#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 4ayk h LEU 2 N 0.00 1.15-10.27 7.52 4.07 -2.03 -3.43 115.31 112.33 4ayk h LEU 2 Ca 0.00 -0.03 -0.48 0.00 0.08 0.00 0.00 57.88 57.45 4ayk h LEU 2 Cb 0.00 -0.29 0.02 0.00 1.08 0.00 0.00 40.66 41.47 4ayk h LEU 2 CO 0.00 0.84 -0.07 0.42 -1.08 0.00 0.00 178.44 178.54 4ayk s THR 3 N -6.11 4.98 0.05 0.22 -4.23 -1.26 -5.04 115.64 104.25 4ayk s THR 3 Ca -0.13 -0.22 -0.30 0.00 -1.18 0.00 0.00 61.69 59.86 4ayk s THR 3 Cb 0.18 -3.85 -0.05 0.00 1.34 0.00 0.00 72.50 70.12 4ayk s THR 3 CO 0.82 -0.66 1.14 -0.70 -0.54 0.00 0.00 174.62 174.68 4ayk s GLU 4 N -4.49 4.47 0.93 3.99 2.12 -1.26 -4.78 118.70 119.68 4ayk s GLU 4 Ca 0.43 1.67 0.00 0.00 0.36 0.00 0.00 54.97 57.43 4ayk s GLU 4 Cb -0.10 -3.38 0.00 0.00 0.26 0.00 0.00 34.13 30.91 4ayk s GLU 4 CO 0.39 -0.20 0.00 0.41 -0.54 0.00 0.00 175.26 175.33 4ayk n GLY 5 N 3.12 -1.94 3.82 -1.50 0.00 -1.26 -4.87 105.19 102.55 4ayk n GLY 5 Ca 0.08 -1.54 -0.33 0.00 0.00 0.00 0.00 46.02 44.23 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 0.17 1.61 -0.87 -1.26 -4.96 114.94 112.58 4ayk s ASN 6 Ca 0.00 1.69 -0.32 0.00 -1.57 0.00 0.00 52.86 52.66 4ayk s ASN 6 Cb 0.00 -2.54 -0.11 0.00 -0.02 0.00 0.00 41.25 38.58 4ayk s ASN 6 CO 0.00 -0.35 1.70 -2.16 -2.57 0.00 0.00 177.10 173.72 4ayk s PRO 7 N -3.13 4.16 0.51 -0.60 0.04 -1.26 -4.97 135.00 129.75 4ayk s PRO 7 Ca 0.61 2.52 -0.01 0.00 0.04 0.00 0.00 61.00 64.16 4ayk s PRO 7 Cb -0.09 -3.23 0.01 0.00 0.04 0.00 0.00 34.50 31.22 4ayk s PRO 7 CO 0.14 -0.73 0.76 1.03 0.04 0.00 0.00 177.00 178.23 4ayk s ARG 8 N 1.58 2.87 -0.10 4.56 0.52 -1.26 -4.65 118.95 122.47 4ayk s ARG 8 Ca 0.75 -0.46 -0.29 0.00 -0.52 0.00 0.00 55.73 55.21 4ayk s ARG 8 Cb -0.47 -2.47 -0.02 0.00 0.52 0.00 0.00 34.95 32.52 4ayk s ARG 8 CO 0.33 -0.50 0.96 -1.58 0.02 0.00 0.00 175.30 174.52 4ayk s TRP 9 N -2.72 3.52 -0.81 -0.53 0.52 -1.26 -4.91 118.94 112.75 4ayk s TRP 9 Ca 0.52 1.53 0.26 0.00 0.02 0.00 0.00 56.10 58.43 4ayk s TRP 9 Cb -0.10 -3.13 0.70 0.00 -1.15 0.00 0.00 33.47 29.79 4ayk s TRP 9 CO 0.40 -0.18 1.60 0.39 0.02 0.00 0.00 176.95 179.18 4ayk n GLU 10 N 4.82 0.17 -2.60 4.98 1.02 -1.26 -4.86 120.64 122.91 4ayk n GLU 10 Ca 0.07 0.09 -0.32 0.00 -0.02 0.00 0.00 57.16 56.98 4ayk n GLU 10 Cb 0.49 -1.65 -0.04 0.00 -0.02 0.00 0.00 31.44 30.22 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 3.96 0.00 3.49 -0.21 -1.26 -4.96 119.66 117.59 4ayk s GLN 11 Ca 0.10 0.86 0.23 0.00 0.02 0.00 0.00 55.36 56.57 4ayk s GLN 11 Cb 0.15 -2.21 0.13 0.00 1.00 0.00 0.00 33.01 32.07 4ayk s GLN 11 CO 0.64 -0.16 1.16 0.25 -2.12 0.00 0.00 175.29 175.06 4ayk n THR 12 N -1.31 0.00 -4.61 -0.19 -2.24 -1.26 -4.88 114.28 99.78 4ayk n THR 12 Ca 0.06 -0.16 -0.24 0.00 -2.27 0.00 0.00 64.05 61.44 4ayk n THR 12 Cb 0.54 0.97 -0.14 0.00 -2.10 0.00 0.00 70.33 69.60 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 -2.63 1.58 0.13 4.78 3.76 -1.26 -3.09 115.29 118.56 4ayk s HIS 13 Ca 0.17 -0.35 0.03 0.00 -0.15 0.00 0.00 55.06 54.77 4ayk s HIS 13 Cb 0.18 -0.96 -0.04 0.00 1.11 0.00 0.00 32.58 32.86 4ayk s HIS 13 CO 0.63 0.05 -0.09 -0.51 -0.85 0.00 0.00 174.74 173.97 4ayk s LEU 14 N -0.96 2.51 0.12 0.89 1.43 -0.74 -4.98 118.68 116.96 4ayk s LEU 14 Ca 0.06 -0.99 0.07 0.00 -1.03 0.00 0.00 54.13 52.23 4ayk s LEU 14 Cb -0.08 -0.25 -0.04 0.00 0.03 0.00 0.00 46.19 45.86 4ayk s LEU 14 CO 0.01 -0.37 -0.17 0.42 0.23 0.00 0.00 176.35 176.47 4ayk s THR 15 N -3.35 1.50 0.04 5.49 -4.23 -1.26 -2.16 115.64 111.67 4ayk s THR 15 Ca 0.14 -1.66 -0.04 0.00 -1.18 0.00 0.00 61.69 58.95 4ayk s THR 15 Cb 0.03 -1.54 -0.02 0.00 1.34 0.00 0.00 72.50 72.31 4ayk s THR 15 CO -0.01 -0.28 0.06 -0.72 -0.54 0.00 0.00 174.62 173.13 4ayk s TYR 16 N -1.76 0.28 -0.15 3.99 1.13 -1.08 -2.37 117.35 117.39 4ayk s TYR 16 Ca 0.08 -0.65 -0.09 0.00 -1.41 0.00 0.00 57.07 55.01 4ayk s TYR 16 Cb -0.07 -0.20 0.05 0.00 -1.10 0.00 0.00 41.96 40.65 4ayk s TYR 16 CO 0.04 -0.37 0.37 0.50 -2.51 0.00 0.00 175.55 173.58 4ayk s ARG 17 N -2.93 0.36 -0.28 -3.49 3.52 -1.06 -2.55 118.95 112.51 4ayk s ARG 17 Ca -0.02 0.68 -0.20 0.00 -0.13 0.00 0.00 55.73 56.06 4ayk s ARG 17 Cb 0.01 -0.00 -0.01 0.00 -1.56 0.00 0.00 34.95 33.38 4ayk s ARG 17 CO -0.06 -0.14 0.63 0.42 -0.81 0.00 0.00 175.30 175.34 4ayk s ILE 18 N 1.15 4.95 0.21 4.11 1.01 -1.26 -2.63 121.20 128.75 4ayk s ILE 18 Ca -0.08 0.98 -0.08 0.00 0.00 0.00 0.00 60.65 61.47 4ayk s ILE 18 Cb -0.08 -3.98 0.15 0.00 0.01 0.00 0.00 42.46 38.56 4ayk s ILE 18 CO -0.09 -0.07 1.76 -0.33 0.00 0.00 0.00 174.94 176.20 4ayk h GLU 19 N 8.07 1.18 -2.15 2.79 5.08 -1.76 -3.46 114.58 124.33 4ayk h GLU 19 Ca -0.27 -0.23 -0.01 0.00 -1.00 0.00 0.00 59.36 57.85 4ayk h GLU 19 Cb 1.12 -0.18 -0.18 0.00 0.50 0.00 0.00 28.75 30.01 4ayk h GLU 19 CO 0.79 0.98 0.30 0.54 -1.00 0.00 0.00 179.01 180.62 4ayk s ASN 20 N -6.38 -0.55 -0.13 1.42 4.22 -1.26 -5.11 114.94 107.15 4ayk s ASN 20 Ca -0.12 0.43 -0.10 0.00 -2.14 0.00 0.00 52.86 50.93 4ayk s ASN 20 Cb 0.15 0.49 -0.05 0.00 1.28 0.00 0.00 41.25 43.13 4ayk s ASN 20 CO 0.84 -0.63 0.19 -0.31 -2.04 0.00 0.00 177.10 175.15 4ayk s TYR 21 N -1.91 3.56 0.30 1.54 2.02 -1.26 -4.62 117.35 116.98 4ayk s TYR 21 Ca -0.05 0.56 -0.29 0.00 -0.37 0.00 0.00 57.07 56.92 4ayk s TYR 21 Cb -0.00 -2.09 -0.10 0.00 -0.40 0.00 0.00 41.96 39.37 4ayk s TYR 21 CO 0.02 0.56 1.23 -0.08 -1.57 0.00 0.00 175.55 175.71 4ayk s THR 22 N -0.54 3.04 -0.48 -0.71 -1.32 -1.26 -4.89 115.64 109.48 4ayk s THR 22 Ca 0.15 1.03 0.21 0.00 -1.21 0.00 0.00 61.69 61.87 