#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 0.97 -8.15 7.52 5.85 -2.06 -3.42 115.31 116.01 4ayk h LEU 2 Ca 0.00 -0.09 -0.46 0.00 0.84 0.00 0.00 57.88 58.17 4ayk h LEU 2 Cb 0.00 -0.25 -0.29 0.00 0.37 0.00 0.00 40.66 40.49 4ayk h LEU 2 CO 0.00 0.78 -0.80 0.42 -0.34 0.00 0.00 178.44 178.50 4ayk s THR 3 N -5.86 1.00 0.05 1.05 -4.23 -1.26 -5.12 115.64 101.28 4ayk s THR 3 Ca -0.13 -0.54 -0.30 0.00 -1.18 0.00 0.00 61.69 59.54 4ayk s THR 3 Cb 0.15 -0.84 -0.05 0.00 1.34 0.00 0.00 72.50 73.10 4ayk s THR 3 CO 0.81 0.28 1.16 -0.70 -0.54 0.00 0.00 174.62 175.63 4ayk s GLU 4 N -0.27 4.45 5.39 3.99 2.12 -1.26 -4.79 118.70 128.33 4ayk s GLU 4 Ca 0.04 1.71 0.00 0.00 0.36 0.00 0.00 54.97 57.08 4ayk s GLU 4 Cb -0.05 -3.37 0.00 0.00 0.26 0.00 0.00 34.13 30.97 4ayk s GLU 4 CO -0.00 -0.22 0.00 0.41 -0.54 0.00 0.00 175.26 174.90 4ayk n GLY 5 N 3.16 2.86 3.81 -1.50 0.00 -1.26 -4.55 105.19 107.70 4ayk n GLY 5 Ca 0.08 -0.32 -0.35 0.00 0.00 0.00 0.00 46.02 45.43 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 7.10 1.18 1.61 0.02 -1.26 -5.05 114.94 114.55 4ayk s ASN 6 Ca 0.00 1.59 -0.15 0.00 -1.02 0.00 0.00 52.86 53.28 4ayk s ASN 6 Cb 0.00 -2.49 0.28 0.00 0.02 0.00 0.00 41.25 39.06 4ayk s ASN 6 CO 0.00 -0.10 1.03 -2.16 0.02 0.00 0.00 177.10 175.89 4ayk s PRO 7 N -2.32 -1.07 0.57 -0.60 0.04 -1.26 -5.04 135.00 125.32 4ayk s PRO 7 Ca 0.50 0.55 -0.05 0.00 0.04 0.00 0.00 61.00 62.04 4ayk s PRO 7 Cb -0.15 -1.56 0.12 0.00 0.04 0.00 0.00 34.50 32.95 4ayk s PRO 7 CO 0.20 -3.74 0.78 0.54 0.04 0.00 0.00 177.00 174.82 4ayk n ARG 8 N -4.89 -0.28 -2.67 4.56 1.74 -1.26 -4.98 116.66 108.88 4ayk n ARG 8 Ca 0.05 -1.70 -0.43 0.00 -0.77 0.00 0.00 57.85 55.00 4ayk n ARG 8 Cb 0.56 -0.65 -0.02 0.00 -1.02 0.00 0.00 32.46 31.33 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 -2.43 3.21 -0.97 -1.55 0.52 -1.26 -4.87 118.94 111.59 4ayk s TRP 9 Ca 0.48 1.25 0.28 0.00 0.02 0.00 0.00 56.10 58.13 4ayk s TRP 9 Cb -0.02 -3.53 0.99 0.00 -1.15 0.00 0.00 33.47 29.75 4ayk s TRP 9 CO 0.33 -0.67 1.76 0.39 0.02 0.00 0.00 176.95 178.78 4ayk n GLU 10 N 6.66 0.03 -3.06 4.98 1.02 -1.26 -4.83 120.64 124.18 4ayk n GLU 10 Ca 0.11 0.02 -0.33 0.00 -0.02 0.00 0.00 57.16 56.94 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 -3.01 4.08 0.00 3.49 -0.21 -1.26 -4.95 119.66 117.79 4ayk s GLN 11 Ca 0.13 0.79 0.24 0.00 0.02 0.00 0.00 55.36 56.54 4ayk s GLN 11 Cb 0.18 -2.41 0.32 0.00 1.00 0.00 0.00 33.01 32.10 4ayk s GLN 11 CO 0.59 0.13 1.30 0.25 -2.12 0.00 0.00 175.29 175.44 4ayk n THR 12 N -0.34 0.00 -4.75 -0.19 -2.24 -1.26 -4.86 114.28 100.63 4ayk n THR 12 Ca 0.04 -0.22 -0.24 0.00 -2.27 0.00 0.00 64.05 61.35 4ayk n THR 12 Cb 0.53 0.93 -0.15 0.00 -2.10 0.00 0.00 70.33 69.54 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 -2.44 1.55 0.09 4.78 3.76 -1.26 -2.37 115.29 119.39 4ayk s HIS 13 Ca 0.22 -0.31 0.02 0.00 -0.15 0.00 0.00 55.06 54.84 4ayk s HIS 13 Cb 0.19 -0.98 -0.04 0.00 1.11 0.00 0.00 32.58 32.86 4ayk s HIS 13 CO 0.53 -0.00 -0.07 -0.51 -0.85 0.00 0.00 174.74 173.84 4ayk s LEU 14 N -0.58 2.47 0.12 0.89 1.43 -0.81 -4.97 118.68 117.22 4ayk s LEU 14 Ca 0.06 -0.93 0.06 0.00 -1.03 0.00 0.00 54.13 52.29 4ayk s LEU 14 Cb -0.07 -0.09 -0.04 0.00 0.03 0.00 0.00 46.19 46.02 4ayk s LEU 14 CO -0.00 -0.42 -0.14 0.42 0.23 0.00 0.00 176.35 176.44 4ayk s THR 15 N -3.24 1.32 0.07 5.49 -4.23 -1.26 -2.12 115.64 111.66 4ayk s THR 15 Ca 0.08 -1.67 -0.03 0.00 -1.18 0.00 0.00 61.69 58.90 4ayk s THR 15 Cb 0.03 -1.49 -0.03 0.00 1.34 0.00 0.00 72.50 72.35 4ayk s THR 15 CO -0.04 -0.39 0.02 -0.72 -0.54 0.00 0.00 174.62 172.96 4ayk s TYR 16 N -2.02 0.48 -0.11 3.99 -0.85 -1.08 -1.78 117.35 115.98 4ayk s TYR 16 Ca 0.08 -0.99 -0.07 0.00 -0.52 0.00 0.00 57.07 55.57 4ayk s TYR 16 Cb -0.06 -0.33 0.04 0.00 0.38 0.00 0.00 41.96 41.99 4ayk s TYR 16 CO 0.03 -0.43 0.26 0.50 -1.52 0.00 0.00 175.55 174.39 4ayk s ARG 17 N -3.92 0.25 -0.24 -3.49 3.52 -1.02 -2.36 118.95 111.68 4ayk s ARG 17 Ca 0.08 0.51 -0.21 0.00 -0.13 0.00 0.00 55.73 55.98 4ayk s ARG 17 Cb 0.07 -0.04 -0.02 0.00 -1.56 0.00 0.00 34.95 33.40 4ayk s ARG 17 CO -0.09 -0.13 0.67 0.42 -0.81 0.00 0.00 175.30 175.36 4ayk s ILE 18 N 0.99 4.96 0.19 4.11 1.01 -1.26 -2.11 121.20 129.10 4ayk s ILE 18 Ca -0.07 1.22 -0.09 0.00 0.00 0.00 0.00 60.65 61.72 4ayk s ILE 18 Cb -0.08 -3.97 0.10 0.00 0.01 0.00 0.00 42.46 38.52 4ayk s ILE 18 CO -0.07 0.02 1.69 -0.08 0.00 0.00 0.00 174.94 176.51 4ayk h GLU 19 N 7.78 1.11 -2.70 2.79 4.81 -1.60 -3.46 114.58 123.32 4ayk h GLU 19 Ca -0.27 -0.29 -0.03 0.00 -0.13 0.00 0.00 59.36 58.64 4ayk h GLU 19 Cb 1.12 -0.13 -0.14 0.00 0.63 0.00 0.00 28.75 30.23 4ayk h GLU 19 CO 0.79 1.01 0.21 0.54 -0.73 0.00 0.00 179.01 180.83 4ayk s ASN 20 N -6.48 -0.59 -0.14 1.04 4.22 -1.26 -5.10 114.94 106.64 4ayk s ASN 20 Ca -0.12 0.20 -0.07 0.00 -2.14 0.00 0.00 52.86 50.74 4ayk s ASN 20 Cb 0.14 0.58 -0.04 0.00 1.28 0.00 0.00 41.25 43.21 4ayk s ASN 20 CO 0.85 -0.86 0.10 -0.31 -2.04 0.00 0.00 177.10 174.84 4ayk s TYR 21 N -3.01 3.44 0.35 1.54 2.02 -1.26 -4.65 117.35 115.79 4ayk s TYR 21 Ca -0.02 0.37 -0.28 0.00 -0.37 0.00 0.00 57.07 56.77 4ayk s TYR 21 Cb -0.01 -1.97 -0.10 0.00 -0.40 0.00 0.00 41.96 39.49 4ayk s TYR 21 CO -0.06 0.53 1.25 -0.08 -1.57 0.00 0.00 175.55 175.62 4ayk s THR 22 N -0.57 2.90 -0.90 -0.71 -1.32 -1.26 -4.88 115.64 108.90 4ayk s THR 22 Ca 0.12 0.86 0.12 0.00 -1.21 0.00 0.00 61.69 61.57 4ayk s THR 22 Cb -0.12 -3.53 0.11 0.00 -1.51 0.00 0.00 72.50 67.45 4ayk s THR 22 CO 0.02 0.17 1.38 -0.81 -2.21 0.00 