#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 0.06-10.15 1.34 3.38 -2.01 -3.43 115.31 104.50 4ayk h LEU 2 Ca 0.00 -0.01 -0.50 0.00 0.09 0.00 0.00 57.88 57.46 4ayk h LEU 2 Cb 0.00 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 40.73 4ayk h LEU 2 CO 0.00 0.05 -0.25 0.42 0.09 0.00 0.00 178.44 178.75 4ayk s THR 3 N -6.17 5.14 0.26 0.22 -4.23 -1.26 -5.06 115.64 104.54 4ayk s THR 3 Ca -0.13 -0.38 -0.29 0.00 -1.18 0.00 0.00 61.69 59.70 4ayk s THR 3 Cb 0.07 -3.79 -0.09 0.00 1.34 0.00 0.00 72.50 70.02 4ayk s THR 3 CO 0.67 -0.37 1.15 -0.70 -0.54 0.00 0.00 174.62 174.83 4ayk s GLU 4 N -3.81 4.57 3.55 3.99 2.12 -1.26 -4.76 118.70 123.10 4ayk s GLU 4 Ca 0.40 1.88 0.00 0.00 0.36 0.00 0.00 54.97 57.60 4ayk s GLU 4 Cb -0.10 -3.19 0.00 0.00 0.26 0.00 0.00 34.13 31.10 4ayk s GLU 4 CO 0.32 0.08 0.00 0.41 -0.54 0.00 0.00 175.26 175.53 4ayk n GLY 5 N 1.39 0.16 3.80 -1.50 0.00 -1.26 -4.79 105.19 102.99 4ayk n GLY 5 Ca 0.00 -0.96 -0.35 0.00 0.00 0.00 0.00 46.02 44.71 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 7.11 0.97 1.61 0.02 -1.26 -4.99 114.94 114.40 4ayk s ASN 6 Ca 0.00 1.77 -0.09 0.00 -1.02 0.00 0.00 52.86 53.51 4ayk s ASN 6 Cb 0.00 -2.56 0.15 0.00 0.02 0.00 0.00 41.25 38.86 4ayk s ASN 6 CO 0.00 -0.23 0.33 -0.81 0.02 0.00 0.00 177.10 176.41 4ayk n PRO 7 N -0.08 -1.91 -3.93 -0.60 -0.04 -1.26 -4.97 135.00 122.21 4ayk n PRO 7 Ca 0.05 -0.56 -0.09 0.00 -0.04 0.00 0.00 63.50 62.86 4ayk n PRO 7 Cb 0.52 -0.89 -0.07 0.00 -0.04 0.00 0.00 33.50 33.02 4ayk n PRO 7 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 4ayk s ARG 8 N -3.21 1.05 -0.26 0.54 0.52 -1.26 -4.92 118.95 111.41 4ayk s ARG 8 Ca 0.26 -1.11 -0.27 0.00 -0.52 0.00 0.00 55.73 54.09 4ayk s ARG 8 Cb -0.05 0.36 0.01 0.00 0.52 0.00 0.00 34.95 35.79 4ayk s ARG 8 CO 0.21 -0.37 0.95 -1.58 0.02 0.00 0.00 175.30 174.53 4ayk s TRP 9 N -3.94 3.27 -1.00 -0.53 0.52 -1.26 -4.89 118.94 111.12 4ayk s TRP 9 Ca 0.13 1.21 0.28 0.00 0.02 0.00 0.00 56.10 57.75 4ayk s TRP 9 Cb 0.04 -3.28 1.13 0.00 -1.15 0.00 0.00 33.47 30.20 4ayk s TRP 9 CO -0.03 -0.53 1.85 0.39 0.02 0.00 0.00 176.95 178.65 4ayk n GLU 10 N 6.32 0.00 -3.15 4.98 1.02 -1.26 -4.81 120.64 123.75 4ayk n GLU 10 Ca 0.09 -0.00 -0.36 0.00 -0.02 0.00 0.00 57.16 56.87 4ayk n GLU 10 Cb 0.47 -1.50 -0.06 0.00 -0.02 0.00 0.00 31.44 30.33 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 -3.00 4.18 0.00 3.49 -0.21 -1.26 -4.95 119.66 117.91 4ayk s GLN 11 Ca 0.14 0.78 0.26 0.00 0.02 0.00 0.00 55.36 56.56 4ayk s GLN 11 Cb 0.19 -2.84 0.66 0.00 1.00 0.00 0.00 33.01 32.02 4ayk s GLN 11 CO 0.56 0.38 1.51 0.25 -2.12 0.00 0.00 175.29 175.86 4ayk n THR 12 N 0.62 0.00 -4.59 -0.19 -2.24 -1.26 -4.84 114.28 101.77 4ayk n THR 12 Ca -0.02 -0.18 -0.22 0.00 -2.27 0.00 0.00 64.05 61.36 4ayk n THR 12 Cb 0.51 0.59 -0.15 0.00 -2.10 0.00 0.00 70.33 69.18 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 -2.40 1.18 0.16 4.78 3.76 -1.26 -2.97 115.29 118.52 4ayk s HIS 13 Ca 0.26 -0.23 0.04 0.00 -0.15 0.00 0.00 55.06 54.98 4ayk s HIS 13 Cb 0.19 -0.76 -0.05 0.00 1.11 0.00 0.00 32.58 33.08 4ayk s HIS 13 CO 0.49 -0.03 -0.08 -0.51 -0.85 0.00 0.00 174.74 173.77 4ayk s LEU 14 N -0.29 2.45 0.17 0.89 1.43 -0.77 -4.98 118.68 117.59 4ayk s LEU 14 Ca 0.05 -1.05 0.07 0.00 -1.03 0.00 0.00 54.13 52.17 4ayk s LEU 14 Cb -0.05 -0.29 -0.04 0.00 0.03 0.00 0.00 46.19 45.84 4ayk s LEU 14 CO -0.00 -0.39 -0.15 0.42 0.23 0.00 0.00 176.35 176.45 4ayk s THR 15 N -3.40 1.63 0.06 5.49 -4.23 -1.26 -2.41 115.64 111.53 4ayk s THR 15 Ca 0.18 -1.98 -0.06 0.00 -1.18 0.00 0.00 61.69 58.65 4ayk s THR 15 Cb 0.04 -1.84 -0.01 0.00 1.34 0.00 0.00 72.50 72.02 4ayk s THR 15 CO 0.01 -0.47 0.12 -0.72 -0.54 0.00 0.00 174.62 173.02 4ayk s TYR 16 N -2.48 0.23 -0.16 3.99 1.13 -1.00 -1.20 117.35 117.86 4ayk s TYR 16 Ca 0.17 -0.61 -0.10 0.00 -1.41 0.00 0.00 57.07 55.11 4ayk s TYR 16 Cb -0.03 -0.15 0.05 0.00 -1.10 0.00 0.00 41.96 40.73 4ayk s TYR 16 CO 0.05 -0.44 0.40 0.50 -2.51 0.00 0.00 175.55 173.55 4ayk s ARG 17 N -3.27 0.40 -0.27 -3.49 3.52 -1.06 -2.24 118.95 112.53 4ayk s ARG 17 Ca 0.01 0.70 -0.21 0.00 -0.13 0.00 0.00 55.73 56.10 4ayk s ARG 17 Cb 0.03 0.05 -0.01 0.00 -1.56 0.00 0.00 34.95 33.45 4ayk s ARG 17 CO -0.08 -0.13 0.66 0.42 -0.81 0.00 0.00 175.30 175.37 4ayk s ILE 18 N 1.03 4.94 0.15 4.11 1.01 -1.26 -2.26 121.20 128.91 4ayk s ILE 18 Ca -0.07 1.09 -0.11 0.00 0.00 0.00 0.00 60.65 61.57 4ayk s ILE 18 Cb -0.07 -3.99 -0.01 0.00 0.01 0.00 0.00 42.46 38.40 4ayk s ILE 18 CO -0.08 -0.06 1.52 -0.33 0.00 