#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 4ayk h LEU 2 N 0.00 0.82 -9.10 1.34 6.46 -2.10 -3.39 115.31 109.34 4ayk h LEU 2 Ca 0.00 -0.03 -0.61 0.00 -0.12 0.00 0.00 57.88 57.11 4ayk h LEU 2 Cb 0.00 -0.21 -0.13 0.00 -0.73 0.00 0.00 40.66 39.60 4ayk h LEU 2 CO 0.00 0.61 -0.30 0.42 -0.62 0.00 0.00 178.44 178.55 4ayk s THR 3 N -6.09 5.25 -0.31 1.05 -4.23 -1.26 -5.04 115.64 105.01 4ayk s THR 3 Ca -0.13 0.52 -0.29 0.00 -1.18 0.00 0.00 61.69 60.61 4ayk s THR 3 Cb 0.14 -3.65 0.02 0.00 1.34 0.00 0.00 72.50 70.35 4ayk s THR 3 CO 0.77 0.27 1.05 -0.70 -0.54 0.00 0.00 174.62 175.48 4ayk s GLU 4 N 1.32 4.07 2.61 3.99 2.12 -1.26 -4.76 118.70 126.79 4ayk s GLU 4 Ca 0.15 1.05 0.00 0.00 0.36 0.00 0.00 54.97 56.53 4ayk s GLU 4 Cb -0.14 -3.73 0.00 0.00 0.26 0.00 0.00 34.13 30.51 4ayk s GLU 4 CO 0.07 -0.87 0.00 0.41 -0.54 0.00 0.00 175.26 174.33 4ayk n GLY 5 N 3.87 0.37 2.45 -1.50 0.00 -1.26 -3.25 105.19 105.87 4ayk n GLY 5 Ca 0.11 0.68 -0.24 0.00 0.00 0.00 0.00 46.02 46.57 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 1.22 1.02 1.61 0.01 -1.26 -4.91 114.94 108.63 4ayk s ASN 6 Ca 0.00 -2.79 -0.03 0.00 -0.71 0.00 0.00 52.86 49.34 4ayk s ASN 6 Cb 0.00 -0.14 0.04 0.00 0.41 0.00 0.00 41.25 41.56 4ayk s ASN 6 CO 0.00 -0.17 0.16 -0.81 -1.51 0.00 0.00 177.10 174.77 4ayk n PRO 7 N 3.02 -0.93 -2.33 -0.60 -0.04 -1.20 -4.91 135.00 128.01 4ayk n PRO 7 Ca 0.26 -0.26 -0.23 0.00 -0.04 0.00 0.00 63.50 63.24 4ayk n PRO 7 Cb 0.48 -0.22 0.13 0.00 -0.04 0.00 0.00 33.50 33.85 4ayk n PRO 7 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 4ayk n ARG 8 N -1.78 -0.28 -2.80 0.54 1.74 -1.26 -4.79 116.66 108.03 4ayk n ARG 8 Ca 0.02 -2.44 -0.42 0.00 -0.77 0.00 0.00 57.85 54.23 4ayk n ARG 8 Cb 0.08 -0.75 -0.03 0.00 -1.02 0.00 0.00 32.46 30.74 4ayk n ARG 8 CO 0.00 0.00 0.00 -1.58 -1.52 0.00 0.00 177.63 174.53 4ayk s TRP 9 N -3.05 3.26 -0.96 -1.55 0.52 -1.26 -4.89 118.94 111.02 4ayk s TRP 9 Ca 0.64 1.16 0.27 0.00 0.02 0.00 0.00 56.10 58.19 4ayk s TRP 9 Cb -0.03 -3.26 0.81 0.00 -1.15 0.00 0.00 33.47 29.83 4ayk s TRP 9 CO 0.43 -0.53 1.64 0.39 0.02 0.00 0.00 176.95 178.90 4ayk n GLU 10 N 6.29 0.04 -2.96 4.98 1.02 -1.26 -4.86 120.64 123.89 4ayk n GLU 10 Ca 0.08 0.02 -0.32 0.00 -0.02 0.00 0.00 57.16 56.91 4ayk n GLU 10 Cb 0.47 -1.53 -0.06 0.00 -0.02 0.00 0.00 31.44 30.30 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 -3.02 4.04 0.00 3.49 -0.21 -1.26 -4.96 119.66 117.74 4ayk s GLN 11 Ca 0.12 0.80 0.24 0.00 0.02 0.00 0.00 55.36 56.54 4ayk s GLN 11 Cb 0.18 -2.33 0.34 0.00 1.00 0.00 0.00 33.01 32.19 4ayk s GLN 11 CO 0.63 0.05 1.31 0.25 -2.12 0.00 0.00 175.29 175.41 4ayk n THR 12 N -0.65 0.00 -4.60 -0.19 -2.24 -1.26 -4.88 114.28 100.47 4ayk n THR 12 Ca 0.05 -0.25 -0.22 0.00 -2.27 0.00 0.00 64.05 61.35 4ayk n THR 12 Cb 0.54 0.97 -0.15 0.00 -2.10 0.00 0.00 70.33 69.58 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 -2.38 1.32 0.10 4.78 3.76 -1.26 -2.67 115.29 118.93 4ayk s HIS 13 Ca 0.23 -0.28 0.02 0.00 -0.15 0.00 0.00 55.06 54.88 4ayk s HIS 13 Cb 0.19 -0.83 -0.04 0.00 1.11 0.00 0.00 32.58 33.01 4ayk s HIS 13 CO 0.50 -0.00 -0.07 -0.51 -0.85 0.00 0.00 174.74 173.81 4ayk s LEU 14 N -0.58 2.51 0.16 0.89 1.43 -0.62 -4.96 118.68 117.50 4ayk s LEU 14 Ca 0.05 -1.01 0.07 0.00 -1.03 0.00 0.00 54.13 52.21 4ayk s LEU 14 Cb -0.06 -0.08 -0.04 0.00 0.03 0.00 0.00 46.19 46.04 4ayk s LEU 14 CO 0.00 -0.46 -0.14 0.42 0.23 0.00 0.00 176.35 176.39 4ayk s THR 15 N -3.62 1.53 0.08 5.49 -4.23 -1.26 -2.40 115.64 111.24 4ayk s THR 15 Ca 0.12 -1.96 -0.08 0.00 -1.18 0.00 0.00 61.69 58.59 4ayk s THR 15 Cb 0.05 -1.80 -0.01 0.00 1.34 0.00 0.00 72.50 72.09 4ayk s THR 15 CO -0.05 -0.50 0.16 -0.72 -0.54 0.00 0.00 174.62 172.98 4ayk s TYR 16 N -2.55 0.20 -0.15 3.99 1.13 -1.09 -1.86 117.35 117.02 4ayk s TYR 16 Ca 0.16 -0.64 -0.10 0.00 -1.41 0.00 0.00 57.07 55.08 4ayk s TYR 16 Cb -0.03 -0.10 0.05 0.00 -1.10 0.00 0.00 41.96 40.78 4ayk s TYR 16 CO 0.05 -0.52 0.37 0.50 -2.51 0.00 0.00 175.55 173.44 4ayk s ARG 17 N -3.85 0.38 -0.28 -3.49 3.52 -1.06 -2.74 118.95 111.43 4ayk s ARG 17 Ca 0.05 0.65 -0.21 0.00 -0.13 0.00 0.00 55.73 56.09 4ayk s ARG 17 Cb 0.05 0.05 -0.01 0.00 -1.56 0.00 0.00 34.95 33.48 4ayk s ARG 17 CO -0.11 -0.12 0.65 0.42 -0.81 0.00 0.00 175.30 175.34 4ayk s ILE 18 N 0.92 4.94 0.17 4.11 1.01 -1.26 -2.20 121.20 128.89 4ayk s ILE 18 Ca -0.06 1.03 -0.10 0.00 0.00 0.00 0.00 60.65 61.53 4ayk s ILE 18 Cb -0.06 -3.99 0.05 0.00 0.01 0.00 0.00 42.46 38.46 4ayk s ILE 18 CO -0.07 -0.08 1.61 -0.33 0.00 0.00 0.00 174.94 176.07 4ayk h GLU 19 N 8.04 1.05 -2.63 2.79 5.08 -1.57 -3.46 114.58 123.88 4ayk h GLU 19 Ca -0.26 -0.37 -0.07 0.00 -1.00 0.00 0.00 59.36 57.66 4ayk h GLU 19 Cb 1.12 -0.08 -0.18 0.00 0.50 0.00 0.00 28.75 30.11 4ayk h GLU 19 CO 0.80 1.06 0.02 -0.80 -1.00 0.00 0.00 179.01 179.09 4ayk s ASN 20 N -6.61 -0.44 -0.18 1.42 0.01 -1.26 -5.09 114.94 102.79 4ayk s ASN 20 Ca -0.12 0.29 -0.08 0.00 -0.71 0.00 0.00 52.86 52.24 4ayk s ASN 20 Cb 0.13 0.47 -0.04 0.00 0.41 0.00 0.00 41.25 42.22 4ayk s ASN 20 CO 0.86 -0.64 0.11 -0.31 -1.51 0.00 0.00 177.10 175.61 4ayk s TYR 21 N -1.93 3.38 0.28 2.20 2.02 -1.26 -4.63 117.35 117.42 4ayk s TYR 21 Ca -0.08 0.28 -0.29 0.00 -0.37 0.00 0.00 57.07 56.60 4ayk s TYR 21 Cb -0.01 -2.09 -0.10 0.00 -0.40 0.00 0.00 41.96 39.36 4ayk s TYR 21 CO 0.02 0.33 1.28 -0.08 -1.57 0.00 0.00 175.55 175.53 4ayk s THR 22 N 0.09 2.97 -1.11 -0.71 -1.32 -1.26 -4.87 115.64 109.43 4ayk s THR 22 Ca 0.08 0.91 0.07 0.00 -1.21 0.00 0.00 61.69 