4ayk s THR 22 Cb -0.13 -3.66 0.22 0.00 -1.51 0.00 0.00 72.50 67.43 4ayk s THR 22 CO 0.04 0.24 1.64 -0.81 -2.21 0.00 0.00 174.62 173.52 4ayk n PRO 23 N 1.08 0.15 -0.26 7.08 -0.04 -1.26 -2.55 135.00 139.20 4ayk n PRO 23 Ca 0.00 0.47 -0.00 0.00 -0.04 0.00 0.00 63.50 63.92 4ayk n PRO 23 Cb 0.43 -1.84 0.20 0.00 -0.04 0.00 0.00 33.50 32.25 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 0.95 -4.70 3.54 3.32 -1.99 -3.43 116.42 114.12 4ayk h ASP 24 Ca 0.00 -0.03 -0.31 0.00 0.02 0.00 0.00 57.03 56.71 4ayk h ASP 24 Cb 0.24 -0.24 -0.21 0.00 0.22 0.00 0.00 39.33 39.34 4ayk h ASP 24 CO 0.00 0.69 -0.74 -0.76 -1.72 0.00 0.00 179.24 176.71 4ayk s LEU 25 N -9.91 2.26 0.00 1.55 1.43 -1.06 -5.06 118.68 107.89 4ayk s LEU 25 Ca -0.12 -0.56 -0.16 0.00 -1.03 0.00 0.00 54.13 52.26 4ayk s LEU 25 Cb 0.18 -0.25 0.24 0.00 0.03 0.00 0.00 46.19 46.39 4ayk s LEU 25 CO 0.79 -0.17 0.71 -0.81 0.23 0.00 0.00 176.35 177.10 4ayk n PRO 26 N 1.42 -3.13 0.03 1.29 -0.04 -1.26 -4.47 135.00 128.84 4ayk n PRO 26 Ca -0.22 -1.16 -0.16 0.00 -0.04 0.00 0.00 63.50 61.92 4ayk n PRO 26 Cb 0.54 -1.23 -0.14 0.00 -0.04 0.00 0.00 33.50 32.63 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 0.19 -0.39 0.54 0.11 -1.96 -3.08 114.38 109.78 4ayk h ARG 27 Ca -0.29 -0.32 0.04 0.00 0.10 0.00 0.00 59.98 59.51 4ayk h ARG 27 Cb 0.91 0.12 -0.04 0.00 1.11 0.00 0.00 29.97 32.07 4ayk h ARG 27 CO 0.18 0.98 0.16 0.00 0.10 0.00 0.00 179.97 181.40 4ayk h ALA 28 N 0.52 0.47 -0.37 0.08 0.00 -1.97 1.62 119.26 119.61 4ayk h ALA 28 Ca -0.30 0.03 -0.16 0.00 0.00 0.00 0.00 54.91 54.48 4ayk h ALA 28 Cb 2.02 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 19.79 4ayk h ALA 28 CO 0.12 -0.22 -0.42 -0.44 0.00 0.00 0.00 179.25 178.30 4ayk h ASP 29 N 0.34 1.00 -0.11 0.00 3.32 -1.95 -1.60 116.42 117.41 4ayk h ASP 29 Ca 0.17 -0.48 -0.07 0.00 0.02 0.00 0.00 57.03 56.67 4ayk h ASP 29 Cb 0.12 -0.28 0.00 0.00 0.22 0.00 0.00 39.33 39.39 4ayk h ASP 29 CO -0.15 1.28 -0.22 0.58 -1.72 0.00 0.00 179.24 179.00 4ayk h VAL 30 N 0.74 1.38 -1.01 -1.35 2.07 -1.34 -2.62 116.25 114.13 4ayk h VAL 30 Ca 0.05 -1.49 0.02 0.00 0.82 0.00 0.00 66.70 66.10 4ayk h VAL 30 Cb 1.02 2.08 -0.05 0.00 -1.52 0.00 0.00 31.29 32.81 4ayk h VAL 30 CO 0.10 0.43 0.67 -0.78 0.02 0.00 0.00 177.57 178.01 4ayk h ASP 31 N -0.08 1.14 -0.32 0.57 1.82 0.23 -1.90 116.42 117.90 4ayk h ASP 31 Ca 0.00 -0.02 0.00 0.00 -0.39 0.00 0.00 57.03 56.62 4ayk h ASP 31 Cb 0.80 -0.28 -0.02 0.00 0.68 0.00 0.00 39.33 40.52 4ayk h ASP 31 CO 0.05 0.81 0.21 -0.74 -1.61 0.00 0.00 179.24 177.96 4ayk h HIS 32 N 1.34 0.39 -0.87 0.28 2.76 -1.23 0.17 115.15 118.00 4ayk h HIS 32 Ca 0.38 0.01 0.01 0.00 -2.20 0.00 0.00 60.37 58.57 4ayk h HIS 32 Cb -0.11 -0.13 -0.04 0.00 1.55 0.00 0.00 27.41 28.67 4ayk h HIS 32 CO -0.00 0.25 0.57 0.00 -1.30 0.00 0.00 177.93 177.45 4ayk h ALA 33 N 1.12 1.10 -0.28 5.26 0.00 -1.02 0.33 119.26 125.77 4ayk h ALA 33 Ca 0.12 -0.06 -0.14 0.00 0.00 0.00 0.00 54.91 54.83 4ayk h ALA 33 Cb -0.04 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.38 4ayk h ALA 33 CO -0.03 0.51 -0.39 0.82 0.00 0.00 0.00 179.25 180.16 4ayk h ILE 34 N 1.18 1.29 -0.62 0.00 1.08 -0.90 -2.85 117.51 116.69 4ayk h ILE 34 Ca 0.32 -1.56 -0.10 0.00 -0.39 0.00 0.00 64.86 63.14 4ayk h ILE 34 Cb -0.13 1.50 -0.02 0.00 -3.07 0.00 0.00 36.82 35.09 4ayk h ILE 34 CO -0.07 0.50 0.01 -0.08 -0.69 0.00 0.00 178.15 177.82 4ayk h GLU 35 N 0.54 1.09 -0.99 2.37 4.81 0.12 -2.66 114.58 119.86 4ayk h GLU 35 Ca 0.05 -0.34 0.01 0.00 -0.13 0.00 0.00 59.36 58.95 4ayk h GLU 35 Cb 0.91 -0.10 -0.05 0.00 0.63 0.00 0.00 28.75 30.14 4ayk h GLU 35 CO 0.08 1.05 0.65 0.87 -0.73 0.00 0.00 179.01 180.93 4ayk h LYS 36 N 1.00 1.31 0.05 1.92 1.57 -0.79 0.57 116.57 122.20 4ayk h LYS 36 Ca 0.18 -0.09 -0.00 0.00 -1.87 0.00 0.00 60.65 58.87 4ayk h LYS 36 Cb 0.55 -0.29 0.00 0.00 0.08 0.00 0.00 32.23 32.57 4ayk h LYS 36 CO 0.03 0.88 -0.02 0.00 -0.57 0.00 0.00 179.45 179.76 4ayk h ALA 37 N 1.37 -0.07 -0.81 3.86 0.00 -1.26 -1.11 119.26 121.24 4ayk h ALA 37 Ca 0.36 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 55.19 4ayk h ALA 37 Cb -0.14 0.03 -0.04 0.00 0.00 0.00 0.00 17.79 17.64 4ayk h ALA 37 CO -0.08 -0.51 0.35 0.74 0.00 0.00 0.00 179.25 179.75 4ayk h PHE 38 N -0.12 1.20 -0.52 0.00 0.04 -1.12 -2.63 116.94 113.79 4ayk h PHE 38 Ca -0.01 -0.08 0.00 0.00 2.80 0.00 0.00 57.97 60.69 4ayk h PHE 38 Cb 0.10 -0.37 -0.03 0.00 2.20 0.00 0.00 35.95 37.86 4ayk h PHE 38 CO -0.06 0.90 0.34 1.96 -0.60 0.00 0.00 178.31 180.85 4ayk h GLN 39 N 1.16 0.69 -0.59 1.51 1.08 -0.62 -0.74 115.11 117.61 4ayk h GLN 39 Ca 0.27 -0.05 0.00 0.00 -1.45 0.00 0.00 58.65 57.43 4ayk h GLN 39 Cb 0.18 -0.15 -0.03 0.00 -0.05 0.00 0.00 27.48 27.43 4ayk h GLN 39 CO -0.03 0.46 0.39 -0.07 -0.95 0.00 0.00 178.83 178.64 4ayk h LEU 40 N 0.70 0.68 -0.30 1.46 3.38 -0.90 0.30 115.31 120.63 4ayk h LEU 40 Ca 0.19 -0.02 -0.14 0.00 0.09 0.00 0.00 57.88 58.00 4ayk h LEU 40 Cb -0.07 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 40.51 4ayk h LEU 40 CO -0.04 0.50 -0.35 -0.50 0.09 0.00 0.00 178.44 178.14 4ayk h TRP 41 N 0.80 0.93 -0.02 1.13 4.06 -1.19 -3.08 115.95 118.58 4ayk h TRP 41 Ca 0.22 -0.29 -0.11 0.00 2.06 0.00 0.00 58.89 60.77 4ayk h TRP 41 Cb -0.09 -0.19 -0.01 0.00 -1.00 0.00 0.00 29.16 27.87 4ayk h TRP 41 CO -0.03 1.06 -0.49 1.03 -3.56 0.00 0.00 178.44 176.45 4ayk h SER 42 N 0.52 0.06 -0.45 -3.49 0.87 -0.92 -2.65 113.55 107.49 4ayk h SER 42 Ca 0.04 -0.03 0.01 0.00 -1.23 0.00 0.00 61.79 60.58 4ayk h SER 42 Cb 