01 -0.94 -4.67 121.20 112.88 4ayk s ILE 59 Ca -0.13 -0.95 -0.06 0.00 0.00 0.00 0.00 60.65 59.51 4ayk s ILE 59 Cb 0.18 -1.94 -0.04 0.00 0.01 0.00 0.00 42.46 40.67 4ayk s ILE 59 CO 0.82 0.49 0.07 -0.04 0.00 0.00 0.00 174.94 176.28 4ayk s MET 60 N 1.29 3.65 -0.13 2.79 -1.94 -1.25 -2.54 119.30 121.18 4ayk s MET 60 Ca 0.04 -0.31 0.03 0.00 -1.71 0.00 0.00 55.69 53.74 4ayk s MET 60 Cb -0.14 -3.12 0.01 0.00 2.01 0.00 0.00 34.83 33.59 4ayk s MET 60 CO -0.12 0.48 -0.22 0.42 -0.01 0.00 0.00 175.02 175.57 4ayk s ILE 61 N -0.21 2.11 0.06 2.53 1.01 -0.96 -1.28 121.20 124.46 4ayk s ILE 61 Ca 0.08 -0.98 -0.13 0.00 0.00 0.00 0.00 60.65 59.62 4ayk s ILE 61 Cb -0.12 -1.83 0.02 0.00 0.01 0.00 0.00 42.46 40.54 4ayk s ILE 61 CO 0.01 0.55 0.29 -0.94 0.00 0.00 0.00 174.94 174.85 4ayk s SER 62 N 0.64 -0.09 -0.09 3.58 1.04 -1.09 -1.37 113.70 116.33 4ayk s SER 62 Ca -0.11 -0.28 -0.04 0.00 0.48 0.00 0.00 55.95 56.00 4ayk s SER 62 Cb -0.16 0.36 -0.04 0.00 0.10 0.00 0.00 66.02 66.28 4ayk s SER 62 CO 0.02 -0.65 0.08 -0.36 0.98 0.00 0.00 173.24 173.31 4ayk s PHE 63 N -2.86 3.40 0.21 5.02 0.40 -1.26 -2.19 117.98 120.70 4ayk s PHE 63 Ca -0.03 0.36 -0.01 0.00 -0.60 0.00 0.00 56.93 56.66 4ayk s PHE 63 Cb 0.00 -1.86 -0.04 0.00 0.51 0.00 0.00 43.02 41.63 4ayk s PHE 63 CO -0.05 0.61 0.12 0.14 0.70 0.00 0.00 175.22 176.74 4ayk s VAL 64 N -1.00 0.11 0.03 -0.44 -7.23 -1.08 -4.91 120.40 105.87 4ayk s VAL 64 Ca 0.16 -2.00 0.01 0.00 -1.81 0.00 0.00 61.98 58.34 4ayk s VAL 64 Cb -0.12 -2.50 -0.02 0.00 0.56 0.00 0.00 36.38 34.30 4ayk s VAL 64 CO 0.05 -0.02 -0.05 -0.13 -0.31 0.00 0.00 175.10 174.64 4ayk s ARG 65 N -4.13 0.40 1.39 4.82 0.52 -1.26 -2.53 118.95 118.15 4ayk s ARG 65 Ca 0.38 -0.64 0.00 0.00 -0.52 0.00 0.00 55.73 54.95 4ayk s ARG 65 Cb 0.07 -0.09 0.00 0.00 0.52 0.00 0.00 34.95 35.45 4ayk s ARG 65 CO 0.12 0.00 0.00 0.41 0.02 0.00 0.00 175.30 175.85 4ayk n GLY 66 N 1.64 1.20 3.71 -3.53 0.00 -1.26 -4.36 105.19 102.59 4ayk n GLY 66 Ca -0.23 -0.49 -0.42 0.00 0.00 0.00 0.00 46.02 44.88 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 6.87 -0.37 1.61 -1.08 -1.26 -4.25 116.67 114.19 4ayk s ASP 67 Ca 0.00 2.27 0.14 0.00 -0.52 0.00 0.00 52.55 54.43 4ayk s ASP 67 Cb 0.00 -2.58 0.39 0.00 -1.46 0.00 0.00 42.92 39.27 4ayk s ASP 67 CO 0.00 -0.62 0.84 0.00 0.52 0.00 0.00 175.17 175.91 4ayk n HIS 68 N 3.95 0.91 -3.57 -5.34 1.44 -1.26 -4.95 115.22 106.40 4ayk n HIS 68 Ca 0.11 -3.41 -0.20 0.00 -2.01 0.00 0.00 57.72 52.21 4ayk n HIS 68 Cb 0.43 -0.39 0.06 0.00 0.12 0.00 0.00 29.99 30.21 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 0.09 -5.96 -3.99 -1.40 1.74 -1.26 -5.00 116.66 100.87 4ayk n ARG 69 Ca 0.20 0.74 -0.08 0.00 -0.77 0.00 0.00 57.85 57.94 4ayk n ARG 69 Cb 0.70 -5.57 -0.09 0.00 -1.02 0.00 0.00 32.46 26.48 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 -4.25 0.32 0.00 0.55 1.01 -1.26 -5.03 116.67 108.00 4ayk s ASP 70 Ca 0.07 -0.78 0.15 0.00 0.71 0.00 0.00 52.55 52.69 4ayk s ASP 70 Cb -0.03 0.23 0.45 0.00 1.01 0.00 0.00 42.92 44.58 4ayk s ASP 70 CO 0.77 -0.59 1.36 0.59 0.21 0.00 0.00 175.17 177.50 4ayk n ASN 71 N 0.31 2.12 -3.32 0.27 5.03 -1.26 -4.43 115.26 113.96 4ayk n ASN 71 Ca -0.16 -1.94 -0.25 0.00 0.87 0.00 0.00 54.58 53.10 4ayk n ASN 71 Cb 0.60 -0.24 -0.08 0.00 -1.02 0.00 0.00 39.78 39.05 4ayk n ASN 71 CO 0.00 0.00 0.00 -1.20 -1.83 0.00 0.00 177.26 174.23 4ayk n SER 72 N 0.64 0.99 -4.79 6.41 7.64 -1.26 -5.12 113.62 118.14 4ayk n SER 72 Ca 0.14 -2.83 -0.35 0.00 1.01 0.00 0.00 58.87 56.85 4ayk n SER 72 Cb 0.35 -0.64 -0.04 0.00 -1.01 0.00 0.00 64.21 62.88 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 -1.25 3.93 0.39 1.43 0.04 -1.26 -5.03 135.00 133.26 4ayk s PRO 73 Ca 0.35 1.43 -0.24 0.00 0.04 0.00 0.00 61.00 62.58 4ayk s PRO 73 Cb 0.13 -2.26 -0.09 0.00 0.04 0.00 0.00 34.50 32.31 4ayk s PRO 73 CO -0.11 -0.33 1.02 -0.06 0.04 0.00 0.00 177.00 177.57 4ayk s PHE 74 N -1.85 3.33 -0.45 0.56 0.40 -1.26 -5.01 117.98 113.70 4ayk s PHE 74 Ca 0.64 1.66 0.06 0.00 -0.60 0.00 0.00 56.93 58.69 4ayk s PHE 74 Cb -0.19 -3.07 0.21 0.00 0.51 0.00 0.00 43.02 40.48 4ayk s PHE 74 CO 0.23 -0.45 0.46 -3.47 0.70 0.00 0.00 175.22 172.68 4ayk n ASP 75 N -0.04 0.44 0.00 1.36 -0.08 -1.26 -4.71 116.55 112.26 4ayk n ASP 75 Ca 0.05 -2.66 0.00 0.00 -1.51 0.00 0.00 54.79 50.67 4ayk n ASP 75 Cb 0.50 -0.61 0.00 0.00 2.34 0.00 0.00 41.12 43.35 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 2.03 -3.14 0.00 0.27 0.00 -1.26 -4.17 105.19 98.92 4ayk n GLY 76 Ca 0.26 -1.81 0.02 0.00 0.00 0.00 0.00 46.02 44.48 4ayk n GLY 76 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 4ayk n PRO 77 N -0.45 0.05 -2.39 1.61 -0.04 -1.26 -4.66 135.00 127.86 4ayk n PRO 77 Ca 0.00 0.28 -0.25 0.00 -0.04 0.00 0.00 63.50 63.49 4ayk n PRO 77 Cb 0.00 -1.50 0.11 0.00 -0.04 0.00 0.00 33.50 32.07 4ayk n PRO 77 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 4ayk s GLY 78 N -2.64 1.76 0.00 0.55 0.00 -1.26 -4.96 107.32 100.77 4ayk s GLY 78 Ca 0.03 -1.42 0.00 0.00 0.00 0.00 0.00 44.72 43.34 4ayk s GLY 78 CO 0.06 -0.88 0.00 0.61 0.00 0.00 0.00 173.10 172.89 4ayk n GLY 79 N -2.96 -2.32 3.79 0.20 0.00 -1.26 -4.36 105.19 98.28 4ayk n GLY 79 Ca 0.13 -1.64 -0.34 0.00 0.00 0.00 0.00 46.02 44.16 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 -3.04 6.02 0.06 1.61 0.01 -1.26 -4.95 114.94 113.40 4ayk s ASN 80 Ca 0.00 1.97 0.24 0.00 -0.71 0.00 0.00 52.86 54.36 4ayk s ASN 80 Cb 0.00 -2.56 0.28 0.00 0.41 0.00 0.00 41.25 39.38 4ayk s ASN 80 CO 0.00 -1.00 1.24 0.18 -1.51 0.00 0.00 177.10 176.01 4ayk n LEU 81 N -1.32 0.62 -3.59 0.60 4.77 -1.26 -4.97 117.00 111.85 4ayk n LEU 81 Ca 0.10 0.07 -0.05 0.00 -0.03 0.00 0.00 56.01 56.10 4ayk n LEU 81 Cb 0.52 -0.17 -0.02 0.00 -2.33 0.00 0.00 43.42 41.43 4ayk n LEU 81 CO 0.42 0.03 0.83 0.00 -1.33 0.00 0.00 177.39 177.34 4ayk s ALA 82 N -3.13 -1.91 0.36 -1.18 0.00 -1.26 -2.37 121.76 112.28 4ayk s ALA 82 Ca 0.07 0.93 -0.16 0.00 0.00 0.00 0.00 51.96 52.80 4ayk s ALA 82 Cb 0.15 0.32 0.06 0.00 0.00 0.00 0.00 23.12 23.65 4ayk s ALA 82 CO 0.74 -0.79 0.84 -3.38 0.00 0.00 0.00 175.76 173.18 4ayk s HIS 83 N -2.88 0.14 0.23 0.00 -3.43 -1.10 -5.01 115.29 103.24 4ayk s HIS 83 Ca 0.09 -0.79 -0.22 0.00 -0.80 0.00 0.00 55.06 53.34 4ayk s HIS 83 Cb -0.00 0.83 0.06 0.00 -1.43 0.00 0.00 32.58 32.04 4ayk s HIS 83 CO -0.05 -1.49 0.91 0.00 -2.00 0.00 0.00 174.74 172.11 4ayk s ALA 84 N -2.13 -1.40 0.17 -1.38 0.00 -1.26 -1.78 121.76 113.98 4ayk s ALA 84 Ca 0.17 -0.24 0.03 0.00 0.00 0.00 0.00 51.96 51.93 4ayk s ALA 84 Cb -0.05 0.71 -0.04 0.00 0.00 0.00 0.00 23.12 23.75 4ayk s ALA 84 CO 0.11 -1.04 0.26 -0.06 0.00 0.00 0.00 175.76 175.03 4ayk s PHE 85 N -2.88 3.40 0.62 0.00 0.40 -1.01 -5.02 117.98 113.48 4ayk s PHE 85 Ca 0.15 0.06 -0.19 0.00 -0.60 0.00 0.00 56.93 56.36 4ayk s PHE 85 Cb -0.03 -1.61 -0.02 0.00 0.51 0.00 0.00 43.02 41.86 4ayk s PHE 85 CO 0.06 0.51 1.29 1.04 0.70 0.00 0.00 175.22 178.81 4ayk n GLN 86 N -0.63 1.25 -1.65 0.44 6.02 -1.26 -3.81 117.38 117.74 4ayk n GLN 86 Ca -0.08 0.48 -0.37 0.00 -0.01 0.00 0.00 57.00 57.03 4ayk n GLN 86 Cb 0.55 -2.52 -0.03 0.00 1.02 0.00 0.00 30.24 29.26 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 -3.21 2.21 0.30 -1.09 0.04 -1.26 -2.82 135.00 129.17 