0.00 174.62 173.17 4ayk n PRO 23 N 0.60 0.03 -0.38 7.08 -0.04 -1.26 -2.85 135.00 138.19 4ayk n PRO 23 Ca 0.01 0.36 -0.02 0.00 -0.04 0.00 0.00 63.50 63.81 4ayk n PRO 23 Cb 0.43 -1.57 0.11 0.00 -0.04 0.00 0.00 33.50 32.44 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 -4.71 3.54 3.32 -1.98 -3.43 116.42 114.32 4ayk h ASP 24 Ca 0.00 -0.03 -0.28 0.00 0.02 0.00 0.00 57.03 56.74 4ayk h ASP 24 Cb 0.18 -0.29 -0.20 0.00 0.22 0.00 0.00 39.33 39.24 4ayk h ASP 24 CO 0.00 0.84 -0.73 -0.76 -1.72 0.00 0.00 179.24 176.86 4ayk s LEU 25 N -10.12 2.29 0.00 1.55 1.43 -1.13 -5.06 118.68 107.64 4ayk s LEU 25 Ca -0.13 -0.62 -0.20 0.00 -1.03 0.00 0.00 54.13 52.15 4ayk s LEU 25 Cb 0.18 -0.18 0.31 0.00 0.03 0.00 0.00 46.19 46.53 4ayk s LEU 25 CO 0.82 -0.23 0.84 -0.81 0.23 0.00 0.00 176.35 177.21 4ayk n PRO 26 N 1.24 -3.95 0.04 1.29 -0.04 -1.26 -4.58 135.00 127.74 4ayk n PRO 26 Ca -0.21 -1.39 -0.17 0.00 -0.04 0.00 0.00 63.50 61.69 4ayk n PRO 26 Cb 0.55 -1.59 -0.14 0.00 -0.04 0.00 0.00 33.50 32.28 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 0.22 -0.84 0.54 0.11 -1.97 -3.22 114.38 109.22 4ayk h ARG 27 Ca -0.35 -0.37 0.09 0.00 0.10 0.00 0.00 59.98 59.45 4ayk h ARG 27 Cb 1.15 0.14 -0.07 0.00 1.11 0.00 0.00 29.97 32.30 4ayk h ARG 27 CO 0.22 1.04 0.49 0.00 0.10 0.00 0.00 179.97 181.82 4ayk h ALA 28 N 0.47 1.21 -0.37 0.08 0.00 -1.99 0.71 119.26 119.36 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 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 19.66 4ayk h ALA 28 CO 0.13 0.13 -0.41 -0.44 0.00 0.00 0.00 179.25 178.66 4ayk h ASP 29 N 0.83 1.00 -0.28 0.00 3.32 -1.95 -2.63 116.42 116.72 4ayk h ASP 29 Ca 0.40 -0.47 -0.13 0.00 0.02 0.00 0.00 57.03 56.85 4ayk h ASP 29 Cb 0.36 -0.28 -0.00 0.00 0.22 0.00 0.00 39.33 39.62 4ayk h ASP 29 CO -0.24 1.27 -0.34 0.58 -1.72 0.00 0.00 179.24 178.79 4ayk h VAL 30 N 0.75 1.30 -0.97 -1.35 2.07 -1.27 -2.80 116.25 113.98 4ayk h VAL 30 Ca 0.06 -1.52 0.01 0.00 0.82 0.00 0.00 66.70 66.06 4ayk h VAL 30 Cb 1.01 1.63 -0.05 0.00 -1.52 0.00 0.00 31.29 32.36 4ayk h VAL 30 CO 0.10 0.49 0.64 -0.78 0.02 0.00 0.00 177.57 178.04 4ayk h ASP 31 N 0.46 1.11 -0.14 0.57 1.82 0.39 -1.47 116.42 119.16 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 0.92 -0.28 -0.01 0.00 0.68 0.00 0.00 39.33 40.65 4ayk h ASP 31 CO 0.08 0.80 0.09 -0.74 -1.61 0.00 0.00 179.24 177.86 4ayk h HIS 32 N 1.31 0.16 -0.46 0.28 2.76 -1.38 0.36 115.15 118.17 4ayk h HIS 32 Ca 0.36 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.54 4ayk h HIS 32 Cb -0.14 -0.05 -0.02 0.00 1.55 0.00 0.00 27.41 28.74 4ayk h HIS 32 CO -0.00 0.10 0.31 0.00 -1.30 0.00 0.00 177.93 177.03 4ayk h ALA 33 N 1.06 0.59 -0.20 5.26 0.00 -1.16 0.68 119.26 125.49 4ayk h ALA 33 Ca 0.05 -0.03 -0.13 0.00 0.00 0.00 0.00 54.91 54.80 4ayk h ALA 33 Cb -0.01 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.59 4ayk h ALA 33 CO -0.02 0.04 -0.37 0.82 0.00 0.00 0.00 179.25 179.72 4ayk h ILE 34 N 0.63 1.33 -0.41 0.00 1.08 -1.04 -2.40 117.51 116.71 4ayk h ILE 34 Ca 0.17 -1.59 -0.15 0.00 -0.39 0.00 0.00 64.86 62.90 4ayk h ILE 34 Cb -0.07 1.85 -0.01 0.00 -3.07 0.00 0.00 36.82 35.52 4ayk h ILE 34 CO -0.04 0.49 -0.34 -0.08 -0.69 0.00 0.00 178.15 177.49 4ayk h GLU 35 N 0.28 0.94 -0.93 2.37 4.81 -0.12 -2.85 114.58 119.08 4ayk h GLU 35 Ca 0.01 -0.47 -0.01 0.00 -0.13 0.00 0.00 59.36 58.76 4ayk h GLU 35 Cb 0.96 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 30.30 4ayk h GLU 35 CO 0.08 1.13 0.54 -0.22 -0.73 0.00 0.00 179.01 179.81 4ayk h LYS 36 N 0.78 1.27 -0.30 1.92 3.64 0.38 -2.09 116.57 122.17 4ayk h LYS 36 Ca 0.07 -0.13 -0.02 0.00 -1.27 0.00 0.00 60.65 59.31 4ayk h LYS 36 Cb 0.93 -0.26 -0.01 0.00 -0.41 0.00 0.00 32.23 32.48 4ayk h LYS 36 CO 0.09 0.90 0.12 0.00 -2.27 0.00 0.00 179.45 178.29 4ayk h ALA 37 N 1.31 0.40 -1.00 5.00 0.00 -1.28 -2.26 119.26 121.42 4ayk h ALA 37 Ca 0.33 -0.13 0.01 0.00 0.00 0.00 0.00 54.91 55.12 4ayk h ALA 37 Cb -0.02 -0.12 -0.05 0.00 0.00 0.00 0.00 17.79 17.60 4ayk h ALA 37 CO -0.06 -0.00 0.66 0.74 0.00 0.00 0.00 179.25 180.59 4ayk h PHE 38 N 0.34 1.27 -0.90 0.00 0.04 -1.26 -1.83 116.94 114.59 4ayk h PHE 38 Ca 0.10 0.02 0.01 0.00 2.80 0.00 0.00 57.97 60.91 4ayk h PHE 38 Cb 0.19 -0.43 -0.04 0.00 2.20 0.00 0.00 35.95 37.87 4ayk h PHE 38 CO -0.00 0.80 0.60 1.96 -0.60 0.00 0.00 178.31 181.07 4ayk h GLN 39 N 1.36 1.19 -0.89 1.51 1.08 -1.04 0.20 115.11 118.51 4ayk h GLN 39 Ca 0.37 -0.07 0.01 0.00 -1.45 0.00 0.00 58.65 57.50 4ayk h GLN 39 Cb -0.14 -0.27 -0.04 0.00 -0.05 0.00 0.00 27.48 26.97 4ayk h GLN 39 CO -0.08 0.79 0.58 -0.07 -0.95 0.00 0.00 178.83 179.10 4ayk h LEU 40 N 1.22 1.03 -0.23 1.46 3.38 -0.77 0.66 115.31 122.07 4ayk h LEU 40 Ca 0.33 -0.03 -0.20 0.00 0.09 0.00 0.00 57.88 58.06 4ayk h LEU 40 Cb -0.14 -0.26 0.01 0.00 0.09 0.00 0.00 40.66 40.36 4ayk h LEU 40 CO -0.07 0.75 -0.66 -0.50 0.09 0.00 0.00 178.44 178.05 4ayk h TRP 41 N 1.21 1.10 -0.30 1.13 4.06 -0.92 -3.18 115.95 119.05 4ayk h TRP 41 Ca 0.33 -0.44 -0.14 0.00 2.06 0.00 0.00 58.89 60.70 4ayk h TRP 41 Cb -0.13 -0.19 -0.01 0.00 -1.00 0.00 0.00 29.16 27.83 4ayk h TRP 41 CO -0.01 1.27 -0.37 1.03 -3.56 0.00 0.00 178.44 176.81 4ayk h SER 42 N 0.62 0.74 -0.04 -3.49 0.87 -0.17 -2.77 113.55 109.31 4ayk h SER 42 Ca -0.02 -0.32 0.01 0.00 -1.23 0.00 0.00 61.79 60.23 4ayk h SER 42 Cb 1.28 -0.21 -0.00 0.00 -0.44 0.00 0.00 62.40 63.03 4ayk h SER 42 CO 0.14 1.03 0.12 0.78 -0.53 0.00 0.00 176.83 178.37 4ayk h ASN 43 N 0.58 0.00 -0.20 6.23 2.35 0.35 -0.41 115.58 124.48 4ayk h ASN 43 