0.00 0.00 174.94 175.99 4ayk h GLU 19 N 7.99 0.97 -2.00 2.79 5.08 -1.60 -3.47 114.58 124.33 4ayk h GLU 19 Ca -0.26 -0.44 -0.03 0.00 -1.00 0.00 0.00 59.36 57.63 4ayk h GLU 19 Cb 1.12 -0.02 -0.19 0.00 0.50 0.00 0.00 28.75 30.16 4ayk h GLU 19 CO 0.80 1.11 0.26 1.21 -1.00 0.00 0.00 179.01 181.39 4ayk s ASN 20 N -6.73 -0.60 -0.11 1.42 2.47 -1.26 -5.09 114.94 105.05 4ayk s ASN 20 Ca -0.11 0.60 -0.14 0.00 0.42 0.00 0.00 52.86 53.63 4ayk s ASN 20 Cb 0.12 0.50 -0.05 0.00 -1.45 0.00 0.00 41.25 40.37 4ayk s ASN 20 CO 0.87 -0.59 0.33 -0.31 -3.72 0.00 0.00 177.10 173.69 4ayk s TYR 21 N -1.39 3.55 0.37 0.43 2.02 -1.26 -4.61 117.35 116.46 4ayk s TYR 21 Ca -0.08 0.73 -0.27 0.00 -0.37 0.00 0.00 57.07 57.09 4ayk s TYR 21 Cb -0.00 -2.32 -0.09 0.00 -0.40 0.00 0.00 41.96 39.15 4ayk s TYR 21 CO 0.07 0.38 1.19 -0.08 -1.57 0.00 0.00 175.55 175.54 4ayk s THR 22 N -0.06 3.08 -1.11 -0.71 -1.32 -1.26 -4.89 115.64 109.37 4ayk s THR 22 Ca 0.20 0.97 0.12 0.00 -1.21 0.00 0.00 61.69 61.77 4ayk s THR 22 Cb -0.14 -3.57 0.13 0.00 -1.51 0.00 0.00 72.50 67.40 4ayk s THR 22 CO 0.07 0.15 1.37 -0.81 -2.21 0.00 0.00 174.62 173.19 4ayk n PRO 23 N 0.39 0.04 -0.35 7.08 -0.04 -1.26 -2.97 135.00 137.89 4ayk n PRO 23 Ca 0.03 0.26 -0.01 0.00 -0.04 0.00 0.00 63.50 63.73 4ayk n PRO 23 Cb 0.45 -1.50 0.13 0.00 -0.04 0.00 0.00 33.50 32.54 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 1.11 -5.00 3.54 3.32 -1.95 -3.43 116.42 114.01 4ayk h ASP 24 Ca 0.00 -0.03 -0.17 0.00 0.02 0.00 0.00 57.03 56.85 4ayk h ASP 24 Cb 0.19 -0.28 -0.20 0.00 0.22 0.00 0.00 39.33 39.26 4ayk h ASP 24 CO 0.00 0.80 -0.70 -0.76 -1.72 0.00 0.00 179.24 176.86 4ayk s LEU 25 N -10.08 2.30 0.00 1.55 1.43 -1.16 -4.94 118.68 107.79 4ayk s LEU 25 Ca -0.13 -0.62 -0.14 0.00 -1.03 0.00 0.00 54.13 52.21 4ayk s LEU 25 Cb 0.18 0.09 0.22 0.00 0.03 0.00 0.00 46.19 46.71 4ayk s LEU 25 CO 0.81 -0.36 0.49 -0.81 0.23 0.00 0.00 176.35 176.72 4ayk n PRO 26 N 1.24 -3.04 0.03 1.29 -0.04 -1.26 -4.60 135.00 128.61 4ayk n PRO 26 Ca -0.22 -0.83 -0.15 0.00 -0.04 0.00 0.00 63.50 62.27 4ayk n PRO 26 Cb 0.56 -1.19 -0.14 0.00 -0.04 0.00 0.00 33.50 32.70 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 0.17 -0.47 0.54 0.11 -1.97 -3.17 114.38 109.59 4ayk h ARG 27 Ca -0.22 -0.29 0.03 0.00 0.10 0.00 0.00 59.98 59.60 4ayk h ARG 27 Cb 0.76 0.11 -0.04 0.00 1.11 0.00 0.00 29.97 31.91 4ayk h ARG 27 CO 0.13 0.96 0.26 0.00 0.10 0.00 0.00 179.97 181.42 4ayk h ALA 28 N 0.58 0.60 -0.40 0.08 0.00 -1.98 0.74 119.26 118.88 4ayk h ALA 28 Ca -0.28 0.01 -0.15 0.00 0.00 0.00 0.00 54.91 54.49 4ayk h ALA 28 Cb 2.00 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 19.69 4ayk h ALA 28 CO 0.12 -0.08 -0.35 -0.44 0.00 0.00 0.00 179.25 178.51 4ayk h ASP 29 N 0.51 0.98 -0.09 0.00 3.32 -1.93 -0.32 116.42 118.89 4ayk h ASP 29 Ca 0.20 -0.43 -0.05 0.00 0.02 0.00 0.00 57.03 56.77 4ayk h ASP 29 Cb 0.07 -0.27 -0.00 0.00 0.22 0.00 0.00 39.33 39.35 4ayk h ASP 29 CO -0.12 1.22 -0.12 0.58 -1.72 0.00 0.00 179.24 179.08 4ayk h VAL 30 N 0.77 1.38 -0.94 -1.35 2.07 -1.43 -2.55 116.25 114.20 4ayk h VAL 30 Ca 0.07 -1.34 0.00 0.00 0.82 0.00 0.00 66.70 66.26 4ayk h VAL 30 Cb 0.93 2.06 -0.05 0.00 -1.52 0.00 0.00 31.29 32.71 4ayk h VAL 30 CO 0.09 0.38 0.61 -0.78 0.02 0.00 0.00 177.57 177.88 4ayk h ASP 31 N -0.19 1.09 -0.28 0.57 1.82 0.49 -2.34 116.42 117.59 4ayk h ASP 31 Ca 0.01 -0.04 0.01 0.00 -0.39 0.00 0.00 57.03 56.62 4ayk h ASP 31 Cb 0.67 -0.27 -0.02 0.00 0.68 0.00 0.00 39.33 40.38 4ayk h ASP 31 CO 0.03 0.81 0.16 -0.74 -1.61 0.00 0.00 179.24 177.88 4ayk h HIS 32 N 1.28 0.29 -0.93 0.28 2.76 -1.00 0.37 115.15 118.19 4ayk h HIS 32 Ca 0.34 0.01 0.03 0.00 -2.20 0.00 0.00 60.37 58.55 4ayk h HIS 32 Cb -0.12 -0.09 -0.05 0.00 1.55 0.00 0.00 27.41 28.70 4ayk h HIS 32 CO -0.00 0.17 0.62 0.00 -1.30 0.00 0.00 177.93 177.41 4ayk h ALA 33 N 1.13 1.38 -0.30 5.26 0.00 -1.02 -1.99 119.26 123.71 4ayk h ALA 33 Ca 0.11 -0.05 -0.16 0.00 0.00 0.00 0.00 54.91 54.81 4ayk h ALA 33 Cb 0.01 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.44 4ayk h ALA 33 CO -0.06 0.55 -0.44 0.82 0.00 0.00 0.00 179.25 180.12 4ayk h ILE 34 N 1.21 1.29 -0.60 0.00 1.08 -0.88 -2.79 117.51 116.82 4ayk h ILE 34 Ca 0.36 -1.63 -0.05 0.00 -0.39 0.00 0.00 64.86 63.16 4ayk h ILE 34 Cb -0.05 1.52 -0.03 0.00 -3.07 0.00 0.00 36.82 35.20 4ayk h ILE 34 CO -0.10 0.53 0.19 -0.08 -0.69 0.00 0.00 178.15 178.00 4ayk h GLU 35 N 0.62 0.92 -0.71 2.37 4.81 -0.26 -2.57 114.58 119.77 4ayk h GLU 35 Ca 0.04 -0.20 -0.07 0.00 -0.13 0.00 0.00 59.36 