4ayk s PRO 87 Ca 0.80 1.27 -0.19 0.00 0.04 0.00 0.00 61.00 62.91 4ayk s PRO 87 Cb -0.39 -4.55 0.03 0.00 0.04 0.00 0.00 34.50 29.63 4ayk s PRO 87 CO 0.43 -3.16 0.72 0.20 0.04 0.00 0.00 177.00 175.22 4ayk s GLY 88 N 11.38 0.05 0.00 0.56 0.00 -1.26 -4.69 107.32 113.36 4ayk s GLY 88 Ca 0.92 -0.44 0.00 0.00 0.00 0.00 0.00 44.72 45.20 4ayk s GLY 88 CO 0.25 -0.17 0.00 -1.55 0.00 0.00 0.00 173.10 171.63 4ayk n PRO 89 N -0.47 -1.70 0.00 2.90 -0.04 -1.26 -3.20 135.00 131.23 4ayk n PRO 89 Ca -0.05 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.41 4ayk n PRO 89 Cb 0.59 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.05 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 0.49 3.49 0.00 0.55 0.00 -1.26 -0.91 105.19 107.55 4ayk n GLY 90 Ca 0.00 -0.13 0.14 0.00 0.00 0.00 0.00 46.02 46.03 4ayk n GLY 90 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 4ayk n ILE 91 N 0.00 0.00 -1.63 -0.61 3.06 -1.26 -4.87 119.36 114.05 4ayk n ILE 91 Ca 0.00 -0.00 -0.39 0.00 -2.50 0.00 0.00 62.75 59.86 4ayk n ILE 91 Cb 0.00 -0.50 0.04 0.00 0.54 0.00 0.00 39.64 39.72 4ayk n ILE 91 CO 0.00 0.00 0.00 0.61 -2.50 0.00 0.00 176.55 174.66 4ayk n GLY 92 N 1.50 -0.16 0.83 4.50 0.00 -0.09 -2.37 105.19 109.41 4ayk n GLY 92 Ca 0.07 -0.03 0.00 0.00 0.00 0.00 0.00 46.02 46.06 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 1.19 3.25 3.75 -0.02 0.00 -1.13 -4.36 105.19 107.87 4ayk n GLY 93 Ca 0.12 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.80 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 -0.46 4.79 -0.10 1.61 1.01 -1.00 -3.74 116.67 118.78 4ayk s ASP 94 Ca 0.00 2.10 -0.04 0.00 0.71 0.00 0.00 52.55 55.32 4ayk s ASP 94 Cb 0.00 -2.56 0.05 0.00 1.01 0.00 0.00 42.92 41.42 4ayk s ASP 94 CO 0.00 -1.85 0.21 0.00 0.21 0.00 0.00 175.17 173.74 4ayk s ALA 95 N -2.25 -0.37 0.04 5.23 0.00 -0.40 -2.41 121.76 121.59 4ayk s ALA 95 Ca 0.69 0.77 0.01 0.00 0.00 0.00 0.00 51.96 53.44 4ayk s ALA 95 Cb -0.23 -0.80 -0.04 0.00 0.00 0.00 0.00 23.12 22.05 4ayk s ALA 95 CO 0.43 -0.47 0.07 -1.01 0.00 0.00 0.00 175.76 174.78 4ayk s HIS 96 N 2.01 3.22 -0.07 0.00 3.76 -0.73 -2.67 115.29 120.81 4ayk s HIS 96 Ca -0.01 0.14 0.05 0.00 -0.15 0.00 0.00 55.06 55.09 4ayk s HIS 96 Cb -0.12 -1.68 -0.01 0.00 1.11 0.00 0.00 32.58 31.89 4ayk s HIS 96 CO -0.07 0.53 -0.24 -0.06 -0.85 0.00 0.00 174.74 174.04 4ayk s PHE 97 N -1.28 2.48 -0.01 1.40 0.40 -0.93 -2.70 117.98 117.35 4ayk s PHE 97 Ca 0.26 -0.79 -0.30 0.00 -0.60 0.00 0.00 56.93 55.50 4ayk s PHE 97 Cb -0.12 -1.63 -0.06 0.00 0.51 0.00 0.00 43.02 41.71 4ayk s PHE 97 CO 0.18 -0.26 1.61 0.34 0.70 0.00 0.00 175.22 177.79 4ayk s ASP 98 N -0.04 6.68 0.00 1.36 -1.08 -1.00 -2.63 116.67 119.97 4ayk s ASP 98 Ca -0.07 2.29 0.25 0.00 -0.52 0.00 0.00 52.55 54.50 4ayk s ASP 98 Cb -0.15 -2.55 0.42 0.00 -1.46 0.00 0.00 42.92 39.18 4ayk s ASP 98 CO 0.05 -0.88 1.37 1.21 0.52 0.00 0.00 175.17 177.44 4ayk n GLU 99 N 6.39 1.52 0.09 4.34 2.13 -1.05 -3.98 120.64 130.08 4ayk n GLU 99 Ca 0.16 -1.13 0.12 0.00 0.66 0.00 0.00 57.16 56.97 4ayk n GLU 99 Cb 0.42 -1.48 0.45 0.00 0.27 0.00 0.00 31.44 31.11 4ayk n GLU 99 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 4ayk n ASP 100 N 0.25 0.62 -4.90 4.31 8.00 -1.26 -4.75 116.55 118.81 4ayk n ASP 100 Ca 0.13 0.59 -0.30 0.00 0.71 0.00 0.00 54.79 55.93 4ayk n ASP 100 Cb 0.46 -0.74 -0.04 0.00 -0.02 0.00 0.00 41.12 40.77 4ayk n ASP 100 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 4ayk s GLU 101 N -3.15 3.63 -0.35 -1.24 0.41 -1.26 -5.03 118.70 111.71 4ayk s GLU 101 Ca 0.09 -0.05 -0.24 0.00 -0.41 0.00 0.00 54.97 54.36 4ayk s GLU 101 Cb 0.12 -2.74 0.01 0.00 -1.78 0.00 0.00 34.13 29.74 4ayk s GLU 101 CO 0.50 0.33 0.81 0.50 -0.49 0.00 0.00 175.26 176.92 4ayk s ARG 102 N -3.15 3.82 0.11 1.61 3.52 -1.26 -5.03 118.95 118.56 4ayk s ARG 102 Ca 0.43 0.44 -0.13 0.00 -0.13 0.00 0.00 55.73 56.33 4ayk s ARG 102 Cb -0.11 -3.79 -0.06 0.00 -1.56 0.00 0.00 34.95 29.43 4ayk s ARG 102 CO 0.27 -0.83 0.48 -1.58 -0.81 0.00 0.00 175.30 172.83 4ayk s TRP 103 N 3.14 3.61 0.37 5.12 0.52 -1.26 -3.92 118.94 126.52 4ayk s TRP 103 Ca 0.33 0.95 0.03 0.00 0.02 0.00 0.00 56.10 57.44 4ayk s TRP 103 Cb -0.13 -2.28 -0.04 0.00 -1.15 0.00 0.00 33.47 29.86 4ayk s TRP 103 CO 0.16 0.48 0.09 0.95 0.02 0.00 0.00 176.95 178.66 4ayk s THR 104 N -1.41 0.85 -0.26 2.01 -4.23 -0.65 -4.85 115.64 107.10 4ayk s THR 104 Ca 0.35 -2.00 0.13 0.00 -1.18 0.00 0.00 61.69 58.99 4ayk s THR 104 Cb -0.15 -2.55 0.69 0.00 1.34 0.00 0.00 72.50 71.84 4ayk s THR 104 CO 0.18 0.00 1.67 0.59 -0.54 0.00 0.00 174.62 176.52 4ayk n ASN 105 N -0.99 4.65 -0.64 3.99 3.02 -1.26 -3.68 115.26 120.35 4ayk n ASN 105 Ca -0.04 -3.14 0.00 0.00 -0.03 0.00 0.00 54.58 51.37 4ayk n ASN 105 Cb 0.66 -0.67 0.00 0.00 -0.61 0.00 0.00 39.78 39.16 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 -0.12 0.00 -1.04 6.41 2.04 -1.26 -5.01 115.26 116.27 4ayk n ASN 106 Ca 0.32 -0.64 -0.01 0.00 -0.44 0.00 0.00 54.58 53.81 4ayk n ASN 106 Cb 1.18 0.00 0.01 0.00 -2.53 0.00 0.00 39.78 38.44 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 0.12 0.00 -2.53 3.01 -1.26 -4.33 117.46 112.46 4ayk n PHE 107 Ca 0.00 -0.55 0.00 0.00 1.01 0.00 0.00 57.45 57.91 4ayk n PHE 107 Cb 0.00 -0.28 0.00 0.00 -0.01 0.00 0.00 39.48 39.19 4ayk n PHE 107 CO 0.00 0.00 0.00 0.54 1.01 0.00 0.00 176.76 178.31 4ayk n ARG 108 N 0.44 1.08 -0.25 -1.08 1.74 -1.26 -4.85 116.66 112.48 4ayk n ARG 108 Ca 0.02 0.00 -0.06 0.00 -0.77 0.00 0.00 57.85 57.04 4ayk n ARG 108 Cb 0.54 0.00 -0.06 0.00 -1.02 0.00 0.00 32.46 31.93 4ayk n ARG 108 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 4ayk n GLU 109 N 0.00 -0.26 -4.01 5.56 -0.58 -1.26 -4.43 120.64 115.66 4ayk n GLU 109 Ca 0.00 0.91 -0.14 0.00 -0.42 0.00 0.00 57.16 57.50 4ayk n GLU 109 Cb 0.00 -1.33 -0.14 0.00 -0.57 0.00 0.00 31.44 29.39 4ayk n GLU 109 CO 0.00 0.00 0.00 0.71 -0.48 0.00 0.00 177.13 177.36 4ayk s TYR 110 N -5.21 0.25 -0.26 -0.32 2.02 -1.25 -5.07 117.35 107.51 4ayk s TYR 110 Ca -0.07 -0.04 -0.08 0.00 -0.37 0.00 0.00 57.07 56.51 4ayk s TYR 110 Cb 0.06 -0.18 -0.03 0.00 -0.40 0.00 0.00 41.96 41.42 4ayk s TYR 110 CO 0.36 -0.02 0.08 1.21 -1.57 0.00 0.00 175.55 175.62 4ayk s ASN 111 N 0.03 5.19 0.17 2.29 3.04 -1.26 -1.63 114.94 122.77 4ayk s ASN 111 Ca 0.00 -0.24 -0.09 0.00 0.04 0.00 0.00 52.86 52.57 4ayk s ASN 111 Cb -0.02 -1.93 0.04 0.00 -1.54 0.00 0.00 41.25 37.80 4ayk s ASN 111 CO -0.00 -0.05 1.59 0.25 -3.04 0.00 0.00 177.10 175.85 4ayk h LEU 112 N 8.25 1.04 -0.74 3.21 5.85 -1.88 -3.17 115.31 127.87 4ayk h LEU 112 Ca -0.38 -0.35 0.01 0.00 0.84 0.00 0.00 57.88 58.00 4ayk h LEU 112 Cb 1.17 -0.28 -0.04 0.00 0.37 0.00 0.00 40.66 41.88 4ayk h LEU 112 CO 0.58 1.15 0.49 -0.74 -0.34 0.00 0.00 178.44 179.58 4ayk h HIS 113 N 0.92 0.93 -1.00 1.25 2.76 -1.90 -1.45 115.15 116.66 4ayk h HIS 113 Ca 0.14 0.02 0.01 0.00 -2.20 0.00 0.00 60.37 58.34 4ayk h HIS 113 Cb 0.69 -0.31 -0.05 0.00 1.55 0.00 0.00 27.41 29.28 4ayk h HIS 113 CO 0.05 0.59 0.66 0.00 -1.30 0.00 0.00 177.93 177.92 4ayk h ARG 114 N 1.00 1.32 -0.34 5.26 3.08 -1.96 -2.05 114.38 120.69 4ayk h ARG 114 Ca 0.27 -0.08 -0.17 0.00 0.07 0.00 0.00 59.98 60.06 4ayk h ARG 114 Cb -0.11 -0.30 -0.00 0.00 0.08 0.00 0.00 29.97 29.64 4ayk h ARG 114 