Ca 0.06 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.81 4ayk h ASN 43 Cb 0.89 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.26 4ayk h ASN 43 CO 0.08 0.00 0.00 1.33 -1.65 0.00 0.00 177.43 177.19 4ayk n VAL 44 N -3.27 0.57 -3.82 2.81 0.24 -1.08 -5.00 118.33 108.78 4ayk n VAL 44 Ca -0.02 -0.78 -0.12 0.00 -2.04 0.00 0.00 64.34 61.38 4ayk n VAL 44 Cb 0.19 0.82 -0.09 0.00 -1.47 0.00 0.00 33.84 33.29 4ayk n VAL 44 CO 0.00 0.00 0.00 0.42 -2.14 0.00 0.00 176.83 175.11 4ayk s THR 45 N -0.96 0.07 -2.00 3.34 -4.23 -0.16 -4.12 115.64 107.58 4ayk s THR 45 Ca 0.18 -0.61 0.06 0.00 -1.18 0.00 0.00 61.69 60.14 4ayk s THR 45 Cb 0.11 -0.55 0.17 0.00 1.34 0.00 0.00 72.50 73.57 4ayk s THR 45 CO 0.15 -0.34 0.78 -0.81 -0.54 0.00 0.00 174.62 173.86 4ayk n PRO 46 N 1.30 0.41 -1.32 3.99 -0.04 -1.26 -4.60 135.00 133.48 4ayk n PRO 46 Ca -0.22 0.00 -0.31 0.00 -0.04 0.00 0.00 63.50 62.93 4ayk n PRO 46 Cb 0.56 -1.23 0.09 0.00 -0.04 0.00 0.00 33.50 32.87 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 -1.47 3.01 0.04 1.53 1.43 -1.26 -4.96 118.68 117.00 4ayk s LEU 47 Ca 0.09 1.76 -0.00 0.00 -1.03 0.00 0.00 54.13 54.95 4ayk s LEU 47 Cb 0.04 -4.48 -0.03 0.00 0.03 0.00 0.00 46.19 41.75 4ayk s LEU 47 CO 0.07 -1.95 -0.04 0.42 0.23 0.00 0.00 176.35 175.08 4ayk s THR 48 N -2.94 0.22 0.09 5.49 -4.23 -1.00 -4.67 115.64 108.61 4ayk s THR 48 Ca 0.61 -1.28 0.05 0.00 -1.18 0.00 0.00 61.69 59.89 4ayk s THR 48 Cb -0.17 -0.79 -0.03 0.00 1.34 0.00 0.00 72.50 72.86 4ayk s THR 48 CO 0.56 -0.67 -0.14 -0.36 -0.54 0.00 0.00 174.62 173.46 4ayk s PHE 49 N -2.38 1.31 -0.19 3.99 0.08 -1.26 -1.92 117.98 117.61 4ayk s PHE 49 Ca -0.06 -0.50 -0.11 0.00 0.12 0.00 0.00 56.93 56.37 4ayk s PHE 49 Cb -0.03 -0.71 0.06 0.00 -0.57 0.00 0.00 43.02 41.77 4ayk s PHE 49 CO -0.04 0.09 0.47 0.99 -0.10 0.00 0.00 175.22 176.63 4ayk s THR 50 N -1.66 -0.02 0.22 0.64 2.01 -0.90 -4.97 115.64 110.97 4ayk s THR 50 Ca 0.03 0.06 -0.30 0.00 0.31 0.00 0.00 61.69 61.79 4ayk s THR 50 Cb -0.08 -0.69 -0.09 0.00 0.01 0.00 0.00 72.50 71.66 4ayk s THR 50 CO 0.02 0.03 0.96 -0.75 -0.69 0.00 0.00 174.62 174.19 4ayk s LYS 51 N 1.29 4.81 -0.06 4.92 2.20 -1.26 -2.63 119.74 129.01 4ayk s LYS 51 Ca -0.08 1.51 0.05 0.00 -0.36 0.00 0.00 55.97 57.08 4ayk s LYS 51 Cb -0.07 -3.29 -0.02 0.00 -1.51 0.00 0.00 37.83 32.95 4ayk s LYS 51 CO -0.12 0.44 -0.20 0.14 -0.36 0.00 0.00 175.35 175.25 4ayk s VAL 52 N -0.98 2.47 -1.26 4.02 -7.23 -1.00 -4.92 120.40 111.50 4ayk s VAL 52 Ca 0.42 -0.92 0.23 0.00 -1.81 0.00 0.00 61.98 59.90 4ayk s VAL 52 Cb -0.26 -1.94 -0.09 0.00 0.56 0.00 0.00 36.38 34.65 4ayk s VAL 52 CO 0.32 0.57 1.11 -0.24 -0.31 0.00 0.00 175.10 176.55 4ayk n SER 53 N 2.83 1.08 -3.91 4.85 2.88 -1.26 -4.68 113.62 115.41 4ayk n SER 53 Ca -0.17 -0.92 -0.08 0.00 -1.33 0.00 0.00 58.87 56.36 4ayk n SER 53 Cb 0.52 0.66 -0.08 0.00 -0.75 0.00 0.00 64.21 64.56 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 -2.86 0.79 0.00 -1.46 2.02 -1.26 -5.12 118.70 110.82 4ayk s GLU 54 Ca 0.12 -1.01 0.00 0.00 0.02 0.00 0.00 54.97 54.10 4ayk s GLU 54 Cb 0.17 0.31 0.00 0.00 0.10 0.00 0.00 34.13 34.71 4ayk s GLU 54 CO 0.75 -0.23 0.00 0.41 0.02 0.00 0.00 175.26 176.20 4ayk n GLY 55 N -0.02 -1.72 3.79 -1.39 0.00 -1.26 -4.88 105.19 99.72 4ayk n GLY 55 Ca -0.15 -1.52 -0.36 0.00 0.00 0.00 0.00 46.02 43.99 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 -1.78 4.46 0.02 1.61 -0.21 -1.26 -5.06 119.66 117.44 4ayk s GLN 56 Ca 0.00 1.25 0.02 0.00 0.02 0.00 0.00 55.36 56.64 4ayk s GLN 56 Cb 0.00 -2.59 -0.04 0.00 1.00 0.00 0.00 33.01 31.38 4ayk s GLN 56 CO 0.00 0.18 0.01 0.00 -2.12 0.00 0.00 175.29 173.36 4ayk s ALA 57 N -1.80 3.31 0.25 6.09 0.00 -1.26 -5.01 121.76 123.33 4ayk s ALA 57 Ca 0.54 -0.97 -0.06 0.00 0.00 0.00 0.00 51.96 51.47 4ayk s ALA 57 Cb -0.15 -1.33 0.26 0.00 0.00 0.00 0.00 23.12 21.90 4ayk s ALA 57 CO 0.20 0.66 1.93 -0.44 0.00 0.00 0.00 175.76 178.11 4ayk h ASP 58 N 4.16 1.16 -3.24 0.00 3.32 -1.88 -3.39 116.42 116.55 4ayk h ASP 58 Ca -0.49 -0.03 -0.67 0.00 0.02 0.00 0.00 57.03 55.87 4ayk h ASP 58 Cb 1.17 -0.29 -0.33 0.00 0.22 0.00 0.00 39.33 40.11 4ayk h ASP 58 CO 0.58 0.84 -0.81 -0.63 -1.72 0.00 0.00 179.24 177.50 4ayk s ILE 59 N -6.12 2.51 -0.26 0.35 1.01 -0.73 -4.77 121.20 113.19 4ayk s ILE 59 Ca -0.13 -0.86 -0.11 0.00 0.00 0.00 0.00 60.65 59.55 4ayk s ILE 59 Cb 0.18 -2.13 -0.05 0.00 0.01 0.00 0.00 42.46 40.47 4ayk s ILE 59 CO 0.82 0.44 0.18 -0.04 0.00 0.00 0.00 174.94 176.34 4ayk s MET 60 N 1.34 3.99 -0.14 2.79 -1.94 -1.22 -2.42 119.30 121.71 4ayk s MET 60 Ca 0.04 -0.30 -0.02 0.00 -1.71 0.00 0.00 55.69 53.70 4ayk s MET 60 Cb -0.14 -3.61 -0.02 0.00 2.01 0.00 0.00 34.83 33.07 4ayk s MET 60 CO -0.09 -0.08 -0.09 0.42 -0.01 0.00 0.00 175.02 175.16 4ayk s ILE 61 N 1.47 3.38 0.12 2.53 1.01 -0.90 -0.00 121.20 128.82 4ayk s ILE 61 Ca 0.07 -0.54 -0.12 0.00 0.00 0.00 0.00 60.65 60.06 4ayk s ILE 61 Cb -0.15 -2.45 0.01 0.00 0.01 0.00 0.00 42.46 39.88 4ayk s ILE 61 CO 0.08 0.51 0.30 -0.94 0.00 0.00 0.00 174.94 174.89 4ayk s SER 62 N 0.37 -0.03 -0.09 3.58 1.04 -0.97 -1.29 113.70 116.32 4ayk s SER 62 Ca -0.08 -0.58 -0.01 0.00 0.48 0.00 0.00 55.95 55.76 4ayk s SER 62 Cb -0.15 0.42 -0.03 0.00 0.10 0.00 0.00 66.02 66.36 4ayk s SER 62 CO 0.04 -0.83 -0.04 -0.36 0.98 0.00 0.00 173.24 173.04 4ayk s PHE 63 N -3.87 3.03 0.17 5.02 0.08 -1.26 -2.55 117.98 118.60 4ayk s PHE 63 Ca 0.07 0.03 0.05 0.00 0.12 0.00 0.00 56.93 57.21 4ayk s PHE 63 Cb 0.03 -1.78 -0.05 0.00 -0.57 0.00 0.00 43.02 40.66 4ayk s PHE 63 CO -0.08 0.32 -0.11 0.14 -0.10 0.00 0.00 175.22 175.39 4ayk s VAL 64 N -0.65 1.35 0.03 -0.44 -7.23 -1.10 -4.94 120.40 107.41 4ayk s VAL 64 Ca 0.10 -2.11 0.03 0.00 -1.81 0.00 0.00 61.98 58.19 4ayk s VAL 64 Cb -0.12 -1.92 -0.02 0.00 0.56 0.00 0.00 36.38 34.89 4ayk s VAL 64 CO 0.02 -0.69 -0.10 -0.13 -0.31 0.00 0.00 175.10 173.88 4ayk s ARG 65 N -3.72 0.70 1.59 4.82 0.52 -1.26 -2.44 118.95 119.17 4ayk s ARG 65 Ca 0.19 -0.62 0.00 0.00 -0.52 0.00 0.00 55.73 54.78 4ayk s ARG 65 Cb 0.02 -0.64 0.00 0.00 0.52 0.00 0.00 34.95 34.85 4ayk s ARG 65 CO 0.03 0.15 0.00 0.41 0.02 0.00 0.00 175.30 175.91 4ayk n GLY 66 N 2.04 1.66 3.73 -3.53 0.00 -1.26 -4.34 105.19 103.49 4ayk n GLY 66 Ca -0.18 -0.32 -0.41 0.00 0.00 0.00 0.00 46.02 45.10 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 7.37 -0.42 1.61 -1.08 -1.26 -3.77 116.67 115.12 4ayk s ASP 67 Ca 0.00 1.93 0.09 0.00 -0.52 0.00 0.00 52.55 54.05 4ayk s ASP 67 Cb 0.00 -2.59 0.30 0.00 -1.46 0.00 0.00 42.92 39.17 4ayk s ASP 67 CO 0.00 -0.17 0.67 0.00 0.52 0.00 0.00 175.17 176.20 4ayk n HIS 68 N 2.74 0.63 -3.72 -5.34 1.44 -1.26 -4.93 115.22 104.78 4ayk n HIS 68 Ca 0.03 -3.77 -0.23 0.00 -2.01 0.00 0.00 57.72 51.74 4ayk n HIS 68 Cb 0.48 -0.41 0.04 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 0.70 -5.29 -4.11 -1.40 1.74 -1.26 -4.98 116.66 102.05 4ayk n ARG 69 Ca 0.24 0.64 -0.10 0.00 -0.77 0.00 0.00 57.85 57.87 4ayk n ARG 69 Cb 0.57 -5.32 -0.09 0.00 -1.02 0.00 0.00 32.46 26.59 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 -4.10 0.26 0.00 0.55 1.01 -1.26 -5.03 116.67 108.10 4ayk s ASP 70 Ca 0.17 -1.13 0.18 0.00 0.71 0.00 0.00 52.55 52.48 4ayk s ASP 70 Cb -0.08 0.32 0.52 0.00 1.01 0.00 0.00 42.92 44.68 4ayk s ASP 70 CO 0.81 -0.75 1.43 0.59 0.21 0.00 0.00 175.17 177.45 4ayk n ASN 71 N -0.11 3.12 -3.23 0.27 3.02 -1.26 -4.47 115.26 112.60 4ayk n ASN 71 Ca -0.06 -2.00 -0.24 0.00 -0.03 0.00 0.00 54.58 52.25 4ayk n ASN 71 Cb 0.63 -0.39 -0.06 0.00 -0.61 0.00 0.00 39.78 39.35 4ayk n ASN 71 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 4ayk n SER 72 N 1.21 1.37 -4.76 6.41 7.64 -1.26 -5.12 113.62 119.12 4ayk n SER 72 Ca 0.19 -2.98 -0.37 0.00 1.01 0.00 0.00 58.87 56.73 4ayk n SER 72 Cb 0.49 -0.64 0.02 0.00 -1.01 0.00 0.00 64.21 63.07 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 -1.82 3.36 0.36 1.43 0.04 -1.26 -4.99 135.00 132.11 4ayk s PRO 73 Ca 0.38 1.94 -0.25 0.00 0.04 0.00 0.00 61.00 63.11 4ayk s PRO 73 Cb 0.20 -2.24 -0.10 0.00 0.04 0.00 0.00 34.50 32.40 4ayk s PRO 73 CO -0.08 -0.93 0.98 -0.06 0.04 0.00 0.00 177.00 176.95 4ayk s PHE 74 N -1.48 3.53 -0.44 0.56 0.08 -1.25 -4.98 117.98 114.01 4ayk s PHE 74 Ca 0.70 1.72 0.04 0.00 0.12 0.00 0.00 56.93 59.51 4ayk s PHE 74 Cb -0.33 -2.97 0.17 0.00 -0.57 0.00 0.00 43.02 39.32 4ayk s PHE 74 CO 0.39 -0.06 0.36 -3.47 -0.10 0.00 0.00 175.22 172.33 4ayk n ASP 75 N 0.25 -0.18 0.00 1.36 -0.08 -1.26 -4.68 116.55 111.95 4ayk n ASP 75 Ca 0.03 -2.45 0.00 0.00 -1.51 0.00 0.00 54.79 50.87 4ayk n ASP 75 Cb 0.50 -0.57 0.00 0.00 2.34 0.00 0.00 41.12 43.39 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 2.75 0.43 0.00 0.27 0.00 -1.26 -4.49 105.19 102.89 4ayk n GLY 76 Ca 0.29 -1.93 0.06 0.00 0.00 0.00 0.00 46.02 44.45 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 0.60 0.11 -2.24 1.61 -0.04 -1.26 -4.75 135.00 129.04 4ayk n PRO 77 Ca 0.00 0.21 -0.26 0.00 -0.04 0.00 0.00 63.50 63.41 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 -2.73 1.74 0.00 0.55 0.00 -1.26 -4.93 107.32 100.68 4ayk s GLY 78 Ca 0.10 -1.24 0.00 0.00 0.00 0.00 0.00 44.72 43.58 4ayk s GLY 78 CO 0.21 -0.69 0.00 0.61 0.00 0.00 0.00 173.10 173.23 4ayk n GLY 79 N -3.12 -1.67 3.78 0.20 0.00 -1.26 -4.68 105.19 98.43 4ayk n GLY 79 Ca 0.12 -1.58 -0.37 0.00 0.00 0.00 0.00 46.02 44.19 4ayk n GLY 79 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 4ayk s ASN 80 N -4.00 7.00 0.10 1.61 0.01 -1.26 -4.95 114.94 113.45 4ayk s ASN 80 Ca 0.00 2.01 0.23 0.00 -0.71 0.00 0.00 52.86 54.40 4ayk s ASN 80 Cb 0.00 -2.59 0.18 0.00 0.41 0.00 0.00 41.25 39.25 4ayk s ASN 80 CO 0.00 -0.32 1.16 0.18 -1.51 0.00 0.00 177.10 176.62 4ayk n LEU 81 N 0.29 0.67 -3.60 0.60 4.77 -1.26 -4.98 117.00 113.50 4ayk n LEU 81 Ca 0.03 0.14 -0.05 0.00 -0.03 0.00 0.00 56.01 56.10 4ayk n LEU 81 Cb 0.49 -0.13 -0.02 0.00 -2.33 0.00 0.00 43.42 41.43 4ayk n LEU 81 CO 0.46 -0.03 0.81 0.00 -1.33 0.00 0.00 177.39 177.30 4ayk s ALA 82 N -3.21 -1.89 -0.29 -1.18 0.00 -1.26 -2.26 121.76 111.68 4ayk s ALA 82 Ca 0.04 0.86 -0.10 0.00 0.00 0.00 0.00 51.96 52.76 4ayk s ALA 82 Cb 0.13 0.36 0.12 0.00 0.00 0.00 0.00 23.12 23.73 4ayk s ALA 82 CO 0.76 -0.81 0.63 -3.38 0.00 0.00 0.00 175.76 172.96 4ayk s HIS 83 N -2.93 -1.26 0.74 0.00 -3.43 -1.07 -5.02 115.29 102.32 4ayk s HIS 83 Ca 0.09 2.23 -0.07 0.00 -0.80 0.00 0.00 55.06 56.51 4ayk s HIS 83 Cb -0.00 0.74 0.09 0.00 -1.43 0.00 0.00 32.58 31.98 4ayk s HIS 83 CO -0.05 -0.63 1.05 0.00 -2.00 0.00 0.00 174.74 173.11 4ayk s ALA 84 N 2.72 3.15 0.07 -1.38 0.00 -1.26 -2.96 121.76 122.10 4ayk s ALA 84 Ca -0.06 -1.14 0.07 0.00 0.00 0.00 0.00 51.96 50.83 4ayk s ALA 84 Cb -0.11 -2.49 -0.04 0.00 0.00 0.00 0.00 23.12 20.48 4ayk s ALA 84 CO -0.18 -1.48 -0.12 -0.06 0.00 0.00 0.00 175.76 173.92 4ayk s PHE 85 N -3.30 2.71 0.62 0.00 0.40 -0.95 -4.96 117.98 112.50 4ayk s PHE 85 Ca 0.63 -0.17 -0.19 0.00 -0.60 0.00 0.00 56.93 56.61 4ayk s PHE 85 Cb -0.09 -1.46 -0.02 0.00 0.51 0.00 0.00 43.02 41.96 4ayk s PHE 85 CO 0.46 0.38 1.31 1.04 0.70 0.00 0.00 175.22 179.10 4ayk n GLN 