59.00 4ayk h GLU 35 Cb 1.01 -0.14 -0.03 0.00 0.63 0.00 0.00 28.75 30.23 4ayk h GLU 35 CO 0.10 0.82 0.17 0.87 -0.73 0.00 0.00 179.01 180.24 4ayk h LYS 36 N 0.84 1.13 -0.03 1.92 1.57 -1.37 -1.90 116.57 118.74 4ayk h LYS 36 Ca 0.19 -0.27 0.00 0.00 -1.87 0.00 0.00 60.65 58.70 4ayk h LYS 36 Cb 0.28 -0.15 -0.00 0.00 0.08 0.00 0.00 32.23 32.44 4ayk h LYS 36 CO -0.01 1.00 0.02 0.00 -0.57 0.00 0.00 179.45 179.89 4ayk h ALA 37 N 1.10 0.04 -0.64 3.86 0.00 -1.23 -0.08 119.26 122.31 4ayk h ALA 37 Ca 0.22 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.13 4ayk h ALA 37 Cb 0.38 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.13 4ayk h ALA 37 CO 0.00 -0.47 0.39 0.74 0.00 0.00 0.00 179.25 179.91 4ayk h PHE 38 N 0.04 0.84 -0.86 0.00 0.04 -1.34 -2.39 116.94 113.27 4ayk h PHE 38 Ca 0.01 -0.00 0.01 0.00 2.80 0.00 0.00 57.97 60.79 4ayk h PHE 38 Cb -0.00 -0.28 -0.04 0.00 2.20 0.00 0.00 35.95 37.83 4ayk h PHE 38 CO -0.08 0.57 0.56 1.96 -0.60 0.00 0.00 178.31 180.72 4ayk h GLN 39 N 0.86 1.13 -0.65 1.51 4.20 -0.94 0.19 115.11 121.42 4ayk h GLN 39 Ca 0.23 -0.07 0.01 0.00 0.06 0.00 0.00 58.65 58.87 4ayk h GLN 39 Cb -0.03 -0.25 -0.03 0.00 0.30 0.00 0.00 27.48 27.46 4ayk h GLN 39 CO -0.04 0.75 0.43 -0.07 -0.67 0.00 0.00 178.83 179.23 4ayk h LEU 40 N 1.16 0.74 -0.12 1.46 3.38 -0.52 0.16 115.31 121.58 4ayk h LEU 40 Ca 0.31 -0.02 -0.17 0.00 0.09 0.00 0.00 57.88 58.09 4ayk h LEU 40 Cb -0.13 -0.18 0.01 0.00 0.09 0.00 0.00 40.66 40.45 4ayk h LEU 40 CO -0.07 0.53 -0.60 -0.50 0.09 0.00 0.00 178.44 177.89 4ayk h TRP 41 N 0.87 0.83 -0.26 1.13 4.06 -1.14 -3.25 115.95 118.19 4ayk h TRP 41 Ca 0.24 -0.37 -0.11 0.00 2.06 0.00 0.00 58.89 60.70 4ayk h TRP 41 Cb -0.10 -0.13 -0.01 0.00 -1.00 0.00 0.00 29.16 27.92 4ayk h TRP 41 CO -0.03 1.17 -0.31 1.03 -3.56 0.00 0.00 178.44 176.74 4ayk h SER 42 N 0.26 0.56 -0.19 -3.49 0.87 -0.82 -2.98 113.55 107.76 4ayk h SER 42 Ca -0.04 -0.22 0.06 0.00 -1.23 0.00 0.00 61.79 60.36 4ayk h SER 42 Cb 1.25 -0.15 -0.01 0.00 -0.44 0.00 0.00 62.40 63.04 4ayk h SER 42 CO 0.12 0.84 0.15 0.78 -0.53 0.00 0.00 176.83 178.20 4ayk h ASN 43 N 0.47 0.00 -0.41 6.23 -0.26 -0.71 -2.04 115.58 118.85 4ayk h ASN 43 Ca 0.06 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.80 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 -4.31 1.06 -3.88 2.81 0.24 -1.15 -4.98 118.33 108.12 4ayk n VAL 44 Ca 0.02 -1.03 -0.11 0.00 -2.04 0.00 0.00 64.34 61.18 4ayk n VAL 44 Cb 0.29 0.47 -0.10 0.00 -1.47 0.00 0.00 33.84 33.03 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 -1.07 0.08 -2.00 3.34 -4.23 -0.77 -4.27 115.64 106.72 4ayk s THR 45 Ca 0.28 -0.70 0.09 0.00 -1.18 0.00 0.00 61.69 60.19 4ayk s THR 45 Cb 0.15 -0.42 0.26 0.00 1.34 0.00 0.00 72.50 73.83 4ayk s THR 45 CO 0.18 -0.38 1.05 -0.81 -0.54 0.00 0.00 174.62 174.12 4ayk n PRO 46 N 1.46 0.61 -1.78 3.99 -0.04 -1.26 -4.68 135.00 133.30 4ayk n PRO 46 Ca -0.23 0.00 -0.33 0.00 -0.04 0.00 0.00 63.50 62.90 4ayk n PRO 46 Cb 0.55 -1.24 0.04 0.00 -0.04 0.00 0.00 33.50 32.82 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 3.38 0.01 1.53 1.43 -1.26 -4.98 118.68 117.31 4ayk s LEU 47 Ca 0.14 1.94 0.04 0.00 -1.03 0.00 0.00 54.13 55.21 4ayk s LEU 47 Cb 0.06 -4.54 -0.01 0.00 0.03 0.00 0.00 46.19 41.73 4ayk s LEU 47 CO 0.11 -1.56 -0.11 0.42 0.23 0.00 0.00 176.35 175.43 4ayk s THR 48 N -2.42 0.90 0.18 5.49 -4.23 -1.16 -4.76 115.64 109.64 4ayk s THR 48 Ca 0.66 -0.66 0.11 0.00 -1.18 0.00 0.00 61.69 60.62 4ayk s THR 48 Cb -0.19 -0.79 -0.04 0.00 1.34 0.00 0.00 72.50 72.82 4ayk s THR 48 CO 0.42 0.13 -0.24 -0.36 -0.54 0.00 0.00 174.62 174.03 4ayk s PHE 49 N -0.50 2.27 -0.19 3.99 0.08 -1.26 -1.84 117.98 120.54 4ayk s PHE 49 Ca 0.02 -0.37 -0.12 0.00 0.12 0.00 0.00 56.93 56.59 4ayk s PHE 49 Cb -0.06 -1.15 0.06 0.00 -0.57 0.00 0.00 43.02 41.30 4ayk s PHE 49 CO 0.00 0.45 0.47 0.99 -0.10 0.00 0.00 175.22 177.03 4ayk s THR 50 N -1.55 -0.02 0.24 0.64 2.01 -1.01 -4.99 115.64 110.97 4ayk s THR 50 Ca 0.19 0.06 -0.30 0.00 0.31 0.00 0.00 61.69 61.95 4ayk s THR 50 Cb -0.08 -0.68 -0.09 0.00 0.01 0.00 0.00 72.50 71.66 4ayk s THR 50 CO 0.09 0.02 1.02 -0.75 -0.69 0.00 0.00 174.62 174.31 4ayk s LYS 51 N 1.17 4.75 -0.05 4.92 2.20 -1.26 -2.36 119.74 129.11 4ayk s LYS 51 Ca -0.07 1.63 0.06 0.00 -0.36 0.00 0.00 55.97 57.22 4ayk s LYS 51 Cb -0.07 -3.25 -0.01 0.00 -1.51 0.00 0.00 37.83 32.99 4ayk s LYS 51 CO -0.11 0.35 -0.23 0.14 -0.36 0.00 0.00 175.35 175.14 4ayk s VAL 52 N -1.04 1.88 -2.43 4.02 -7.23 -0.95 -4.91 120.40 109.74 4ayk s VAL 52 Ca 0.43 -0.98 0.25 0.00 -1.81 0.00 0.00 61.98 59.87 4ayk s VAL 52 Cb -0.28 -1.59 0.21 0.00 0.56 0.00 0.00 36.38 35.28 4ayk s VAL 52 CO 0.36 0.53 1.35 -0.24 -0.31 0.00 0.00 175.10 176.78 4ayk n SER 53 N 2.90 2.12 -3.75 4.85 2.88 -1.26 -4.68 113.62 116.68 4ayk n SER 53 Ca -0.17 -1.59 -0.13 0.00 -1.33 0.00 0.00 58.87 55.65 4ayk n SER 53 Cb 0.52 0.17 -0.08 0.00 -0.75 0.00 0.00 64.21 64.07 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 -2.22 0.74 0.00 -1.46 2.02 -1.26 -5.13 118.70 111.39 4ayk s GLU 54 Ca 0.26 -0.33 0.00 0.00 0.02 0.00 0.00 54.97 54.92 4ayk s GLU 54 Cb 0.19 0.32 0.00 0.00 0.10 0.00 0.00 34.13 34.75 4ayk s GLU 54 CO 0.42 -0.22 0.00 0.41 0.02 0.00 0.00 175.26 175.89 4ayk n GLY 55 N 0.94 -0.92 3.72 -1.39 0.00 -1.26 -4.88 105.19 101.41 4ayk n GLY 55 Ca -0.20 -1.65 -0.42 0.00 0.00 0.00 0.00 46.02 43.75 4ayk n GLY 55 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 4ayk s GLN 56 N -2.13 4.62 0.15 1.61 2.00 -1.26 -5.04 119.66 119.61 4ayk s GLN 56 Ca 0.00 1.44 -0.06 0.00 -2.00 0.00 0.00 55.36 54.74 4ayk s GLN 56 Cb 0.00 -3.42 -0.06 0.00 0.80 0.00 0.00 33.01 30.33 4ayk s GLN 56 CO 0.00 0.06 0.41 0.00 -0.50 0.00 0.00 175.29 175.26 4ayk s ALA 57 N 0.57 3.75 0.25 1.58 0.00 -1.26 -4.98 121.76 121.67 4ayk s ALA 57 Ca 0.50 -0.50 -0.05 0.00 0.00 0.00 0.00 51.96 51.90 4ayk s ALA 57 Cb -0.22 -2.18 0.28 0.00 0.00 0.00 0.00 23.12 21.00 4ayk s ALA 57 CO 0.29 0.64 1.93 -0.44 0.00 0.00 0.00 175.76 178.18 4ayk h ASP 58 N 2.82 1.14 -3.16 0.00 3.32 -1.70 -3.39 116.42 115.45 4ayk h ASP 58 Ca -0.46 -0.03 -0.67 0.00 0.02 0.00 0.00 57.03 55.89 4ayk h ASP 58 Cb 1.17 -0.28 -0.33 0.00 0.22 0.00 0.00 39.33 40.10 4ayk h ASP 58 CO 0.72 0.82 -0.83 -0.63 -1.72 0.00 0.00 179.24 177.60 4ayk s ILE 59 N -6.10 2.35 -0.20 0.35 1.01 -0.34 -4.77 121.20 113.49 4ayk s ILE 59 Ca -0.13 -0.86 -0.09 0.00 0.00 0.00 0.00 60.65 59.57 4ayk s ILE 59 Cb 0.18 -2.02 -0.05 0.00 0.01 0.00 0.00 42.46 40.58 4ayk s ILE 59 CO 0.82 0.50 0.12 -0.04 0.00 0.00 0.00 174.94 176.33 4ayk s MET 60 N 1.33 4.10 -0.18 2.79 -1.94 -1.26 -2.57 119.30 121.57 4ayk s MET 60 Ca 0.05 -0.27 -0.04 0.00 -1.71 0.00 0.00 55.69 53.72 4ayk s MET 60 Cb -0.13 -3.38 -0.02 0.00 2.01 0.00 0.00 34.83 33.30 4ayk s MET 60 CO -0.11 0.24 -0.04 0.42 -0.01 0.00 0.00 175.02 175.53 4ayk s ILE 61 N 0.50 3.71 0.10 2.53 1.01 -0.96 -0.77 121.20 127.33 4ayk s ILE 61 Ca 0.07 -0.41 -0.12 0.00 0.00 0.00 0.00 60.65 60.19 4ayk s ILE 61 Cb -0.12 -2.65 0.02 0.00 0.01 0.00 0.00 42.46 39.72 4ayk s ILE 61 CO -0.00 0.46 0.29 -0.94 0.00 0.00 0.00 174.94 174.75 4ayk s SER 62 N 0.77 -0.04 -0.07 3.58 1.04 -1.10 -1.31 113.70 116.56 4ayk s SER 62 Ca -0.01 -0.48 0.02 0.00 0.48 0.00 0.00 55.95 55.95 4ayk s SER 62 Cb -0.15 0.40 -0.02 0.00 0.10 0.00 0.00 66.02 66.35 4ayk s SER 62 CO 0.02 -0.78 -0.12 -0.36 0.98 0.00 0.00 173.24 172.98 4ayk s PHE 63 N -3.76 2.78 0.18 5.02 0.40 -1.26 -2.48 117.98 118.86 4ayk s PHE 63 Ca 0.04 -0.21 0.04 0.00 -0.60 0.00 0.00 56.93 56.19 4ayk s PHE 63 Cb 0.03 -1.70 -0.05 0.00 0.51 0.00 0.00 43.02 41.82 4ayk s PHE 63 CO -0.11 0.14 -0.05 0.14 0.70 0.00 0.00 175.22 176.04 4ayk s VAL 64 N -0.51 1.03 0.03 -0.44 -7.23 -1.09 -4.94 120.40 107.24 4ayk s VAL 64 Ca 0.07 -2.03 0.05 0.00 -1.81 0.00 0.00 61.98 58.25 4ayk s VAL 64 Cb -0.12 -2.06 -0.02 0.00 0.56 0.00 0.00 36.38 34.74 4ayk s VAL 64 CO 0.02 -0.56 -0.14 -0.13 -0.31 0.00 0.00 175.10 173.98 4ayk s ARG 65 N -3.82 0.92 0.51 4.82 0.52 -1.26 -1.66 118.95 118.97 4ayk s ARG 65 Ca 0.22 -0.72 0.00 0.00 -0.52 0.00 0.00 55.73 54.71 4ayk s ARG 65 Cb 0.04 -0.91 0.00 0.00 0.52 0.00 0.00 34.95 34.60 4ayk s ARG 65 CO 0.04 0.23 0.00 0.41 0.02 0.00 0.00 175.30 175.99 4ayk n GLY 66 N 1.98 1.04 3.71 -3.53 0.00 -1.26 -4.26 105.19 102.87 4ayk n GLY 66 Ca -0.18 -0.50 -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 6.98 -0.44 1.61 -1.08 -1.26 -4.23 116.67 114.25 4ayk s ASP 67 Ca 0.00 2.09 0.09 0.00 -0.52 0.00 0.00 52.55 54.21 4ayk s ASP 67 Cb 0.00 -2.58 0.39 0.00 -1.46 0.00 0.00 42.92 39.28 4ayk s ASP 67 CO 0.00 -0.56 0.96 0.00 0.52 0.00 0.00 175.17 176.09 4ayk n HIS 68 N 4.23 2.49 -3.58 -5.34 1.44 -1.26 -4.93 115.22 108.27 4ayk n HIS 68 Ca 0.10 -3.42 -0.19 0.00 -2.01 0.00 0.00 57.72 52.20 4ayk n HIS 68 Cb 0.45 -0.32 0.06 0.00 0.12 0.00 0.00 29.99 30.30 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 -0.18 -5.66 -4.13 -1.40 1.74 -1.26 -5.00 116.66 100.77 4ayk n ARG 69 Ca 0.28 0.72 -0.09 0.00 -0.77 0.00 0.00 57.85 57.99 4ayk n ARG 69 Cb 0.62 -5.48 -0.10 0.00 -1.02 0.00 0.00 32.46 26.48 