#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 4ayk s LEU 2 N 0.00 4.17 -0.24 1.34 1.43 -1.26 -5.08 118.68 119.04 4ayk s LEU 2 Ca 0.00 0.22 -0.11 0.00 -1.03 0.00 0.00 54.13 53.21 4ayk s LEU 2 Cb 0.00 -2.07 -0.05 0.00 0.03 0.00 0.00 46.19 44.10 4ayk s LEU 2 CO 0.00 0.19 0.17 0.42 0.23 0.00 0.00 176.35 177.36 4ayk s THR 3 N 0.29 5.35 -0.00 5.49 -4.23 -1.26 -5.06 115.64 116.22 4ayk s THR 3 Ca 0.08 0.20 -0.30 0.00 -1.18 0.00 0.00 61.69 60.49 4ayk s THR 3 Cb -0.11 -3.51 -0.03 0.00 1.34 0.00 0.00 72.50 70.18 4ayk s THR 3 CO -0.01 0.34 1.05 -0.70 -0.54 0.00 0.00 174.62 174.75 4ayk s GLU 4 N 1.10 4.50 0.00 3.99 2.12 -1.26 -3.99 118.70 125.16 4ayk s GLU 4 Ca 0.08 1.52 0.00 0.00 0.36 0.00 0.00 54.97 56.93 4ayk s GLU 4 Cb -0.14 -3.45 0.00 0.00 0.26 0.00 0.00 34.13 30.80 4ayk s GLU 4 CO 0.05 -0.16 0.00 0.41 -0.54 0.00 0.00 175.26 175.02 4ayk n GLY 5 N 3.03 2.49 2.66 -1.50 0.00 -1.26 -4.94 105.19 105.67 4ayk n GLY 5 Ca 0.07 -0.60 -0.10 0.00 0.00 0.00 0.00 46.02 45.40 4ayk n GLY 5 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 4ayk n ASN 6 N 0.00 -2.64 -4.64 1.61 4.13 -1.26 -5.09 115.26 107.38 4ayk n ASN 6 Ca 0.00 -2.91 -0.54 0.00 1.68 0.00 0.00 54.58 52.81 4ayk n ASN 6 Cb 0.00 1.26 -0.06 0.00 -1.54 0.00 0.00 39.78 39.43 4ayk n ASN 6 CO 0.00 0.00 0.00 -2.65 0.28 0.00 0.00 177.26 174.89 4ayk n PRO 7 N 2.53 1.14 -2.99 3.52 -0.02 -1.26 -4.96 135.00 132.97 4ayk n PRO 7 Ca 0.18 0.41 -0.25 0.00 -2.02 0.00 0.00 63.50 61.83 4ayk n PRO 7 Cb 0.56 -2.07 0.00 0.00 -0.02 0.00 0.00 33.50 31.97 4ayk n PRO 7 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 4ayk s ARG 8 N 1.74 3.36 -0.03 -0.52 0.52 -1.26 -4.66 118.95 118.09 4ayk s ARG 8 Ca 0.90 -0.19 -0.27 0.00 -0.52 0.00 0.00 55.73 55.66 4ayk s ARG 8 Cb -1.00 -2.52 -0.03 0.00 0.52 0.00 0.00 34.95 31.91 4ayk s ARG 8 CO 0.55 -0.12 0.84 -1.58 0.02 0.00 0.00 175.30 175.01 4ayk s TRP 9 N -2.55 3.62 -0.77 -0.53 0.52 -1.26 -4.93 118.94 113.04 4ayk s TRP 9 Ca 0.45 1.48 0.26 0.00 0.02 0.00 0.00 56.10 58.31 4ayk s TRP 9 Cb -0.10 -2.97 0.76 0.00 -1.15 0.00 0.00 33.47 30.01 4ayk s TRP 9 CO 0.40 0.04 1.68 0.39 0.02 0.00 0.00 176.95 179.48 4ayk n GLU 10 N 3.84 0.21 -2.91 4.98 1.02 -1.26 -4.84 120.64 121.69 4ayk n GLU 10 Ca 0.02 0.14 -0.32 0.00 -0.02 0.00 0.00 57.16 56.98 4ayk n GLU 10 Cb 0.51 -1.71 -0.05 0.00 -0.02 0.00 0.00 31.44 30.16 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 -3.09 4.00 0.00 3.49 -0.21 -1.26 -4.96 119.66 117.63 4ayk s GLN 11 Ca 0.10 0.77 0.23 0.00 0.02 0.00 0.00 55.36 56.48 4ayk s GLN 11 Cb 0.14 -2.33 0.08 0.00 1.00 0.00 0.00 33.01 31.90 4ayk s GLN 11 CO 0.62 0.02 1.13 0.25 -2.12 0.00 0.00 175.29 175.18 4ayk n THR 12 N -0.78 0.00 -4.32 -0.19 -2.24 -1.26 -4.81 114.28 100.68 4ayk n THR 12 Ca 0.04 -0.12 -0.32 0.00 -2.27 0.00 0.00 64.05 61.39 4ayk n THR 12 Cb 0.54 0.93 -0.16 0.00 -2.10 0.00 0.00 70.33 69.53 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 -2.73 2.53 0.20 4.78 3.76 -1.26 -2.87 115.29 119.69 4ayk s HIS 13 Ca 0.15 -1.38 0.07 0.00 -0.15 0.00 0.00 55.06 53.75 4ayk s HIS 13 Cb 0.17 -1.76 -0.04 0.00 1.11 0.00 0.00 32.58 32.06 4ayk s HIS 13 CO 0.69 -0.68 0.04 -0.51 -0.85 0.00 0.00 174.74 173.43 4ayk s LEU 14 N 1.14 3.41 0.12 0.89 1.43 -0.45 -4.99 118.68 120.23 4ayk s LEU 14 Ca -0.00 -0.39 0.07 0.00 -1.03 0.00 0.00 54.13 52.78 4ayk s LEU 14 Cb -0.14 -2.02 -0.04 0.00 0.03 0.00 0.00 46.19 44.02 4ayk s LEU 14 CO -0.08 0.05 -0.18 0.42 0.23 0.00 0.00 176.35 176.80 4ayk s THR 15 N -1.89 1.59 0.07 5.49 -4.23 -1.26 -2.10 115.64 113.30 4ayk s THR 15 Ca 0.29 -1.68 -0.05 0.00 -1.18 0.00 0.00 61.69 59.08 4ayk s THR 15 Cb -0.09 -1.59 -0.02 0.00 1.34 0.00 0.00 72.50 72.15 4ayk s THR 15 CO 0.20 -0.24 0.09 -0.72 -0.54 0.00 0.00 174.62 173.41 4ayk s TYR 16 N -1.68 0.31 -0.15 3.99 -0.85 -1.00 -2.21 117.35 115.75 4ayk s TYR 16 Ca 0.09 -0.78 -0.09 0.00 -0.52 0.00 0.00 57.07 55.78 4ayk s TYR 16 Cb -0.07 -0.21 0.05 0.00 0.38 0.00 0.00 41.96 42.11 4ayk s TYR 16 CO 0.04 -0.46 0.37 0.50 -1.52 0.00 0.00 175.55 174.49 4ayk s ARG 17 N -3.77 0.35 -0.25 -3.49 3.52 -1.05 -2.25 118.95 112.02 4ayk s ARG 17 Ca 0.05 0.71 -0.22 0.00 -0.13 0.00 0.00 55.73 56.13 4ayk s ARG 17 Cb 0.06 -0.03 -0.01 0.00 -1.56 0.00 0.00 34.95 33.40 4ayk s ARG 17 CO -0.10 -0.15 0.73 0.42 -0.81 0.00 0.00 175.30 175.38 4ayk s ILE 18 N 1.28 4.91 0.17 4.11 1.01 -1.26 -2.16 121.20 129.27 4ayk s ILE 18 Ca -0.09 1.34 -0.10 0.00 0.00 0.00 0.00 60.65 61.81 4ayk s ILE 18 Cb -0.08 -4.02 0.04 0.00 0.01 0.00 0.00 42.46 38.40 4ayk s ILE 18 CO -0.11 -0.02 1.60 -0.33 0.00 0.00 0.00 174.94 176.08 4ayk h GLU 19 N 7.79 1.05 -1.96 2.79 5.08 -1.52 -3.46 114.58 124.35 4ayk h GLU 19 Ca -0.25 -0.38 -0.05 0.00 -1.00 0.00 0.00 59.36 57.69 4ayk h GLU 19 Cb 1.11 -0.07 -0.19 0.00 0.50 0.00 0.00 28.75 30.09 4ayk h GLU 19 CO 0.82 1.07 0.22 1.21 -1.00 0.00 0.00 179.01 181.34 4ayk s ASN 20 N -6.63 -0.63 -0.15 1.42 2.47 -1.26 -5.09 114.94 105.06 4ayk s ASN 20 Ca -0.12 0.69 -0.12 0.00 0.42 0.00 0.00 52.86 53.73 4ayk s ASN 20 Cb 0.13 0.52 -0.05 0.00 -1.45 0.00 0.00 41.25 40.40 4ayk s ASN 20 CO 0.86 -0.59 0.25 -0.31 -3.72 0.00 0.00 177.10 173.60 4ayk s TYR 21 N -1.18 3.49 0.40 0.43 2.02 -1.26 -4.54 117.35 116.71 4ayk s TYR 21 Ca -0.10 0.57 -0.26 0.00 -0.37 0.00 0.00 57.07 56.91 4ayk s TYR 21 Cb -0.00 -2.25 -0.08 0.00 -0.40 0.00 0.00 41.96 39.23 4ayk s TYR 21 CO 0.09 0.35 1.22 -0.08 -1.57 0.00 0.00 175.55 175.56 4ayk s THR 22 N 0.12 2.95 -1.38 -0.71 -1.32 -1.26 -4.87 115.64 109.16 4ayk s THR 22 Ca 0.15 0.82 0.09 0.00 -1.21 0.00 0.00 61.69 61.54 4ayk