0.93 -0.02 -0.02 0.00 -0.44 0.00 0.00 62.40 62.85 4ayk h SER 42 CO 0.08 0.54 0.30 0.78 -0.53 0.00 0.00 176.83 178.00 4ayk h ASN 43 N 0.04 0.50 -0.37 6.23 -0.26 -0.30 -2.73 115.58 118.70 4ayk h ASN 43 Ca -0.00 -0.01 0.00 0.00 -0.56 0.00 0.00 56.30 55.73 4ayk h ASN 43 Cb 0.88 -0.13 0.00 0.00 -1.06 0.00 0.00 38.32 38.01 4ayk h ASN 43 CO 0.07 0.36 0.00 1.33 -1.06 0.00 0.00 177.43 178.13 4ayk n VAL 44 N -4.47 1.14 -3.94 2.81 0.24 -1.16 -4.99 118.33 107.96 4ayk n VAL 44 Ca 0.04 -1.09 -0.10 0.00 -2.04 0.00 0.00 64.34 61.15 4ayk n VAL 44 Cb 0.07 0.42 -0.11 0.00 -1.47 0.00 0.00 33.84 32.74 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 -1.19 0.09 -2.00 3.34 -4.23 -1.01 -4.28 115.64 106.36 4ayk s THR 45 Ca 0.27 -0.71 0.01 0.00 -1.18 0.00 0.00 61.69 60.08 4ayk s THR 45 Cb 0.15 -0.25 0.04 0.00 1.34 0.00 0.00 72.50 73.78 4ayk s THR 45 CO 0.16 -0.39 0.56 -0.81 -0.54 0.00 0.00 174.62 173.60 4ayk n PRO 46 N 1.85 0.48 -1.85 3.99 -0.04 -1.26 -4.61 135.00 133.55 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 -1.04 0.03 0.00 -0.04 0.00 0.00 33.50 33.00 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 -1.09 3.37 0.04 1.53 1.43 -1.26 -4.97 118.68 117.73 4ayk s LEU 47 Ca 0.02 1.78 0.03 0.00 -1.03 0.00 0.00 54.13 54.92 4ayk s LEU 47 Cb 0.01 -4.52 -0.02 0.00 0.03 0.00 0.00 46.19 41.68 4ayk s LEU 47 CO 0.02 -1.32 -0.08 0.42 0.23 0.00 0.00 176.35 175.61 4ayk s THR 48 N -2.63 0.60 0.17 5.49 -4.23 -1.18 -4.69 115.64 109.18 4ayk s THR 48 Ca 0.62 -1.09 0.08 0.00 -1.18 0.00 0.00 61.69 60.11 4ayk s THR 48 Cb -0.16 -0.66 -0.04 0.00 1.34 0.00 0.00 72.50 72.98 4ayk s THR 48 CO 0.43 -0.36 -0.16 -0.36 -0.54 0.00 0.00 174.62 173.63 4ayk s PHE 49 N -1.35 1.70 -0.21 3.99 0.08 -1.26 -1.79 117.98 119.14 4ayk s PHE 49 Ca -0.09 -0.52 -0.12 0.00 0.12 0.00 0.00 56.93 56.32 4ayk s PHE 49 Cb -0.10 -0.84 0.06 0.00 -0.57 0.00 0.00 43.02 41.58 4ayk s PHE 49 CO 0.01 0.30 0.51 0.99 -0.10 0.00 0.00 175.22 176.92 4ayk s THR 50 N -2.37 -0.01 0.34 0.64 2.01 -0.92 -4.97 115.64 110.36 4ayk s THR 50 Ca 0.17 0.05 -0.26 0.00 0.31 0.00 0.00 61.69 61.96 4ayk s THR 50 Cb -0.04 -0.74 -0.09 0.00 0.01 0.00 0.00 72.50 71.64 4ayk s THR 50 CO 0.06 0.02 1.02 -0.75 -0.69 0.00 0.00 174.62 174.28 4ayk s LYS 51 N 1.34 4.46 -0.06 4.92 2.20 -1.26 -2.63 119.74 128.71 4ayk s LYS 51 Ca -0.09 1.51 0.05 0.00 -0.36 0.00 0.00 55.97 57.08 4ayk s LYS 51 Cb -0.07 -2.82 -0.01 0.00 -1.51 0.00 0.00 37.83 33.43 4ayk s LYS 51 CO -0.13 0.12 -0.22 0.14 -0.36 0.00 0.00 175.35 174.90 4ayk s VAL 52 N -1.50 1.80 -2.10 4.02 -7.23 -1.06 -4.91 120.40 109.42 4ayk s VAL 52 Ca 0.51 -0.92 0.24 0.00 -1.81 0.00 0.00 61.98 60.00 4ayk s VAL 52 Cb -0.23 -1.54 0.10 0.00 0.56 0.00 0.00 36.38 35.27 4ayk s VAL 52 CO 0.29 0.51 1.25 -0.24 -0.31 0.00 0.00 175.10 176.60 4ayk n SER 53 N 3.11 1.88 -3.91 4.85 2.88 -1.26 -4.72 113.62 116.45 4ayk n SER 53 Ca -0.18 -1.43 -0.09 0.00 -1.33 0.00 0.00 58.87 55.85 4ayk n SER 53 Cb 0.52 0.32 -0.08 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 -2.41 0.76 0.09 -1.46 2.02 -1.26 -5.12 118.70 111.32 4ayk s GLU 54 Ca 0.22 -0.97 0.00 0.00 0.02 0.00 0.00 54.97 54.24 4ayk s GLU 54 Cb 0.19 0.30 0.00 0.00 0.10 0.00 0.00 34.13 34.72 4ayk s GLU 54 CO 0.52 -0.22 0.00 0.41 0.02 0.00 0.00 175.26 175.99 4ayk n GLY 55 N 0.12 -1.87 3.83 -1.39 0.00 -1.26 -4.87 105.19 99.75 4ayk n GLY 55 Ca -0.16 -1.43 -0.33 0.00 0.00 0.00 0.00 46.02 44.11 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 -1.95 4.12 0.15 1.61 -0.21 -1.26 -5.07 119.66 117.06 4ayk s GLN 56 Ca 0.00 0.99 0.06 0.00 0.02 0.00 0.00 55.36 56.44 4ayk s GLN 56 Cb 0.00 -2.21 -0.04 0.00 1.00 0.00 0.00 33.01 31.76 4ayk s GLN 56 CO 0.00 -0.06 0.03 0.00 -2.12 0.00 0.00 175.29 173.14 4ayk s ALA 57 N -2.26 3.30 0.24 6.09 0.00 -1.26 -5.02 121.76 122.85 4ayk s ALA 57 Ca 0.60 -1.28 -0.07 0.00 0.00 0.00 0.00 51.96 51.21 4ayk s ALA 57 Cb -0.09 -1.11 0.23 0.00 0.00 0.00 0.00 23.12 22.14 4ayk s ALA 57 CO 0.18 0.54 1.91 -0.44 0.00 0.00 0.00 175.76 177.95 4ayk h ASP 58 N 2.83 1.05 -3.11 0.00 3.32 -1.90 -3.39 116.42 115.22 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 1.19 -0.26 -0.35 0.00 0.22 0.00 0.00 39.33 40.13 4ayk h ASP 58 CO 0.59 0.75 -0.86 -0.63 -1.72 0.00 0.00 179.24 177.38 4ayk s ILE 59 N -6.12 2.08 -0.17 0.35 1.01 -1.00 -4.60 121.20 112.75 4ayk s ILE 59 Ca -0.13 -0.97 -0.07 0.00 0.00 0.00 0.00 60.65 59.48 4ayk s ILE 59 Cb 0.17 -1.89 -0.04 0.00 0.01 0.00 0.00 42.46 40.71 4ayk s ILE 59 CO 0.80 0.51 0.06 -0.04 0.00 0.00 0.00 174.94 176.27 4ayk s MET 60 N 1.28 3.86 -0.11 2.79 -1.94 -1.21 -2.58 119.30 121.40 4ayk s MET 60 Ca 0.04 -0.34 0.03 0.00 -1.71 0.00 0.00 55.69 53.72 4ayk s MET 60 Cb -0.13 -3.17 -0.00 0.00 2.01 0.00 0.00 34.83 33.53 4ayk s MET 60 CO -0.12 0.34 -0.22 0.42 -0.01 0.00 0.00 175.02 175.43 4ayk s ILE 61 N 0.18 2.25 0.10 2.53 1.01 -1.08 -0.94 121.20 125.25 4ayk s ILE 61 Ca 0.04 -0.95 -0.13 0.00 0.00 0.00 0.00 60.65 59.62 4ayk s ILE 61 Cb -0.12 -1.88 0.02 0.00 0.01 0.00 0.00 42.46 40.49 4ayk s ILE 61 CO 0.01 0.55 0.30 -0.94 0.00 0.00 0.00 174.94 174.86 4ayk s SER 62 N 0.40 -0.07 -0.11 3.58 1.04 -1.07 -1.81 113.70 115.66 4ayk s SER 62 Ca -0.16 -0.45 -0.03 0.00 0.48 0.00 0.00 55.95 55.78 4ayk s SER 62 Cb -0.17 0.41 -0.03 0.00 0.10 0.00 0.00 66.02 66.32 4ayk s SER 62 CO 0.07 -0.78 0.02 -0.36 0.98 0.00 0.00 173.24 173.16 4ayk s PHE 63 N -3.75 3.19 0.15 5.02 0.40 -1.26 -2.36 117.98 119.37 4ayk s PHE 63 Ca 0.03 0.14 0.05 0.00 -0.60 0.00 0.00 56.93 56.55 4ayk s PHE 63 Cb 0.03 -1.86 -0.04 