4ayk n ARG 69 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 4ayk s ASP 70 N -4.36 0.41 -0.05 0.55 1.01 -1.26 -5.03 116.67 107.94 4ayk s ASP 70 Ca 0.00 -1.12 0.09 0.00 0.71 0.00 0.00 52.55 52.23 4ayk s ASP 70 Cb -0.00 0.25 0.35 0.00 1.01 0.00 0.00 42.92 44.53 4ayk s ASP 70 CO 0.78 -0.67 1.18 0.59 0.21 0.00 0.00 175.17 177.26 4ayk n ASN 71 N -0.01 2.52 -3.18 0.27 3.02 -1.26 -4.37 115.26 112.24 4ayk n ASN 71 Ca -0.09 -2.20 -0.23 0.00 -0.03 0.00 0.00 54.58 52.03 4ayk n ASN 71 Cb 0.63 -0.40 -0.06 0.00 -0.61 0.00 0.00 39.78 39.34 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 0.42 0.17 -4.77 6.41 7.64 -1.26 -5.13 113.62 117.10 4ayk n SER 72 Ca 0.12 -2.75 -0.36 0.00 1.01 0.00 0.00 58.87 56.89 4ayk n SER 72 Cb 0.48 -0.56 -0.00 0.00 -1.01 0.00 0.00 64.21 63.12 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 -1.29 3.55 0.49 1.43 0.04 -1.26 -5.00 135.00 132.96 4ayk s PRO 73 Ca 0.36 1.70 -0.20 0.00 0.04 0.00 0.00 61.00 62.89 4ayk s PRO 73 Cb 0.20 -2.20 -0.08 0.00 0.04 0.00 0.00 34.50 32.46 4ayk s PRO 73 CO -0.11 -0.71 1.06 -0.06 0.04 0.00 0.00 177.00 177.22 4ayk s PHE 74 N -1.66 2.93 -0.61 0.56 0.08 -1.26 -5.00 117.98 113.03 4ayk s PHE 74 Ca 0.68 1.57 0.06 0.00 0.12 0.00 0.00 56.93 59.36 4ayk s PHE 74 Cb -0.26 -3.12 0.21 0.00 -0.57 0.00 0.00 43.02 39.28 4ayk s PHE 74 CO 0.31 -0.99 0.59 -3.47 -0.10 0.00 0.00 175.22 171.56 4ayk n ASP 75 N -1.00 2.62 0.00 1.36 -0.08 -1.26 -4.80 116.55 113.38 4ayk n ASP 75 Ca 0.10 -3.16 0.00 0.00 -1.51 0.00 0.00 54.79 50.22 4ayk n ASP 75 Cb 0.52 -0.68 0.00 0.00 2.34 0.00 0.00 41.12 43.30 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 1.49 -2.44 0.11 0.27 0.00 -1.26 -4.17 105.19 99.20 4ayk n GLY 76 Ca 0.25 -1.66 0.10 0.00 0.00 0.00 0.00 46.02 44.71 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 -0.35 0.14 -1.37 1.61 -0.04 -1.26 -4.70 135.00 129.04 4ayk n PRO 77 Ca 0.00 0.43 -0.10 0.00 -0.04 0.00 0.00 63.50 63.79 4ayk n PRO 77 Cb 0.00 -1.80 0.05 0.00 -0.04 0.00 0.00 33.50 31.71 4ayk n PRO 77 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 4ayk n GLY 78 N -0.28 0.53 4.54 0.55 0.00 -1.26 -4.95 105.19 104.32 4ayk n GLY 78 Ca 0.02 -1.96 0.00 0.00 0.00 0.00 0.00 46.02 44.08 4ayk n GLY 78 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 4ayk n GLY 79 N 1.78 -1.54 3.74 -0.02 0.00 -1.26 -4.40 105.19 103.49 4ayk n GLY 79 Ca 0.07 -1.54 -0.41 0.00 0.00 0.00 0.00 46.02 44.14 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 7.15 0.02 1.61 -0.87 -1.26 -4.91 114.94 112.68 4ayk s ASN 80 Ca 0.00 2.18 0.25 0.00 -1.57 0.00 0.00 52.86 53.72 4ayk s ASN 80 Cb 0.00 -2.61 0.47 0.00 -0.02 0.00 0.00 41.25 39.10 4ayk s ASN 80 CO 0.00 -0.32 1.39 0.18 -2.57 0.00 0.00 177.10 175.78 4ayk n LEU 81 N 2.44 0.52 -3.57 0.60 4.77 -1.26 -4.94 117.00 115.56 4ayk n LEU 81 Ca 0.04 0.03 -0.05 0.00 -0.03 0.00 0.00 56.01 56.00 4ayk n LEU 81 Cb 0.45 -0.24 -0.02 0.00 -2.33 0.00 0.00 43.42 41.29 4ayk n LEU 81 CO 0.55 0.10 0.88 0.00 -1.33 0.00 0.00 177.39 177.59 4ayk s ALA 82 N -3.03 -1.97 -0.30 -1.18 0.00 -1.26 -2.09 121.76 111.93 4ayk s ALA 82 Ca 0.10 1.23 -0.08 0.00 0.00 0.00 0.00 51.96 53.21 4ayk s ALA 82 Cb 0.17 0.16 0.15 0.00 0.00 0.00 0.00 23.12 23.60 4ayk s ALA 82 CO 0.71 -0.69 0.69 -3.38 0.00 0.00 0.00 175.76 173.08 4ayk s HIS 83 N -2.73 -1.31 0.69 0.00 -3.43 -1.01 -5.00 115.29 102.50 4ayk s HIS 83 Ca 0.08 1.97 -0.04 0.00 -0.80 0.00 0.00 55.06 56.28 4ayk s HIS 83 Cb -0.01 0.68 0.08 0.00 -1.43 0.00 0.00 32.58 31.90 4ayk s HIS 83 CO -0.06 -0.67 0.97 0.00 -2.00 0.00 0.00 174.74 172.98 4ayk s ALA 84 N 2.84 3.42 0.20 -1.38 0.00 -1.26 -2.84 121.76 122.73 4ayk s ALA 84 Ca 0.02 -1.27 0.05 0.00 0.00 0.00 0.00 51.96 50.76 4ayk s ALA 84 Cb -0.12 -2.32 -0.04 0.00 0.00 0.00 0.00 23.12 20.65 4ayk s ALA 84 CO -0.19 -1.30 0.19 -0.06 0.00 0.00 0.00 175.76 174.40 4ayk s PHE 85 N -3.15 3.20 0.58 0.00 0.40 -0.86 -4.94 117.98 113.21 4ayk s PHE 85 Ca 0.62 -0.03 -0.21 0.00 -0.60 0.00 0.00 56.93 56.71 4ayk s PHE 85 Cb -0.09 -1.50 -0.04 0.00 0.51 0.00 0.00 43.02 41.91 4ayk s PHE 85 CO 0.44 0.51 1.34 1.04 0.70 0.00 0.00 175.22 179.25 4ayk n GLN 86 N -0.74 1.50 -1.55 0.44 6.02 -1.26 -3.38 117.38 118.41 4ayk n GLN 86 Ca -0.08 0.56 -0.40 0.00 -0.01 0.00 0.00 57.00 57.07 4ayk n GLN 86 Cb 0.56 -2.56 -0.04 0.00 1.02 0.00 0.00 30.24 29.22 4ayk n GLN 86 CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 177.06 175.70 4ayk n PRO 87 N -1.30 1.27 -3.92 -1.09 -0.04 -1.26 -2.51 135.00 126.14 4ayk n PRO 87 Ca 0.12 0.20 -0.08 0.00 -0.04 