s THR 22 Cb -0.13 -3.47 0.15 0.00 -1.51 0.00 0.00 72.50 67.55 4ayk s THR 22 CO 0.03 0.09 1.19 -0.81 -2.21 0.00 0.00 174.62 172.92 4ayk n PRO 23 N 0.11 0.12 -0.37 7.08 -0.04 -1.26 -2.88 135.00 137.76 4ayk n PRO 23 Ca 0.04 0.22 -0.02 0.00 -0.04 0.00 0.00 63.50 63.69 4ayk n PRO 23 Cb 0.45 -1.50 0.10 0.00 -0.04 0.00 0.00 33.50 32.52 4ayk n PRO 23 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 4ayk h ASP 24 N 0.00 1.14 -4.92 3.54 3.32 -1.94 -3.43 116.42 114.12 4ayk h ASP 24 Ca 0.00 -0.04 -0.20 0.00 0.02 0.00 0.00 57.03 56.81 4ayk h ASP 24 Cb 0.10 -0.28 -0.21 0.00 0.22 0.00 0.00 39.33 39.15 4ayk h ASP 24 CO 0.00 0.83 -0.71 -0.76 -1.72 0.00 0.00 179.24 176.88 4ayk s LEU 25 N -10.10 2.25 1.19 1.55 1.43 -1.14 -5.00 118.68 108.86 4ayk s LEU 25 Ca -0.13 -0.52 -0.18 0.00 -1.03 0.00 0.00 54.13 52.28 4ayk s LEU 25 Cb 0.18 0.02 0.25 0.00 0.03 0.00 0.00 46.19 46.67 4ayk s LEU 25 CO 0.82 -0.27 0.55 -2.65 0.23 0.00 0.00 176.35 175.02 4ayk n PRO 26 N 1.56 -3.20 0.03 1.29 -0.02 -1.26 -4.64 135.00 128.76 4ayk n PRO 26 Ca -0.24 -0.94 -0.20 0.00 -2.02 0.00 0.00 63.50 60.09 4ayk n PRO 26 Cb 0.55 -1.68 -0.14 0.00 -0.02 0.00 0.00 33.50 32.21 4ayk n PRO 26 CO 0.00 0.00 0.00 0.07 1.98 0.00 0.00 175.50 177.55 4ayk h ARG 27 N -3.01 0.29 -0.59 -0.52 0.11 -1.96 -3.14 114.38 105.56 4ayk h ARG 27 Ca -0.33 -0.49 0.02 0.00 0.10 0.00 0.00 59.98 59.27 4ayk h ARG 27 Cb 1.02 0.18 -0.03 0.00 1.11 0.00 0.00 29.97 32.25 4ayk h ARG 27 CO 0.21 1.18 0.38 0.00 0.10 0.00 0.00 179.97 181.84 4ayk h ALA 28 N 0.21 0.76 -0.36 0.08 0.00 -1.99 0.25 119.26 118.22 4ayk h ALA 28 Ca -0.37 -0.03 -0.17 0.00 0.00 0.00 0.00 54.91 54.35 4ayk h ALA 28 Cb 2.05 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 19.64 4ayk h ALA 28 CO 0.13 0.13 -0.43 -0.44 0.00 0.00 0.00 179.25 178.64 4ayk h ASP 29 N 0.75 0.98 -0.27 0.00 3.32 -1.94 -2.29 116.42 116.97 4ayk h ASP 29 Ca 0.23 -0.47 -0.10 0.00 0.02 0.00 0.00 57.03 56.72 4ayk h ASP 29 Cb -0.02 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.25 4ayk h ASP 29 CO -0.08 1.26 -0.21 0.58 -1.72 0.00 0.00 179.24 179.07 4ayk h VAL 30 N 0.73 1.31 -0.95 -1.35 2.07 -1.42 -2.82 116.25 113.82 4ayk h VAL 30 Ca 0.05 -1.36 0.04 0.00 0.82 0.00 0.00 66.70 66.25 4ayk h VAL 30 Cb 1.02 1.59 -0.05 0.00 -1.52 0.00 0.00 31.29 32.32 4ayk h VAL 30 CO 0.10 0.43 0.63 -0.78 0.02 0.00 0.00 177.57 177.97 4ayk h ASP 31 N 0.35 1.04 -0.36 0.57 1.82 -0.49 -1.72 116.42 117.63 4ayk h ASP 31 Ca 0.05 -0.01 0.04 0.00 -0.39 0.00 0.00 57.03 56.72 4ayk h ASP 31 Cb 0.76 -0.24 -0.04 0.00 0.68 0.00 0.00 39.33 40.49 4ayk h ASP 31 CO 0.06 0.71 0.14 -0.74 -1.61 0.00 0.00 179.24 177.80 4ayk h HIS 32 N 1.20 0.25 -1.00 0.28 2.76 -1.22 0.15 115.15 117.58 4ayk h HIS 32 Ca 0.38 0.02 0.01 0.00 -2.20 0.00 0.00 60.37 58.57 4ayk h HIS 32 Cb 0.00 -0.06 -0.05 0.00 1.55 0.00 0.00 27.41 28.86 4ayk h HIS 32 CO -0.00 0.11 0.66 0.00 -1.30 0.00 0.00 177.93 177.40 4ayk h ALA 33 N 1.22 1.26 -0.35 5.26 0.00 -1.09 -1.81 119.26 123.75 4ayk h ALA 33 Ca 0.16 -0.07 -0.16 0.00 0.00 0.00 0.00 54.91 54.84 4ayk h ALA 33 Cb 0.12 -0.41 -0.01 0.00 0.00 0.00 0.00 17.79 17.50 4ayk h ALA 33 CO -0.15 0.66 -0.42 0.82 0.00 0.00 0.00 179.25 180.15 4ayk h ILE 34 N 1.35 1.28 -0.58 0.00 1.08 -0.68 -2.80 117.51 117.16 4ayk h ILE 34 Ca 0.37 -1.60 -0.06 0.00 -0.39 0.00 0.00 64.86 63.17 4ayk h ILE 34 Cb -0.16 1.45 -0.02 0.00 -3.07 0.00 0.00 36.82 35.02 4ayk h ILE 34 CO -0.08 0.53 0.12 -0.08 -0.69 0.00 0.00 178.15 177.95 4ayk h GLU 35 N 0.71 0.95 -0.68 2.37 4.81 -0.31 -2.66 114.58 119.78 4ayk h GLU 35 Ca 0.05 -0.24 -0.03 0.00 -0.13 0.00 0.00 59.36 59.00 4ayk h GLU 35 Cb 1.01 -0.12 -0.03 0.00 0.63 0.00 0.00 28.75 30.24 4ayk h GLU 35 CO 0.10 0.89 0.30 0.87 -0.73 0.00 0.00 179.01 180.44 4ayk h LYS 36 N 0.86 0.99 -0.23 1.92 1.57 -1.31 -1.52 116.57 118.84 4ayk h LYS 36 Ca 0.18 -0.15 0.00 0.00 -1.87 0.00 0.00 60.65 58.81 4ayk h LYS 36 Cb 0.38 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.51 4ayk h LYS 36 CO 0.01 0.79 0.15 0.00 -0.57 0.00 0.00 179.45 179.83 4ayk h ALA 37 N 1.35 0.29 -0.82 3.86 0.00 -1.20 0.04 119.26 122.78 4ayk h ALA 37 Ca 0.23 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.11 4ayk h ALA 37 Cb 0.15 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 17.81 4ayk h ALA 37 CO -0.02 -0.23 0.46 0.74 0.00 0.00 0.00 179.25 180.20 4ayk h PHE 38 N 0.31 1.12 -0.77 0.00 0.04 -1.21 -2.40 116.94 114.02 4ayk h PHE 38 Ca 0.08 -0.02 0.00 0.00 2.80 0.00 0.00 57.97 60.84 4ayk h PHE 38 Cb -0.03 -0.36 -0.04 0.00 2.20 0.00 0.00 35.95 37.72 4ayk h PHE 38 CO -0.06 0.77 0.50 1.96 -0.60 0.00 0.00 178.31 180.88 4ayk h GLN 39 N 1.14 1.03 -0.66 1.51 4.20 -0.58 0.46 115.11 122.20 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 0.01 -0.23 -0.03 0.00 0.30 0.00 0.00 27.48 27.53 4ayk h GLN 39 CO -0.05 0.70 0.44 -0.07 -0.67 0.00 0.00 178.83 179.18 4ayk h LEU 40 N 1.05 0.76 -0.17 1.46 3.38 -0.52 0.24 115.31 121.51 4ayk h LEU 40 Ca 0.28 -0.02 -0.18 0.00 0.09 0.00 0.00 57.88 58.05 4ayk h LEU 40 Cb -0.09 -0.19 0.01 0.00 0.09 0.00 0.00 40.66 40.47 4ayk h LEU 40 CO -0.06 0.55 -0.59 -0.50 0.09 0.00 0.00 178.44 177.93 4ayk h TRP 41 N 0.89 0.92 -0.30 1.13 4.06 -1.15 -3.23 115.95 118.27 4ayk h TRP 41 Ca 0.24 -0.38 -0.12 0.00 2.06 0.00 0.00 58.89 60.70 4ayk h TRP 41 Cb -0.10 -0.15 -0.01 0.00 -1.00 0.00 0.00 29.16 27.90 4ayk h TRP 41 CO -0.03 1.18 -0.29 1.03 -3.56 0.00 0.00 178.44 176.77 4ayk h SER 42 N 0.40 0.64 0.00 -3.49 0.87 -0.70 -2.48 113.55 108.79 4ayk h SER 42 Ca -0.03 -0.25 0.00 0.00 -1.23 0.00 0.00 61.79 60.29 4ayk h SER 