0.00 0.51 0.00 0.00 43.02 41.65 4ayk s PHE 63 CO -0.11 0.38 -0.10 0.14 0.70 0.00 0.00 175.22 176.23 4ayk s VAL 64 N -0.56 1.23 -0.02 -0.44 -7.23 -1.11 -4.92 120.40 107.36 4ayk s VAL 64 Ca 0.10 -2.08 0.04 0.00 -1.81 0.00 0.00 61.98 58.23 4ayk s VAL 64 Cb -0.12 -1.88 -0.01 0.00 0.56 0.00 0.00 36.38 34.94 4ayk s VAL 64 CO 0.02 -0.72 -0.14 -0.13 -0.31 0.00 0.00 175.10 173.82 4ayk s ARG 65 N -3.74 1.30 1.21 4.82 0.52 -1.26 -2.39 118.95 119.42 4ayk s ARG 65 Ca 0.18 -0.50 0.00 0.00 -0.52 0.00 0.00 55.73 54.88 4ayk s ARG 65 Cb 0.02 -1.21 0.00 0.00 0.52 0.00 0.00 34.95 34.28 4ayk s ARG 65 CO 0.01 0.25 0.00 0.41 0.02 0.00 0.00 175.30 176.00 4ayk n GLY 66 N 2.96 1.48 3.70 -3.53 0.00 -1.26 -4.25 105.19 104.29 4ayk n GLY 66 Ca -0.16 -0.35 -0.42 0.00 0.00 0.00 0.00 46.02 45.09 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 6.92 -0.40 1.61 -1.08 -1.26 -4.23 116.67 114.22 4ayk s ASP 67 Ca 0.00 2.09 0.12 0.00 -0.52 0.00 0.00 52.55 54.24 4ayk s ASP 67 Cb 0.00 -2.57 0.39 0.00 -1.46 0.00 0.00 42.92 39.28 4ayk s ASP 67 CO 0.00 -0.64 0.89 0.00 0.52 0.00 0.00 175.17 175.93 4ayk n HIS 68 N 4.82 1.61 -3.61 -5.34 1.44 -1.26 -4.94 115.22 107.93 4ayk n HIS 68 Ca 0.12 -3.46 -0.21 0.00 -2.01 0.00 0.00 57.72 52.16 4ayk n HIS 68 Cb 0.44 -0.37 0.05 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 -0.02 -4.41 -4.12 -1.40 1.74 -1.26 -5.00 116.66 102.20 4ayk n ARG 69 Ca 0.23 0.66 -0.08 0.00 -0.77 0.00 0.00 57.85 57.89 4ayk n ARG 69 Cb 0.66 -5.22 -0.10 0.00 -1.02 0.00 0.00 32.46 26.77 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 -4.15 0.54 0.00 0.55 -4.77 -1.26 -5.03 116.67 102.54 4ayk s ASP 70 Ca 0.11 -1.05 0.14 0.00 -3.30 0.00 0.00 52.55 48.44 4ayk s ASP 70 Cb -0.03 0.21 0.40 0.00 -1.09 0.00 0.00 42.92 42.41 4ayk s ASP 70 CO 0.80 -0.61 1.32 -0.46 0.70 0.00 0.00 175.17 176.92 4ayk n ASN 71 N 0.04 2.17 -3.25 2.11 6.94 -1.26 -4.43 115.26 117.58 4ayk n ASN 71 Ca -0.12 -1.97 -0.25 0.00 -0.02 0.00 0.00 54.58 52.22 4ayk n ASN 71 Cb 0.62 -0.26 -0.08 0.00 -2.36 0.00 0.00 39.78 37.70 4ayk n ASN 71 CO 0.00 0.00 0.00 -0.24 -1.03 0.00 0.00 177.26 175.99 4ayk n SER 72 N 0.68 0.02 -4.76 0.53 2.88 -1.26 -5.13 113.62 106.59 4ayk n SER 72 Ca 0.14 -2.61 -0.35 0.00 -1.33 0.00 0.00 58.87 54.73 4ayk n SER 72 Cb 0.35 -0.61 0.04 0.00 -0.75 0.00 0.00 64.21 63.23 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 -0.84 2.90 0.46 -1.46 0.05 -1.26 -5.00 135.00 129.85 4ayk s PRO 73 Ca 0.34 1.63 -0.20 0.00 0.05 0.00 0.00 61.00 62.83 4ayk s PRO 73 Cb 0.13 -1.94 -0.10 0.00 0.05 0.00 0.00 34.50 32.64 4ayk s PRO 73 CO -0.14 -1.22 0.99 -0.06 0.05 0.00 0.00 177.00 176.63 4ayk s PHE 74 N -1.91 3.18 -0.53 0.56 0.40 -1.26 -5.02 117.98 113.40 4ayk s PHE 74 Ca 0.73 1.59 0.06 0.00 -0.60 0.00 0.00 56.93 58.71 4ayk s PHE 74 Cb -0.26 -2.94 0.23 0.00 0.51 0.00 0.00 43.02 40.56 4ayk s PHE 74 CO 0.36 -0.44 0.59 -3.47 0.70 0.00 0.00 175.22 172.95 4ayk n ASP 75 N -0.85 1.87 0.00 1.36 -0.08 -1.26 -4.84 116.55 112.74 4ayk n ASP 75 Ca 0.08 -3.02 0.00 0.00 -1.51 0.00 0.00 54.79 50.34 4ayk n ASP 75 Cb 0.53 -0.66 0.00 0.00 2.34 0.00 0.00 41.12 43.34 4ayk n ASP 75 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 4ayk n GLY 76 N 1.42 0.35 0.26 0.27 0.00 -1.26 -4.58 105.19 101.65 4ayk n GLY 76 Ca 0.25 -1.86 0.13 0.00 0.00 0.00 0.00 46.02 44.54 4ayk n GLY 76 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 4ayk h PRO 77 N 0.00 0.00 0.00 1.61 0.13 -1.97 -3.44 132.00 128.33 4ayk h PRO 77 Ca 0.00 0.00 -0.37 0.00 -0.87 0.00 0.00 66.00 64.76 4ayk h PRO 77 Cb 0.00 0.00 0.09 0.00 0.13 0.00 0.00 31.00 31.22 4ayk h PRO 77 CO 0.00 0.12 0.17 0.41 -0.23 0.00 0.00 178.00 178.47 4ayk n GLY 78 N -0.64 0.02 4.27 1.56 0.00 -1.26 -4.87 105.19 104.27 4ayk n GLY 78 Ca -0.02 -1.92 0.00 0.00 0.00 0.00 0.00 46.02 44.08 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 -1.55 0.62 3.67 -0.02 0.00 -1.26 -4.68 105.19 101.97 4ayk n GLY 79 Ca 0.14 -1.15 -0.43 0.00 0.00 0.00 0.00 46.02 44.58 4ayk n GLY 79 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 4ayk s ASN 80 N -4.00 7.01 0.14 1.61 3.04 -1.26 -4.90 114.94 116.59 4ayk s ASN 80 Ca 0.00 1.70 0.23 0.00 0.04 0.00 0.00 52.86 54.83 4ayk s ASN 80 Cb 0.00 -2.55 0.10 0.00 -1.54 0.00 0.00 41.25 37.26 4ayk s ASN 80 CO 0.00 -0.67 1.10 0.18 -3.04 0.00 0.00 177.10 174.67 4ayk n LEU 81 N 6.00 0.74 -3.54 3.21 4.77 -1.26 -4.92 117.00 121.99 4ayk n LEU 81 Ca 0.12 0.23 -0.07 0.00 -0.03 0.00 0.00 56.01 56.26 4ayk n LEU 81 Cb 0.46 -0.10 -0.02 0.00 -2.33 0.00 0.00 43.42 41.43 4ayk n LEU 81 CO 0.55 -0.10 0.80 0.00 -1.33 0.00 0.00 177.39 177.31 4ayk s ALA 82 N -3.28 -1.91 0.38 -1.18 0.00 -1.26 -2.45 121.76 112.06 4ayk s ALA 82 Ca 0.02 1.19 -0.16 0.00 0.00 0.00 0.00 51.96 53.01 4ayk s ALA 82 Cb 0.12 0.24 0.06 0.00 0.00 0.00 0.00 23.12 23.54 4ayk s ALA 82 CO 0.78 -0.67 0.83 -3.38 0.00 0.00 0.00 175.76 173.31 4ayk s HIS 83 N -2.87 0.15 0.22 0.00 -3.43 -1.10 -5.03 115.29 103.23 4ayk s HIS 83 Ca 0.07 -0.83 -0.22 0.00 -0.80 0.00 0.00 55.06 53.28 4ayk s HIS 83 Cb -0.01 0.84 0.06 0.00 -1.43 0.00 0.00 32.58 32.04 4ayk s HIS 83 CO -0.07 -1.55 0.90 0.00 -2.00 0.00 0.00 174.74 172.02 4ayk s ALA 84 N -2.09 -1.40 0.02 -1.38 0.00 -1.26 -1.81 121.76 113.84 4ayk s ALA 84 Ca 0.17 -0.21 -0.00 0.00 0.00 0.00 0.00 51.96 51.92 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 0.11 -0.06 0.00 0.00 0.00 175.76 174.89 4ayk s PHE 85 N -3.02 3.35 0.57 0.00 0.40 -1.06 -5.02 117.98 113.19 4ayk s PHE 85 Ca 0.15 0.22 -0.21 0.00 -0.60 0.00 0.00 56.93 