61.54 4ayk s THR 22 Cb -0.12 -3.58 0.07 0.00 -1.51 0.00 0.00 72.50 67.36 4ayk s THR 22 CO -0.00 0.19 1.17 -0.81 -2.21 0.00 0.00 174.62 172.96 4ayk n PRO 23 N 1.43 0.02 -0.38 7.08 -0.04 -1.26 -2.60 135.00 139.25 4ayk n PRO 23 Ca 0.02 0.35 -0.02 0.00 -0.04 0.00 0.00 63.50 63.80 4ayk n PRO 23 Cb 0.42 -1.50 0.11 0.00 -0.04 0.00 0.00 33.50 32.49 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 -4.67 3.54 3.32 -1.94 -3.43 116.42 114.39 4ayk h ASP 24 Ca 0.00 -0.03 -0.29 0.00 0.02 0.00 0.00 57.03 56.73 4ayk h ASP 24 Cb 0.10 -0.29 -0.22 0.00 0.22 0.00 0.00 39.33 39.14 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 -10.10 2.23 0.00 1.55 1.43 -1.07 -4.99 118.68 107.73 4ayk s LEU 25 Ca -0.13 -0.51 -0.14 0.00 -1.03 0.00 0.00 54.13 52.32 4ayk s LEU 25 Cb 0.18 -0.19 0.21 0.00 0.03 0.00 0.00 46.19 46.42 4ayk s LEU 25 CO 0.82 -0.17 0.48 -0.81 0.23 0.00 0.00 176.35 176.90 4ayk n PRO 26 N 1.59 -3.60 0.00 1.29 -0.04 -1.26 -4.55 135.00 128.43 4ayk n PRO 26 Ca -0.22 -0.81 -0.18 0.00 -0.04 0.00 0.00 63.50 62.26 4ayk n PRO 26 Cb 0.55 -1.05 -0.14 0.00 -0.04 0.00 0.00 33.50 32.82 4ayk n PRO 26 CO 0.00 0.00 0.00 2.89 -0.04 0.00 0.00 175.50 178.35 4ayk n ARG 27 N -4.11 0.73 -0.16 0.54 1.85 -1.26 -3.20 116.66 111.05 4ayk n ARG 27 Ca 0.08 0.28 -0.05 0.00 -1.00 0.00 0.00 57.85 57.15 4ayk n ARG 27 Cb 0.33 -1.74 0.04 0.00 -1.05 0.00 0.00 32.46 30.04 4ayk n ARG 27 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 4ayk h ALA 28 N 0.33 0.61 -0.34 2.89 0.00 -1.98 0.60 119.26 121.38 4ayk h ALA 28 Ca -0.38 0.01 -0.17 0.00 0.00 0.00 0.00 54.91 54.37 4ayk h ALA 28 Cb 2.03 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 19.73 4ayk h ALA 28 CO 0.09 -0.08 -0.47 -0.44 0.00 0.00 0.00 179.25 178.35 4ayk h ASP 29 N 0.51 0.98 -0.17 0.00 3.32 -1.95 -2.21 116.42 116.90 4ayk h ASP 29 Ca 0.21 -0.49 -0.07 0.00 0.02 0.00 0.00 57.03 56.69 4ayk h ASP 29 Cb 0.09 -0.28 -0.00 0.00 0.22 0.00 0.00 39.33 39.36 4ayk h ASP 29 CO -0.13 1.29 -0.17 0.58 -1.72 0.00 0.00 179.24 179.09 4ayk h VAL 30 N 0.71 1.34 -1.00 -1.35 2.07 -1.41 -2.52 116.25 114.09 4ayk h VAL 30 Ca 0.04 -1.32 0.01 0.00 0.82 0.00 0.00 66.70 66.24 4ayk h VAL 30 Cb 1.07 1.81 -0.05 0.00 -1.52 0.00 0.00 31.29 32.60 4ayk h VAL 30 CO 0.11 0.40 0.66 -0.78 0.02 0.00 0.00 177.57 177.98 4ayk h ASP 31 N 0.07 1.15 -0.75 0.57 1.82 0.18 -1.68 116.42 117.77 4ayk h ASP 31 Ca 0.03 -0.03 0.01 0.00 -0.39 0.00 0.00 57.03 56.65 4ayk h ASP 31 Cb 0.70 -0.29 -0.04 0.00 0.68 0.00 0.00 39.33 40.39 4ayk h ASP 31 CO 0.04 0.83 0.49 -0.74 -1.61 0.00 0.00 179.24 178.25 4ayk h HIS 32 N 1.35 0.95 -0.93 0.28 2.76 -1.31 0.85 115.15 119.10 4ayk h HIS 32 Ca 0.37 0.02 0.01 0.00 -2.20 0.00 0.00 60.37 58.57 4ayk h HIS 32 Cb -0.15 -0.32 -0.05 0.00 1.55 0.00 0.00 27.41 28.44 4ayk h HIS 32 CO -0.00 0.60 0.62 0.00 -1.30 0.00 0.00 177.93 177.85 4ayk h ALA 33 N 1.27 1.19 -0.24 5.26 0.00 -0.88 -0.84 119.26 125.02 4ayk h ALA 33 Ca 0.27 -0.06 -0.15 0.00 0.00 0.00 0.00 54.91 54.97 4ayk h ALA 33 Cb -0.11 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 17.30 4ayk h ALA 33 CO -0.06 0.58 -0.48 0.82 0.00 0.00 0.00 179.25 180.11 4ayk h ILE 34 N 1.27 1.30 -0.52 0.00 1.08 -0.71 -2.79 117.51 117.15 4ayk h ILE 34 Ca 0.34 -1.69 -0.07 0.00 -0.39 0.00 0.00 64.86 63.06 4ayk h ILE 34 Cb -0.15 1.64 -0.02 0.00 -3.07 0.00 0.00 36.82 35.22 4ayk h ILE 34 CO -0.07 0.53 0.04 -0.08 -0.69 0.00 0.00 178.15 177.88 4ayk h GLU 35 N 0.50 0.88 -0.81 2.37 4.81 -0.12 -2.68 114.58 119.53 4ayk h GLU 35 Ca 0.03 -0.26 -0.04 0.00 -0.13 0.00 0.00 59.36 58.96 4ayk h GLU 35 Cb 1.02 -0.09 -0.04 0.00 0.63 0.00 0.00 28.75 30.27 4ayk h GLU 35 CO 0.10 0.89 0.37 0.87 -0.73 0.00 0.00 179.01 180.50 4ayk h LYS 36 N 0.76 1.18 -0.01 1.92 1.57 -1.13 -1.21 116.57 119.66 4ayk h LYS 36 Ca 0.15 -0.18 0.00 0.00 -1.87 0.00 0.00 60.65 58.75 4ayk h LYS 36 Cb 0.46 -0.21 -0.00 0.00 0.08 0.00 0.00 32.23 32.57 4ayk h LYS 36 CO 0.02 0.92 0.00 0.00 -0.57 0.00 0.00 179.45 179.82 4ayk h ALA 37 N 1.24 0.01 -0.82 3.86 0.00 -1.23 0.93 119.26 123.24 4ayk h ALA 37 Ca 0.28 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.17 4ayk h ALA 37 Cb 0.15 -0.00 -0.04 0.00 0.00 0.00 0.00 17.79 17.90 4ayk h ALA 37 CO -0.03 -0.49 0.44 0.74 0.00 0.00 0.00 179.25 179.91 4ayk h PHE 38 N 0.01 1.13 -0.79 0.00 0.04 -1.28 -2.38 116.94 113.66 4ayk h PHE 38 Ca 0.00 -0.03 0.00 0.00 2.80 0.00 0.00 57.97 60.75 4ayk h PHE 38 Cb -0.00 -0.36 -0.04 0.00 2.20 0.00 0.00 35.95 37.75 4ayk h PHE 38 CO -0.08 0.79 0.51 1.96 -0.60 0.00 0.00 178.31 180.89 4ayk h GLN 39 N 1.14 1.05 -0.95 1.51 4.20 -0.66 -0.13 115.11 121.27 4ayk h GLN 39 Ca 0.29 -0.07 0.01 0.00 0.06 0.00 0.00 58.65 58.94 4ayk h GLN 39 Cb 0.04 -0.23 -0.05 0.00 0.30 0.00 0.00 27.48 27.54 4ayk h GLN 39 CO -0.04 0.71 0.63 -0.07 -0.67 0.00 0.00 178.83 179.38 4ayk h LEU 40 N 1.08 1.08 -0.18 1.46 3.38 -0.32 0.60 115.31 122.41 4ayk h LEU 40 Ca 0.29 -0.03 -0.22 0.00 0.09 0.00 0.00 57.88 58.02 4ayk h LEU 40 Cb -0.10 -0.27 0.01 0.00 0.09 0.00 0.00 40.66 40.39 4ayk h LEU 40 CO -0.06 0.78 -0.73 -0.50 0.09 0.00 0.00 178.44 178.01 4ayk h TRP 41 N 1.27 1.09 0.00 1.13 4.06 -1.18 -3.08 115.95 119.24 4ayk h TRP 41 Ca 0.35 -0.46 -0.07 0.00 2.06 0.00 0.00 58.89 60.77 4ayk h TRP 41 Cb -0.13 -0.18 -0.01 0.00 -1.00 0.00 0.00 29.16 27.85 4ayk h TRP 41 CO -0.01 1.30 -0.33 1.03 -3.56 0.00 0.00 178.44 176.88 4ayk h SER 42 N 0.57 0.00 -0.61 -3.49 0.87 -0.51 -2.53 113.55 107.86 4ayk h SER 42 Ca -0.04 0.00 0.01 0.00 -1.23 0.00 0.00 61.79 60.53 4ayk h SER 42 Cb 1.36 