0.00 0.00 63.50 63.70 4ayk n PRO 87 Cb 0.46 -3.14 -0.03 0.00 -0.04 0.00 0.00 33.50 30.74 4ayk n PRO 87 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 4ayk s GLY 88 N 10.24 0.27 0.90 0.55 0.00 -1.26 -4.75 107.32 113.27 4ayk s GLY 88 Ca 1.03 -0.63 -0.12 0.00 0.00 0.00 0.00 44.72 45.01 4ayk s GLY 88 CO 0.33 -0.37 1.09 2.56 0.00 0.00 0.00 173.10 176.72 4ayk s PRO 89 N -3.82 1.20 7.87 2.90 0.04 -1.26 -3.20 135.00 138.73 4ayk s PRO 89 Ca 0.17 0.79 0.00 0.00 0.04 0.00 0.00 61.00 62.00 4ayk s PRO 89 Cb -0.03 -1.80 0.00 0.00 0.04 0.00 0.00 34.50 32.70 4ayk s PRO 89 CO 0.09 -2.27 0.00 0.41 0.04 0.00 0.00 177.00 175.26 4ayk n GLY 90 N -1.14 3.38 0.08 0.56 0.00 -1.26 -2.03 105.19 104.78 4ayk n GLY 90 Ca 0.07 -0.12 0.11 0.00 0.00 0.00 0.00 46.02 46.08 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 0.76 -1.88 -0.61 3.06 -1.26 -4.74 119.36 114.69 4ayk n ILE 91 Ca 0.00 0.14 -0.41 0.00 -2.50 0.00 0.00 62.75 59.97 4ayk n ILE 91 Cb 0.00 -0.97 -0.02 0.00 0.54 0.00 0.00 39.64 39.19 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 -3.35 2.35 0.00 4.50 0.00 -0.86 -1.36 107.32 108.59 4ayk s GLY 92 Ca 0.07 1.47 0.00 0.00 0.00 0.00 0.00 44.72 46.26 4ayk s GLY 92 CO 0.40 2.38 0.00 0.61 0.00 0.00 0.00 173.10 176.49 4ayk n GLY 93 N 1.87 1.62 3.71 0.20 0.00 -1.04 -4.17 105.19 107.37 4ayk n GLY 93 Ca 0.06 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.66 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 -3.15 6.62 -0.34 1.61 1.11 -0.46 -4.10 116.67 117.96 4ayk s ASP 94 Ca 0.00 2.53 -0.13 0.00 0.18 0.00 0.00 52.55 55.13 4ayk s ASP 94 Cb 0.00 -2.58 -0.02 0.00 1.07 0.00 0.00 42.92 41.39 4ayk s ASP 94 CO 0.00 -0.83 0.25 0.00 1.18 0.00 0.00 175.17 175.77 4ayk s ALA 95 N 1.73 3.51 -0.13 5.23 0.00 0.05 -2.03 121.76 130.12 4ayk s ALA 95 Ca 0.71 -1.35 -0.10 0.00 0.00 0.00 0.00 51.96 51.21 4ayk s ALA 95 Cb -0.41 -2.67 -0.05 0.00 0.00 0.00 0.00 23.12 19.99 4ayk s ALA 95 CO 0.31 -0.96 0.20 -1.01 0.00 0.00 0.00 175.76 174.30 4ayk s HIS 96 N 1.75 3.55 -0.08 0.00 3.76 -1.13 -2.72 115.29 120.41 4ayk s HIS 96 Ca 0.07 0.55 0.04 0.00 -0.15 0.00 0.00 55.06 55.57 4ayk s HIS 96 Cb -0.17 -2.11 -0.01 0.00 1.11 0.00 0.00 32.58 31.39 4ayk s HIS 96 CO 0.11 0.53 -0.20 -0.06 -0.85 0.00 0.00 174.74 174.27 4ayk s PHE 97 N -0.43 2.60 -0.11 1.40 0.40 -1.03 -2.41 117.98 118.40 4ayk s PHE 97 Ca 0.15 -0.62 -0.29 0.00 -0.60 0.00 0.00 56.93 55.56 4ayk s PHE 97 Cb -0.13 -1.68 -0.05 0.00 0.51 0.00 0.00 43.02 41.67 4ayk s PHE 97 CO 0.04 -0.16 1.76 0.34 0.70 0.00 0.00 175.22 177.90 4ayk s ASP 98 N -0.09 6.40 0.00 1.36 -1.08 -0.89 -2.69 116.67 119.68 4ayk s ASP 98 Ca -0.04 2.06 0.25 0.00 -0.52 0.00 0.00 52.55 54.30 4ayk s ASP 98 Cb -0.14 -2.53 0.40 0.00 -1.46 0.00 0.00 42.92 39.19 4ayk s ASP 98 CO 0.04 -1.17 1.38 1.21 0.52 0.00 0.00 175.17 177.14 4ayk n GLU 99 N 7.56 2.08 0.24 4.34 2.13 -0.67 -4.10 120.64 132.22 4ayk n GLU 99 Ca 0.20 -1.62 0.13 0.00 0.66 0.00 0.00 57.16 56.53 4ayk n GLU 99 Cb 0.44 -1.47 0.42 0.00 0.27 0.00 0.00 31.44 31.09 4ayk n GLU 99 CO 0.00 0.00 0.00 -0.44 -0.41 0.00 0.00 177.13 176.28 4ayk h ASP 100 N 3.95 0.00 -2.25 4.31 3.32 -1.88 -3.44 116.42 120.42 4ayk h ASP 100 Ca 0.00 0.00 -0.48 0.00 0.02 0.00 0.00 57.03 56.57 4ayk h ASP 100 Cb 0.86 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.39 4ayk h ASP 100 CO 0.00 0.06 -0.45 -1.61 -1.72 0.00 0.00 179.24 175.53 4ayk s GLU 101 N -3.44 3.37 -0.19 3.56 2.02 -1.26 -5.01 118.70 117.75 4ayk s GLU 101 Ca 0.03 -0.77 -0.23 0.00 0.02 0.00 0.00 54.97 54.03 4ayk s GLU 101 Cb 0.08 -2.86 -0.02 0.00 0.10 0.00 0.00 34.13 31.43 4ayk s GLU 101 CO 0.62 0.44 0.72 0.50 0.02 0.00 0.00 175.26 177.55 4ayk s ARG 102 N -3.85 4.24 0.17 1.61 3.52 -1.26 -5.04 118.95 118.34 4ayk s ARG 102 Ca 0.34 0.79 -0.15 0.00 -0.13 0.00 0.00 55.73 56.57 4ayk s ARG 102 Cb -0.09 -3.58 -0.07 0.00 -1.56 0.00 0.00 34.95 29.65 4ayk s ARG 102 CO 0.28 -0.28 0.59 -1.58 -0.81 0.00 0.00 175.30 173.50 4ayk s TRP 103 N 2.04 3.60 0.30 5.12 0.52 -1.26 -4.56 118.94 124.70 4ayk s TRP 103 Ca 0.33 1.12 0.03 0.00 0.02 0.00 0.00 56.10 57.60 4ayk s TRP 103 Cb -0.16 -2.42 -0.06 0.00 -1.15 0.00 0.00 33.47 29.68 4ayk s TRP 103 CO 0.11 0.40 0.05 0.95 0.02 0.00 0.00 176.95 178.48 4ayk s THR 104 N -1.50 1.05 -0.28 2.01 -4.23 -1.14 -4.79 115.64 106.76 4ayk s THR 104 Ca 0.40 -2.01 0.10 0.00 -1.18 0.00 0.00 61.69 58.99 4ayk s THR 104 Cb -0.15 -2.69 0.50 0.00 1.34 0.00 0.00 72.50 71.50 4ayk s THR 104 CO 0.19 -0.05 1.44 0.59 -0.54 0.00 0.00 174.62 176.26 4ayk n ASN 105 N -0.60 