CO -0.06 0.88 -0.46 0.28 -1.07 0.00 0.00 179.97 179.54 4ayk h VAL 115 N 1.36 1.27 -0.65 2.04 2.07 -1.48 -2.87 116.25 117.99 4ayk h VAL 115 Ca 0.37 -1.64 0.01 0.00 0.82 0.00 0.00 66.70 66.26 4ayk h VAL 115 Cb -0.15 1.49 -0.04 0.00 -1.52 0.00 0.00 31.29 31.08 4ayk h VAL 115 CO -0.08 0.54 0.42 0.00 0.02 0.00 0.00 177.57 178.48 4ayk h ALA 116 N 0.75 0.84 -0.74 1.67 0.00 -0.80 -0.19 119.26 120.79 4ayk h ALA 116 Ca 0.04 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.86 4ayk h ALA 116 Cb 1.06 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.57 4ayk h ALA 116 CO 0.11 0.23 0.26 0.00 0.00 0.00 0.00 179.25 179.84 4ayk h ALA 117 N 1.25 1.06 -0.13 0.00 0.00 -1.36 -2.20 119.26 117.89 4ayk h ALA 117 Ca 0.25 -0.21 -0.04 0.00 0.00 0.00 0.00 54.91 54.91 4ayk h ALA 117 Cb -0.06 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 17.44 4ayk h ALA 117 CO -0.07 0.65 -0.05 1.25 0.00 0.00 0.00 179.25 181.03 4ayk h HIS 118 N 1.09 0.31 -1.01 0.00 6.17 -1.18 -2.65 115.15 117.89 4ayk h HIS 118 Ca 0.24 -0.07 0.07 0.00 0.71 0.00 0.00 60.37 61.32 4ayk h HIS 118 Cb 0.26 -0.07 -0.07 0.00 2.52 0.00 0.00 27.41 30.05 4ayk h HIS 118 CO 0.02 0.59 0.65 0.93 0.71 0.00 0.00 177.93 180.83 4ayk h GLU 119 N -0.06 1.12 -0.87 5.26 4.39 -0.92 -0.08 114.58 123.42 4ayk h GLU 119 Ca 0.03 -0.07 -0.02 0.00 0.34 0.00 0.00 59.36 59.65 4ayk h GLU 119 Cb 0.50 -0.25 -0.04 0.00 -0.10 0.00 0.00 28.75 28.86 4ayk h GLU 119 CO 0.02 0.74 0.48 -0.07 -1.16 0.00 0.00 179.01 179.02 4ayk h LEU 120 N 1.16 1.08 -1.00 1.33 3.38 -1.28 -1.87 115.31 118.11 4ayk h LEU 120 Ca 0.44 -0.09 0.07 0.00 0.09 0.00 0.00 57.88 58.39 4ayk h LEU 120 Cb 0.21 -0.28 -0.07 0.00 0.09 0.00 0.00 40.66 40.61 4ayk h LEU 120 CO -0.18 0.87 0.64 1.23 0.09 0.00 0.00 178.44 181.09 4ayk h GLY 121 N 1.23 1.53 1.04 0.83 0.00 -0.65 -0.00 103.07 107.05 4ayk h GLY 121 Ca 0.31 -0.47 -0.04 0.00 0.00 0.00 0.00 47.33 47.13 4ayk h GLY 121 CO -0.05 0.32 0.38 0.45 0.00 0.00 0.00 176.54 177.64 4ayk h HIS 122 N 1.16 1.23 0.00 5.60 3.86 -1.00 -0.68 115.15 125.32 4ayk h HIS 122 Ca 0.44 -0.07 -0.04 0.00 -1.16 0.00 0.00 60.37 59.53 4ayk h HIS 122 Cb 0.19 -0.38 -0.01 0.00 1.06 0.00 0.00 27.41 28.28 4ayk h HIS 122 CO -0.00 0.90 -0.19 0.66 0.86 0.00 0.00 177.93 180.16 4ayk h SER 123 N 1.20 0.00 0.29 2.45 4.64 -0.90 -2.01 113.55 119.23 4ayk h SER 123 Ca 0.29 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.61 4ayk h SER 123 Cb 0.15 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.24 4ayk h SER 123 CO -0.03 0.19 -0.08 0.18 -0.87 0.00 0.00 176.83 176.22 4ayk n LEU 124 N -3.37 0.49 0.00 5.97 4.77 -0.15 -4.58 117.00 120.13 4ayk n LEU 124 Ca 0.00 -0.03 0.00 0.00 -0.03 0.00 0.00 56.01 55.95 4ayk n LEU 124 Cb 0.40 -0.15 0.00 0.00 -2.33 0.00 0.00 43.42 41.34 4ayk n LEU 124 CO 0.32 0.09 0.00 0.61 -1.33 0.00 0.00 177.39 177.08 4ayk n GLY 125 N 1.24 0.47 3.71 -0.72 0.00 -0.75 -4.96 105.19 104.17 4ayk n GLY 125 Ca 0.16 -0.69 -0.41 0.00 0.00 0.00 0.00 46.02 45.08 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 4.33 0.63 0.99 1.43 -0.38 -5.01 118.68 120.66 4ayk s LEU 126 Ca 0.00 1.45 -0.04 0.00 -1.03 0.00 0.00 54.13 54.51 4ayk s LEU 126 Cb 0.00 -3.38 0.04 0.00 0.03 0.00 0.00 46.19 42.88 4ayk s LEU 126 CO 0.00 -0.24 0.91 -0.44 0.23 0.00 0.00 176.35 176.82 4ayk s SER 127 N 0.96 5.14 0.79 2.29 0.01 -1.26 -4.43 113.70 117.20 4ayk s SER 127 Ca 0.46 0.37 -0.10 0.00 1.31 0.00 0.00 55.95 57.99 4ayk s SER 127 Cb -0.19 -1.18 0.07 0.00 0.21 0.00 0.00 66.02 64.92 4ayk s SER 127 CO 0.23 -1.33 1.10 -1.00 0.41 0.00 0.00 173.24 172.65 4ayk s HIS 128 N -3.03 2.47 0.29 2.43 3.76 -1.26 -5.01 