42 Cb 1.22 -0.18 0.00 0.00 -0.44 0.00 0.00 62.40 63.00 4ayk h SER 42 CO 0.13 0.90 0.00 0.78 -0.53 0.00 0.00 176.83 178.11 4ayk h ASN 43 N 0.54 0.00 -0.04 6.23 -0.26 -0.55 -1.15 115.58 120.34 4ayk h ASN 43 Ca 0.07 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.81 4ayk h ASN 43 Cb 0.78 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 38.04 4ayk h ASN 43 CO 0.06 0.00 0.00 1.33 -1.06 0.00 0.00 177.43 177.76 4ayk n VAL 44 N -2.95 0.11 -3.88 2.81 0.24 -1.01 -4.99 118.33 108.67 4ayk n VAL 44 Ca -0.03 -0.56 -0.11 0.00 -2.04 0.00 0.00 64.34 61.61 4ayk n VAL 44 Cb 0.06 1.11 -0.10 0.00 -1.47 0.00 0.00 33.84 33.45 4ayk n VAL 44 CO 0.00 0.00 0.00 0.42 -2.14 0.00 0.00 176.83 175.11 4ayk s THR 45 N -0.80 0.09 -2.00 3.34 -4.23 -0.44 -4.11 115.64 107.50 4ayk s THR 45 Ca 0.12 -0.72 0.03 0.00 -1.18 0.00 0.00 61.69 59.94 4ayk s THR 45 Cb 0.08 -0.45 0.10 0.00 1.34 0.00 0.00 72.50 73.57 4ayk s THR 45 CO 0.12 -0.40 0.66 -0.81 -0.54 0.00 0.00 174.62 173.65 4ayk n PRO 46 N 1.41 0.46 -2.23 3.99 -0.04 -1.26 -4.57 135.00 132.76 4ayk n PRO 46 Ca -0.23 0.00 -0.34 0.00 -0.04 0.00 0.00 63.50 62.89 4ayk n PRO 46 Cb 0.56 -1.12 -0.00 0.00 -0.04 0.00 0.00 33.50 32.90 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 -1.23 3.67 0.08 1.53 1.43 -1.26 -4.99 118.68 117.90 4ayk s LEU 47 Ca 0.05 1.99 0.06 0.00 -1.03 0.00 0.00 54.13 55.20 4ayk s LEU 47 Cb 0.02 -4.56 -0.03 0.00 0.03 0.00 0.00 46.19 41.65 4ayk s LEU 47 CO 0.04 -1.13 -0.15 0.42 0.23 0.00 0.00 176.35 175.76 4ayk s THR 48 N -2.07 1.21 0.12 5.49 -4.23 -1.14 -4.66 115.64 110.35 4ayk s THR 48 Ca 0.68 -1.34 0.07 0.00 -1.18 0.00 0.00 61.69 59.91 4ayk s THR 48 Cb -0.19 -1.15 -0.04 0.00 1.34 0.00 0.00 72.50 72.46 4ayk s THR 48 CO 0.29 -0.20 -0.16 -0.36 -0.54 0.00 0.00 174.62 173.66 4ayk s PHE 49 N -1.25 1.50 -0.18 3.99 0.40 -1.26 -1.34 117.98 119.83 4ayk s PHE 49 Ca -0.01 -0.51 -0.13 0.00 -0.60 0.00 0.00 56.93 55.68 4ayk s PHE 49 Cb -0.10 -0.79 0.05 0.00 0.51 0.00 0.00 43.02 42.70 4ayk s PHE 49 CO 0.03 0.17 0.46 0.99 0.70 0.00 0.00 175.22 177.57 4ayk s THR 50 N -1.90 -0.01 0.05 0.64 2.01 -0.89 -4.96 115.64 110.57 4ayk s THR 50 Ca 0.08 0.04 -0.30 0.00 0.31 0.00 0.00 61.69 61.82 4ayk s THR 50 Cb -0.06 -0.67 -0.04 0.00 0.01 0.00 0.00 72.50 71.74 4ayk s THR 50 CO 0.04 0.02 1.01 -0.75 -0.69 0.00 0.00 174.62 174.24 4ayk s LYS 51 N 0.85 4.58 -0.10 4.92 2.20 -1.26 -2.38 119.74 128.56 4ayk s LYS 51 Ca -0.05 1.49 0.04 0.00 -0.36 0.00 0.00 55.97 57.09 4ayk s LYS 51 Cb -0.06 -3.41 -0.00 0.00 -1.51 0.00 0.00 37.83 32.85 4ayk s LYS 51 CO -0.07 0.00 -0.24 0.14 -0.36 0.00 0.00 175.35 174.83 4ayk s VAL 52 N 0.67 2.11 -1.22 4.02 -7.23 -0.96 -4.93 120.40 112.86 4ayk s VAL 52 Ca 0.51 -1.01 0.23 0.00 -1.81 0.00 0.00 61.98 59.91 4ayk s VAL 52 Cb -0.23 -1.80 -0.08 0.00 0.56 0.00 0.00 36.38 34.83 4ayk s VAL 52 CO 0.29 0.56 1.15 -0.24 -0.31 0.00 0.00 175.10 176.55 4ayk n SER 53 N 3.45 1.00 -3.91 4.85 2.88 -1.26 -4.63 113.62 115.99 4ayk n SER 53 Ca -0.19 -0.83 -0.10 0.00 -1.33 0.00 0.00 58.87 56.42 4ayk n SER 53 Cb 0.53 0.61 -0.10 0.00 -0.75 0.00 0.00 64.21 64.51 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 -2.88 0.51 0.00 -1.46 2.02 -1.26 -5.12 118.70 110.52 4ayk s GLU 54 Ca 0.12 -0.58 0.00 0.00 0.02 0.00 0.00 54.97 54.53 4ayk s GLU 54 Cb 0.17 0.21 0.00 0.00 0.10 0.00 0.00 34.13 34.61 4ayk s GLU 54 CO 0.74 -0.12 0.00 0.41 0.02 0.00 0.00 175.26 176.31 4ayk n GLY 55 N 1.16 0.08 3.73 -1.39 0.00 -1.26 -4.92 105.19 102.60 4ayk n GLY 55 Ca -0.21 -1.99 -0.40 0.00 0.00 0.00 0.00 46.02 43.41 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 -1.05 4.55 -0.18 1.61 -0.21 -1.26 -5.04 119.66 118.08 4ayk s GLN 56 Ca 0.00 1.18 -0.11 0.00 0.02 0.00 0.00 55.36 56.46 4ayk s GLN 56 Cb 0.00 -3.39 -0.05 0.00 1.00 0.00 0.00 33.01 30.57 4ayk s GLN 56 CO 0.00 0.20 0.17 0.00 -2.12 0.00 0.00 175.29 173.54 4ayk s ALA 57 N 0.19 3.68 0.19 6.09 0.00 -1.26 -4.99 121.76 125.67 4ayk s ALA 57 Ca 0.42 -0.63 -0.12 0.00 0.00 0.00 0.00 51.96 51.63 4ayk s ALA 57 Cb -0.21 -2.20 0.11 0.00 0.00 0.00 0.00 23.12 20.82 4ayk s ALA 57 CO 0.25 0.19 1.86 -0.44 0.00 0.00 0.00 175.76 177.61 4ayk h ASP 58 N 6.50 0.72 -3.07 0.00 3.32 -1.86 -3.40 116.42 118.64 4ayk h ASP 58 Ca -0.42 -0.02 -0.67 0.00 0.02 0.00 0.00 57.03 55.94 4ayk h ASP 58 Cb 1.16 -0.18 -0.35 0.00 0.22 0.00 0.00 39.33 40.18 4ayk h ASP 58 CO 0.74 0.52 -0.86 -0.63 -1.72 0.00 0.00 179.24 177.29 4ayk s ILE 59 N -6.14 2.07 -0.20 0.35 1.01 -0.94 -4.77 121.20 112.58 4ayk s ILE 59 Ca -0.13 -0.94 -0.10 0.00 0.00 0.00 0.00 60.65 59.48 4ayk s ILE 59 Cb 0.14 -1.87 -0.05 0.00 0.01 0.00 0.00 42.46 40.69 4ayk s ILE 59 CO 0.76 0.54 0.14 -0.04 0.00 0.00 0.00 174.94 176.34 4ayk s MET 60 N 1.28 4.17 -0.18 2.79 -1.94 -1.26 -2.51 119.30 121.65 4ayk s MET 60 Ca 0.05 -0.21 -0.04 0.00 -1.71 0.00 0.00 55.69 53.78 4ayk s MET 60 Cb -0.13 -3.41 -0.02 0.00 2.01 0.00 0.00 34.83 33.28 4ayk s MET 60 CO -0.13 0.32 -0.03 0.42 -0.01 0.00 0.00 175.02 175.59 4ayk s ILE 61 N 0.31 3.76 0.12 2.53 1.01 -0.92 -0.50 121.20 127.52 4ayk s ILE 61 Ca 0.09 -0.39 -0.13 0.00 0.00 0.00 0.00 60.65 60.22 4ayk s ILE 61 Cb -0.11 -2.67 0.02 0.00 0.01 0.00 0.00 42.46 39.70 4ayk s ILE 61 CO -0.02 0.46 0.32 -0.94 0.00 0.00 0.00 174.94 174.76 4ayk s SER 62 N 0.77 -0.08 -0.09 3.58 1.04 -1.07 -1.12 113.70 116.73 4ayk s SER 62 Ca -0.01 -0.50 -0.02 0.00 0.48 0.00 0.00 55.95 55.90 4ayk s SER 62 Cb -0.14 0.43 -0.03 0.00 0.10 0.00 0.00 66.02 66.37 4ayk s SER 62 CO 0.02 -0.82 -0.00 -0.36 0.98 0.00 0.00 173.24 173.05 4ayk s PHE 63 N -3.84 3.15 0.16 5.02 