0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 63.29 4ayk h SER 42 CO 0.15 0.33 0.40 0.78 -0.53 0.00 0.00 176.83 177.96 4ayk h ASN 43 N 0.00 0.69 -0.43 6.23 2.35 0.30 -2.30 115.58 122.43 4ayk h ASN 43 Ca -0.00 -0.02 0.00 0.00 -0.55 0.00 0.00 56.30 55.73 4ayk h ASN 43 Cb 0.75 -0.17 0.00 0.00 0.05 0.00 0.00 38.32 38.95 4ayk h ASN 43 CO 0.04 0.50 0.00 1.33 -1.65 0.00 0.00 177.43 177.65 4ayk n VAL 44 N -4.45 1.04 -3.93 2.81 0.24 -1.15 -4.97 118.33 107.92 4ayk n VAL 44 Ca 0.06 -1.02 -0.10 0.00 -2.04 0.00 0.00 64.34 61.24 4ayk n VAL 44 Cb 0.05 0.48 -0.12 0.00 -1.47 0.00 0.00 33.84 32.78 4ayk n VAL 44 CO 0.00 0.00 0.00 0.42 -2.14 0.00 0.00 176.83 175.11 4ayk s THR 45 N -1.05 0.08 -2.00 3.34 -4.23 -0.86 -4.11 115.64 106.80 4ayk s THR 45 Ca 0.29 -0.63 0.07 0.00 -1.18 0.00 0.00 61.69 60.24 4ayk s THR 45 Cb 0.15 -0.23 0.20 0.00 1.34 0.00 0.00 72.50 73.96 4ayk s THR 45 CO 0.19 -0.34 0.93 -0.81 -0.54 0.00 0.00 174.62 174.05 4ayk n PRO 46 N 1.97 0.59 -1.76 3.99 -0.04 -1.26 -4.50 135.00 134.00 4ayk n PRO 46 Ca -0.21 0.00 -0.33 0.00 -0.04 0.00 0.00 63.50 62.93 4ayk n PRO 46 Cb 0.56 -1.19 0.04 0.00 -0.04 0.00 0.00 33.50 32.88 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 -1.37 3.36 0.05 1.53 1.43 -1.26 -4.95 118.68 117.46 4ayk s LEU 47 Ca 0.10 1.90 0.03 0.00 -1.03 0.00 0.00 54.13 55.14 4ayk s LEU 47 Cb 0.05 -4.54 -0.03 0.00 0.03 0.00 0.00 46.19 41.70 4ayk s LEU 47 CO 0.08 -1.54 -0.10 0.42 0.23 0.00 0.00 176.35 175.44 4ayk s THR 48 N -2.49 0.69 0.16 5.49 -4.23 -1.09 -4.63 115.64 109.54 4ayk s THR 48 Ca 0.65 -1.13 0.08 0.00 -1.18 0.00 0.00 61.69 60.11 4ayk s THR 48 Cb -0.18 -0.73 -0.04 0.00 1.34 0.00 0.00 72.50 72.88 4ayk s THR 48 CO 0.43 -0.33 -0.17 -0.36 -0.54 0.00 0.00 174.62 173.65 4ayk s PHE 49 N -1.33 1.73 -0.16 3.99 0.40 -1.26 -1.59 117.98 119.76 4ayk s PHE 49 Ca -0.08 -0.49 -0.13 0.00 -0.60 0.00 0.00 56.93 55.63 4ayk s PHE 49 Cb -0.10 -0.87 0.05 0.00 0.51 0.00 0.00 43.02 42.61 4ayk s PHE 49 CO 0.01 0.29 0.42 0.99 0.70 0.00 0.00 175.22 177.63 4ayk s THR 50 N -2.08 -0.01 0.18 0.64 2.01 -1.01 -4.97 115.64 110.41 4ayk s THR 50 Ca 0.14 0.03 -0.30 0.00 0.31 0.00 0.00 61.69 61.87 4ayk s THR 50 Cb -0.05 -0.59 -0.08 0.00 0.01 0.00 0.00 72.50 71.79 4ayk s THR 50 CO 0.06 0.01 1.00 -0.75 -0.69 0.00 0.00 174.62 174.25 4ayk s LYS 51 N 0.55 4.72 -0.06 4.92 2.47 -1.26 -2.66 119.74 128.41 4ayk s LYS 51 Ca -0.03 1.56 0.05 0.00 -1.56 0.00 0.00 55.97 56.00 4ayk s LYS 51 Cb -0.04 -3.31 -0.01 0.00 -1.46 0.00 0.00 37.83 33.01 4ayk s LYS 51 CO -0.03 0.27 -0.23 0.14 0.16 0.00 0.00 175.35 175.66 4ayk s VAL 52 N -0.52 1.89 -1.75 4.02 -7.23 -1.11 -4.95 120.40 110.76 4ayk s VAL 52 Ca 0.46 -0.97 0.23 0.00 -1.81 0.00 0.00 61.98 59.89 4ayk s VAL 52 Cb -0.26 -1.61 0.01 0.00 0.56 0.00 0.00 36.38 35.07 4ayk s VAL 52 CO 0.33 0.53 1.17 -0.24 -0.31 0.00 0.00 175.10 176.58 4ayk n SER 53 N 3.10 1.57 -3.91 4.85 2.88 -1.26 -4.73 113.62 116.12 4ayk n SER 53 Ca -0.18 -1.23 -0.10 0.00 -1.33 0.00 0.00 58.87 56.03 4ayk n SER 53 Cb 0.52 0.49 -0.09 0.00 -0.75 0.00 0.00 64.21 64.38 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 -2.60 0.56 0.00 -1.46 2.02 -1.26 -5.11 118.70 110.85 4ayk s GLU 54 Ca 0.17 -0.64 0.00 0.00 0.02 0.00 0.00 54.97 54.53 4ayk s GLU 54 Cb 0.18 0.22 0.00 0.00 0.10 0.00 0.00 34.13 34.63 4ayk s GLU 54 CO 0.62 -0.14 0.00 0.41 0.02 0.00 0.00 175.26 176.17 4ayk n GLY 55 N 0.97 -2.08 3.81 -1.39 0.00 -1.26 -4.89 105.19 100.35 4ayk n GLY 55 Ca -0.20 -1.50 -0.35 0.00 0.00 0.00 0.00 46.02 43.97 4ayk n GLY 55 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 4ayk s GLN 56 N -2.44 4.35 0.20 1.61 -1.52 -1.26 -5.06 119.66 115.53 4ayk s GLN 56 Ca 0.00 1.13 0.06 0.00 -1.95 0.00 0.00 55.36 54.60 4ayk s GLN 56 Cb 0.00 -2.51 -0.04 0.00 -0.22 0.00 0.00 33.01 30.24 4ayk s GLN 56 CO 0.00 0.15 0.16 0.00 -0.25 0.00 0.00 175.29 175.34 4ayk s ALA 57 N -1.88 3.57 0.29 6.09 0.00 -1.26 -5.00 121.76 123.56 4ayk s ALA 57 Ca 0.55 -1.29 -0.03 0.00 0.00 0.00 0.00 51.96 51.19 4ayk s ALA 57 Cb -0.14 -1.34 0.41 0.00 0.00 0.00 0.00 23.12 22.05 4ayk s ALA 57 CO 0.18 0.41 1.95 -0.44 0.00 0.00 0.00 175.76 177.87 4ayk h ASP 58 N 2.08 0.99 -3.31 0.00 3.32 -1.88 -3.39 116.42 114.23 4ayk h ASP 58 Ca -0.48 -0.02 -0.67 0.00 0.02 0.00 0.00 57.03 55.88 4ayk h ASP 58 Cb 1.21 -0.24 -0.32 0.00 0.22 0.00 0.00 39.33 40.20 4ayk h ASP 58 CO 0.62 0.71 -0.79 -0.63 -1.72 0.00 0.00 179.24 177.44 4ayk s ILE 59 N -5.97 2.66 -0.20 0.35 1.01 -0.78 -4.70 121.20 113.57 4ayk s ILE 59 Ca -0.12 -0.86 -0.10 0.00 0.00 0.00 0.00 60.65 59.57 4ayk s ILE 59 Cb 0.18 -2.23 -0.05 0.00 0.01 0.00 0.00 42.46 40.37 4ayk s ILE 59 CO 0.80 0.39 0.12 -0.04 0.00 0.00 0.00 174.94 176.22 4ayk s MET 60 N 1.35 4.16 -0.12 2.79 -1.94 -1.25 -2.56 119.30 121.72 4ayk s MET 60 Ca 0.03 -0.24 0.01 0.00 -1.71 0.00 0.00 55.69 53.79 4ayk s MET 60 Cb -0.15 -3.40 -0.01 0.00 2.01 0.00 0.00 34.83 33.28 4ayk s MET 60 CO -0.08 0.28 -0.16 0.42 -0.01 0.00 0.00 175.02 175.48 4ayk s ILE 61 N 0.41 2.82 0.11 2.53 1.01 -0.93 -0.29 121.20 126.86 4ayk s ILE 61 Ca 0.07 -0.75 -0.10 0.00 0.00 0.00 0.00 60.65 59.87 4ayk s ILE 61 Cb -0.11 -2.16 0.00 0.00 0.01 0.00 0.00 42.46 40.20 4ayk s ILE 61 CO -0.01 0.54 0.25 -0.94 0.00 0.00 0.00 174.94 174.78 4ayk s SER 62 N 0.28 0.04 -0.05 3.58 1.04 -0.97 -1.20 113.70 116.41 4ayk s SER 62 Ca -0.11 -0.64 0.04 0.00 0.48 0.00 0.00 55.95 55.72 4ayk s SER 62 Cb -0.16 0.39 -0.03 0.00 0.10 0.00 0.00 66.02 66.32 4ayk s SER 62 CO 0.06 -0.79 -0.14 -0.36 0.98 0.00 0.00 173.24 172.99 4ayk s PHE 63 N -3.87 