2.53 -0.70 3.99 5.03 -1.26 -3.16 115.26 121.09 4ayk n ASN 105 Ca -0.02 -3.72 0.00 0.00 0.87 0.00 0.00 54.58 51.71 4ayk n ASN 105 Cb 0.66 -0.62 0.00 0.00 -1.02 0.00 0.00 39.78 38.80 4ayk n ASN 105 CO 0.00 0.00 0.00 -0.46 -1.83 0.00 0.00 177.26 174.97 4ayk n ASN 106 N -1.08 0.00 -0.62 6.41 2.04 -1.26 -4.99 115.26 115.75 4ayk n ASN 106 Ca 0.31 -0.70 0.00 0.00 -0.44 0.00 0.00 54.58 53.75 4ayk n ASN 106 Cb 1.00 0.00 0.00 0.00 -2.53 0.00 0.00 39.78 38.25 4ayk n ASN 106 CO 0.00 0.00 0.00 2.22 -0.44 0.00 0.00 177.26 179.04 4ayk n PHE 107 N 0.00 0.00 -0.03 -2.53 -1.74 -1.26 -4.55 117.46 107.35 4ayk n PHE 107 Ca 0.00 -0.07 0.00 0.00 -0.56 0.00 0.00 57.45 56.82 4ayk n PHE 107 Cb 0.00 -0.09 0.00 0.00 1.52 0.00 0.00 39.48 40.91 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 0.34 0.95 0.00 3.97 5.12 -1.26 -4.90 116.66 120.87 4ayk n ARG 108 Ca 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.92 4ayk n ARG 108 Cb 0.17 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.47 4ayk n ARG 108 CO 0.00 0.00 0.00 0.39 -1.93 0.00 0.00 177.63 176.09 4ayk n GLU 109 N -0.05 0.00 -4.21 5.56 4.71 -1.26 -4.64 120.64 120.75 4ayk n GLU 109 Ca 0.00 0.35 -0.20 0.00 -0.01 0.00 0.00 57.16 57.30 4ayk n GLU 109 Cb 0.00 -0.64 -0.12 0.00 -1.01 0.00 0.00 31.44 29.67 4ayk n GLU 109 CO 0.00 0.00 0.00 0.71 0.09 0.00 0.00 177.13 177.93 4ayk s TYR 110 N -1.38 1.39 -0.35 -0.32 2.02 -1.26 -5.07 117.35 112.38 4ayk s TYR 110 Ca 0.00 -0.47 -0.14 0.00 -0.37 0.00 0.00 57.07 56.09 4ayk s TYR 110 Cb 0.00 -0.77 -0.01 0.00 -0.40 0.00 0.00 41.96 40.79 4ayk s TYR 110 CO 0.00 0.11 0.28 -0.80 -1.57 0.00 0.00 175.55 173.58 4ayk s ASN 111 N -1.95 6.10 0.23 2.29 0.01 -1.26 -2.87 114.94 117.49 4ayk s ASN 111 Ca 0.02 -0.46 -0.08 0.00 -0.71 0.00 0.00 52.86 51.63 4ayk s ASN 111 Cb -0.09 -2.16 0.21 0.00 0.41 0.00 0.00 41.25 39.62 4ayk s ASN 111 CO 0.03 -0.30 1.90 0.25 -1.51 0.00 0.00 177.10 177.46 4ayk h LEU 112 N 8.59 1.02 -0.80 0.60 5.85 -1.91 -2.62 115.31 126.04 4ayk h LEU 112 Ca -0.30 -0.04 0.01 0.00 0.84 0.00 0.00 57.88 58.39 4ayk h LEU 112 Cb 1.15 -0.26 -0.04 0.00 0.37 0.00 0.00 40.66 41.88 4ayk h LEU 112 CO 0.67 0.76 0.53 -0.74 -0.34 0.00 0.00 178.44 179.31 4ayk h HIS 113 N 1.20 1.01 -1.00 1.25 2.76 -1.90 -0.52 115.15 117.94 4ayk h HIS 113 Ca 0.32 0.02 0.01 0.00 -2.20 0.00 0.00 60.37 58.53 4ayk h HIS 113 Cb -0.11 -0.34 -0.05 0.00 1.55 0.00 0.00 27.41 28.46 4ayk h HIS 113 CO -0.01 0.63 0.66 -0.09 -1.30 0.00 0.00 177.93 177.82 4ayk h ARG 114 N 1.08 1.30 -0.25 5.26 2.43 -1.88 -1.33 114.38 120.99 4ayk h ARG 114 Ca 0.30 -0.08 -0.19 0.00 -0.81 0.00 0.00 59.98 59.20 4ayk h ARG 114 Cb -0.11 -0.29 0.00 0.00 -0.42 0.00 0.00 29.97 29.15 4ayk h ARG 114 CO -0.07 0.86 -0.59 0.28 -1.51 0.00 0.00 179.97 178.94 4ayk h VAL 115 N 1.34 1.28 -0.97 0.20 2.07 -1.25 -2.68 116.25 116.24 4ayk h VAL 115 Ca 0.37 -1.79 0.00 0.00 0.82 0.00 0.00 66.70 66.10 4ayk h VAL 115 Cb -0.14 1.71 -0.05 0.00 -1.52 0.00 0.00 31.29 31.30 4ayk h VAL 115 CO -0.08 0.58 0.61 0.00 0.02 0.00 0.00 177.57 178.69 4ayk h ALA 116 N 0.70 1.23 -0.80 1.67 0.00 -0.60 -1.27 119.26 120.19 4ayk h ALA 116 Ca 0.00 -0.09 -0.04 0.00 0.00 0.00 0.00 54.91 54.78 4ayk h ALA 116 Cb 1.20 -0.39 -0.04 0.00 0.00 0.00 0.00 17.79 18.56 4ayk h ALA 116 CO 0.13 0.65 0.34 0.00 0.00 0.00 0.00 179.25 180.37 4ayk h ALA 117 N 1.34 1.09 0.00 0.00 0.00 -1.15 -2.04 119.26 118.50 4ayk h ALA 117 Ca 0.35 -0.18 -0.00 0.00 0.00 0.00 0.00 54.91 55.08 4ayk h ALA 117 Cb -0.10 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.37 4ayk h ALA 117 CO -0.07 0.66 -0.00 1.25 0.00 0.00 0.00 179.25 181.09 4ayk h HIS 118 N 1.16 -0.00 -1.01 0.00 6.17 -1.03 -2.57 115.15 117.88 4ayk h HIS 118 Ca 0.27 -0.00 0.04 0.00 0.71 0.00 0.00 60.37 61.39 4ayk h HIS 118 Cb 0.18 0.00 -0.06 0.00 2.52 0.00 0.00 27.41 30.06 4ayk h HIS 118 CO 0.02 0.46 0.66 0.93 0.71 0.00 0.00 177.93 180.70 4ayk h GLU 119 N -0.46 1.23 -0.90 5.26 3.07 -1.20 -1.58 114.58 120.01 4ayk h GLU 119 Ca -0.00 -0.07 -0.02 0.00 -0.50 0.00 0.00 59.36 58.77 4ayk h GLU 119 Cb 0.46 -0.28 -0.04 0.00 -0.84 0.00 0.00 28.75 28.05 4ayk h GLU 119 CO 0.00 0.81 0.48 -0.07 -1.40 0.00 0.00 179.01 178.84 4ayk h LEU 120 N 1.27 1.13 -1.15 1.33 3.38 -1.34 -2.02 115.31 117.91 4ayk h LEU 120 Ca 0.40 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 58.27 4ayk h LEU 120 Cb 0.01 -0.29 -0.04 0.00 0.09 0.00 0.00 40.66 40.43 4ayk h LEU 120 CO -0.13 0.91 0.51 1.23 0.09 0.00 0.00 178.44 181.05 4ayk h GLY 121 N 1.26 1.16 1.27 0.83 0.00 -0.87 -1.26 103.07 