56.48 4ayk s PHE 85 Cb -0.03 -1.74 -0.04 0.00 0.51 0.00 0.00 43.02 41.72 4ayk s PHE 85 CO 0.05 0.57 1.34 1.04 0.70 0.00 0.00 175.22 178.93 4ayk n GLN 86 N 0.91 1.58 -1.53 0.44 3.00 -1.26 -3.60 117.38 116.92 4ayk n GLN 86 Ca -0.11 0.59 -0.52 0.00 -0.01 0.00 0.00 57.00 56.95 4ayk n GLN 86 Cb 0.52 -2.56 -0.07 0.00 0.00 0.00 0.00 30.24 28.13 4ayk n GLN 86 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.06 174.76 4ayk n PRO 87 N -1.18 1.25 -3.33 -1.09 -0.02 -1.26 -3.66 135.00 125.71 4ayk n PRO 87 Ca 0.11 0.39 -0.07 0.00 -2.02 0.00 0.00 63.50 61.91 4ayk n PRO 87 Cb 0.45 -2.42 0.02 0.00 -0.02 0.00 0.00 33.50 31.53 4ayk n PRO 87 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 4ayk n GLY 88 N 5.81 1.12 3.80 -1.23 0.00 -1.26 -4.72 105.19 108.71 4ayk n GLY 88 Ca 0.36 -1.21 -0.30 0.00 0.00 0.00 0.00 46.02 44.87 4ayk n GLY 88 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 4ayk s PRO 89 N -2.07 0.11 7.95 1.61 0.04 -1.26 -3.78 135.00 137.60 4ayk s PRO 89 Ca 0.14 -0.21 0.00 0.00 0.04 0.00 0.00 61.00 60.97 4ayk s PRO 89 Cb -0.04 -1.76 0.00 0.00 0.04 0.00 0.00 34.50 32.73 4ayk s PRO 89 CO 0.10 -2.80 0.00 0.41 0.04 0.00 0.00 177.00 174.74 4ayk n GLY 90 N -2.65 3.90 0.01 0.56 0.00 -1.26 -1.63 105.19 104.12 4ayk n GLY 90 Ca 0.13 0.02 0.13 0.00 0.00 0.00 0.00 46.02 46.30 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 0.17 -1.48 -0.61 3.06 -1.26 -4.87 119.36 114.36 4ayk n ILE 91 Ca 0.00 0.01 -0.37 0.00 -2.50 0.00 0.00 62.75 59.89 4ayk n ILE 91 Cb 0.00 -0.57 0.06 0.00 0.54 0.00 0.00 39.64 39.68 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 1.30 -0.65 2.50 4.50 0.00 -0.65 -1.99 105.19 110.21 4ayk n GLY 92 Ca 0.06 -0.24 0.00 0.00 0.00 0.00 0.00 46.02 45.84 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 1.34 3.08 3.76 -0.02 0.00 -1.24 -4.51 105.19 107.60 4ayk n GLY 93 Ca 0.13 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.83 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 -1.19 4.60 -0.12 1.61 1.11 -0.84 -3.31 116.67 118.54 4ayk s ASP 94 Ca 0.00 2.00 -0.05 0.00 0.18 0.00 0.00 52.55 54.68 4ayk s ASP 94 Cb 0.00 -2.55 0.06 0.00 1.07 0.00 0.00 42.92 41.50 4ayk s ASP 94 CO 0.00 -1.97 0.25 0.00 1.18 0.00 0.00 175.17 174.63 4ayk s ALA 95 N -2.51 -0.54 -0.00 5.23 0.00 -0.12 -2.58 121.76 121.24 4ayk s ALA 95 Ca 0.66 0.94 -0.01 0.00 0.00 0.00 0.00 51.96 53.55 4ayk s ALA 95 Cb -0.21 -0.90 -0.04 0.00 0.00 0.00 0.00 23.12 21.98 4ayk s ALA 95 CO 0.48 -0.51 0.14 -1.01 0.00 0.00 0.00 175.76 174.86 4ayk s HIS 96 N 2.08 3.42 -0.05 0.00 3.76 -0.75 -2.60 115.29 121.15 4ayk s HIS 96 Ca -0.02 0.28 0.05 0.00 -0.15 0.00 0.00 55.06 55.23 4ayk s HIS 96 Cb -0.12 -1.78 -0.02 0.00 1.11 0.00 0.00 32.58 31.77 4ayk s HIS 96 CO -0.08 0.60 -0.21 -0.06 -0.85 0.00 0.00 174.74 174.14 4ayk s PHE 97 N -1.27 2.52 -0.08 1.40 0.40 -0.99 -2.72 117.98 117.23 4ayk s PHE 97 Ca 0.25 -0.41 -0.29 0.00 -0.60 0.00 0.00 56.93 55.88 4ayk s PHE 97 Cb -0.12 -1.59 -0.05 0.00 0.51 0.00 0.00 43.02 41.76 4ayk s PHE 97 CO 0.17 -0.01 1.74 0.34 0.70 0.00 0.00 175.22 178.16 4ayk s ASP 98 N -0.49 6.50 0.00 1.36 -1.08 -1.02 -2.75 116.67 119.19 4ayk s ASP 98 Ca 0.06 2.17 0.24 0.00 -0.52 0.00 0.00 52.55 54.50 4ayk s ASP 98 Cb -0.11 -2.53 0.31 0.00 -1.46 0.00 0.00 42.92 39.12 4ayk s ASP 98 CO 0.01 -1.08 1.31 1.21 0.52 0.00 0.00 175.17 177.14 4ayk n GLU 99 N 7.41 1.88 0.21 4.34 2.13 -1.00 -4.08 120.64 131.52 4ayk n GLU 99 Ca 0.19 -1.48 0.14 0.00 0.66 0.00 0.00 57.16 56.67 4ayk n GLU 99 Cb 0.43 -1.47 0.42 0.00 0.27 0.00 0.00 31.44 31.09 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 3.61 0.00 -2.56 4.31 3.32 -1.88 -3.44 116.42 119.77 4ayk h ASP 100 Ca 0.00 0.00 -0.49 0.00 0.02 0.00 0.00 57.03 56.56 4ayk h ASP 100 Cb 0.84 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.38 4ayk h ASP 100 CO 0.00 0.00 -0.34 -1.61 -1.72 0.00 0.00 179.24 175.57 4ayk s GLU 101 N -3.37 3.47 -0.35 3.56 2.02 -1.26 -5.04 118.70 117.74 4ayk s GLU 101 Ca 0.05 -0.52 -0.24 0.00 0.02 0.00 0.00 54.97 54.28 4ayk s GLU 101 Cb 0.08 -2.82 0.01 0.00 0.10 0.00 0.00 34.13 31.50 4ayk s GLU 101 CO 0.58 0.35 0.81 0.50 0.02 0.00 0.00 175.26 177.53 4ayk s ARG 102 N -3.83 3.83 0.22 1.61 3.52 -1.26 -5.04 118.95 117.99 4ayk s ARG 102 Ca 0.37 0.44 -0.12 0.00 -0.13 0.00 0.00 55.73 56.29 4ayk s ARG 102 Cb -0.10 -3.79 -0.07 0.00 -1.56 0.00 0.00 34.95 29.43 4ayk s ARG 102 CO 0.31 -0.82 0.57 -1.58 -0.81 0.00 0.00 175.30 172.97 4ayk s TRP 103 N 3.13 3.47 0.18 5.12 0.52 -1.26 -4.66 118.94 125.45 4ayk s TRP 103 Ca 0.33 0.97 0.07 0.00 0.02 0.00 0.00 56.10 57.48 4ayk s TRP 103 Cb -0.13 -2.32 -0.05 0.00 -1.15 0.00 0.00 33.47 29.82 4ayk s TRP 103 CO 0.16 0.30 -0.13 0.95 0.02 0.00 0.00 176.95 178.24 4ayk s THR 104 N -1.73 1.57 -0.29 2.01 -4.23 -0.71 -4.92 115.64 107.33 4ayk s THR 104 Ca 0.45 -2.13 0.09 0.00 -1.18 0.00 0.00 61.69 58.92 4ayk s THR 104 Cb -0.12 -1.95 0.50 0.00 1.34 0.00 0.00 72.50 72.27 4ayk s THR 104 CO 0.20 -0.61 1.44 0.59 -0.54 0.00 0.00 174.62 175.70 4ayk n ASN 105 N -0.24 2.44 -0.44 3.99 5.03 -1.26 -2.39 115.26 122.39 4ayk n ASN 105 Ca -0.09 -3.81 0.00 0.00 0.87 0.00 0.00 54.58 51.54 4ayk n ASN 105 Cb 0.60 -0.62 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 -1.12 0.00 -0.78 6.41 2.04 -1.26 -5.00 115.26 115.55 4ayk n ASN 106 Ca 0.32 -0.44 0.00 0.00 -0.44 0.00 0.00 54.58 54.02 4ayk n ASN 106 Cb 1.00 0.00 0.00 0.00 -2.53 0.00 0.00 39.78 38.25 4ayk n ASN 106 CO 0.00 0.00 0.00 0.33 -0.44 0.00 0.00 177.26 177.15 4ayk n PHE 107 N 0.00 0.00 -0.65 -2.53 