0.08 -1.26 -2.50 117.98 118.79 4ayk s PHE 63 Ca 0.05 0.18 0.05 0.00 0.12 0.00 0.00 56.93 57.33 4ayk s PHE 63 Cb 0.03 -1.79 -0.04 0.00 -0.57 0.00 0.00 43.02 40.65 4ayk s PHE 63 CO -0.10 0.45 -0.11 0.14 -0.10 0.00 0.00 175.22 175.50 4ayk s VAL 64 N -0.85 1.34 0.02 -0.44 -7.23 -1.09 -4.94 120.40 107.21 4ayk s VAL 64 Ca 0.13 -2.11 0.04 0.00 -1.81 0.00 0.00 61.98 58.23 4ayk s VAL 64 Cb -0.11 -1.91 -0.02 0.00 0.56 0.00 0.00 36.38 34.91 4ayk s VAL 64 CO 0.02 -0.70 -0.12 -0.13 -0.31 0.00 0.00 175.10 173.86 4ayk s ARG 65 N -3.72 0.86 0.60 4.82 0.52 -1.26 -2.21 118.95 118.57 4ayk s ARG 65 Ca 0.18 -0.60 0.00 0.00 -0.52 0.00 0.00 55.73 54.79 4ayk s ARG 65 Cb 0.02 -0.84 0.00 0.00 0.52 0.00 0.00 34.95 34.65 4ayk s ARG 65 CO 0.02 0.21 0.00 0.41 0.02 0.00 0.00 175.30 175.97 4ayk n GLY 66 N 2.23 1.02 3.72 -3.53 0.00 -1.26 -4.28 105.19 103.10 4ayk n GLY 66 Ca -0.17 -0.52 -0.42 0.00 0.00 0.00 0.00 46.02 44.92 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 6.73 -0.40 1.61 -1.08 -1.26 -4.26 116.67 114.00 4ayk s ASP 67 Ca 0.00 2.46 0.11 0.00 -0.52 0.00 0.00 52.55 54.61 4ayk s ASP 67 Cb 0.00 -2.59 0.39 0.00 -1.46 0.00 0.00 42.92 39.25 4ayk s ASP 67 CO 0.00 -0.71 0.88 0.00 0.52 0.00 0.00 175.17 175.86 4ayk n HIS 68 N 3.73 1.56 -3.50 -5.34 1.44 -1.26 -4.94 115.22 106.91 4ayk n HIS 68 Ca 0.12 -3.50 -0.18 0.00 -2.01 0.00 0.00 57.72 52.14 4ayk n HIS 68 Cb 0.41 -0.38 0.08 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 -0.00 -6.35 -4.09 -1.40 1.74 -1.26 -5.01 116.66 100.30 4ayk n ARG 69 Ca 0.24 0.80 -0.10 0.00 -0.77 0.00 0.00 57.85 58.02 4ayk n ARG 69 Cb 0.65 -5.73 -0.09 0.00 -1.02 0.00 0.00 32.46 26.28 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 -4.29 0.20 0.00 0.55 1.01 -1.26 -5.03 116.67 107.85 4ayk s ASP 70 Ca 0.04 -1.10 0.16 0.00 0.71 0.00 0.00 52.55 52.36 4ayk s ASP 70 Cb -0.02 0.35 0.46 0.00 1.01 0.00 0.00 42.92 44.72 4ayk s ASP 70 CO 0.75 -0.80 1.38 0.59 0.21 0.00 0.00 175.17 177.30 4ayk n ASN 71 N -0.15 2.54 -3.30 0.27 5.03 -1.26 -4.48 115.26 113.91 4ayk n ASN 71 Ca -0.06 -1.97 -0.25 0.00 0.87 0.00 0.00 54.58 53.17 4ayk n ASN 71 Cb 0.64 -0.30 -0.08 0.00 -1.02 0.00 0.00 39.78 39.02 4ayk n ASN 71 CO 0.00 0.00 0.00 -1.20 -1.83 0.00 0.00 177.26 174.23 4ayk n SER 72 N 0.89 1.16 -4.76 6.41 7.64 -1.26 -5.12 113.62 118.58 4ayk n SER 72 Ca 0.16 -2.87 -0.35 0.00 1.01 0.00 0.00 58.87 56.82 4ayk n SER 72 Cb 0.41 -0.64 0.04 0.00 -1.01 0.00 0.00 64.21 63.01 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 -1.39 2.89 0.42 1.43 0.04 -1.26 -4.99 135.00 132.13 4ayk s PRO 73 Ca 0.36 1.64 -0.23 0.00 0.04 0.00 0.00 61.00 62.81 4ayk s PRO 73 Cb 0.14 -1.94 -0.09 0.00 0.04 0.00 0.00 34.50 32.65 4ayk s PRO 73 CO -0.10 -1.22 1.01 -0.06 0.04 0.00 0.00 177.00 176.67 4ayk s PHE 74 N -1.90 3.26 -0.90 0.56 0.40 -1.26 -4.98 117.98 113.16 4ayk s PHE 74 Ca 0.73 1.64 -0.01 0.00 -0.60 0.00 0.00 56.93 58.69 4ayk s PHE 74 Cb -0.26 -3.03 0.25 0.00 0.51 0.00 0.00 43.02 40.50 4ayk s PHE 74 CO 0.36 -0.46 0.98 -3.47 0.70 0.00 0.00 175.22 173.33 4ayk n ASP 75 N -0.34 4.77 -0.06 1.36 -0.08 -1.25 -4.86 116.55 116.09 4ayk n ASP 75 Ca 0.06 -3.28 0.00 0.00 -1.51 0.00 0.00 54.79 50.06 4ayk n ASP 75 Cb 0.51 -1.04 0.00 0.00 2.34 0.00 0.00 41.12 42.94 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 1.71 0.78 0.19 0.27 0.00 -1.26 -2.12 105.19 104.76 4ayk n GLY 76 Ca 0.25 -0.84 0.12 0.00 0.00 0.00 0.00 46.02 45.55 4ayk n GLY 76 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 4ayk h PRO 77 N 0.00 0.00 0.00 1.61 0.11 -1.96 -3.42 132.00 128.34 4ayk h PRO 77 Ca 0.00 0.00 -0.45 0.00 0.11 0.00 0.00 66.00 65.66 4ayk h PRO 77 Cb 0.00 0.00 0.11 0.00 0.11 0.00 0.00 31.00 31.22 4ayk h PRO 77 CO 0.00 0.00 0.20 0.41 -0.21 0.00 0.00 178.00 178.40 4ayk n GLY 78 N -1.26 0.05 4.91 -0.55 0.00 -0.90 -4.96 105.19 102.47 4ayk n GLY 78 Ca -0.02 -1.94 0.00 0.00 0.00 0.00 0.00 46.02 44.06 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 -2.82 -1.79 3.79 -0.02 0.00 -1.26 -3.80 105.19 99.29 4ayk n GLY 79 Ca 0.16 -1.56 -0.36 0.00 0.00 0.00 0.00 46.02 44.26 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 6.63 0.13 1.61 0.02 -1.26 -4.95 114.94 113.12 4ayk s ASN 80 Ca 0.00 1.99 0.23 0.00 -1.02 0.00 0.00 52.86 54.06 4ayk s ASN 80 Cb 0.00 -2.58 -0.05 0.00 0.02 0.00 0.00 41.25 38.65 4ayk s ASN 80 CO 0.00 -0.58 0.94 0.18 0.02 0.00 0.00 177.10 177.66 4ayk n LEU 81 N -0.37 0.62 -3.56 0.60 4.77 -1.26 -4.89 117.00 112.91 4ayk n LEU 81 Ca 0.06 0.20 -0.06 0.00 -0.03 0.00 0.00 56.01 56.18 4ayk n LEU 81 Cb 0.51 -0.06 -0.02 0.00 -2.33 0.00 0.00 43.42 41.52 4ayk n LEU 81 CO 0.43 -0.10 0.82 0.00 -1.33 0.00 0.00 177.39 177.20 4ayk s ALA 82 N -3.36 -1.91 0.29 -1.18 0.00 -1.26 -2.20 121.76 112.14 4ayk s ALA 82 Ca -0.01 1.10 -0.18 0.00 0.00 0.00 0.00 51.96 52.87 4ayk s ALA 82 Cb 0.11 0.26 0.07 0.00 0.00 0.00 0.00 23.12 23.56 4ayk s ALA 82 CO 0.81 -0.72 0.90 -2.39 0.00 0.00 0.00 175.76 174.37 4ayk n HIS 83 N -0.23 -1.87 -3.72 0.00 1.44 -0.96 -5.01 115.22 104.88 4ayk n HIS 83 Ca -0.05 -1.56 -0.06 0.00 -2.01 0.00 0.00 57.72 54.03 4ayk n HIS 83 Cb 0.61 0.77 -0.02 0.00 0.12 0.00 0.00 29.99 31.47 4ayk n HIS 83 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 4ayk s ALA 84 N -2.05 -1.52 -0.15 1.59 0.00 -1.26 -1.19 121.76 117.18 4ayk s ALA 84 Ca 0.19 0.13 -0.08 0.00 0.00 0.00 0.00 51.96 52.21 4ayk s ALA 84 Cb -0.04 0.72 -0.04 0.00 0.00 0.00 0.00 23.12 23.76 4ayk s ALA 84 CO 0.09 -0.96 0.11 -0.06 0.00 0.00 0.00 175.76 174.94 4ayk s PHE 85 N -3.55 3.45 0.65 0.00 0.08 -0.92 -5.00 117.98 112.70 4ayk