86 N 1.05 1.27 -1.63 0.44 6.02 -1.26 -3.57 117.38 119.70 4ayk n GLN 86 Ca -0.15 0.49 -0.43 0.00 -0.01 0.00 0.00 57.00 56.90 4ayk n GLN 86 Cb 0.52 -2.55 -0.03 0.00 1.02 0.00 0.00 30.24 29.21 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 -3.24 3.37 0.14 -1.09 0.04 -1.26 -2.34 135.00 130.61 4ayk s PRO 87 Ca 0.80 2.15 -0.25 0.00 0.04 0.00 0.00 61.00 63.74 4ayk s PRO 87 Cb -0.39 -4.32 0.08 0.00 0.04 0.00 0.00 34.50 29.91 4ayk s PRO 87 CO 0.42 -1.83 1.04 0.20 0.04 0.00 0.00 177.00 176.87 4ayk s GLY 88 N 7.34 -0.15 0.76 0.56 0.00 -1.26 -4.75 107.32 109.81 4ayk s GLY 88 Ca 0.97 0.06 -0.11 0.00 0.00 0.00 0.00 44.72 45.64 4ayk s GLY 88 CO 0.37 0.84 1.08 2.56 0.00 0.00 0.00 173.10 177.95 4ayk s PRO 89 N -2.80 2.41 7.90 2.90 0.04 -1.26 -3.30 135.00 140.90 4ayk s PRO 89 Ca 0.16 0.92 0.00 0.00 0.04 0.00 0.00 61.00 62.12 4ayk s PRO 89 Cb -0.01 -1.93 0.00 0.00 0.04 0.00 0.00 34.50 32.60 4ayk s PRO 89 CO 0.02 -1.46 0.00 0.41 0.04 0.00 0.00 177.00 176.01 4ayk n GLY 90 N -1.75 2.34 0.03 0.56 0.00 -1.26 -2.98 105.19 102.13 4ayk n GLY 90 Ca 0.08 -0.42 0.14 0.00 0.00 0.00 0.00 46.02 45.82 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 -1.77 -0.61 3.06 -1.26 -4.84 119.36 114.11 4ayk n ILE 91 Ca 0.00 -0.08 -0.39 0.00 -2.50 0.00 0.00 62.75 59.77 4ayk n ILE 91 Cb 0.00 -0.48 0.03 0.00 0.54 0.00 0.00 39.64 39.73 4ayk n ILE 91 CO 0.00 0.00 0.00 -0.83 -2.50 0.00 0.00 176.55 173.22 4ayk s GLY 92 N -3.17 2.91 0.00 4.50 0.00 -1.16 -1.71 107.32 108.69 4ayk s GLY 92 Ca 0.13 1.42 0.00 0.00 0.00 0.00 0.00 44.72 46.27 4ayk s GLY 92 CO 0.56 2.00 0.00 0.61 0.00 0.00 0.00 173.10 176.27 4ayk n GLY 93 N 0.64 2.68 3.72 0.20 0.00 -0.99 -4.30 105.19 107.14 4ayk n GLY 93 Ca 0.08 0.00 -0.30 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 -2.07 3.65 -0.06 1.61 1.11 -0.69 -3.38 116.67 116.84 4ayk s ASP 94 Ca 0.00 1.78 -0.03 0.00 0.18 0.00 0.00 52.55 54.48 4ayk s ASP 94 Cb 0.00 -2.41 0.04 0.00 1.07 0.00 0.00 42.92 41.62 4ayk s ASP 94 CO 0.00 -2.57 0.11 0.00 1.18 0.00 0.00 175.17 173.89 4ayk s ALA 95 N -2.84 0.01 -0.14 5.23 0.00 0.99 -2.23 121.76 122.79 4ayk s ALA 95 Ca 0.63 0.40 -0.05 0.00 0.00 0.00 0.00 51.96 52.94 4ayk s ALA 95 Cb -0.19 -0.71 -0.04 0.00 0.00 0.00 0.00 23.12 22.18 4ayk s ALA 95 CO 0.57 -0.51 0.04 -1.01 0.00 0.00 0.00 175.76 174.85 4ayk s HIS 96 N 2.19 3.25 -0.11 0.00 3.76 -1.16 -2.28 115.29 120.94 4ayk s HIS 96 Ca 0.03 0.13 0.02 0.00 -0.15 0.00 0.00 55.06 55.09 4ayk s HIS 96 Cb -0.12 -1.96 -0.01 0.00 1.11 0.00 0.00 32.58 31.60 4ayk s HIS 96 CO -0.05 0.30 -0.18 -0.06 -0.85 0.00 0.00 174.74 173.90 4ayk s PHE 97 N -0.18 2.68 0.02 1.40 0.40 -1.06 -2.61 117.98 118.63 4ayk s PHE 97 Ca 0.07 -0.79 -0.30 0.00 -0.60 0.00 0.00 56.93 55.30 4ayk s PHE 97 Cb -0.12 -1.76 -0.07 0.00 0.51 0.00 0.00 43.02 41.58 4ayk s PHE 97 CO 0.02 -0.28 1.57 0.34 0.70 0.00 0.00 175.22 177.57 4ayk s ASP 98 N 0.25 6.70 0.00 1.36 -1.08 -0.96 -2.72 116.67 120.22 4ayk s ASP 98 Ca -0.13 2.31 0.21 0.00 -0.52 0.00 0.00 52.55 54.43 4ayk s ASP 98 Cb -0.16 -2.56 0.18 0.00 -1.46 0.00 0.00 42.92 38.92 4ayk s ASP 98 CO 0.07 -0.84 1.19 1.21 0.52 0.00 0.00 175.17 177.31 4ayk n GLU 99 N 5.88 2.00 0.25 4.34 4.07 -1.02 -4.22 120.64 131.94 4ayk n GLU 99 Ca 0.15 -1.80 0.15 0.00 -0.06 0.00 0.00 57.16 55.60 4ayk n GLU 99 Cb 0.42 -1.41 0.49 0.00 -0.06 0.00 0.00 31.44 30.88 4ayk n GLU 99 CO 0.00 0.00 0.00 -0.44 -0.06 0.00 0.00 177.13 176.63 4ayk h ASP 100 N 4.20 0.00 -2.51 4.31 3.32 -1.90 -3.43 116.42 120.41 4ayk h ASP 100 Ca 0.00 0.00 -0.53 0.00 0.02 0.00 0.00 57.03 56.52 4ayk h ASP 100 Cb 0.90 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.42 4ayk h ASP 100 CO 0.00 0.00 -0.47 -1.61 -1.72 0.00 0.00 179.24 175.44 4ayk s GLU 101 N -3.48 3.39 -0.22 3.56 2.02 -1.26 -4.98 118.70 117.74 4ayk s GLU 101 Ca 0.04 -0.65 -0.24 0.00 0.02 0.00 0.00 54.97 54.14 4ayk s GLU 101 Cb 0.08 -2.93 -0.01 0.00 0.10 0.00 0.00 34.13 31.37 4ayk s GLU 101 CO 0.58 0.50 0.77 0.50 0.02 0.00 0.00 175.26 177.64 4ayk s ARG 102 N -3.34 4.21 0.26 1.61 3.52 -1.26 -5.04 118.95 118.91 4ayk s ARG 102 Ca 0.34 0.86 -0.14 0.00 -0.13 0.00 0.00 55.73 56.67 4ayk s ARG 102 Cb -0.11 -3.61 -0.08 0.00 -1.56 0.00 0.00 34.95 29.59 4ayk s ARG 102 CO 0.28 -0.41 0.65 -1.58 -0.81 0.00 0.00 175.30 173.43 4ayk s TRP 103 N 2.46 3.45 0.16 5.12 0.52 -1.26 -4.64 118.94 124.74 4ayk s TRP 103 Ca 0.34 1.10 0.07 0.00 0.02 0.00 0.00 56.10 57.63 4ayk s TRP 103 Cb -0.16 -2.43 -0.04 0.00 -1.15 0.00 0.00 33.47 29.69 4ayk s TRP 103 CO 0.09 0.22 -0.16 0.95 0.02 0.00 0.00 176.95 178.08 4ayk s THR 104 N -1.81 1.62 -0.38 2.01 -4.23 -1.11 -4.93 115.64 106.81 4ayk s THR 104 Ca 0.49 -1.94 0.06 0.00 -1.18 0.00 0.00 61.69 59.11 4ayk s THR 104 Cb -0.12 -1.80 0.57 0.00 1.34 0.00 0.00 72.50 72.48 4ayk s THR 104 CO 0.19 -0.44 1.67 0.59 -0.54 0.00 0.00 174.62 176.09 4ayk n ASN 105 N 0.16 3.35 -0.50 3.99 3.02 -1.26 -3.08 115.26 120.94 4ayk n ASN 105 Ca -0.12 -3.73 0.00 0.00 -0.03 0.00 0.00 54.58 50.70 4ayk n ASN 105 Cb 0.58 -0.73 0.00 0.00 -0.61 0.00 0.00 39.78 39.02 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 -1.11 0.00 -1.43 6.41 0.23 -1.26 -5.01 115.26 113.09 4ayk n ASN 106 Ca 0.46 -0.50 -0.06 0.00 -0.53 0.00 0.00 54.58 53.95 4ayk n ASN 106 Cb 1.26 0.00 0.03 0.00 -2.08 0.00 0.00 39.78 38.99 4ayk n ASN 106 CO 0.00 0.00 0.00 0.49 -0.93 0.00 0.00 177.26 176.82 4ayk n PHE 107 N 0.00 0.68 -0.28 -2.53 3.72 -1.26 -4.71 117.46 113.08 4ayk n PHE 107 Ca 0.00 -1.04 0.00 0.00 -0.05 0.00 0.00 57.45 56.36 4ayk n PHE 107 Cb 0.00 -0.52 0.00 