2.71 0.27 5.02 0.08 -1.26 -2.22 117.98 118.70 4ayk s PHE 63 Ca 0.07 -0.15 0.02 0.00 0.12 0.00 0.00 56.93 56.99 4ayk s PHE 63 Cb 0.04 -1.63 -0.04 0.00 -0.57 0.00 0.00 43.02 40.82 4ayk s PHE 63 CO -0.09 0.19 0.16 0.14 -0.10 0.00 0.00 175.22 175.53 4ayk s VAL 64 N -0.73 0.18 0.00 -0.44 -7.23 -1.10 -4.94 120.40 106.14 4ayk s VAL 64 Ca 0.11 -2.00 0.01 0.00 -1.81 0.00 0.00 61.98 58.29 4ayk s VAL 64 Cb -0.11 -2.52 -0.01 0.00 0.56 0.00 0.00 36.38 34.31 4ayk s VAL 64 CO 0.00 0.00 -0.03 -0.13 -0.31 0.00 0.00 175.10 174.64 4ayk s ARG 65 N -3.89 0.24 0.74 4.82 0.52 -1.26 -1.87 118.95 118.24 4ayk s ARG 65 Ca 0.38 -0.20 0.00 0.00 -0.52 0.00 0.00 55.73 55.39 4ayk s ARG 65 Cb 0.06 -0.17 0.00 0.00 0.52 0.00 0.00 34.95 35.36 4ayk s ARG 65 CO 0.17 0.04 0.00 0.41 0.02 0.00 0.00 175.30 175.94 4ayk n GLY 66 N 2.73 1.43 3.72 -3.53 0.00 -1.26 -4.24 105.19 104.04 4ayk n GLY 66 Ca -0.15 -0.30 -0.42 0.00 0.00 0.00 0.00 46.02 45.15 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 6.95 -0.40 1.61 -1.08 -1.26 -3.74 116.67 114.75 4ayk s ASP 67 Ca 0.00 2.18 0.11 0.00 -0.52 0.00 0.00 52.55 54.32 4ayk s ASP 67 Cb 0.00 -2.58 0.34 0.00 -1.46 0.00 0.00 42.92 39.22 4ayk s ASP 67 CO 0.00 -0.55 0.75 0.00 0.52 0.00 0.00 175.17 175.89 4ayk n HIS 68 N 3.84 0.76 -3.74 -5.34 1.44 -1.26 -4.95 115.22 105.97 4ayk n HIS 68 Ca 0.10 -3.84 -0.23 0.00 -2.01 0.00 0.00 57.72 51.74 4ayk n HIS 68 Cb 0.44 -0.43 0.02 0.00 0.12 0.00 0.00 29.99 30.15 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 0.25 -4.13 -3.95 -1.40 1.74 -1.26 -4.98 116.66 102.93 4ayk n ARG 69 Ca 0.26 0.56 -0.08 0.00 -0.77 0.00 0.00 57.85 57.82 4ayk n ARG 69 Cb 0.61 -4.95 -0.08 0.00 -1.02 0.00 0.00 32.46 27.02 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 -4.26 0.26 0.00 0.55 -1.08 -1.26 -5.02 116.67 105.86 4ayk s ASP 70 Ca 0.06 -0.79 0.11 0.00 -0.52 0.00 0.00 52.55 51.40 4ayk s ASP 70 Cb -0.02 0.29 0.31 0.00 -1.46 0.00 0.00 42.92 42.04 4ayk s ASP 70 CO 0.83 -0.68 1.25 0.59 0.52 0.00 0.00 175.17 177.68 4ayk n ASN 71 N 0.00 1.79 -3.36 -0.34 5.03 -1.26 -4.35 115.26 112.76 4ayk n ASN 71 Ca -0.15 -1.99 -0.26 0.00 0.87 0.00 0.00 54.58 53.05 4ayk n ASN 71 Cb 0.62 -0.22 -0.09 0.00 -1.02 0.00 0.00 39.78 39.07 4ayk n ASN 71 CO 0.00 0.00 0.00 -0.24 -1.83 0.00 0.00 177.26 175.19 4ayk n SER 72 N 0.48 0.96 -4.77 6.41 2.88 -1.26 -5.12 113.62 113.20 4ayk n SER 72 Ca 0.11 -2.80 -0.37 0.00 -1.33 0.00 0.00 58.87 54.48 4ayk n SER 72 Cb 0.28 -0.63 -0.02 0.00 -0.75 0.00 0.00 64.21 63.08 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 -1.12 4.03 0.34 -1.46 0.04 -1.26 -4.95 135.00 130.61 4ayk s PRO 73 Ca 0.34 1.73 -0.27 0.00 0.04 0.00 0.00 61.00 62.84 4ayk s PRO 73 Cb 0.11 -2.59 -0.09 0.00 0.04 0.00 0.00 34.50 31.97 4ayk s PRO 73 CO -0.12 -0.31 1.09 -0.06 0.04 0.00 0.00 177.00 177.64 4ayk s PHE 74 N -1.51 3.41 -1.00 0.56 0.40 -1.25 -4.96 117.98 113.63 4ayk s PHE 74 Ca 0.58 1.66 -0.02 0.00 -0.60 0.00 0.00 56.93 58.56 4ayk s PHE 74 Cb -0.28 -3.24 0.31 0.00 0.51 0.00 0.00 43.02 40.32 4ayk s PHE 74 CO 0.34 -0.66 1.54 -3.47 0.70 0.00 0.00 175.22 173.67 4ayk n ASP 75 N 0.62 6.52 -0.42 1.36 -0.08 -1.25 -4.71 116.55 118.59 4ayk n ASP 75 Ca 0.02 -3.54 0.00 0.00 -1.51 0.00 0.00 54.79 49.76 4ayk n ASP 75 Cb 0.47 -1.15 0.00 0.00 2.34 0.00 0.00 41.12 42.77 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 0.66 -0.87 0.34 0.27 0.00 -1.26 -3.16 105.19 101.17 4ayk n GLY 76 Ca 0.35 -1.10 0.16 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 -7.26 1.61 0.11 -1.95 -3.41 132.00 121.09 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 0.09 0.00 0.11 0.00 0.00 31.00 31.20 4ayk h PRO 77 CO 0.00 0.00 0.18 0.20 -0.21 0.00 0.00 178.00 178.17 4ayk s GLY 78 N -3.81 1.75 0.00 -0.55 0.00 -1.19 -4.95 107.32 98.57 4ayk s GLY 78 Ca -0.04 -1.28 0.00 0.00 0.00 0.00 0.00 44.72 43.40 4ayk s GLY 78 CO 0.29 -0.78 0.00 0.61 0.00 0.00 0.00 173.10 173.22 4ayk n GLY 79 N -2.95 -1.79 3.80 0.20 0.00 -1.26 -3.91 105.19 99.27 4ayk n GLY 79 Ca 0.11 -1.81 -0.33 0.00 0.00 0.00 0.00 46.02 43.99 4ayk n GLY 79 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 4ayk s ASN 80 N -4.00 5.98 0.11 1.61 4.22 -1.26 -4.95 114.94 116.65 4ayk s ASN 80 Ca 0.00 1.91 0.23 0.00 -2.14 0.00 0.00 52.86 52.86 4ayk s ASN 80 Cb 0.00 -2.55 0.07 0.00 1.28 0.00 0.00 41.25 40.05 4ayk s ASN 80 CO 0.00 -1.03 1.05 0.18 -2.04 0.00 0.00 177.10 175.26 4ayk n LEU 81 N -1.53 0.67 -3.73 3.54 4.77 -1.26 -4.92 117.00 114.53 4ayk n LEU 81 Ca 0.09 0.16 -0.02 0.00 -0.03 0.00 0.00 56.01 56.22 4ayk n LEU 81 Cb 0.52 -0.10 -0.01 0.00 -2.33 0.00 0.00 43.42 41.51 4ayk n LEU 81 CO 0.44 -0.06 0.85 0.00 -1.33 0.00 0.00 177.39 177.29 4ayk s ALA 82 N -3.28 -1.86 -0.30 -1.18 0.00 -1.26 -1.16 121.76 112.72 4ayk s ALA 82 Ca 0.02 0.25 -0.12 0.00 0.00 0.00 0.00 51.96 52.11 4ayk s ALA 82 Cb 0.12 0.57 0.13 0.00 0.00 0.00 0.00 23.12 23.94 4ayk s ALA 82 CO 0.79 -1.05 0.74 -3.38 0.00 0.00 0.00 175.76 172.86 4ayk s HIS 83 N -2.84 -1.13 0.74 0.00 -3.43 -1.05 -4.99 115.29 102.59 4ayk s HIS 83 Ca 0.14 2.01 -0.06 0.00 -0.80 0.00 0.00 55.06 56.35 4ayk s HIS 83 Cb 0.01 0.68 0.10 0.00 -1.43 0.00 0.00 32.58 31.93 4ayk s HIS 83 CO 0.01 -0.56 1.04 0.00 -2.00 0.00 0.00 174.74 173.23 4ayk s ALA 84 N 2.54 3.19 0.24 -1.38 0.00 -1.26 -2.88 121.76 122.20 4ayk s ALA 84 Ca -0.06 -1.21 0.08 0.00 0.00 0.00 0.00 51.96 50.77 4ayk s ALA 84 Cb -0.09 -2.44 -0.04 0.00 0.00 0.00 0.00 23.12 20.55 4ayk s ALA 84 CO -0.19 -1.50 0.07 -0.06 0.00 0.00 0.00 175.76 174.09 4ayk s PHE 85 N -3.29 2.90 0.53 