s PHE 85 Ca 0.09 0.37 -0.18 0.00 0.12 0.00 0.00 56.93 57.33 4ayk s PHE 85 Cb -0.03 -2.02 -0.01 0.00 -0.57 0.00 0.00 43.02 40.39 4ayk s PHE 85 CO 0.01 0.48 1.30 -0.65 -0.10 0.00 0.00 175.22 176.26 4ayk s GLN 86 N -0.35 2.52 -0.41 0.44 -0.21 -1.26 -0.82 119.66 119.57 4ayk s GLN 86 Ca 0.11 2.08 -0.45 0.00 0.02 0.00 0.00 55.36 57.12 4ayk s GLN 86 Cb -0.12 -1.84 -0.19 0.00 1.00 0.00 0.00 33.01 31.86 4ayk s GLN 86 CO 0.01 -1.62 1.58 -2.30 -2.12 0.00 0.00 175.29 170.84 4ayk n PRO 87 N -1.93 0.25 -1.03 2.91 -0.02 -1.26 -3.21 135.00 130.71 4ayk n PRO 87 Ca 0.16 0.09 0.00 0.00 -2.02 0.00 0.00 63.50 61.73 4ayk n PRO 87 Cb 0.48 -1.63 0.00 0.00 -0.02 0.00 0.00 33.50 32.33 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 3.82 2.29 3.64 -1.23 0.00 -1.26 -4.64 105.19 107.82 4ayk n GLY 88 Ca 0.29 -1.06 -0.43 0.00 0.00 0.00 0.00 46.02 44.82 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 -1.78 4.08 6.30 1.61 0.04 -1.26 -3.93 135.00 140.04 4ayk s PRO 89 Ca 0.00 1.39 0.00 0.00 0.04 0.00 0.00 61.00 62.43 4ayk s PRO 89 Cb 0.00 -3.80 0.00 0.00 0.04 0.00 0.00 34.50 30.74 4ayk s PRO 89 CO 0.00 -0.90 0.00 0.41 0.04 0.00 0.00 177.00 176.55 4ayk n GLY 90 N 3.92 1.76 0.12 0.56 0.00 -1.26 -3.71 105.19 106.59 4ayk n GLY 90 Ca 0.14 -0.15 0.05 0.00 0.00 0.00 0.00 46.02 46.06 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 0.71 -1.74 -0.61 3.06 -1.26 -4.60 119.36 114.92 4ayk n ILE 91 Ca 0.00 0.68 -0.42 0.00 -2.50 0.00 0.00 62.75 60.52 4ayk n ILE 91 Cb 0.00 -1.68 -0.02 0.00 0.54 0.00 0.00 39.64 38.47 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 -1.28 1.44 1.51 4.50 0.00 -1.24 -1.56 105.19 108.55 4ayk n GLY 92 Ca -0.01 0.52 0.00 0.00 0.00 0.00 0.00 46.02 46.54 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 2.87 1.45 3.72 -0.02 0.00 -0.00 -4.21 105.19 108.99 4ayk n GLY 93 Ca 0.11 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.71 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 -3.00 6.64 -0.20 1.61 1.01 -0.60 -4.08 116.67 118.03 4ayk s ASP 94 Ca 0.00 2.55 -0.10 0.00 0.71 0.00 0.00 52.55 55.71 4ayk s ASP 94 Cb 0.00 -2.59 -0.05 0.00 1.01 0.00 0.00 42.92 41.29 4ayk s ASP 94 CO 0.00 -0.79 0.13 0.00 0.21 0.00 0.00 175.17 174.72 4ayk s ALA 95 N 1.21 3.64 -0.10 5.23 0.00 0.35 -2.16 121.76 129.93 4ayk s ALA 95 Ca 0.69 -0.73 0.02 0.00 0.00 0.00 0.00 51.96 51.94 4ayk s ALA 95 Cb -0.42 -2.17 -0.02 0.00 0.00 0.00 0.00 23.12 20.52 4ayk s ALA 95 CO 0.31 0.10 -0.15 -1.01 0.00 0.00 0.00 175.76 175.00 4ayk s HIS 96 N 0.48 2.73 -0.09 0.00 3.76 -0.33 -2.59 115.29 119.24 4ayk s HIS 96 Ca 0.07 -0.57 0.03 0.00 -0.15 0.00 0.00 55.06 54.45 4ayk s HIS 96 Cb -0.12 -1.76 -0.01 0.00 1.11 0.00 0.00 32.58 31.81 4ayk s HIS 96 CO -0.01 -0.13 -0.21 -0.06 -0.85 0.00 0.00 174.74 173.48 4ayk s PHE 97 N 0.04 2.61 0.09 1.40 0.40 -1.04 -2.25 117.98 119.22 4ayk s PHE 97 Ca -0.06 -0.80 -0.31 0.00 -0.60 0.00 0.00 56.93 55.16 4ayk s PHE 97 Cb -0.15 -1.71 -0.09 0.00 0.51 0.00 0.00 43.02 41.58 4ayk s PHE 97 CO 0.05 -0.27 1.63 0.34 0.70 0.00 0.00 175.22 177.66 4ayk s ASP 98 N 0.15 6.61 0.00 1.36 -1.08 -0.93 -2.67 116.67 120.11 4ayk s ASP 98 Ca -0.11 2.50 0.24 0.00 -0.52 0.00 0.00 52.55 54.66 4ayk s ASP 98 Cb -0.16 -2.57 0.22 0.00 -1.46 0.00 0.00 42.92 38.95 4ayk s ASP 98 CO 0.06 -0.87 1.27 1.21 0.52 0.00 0.00 175.17 177.36 4ayk n GLU 99 N 5.26 2.31 0.25 4.34 2.13 -0.94 -4.23 120.64 129.76 4ayk n GLU 99 Ca 0.15 -1.96 0.15 0.00 0.66 0.00 0.00 57.16 56.17 4ayk n GLU 99 Cb 0.40 -1.46 0.46 0.00 0.27 0.00 0.00 31.44 31.12 4ayk n GLU 99 CO 0.00 0.00 0.00 -0.44 -0.41 0.00 0.00 177.13 176.28 4ayk h ASP 100 N 4.62 0.00 -2.40 4.31 3.32 -1.90 -3.44 116.42 120.94 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 0.99 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.52 4ayk h ASP 100 CO 0.00 0.00 -0.40 -1.61 -1.72 0.00 0.00 179.24 175.51 4ayk s GLU 101 N -3.47 3.45 -0.36 3.56 2.02 -1.26 -4.95 118.70 117.69 4ayk s GLU 101 Ca 0.04 -0.64 -0.23 0.00 0.02 0.00 0.00 54.97 54.15 4ayk s GLU 101 Cb 0.07 -2.88 0.01 0.00 0.10 0.00 0.00 34.13 31.43 4ayk s GLU 101 CO 0.60 0.42 0.78 0.50 0.02 0.00 0.00 175.26 177.57 4ayk s ARG 102 N -3.79 3.77 0.27 1.61 3.52 -1.26 -5.04 118.95 118.02 4ayk s ARG 102 Ca 0.35 0.32 -0.10 0.00 -0.13 0.00 0.00 55.73 56.17 4ayk s ARG 102 Cb -0.10 -3.80 -0.07 0.00 -1.56 0.00 0.00 34.95 29.42 4ayk s ARG 102 CO 0.30 -0.83 0.60 -1.58 -0.81 0.00 0.00 175.30 172.98 4ayk s TRP 103 N 3.07 3.42 0.27 5.12 0.52 -1.26 -4.66 118.94 125.41 4ayk s TRP 103 Ca 0.31 0.94 0.06 0.00 0.02 0.00 0.00 56.10 57.43 4ayk s TRP 103 Cb -0.13 -2.32 -0.06 0.00 -1.15 0.00 0.00 33.47 29.82 4ayk s TRP 103 CO 0.16 0.20 -0.06 0.95 0.02 0.00 0.00 176.95 178.22 4ayk s THR 104 N -1.91 1.59 -0.38 2.01 -4.23 -0.90 -4.80 115.64 107.03 4ayk s THR 104 Ca 0.49 -2.12 0.06 0.00 -1.18 0.00 0.00 61.69 58.93 4ayk s THR 104 Cb -0.11 -2.40 0.54 0.00 1.34 0.00 0.00 72.50 71.87 4ayk s THR 104 CO 0.22 -0.33 1.63 0.59 -0.54 0.00 0.00 174.62 176.19 4ayk n ASN 105 N -0.55 3.65 -0.50 3.99 3.02 -1.26 -2.08 115.26 121.53 4ayk n ASN 105 Ca -0.06 -3.75 0.00 0.00 -0.03 0.00 0.00 54.58 50.75 4ayk n ASN 105 Cb 0.63 -0.71 0.00 0.00 -0.61 0.00 0.00 39.78 39.09 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 -1.07 0.00 -1.22 6.41 2.04 -1.26 -5.01 115.26 115.14 4ayk n ASN 106 Ca 0.45 -0.50 -0.05 0.00 -0.44 0.00 0.00 54.58 54.05 4ayk n ASN 106 Cb 1.16 0.00 0.05 0.00 -2.53 0.00 0.00 39.78 38.46 4ayk n ASN 106 CO 0.00 0.00 0.00 2.22 -0.44 0.00 0.00 177.26 179.04 4ayk n PHE 107 N 0.00 0.70 -0.34 -2.53 -1.74 -1.26 -4.37 117.46 107.92 4ayk n PHE 107 Ca 0.00 -0.72 0.00 0.00 -0.56 0.00 0.00 57.45 56.17 4ayk n PHE 107 Cb 0.00 -0.38 0.00 0.00 1.52 0.00 0.00 39.48 40.62 4ayk n PHE 107 CO 0.00 0.00 0.00 0.54 -0.56 0.00 0.00 176.76 176.74 4ayk n ARG 108 N 0.11 0.46 -0.25 3.97 1.74 -1.26 -4.91 116.66 116.52 4ayk n ARG 108 Ca 0.13 0.00 -0.13 0.00 -0.77 0.00 0.00 57.85 57.08 4ayk n ARG 108 Cb 0.73 0.00 -0.10 0.00 -1.02 0.00 0.00 32.46 32.08 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 -0.24 -5.09 5.56 5.08 -1.97 -3.38 114.58 114.55 4ayk h GLU 109 Ca 0.00 0.02 -0.66 0.00 -1.00 0.00 0.00 59.36 57.71 4ayk h GLU 109 Cb 0.00 0.05 -0.31 0.00 0.50 0.00 0.00 28.75 28.99 4ayk h GLU 109 CO 0.00 -0.16 -0.80 0.71 -1.00 0.00 0.00 179.01 177.76 4ayk s TYR 110 N -5.59 2.84 -0.33 4.33 2.02 -1.26 -5.09 117.35 114.26 4ayk s TYR 110 Ca -0.13 -1.22 -0.13 0.00 -0.37 0.00 0.00 57.07 55.22 4ayk s TYR 110 Cb 0.09 -1.97 -0.02 0.00 -0.40 0.00 0.00 41.96 39.67 4ayk s TYR 110 CO 0.62 -0.62 0.23 1.21 -1.57 0.00 0.00 175.55 175.43 4ayk s ASN 111 N 1.19 6.06 0.25 2.29 3.04 -1.26 -2.11 114.94 124.39 4ayk s ASN 111 Ca 0.02 -0.36 -0.06 0.00 0.04 0.00 0.00 52.86 52.50 4ayk s ASN 111 Cb -0.14 -2.14 0.27 0.00 -1.54 0.00 0.00 41.25 37.70 4ayk s ASN 111 CO -0.06 -0.21 1.93 0.25 -3.04 0.00 0.00 177.10 175.97 4ayk h LEU 112 N 8.47 1.15 -0.82 3.21 5.85 -1.71 -2.80 115.31 128.67 4ayk h LEU 112 Ca -0.32 -0.03 0.01 0.00 0.84 0.00 0.00 57.88 58.38 4ayk h LEU 112 Cb 1.16 -0.29 -0.04 0.00 0.37 0.00 0.00 40.66 41.86 4ayk h LEU 112 CO 0.62 0.84 0.54 -0.74 -0.34 0.00 0.00 178.44 179.36 4ayk h HIS 113 N 1.35 1.02 -0.88 1.25 2.76 -1.89 -1.43 115.15 117.34 4ayk h HIS 113 Ca 0.36 0.02 0.01 0.00 -2.20 0.00 0.00 60.37 58.57 4ayk h HIS 113 Cb -0.15 -0.35 -0.04 0.00 1.55 0.00 0.00 27.41 28.42 4ayk h HIS 113 CO 0.00 0.64 0.58 0.07 -1.30 0.00 0.00 177.93 177.92 4ayk h ARG 114 N 1.10 1.16 -0.32 5.26 0.11 -1.90 -1.56 114.38 118.22 4ayk h ARG 114 Ca 0.30 -0.07 -0.17 0.00 0.10 0.00 0.00 59.98 60.14 4ayk h ARG 114 Cb -0.12 -0.26 -0.00 0.00 1.11 0.00 0.00 29.97 30.70 4ayk h ARG 114 CO -0.07 0.76 -0.46 0.28 0.10 0.00 0.00 179.97 180.59 4ayk h VAL 115 N 1.19 1.28 -1.00 0.08 2.07 -1.50 -2.84 116.25 115.52 4ayk h VAL 115 Ca 0.32 -1.64 0.01 0.00 0.82 0.00 0.00 66.70 66.22 4ayk h VAL 115 Cb -0.14 1.51 -0.05 0.00 -1.52 0.00 0.00 31.29 31.09 4ayk h VAL 115 CO -0.07 0.54 0.66 0.00 0.02 0.00 0.00 177.57 178.72 4ayk h ALA 116 N 0.79 1.28 -0.83 1.67 0.00 -0.74 0.87 119.26 122.31 4ayk h ALA 116 Ca 0.04 -0.07 -0.04 0.00 0.00 0.00 0.00 54.91 54.85 4ayk h ALA 116 Cb 1.05 -0.40 -0.04 0.00 0.00 0.00 0.00 17.79 18.40 4ayk h ALA 116 CO 0.10 0.64 0.38 0.00 0.00 0.00 0.00 179.25 180.37 4ayk h ALA 117 N 1.37 1.11 -0.03 0.00 0.00 -1.18 -1.23 119.26 119.31 4ayk h ALA 117 Ca 0.37 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 55.10 4ayk h ALA 117 Cb -0.13 -0.33 -0.00 0.00 0.00 0.00 0.00 17.79 17.33 4ayk h ALA 117 CO -0.09 0.66 -0.03 1.25 0.00 0.00 0.00 179.25 181.05 4ayk h HIS 118 N 1.19 0.08 -0.99 0.00 6.17 -1.05 -2.30 115.15 118.25 4ayk h HIS 118 Ca 0.28 -0.03 0.03 0.00 0.71 0.00 0.00 60.37 61.37 4ayk h HIS 118 Cb 0.14 -0.02 -0.06 0.00 2.52 0.00 0.00 27.41 30.00 4ayk h HIS 118 CO 0.02 0.54 0.65 0.93 0.71 0.00 0.00 177.93 180.78 4ayk h GLU 119 N -0.40 1.24 -0.80 5.26 4.39 -0.75 -1.59 114.58 121.93 4ayk h GLU 119 Ca 0.00 -0.07 -0.04 0.00 0.34 0.00 0.00 59.36 59.59 4ayk h GLU 119 Cb 0.53 -0.28 -0.04 0.00 -0.10 0.00 0.00 28.75 28.86 4ayk h GLU 119 CO 0.01 0.82 0.33 -0.07 -1.16 0.00 0.00 179.01 178.94 4ayk h LEU 120 N 1.28 1.09 -1.01 1.33 3.38 -1.20 -2.46 115.31 117.73 4ayk h LEU 120 Ca 0.39 -0.16 0.03 0.00 0.09 0.00 0.00 57.88 58.22 4ayk h LEU 120 Cb -0.03 -0.28 -0.05 0.00 0.09 0.00 0.00 40.66 40.38 4ayk h LEU 120 CO -0.11 0.96 0.66 1.23 0.09 0.00 0.00 178.44 181.27 4ayk h GLY 121 N 1.17 1.45 1.11 0.83 0.00 -0.70 -0.03 103.07 106.89 4ayk h GLY 121 Ca 0.27 -0.51 -0.02 0.00 0.00 0.00 0.00 47.33 47.07 4ayk h GLY 121 CO -0.02 0.47 0.45 0.45 0.00 0.00 0.00 176.54 177.88 4ayk h HIS 122 N 1.31 1.14 0.00 5.60 3.86 -1.06 0.11 115.15 126.11 4ayk h HIS 122 Ca 0.39 -0.03 -0.07 0.00 -1.16 0.00 0.00 60.37 59.50 4ayk h HIS 122 Cb -0.07 -0.37 -0.01 0.00 1.06 0.00 0.00 27.41 28.03 4ayk h HIS 122 CO -0.00 0.80 -0.32 0.77 0.86 0.00 0.00 177.93 180.04 4ayk h SER 123 N 1.17 0.00 0.34 2.45 0.02 -0.91 -2.10 113.55 114.51 4ayk h SER 123 Ca 0.29 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.24 4ayk h SER 123 Cb 0.04 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.58 4ayk h SER 123 CO -0.05 0.32 -0.06 0.18 -1.14 0.00 0.00 176.83 176.08 4ayk n LEU 124 N -3.62 0.31 0.00 5.07 4.77 -0.16 -4.72 117.00 118.66 4ayk n LEU 124 Ca -0.01 0.06 0.00 0.00 -0.03 0.00 0.00 56.01 56.03 4ayk n LEU 124 Cb 0.44 -0.17 0.00 0.00 -2.33 0.00 0.00 43.42 41.36 4ayk n LEU 124 CO 0.35 0.06 0.00 0.61 -1.33 0.00 0.00 177.39 177.08 4ayk n GLY 125 N 1.23 0.71 3.71 -0.72 0.00 -0.78 -5.02 105.19 104.30 4ayk n GLY 125 Ca 0.16 -0.25 -0.42 0.00 0.00 0.00 0.00 46.02 45.52 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 4.34 0.64 0.99 1.43 0.24 -4.99 118.68 121.32 4ayk s LEU 126 Ca 0.00 1.58 -0.04 0.00 -1.03 0.00 0.00 54.13 54.64 4ayk s LEU 126 Cb 0.00 -3.51 0.05 0.00 0.03 0.00 0.00 46.19 42.76 4ayk s LEU 126 CO 0.00 -0.28 0.92 -0.44 0.23 0.00 0.00 176.35 176.78 4ayk s SER 127 N 1.01 5.02 0.72 2.29 0.01 -1.26 -4.25 113.70 117.24 4ayk s SER 127 Ca 0.49 0.30 -0.13 0.00 1.31 0.00 0.00 55.95 57.92 4ayk s SER 127 Cb -0.20 -1.05 0.03 0.00 0.21 0.00 0.00 66.02 65.01 