0.00 -0.94 0.00 0.00 39.48 38.02 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 0.47 0.55 0.24 -1.08 1.74 -1.26 -4.95 116.66 112.36 4ayk n ARG 108 Ca 0.13 0.00 -0.17 0.00 -0.77 0.00 0.00 57.85 57.04 4ayk n ARG 108 Cb 0.67 0.00 -0.09 0.00 -1.02 0.00 0.00 32.46 32.02 4ayk n ARG 108 CO 0.00 0.00 0.00 0.93 -1.52 0.00 0.00 177.63 177.04 4ayk h GLU 109 N 0.00 -0.87 -5.30 5.56 5.08 -1.96 -3.41 114.58 113.68 4ayk h GLU 109 Ca 0.00 0.06 -0.63 0.00 -1.00 0.00 0.00 59.36 57.79 4ayk h GLU 109 Cb 0.00 0.20 -0.20 0.00 0.50 0.00 0.00 28.75 29.25 4ayk h GLU 109 CO 0.00 -0.58 -0.63 0.71 -1.00 0.00 0.00 179.01 177.51 4ayk s TYR 110 N -5.87 3.10 -0.29 4.33 2.02 -1.26 -5.07 117.35 114.30 4ayk s TYR 110 Ca -0.17 -0.18 -0.10 0.00 -0.37 0.00 0.00 57.07 56.25 4ayk s TYR 110 Cb 0.05 -1.99 -0.03 0.00 -0.40 0.00 0.00 41.96 39.59 4ayk s TYR 110 CO 0.61 0.03 0.16 -0.80 -1.57 0.00 0.00 175.55 173.98 4ayk s ASN 111 N 0.35 5.67 0.03 2.29 0.01 -1.26 -2.75 114.94 119.28 4ayk s ASN 111 Ca -0.02 -0.29 -0.24 0.00 -0.71 0.00 0.00 52.86 51.61 4ayk s ASN 111 Cb -0.14 -2.04 -0.17 0.00 0.41 0.00 0.00 41.25 39.32 4ayk s ASN 111 CO 0.02 -0.12 1.46 0.25 -1.51 0.00 0.00 177.10 177.19 4ayk h LEU 112 N 8.35 0.07 -0.98 0.60 5.85 -1.88 -3.09 115.31 124.23 4ayk h LEU 112 Ca -0.34 -0.31 0.01 0.00 0.84 0.00 0.00 57.88 58.08 4ayk h LEU 112 Cb 1.17 -0.02 -0.05 0.00 0.37 0.00 0.00 40.66 42.13 4ayk h LEU 112 CO 0.59 0.36 0.65 -0.74 -0.34 0.00 0.00 178.44 178.96 4ayk h HIS 113 N -0.22 1.23 -0.88 1.25 2.76 -1.91 -0.89 115.15 116.49 4ayk h HIS 113 Ca 0.01 0.03 0.01 0.00 -2.20 0.00 0.00 60.37 58.22 4ayk h HIS 113 Cb 0.32 -0.42 -0.04 0.00 1.55 0.00 0.00 27.41 28.82 4ayk h HIS 113 CO 0.03 0.77 0.58 0.00 -1.30 0.00 0.00 177.93 178.01 4ayk h ARG 114 N 1.32 1.16 -0.38 5.26 2.47 -1.97 0.36 114.38 122.60 4ayk h ARG 114 Ca 0.36 -0.07 -0.16 0.00 -1.26 0.00 0.00 59.98 58.85 4ayk h ARG 114 Cb -0.14 -0.26 -0.01 0.00 -1.65 0.00 0.00 29.97 27.91 4ayk h ARG 114 CO -0.08 0.77 -0.40 0.28 0.56 0.00 0.00 179.97 181.09 4ayk h VAL 115 N 1.20 1.27 -0.99 2.04 2.07 -1.36 -2.81 116.25 117.67 4ayk h VAL 115 Ca 0.32 -1.58 0.00 0.00 0.82 0.00 0.00 66.70 66.27 4ayk h VAL 115 Cb -0.14 1.40 -0.05 0.00 -1.52 0.00 0.00 31.29 30.99 4ayk h VAL 115 CO -0.07 0.53 0.63 0.00 0.02 0.00 0.00 177.57 178.68 4ayk h ALA 116 N 0.76 1.26 -0.90 1.67 0.00 -0.51 0.18 119.26 121.72 4ayk h ALA 116 Ca 0.06 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 4ayk h ALA 116 Cb 1.00 -0.40 -0.04 0.00 0.00 0.00 0.00 17.79 18.35 4ayk h ALA 116 CO 0.10 0.67 0.52 0.00 0.00 0.00 0.00 179.25 180.54 4ayk h ALA 117 N 1.35 1.14 -0.13 0.00 0.00 -0.76 -0.49 119.26 120.38 4ayk h ALA 117 Ca 0.36 -0.11 -0.06 0.00 0.00 0.00 0.00 54.91 55.10 4ayk h ALA 117 Cb -0.12 -0.36 -0.00 0.00 0.00 0.00 0.00 17.79 17.31 4ayk h ALA 117 CO -0.07 0.62 -0.14 1.25 0.00 0.00 0.00 179.25 180.91 4ayk h HIS 118 N 1.24 0.38 -0.96 0.00 2.76 -1.10 -2.31 115.15 115.16 4ayk h HIS 118 Ca 0.32 -0.12 0.03 0.00 -2.20 0.00 0.00 60.37 58.40 4ayk h HIS 118 Cb -0.02 -0.08 -0.05 0.00 1.55 0.00 0.00 27.41 28.81 4ayk h HIS 118 CO 0.01 0.73 0.63 0.93 -1.30 0.00 0.00 177.93 178.93 4ayk h GLU 119 N -0.07 1.21 -0.41 5.26 4.39 -0.72 -0.81 114.58 123.43 4ayk h GLU 119 Ca 0.02 -0.07 -0.06 0.00 0.34 0.00 0.00 59.36 59.58 4ayk h GLU 119 Cb 0.67 -0.27 -0.02 0.00 -0.10 0.00 0.00 28.75 29.03 4ayk h GLU 119 CO 0.03 0.80 -0.00 -0.07 -1.16 0.00 0.00 179.01 178.61 4ayk h LEU 120 N 1.24 0.62 -0.96 1.33 3.38 -1.05 -2.45 115.31 117.43 4ayk h LEU 120 Ca 0.37 -0.13 0.01 0.00 0.09 0.00 0.00 57.88 58.22 4ayk h LEU 120 Cb -0.05 -0.16 -0.05 0.00 0.09 0.00 0.00 40.66 40.49 4ayk h LEU 120 CO -0.11 0.69 0.64 1.23 0.09 0.00 0.00 178.44 180.99 4ayk h GLY 121 N 0.92 1.36 1.25 0.83 0.00 -0.57 -1.07 103.07 105.79 4ayk h GLY 121 Ca 0.13 -0.50 -0.10 0.00 0.00 0.00 0.00 47.33 46.85 4ayk h GLY 121 CO 0.01 0.48 -0.12 0.45 0.00 0.00 0.00 176.54 177.36 4ayk h HIS 122 N 1.29 0.97 0.00 5.60 3.86 -1.03 0.67 115.15 126.51 4ayk h HIS 122 Ca 0.36 -0.19 -0.03 0.00 -1.16 0.00 0.00 60.37 59.34 4ayk h HIS 122 Cb -0.13 -0.24 -0.00 0.00 1.06 0.00 0.00 27.41 28.10 4ayk h HIS 122 CO -0.00 0.94 -0.15 0.66 0.86 0.00 0.00 177.93 180.24 4ayk h SER 123 N 0.78 0.00 0.14 2.45 4.64 -1.00 -1.63 113.55 118.93 4ayk h SER 123 Ca 0.13 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.45 4ayk h SER 123 Cb 0.64 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.73 4ayk h SER 123 CO 0.04 0.15 -0.08 0.18 -0.87 0.00 0.00 176.83 176.25 4ayk n LEU 124 N -3.37 0.88 0.00 5.97 4.77 -0.48 -4.81 117.00 119.96 4ayk n LEU 124 Ca -0.00 -0.23 0.00 0.00 -0.03 0.00 0.00 56.01 55.75 4ayk n LEU 124 Cb 0.35 -0.08 0.00 0.00 -2.33 0.00 0.00 43.42 41.37 4ayk n LEU 124 CO 0.31 0.15 0.00 0.61 -1.33 0.00 0.00 177.39 177.13 4ayk n GLY 125 N 1.21 0.63 3.70 -0.72 0.00 -0.61 -4.96 105.19 104.43 4ayk n GLY 125 Ca 0.17 -0.33 -0.41 0.00 0.00 0.00 0.00 46.02 45.45 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 4.30 0.73 0.99 1.43 0.18 -5.00 118.68 121.31 4ayk s LEU 126 Ca 0.00 1.35 -0.05 0.00 -1.03 0.00 0.00 54.13 54.40 4ayk s LEU 126 Cb 0.00 -3.29 0.10 0.00 0.03 0.00 0.00 46.19 43.03 4ayk s LEU 126 CO 0.00 -0.24 1.02 -0.44 0.23 0.00 0.00 176.35 176.92 4ayk s SER 127 N 0.96 4.45 0.78 2.29 0.01 -1.26 -4.16 113.70 116.77 4ayk s SER 127 Ca 0.43 0.09 -0.12 0.00 1.31 0.00 0.00 55.95 57.66 4ayk s SER 127 Cb -0.18 -0.59 0.06 0.00 0.21 0.00 0.00 66.02 65.52 4ayk s SER 127 CO 0.20 -1.80 1.12 -1.00 0.41 0.00 0.00 173.24 172.16 4ayk s HIS 128 N -3.25 2.34 0.16 2.43 0.09 -1.26 -5.02 115.29 110.77 4ayk s HIS 128 Ca 0.64 1.61 0.07 0.00 -0.00 0.00 0.00 55.06 57.38 4ayk s HIS 128 Cb -0.08 -3.17 -0.04 0.00 -0.00 0.00 0.00 32.58 29.29 4ayk s HIS 128 CO 0.45 -2.06 -0.15 0.45 -0.00 0.00 0.00 174.74 173.43 4ayk s SER 129 N -2.96 2.30 0.00 1.40 0.15 -1.25 -5.03 113.70 108.31 4ayk s SER 129 Ca 0.65 -0.90 0.22 0.00 0.70 0.00 0.00 55.95 56.62 4ayk s SER 129 Cb -0.20 -0.10 0.56 0.00 -1.71 0.00 0.00 66.02 64.56 4ayk s SER 129 CO 0.53 -0.14 1.47 0.35 1.20 0.00 0.00 173.24 176.65 4ayk n THR 130 N 0.17 0.84 -2.76 6.45 -2.24 -1.26 -4.66 114.28 110.81 4ayk n THR 130 Ca -0.12 -0.92 -0.42 0.00 -2.27 0.00 0.00 64.05 60.32 4ayk n THR 130 Cb 0.58 0.66 -0.03 0.00 -2.10 0.00 0.00 70.33 69.44 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 -1.14 7.31 0.26 3.42 -1.08 -1.26 -4.94 116.67 119.24 4ayk s ASP 131 Ca 0.44 1.59 -0.06 0.00 -0.52 0.00 0.00 52.55 54.01 4ayk s ASP 131 Cb 0.24 -2.55 0.28 0.00 -1.46 0.00 0.00 42.92 39.43 4ayk s ASP 131 CO 0.32 -0.24 1.93 0.40 0.52 0.00 0.00 175.17 178.11 4ayk h ILE 132 N 4.79 1.25 0.00 4.11 2.04 -1.99 -1.44 117.51 126.27 4ayk h ILE 132 Ca -0.41 -0.46 0.00 0.00 1.00 0.00 0.00 64.86 64.99 4ayk h ILE 132 Cb 1.22 -0.20 0.00 0.00 -0.74 0.00 0.00 36.82 37.09 4ayk h ILE 132 CO 0.75 0.24 0.00 0.61 0.00 0.00 0.00 178.15 179.75 4ayk n GLY 133 N -1.38 -0.93 3.75 5.37 0.00 -1.26 -4.80 105.19 105.94 4ayk n GLY 133 Ca 0.12 -0.16 -0.40 0.00 0.00 0.00 0.00 46.02 45.58 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 3.37 0.33 4.61 0.00 -0.54 -4.62 121.76 122.90 4ayk s ALA 134 Ca 0.38 0.44 0.25 0.00 0.00 0.00 0.00 51.96 53.03 4ayk s ALA 134 Cb 0.18 -3.08 1.20 0.00 0.00 0.00 0.00 23.12 21.41 4ayk s ALA 134 CO 0.30 0.17 1.97 -0.07 0.00 0.00 0.00 175.76 178.12 4ayk h LEU 135 N 4.79 0.00 -5.50 0.00 3.38 -1.87 -3.29 115.31 112.82 4ayk h LEU 135 Ca -0.45 0.00 -0.51 0.00 0.09 0.00 0.00 57.88 57.01 4ayk h LEU 135 Cb 1.21 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.98 4ayk h LEU 135 CO 0.69 0.19 2.94 0.23 0.09 0.00 0.00 178.44 182.57 4ayk n MET 136 N -3.62 2.49 -2.32 1.13 2.81 -1.26 -4.89 117.12 111.47 4ayk n MET 136 Ca -0.01 -1.79 -0.42 0.00 -1.81 0.00 0.00 57.70 53.67 4ayk n MET 136 Cb 0.32 -2.66 -0.03 0.00 -0.71 0.00 0.00 33.22 30.13 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 3.28 3.31 0.12 2.03 6.14 -1.24 -3.78 117.35 127.20 4ayk s TYR 137 Ca 0.50 1.13 -0.34 0.00 0.64 0.00 0.00 57.07 59.01 4ayk s TYR 137 Cb 0.13 -3.53 -0.12 0.00 0.42 0.00 0.00 41.96 38.85 4ayk s TYR 137 CO -0.03 -1.77 1.55 -1.35 0.64 0.00 0.00 175.55 174.60 4ayk h PRO 138 N 6.91 -0.54 -6.36 4.97 0.11 -1.91 -3.43 132.00 131.75 4ayk h PRO 138 Ca -0.41 0.04 -0.48 0.00 0.11 0.00 0.00 66.00 65.26 4ayk h PRO 138 Cb 1.21 0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.44 4ayk h PRO 138 CO 0.84 -0.36 -0.25 0.45 -0.21 0.00 0.00 178.00 178.47 4ayk s SER 139 N -4.88 5.23 0.11 -2.05 0.15 -1.26 -5.09 113.70 105.91 4ayk s SER 139 Ca -0.15 -0.72 -0.23 0.00 0.70 0.00 0.00 55.95 55.55 4ayk s SER 139 Cb 0.07 -0.26 -0.07 0.00 -1.71 0.00 0.00 66.02 64.05 4ayk s SER 139 CO 0.61 -0.92 0.71 -0.47 1.20 0.00 0.00 173.24 174.37 4ayk s TYR 140 N -2.52 3.84 0.07 3.44 5.04 -1.26 -5.04 117.35 120.92 4ayk s TYR 140 Ca 0.53 1.49 -0.02 0.00 -2.44 0.00 0.00 57.07 56.63 4ayk s TYR 140 Cb -0.06 -2.70 0.01 0.00 0.35 0.00 0.00 41.96 39.56 4ayk s TYR 140 CO 0.32 0.49 0.12 0.25 -1.34 0.00 0.00 175.55 175.38 4ayk n THR 141 N 1.89 0.00 -1.79 4.34 -2.24 -1.26 -5.12 114.28 110.10 4ayk n THR 141 Ca -0.06 -0.27 -0.42 0.00 -2.27 0.00 0.00 64.05 61.03 4ayk n THR 141 Cb 0.50 0.20 -0.03 0.00 -2.10 0.00 0.00 70.33 68.90 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 -6.08 2.95 0.32 4.78 -0.12 -1.26 -4.98 117.98 113.58 4ayk s PHE 142 Ca 0.04 0.44 -0.03 0.00 -0.05 0.00 0.00 56.93 57.34 4ayk s PHE 142 Cb -0.01 -4.07 -0.04 0.00 -0.63 0.00 0.00 43.02 38.27 4ayk s PHE 142 CO 0.03 -4.03 0.56 -1.54 -0.05 0.00 0.00 175.22 170.19 4ayk s SER 143 N 1.14 6.38 0.00 1.98 1.04 -1.26 -5.10 113.70 117.89 4ayk s SER 143 Ca 0.73 0.63 0.00 0.00 0.48 0.00 0.00 55.95 57.79 4ayk s SER 143 Cb -0.48 -2.11 0.00 0.00 0.10 0.00 0.00 66.02 63.53 4ayk s SER 143 CO 0.32 -0.24 0.00 0.61 0.98 0.00 0.00 173.24 174.91 4ayk n GLY 144 N -1.27 0.85 3.86 7.32 0.00 -1.26 -5.07 105.19 109.61 4ayk n GLY 144 Ca -0.03 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.68 4ayk n GLY 144 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 4ayk s ASP 145 N -0.52 6.68 -0.98 1.61 -4.77 -1.26 -4.98 116.67 112.45 4ayk s ASP 145 Ca 0.00 1.28 -0.21 0.00 -3.30 0.00 0.00 52.55 50.32 4ayk s ASP 145 Cb 0.00 -2.38 0.10 0.00 -1.09 0.00 0.00 42.92 39.55 4ayk s ASP 145 CO 0.00 -0.32 1.28 -0.69 0.70 0.00 0.00 175.17 176.14 4ayk s VAL 146 N -2.20 4.37 0.03 2.11 1.01 -1.26 -4.94 120.40 119.52 4ayk s VAL 146 Ca 0.54 -1.24 -0.14 0.00 0.00 0.00 0.00 61.98 61.14 4ayk s VAL 146 Cb -0.10 -4.91 0.02 0.00 0.00 0.00 0.00 36.38 31.39 4ayk s VAL 146 CO 0.24 -1.71 0.31 -1.10 0.00 0.00 0.00 175.10 172.84 4ayk s GLN 147 N 3.70 0.79 0.41 2.72 -0.21 -1.26 -5.15 119.66 120.67 4ayk s GLN 147 Ca 0.39 -0.45 -0.23 0.00 0.02 0.00 0.00 55.36 55.09 4ayk s GLN 147 Cb -0.03 0.35 -0.09 0.00 1.00 0.00 0.00 33.01 34.24 4ayk s GLN 147 CO -0.09 -0.25 1.03 -0.51 -2.12 0.00 0.00 175.29 173.35 4ayk s LEU 148 N -1.95 4.08 0.43 2.90 1.43 -1.26 -4.88 118.68 119.42 4ayk s LEU 148 Ca -0.06 1.98 -0.02 0.00 -1.03 0.00 0.00 54.13 55.00 4ayk s LEU 148 Cb -0.01 -4.27 -0.02 0.00 0.03 