0.00 0.40 -0.92 -4.96 117.98 112.64 4ayk s PHE 85 Ca 0.64 -0.15 -0.22 0.00 -0.60 0.00 0.00 56.93 56.59 4ayk s PHE 85 Cb -0.08 -1.32 -0.06 0.00 0.51 0.00 0.00 43.02 42.07 4ayk s PHE 85 CO 0.46 0.56 1.31 1.04 0.70 0.00 0.00 175.22 179.29 4ayk n GLN 86 N -0.79 1.68 -1.96 0.44 6.02 -1.26 -3.90 117.38 117.61 4ayk n GLN 86 Ca -0.08 0.62 -0.33 0.00 -0.01 0.00 0.00 57.00 57.20 4ayk n GLN 86 Cb 0.58 -2.51 -0.04 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 -2.74 2.48 0.32 -1.09 0.04 -1.26 -2.04 135.00 130.71 4ayk s PRO 87 Ca 0.70 0.43 -0.19 0.00 0.04 0.00 0.00 61.00 61.98 4ayk s PRO 87 Cb -0.43 -4.63 0.03 0.00 0.04 0.00 0.00 34.50 29.51 4ayk s PRO 87 CO 0.51 -3.09 0.75 0.20 0.04 0.00 0.00 177.00 175.40 4ayk s GLY 88 N 8.73 0.10 0.56 0.56 0.00 -1.26 -4.41 107.32 111.60 4ayk s GLY 88 Ca 0.73 -0.49 -0.09 0.00 0.00 0.00 0.00 44.72 44.87 4ayk s GLY 88 CO 0.14 -0.18 0.41 -1.55 0.00 0.00 0.00 173.10 171.92 4ayk n PRO 89 N -0.49 -2.54 0.00 2.90 -0.04 -1.26 -3.24 135.00 130.33 4ayk n PRO 89 Ca -0.06 -0.67 0.00 0.00 -0.04 0.00 0.00 63.50 62.73 4ayk n PRO 89 Cb 0.59 -0.74 0.00 0.00 -0.04 0.00 0.00 33.50 33.32 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 -1.46 3.32 0.08 0.55 0.00 -1.26 -1.23 105.19 105.19 4ayk n GLY 90 Ca 0.06 -0.22 0.11 0.00 0.00 0.00 0.00 46.02 45.97 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 0.82 -1.74 -0.61 3.06 -1.26 -4.79 119.36 114.85 4ayk n ILE 91 Ca 0.00 0.18 -0.40 0.00 -2.50 0.00 0.00 62.75 60.04 4ayk n ILE 91 Cb 0.00 -1.03 0.03 0.00 0.54 0.00 0.00 39.64 39.17 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 0.17 0.77 1.68 4.50 0.00 -0.37 -1.80 105.19 110.14 4ayk n GLY 92 Ca 0.03 0.12 0.00 0.00 0.00 0.00 0.00 46.02 46.17 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 0.72 2.00 3.74 -0.02 0.00 -0.86 -4.35 105.19 106.42 4ayk n GLY 93 Ca 0.08 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.79 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 -2.49 4.09 -0.12 1.61 1.11 -0.75 -3.77 116.67 116.36 4ayk s ASP 94 Ca 0.00 1.82 -0.04 0.00 0.18 0.00 0.00 52.55 54.52 4ayk s ASP 94 Cb 0.00 -2.48 0.05 0.00 1.07 0.00 0.00 42.92 41.57 4ayk s ASP 94 CO 0.00 -2.30 0.12 0.00 1.18 0.00 0.00 175.17 174.17 4ayk s ALA 95 N -2.87 0.10 -0.07 5.23 0.00 0.60 -2.16 121.76 122.60 4ayk s ALA 95 Ca 0.62 0.16 -0.05 0.00 0.00 0.00 0.00 51.96 52.69 4ayk s ALA 95 Cb -0.18 -0.90 -0.04 0.00 0.00 0.00 0.00 23.12 22.00 4ayk s ALA 95 CO 0.57 -0.82 0.15 -1.01 0.00 0.00 0.00 175.76 174.65 4ayk s HIS 96 N 2.22 3.57 -0.06 0.00 3.76 -1.14 -2.30 115.29 121.35 4ayk s HIS 96 Ca 0.04 0.45 0.05 0.00 -0.15 0.00 0.00 55.06 55.46 4ayk s HIS 96 Cb -0.14 -1.89 -0.01 0.00 1.11 0.00 0.00 32.58 31.65 4ayk s HIS 96 CO -0.07 0.70 -0.22 -0.06 -0.85 0.00 0.00 174.74 174.24 4ayk s PHE 97 N -1.15 2.20 -0.09 1.40 0.40 -0.94 -2.53 117.98 117.27 4ayk s PHE 97 Ca 0.20 -0.67 -0.29 0.00 -0.60 0.00 0.00 56.93 55.57 4ayk s PHE 97 Cb -0.12 -1.46 -0.04 0.00 0.51 0.00 0.00 43.02 41.91 4ayk s PHE 97 CO 0.10 -0.22 1.58 0.34 0.70 0.00 0.00 175.22 177.72 4ayk s ASP 98 N -0.05 6.69 0.00 1.36 -1.08 -0.31 -2.72 116.67 120.55 4ayk s ASP 98 Ca -0.05 2.07 0.26 0.00 -0.52 0.00 0.00 52.55 54.31 4ayk s ASP 98 Cb -0.13 -2.53 0.60 0.00 -1.46 0.00 0.00 42.92 39.39 4ayk s ASP 98 CO 0.04 -0.93 1.49 1.21 0.52 0.00 0.00 175.17 177.49 4ayk n GLU 99 N 7.09 1.95 0.22 4.34 2.13 -0.78 -4.05 120.64 131.54 4ayk n GLU 99 Ca 0.17 -1.42 0.15 0.00 0.66 0.00 0.00 57.16 56.71 4ayk n GLU 99 Cb 0.43 -1.47 0.49 0.00 0.27 0.00 0.00 31.44 31.16 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 3.47 0.00 -2.23 4.31 3.32 -1.89 -3.44 116.42 119.95 4ayk h ASP 100 Ca 0.00 0.00 -0.45 0.00 0.02 0.00 0.00 57.03 56.60 4ayk h ASP 100 Cb 0.75 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.30 4ayk h ASP 100 CO 0.00 0.00 -0.31 -1.61 -1.72 0.00 0.00 179.24 175.60 4ayk s GLU 101 N -3.42 3.27 -0.27 3.56 8.01 -1.26 -4.90 118.70 123.70 4ayk s GLU 101 Ca 0.04 -0.74 -0.23 0.00 0.01 0.00 0.00 54.97 54.06 4ayk s GLU 101 Cb 0.08 -2.78 -0.01 0.00 -4.31 0.00 0.00 34.13 27.12 4ayk s GLU 101 CO 0.56 0.14 0.74 0.50 0.01 0.00 0.00 175.26 177.21 4ayk s ARG 102 N -4.19 4.09 0.11 1.61 3.52 -1.26 -5.04 118.95 117.78 4ayk s ARG 102 Ca 0.41 0.69 -0.21 0.00 -0.13 0.00 0.00 55.73 56.49 4ayk s ARG 102 Cb -0.09 -3.67 -0.07 0.00 -1.56 0.00 0.00 34.95 29.55 4ayk s ARG 102 CO 0.32 -0.53 0.64 -1.58 -0.81 0.00 0.00 175.30 173.35 4ayk s TRP 103 N 2.75 3.84 0.27 5.12 0.52 -1.26 -4.55 118.94 125.62 4ayk s TRP 103 Ca 0.31 1.40 0.05 0.00 0.02 0.00 0.00 56.10 57.87 4ayk s TRP 103 Cb -0.15 -2.59 -0.06 0.00 -1.15 0.00 0.00 33.47 29.52 4ayk s TRP 103 CO 0.09 0.56 -0.01 0.95 0.02 0.00 0.00 176.95 178.56 4ayk s THR 104 N -1.13 1.26 -0.25 2.01 -4.23 -1.17 -4.79 115.64 107.34 4ayk s THR 104 Ca 0.32 -2.05 0.10 0.00 -1.18 0.00 0.00 61.69 58.87 4ayk s THR 104 Cb -0.21 -2.48 0.45 0.00 1.34 0.00 0.00 72.50 71.60 4ayk s THR 104 CO 0.22 -0.24 1.30 0.59 -0.54 0.00 0.00 174.62 175.94 4ayk n ASN 105 N -0.53 2.29 -0.27 3.99 3.02 -1.26 -3.35 115.26 119.15 4ayk n ASN 105 Ca -0.05 -3.86 0.00 0.00 -0.03 0.00 0.00 54.58 50.64 4ayk n ASN 105 Cb 0.64 -0.55 0.00 0.00 -0.61 0.00 0.00 39.78 39.26 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 -1.08 0.00 -1.27 6.41 2.04 -1.26 -5.01 115.26 115.09 4ayk n ASN 106 Ca 0.26 -0.27 -0.02 0.00 -0.44 0.00 0.00 54.58 54.11 4ayk n ASN 106 Cb 0.82 0.00 0.01 0.00 -2.53 0.00 0.00 39.78 38.07 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 0.18 -0.53 -2.53 3.72 -1.26 -4.73 117.46 112.30 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 0.81 0.16 0.01 -1.08 5.12 -1.26 -4.94 116.66 115.49 4ayk n ARG 108 Ca 0.03 0.00 -0.12 0.00 -1.93 0.00 0.00 57.85 55.83 4ayk n ARG 108 Cb 0.54 0.00 -0.06 0.00 -1.16 0.00 0.00 32.46 31.78 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 -0.48 -6.61 5.56 5.08 -1.94 -3.42 114.58 112.77 4ayk h GLU 109 Ca 0.00 0.03 -0.70 0.00 -1.00 0.00 0.00 59.36 57.69 4ayk h GLU 109 Cb 0.00 0.11 -0.30 0.00 0.50 0.00 0.00 28.75 29.06 4ayk h GLU 109 CO 0.00 -0.32 -0.89 0.71 -1.00 0.00 0.00 179.01 177.51 4ayk s TYR 110 N -5.89 2.33 -0.25 4.33 1.51 -1.26 -5.03 117.35 113.09 4ayk s TYR 110 Ca -0.15 -0.44 -0.06 0.00 -1.01 0.00 0.00 57.07 55.41 4ayk s TYR 110 Cb 0.09 -1.50 -0.01 0.00 -0.11 0.00 0.00 41.96 40.43 4ayk s TYR 110 CO 0.64 -0.03 0.04 -0.80 -1.11 0.00 0.00 175.55 174.29 4ayk s ASN 111 N -0.63 4.91 0.14 2.29 -0.87 -1.26 -3.03 114.94 116.48 4ayk s ASN 111 Ca 0.10 -0.40 -0.13 0.00 -1.57 0.00 0.00 52.86 50.86 4ayk s ASN 111 Cb -0.10 -1.86 -0.00 0.00 -0.02 0.00 0.00 41.25 39.27 4ayk s ASN 111 CO -0.01 -0.08 1.56 0.25 -2.57 0.00 0.00 177.10 176.26 4ayk h LEU 112 N 8.20 0.84 -0.80 0.60 5.85 -1.93 -3.10 115.31 124.98 4ayk h LEU 112 Ca -0.37 -0.34 0.01 0.00 0.84 0.00 0.00 57.88 58.01 4ayk h LEU 112 Cb 1.16 -0.23 -0.04 0.00 0.37 0.00 0.00 40.66 41.92 4ayk h LEU 112 CO 0.59 0.99 0.53 -0.74 -0.34 0.00 0.00 178.44 179.47 4ayk h HIS 113 N 0.68 1.00 -0.92 1.25 2.76 -1.90 -1.10 115.15 116.92 4ayk h HIS 113 Ca 0.12 0.02 0.01 0.00 -2.20 0.00 0.00 60.37 58.33 4ayk h HIS 113 Cb 0.60 -0.34 -0.05 0.00 1.55 0.00 0.00 27.41 29.17 4ayk h HIS 113 CO 0.05 0.63 0.61 0.00 -1.30 0.00 0.00 177.93 177.92 4ayk h ARG 114 N 1.08 1.21 -0.35 5.26 3.08 -1.95 -1.33 114.38 121.37 4ayk h ARG 114 Ca 0.29 -0.07 -0.17 0.00 0.07 0.00 0.00 59.98 60.10 4ayk h ARG 114 Cb -0.12 -0.27 -0.00 0.00 0.08 0.00 0.00 29.97 29.65 4ayk h ARG 114 CO -0.07 0.80 -0.44 0.28 -1.07 0.00 0.00 179.97 179.47 4ayk h VAL 115 N 1.24 1.27 -0.90 2.04 2.07 -1.39 -2.70 116.25 117.88 4ayk h VAL 115 Ca 0.34 -1.62 0.05 0.00 0.82 0.00 0.00 66.70 66.30 4ayk h VAL 115 Cb -0.13 1.47 -0.06 0.00 -1.52 0.00 0.00 31.29 31.05 4ayk h VAL 115 CO -0.08 0.54 0.57 0.00 0.02 0.00 0.00 177.57 178.62 4ayk h ALA 116 N 0.74 1.22 -0.38 1.67 0.00 -0.62 -0.63 119.26 121.27 4ayk h ALA 116 Ca 0.04 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 54.88 4ayk h ALA 116 Cb 1.04 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.54 4ayk h ALA 116 CO 0.10 0.36 0.01 0.00 0.00 0.00 0.00 179.25 179.73 4ayk h ALA 117 N 1.40 1.32 0.32 0.00 0.00 -1.09 -0.98 119.26 120.24 4ayk h ALA 117 Ca 0.38 -0.21 -0.02 0.00 0.00 0.00 0.00 54.91 55.07 4ayk h ALA 117 Cb 0.12 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.75 4ayk h ALA 117 CO -0.16 0.46 -0.15 1.25 0.00 0.00 0.00 179.25 180.65 4ayk h HIS 118 N 0.56 -0.40 -1.00 0.00 6.17 -0.83 -1.90 115.15 117.76 4ayk h HIS 118 Ca 0.12 -0.01 0.06 0.00 0.71 0.00 0.00 60.37 61.25 4ayk h HIS 118 Cb 0.34 0.13 -0.06 0.00 2.52 0.00 0.00 27.41 30.33 4ayk h HIS 118 CO 0.01 -0.06 0.65 0.93 0.71 0.00 0.00 177.93 180.18 4ayk h GLU 119 N -0.93 1.17 -0.93 5.26 3.07 -1.29 -0.79 114.58 120.15 4ayk h GLU 119 Ca -0.04 -0.07 -0.01 0.00 -0.50 0.00 0.00 59.36 58.74 4ayk h GLU 119 Cb 0.52 -0.26 -0.04 0.00 -0.84 0.00 0.00 28.75 28.12 4ayk h GLU 119 CO 0.07 0.77 0.55 -0.07 -1.40 0.00 0.00 179.01 178.94 4ayk h LEU 120 N 1.21 1.12 -1.02 1.33 3.38 -1.18 -1.63 115.31 118.50 4ayk h LEU 120 Ca 0.42 -0.07 0.02 0.00 0.09 0.00 0.00 57.88 58.34 4ayk h LEU 120 Cb 0.12 -0.28 -0.05 0.00 0.09 0.00 0.00 40.66 40.53 4ayk h LEU 120 CO -0.16 0.86 0.66 1.23 0.09 0.00 0.00 178.44 181.12 4ayk h GLY 121 N 1.28 1.42 1.65 0.83 0.00 -0.30 -0.30 103.07 107.65 4ayk h GLY 121 Ca 0.33 -0.52 -0.04 0.00 0.00 0.00 0.00 47.33 47.10 4ayk h GLY 121 CO -0.06 0.49 -0.00 0.45 0.00 0.00 0.00 176.54 177.42 4ayk h HIS 122 N 1.33 0.45 0.00 5.60 3.86 -0.82 -0.53 115.15 125.04 4ayk h HIS 122 Ca 0.37 -0.04 -0.05 0.00 -1.16 0.00 0.00 60.37 59.50 4ayk h HIS 122 Cb -0.12 -0.13 -0.01 0.00 1.06 0.00 0.00 27.41 28.21 4ayk h HIS 122 CO -0.00 0.45 -0.23 1.03 0.86 0.00 0.00 177.93 180.04 4ayk h SER 123 N 0.42 0.00 0.48 2.45 0.87 -0.44 -1.55 113.55 115.78 4ayk h SER 123 Ca 0.09 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.65 4ayk h SER 123 Cb 0.28 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.24 4ayk h SER 123 CO 0.01 0.23 -0.14 0.18 -0.53 0.00 0.00 176.83 176.58 4ayk n LEU 124 N -3.58 0.40 0.00 2.23 4.77 -0.27 -4.87 117.00 115.68 4ayk n LEU 124 Ca -0.01 0.08 0.00 0.00 -0.03 0.00 0.00 56.01 56.06 4ayk n LEU 124 Cb 0.38 -0.24 0.00 0.00 -2.33 0.00 0.00 43.42 41.22 4ayk n LEU 124 CO 0.33 0.08 0.00 0.61 -1.33 0.00 0.00 177.39 177.08 4ayk n GLY 125 N 1.34 0.64 3.74 -0.72 0.00 -0.58 -4.96 105.19 104.65 4ayk n GLY 125 Ca 0.12 -0.62 -0.40 0.00 0.00 0.00 0.00 46.02 45.12 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 4.47 0.63 0.99 1.43 -0.80 -5.01 118.68 120.39 4ayk s LEU 126 Ca 0.00 1.55 -0.05 0.00 -1.03 0.00 0.00 54.13 54.61 4ayk s LEU 126 Cb 0.00 -3.34 0.04 0.00 0.03 0.00 0.00 46.19 42.92 4ayk s LEU 126 CO 0.00 0.00 0.92 -0.44 0.23 0.00 0.00 176.35 177.06 4ayk s SER 127 N -0.09 5.17 0.77 2.29 0.01 -1.26 -4.45 113.70 116.14 4ayk s SER 127 Ca 0.41 0.43 -0.11 0.00 1.31 0.00 0.00 55.95 57.98 4ayk s SER 127 Cb -0.21 -1.25 0.06 0.00 0.21 0.00 0.00 66.02 64.83 4ayk s SER 127 CO 0.25 -1.32 1.10 -1.00 0.41 0.00 0.00 173.24 172.68 4ayk s HIS 128 N -3.05 