4ayk s SER 127 CO 0.25 -1.40 1.11 -1.00 0.41 0.00 0.00 173.24 172.61 4ayk s HIS 128 N -3.05 2.53 0.26 2.43 0.09 -1.26 -4.99 115.29 111.29 4ayk s HIS 128 Ca 0.59 1.57 0.07 0.00 -0.00 0.00 0.00 55.06 57.28 4ayk s HIS 128 Cb -0.11 -3.15 -0.05 0.00 -0.00 0.00 0.00 32.58 29.27 4ayk s HIS 128 CO 0.42 -1.84 -0.08 0.45 -0.00 0.00 0.00 174.74 173.69 4ayk s SER 129 N -2.84 2.72 -0.07 1.40 0.15 -1.17 -5.04 113.70 108.84 4ayk s SER 129 Ca 0.65 -1.14 0.17 0.00 0.70 0.00 0.00 55.95 56.33 4ayk s SER 129 Cb -0.20 -0.16 0.56 0.00 -1.71 0.00 0.00 66.02 64.51 4ayk s SER 129 CO 0.48 -0.29 1.48 0.35 1.20 0.00 0.00 173.24 176.45 4ayk n THR 130 N -0.53 1.54 -2.95 6.45 -2.24 -1.26 -4.58 114.28 110.71 4ayk n THR 130 Ca -0.06 -1.22 -0.40 0.00 -2.27 0.00 0.00 64.05 60.10 4ayk n THR 130 Cb 0.62 0.23 -0.04 0.00 -2.10 0.00 0.00 70.33 69.04 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 -1.11 7.12 0.29 3.42 -1.08 -1.26 -4.95 116.67 119.11 4ayk s ASP 131 Ca 0.41 1.35 -0.02 0.00 -0.52 0.00 0.00 52.55 53.77 4ayk s ASP 131 Cb 0.26 -2.46 0.42 0.00 -1.46 0.00 0.00 42.92 39.68 4ayk s ASP 131 CO 0.21 -0.12 1.96 -0.29 0.52 0.00 0.00 175.17 177.45 4ayk h ILE 132 N 4.64 1.22 -0.00 4.11 2.10 -2.02 -1.30 117.51 126.26 4ayk h ILE 132 Ca -0.42 -0.40 0.00 0.00 1.08 0.00 0.00 64.86 65.13 4ayk h ILE 132 Cb 1.20 -0.02 0.00 0.00 -1.09 0.00 0.00 36.82 36.91 4ayk h ILE 132 CO 0.74 0.21 0.00 0.61 -1.08 0.00 0.00 178.15 178.63 4ayk n GLY 133 N -1.40 -0.99 3.70 8.18 0.00 -1.26 -4.79 105.19 108.64 4ayk n GLY 133 Ca 0.09 -0.17 -0.41 0.00 0.00 0.00 0.00 46.02 45.53 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 3.30 0.32 4.61 0.00 -0.49 -4.68 121.76 122.82 4ayk s ALA 134 Ca 0.41 0.31 0.21 0.00 0.00 0.00 0.00 51.96 52.89 4ayk s ALA 134 Cb 0.19 -3.20 1.06 0.00 0.00 0.00 0.00 23.12 21.17 4ayk s ALA 134 CO 0.31 -0.28 1.92 -0.07 0.00 0.00 0.00 175.76 177.64 4ayk h LEU 135 N 7.13 0.00 -4.01 0.00 3.38 -1.87 -3.18 115.31 116.76 4ayk h LEU 135 Ca -0.38 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.51 4ayk h LEU 135 Cb 1.19 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.91 4ayk h LEU 135 CO 0.77 0.24 -0.03 0.23 0.09 0.00 0.00 178.44 179.74 4ayk n MET 136 N -3.72 1.01 -2.20 1.13 2.81 -1.26 -4.87 117.12 110.02 4ayk n MET 136 Ca -0.01 -0.39 -0.42 0.00 -1.81 0.00 0.00 57.70 55.07 4ayk n MET 136 Cb 0.35 -1.58 -0.03 0.00 -0.71 0.00 0.00 33.22 31.25 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 1.39 3.06 0.05 2.03 6.14 -1.20 -3.04 117.35 125.78 4ayk s TYR 137 Ca 0.26 0.89 -0.18 0.00 0.64 0.00 0.00 57.07 58.68 4ayk s TYR 137 Cb 0.12 -3.67 -0.08 0.00 0.42 0.00 0.00 41.96 38.75 4ayk s TYR 137 CO 0.00 -2.41 1.29 -1.35 0.64 0.00 0.00 175.55 173.72 4ayk h PRO 138 N 7.28 -0.43 -7.26 4.97 0.11 -1.90 -3.43 132.00 131.35 4ayk h PRO 138 Ca -0.40 0.03 -0.46 0.00 0.11 0.00 0.00 66.00 65.28 4ayk h PRO 138 Cb 1.20 0.10 0.07 0.00 0.11 0.00 0.00 31.00 32.48 4ayk h PRO 138 CO 0.88 -0.29 0.21 -1.54 -0.21 0.00 0.00 178.00 177.05 4ayk s SER 139 N -3.49 4.94 0.07 -2.05 1.04 -1.26 -5.05 113.70 107.91 4ayk s SER 139 Ca -0.09 0.47 -0.24 0.00 0.48 0.00 0.00 55.95 56.57 4ayk s SER 139 Cb 0.03 -1.18 -0.06 0.00 0.10 0.00 0.00 66.02 64.91 4ayk s SER 139 CO 0.31 -1.51 0.72 -0.47 0.98 0.00 0.00 173.24 173.28 4ayk s TYR 140 N -3.19 3.78 0.19 5.02 5.04 -1.26 -5.05 117.35 121.88 4ayk s TYR 140 Ca 0.59 1.46 -0.09 0.00 -2.44 0.00 0.00 57.07 56.59 4ayk s TYR 140 Cb -0.11 -2.74 -0.01 0.00 0.35 0.00 0.00 41.96 39.45 4ayk s TYR 140 CO 0.44 0.38 0.32 0.95 -1.34 0.00 0.00 175.55 176.30 4ayk s THR 141 N -0.46 0.04 0.32 4.34 -4.23 -1.26 -5.12 115.64 109.26 4ayk s THR 141 Ca 0.36 -1.49 -0.29 0.00 -1.18 0.00 0.00 61.69 59.09 4ayk s THR 141 Cb -0.21 -2.05 -0.12 0.00 1.34 0.00 0.00 72.50 71.46 4ayk s THR 141 CO 0.23 -0.16 1.42 0.33 -0.54 0.00 0.00 174.62 175.90 4ayk n PHE 142 N -0.27 2.53 -4.04 3.99 -0.00 -1.26 -4.99 117.46 113.42 4ayk n PHE 142 Ca -0.04 0.44 -0.08 0.00 -0.00 0.00 0.00 57.45 57.77 4ayk n PHE 142 Cb 0.63 -2.49 -0.10 0.00 -0.00 0.00 0.00 39.48 37.52 4ayk n PHE 142 CO 0.00 0.00 0.00 -1.54 -0.00 0.00 0.00 176.76 175.22 4ayk s SER 143 N 0.03 0.38 0.00 -2.13 1.04 -1.26 -5.15 113.70 106.61 4ayk s SER 143 Ca 0.59 -0.76 0.00 0.00 0.48 0.00 0.00 55.95 56.27 4ayk s SER 143 Cb -0.55 0.15 0.00 0.00 0.10 0.00 0.00 66.02 65.72 4ayk s SER 143 CO 0.57 -0.45 0.00 0.61 0.98 0.00 0.00 173.24 174.95 4ayk n GLY 144 N 0.83 0.64 3.87 7.32 0.00 -1.26 -5.04 105.19 111.55 4ayk n GLY 144 Ca -0.19 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.53 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 -1.00 6.23 -0.42 1.61 1.01 -1.26 -5.00 116.67 117.83 4ayk s ASP 145 Ca 0.00 1.37 -0.24 0.00 0.71 0.00 0.00 52.55 54.39 4ayk s ASP 145 Cb 0.00 -2.44 0.02 0.00 1.01 0.00 0.00 42.92 41.51 4ayk s ASP 145 CO 0.00 -0.85 0.84 -0.69 0.21 0.00 0.00 175.17 174.68 4ayk s VAL 146 N -3.14 4.61 0.00 -1.27 1.01 -1.26 -5.01 120.40 115.35 4ayk s VAL 146 Ca 0.54 0.73 -0.08 0.00 0.00 0.00 0.00 61.98 63.18 4ayk s VAL 146 Cb -0.11 -4.32 0.00 0.00 0.00 0.00 0.00 36.38 31.95 4ayk s VAL 146 CO 0.53 -0.65 0.15 -1.10 0.00 0.00 0.00 175.10 174.02 4ayk s GLN 147 N 3.39 0.50 0.35 2.72 -0.21 -1.26 -5.09 119.66 120.06 4ayk s GLN 147 Ca 0.33 -0.39 -0.26 0.00 0.02 0.00 0.00 55.36 55.06 4ayk s GLN 147 Cb -0.12 0.21 -0.09 0.00 1.00 0.00 0.00 33.01 34.01 4ayk s GLN 147 CO 0.22 -0.12 1.04 -0.51 -2.12 0.00 0.00 175.29 173.79 4ayk s LEU 148 N -1.39 4.31 0.37 2.90 1.43 -1.26 -4.75 118.68 120.29 4ayk s LEU 148 Ca -0.15 2.05 0.03 0.00 -1.03 0.00 0.00 