0.00 0.00 46.19 41.91 4ayk s LEU 148 CO -0.02 -0.51 0.68 0.00 0.23 0.00 0.00 176.35 176.72 4ayk s ALA 149 N -1.75 3.59 0.25 4.21 0.00 -1.26 -4.91 121.76 121.89 4ayk s ALA 149 Ca 0.59 -0.81 -0.06 0.00 0.00 0.00 0.00 51.96 51.68 4ayk s ALA 149 Cb -0.20 -2.29 0.26 0.00 0.00 0.00 0.00 23.12 20.89 4ayk s ALA 149 CO 0.25 -0.27 1.92 0.37 0.00 0.00 0.00 175.76 178.03 4ayk h GLN 150 N 0.44 1.31 -0.86 0.00 4.15 -1.96 0.16 115.11 118.35 4ayk h GLN 150 Ca -0.48 -0.09 0.03 0.00 0.77 0.00 0.00 58.65 58.88 4ayk h GLN 150 Cb 1.23 -0.29 -0.05 0.00 0.21 0.00 0.00 27.48 28.58 4ayk h GLN 150 CO 0.60 0.88 0.56 0.22 -1.93 0.00 0.00 178.83 179.16 4ayk h ASP 151 N 1.34 0.94 -0.12 -0.69 1.82 -1.96 0.78 116.42 118.54 4ayk h ASP 151 Ca 0.36 -0.01 -0.23 0.00 -0.39 0.00 0.00 57.03 56.75 4ayk h ASP 151 Cb -0.13 -0.22 0.01 0.00 0.68 0.00 0.00 39.33 39.68 4ayk h ASP 151 CO -0.07 0.65 -0.84 0.44 -1.61 0.00 0.00 179.24 177.81 4ayk h ASP 152 N 1.10 0.94 0.01 2.28 3.32 -1.74 -2.26 116.42 120.08 4ayk h ASP 152 Ca 0.34 -0.66 -0.00 0.00 0.02 0.00 0.00 57.03 56.73 4ayk h ASP 152 Cb -0.03 -0.28 0.00 0.00 0.22 0.00 0.00 39.33 39.24 4ayk h ASP 152 CO -0.10 1.45 -0.01 0.40 -1.72 0.00 0.00 179.24 179.26 4ayk h ILE 153 N 0.50 1.15 -0.96 0.35 2.04 -0.59 -1.96 117.51 118.04 4ayk h ILE 153 Ca -0.07 -0.48 -0.00 0.00 1.00 0.00 0.00 64.86 65.31 4ayk h ILE 153 Cb 1.48 1.47 -0.05 0.00 -0.74 0.00 0.00 36.82 38.98 4ayk h ILE 153 CO 0.17 0.12 0.60 0.44 0.00 0.00 0.00 178.15 179.48 4ayk h ASP 154 N -0.22 1.14 0.87 1.72 3.32 -0.93 -0.44 116.42 121.88 4ayk h ASP 154 Ca -0.00 -0.06 -0.04 0.00 0.02 0.00 0.00 57.03 56.95 4ayk h ASP 154 Cb 0.22 -0.29 0.01 0.00 0.22 0.00 0.00 39.33 39.49 4ayk h ASP 154 CO 0.00 0.86 -0.42 1.23 -1.72 0.00 0.00 179.24 179.19 4ayk h GLY 155 N 1.32 -1.22 1.02 2.75 0.00 -1.20 0.71 103.07 106.45 4ayk h GLY 155 Ca 0.35 0.45 0.01 0.00 0.00 0.00 0.00 47.33 48.14 4ayk h GLY 155 CO -0.07 -0.44 0.64 1.19 0.00 0.00 0.00 176.54 177.86 4ayk h ILE 156 N -1.22 1.26 -0.52 2.60 6.09 -1.32 -1.40 117.51 122.99 4ayk h ILE 156 Ca -0.12 -0.49 -0.08 0.00 -1.37 0.00 0.00 64.86 62.79 4ayk h ILE 156 Cb 0.90 -0.18 -0.02 0.00 0.47 0.00 0.00 36.82 37.99 4ayk h ILE 156 CO 0.20 0.26 -0.01 1.56 -3.07 0.00 0.00 178.15 177.08 4ayk h GLN 157 N 1.35 0.90 -0.61 2.19 4.20 -0.97 -2.51 115.11 119.65 4ayk h GLN 157 Ca 0.36 -0.26 0.00 0.00 0.06 0.00 0.00 58.65 58.81 4ayk h GLN 157 Cb -0.13 -0.09 -0.03 0.00 0.30 0.00 0.00 27.48 27.53 4ayk h GLN 157 CO -0.07 0.90 0.40 0.00 -0.67 0.00 0.00 178.83 179.38 4ayk h ALA 158 N 1.15 0.77 0.01 3.87 0.00 0.15 2.37 119.26 127.58 4ayk h ALA 158 Ca 0.15 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 4ayk h ALA 158 Cb 0.51 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.05 4ayk h ALA 158 CO 0.03 0.21 -0.01 0.82 0.00 0.00 0.00 179.25 180.30 4ayk h ILE 159 N 0.82 1.00 0.00 0.00 2.04 -1.08 -3.39 117.51 116.90 4ayk h ILE 159 Ca 0.22 -0.02 0.00 0.00 1.00 0.00 0.00 64.86 66.06 4ayk h ILE 159 Cb -0.08 1.01 0.00 0.00 -0.74 0.00 0.00 36.82 37.01 4ayk h ILE 159 CO -0.05 0.01 0.00 -1.22 0.00 0.00 0.00 178.15 176.89 4ayk n TYR 160 N -5.09 0.00 -0.94 1.37 4.02 -0.97 -5.13 117.16 110.42 4ayk n TYR 160 Ca -0.07 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.82 4ayk n TYR 160 Cb 0.04 -0.07 0.00 0.00 -0.02 0.00 0.00 39.34 39.29 4ayk n TYR 160 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 4ayk n GLY 161 N 1.67 -2.36 3.85 2.72 0.00 0.80 -5.03 105.19 106.82 4ayk n GLY 161 Ca 0.00 -1.25 -0.34 0.00 0.00 0.00 0.00 46.02 44.42 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 -1.93 3.97 -1.25 1.61 0.52 -1.26 -4.45 118.95 116.17 4ayk s ARG 162 Ca 0.00 0.50 -0.19 0.00 -0.52 0.00 0.00 55.73 55.52 4ayk s ARG 162 Cb 0.00 -2.82 0.00 0.00 0.52 0.00 0.00 34.95 32.65 4ayk s ARG 162 CO 0.00 0.41 1.88 0.43 0.02 0.00 0.00 175.30 178.04 4ayk n SER 163 N 0.49 4.06 -4.65 0.23 7.64 -1.26 -4.88 113.62 115.25 4ayk n SER 163 Ca -0.03 -2.83 -0.36 0.00 1.01 0.00 0.00 58.87 56.66 4ayk n SER 163 Cb 0.52 -1.68 -0.10 0.00 -1.01 0.00 0.00 64.21 61.95 4ayk n SER 163 CO 0.00 0.00 0.00 -1.10 -3.01 0.00 0.00 175.04 170.93 4ayk s GLN 164 N 4.73 4.06 -0.48 1.43 -1.52 -1.26 -5.00 119.66 121.62 4ayk s GLN 164 Ca 0.57 -0.28 0.06 0.00 -1.95 0.00 0.00 55.36 53.77 4ayk s GLN 164 Cb 0.05 -3.52 0.21 0.00 -0.22 0.00 0.00 33.01 29.53 4ayk s GLN 164 CO 0.07 0.06 0.70 0.09 -0.25 0.00 0.00 175.29 175.96 4ayk n ASN 165 N 4.28 -2.39 -2.46 5.90 5.03 -1.26 -5.02 115.26 119.34 4ayk n ASN 165 Ca -0.15 -2.94 -0.22 0.00 0.87 0.00 0.00 54.58 52.14 4ayk n ASN 165 Cb 0.52 1.14 -0.11 0.00 -1.02 0.00 0.00 39.78 40.31 4ayk n ASN 165 CO 0.00 0.00 0.00 -0.81 -1.83 0.00 0.00 177.26 174.62 4ayk n PRO 166 N 2.31 2.61 -3.14 3.52 -0.04 -1.26 -4.91 135.00 134.09 4ayk n PRO 166 Ca 0.17 -1.72 -0.39 0.00 -0.04 0.00 0.00 63.50 61.52 4ayk n PRO 166 Cb 0.57 -2.22 -0.05 0.00 -0.04 0.00 0.00 33.50 31.75 4ayk n PRO 166 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 4ayk s VAL 167 N 0.28 5.06 -0.62 0.52 1.01 -1.26 -5.01 120.40 120.38 4ayk s VAL 167 Ca 0.65 1.22 0.05 0.00 0.00 0.00 0.00 61.98 63.89 4ayk s VAL 167 Cb 0.30 -3.95 0.17 0.00 0.00 0.00 0.00 36.38 32.90 4ayk s VAL 167 CO -0.07 0.20 0.46 0.00 0.00 0.00 0.00 175.10 175.69 4ayk n GLN 168 N 4.38 1.38 0.00 2.72 6.02 -1.26 -5.32 117.38 125.29 4ayk n GLN 168 Ca -0.02 -4.11 0.00 0.00 -0.01 0.00 0.00 57.00 52.86 4ayk n GLN 168 Cb 0.51 -2.10 0.00 0.00 1.02 0.00 0.00 30.24 29.67 4ayk n GLN 168 CO 0.00 0.00 0.00 -2.30 -1.01 0.00 0.00 177.06 173.75