2.45 0.12 2.43 0.09 -1.26 -4.98 115.29 111.09 4ayk s HIS 128 Ca 0.57 1.59 0.04 0.00 -0.00 0.00 0.00 55.06 57.26 4ayk s HIS 128 Cb -0.11 -3.11 -0.04 0.00 -0.00 0.00 0.00 32.58 29.32 4ayk s HIS 128 CO 0.43 -1.93 -0.10 0.45 -0.00 0.00 0.00 174.74 173.59 4ayk s SER 129 N -3.15 1.62 -0.00 1.40 0.15 -1.17 -5.04 113.70 107.50 4ayk s SER 129 Ca 0.63 -0.92 0.22 0.00 0.70 0.00 0.00 55.95 56.58 4ayk s SER 129 Cb -0.19 0.00 0.64 0.00 -1.71 0.00 0.00 66.02 64.76 4ayk s SER 129 CO 0.54 -0.30 1.53 0.35 1.20 0.00 0.00 173.24 176.56 4ayk n THR 130 N 0.16 1.03 -2.81 6.45 -2.24 -1.26 -4.46 114.28 111.15 4ayk n THR 130 Ca -0.13 -1.01 -0.41 0.00 -2.27 0.00 0.00 64.05 60.23 4ayk n THR 130 Cb 0.59 0.49 -0.03 0.00 -2.10 0.00 0.00 70.33 69.28 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 7.21 0.56 3.42 -1.08 -1.26 -4.92 116.67 119.60 4ayk s ASP 131 Ca 0.48 1.47 0.23 0.00 -0.52 0.00 0.00 52.55 54.21 4ayk s ASP 131 Cb 0.25 -2.52 1.54 0.00 -1.46 0.00 0.00 42.92 40.74 4ayk s ASP 131 CO 0.32 -0.27 2.19 -0.29 0.52 0.00 0.00 175.17 177.64 4ayk h ILE 132 N 4.88 0.76 -0.00 4.11 2.10 -2.02 -0.08 117.51 127.26 4ayk h ILE 132 Ca -0.38 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.56 4ayk h ILE 132 Cb 1.19 0.99 0.00 0.00 -1.09 0.00 0.00 36.82 37.91 4ayk h ILE 132 CO 0.78 0.00 -0.10 0.61 -1.08 0.00 0.00 178.15 178.36 4ayk n GLY 133 N -1.44 -0.97 3.73 8.18 0.00 -1.26 -4.82 105.19 108.61 4ayk n GLY 133 Ca -0.03 -0.25 -0.41 0.00 0.00 0.00 0.00 46.02 45.33 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 -2.48 3.29 0.30 4.61 0.00 -0.04 -4.42 121.76 123.02 4ayk s ALA 134 Ca 0.29 0.35 0.18 0.00 0.00 0.00 0.00 51.96 52.78 4ayk s ALA 134 Cb 0.20 -3.11 0.84 0.00 0.00 0.00 0.00 23.12 21.05 4ayk s ALA 134 CO 0.47 -0.06 1.84 -0.07 0.00 0.00 0.00 175.76 177.94 4ayk h LEU 135 N 6.20 0.00 -3.75 0.00 3.38 -1.86 -3.17 115.31 116.10 4ayk h LEU 135 Ca -0.42 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.47 4ayk h LEU 135 Cb 1.21 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.93 4ayk h LEU 135 CO 0.73 0.33 -0.11 0.23 0.09 0.00 0.00 178.44 179.71 4ayk n MET 136 N -3.78 1.21 -2.24 1.13 2.81 -1.26 -4.85 117.12 110.14 4ayk n MET 136 Ca -0.01 -0.42 -0.41 0.00 -1.81 0.00 0.00 57.70 55.04 4ayk n MET 136 Cb 0.42 -1.53 -0.03 0.00 -0.71 0.00 0.00 33.22 31.37 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 0.97 3.27 0.02 2.03 6.14 -1.20 -3.06 117.35 125.51 4ayk s TYR 137 Ca 0.28 1.30 -0.05 0.00 0.64 0.00 0.00 57.07 59.24 4ayk s TYR 137 Cb 0.14 -3.57 -0.02 0.00 0.42 0.00 0.00 41.96 38.92 4ayk s TYR 137 CO 0.00 -1.71 1.09 -1.35 0.64 0.00 0.00 175.55 174.22 4ayk h PRO 138 N 5.00 -0.07 -7.42 4.97 0.11 -1.91 -3.43 132.00 129.25 4ayk h PRO 138 Ca -0.45 0.01 -0.46 0.00 0.11 0.00 0.00 66.00 65.21 4ayk h PRO 138 Cb 1.22 0.02 0.10 0.00 0.11 0.00 0.00 31.00 32.45 4ayk h PRO 138 CO 0.75 -0.05 0.26 -1.54 -0.21 0.00 0.00 178.00 177.21 4ayk s SER 139 N -3.02 4.21 0.09 -2.05 1.04 -1.26 -5.04 113.70 107.67 4ayk s SER 139 Ca -0.02 0.23 -0.25 0.00 0.48 0.00 0.00 55.95 56.38 4ayk s SER 139 Cb 0.01 -0.64 -0.06 0.00 0.10 0.00 0.00 66.02 65.43 4ayk s SER 139 CO 0.10 -2.00 0.77 -0.47 0.98 0.00 0.00 173.24 172.62 4ayk s TYR 140 N -3.42 3.80 0.08 5.02 5.04 -1.26 -5.06 117.35 121.55 4ayk s TYR 140 Ca 0.66 1.53 -0.07 0.00 -2.44 0.00 0.00 57.07 56.74 4ayk s TYR 140 Cb -0.08 -2.79 -0.01 0.00 0.35 0.00 0.00 41.96 39.43 4ayk s TYR 140 CO 0.47 0.37 0.15 0.95 -1.34 0.00 0.00 175.55 176.15 4ayk s THR 141 N -0.47 0.15 -0.07 4.34 -4.23 -1.26 -5.13 115.64 108.97 4ayk s THR 141 Ca 0.37 -1.25 -0.29 0.00 -1.18 0.00 0.00 61.69 59.34 4ayk s THR 141 Cb -0.21 -1.32 -0.02 0.00 1.34 0.00 0.00 72.50 72.28 4ayk s THR 141 CO 0.24 -0.69 0.95 0.12 -0.54 0.00 0.00 174.62 174.70 4ayk s PHE 142 N -3.74 3.56 -0.17 3.99 2.19 -1.26 -5.03 117.98 117.52 4ayk s PHE 142 Ca 0.04 1.56 -0.00 0.00 0.33 0.00 0.00 56.93 58.86 4ayk s PHE 142 Cb 0.05 -3.11 0.01 0.00 -1.31 0.00 0.00 43.02 38.66 4ayk s PHE 142 CO -0.10 -0.12 -0.15 0.45 1.83 0.00 0.00 175.22 177.13 4ayk s SER 143 N 1.04 3.55 0.00 6.13 0.15 -1.26 -5.08 113.70 118.24 4ayk s SER 143 Ca 0.48 -0.53 0.00 0.00 0.70 0.00 0.00 55.95 56.60 4ayk s SER 143 Cb -0.19 -1.56 0.00 0.00 -1.71 0.00 0.00 66.02 62.56 4ayk s SER 143 CO 0.21 0.04 0.00 0.61 1.20 0.00 0.00 173.24 175.30 4ayk n GLY 144 N 4.37 -1.38 3.78 9.45 0.00 -1.26 -4.66 105.19 115.49 4ayk n GLY 144 Ca -0.20 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.44 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 -2.40 7.33 -0.50 1.61 1.01 -1.26 -5.01 116.67 117.45 4ayk s ASP 145 Ca 0.00 1.64 -0.22 0.00 0.71 0.00 0.00 52.55 54.67 4ayk s ASP 145 Cb 0.00 -2.50 0.04 0.00 1.01 0.00 0.00 42.92 41.47 4ayk s ASP 145 CO 0.00 0.14 0.80 -0.69 0.21 0.00 0.00 175.17 175.62 4ayk s VAL 146 N -1.29 4.61 0.03 -1.27 1.01 -1.26 -5.01 120.40 117.22 4ayk s VAL 146 Ca 0.39 0.16 -0.08 0.00 0.00 0.00 0.00 61.98 62.45 4ayk s VAL 146 Cb -0.21 -4.39 0.00 0.00 0.00 0.00 0.00 36.38 31.78 4ayk s VAL 146 CO 0.25 -0.87 0.17 -1.10 0.00 0.00 0.00 175.10 173.55 4ayk s GLN 147 N 3.36 0.64 0.47 2.72 -0.21 -1.26 -5.15 119.66 120.24 4ayk s GLN 147 Ca 0.26 -0.61 -0.21 0.00 0.02 0.00 0.00 55.36 54.83 4ayk s GLN 147 Cb -0.14 0.26 -0.09 0.00 1.00 0.00 0.00 33.01 34.05 4ayk s GLN 147 CO 0.19 -0.18 1.04 -0.51 -2.12 0.00 0.00 175.29 173.71 4ayk s LEU 148 N -1.97 3.89 0.40 2.90 1.43 -1.26 -4.79 118.68 119.27 4ayk s LEU 148 Ca -0.07 1.94 -0.01 0.00 -1.03 0.00 0.00 54.13 54.97 4ayk s LEU 148 Cb -0.02 -4.51 -0.02 0.00 