7.35 -1.26 -4.73 117.46 115.64 4ayk n PHE 107 Ca 0.00 -0.19 0.00 0.00 -0.76 0.00 0.00 57.45 56.50 4ayk n PHE 107 Cb 0.00 -0.14 0.00 0.00 0.35 0.00 0.00 39.48 39.69 4ayk n PHE 107 CO 0.00 0.00 0.00 0.54 -0.76 0.00 0.00 176.76 176.54 4ayk n ARG 108 N 0.44 -0.12 0.37 -4.13 5.12 -1.26 -4.98 116.66 112.10 4ayk n ARG 108 Ca 0.00 0.00 -0.17 0.00 -1.93 0.00 0.00 57.85 55.75 4ayk n ARG 108 Cb 0.27 0.00 -0.09 0.00 -1.16 0.00 0.00 32.46 31.48 4ayk n ARG 108 CO 0.00 0.00 0.00 0.93 -1.93 0.00 0.00 177.63 176.63 4ayk h GLU 109 N 0.00 -0.89 -4.88 5.56 4.39 -1.97 -3.41 114.58 113.38 4ayk h GLU 109 Ca 0.00 0.06 -0.65 0.00 0.34 0.00 0.00 59.36 59.11 4ayk h GLU 109 Cb 0.00 0.20 -0.17 0.00 -0.10 0.00 0.00 28.75 28.68 4ayk h GLU 109 CO 0.00 -0.57 -0.47 0.71 -1.16 0.00 0.00 179.01 177.52 4ayk s TYR 110 N -5.49 3.22 -0.33 4.33 2.02 -1.26 -5.06 117.35 114.79 4ayk s TYR 110 Ca -0.17 0.05 -0.13 0.00 -0.37 0.00 0.00 57.07 56.46 4ayk s TYR 110 Cb 0.02 -2.44 -0.02 0.00 -0.40 0.00 0.00 41.96 39.12 4ayk s TYR 110 CO 0.56 -0.23 0.25 1.21 -1.57 0.00 0.00 175.55 175.77 4ayk s ASN 111 N 1.74 6.07 0.25 2.29 3.04 -1.26 -1.74 114.94 125.33 4ayk s ASN 111 Ca 0.08 -0.28 -0.04 0.00 0.04 0.00 0.00 52.86 52.65 4ayk s ASN 111 Cb -0.16 -2.14 0.28 0.00 -1.54 0.00 0.00 41.25 37.69 4ayk s ASN 111 CO 0.11 -0.21 1.80 0.25 -3.04 0.00 0.00 177.10 176.01 4ayk h LEU 112 N 8.50 0.94 -1.01 3.21 5.85 -1.83 -2.89 115.31 128.07 4ayk h LEU 112 Ca -0.32 -0.16 0.01 0.00 0.84 0.00 0.00 57.88 58.26 4ayk h LEU 112 Cb 1.16 -0.24 -0.05 0.00 0.37 0.00 0.00 40.66 41.90 4ayk h LEU 112 CO 0.62 0.87 0.67 -0.74 -0.34 0.00 0.00 178.44 179.52 4ayk h HIS 113 N 0.98 1.26 -0.63 1.25 2.76 -1.87 -1.56 115.15 117.33 4ayk h HIS 113 Ca 0.22 0.03 0.02 0.00 -2.20 0.00 0.00 60.37 58.43 4ayk h HIS 113 Cb 0.26 -0.43 -0.04 0.00 1.55 0.00 0.00 27.41 28.76 4ayk h HIS 113 CO 0.02 0.78 0.41 -0.09 -1.30 0.00 0.00 177.93 177.75 4ayk h ARG 114 N 1.35 0.79 -0.32 5.26 9.65 -1.91 -0.66 114.38 128.54 4ayk h ARG 114 Ca 0.37 -0.05 -0.18 0.00 -1.10 0.00 0.00 59.98 59.03 4ayk h ARG 114 Cb -0.13 -0.18 -0.00 0.00 -1.39 0.00 0.00 29.97 28.27 4ayk h ARG 114 CO -0.09 0.52 -0.49 0.28 2.80 0.00 0.00 179.97 182.99 4ayk h VAL 115 N 0.81 1.27 -0.53 0.20 2.07 -1.53 -2.68 116.25 115.87 4ayk h VAL 115 Ca 0.24 -1.67 0.02 0.00 0.82 0.00 0.00 66.70 66.11 4ayk h VAL 115 Cb -0.04 1.54 -0.03 0.00 -1.52 0.00 0.00 31.29 31.23 4ayk h VAL 115 CO -0.07 0.55 0.33 0.00 0.02 0.00 0.00 177.57 178.40 4ayk h ALA 116 N 0.72 0.68 -0.87 1.67 0.00 -0.86 0.52 119.26 121.13 4ayk h ALA 116 Ca 0.03 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 4ayk h ALA 116 Cb 1.10 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 18.67 4ayk h ALA 116 CO 0.11 0.07 0.46 0.00 0.00 0.00 0.00 179.25 179.89 4ayk h ALA 117 N 1.22 1.16 -0.14 0.00 0.00 -1.08 -2.16 119.26 118.25 4ayk h ALA 117 Ca 0.21 -0.14 -0.06 0.00 0.00 0.00 0.00 54.91 54.91 4ayk h ALA 117 Cb -0.02 -0.35 -0.00 0.00 0.00 0.00 0.00 17.79 17.42 4ayk h ALA 117 CO -0.07 0.66 -0.15 1.25 0.00 0.00 0.00 179.25 180.94 4ayk h HIS 118 N 1.23 0.42 -0.96 0.00 6.17 -1.02 -2.44 115.15 118.55 4ayk h HIS 118 Ca 0.30 -0.13 0.01 0.00 0.71 0.00 0.00 60.37 61.27 4ayk h HIS 118 Cb 0.06 -0.09 -0.05 0.00 2.52 0.00 0.00 27.41 29.86 4ayk h HIS 118 CO 0.01 0.75 0.64 0.93 0.71 0.00 0.00 177.93 180.97 4ayk h GLU 119 N -0.03 1.26 -0.87 5.26 5.08 -0.78 -1.12 114.58 123.38 4ayk h GLU 119 Ca 0.02 -0.08 -0.02 0.00 -1.00 0.00 0.00 59.36 58.29 4ayk h GLU 119 Cb 0.68 -0.28 -0.04 0.00 0.50 0.00 0.00 28.75 29.61 4ayk h GLU 119 CO 0.04 0.83 0.47 -0.07 -1.00 0.00 0.00 179.01 179.28 4ayk h LEU 120 N 1.30 1.08 -0.99 1.33 3.38 -1.36 -1.92 115.31 118.13 4ayk h LEU 120 Ca 0.36 -0.10 0.10 0.00 0.09 0.00 0.00 57.88 58.33 4ayk h LEU 120 Cb -0.14 -0.28 -0.08 0.00 0.09 0.00 0.00 40.66 40.26 4ayk h LEU 120 CO -0.08 0.87 0.62 1.23 0.09 0.00 0.00 178.44 181.17 4ayk h GLY 121 N 1.23 1.57 1.27 0.83 0.00 -0.70 0.10 103.07 107.36 4ayk h GLY 121 Ca 0.31 -0.43 -0.07 0.00 0.00 0.00 0.00 47.33 47.13 4ayk h GLY 121 CO -0.05 0.22 0.05 0.45 0.00 0.00 0.00 176.54 177.21 4ayk h HIS 122 N 1.04 0.95 0.00 5.60 3.86 -1.01 0.06 115.15 125.65 4ayk h HIS 122 Ca 0.46 -0.13 -0.05 0.00 -1.16 0.00 0.00 60.37 59.50 4ayk h HIS 122 Cb 0.36 -0.26 -0.01 0.00 1.06 0.00 0.00 27.41 28.56 4ayk h HIS 122 CO -0.01 0.84 -0.24 0.66 0.86 0.00 0.00 177.93 180.04 4ayk h SER 123 N 0.84 0.00 0.23 2.45 4.64 -0.56 -1.95 113.55 119.19 4ayk h SER 123 Ca 0.17 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.49 4ayk h SER 123 Cb 0.43 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.52 4ayk h SER 123 CO 0.02 0.24 -0.07 0.18 -0.87 0.00 0.00 176.83 176.33 4ayk n LEU 124 N -3.49 0.54 0.00 5.97 4.77 0.12 -4.71 117.00 120.21 4ayk n LEU 124 Ca -0.00 -0.08 0.00 0.00 -0.03 0.00 0.00 56.01 55.90 4ayk n LEU 124 Cb 0.41 -0.12 0.00 0.00 -2.33 0.00 0.00 43.42 41.38 4ayk n LEU 124 CO 0.34 0.10 0.00 0.61 -1.33 0.00 0.00 177.39 177.10 4ayk n GLY 125 N 1.20 0.62 3.71 -0.72 0.00 -0.73 -4.80 105.19 104.48 4ayk n GLY 125 Ca 0.17 -0.42 -0.41 0.00 0.00 0.00 0.00 46.02 45.36 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 4.35 0.65 0.99 1.43 -0.07 -4.92 118.68 121.11 4ayk s LEU 126 Ca 0.00 1.46 -0.04 0.00 -1.03 0.00 0.00 54.13 54.52 4ayk s LEU 126 Cb 0.00 -3.36 0.05 0.00 0.03 0.00 0.00 46.19 42.91 4ayk s LEU 126 CO 0.00 -0.19 0.93 -0.44 0.23 0.00 0.00 176.35 176.88 4ayk s SER 127 N 0.88 4.98 0.71 2.29 0.01 -1.26 -4.32 113.70 117.00 4ayk s SER 127 Ca 0.45 0.29 -0.13 0.00 