115.29 114.93 4ayk s HIS 128 Ca 0.57 1.58 0.03 0.00 -0.15 0.00 0.00 55.06 57.10 4ayk s HIS 128 Cb -0.11 -3.08 -0.06 0.00 1.11 0.00 0.00 32.58 30.45 4ayk s HIS 128 CO 0.43 -1.91 0.05 0.45 -0.85 0.00 0.00 174.74 172.90 4ayk s SER 129 N -3.31 1.98 -0.00 1.40 0.15 -1.24 -5.04 113.70 107.63 4ayk s SER 129 Ca 0.62 -1.34 0.19 0.00 0.70 0.00 0.00 55.95 56.12 4ayk s SER 129 Cb -0.18 -0.01 0.56 0.00 -1.71 0.00 0.00 66.02 64.69 4ayk s SER 129 CO 0.56 -0.61 1.47 0.35 1.20 0.00 0.00 173.24 176.21 4ayk n THR 130 N -0.57 1.01 -2.72 6.45 -2.24 -1.26 -4.67 114.28 110.28 4ayk n THR 130 Ca -0.02 -1.00 -0.42 0.00 -2.27 0.00 0.00 64.05 60.33 4ayk n THR 130 Cb 0.66 0.50 -0.03 0.00 -2.10 0.00 0.00 70.33 69.35 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 -1.00 7.31 0.25 3.42 -1.08 -1.26 -4.93 116.67 119.37 4ayk s ASP 131 Ca 0.42 1.59 -0.06 0.00 -0.52 0.00 0.00 52.55 53.98 4ayk s ASP 131 Cb 0.22 -2.56 0.26 0.00 -1.46 0.00 0.00 42.92 39.38 4ayk s ASP 131 CO 0.29 -0.31 1.93 0.40 0.52 0.00 0.00 175.17 177.99 4ayk h ILE 132 N 4.90 1.25 0.00 4.11 2.04 -2.01 -1.69 117.51 126.11 4ayk h ILE 132 Ca -0.38 -0.46 0.00 0.00 1.00 0.00 0.00 64.86 65.02 4ayk h ILE 132 Cb 1.20 -0.22 0.00 0.00 -0.74 0.00 0.00 36.82 37.06 4ayk h ILE 132 CO 0.78 0.25 0.00 0.61 0.00 0.00 0.00 178.15 179.79 4ayk n GLY 133 N -1.38 -0.88 3.75 5.37 0.00 -1.26 -4.80 105.19 106.00 4ayk n GLY 133 Ca 0.12 -0.15 -0.40 0.00 0.00 0.00 0.00 46.02 45.59 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 3.36 0.28 4.61 0.00 -0.64 -4.55 121.76 122.81 4ayk s ALA 134 Ca 0.35 0.41 0.20 0.00 0.00 0.00 0.00 51.96 52.92 4ayk s ALA 134 Cb 0.16 -3.08 0.92 0.00 0.00 0.00 0.00 23.12 21.13 4ayk s ALA 134 CO 0.27 0.11 1.85 -0.07 0.00 0.00 0.00 175.76 177.93 4ayk h LEU 135 N 5.15 0.00 -4.45 0.00 3.38 -1.87 -3.24 115.31 114.29 4ayk h LEU 135 Ca -0.45 0.00 -0.22 0.00 0.09 0.00 0.00 57.88 57.30 4ayk h LEU 135 Cb 1.21 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.92 4ayk h LEU 135 CO 0.70 0.29 0.54 0.23 0.09 0.00 0.00 178.44 180.28 4ayk n MET 136 N -3.67 1.80 -2.26 1.13 2.81 -1.26 -4.91 117.12 110.77 4ayk n MET 136 Ca -0.01 -0.98 -0.41 0.00 -1.81 0.00 0.00 57.70 54.49 4ayk n MET 136 Cb 0.41 -2.04 -0.03 0.00 -0.71 0.00 0.00 33.22 30.85 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 1.77 3.28 -2.00 2.03 5.04 -1.22 -3.73 117.35 122.52 4ayk s TYR 137 Ca 0.52 1.40 0.02 0.00 -2.44 0.00 0.00 57.07 56.56 4ayk s TYR 137 Cb 0.22 -3.54 0.10 0.00 0.35 0.00 0.00 41.96 39.09 4ayk s TYR 137 CO -0.01 -1.52 0.40 -0.35 -1.34 0.00 0.00 175.55 172.73 4ayk n PRO 138 N 1.79 0.10 -3.82 4.97 -0.04 -1.26 -4.70 135.00 132.03 4ayk n PRO 138 Ca 0.03 0.00 -0.08 0.00 -0.04 0.00 0.00 63.50 63.40 4ayk n PRO 138 Cb 0.43 -1.27 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 -1.96 -0.07 -0.10 3.54 1.04 -1.26 -5.14 113.70 109.75 4ayk s SER 139 Ca 0.02 -0.98 -0.23 0.00 0.48 0.00 0.00 55.95 55.25 4ayk s SER 139 Cb 0.01 0.81 -0.03 0.00 0.10 0.00 0.00 66.02 66.91 4ayk s SER 139 CO 0.02 -1.58 0.68 -0.47 0.98 0.00 0.00 173.24 172.87 4ayk s TYR 140 N -2.78 3.52 0.05 5.02 5.04 -1.26 -5.02 117.35 121.92 4ayk s TYR 140 Ca 0.14 1.16 -0.01 0.00 -2.44 0.00 0.00 57.07 55.92 4ayk s TYR 140 Cb -0.05 -2.80 0.00 0.00 0.35 0.00 0.00 41.96 39.46 4ayk s TYR 140 CO 0.10 0.02 0.09 0.25 -1.34 0.00 0.00 175.55 174.67 4ayk n THR 141 N 4.00 0.00 -3.94 4.34 -2.24 -1.26 -5.18 114.28 110.00 4ayk n THR 141 Ca -0.01 -0.21 -0.10 0.00 -2.27 0.00 0.00 64.05 61.46 4ayk n THR 141 Cb 0.51 0.15 -0.11 0.00 -2.10 0.00 0.00 70.33 68.78 4ayk n THR 141 CO 0.00 0.00 0.00 0.72 -0.57 0.00 0.00 175.07 175.22 4ayk