54.13 55.04 4ayk s LEU 148 Cb -0.08 -3.98 -0.01 0.00 0.03 0.00 0.00 46.19 42.15 4ayk s LEU 148 CO 0.02 -0.29 0.55 0.00 0.23 0.00 0.00 176.35 176.86 4ayk s ALA 149 N -1.50 3.94 0.25 4.21 0.00 -1.26 -4.92 121.76 122.47 4ayk s ALA 149 Ca 0.52 -1.20 -0.06 0.00 0.00 0.00 0.00 51.96 51.22 4ayk s ALA 149 Cb -0.24 -1.93 0.25 0.00 0.00 0.00 0.00 23.12 21.20 4ayk s ALA 149 CO 0.30 -0.15 1.92 0.37 0.00 0.00 0.00 175.76 178.21 4ayk h GLN 150 N 0.70 1.30 -1.01 0.00 5.75 -1.96 -0.06 115.11 119.84 4ayk h GLN 150 Ca -0.47 -0.08 0.02 0.00 -0.15 0.00 0.00 58.65 57.96 4ayk h GLN 150 Cb 1.25 -0.29 -0.05 0.00 1.07 0.00 0.00 27.48 29.45 4ayk h GLN 150 CO 0.57 0.87 0.67 0.22 -2.65 0.00 0.00 178.83 178.50 4ayk h ASP 151 N 1.34 1.14 -0.19 -0.69 1.82 -1.98 0.34 116.42 118.20 4ayk h ASP 151 Ca 0.36 -0.03 -0.21 0.00 -0.39 0.00 0.00 57.03 56.76 4ayk h ASP 151 Cb -0.15 -0.28 0.01 0.00 0.68 0.00 0.00 39.33 39.58 4ayk h ASP 151 CO -0.08 0.82 -0.71 0.44 -1.61 0.00 0.00 179.24 178.10 4ayk h ASP 152 N 1.35 0.96 0.01 2.28 3.32 -1.71 -2.13 116.42 120.50 4ayk h ASP 152 Ca 0.37 -0.60 -0.00 0.00 0.02 0.00 0.00 57.03 56.82 4ayk h ASP 152 Cb -0.13 -0.28 0.00 0.00 0.22 0.00 0.00 39.33 39.14 4ayk h ASP 152 CO -0.09 1.40 -0.01 0.40 -1.72 0.00 0.00 179.24 179.23 4ayk h ILE 153 N 0.58 1.11 -0.95 0.35 2.04 -0.58 -2.36 117.51 117.69 4ayk h ILE 153 Ca -0.04 -0.36 -0.01 0.00 1.00 0.00 0.00 64.86 65.46 4ayk h ILE 153 Cb 1.34 1.35 -0.05 0.00 -0.74 0.00 0.00 36.82 38.73 4ayk h ILE 153 CO 0.15 0.09 0.57 0.44 0.00 0.00 0.00 178.15 179.41 4ayk h ASP 154 N -0.17 1.14 0.35 1.72 3.32 -0.99 -1.08 116.42 120.71 4ayk h ASP 154 Ca -0.00 -0.07 -0.01 0.00 0.02 0.00 0.00 57.03 56.97 4ayk h ASP 154 Cb 0.17 -0.29 -0.00 0.00 0.22 0.00 0.00 39.33 39.42 4ayk h ASP 154 CO 0.00 0.88 -0.21 1.23 -1.72 0.00 0.00 179.24 179.42 4ayk h GLY 155 N 1.31 -0.55 1.20 2.75 0.00 -1.15 0.19 103.07 106.82 4ayk h GLY 155 Ca 0.34 0.23 -0.14 0.00 0.00 0.00 0.00 47.33 47.76 4ayk h GLY 155 CO -0.06 -0.21 -0.27 1.19 0.00 0.00 0.00 176.54 177.18 4ayk h ILE 156 N -0.53 1.27 -0.73 2.60 6.09 -1.34 -2.82 117.51 122.04 4ayk h ILE 156 Ca -0.04 -1.43 -0.05 0.00 -1.37 0.00 0.00 64.86 61.97 4ayk h ILE 156 Cb 0.43 1.23 -0.03 0.00 0.47 0.00 0.00 36.82 38.93 4ayk h ILE 156 CO 0.05 0.48 0.25 1.56 -3.07 0.00 0.00 178.15 177.42 4ayk h GLN 157 N 0.77 1.12 -0.72 2.19 4.20 -1.07 -2.35 115.11 119.25 4ayk h GLN 157 Ca 0.09 -0.23 0.01 0.00 0.06 0.00 0.00 58.65 58.58 4ayk h GLN 157 Cb 0.84 -0.17 -0.04 0.00 0.30 0.00 0.00 27.48 28.41 4ayk h GLN 157 CO 0.07 0.94 0.48 0.00 -0.67 0.00 0.00 178.83 179.65 4ayk h ALA 158 N 1.18 0.91 0.01 3.87 0.00 -0.45 2.18 119.26 126.97 4ayk h ALA 158 Ca 0.24 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 55.10 4ayk h ALA 158 Cb 0.27 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 17.77 4ayk h ALA 158 CO -0.01 0.34 -0.00 0.82 0.00 0.00 0.00 179.25 180.39 4ayk h ILE 159 N 0.98 1.07 0.00 0.00 2.04 -1.21 -3.39 117.51 116.99 4ayk h ILE 159 Ca 0.26 -0.22 0.00 0.00 1.00 0.00 0.00 64.86 65.90 4ayk h ILE 159 Cb -0.11 1.22 0.00 0.00 -0.74 0.00 0.00 36.82 37.18 4ayk h ILE 159 CO -0.06 0.06 -0.20 -1.22 0.00 0.00 0.00 178.15 176.73 4ayk n TYR 160 N -5.05 0.10 -2.50 1.37 4.02 -0.92 -5.13 117.16 109.04 4ayk n TYR 160 Ca -0.07 0.04 0.00 0.00 -0.01 0.00 0.00 57.90 57.86 4ayk n TYR 160 Cb 0.08 -0.23 0.00 0.00 -0.02 0.00 0.00 39.34 39.16 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 1.58 -1.77 3.83 2.72 0.00 0.74 -5.04 105.19 107.25 4ayk n GLY 161 Ca -0.03 -1.18 -0.37 0.00 0.00 0.00 0.00 46.02 44.44 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 4.05 -1.10 1.61 0.52 -1.26 -4.34 118.95 116.70 4ayk s ARG 162 Ca 0.00 0.56 -0.22 0.00 -0.52 0.00 0.00 55.73 55.55 4ayk s ARG 162 Cb 0.00 -3.10 0.01 0.00 0.52 0.00 0.00 34.95 32.39 4ayk s ARG 162 CO 0.00 0.58 1.71 -1.12 0.02 0.00 0.00 175.30 176.48 4ayk s SER 163 N -1.38 6.10 -0.58 0.23 0.01 -1.26 -4.89 113.70 111.92 4ayk s SER 163 Ca 0.32 -1.62 -0.20 0.00 1.31 0.00 0.00 55.95 55.77 4ayk s SER 163 Cb -0.17 -2.57 0.09 0.00 0.21 0.00 0.00 66.02 63.58 4ayk s SER 163 CO 0.18 -1.91 0.73 -1.10 0.41 0.00 0.00 173.24 171.55 4ayk s GLN 164 N 5.40 3.07 0.06 12.44 -0.21 -1.26 -4.99 119.66 134.18 4ayk s GLN 164 Ca 0.57 -1.15 -0.25 0.00 0.02 0.00 0.00 55.36 54.54 4ayk s GLN 164 Cb -0.00 -4.23 0.07 0.00 1.00 0.00 0.00 33.01 29.85 4ayk s GLN 164 CO 0.01 -1.52 0.61 -0.80 -2.12 0.00 0.00 175.29 171.46 4ayk s ASN 165 N 3.45 -0.57 -1.38 5.90 0.01 -1.26 -5.05 114.94 116.04 4ayk s ASN 165 Ca 0.14 0.27 -0.14 0.00 -0.71 0.00 0.00 52.86 52.42 4ayk s ASN 165 Cb -0.22 0.55 -0.00 0.00 0.41 0.00 0.00 41.25 41.99 4ayk s ASN 165 CO 0.08 -0.79 2.27 -0.81 -1.51 0.00 0.00 177.10 176.33 4ayk n PRO 166 N 0.22 2.75 -3.10 -0.60 -0.04 -1.26 -4.93 135.00 128.04 4ayk n PRO 166 Ca -0.18 -2.44 -0.39 0.00 -0.04 0.00 0.00 63.50 60.45 4ayk n PRO 166 Cb 0.61 -3.18 -0.05 0.00 -0.04 0.00 0.00 33.50 30.85 4ayk n PRO 166 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 4ayk s VAL 167 N 3.33 4.89 -0.65 0.52 1.01 -1.26 -5.02 120.40 123.22 4ayk s VAL 167 Ca 0.51 1.40 0.05 0.00 0.00 0.00 0.00 61.98 63.93 4ayk s VAL 167 Cb 0.14 -4.01 0.17 0.00 0.00 0.00 0.00 36.38 32.68 4ayk s VAL 167 CO -0.06 0.36 0.46 -1.10 0.00 0.00 0.00 175.10 174.76 4ayk s GLN 168 N 0.10 2.21 0.00 2.72 -1.52 -1.26 -5.26 119.66 116.65 4ayk s GLN 168 Ca 0.35 -3.13 0.16 0.00 -1.95 0.00 0.00 55.36 50.78 4ayk s GLN 168 Cb -0.19 -3.12 0.93 0.00 -0.22 0.00 0.00 33.01 30.41 4ayk s GLN 168 CO 0.19 -1.29 1.34 -0.35 -0.25 0.00 0.00 175.29 174.93