1.31 0.00 0.00 55.95 57.87 4ayk s SER 127 Cb -0.20 -1.02 0.03 0.00 0.21 0.00 0.00 66.02 65.04 4ayk s SER 127 CO 0.24 -1.43 1.12 -1.00 0.41 0.00 0.00 173.24 172.57 4ayk s HIS 128 N -3.07 2.50 0.15 2.43 0.09 -1.26 -4.94 115.29 111.19 4ayk s HIS 128 Ca 0.59 1.57 0.04 0.00 -0.00 0.00 0.00 55.06 57.26 4ayk s HIS 128 Cb -0.11 -3.17 -0.05 0.00 -0.00 0.00 0.00 32.58 29.26 4ayk s HIS 128 CO 0.42 -1.87 -0.08 0.45 -0.00 0.00 0.00 174.74 173.66 4ayk s SER 129 N -2.76 1.73 0.00 1.40 0.15 -1.04 -5.03 113.70 108.15 4ayk s SER 129 Ca 0.66 -1.04 0.23 0.00 0.70 0.00 0.00 55.95 56.50 4ayk s SER 129 Cb -0.20 0.00 0.51 0.00 -1.71 0.00 0.00 66.02 64.62 4ayk s SER 129 CO 0.47 -0.37 1.46 0.35 1.20 0.00 0.00 173.24 176.34 4ayk n THR 130 N -0.21 0.67 -2.71 6.45 -2.24 -1.26 -4.36 114.28 110.61 4ayk n THR 130 Ca -0.10 -0.82 -0.42 0.00 -2.27 0.00 0.00 64.05 60.45 4ayk n THR 130 Cb 0.61 0.80 -0.03 0.00 -2.10 0.00 0.00 70.33 69.60 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 -1.32 7.40 0.25 3.42 -1.08 -1.26 -4.93 116.67 119.14 4ayk s ASP 131 Ca 0.42 1.70 -0.06 0.00 -0.52 0.00 0.00 52.55 54.09 4ayk s ASP 131 Cb 0.24 -2.57 0.26 0.00 -1.46 0.00 0.00 42.92 39.38 4ayk s ASP 131 CO 0.32 -0.22 1.93 0.40 0.52 0.00 0.00 175.17 178.12 4ayk h ILE 132 N 4.62 1.26 0.00 4.11 2.04 -2.02 -1.24 117.51 126.27 4ayk h ILE 132 Ca -0.41 -0.48 0.00 0.00 1.00 0.00 0.00 64.86 64.97 4ayk h ILE 132 Cb 1.22 -0.22 0.00 0.00 -0.74 0.00 0.00 36.82 37.08 4ayk h ILE 132 CO 0.74 0.25 0.00 0.61 0.00 0.00 0.00 178.15 179.75 4ayk n GLY 133 N -1.37 -0.91 3.72 5.37 0.00 -1.26 -4.75 105.19 105.99 4ayk n GLY 133 Ca 0.12 -0.13 -0.40 0.00 0.00 0.00 0.00 46.02 45.60 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 -2.27 3.30 0.32 4.61 0.00 -0.47 -4.41 121.76 122.83 4ayk s ALA 134 Ca 0.30 0.31 0.12 0.00 0.00 0.00 0.00 51.96 52.68 4ayk s ALA 134 Cb 0.16 -3.08 0.54 0.00 0.00 0.00 0.00 23.12 20.74 4ayk s ALA 134 CO 0.32 -0.08 1.72 -0.07 0.00 0.00 0.00 175.76 177.65 4ayk h LEU 135 N 6.36 0.00 -4.62 0.00 3.38 -1.86 -3.28 115.31 115.29 4ayk h LEU 135 Ca -0.42 0.00 -0.30 0.00 0.09 0.00 0.00 57.88 57.25 4ayk h LEU 135 Cb 1.21 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.93 4ayk h LEU 135 CO 0.74 0.49 1.16 0.23 0.09 0.00 0.00 178.44 181.15 4ayk n MET 136 N -3.93 2.09 -2.28 1.13 2.81 -1.26 -4.89 117.12 110.79 4ayk n MET 136 Ca -0.01 -1.19 -0.40 0.00 -1.81 0.00 0.00 57.70 54.28 4ayk n MET 136 Cb 0.51 -2.18 -0.03 0.00 -0.71 0.00 0.00 33.22 30.81 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 1.98 3.27 -2.00 2.03 5.04 -1.24 -2.50 117.35 123.93 4ayk s TYR 137 Ca 0.53 1.54 0.06 0.00 -2.44 0.00 0.00 57.07 56.76 4ayk s TYR 137 Cb 0.21 -3.50 0.33 0.00 0.35 0.00 0.00 41.96 39.35 4ayk s TYR 137 CO -0.02 -1.28 0.72 -0.35 -1.34 0.00 0.00 175.55 173.28 4ayk n PRO 138 N 0.91 0.29 -3.88 4.97 -0.04 -1.26 -4.74 135.00 131.25 4ayk n PRO 138 Ca -0.00 0.00 -0.10 0.00 -0.04 0.00 0.00 63.50 63.36 4ayk n PRO 138 Cb 0.43 -1.30 0.00 0.00 -0.04 0.00 0.00 33.50 32.60 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 -1.88 0.18 -0.02 3.54 1.04 -1.26 -5.15 113.70 110.15 4ayk s SER 139 Ca 0.08 -1.16 -0.18 0.00 0.48 0.00 0.00 55.95 55.17 4ayk s SER 139 Cb 0.04 0.79 -0.05 0.00 0.10 0.00 0.00 66.02 66.89 4ayk s SER 139 CO 0.06 -1.55 0.52 -0.47 0.98 0.00 0.00 173.24 172.78 4ayk s TYR 140 N -2.70 3.67 0.23 5.02 5.04 -1.26 -5.07 117.35 122.29 4ayk s TYR 140 Ca 0.19 1.09 -0.11 0.00 -2.44 0.00 0.00 57.07 55.80 4ayk s TYR 140 Cb -0.04 -2.50 -0.01 0.00 0.35 0.00 0.00 41.96 39.76 4ayk s TYR 140 CO 0.13 0.41 0.41 0.95 -1.34 0.00 0.00 175.55 176.11 4ayk s THR 141 N -0.35 0.01 -0.11 4.34 -4.23 -1.26 -5.12 115.64 108.92 4ayk s THR 141 Ca 0.28 -1.47 -0.30 0.00 -1.18 0.00 0.00 61.69 59.02 4ayk s THR 141 Cb -0.17 -2.19 -0.02 0.00 1.34 0.00 0.00 72.50 71.46 4ayk s THR 141 CO 0.15 -0.04 1.17 0.12 -0.54 0.00 0.00 174.62 175.48 4ayk s PHE 142 N -4.03 3.17 -0.09 3.99 2.19 -1.26 -5.02 117.98 116.94 4ayk s PHE 142 Ca 0.24 1.25 0.04 0.00 0.33 0.00 0.00 56.93 58.79 4ayk s PHE 142 Cb 0.01 -3.39 -0.01 0.00 -1.31 0.00 0.00 43.02 38.32 4ayk s PHE 142 CO 0.08 -1.15 -0.22 -1.12 1.83 0.00 0.00 175.22 174.64 4ayk s SER 143 N 1.52 3.25 0.00 6.13 0.01 -1.26 -5.11 113.70 118.24 4ayk s SER 143 Ca 0.53 -0.49 0.00 0.00 1.31 0.00 0.00 55.95 57.30 4ayk s SER 143 Cb -0.22 -1.20 0.00 0.00 0.21 0.00 0.00 66.02 64.81 4ayk s SER 143 CO 0.17 0.20 0.00 0.61 0.41 0.00 0.00 173.24 174.64 4ayk n GLY 144 N 3.25 -2.52 3.85 3.44 0.00 -1.26 -4.84 105.19 107.10 4ayk n GLY 144 Ca -0.18 -0.08 -0.32 0.00 0.00 0.00 0.00 46.02 45.43 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 -1.98 6.72 -0.51 1.61 -1.08 -1.26 -5.00 116.67 115.17 4ayk s ASP 145 Ca 0.00 1.44 -0.24 0.00 -0.52 0.00 0.00 52.55 53.22 4ayk s ASP 145 Cb 0.00 -2.44 0.04 0.00 -1.46 0.00 0.00 42.92 39.05 4ayk s ASP 145 CO 0.00 -0.39 0.91 -0.69 0.52 0.00 0.00 175.17 175.52 4ayk s VAL 146 N -2.30 4.45 0.02 1.11 1.01 -1.26 -5.00 120.40 118.43 4ayk s VAL 146 Ca 0.57 0.41 -0.04 0.00 0.00 0.00 0.00 61.98 62.92 4ayk s VAL 146 Cb -0.10 -4.48 -0.01 0.00 0.00 0.00 0.00 36.38 31.79 4ayk s VAL 146 CO 0.23 -0.99 0.06 -1.10 0.00 0.00 0.00 175.10 173.30 4ayk s GLN 147 N 3.80 0.45 0.43 2.72 -0.21 -1.26 -5.14 119.66 120.45 4ayk s GLN 147 Ca 0.32 -0.59 -0.22 0.00 0.02 0.00 0.00 55.36 54.88 4ayk s GLN 147 Cb -0.12 0.17 -0.09 0.00 1.00 0.00 0.00 33.01 33.98 4ayk s GLN 147 CO 0.21 -0.10 1.03 -0.51 -2.12 0.00 0.00 175.29 173.81 4ayk s LEU 148 N -1.65 4.01 0.27 2.90 1.43 -1.26 -4.77 118.68 119.61 4ayk s LEU 148 Ca -0.12 1.96 -0.06 0.00 -1.03 0.00 0.00 54.13 54.88 4ayk s LEU 148 Cb -0.06 -4.36 -0.06 0.00 0.03 0.00 0.00 46.19 41.74 4ayk s LEU 148 CO -0.01 -0.58 0.55 0.00 0.23 0.00 0.00 176.35 176.53 4ayk s ALA 149 N -1.83 3.61 0.28 4.21 0.00 -1.26 -4.94 121.76 121.83 4ayk s ALA 149 Ca 0.62 -0.48 -0.02 0.00 0.00 0.00 0.00 51.96 52.08 4ayk s ALA 149 Cb -0.19 -2.33 0.43 0.00 0.00 0.00 0.00 23.12 21.03 4ayk s ALA 149 CO 0.23 0.32 1.91 0.37 0.00 0.00 0.00 175.76 178.60 4ayk h GLN 150 N 1.94 1.12 -1.01 0.00 4.15 -1.96 0.37 115.11 119.73 4ayk h GLN 150 Ca -0.47 -0.07 0.14 0.00 0.77 0.00 0.00 58.65 59.02 4ayk h GLN 150 Cb 1.18 -0.25 -0.09 0.00 0.21 0.00 0.00 27.48 28.53 4ayk h GLN 150 CO 0.67 0.74 0.63 0.22 -1.93 0.00 0.00 178.83 179.16 4ayk h ASP 151 N 1.15 0.89 -0.20 -0.69 1.82 -1.98 0.47 116.42 117.88 4ayk h ASP 151 Ca 0.40 0.06 -0.21 0.00 -0.39 0.00 0.00 57.03 56.89 4ayk h ASP 151 Cb 0.10 -0.11 0.01 0.00 0.68 0.00 0.00 39.33 40.00 4ayk h ASP 151 CO -0.14 0.43 -0.71 0.44 -1.61 0.00 0.00 179.24 177.65 4ayk h ASP 152 N 0.93 0.96 0.02 2.28 3.32 -1.37 -1.08 116.42 121.48 4ayk h ASP 152 Ca 0.52 -0.59 -0.00 0.00 0.02 0.00 0.00 57.03 56.98 4ayk h ASP 152 Cb 0.61 -0.28 0.00 0.00 0.22 0.00 0.00 39.33 39.88 4ayk h ASP 152 CO -0.30 1.40 -0.01 0.40 -1.72 0.00 0.00 179.24 179.01 4ayk h ILE 153 N 0.59 1.04 -0.90 0.35 1.08 0.47 0.23 117.51 120.36 4ayk h ILE 153 Ca -0.03 -0.16 -0.02 0.00 -0.39 0.00 0.00 64.86 64.26 4ayk h ILE 153 Cb 1.33 1.15 -0.04 0.00 -3.07 0.00 0.00 36.82 36.19 4ayk h ILE 153 CO 0.15 0.04 0.49 0.44 -0.69 0.00 0.00 178.15 178.59 4ayk h ASP 154 N -0.10 1.13 0.36 1.72 3.32 -0.19 0.16 116.42 122.81 4ayk h ASP 154 Ca -0.00 -0.10 -0.02 0.00 0.02 0.00 0.00 57.03 56.93 4ayk h ASP 154 Cb 0.09 -0.29 0.00 0.00 0.22 0.00 0.00 39.33 39.35 4ayk h ASP 154 CO 0.00 0.91 -0.17 1.23 -1.72 0.00 0.00 179.24 179.49 4ayk h GLY 155 N 1.27 -0.50 1.04 2.75 0.00 -0.78 0.44 103.07 107.28 4ayk h GLY 155 Ca 0.32 0.19 -0.04 0.00 0.00 0.00 0.00 47.33 47.79 4ayk h GLY 155 CO -0.05 -0.18 0.33 1.19 0.00 0.00 0.00 176.54 177.82 4ayk h ILE 156 N -0.87 1.26 -0.35 2.60 6.09 -0.52 -1.73 117.51 123.99 4ayk h ILE 156 Ca -0.05 -0.81 -0.15 0.00 -1.37 0.00 0.00 64.86 62.48 4ayk h ILE 156 Cb 0.53 0.30 -0.01 0.00 0.47 0.00 0.00 36.82 38.12 4ayk h ILE 156 CO 0.08 0.33 -0.38 1.56 -3.07 0.00 0.00 178.15 176.67 4ayk h GLN 157 N 1.15 0.84 -0.65 2.19 4.20 -0.71 -2.64 115.11 119.50 4ayk h GLN 157 Ca 0.27 -0.44 0.01 0.00 0.06 0.00 0.00 58.65 58.55 4ayk h GLN 157 Cb 0.20 0.01 -0.03 0.00 0.30 0.00 0.00 27.48 27.96 4ayk h GLN 157 CO -0.02 1.07 0.43 0.00 -0.67 0.00 0.00 178.83 179.64 4ayk h ALA 158 N 0.87 0.83 0.01 3.87 0.00 0.30 2.33 119.26 127.46 4ayk h ALA 158 Ca 0.06 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 4ayk h ALA 158 Cb 0.95 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.48 4ayk h ALA 158 CO 0.09 0.24 -0.00 0.82 0.00 0.00 0.00 179.25 180.40 4ayk h ILE 159 N 0.87 1.06 0.00 0.00 2.04 -1.22 -3.39 117.51 116.87 4ayk h ILE 159 Ca 0.24 -0.18 0.00 0.00 1.00 0.00 0.00 64.86 65.92 4ayk h ILE 159 Cb -0.09 1.18 0.00 0.00 -0.74 0.00 0.00 36.82 37.17 4ayk h ILE 159 CO -0.06 0.05 -0.06 -1.22 0.00 0.00 0.00 178.15 176.86 4ayk n TYR 160 N -5.06 0.02 -2.45 1.37 4.01 -1.00 -5.13 117.16 108.92 4ayk n TYR 160 Ca -0.07 0.01 0.00 0.00 -0.16 0.00 0.00 57.90 57.68 4ayk n TYR 160 Cb 0.07 -0.12 0.00 0.00 -0.31 0.00 0.00 39.34 38.97 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 1.58 -1.78 3.86 2.72 0.00 0.78 -5.03 105.19 107.32 4ayk n GLY 161 Ca -0.01 -1.18 -0.33 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 -1.72 3.93 -0.99 1.61 0.52 -1.26 -4.37 118.95 116.67 4ayk s ARG 162 Ca 0.00 0.47 -0.23 0.00 -0.52 0.00 0.00 55.73 55.45 4ayk s ARG 162 Cb 0.00 -2.69 -0.01 0.00 0.52 0.00 0.00 34.95 32.77 4ayk s ARG 162 CO 0.00 0.33 1.76 -1.12 0.02 0.00 0.00 175.30 176.28 4ayk s SER 163 N -2.12 5.71 -0.07 0.23 0.01 -1.26 -4.77 113.70 111.44 4ayk s SER 163 Ca 0.46 -1.12 0.00 0.00 1.31 0.00 0.00 55.95 56.60 4ayk s SER 163 Cb -0.12 -2.57 0.07 0.00 0.21 0.00 0.00 66.02 63.61 4ayk s SER 163 CO 0.20 -2.25 1.44 0.00 0.41 0.00 0.00 173.24 173.04 4ayk n GLN 164 N 8.80 1.18 -2.91 12.44 1.13 -1.26 -4.23 117.38 132.52 4ayk n GLN 164 Ca 0.38 -0.39 -0.13 0.00 -1.94 0.00 0.00 57.00 54.92 4ayk n GLN 164 Cb 0.48 -1.15 0.00 0.00 0.11 0.00 0.00 30.24 29.68 4ayk n GLN 164 CO 0.00 0.00 0.00 0.09 -1.44 0.00 0.00 177.06 175.71 4ayk n ASN 165 N 0.62 -2.06 -3.69 1.08 4.13 -1.26 -5.05 115.26 109.04 4ayk n ASN 165 Ca 0.08 -3.01 -0.42 0.00 1.68 0.00 0.00 54.58 52.91 4ayk n ASN 165 Cb 0.60 1.02 -0.00 0.00 -1.54 0.00 0.00 39.78 39.86 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 1.92 3.19 -3.03 3.52 -0.04 -1.26 -4.96 135.00 134.34 4ayk n PRO 166 Ca 0.15 -2.77 -0.40 0.00 -0.04 0.00 0.00 63.50 60.45 4ayk n PRO 166 Cb 0.58 -3.13 -0.05 0.00 -0.04 0.00 0.00 33.50 30.86 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 4.75 0.50 0.52 0.11 -1.26 -5.04 120.40 122.30 4ayk s VAL 167 Ca 0.49 1.55 -0.21 0.00 -2.93 0.00 0.00 61.98 60.88 4ayk s VAL 167 Cb 0.14 -4.08 -0.07 0.00 -1.53 0.00 0.00 36.38 30.84 4ayk s VAL 167 CO -0.07 0.38 1.11 -1.10 -3.33 0.00 0.00 175.10 172.09 4ayk s GLN 168 N -0.13 3.60 0.00 1.54 -0.21 -1.26 -5.20 119.66 118.00 4ayk s GLN 168 Ca 0.37 1.57 0.00 0.00 0.02 0.00 0.00 55.36 57.31 4ayk s GLN 168 Cb -0.20 -2.13 0.00 0.00 1.00 0.00 0.00 33.01 31.68 4ayk s GLN 168 CO 0.22 -0.64 0.48 -0.35 -2.12 0.00 0.00 175.29 172.88