s PHE 142 N -6.16 0.17 -0.30 4.78 -0.71 -1.26 -5.14 117.98 109.36 4ayk s PHE 142 Ca 0.03 -0.36 -0.18 0.00 -1.04 0.00 0.00 56.93 55.39 4ayk s PHE 142 Cb -0.00 -0.13 0.19 0.00 -1.21 0.00 0.00 43.02 41.86 4ayk s PHE 142 CO 0.02 -0.18 1.21 0.45 -1.34 0.00 0.00 175.22 175.38 4ayk s SER 143 N -1.22 -0.19 0.43 1.98 0.15 -1.26 -5.14 113.70 108.45 4ayk s SER 143 Ca -0.13 0.27 0.00 0.00 0.70 0.00 0.00 55.95 56.79 4ayk s SER 143 Cb -0.08 1.19 0.00 0.00 -1.71 0.00 0.00 66.02 65.42 4ayk s SER 143 CO -0.00 -0.04 0.00 0.61 1.20 0.00 0.00 173.24 175.01 4ayk n GLY 144 N 4.31 -0.14 3.91 9.45 0.00 -1.26 -4.71 105.19 116.75 4ayk n GLY 144 Ca -0.10 -0.53 -0.28 0.00 0.00 0.00 0.00 46.02 45.12 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 -4.00 4.67 -0.50 1.61 1.01 -1.26 -4.99 116.67 113.21 4ayk s ASP 145 Ca 0.00 0.65 -0.25 0.00 0.71 0.00 0.00 52.55 53.66 4ayk s ASP 145 Cb 0.00 -1.23 0.03 0.00 1.01 0.00 0.00 42.92 42.74 4ayk s ASP 145 CO 0.00 -1.75 0.95 -0.69 0.21 0.00 0.00 175.17 173.88 4ayk s VAL 146 N -3.43 4.41 0.08 -1.27 1.01 -1.26 -5.00 120.40 114.95 4ayk s VAL 146 Ca 0.61 0.60 -0.06 0.00 0.00 0.00 0.00 61.98 63.13 4ayk s VAL 146 Cb -0.11 -4.49 -0.02 0.00 0.00 0.00 0.00 36.38 31.77 4ayk s VAL 146 CO 0.47 -0.96 0.12 -1.10 0.00 0.00 0.00 175.10 173.62 4ayk s GLN 147 N 3.90 0.77 0.30 2.72 -1.52 -1.26 -5.14 119.66 119.44 4ayk s GLN 147 Ca 0.35 -1.06 -0.28 0.00 -1.95 0.00 0.00 55.36 52.42 4ayk s GLN 147 Cb -0.11 0.30 -0.09 0.00 -0.22 0.00 0.00 33.01 32.89 4ayk s GLN 147 CO 0.24 -0.22 1.10 -0.51 -0.25 0.00 0.00 175.29 175.65 4ayk s LEU 148 N -2.89 4.48 0.30 2.90 1.43 -1.26 -4.73 118.68 118.92 4ayk s LEU 148 Ca 0.06 2.24 -0.03 0.00 -1.03 0.00 0.00 54.13 55.38 4ayk s LEU 148 Cb 0.06 -3.73 -0.04 0.00 0.03 0.00 0.00 46.19 42.51 4ayk s LEU 148 CO -0.10 -0.22 0.54 0.00 0.23 0.00 0.00 176.35 176.80 4ayk s ALA 149 N -1.25 3.66 0.30 4.21 0.00 -1.26 -4.91 121.76 122.51 4ayk s ALA 149 Ca 0.47 -0.69 0.01 0.00 0.00 0.00 0.00 51.96 51.75 4ayk s ALA 149 Cb -0.31 -2.22 0.53 0.00 0.00 0.00 0.00 23.12 21.13 4ayk s ALA 149 CO 0.39 0.16 1.89 0.37 0.00 0.00 0.00 175.76 178.57 4ayk h GLN 150 N 1.38 1.00 -1.01 0.00 4.15 -1.96 0.20 115.11 118.88 4ayk h GLN 150 Ca -0.48 -0.06 0.11 0.00 0.77 0.00 0.00 58.65 58.98 4ayk h GLN 150 Cb 1.20 -0.23 -0.08 0.00 0.21 0.00 0.00 27.48 28.58 4ayk h GLN 150 CO 0.65 0.66 0.64 0.22 -1.93 0.00 0.00 178.83 179.07 4ayk h ASP 151 N 1.03 0.96 -0.13 -0.69 1.82 -1.98 0.41 116.42 117.84 4ayk h ASP 151 Ca 0.42 0.04 -0.23 0.00 -0.39 0.00 0.00 57.03 56.87 4ayk h ASP 151 Cb 0.29 -0.16 0.01 0.00 0.68 0.00 0.00 39.33 40.15 4ayk h ASP 151 CO -0.18 0.54 -0.82 0.44 -1.61 0.00 0.00 179.24 177.61 4ayk h ASP 152 N 1.05 0.95 0.12 2.28 3.32 -1.10 -0.84 116.42 122.21 4ayk h ASP 152 Ca 0.48 -0.65 -0.01 0.00 0.02 0.00 0.00 57.03 56.88 4ayk h ASP 152 Cb 0.40 -0.28 0.00 0.00 0.22 0.00 0.00 39.33 39.67 4ayk h ASP 152 CO -0.24 1.45 -0.06 0.40 -1.72 0.00 0.00 179.24 179.07 4ayk h ILE 153 N 0.52 0.93 -0.79 0.35 1.08 0.54 -1.47 117.51 118.67 4ayk h ILE 153 Ca -0.07 -0.20 -0.04 0.00 -0.39 0.00 0.00 64.86 64.16 4ayk h ILE 153 Cb 1.46 1.06 -0.04 0.00 -3.07 0.00 0.00 36.82 36.23 4ayk h ILE 153 CO 0.17 0.05 0.32 0.44 -0.69 0.00 0.00 178.15 178.44 4ayk h ASP 154 N -0.26 1.09 0.29 1.72 3.32 -0.29 -0.21 116.42 122.07 4ayk h ASP 154 Ca -0.02 -0.17 -0.01 0.00 0.02 0.00 0.00 57.03 56.85 4ayk h ASP 154 Cb 0.21 -0.28 0.00 0.00 0.22 0.00 0.00 39.33 39.48 4ayk h ASP 154 CO 0.03 0.97 -0.14 1.23 -1.72 0.00 0.00 179.24 179.61 4ayk h GLY 155 N 1.15 -0.40 1.15 2.75 0.00 -0.95 0.48 103.07 107.26 4ayk h GLY 155 Ca 0.27 0.15 -0.15 0.00 0.00 0.00 0.00 47.33 47.60 4ayk h GLY 155 CO -0.02 -0.15 -0.31 1.19 0.00 0.00 0.00 176.54 177.25 4ayk h ILE 156 N -0.54 1.27 -0.44 2.60 6.09 -1.26 -2.53 117.51 122.70 4ayk h ILE 156 Ca -0.04 -1.48 -0.11 0.00 -1.37 0.00 0.00 64.86 61.87 4ayk h ILE 156 Cb 0.40 1.27 -0.02 0.00 0.47 0.00 0.00 36.82 38.94 4ayk h ILE 156 CO 0.06 0.50 -0.16 1.56 -3.07 0.00 0.00 178.15 177.05 4ayk h GLN 157 N 0.79 0.84 -0.36 2.19 4.20 -0.99 -2.28 115.11 119.50 4ayk h GLN 157 Ca 0.08 -0.31 0.00 0.00 0.06 0.00 0.00 58.65 58.49 4ayk h GLN 157 Cb 0.89 -0.05 -0.02 0.00 0.30 0.00 0.00 27.48 28.60 4ayk h GLN 157 CO 0.08 0.94 0.24 0.00 -0.67 0.00 0.00 178.83 179.42 4ayk h ALA 158 N 1.08 0.46 0.01 3.87 0.00 0.14 2.39 119.26 127.20 4ayk h ALA 158 Ca 0.11 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.00 4ayk h ALA 158 Cb 0.67 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.31 4ayk h ALA 158 CO 0.05 -0.08 -0.01 0.82 0.00 0.00 0.00 179.25 180.03 4ayk h ILE 159 N 0.49 0.98 0.00 0.00 2.04 -1.26 -3.38 117.51 116.38 4ayk h ILE 159 Ca 0.13 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.99 4ayk h ILE 159 Cb -0.06 0.98 0.00 0.00 -0.74 0.00 0.00 36.82 37.00 4ayk h ILE 159 CO -0.03 0.00 -0.00 -1.22 0.00 0.00 0.00 178.15 176.90 4ayk n TYR 160 N -5.10 0.00 -3.97 1.37 4.01 -0.87 -5.13 117.16 107.47 4ayk n TYR 160 Ca -0.07 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.67 4ayk n TYR 160 Cb 0.04 -0.12 0.00 0.00 -0.31 0.00 0.00 39.34 38.95 4ayk n TYR 160 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 4ayk n GLY 161 N 1.62 -1.26 3.86 2.72 0.00 0.80 -5.03 105.19 107.90 4ayk n GLY 161 Ca -0.00 -1.20 -0.32 0.00 0.00 0.00 0.00 46.02 44.50 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 -1.94 3.91 -0.89 1.61 0.52 -1.26 -4.37 118.95 116.53 4ayk s ARG 162 Ca 0.00 0.50 -0.25 0.00 -0.52 0.00 0.00 55.73 55.47 4ayk s ARG 162 Cb 0.00 -2.51 -0.03 0.00 0.52 0.00 0.00 34.95 32.93 4ayk s ARG 162 CO 0.00 0.21 1.87 -1.12 0.02 0.00 0.00 175.30 176.28 4ayk s SER 163 N -2.36 5.33 0.00 0.23 0.01 -1.26 -4.71 113.70 110.95 4ayk s SER 163 Ca 0.51 -0.69 0.00 0.00 1.31 0.00 0.00 55.95 57.09 4ayk s SER 163 Cb -0.11 -2.56 0.00 0.00 0.21 0.00 0.00 66.02 63.57 4ayk s SER 163 CO 0.20 -2.55 1.24 0.00 0.41 0.00 0.00 173.24 172.53 4ayk n GLN 164 N 8.89 0.85 -2.95 12.44 6.02 -1.26 -4.16 117.38 137.21 4ayk n GLN 164 Ca 0.37 0.00 -0.14 0.00 -0.01 0.00 0.00 57.00 57.23 4ayk n GLN 164 Cb 0.48 -1.07 -0.01 0.00 1.02 0.00 0.00 30.24 30.66 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 1.03 -1.97 -3.42 1.08 4.13 -1.26 -5.03 115.26 109.81 4ayk n ASN 165 Ca 0.00 -2.93 -0.40 0.00 1.68 0.00 0.00 54.58 52.93 4ayk n ASN 165 Cb 0.43 0.89 -0.02 0.00 -1.54 0.00 0.00 39.78 39.53 4ayk n ASN 165 CO 0.00 0.00 0.00 -0.81 0.28 0.00 0.00 177.26 176.73 4ayk n PRO 166 N 2.08 3.86 -2.96 3.52 -0.04 -1.26 -4.95 135.00 135.26 4ayk n PRO 166 Ca 0.17 -2.63 -0.40 0.00 -0.04 0.00 0.00 63.50 60.60 4ayk n PRO 166 Cb 0.57 -2.81 -0.05 0.00 -0.04 0.00 0.00 33.50 31.17 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 1.30 4.66 0.11 0.52 -7.23 -1.26 -5.06 120.40 113.43 4ayk s VAL 167 Ca 0.62 1.68 0.08 0.00 -1.81 0.00 0.00 61.98 62.56 4ayk s VAL 167 Cb 0.17 -4.14 -0.04 0.00 0.56 0.00 0.00 36.38 32.94 4ayk s VAL 167 CO -0.07 0.38 -0.16 -1.10 -0.31 0.00 0.00 175.10 173.85 4ayk s GLN 168 N -0.20 1.89 0.00 4.82 -0.21 -1.26 -5.20 119.66 119.50 4ayk s GLN 168 Ca 0.39 -1.13 0.00 0.00 0.02 0.00 0.00 55.36 54.64 4ayk s GLN 168 Cb -0.21 -2.17 0.00 0.00 1.00 0.00 0.00 33.01 31.63 4ayk s GLN 168 CO 0.24 0.49 0.13 -2.30 -2.12 0.00 0.00 175.29 171.73