0.03 0.00 0.00 46.19 41.67 4ayk s LEU 148 CO -0.03 -0.74 0.63 0.00 0.23 0.00 0.00 176.35 176.44 4ayk s ALA 149 N -1.94 3.66 0.25 4.21 0.00 -1.26 -4.93 121.76 121.75 4ayk s ALA 149 Ca 0.66 -0.88 -0.06 0.00 0.00 0.00 0.00 51.96 51.68 4ayk s ALA 149 Cb -0.17 -2.20 0.28 0.00 0.00 0.00 0.00 23.12 21.02 4ayk s ALA 149 CO 0.21 -0.19 1.93 0.37 0.00 0.00 0.00 175.76 178.08 4ayk h GLN 150 N 0.55 1.30 -0.98 0.00 4.15 -1.96 -0.54 115.11 117.64 4ayk h GLN 150 Ca -0.48 -0.08 0.04 0.00 0.77 0.00 0.00 58.65 58.90 4ayk h GLN 150 Cb 1.23 -0.29 -0.06 0.00 0.21 0.00 0.00 27.48 28.57 4ayk h GLN 150 CO 0.60 0.87 0.64 0.22 -1.93 0.00 0.00 178.83 179.23 4ayk h ASP 151 N 1.34 1.06 -0.21 -0.69 1.82 -1.98 0.19 116.42 117.95 4ayk h ASP 151 Ca 0.36 -0.01 -0.21 0.00 -0.39 0.00 0.00 57.03 56.79 4ayk h ASP 151 Cb -0.15 -0.24 0.01 0.00 0.68 0.00 0.00 39.33 39.62 4ayk h ASP 151 CO -0.08 0.72 -0.68 0.44 -1.61 0.00 0.00 179.24 178.04 4ayk h ASP 152 N 1.23 0.96 -0.02 2.28 3.32 -1.67 -1.50 116.42 121.01 4ayk h ASP 152 Ca 0.39 -0.59 -0.00 0.00 0.02 0.00 0.00 57.03 56.85 4ayk h ASP 152 Cb 0.01 -0.28 -0.00 0.00 0.22 0.00 0.00 39.33 39.28 4ayk h ASP 152 CO -0.13 1.38 0.00 0.40 -1.72 0.00 0.00 179.24 179.18 4ayk h ILE 153 N 0.59 1.19 -0.95 0.35 2.04 -0.56 -1.30 117.51 118.87 4ayk h ILE 153 Ca -0.03 -0.58 -0.00 0.00 1.00 0.00 0.00 64.86 65.25 4ayk h ILE 153 Cb 1.30 1.55 -0.05 0.00 -0.74 0.00 0.00 36.82 38.88 4ayk h ILE 153 CO 0.14 0.15 0.58 0.44 0.00 0.00 0.00 178.15 179.47 4ayk h ASP 154 N -0.20 1.13 0.60 1.72 3.32 -0.68 -0.44 116.42 121.87 4ayk h ASP 154 Ca 0.01 -0.06 -0.03 0.00 0.02 0.00 0.00 57.03 56.97 4ayk h ASP 154 Cb 0.25 -0.28 0.01 0.00 0.22 0.00 0.00 39.33 39.52 4ayk h ASP 154 CO 0.00 0.85 -0.29 1.23 -1.72 0.00 0.00 179.24 179.32 4ayk h GLY 155 N 1.30 -0.84 1.01 2.75 0.00 -1.07 -0.11 103.07 106.11 4ayk h GLY 155 Ca 0.34 0.31 0.01 0.00 0.00 0.00 0.00 47.33 47.99 4ayk h GLY 155 CO -0.07 -0.30 0.65 1.19 0.00 0.00 0.00 176.54 178.01 4ayk h ILE 156 N -1.02 1.26 -0.78 2.60 6.09 -1.19 -1.78 117.51 122.68 4ayk h ILE 156 Ca -0.08 -0.49 -0.04 0.00 -1.37 0.00 0.00 64.86 62.88 4ayk h ILE 156 Cb 0.67 -0.20 -0.03 0.00 0.47 0.00 0.00 36.82 37.72 4ayk h ILE 156 CO 0.13 0.25 0.31 1.56 -3.07 0.00 0.00 178.15 177.34 4ayk h GLN 157 N 1.36 1.16 -0.75 2.19 4.20 -1.03 -2.56 115.11 119.68 4ayk h GLN 157 Ca 0.36 -0.21 0.01 0.00 0.06 0.00 0.00 58.65 58.88 4ayk h GLN 157 Cb -0.14 -0.19 -0.04 0.00 0.30 0.00 0.00 27.48 27.41 4ayk h GLN 157 CO -0.08 0.93 0.50 0.00 -0.67 0.00 0.00 178.83 179.52 4ayk h ALA 158 N 1.21 0.95 0.21 3.87 0.00 -0.15 2.01 119.26 127.36 4ayk h ALA 158 Ca 0.26 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.11 4ayk h ALA 158 Cb 0.21 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 17.70 4ayk h ALA 158 CO -0.02 0.37 -0.10 0.82 0.00 0.00 0.00 179.25 180.32 4ayk h ILE 159 N 1.02 0.80 0.00 0.00 2.04 -1.06 -3.39 117.51 116.92 4ayk h ILE 159 Ca 0.28 -0.02 0.00 0.00 1.00 0.00 0.00 64.86 66.11 4ayk h ILE 159 Cb -0.12 0.81 0.00 0.00 -0.74 0.00 0.00 36.82 36.78 4ayk h ILE 159 CO -0.06 0.01 0.00 -1.22 0.00 0.00 0.00 178.15 176.87 4ayk n TYR 160 N -5.21 0.00 -3.72 1.37 4.01 -1.05 -5.13 117.16 107.43 4ayk n TYR 160 Ca -0.09 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.65 4ayk n TYR 160 Cb 0.14 -0.09 0.00 0.00 -0.31 0.00 0.00 39.34 39.08 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 1.68 -1.36 3.84 2.72 0.00 0.68 -5.04 105.19 107.71 4ayk n GLY 161 Ca 0.00 -1.12 -0.37 0.00 0.00 0.00 0.00 46.02 44.53 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 -1.49 3.90 -1.10 1.61 0.52 -1.26 -4.37 118.95 116.76 4ayk s ARG 162 Ca 0.00 0.38 -0.22 0.00 -0.52 0.00 0.00 55.73 55.37 4ayk s ARG 162 Cb 0.00 -3.14 -0.00 0.00 0.52 0.00 0.00 34.95 32.33 4ayk s ARG 162 CO 0.00 0.64 1.76 -1.12 0.02 0.00 0.00 175.30 176.59 4ayk s SER 163 N -1.31 5.91 -0.79 0.23 0.01 -1.26 -4.90 113.70 111.59 4ayk s SER 163 Ca 0.28 -1.56 -0.15 0.00 1.31 0.00 0.00 55.95 55.83 4ayk s SER 163 Cb -0.16 -2.57 0.19 0.00 0.21 0.00 0.00 66.02 63.69 4ayk s SER 163 CO 0.15 -2.09 0.78 -1.10 0.41 0.00 0.00 173.24 171.38 4ayk s GLN 164 N 5.64 3.50 0.02 12.44 -0.21 -1.26 -5.00 119.66 134.79 4ayk s GLN 164 Ca 0.59 -2.22 -0.25 0.00 0.02 0.00 0.00 55.36 53.50 4ayk s GLN 164 Cb -0.01 -4.46 0.06 0.00 1.00 0.00 0.00 33.01 29.60 4ayk s GLN 164 CO 0.02 -1.37 0.57 -0.80 -2.12 0.00 0.00 175.29 171.59 4ayk s ASN 165 N 2.60 -0.51 -0.96 5.90 -0.87 -1.26 -5.09 114.94 114.74 4ayk s ASN 165 Ca 0.18 0.35 -0.24 0.00 -1.57 0.00 0.00 52.86 51.58 4ayk s ASN 165 Cb -0.13 0.51 0.04 0.00 -0.02 0.00 0.00 41.25 41.65 4ayk s ASN 165 CO -0.07 -0.68 1.47 -2.16 -2.57 0.00 0.00 177.10 173.09 4ayk s PRO 166 N -2.03 3.44 0.13 -0.60 0.04 -1.26 -4.99 135.00 129.73 4ayk s PRO 166 Ca -0.07 -0.90 -0.24 0.00 0.04 0.00 0.00 61.00 59.82 4ayk s PRO 166 Cb -0.01 -5.15 -0.07 0.00 0.04 0.00 0.00 34.50 29.31 4ayk s PRO 166 CO 0.02 -2.30 0.73 0.14 0.04 0.00 0.00 177.00 175.63 4ayk s VAL 167 N 5.56 4.50 0.04 -0.36 -7.23 -1.26 -5.01 120.40 116.63 4ayk s VAL 167 Ca 0.47 1.59 -0.31 0.00 -1.81 0.00 0.00 61.98 61.92 4ayk s VAL 167 Cb -0.02 -4.09 -0.17 0.00 0.56 0.00 0.00 36.38 32.66 4ayk s VAL 167 CO -0.05 0.51 1.34 1.56 -0.31 0.00 0.00 175.10 178.15 4ayk h GLN 168 N 4.57 -0.97 0.00 4.82 1.08 -2.07 -3.56 115.11 118.97 4ayk h GLN 168 Ca -0.47 0.07 0.00 0.00 -1.45 0.00 0.00 58.65 56.80 4ayk h GLN 168 Cb 1.21 0.22 0.00 0.00 -0.05 0.00 0.00 27.48 28.86 4ayk h GLN 168 CO 0.66 -0.63 0.00 -0.35 -0.95 0.00 0.00 178.83 177.57