105.45 4ayk h GLY 121 Ca 0.31 -0.46 -0.05 0.00 0.00 0.00 0.00 47.33 47.14 4ayk h GLY 121 CO -0.05 0.45 0.18 0.45 0.00 0.00 0.00 176.54 177.56 4ayk h HIS 122 N 1.11 0.95 0.00 5.60 3.86 -0.97 -0.82 115.15 124.88 4ayk h HIS 122 Ca 0.29 -0.08 -0.02 0.00 -1.16 0.00 0.00 60.37 59.40 4ayk h HIS 122 Cb -0.08 -0.28 -0.00 0.00 1.06 0.00 0.00 27.41 28.10 4ayk h HIS 122 CO 0.00 0.77 -0.09 0.66 0.86 0.00 0.00 177.93 180.14 4ayk h SER 123 N 0.89 0.00 0.07 2.45 4.64 -0.81 -1.72 113.55 119.08 4ayk h SER 123 Ca 0.20 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.52 4ayk h SER 123 Cb 0.27 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.36 4ayk h SER 123 CO -0.01 0.09 -0.05 0.18 -0.87 0.00 0.00 176.83 176.17 4ayk n LEU 124 N -3.25 1.11 0.00 5.97 4.77 -0.44 -4.79 117.00 120.37 4ayk n LEU 124 Ca 0.00 -0.34 0.00 0.00 -0.03 0.00 0.00 56.01 55.64 4ayk n LEU 124 Cb 0.33 -0.04 0.00 0.00 -2.33 0.00 0.00 43.42 41.38 4ayk n LEU 124 CO 0.29 0.19 0.00 0.61 -1.33 0.00 0.00 177.39 177.15 4ayk n GLY 125 N 1.19 0.54 3.72 -0.72 0.00 -0.65 -4.92 105.19 104.35 4ayk n GLY 125 Ca 0.18 -0.61 -0.40 0.00 0.00 0.00 0.00 46.02 45.19 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 4.37 0.62 0.99 1.43 -0.48 -5.01 118.68 120.60 4ayk s LEU 126 Ca 0.00 1.36 -0.03 0.00 -1.03 0.00 0.00 54.13 54.43 4ayk s LEU 126 Cb 0.00 -3.23 0.04 0.00 0.03 0.00 0.00 46.19 43.03 4ayk s LEU 126 CO 0.00 -0.11 0.90 -0.44 0.23 0.00 0.00 176.35 176.93 4ayk s SER 127 N 0.60 5.12 0.74 2.29 0.01 -1.26 -4.36 113.70 116.84 4ayk s SER 127 Ca 0.41 0.31 -0.13 0.00 1.31 0.00 0.00 55.95 57.85 4ayk s SER 127 Cb -0.19 -1.11 0.04 0.00 0.21 0.00 0.00 66.02 64.97 4ayk s SER 127 CO 0.22 -1.33 1.12 -1.00 0.41 0.00 0.00 173.24 172.66 4ayk s HIS 128 N -3.01 2.42 0.24 2.43 0.09 -1.26 -4.97 115.29 111.24 4ayk s HIS 128 Ca 0.58 1.59 0.06 0.00 -0.00 0.00 0.00 55.06 57.28 4ayk s HIS 128 Cb -0.11 -3.17 -0.05 0.00 -0.00 0.00 0.00 32.58 29.25 4ayk s HIS 128 CO 0.42 -1.97 -0.06 0.45 -0.00 0.00 0.00 174.74 173.59 4ayk s SER 129 N -2.85 2.37 0.00 1.40 0.15 -1.22 -5.04 113.70 108.51 4ayk s SER 129 Ca 0.65 -1.16 0.20 0.00 0.70 0.00 0.00 55.95 56.34 4ayk s SER 129 Cb -0.20 -0.10 0.53 0.00 -1.71 0.00 0.00 66.02 64.54 4ayk s SER 129 CO 0.50 -0.37 1.45 0.35 1.20 0.00 0.00 173.24 176.36 4ayk n THR 130 N -0.48 0.89 -2.89 6.45 -2.24 -1.26 -4.66 114.28 110.09 4ayk n THR 130 Ca -0.06 -0.95 -0.41 0.00 -2.27 0.00 0.00 64.05 60.36 4ayk n THR 130 Cb 0.63 0.60 -0.04 0.00 -2.10 0.00 0.00 70.33 69.42 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 -1.08 7.09 0.52 3.42 -1.08 -1.26 -4.93 116.67 119.36 4ayk s ASP 131 Ca 0.42 1.32 0.18 0.00 -0.52 0.00 0.00 52.55 53.95 4ayk s ASP 131 Cb 0.22 -2.47 1.29 0.00 -1.46 0.00 0.00 42.92 40.50 4ayk s ASP 131 CO 0.29 -0.27 2.12 -0.29 0.52 0.00 0.00 175.17 177.55 4ayk h ILE 132 N 4.93 0.95 -0.01 4.11 2.10 -2.02 0.40 117.51 127.97 4ayk h ILE 132 Ca -0.37 -0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.57 4ayk h ILE 132 Cb 1.18 0.95 0.00 0.00 -1.09 0.00 0.00 36.82 37.86 4ayk h ILE 132 CO 0.79 0.00 0.00 0.61 -1.08 0.00 0.00 178.15 178.47 4ayk n GLY 133 N -1.56 -0.76 3.74 8.18 0.00 -1.26 -4.82 105.19 108.71 4ayk n GLY 133 Ca -0.01 -0.24 -0.40 0.00 0.00 0.00 0.00 46.02 45.37 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 -1.99 3.32 0.29 4.61 0.00 0.13 -4.42 121.76 123.69 4ayk s ALA 134 Ca 0.43 0.35 0.15 0.00 0.00 0.00 0.00 51.96 52.89 4ayk s ALA 134 Cb 0.20 -3.08 0.65 0.00 0.00 0.00 0.00 23.12 20.90 4ayk s ALA 134 CO 0.34 0.01 1.75 -0.07 0.00 0.00 0.00 175.76 177.79 4ayk h LEU 135 N 5.84 0.00 -4.51 0.00 3.38 -1.87 -3.27 115.31 114.88 4ayk h LEU 135 Ca -0.43 0.00 -0.24 0.00 0.09 0.00 0.00 57.88 57.30 4ayk h LEU 135 Cb 1.21 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.92 4ayk h LEU 135 CO 0.72 0.43 0.71 0.23 0.09 0.00 0.00 178.44 180.62 4ayk n MET 136 N -3.81 1.84 -2.23 1.13 2.81 -1.26 -4.83 117.12 110.77 4ayk n MET 136 Ca -0.01 -1.02 -0.42 0.00 -1.81 0.00 0.00 57.70 54.44 4ayk n MET 136 Cb 0.49 -2.07 -0.03 0.00 -0.71 0.00 0.00 33.22 30.90 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 1.86 3.19 0.03 2.03 6.14 -1.24 -3.40 117.35 125.98 4ayk s TYR 137 Ca 0.51 0.98 -0.10 0.00 0.64 0.00 0.00 57.07 59.10 4ayk s TYR 137 Cb 0.21 -3.63 -0.04 0.00 0.42 0.00 0.00 41.96 38.92 4ayk s TYR 137 CO -0.01 -2.20 1.17 -1.35 0.64 0.00 0.00 175.55 173.79 4ayk h PRO 138 N 7.03 -0.18 -7.21 4.97 0.11 -1.90 -3.42 132.00 131.39 4ayk h PRO 138 Ca -0.41 0.01 -0.46 0.00 0.11 0.00 0.00 66.00 65.25 4ayk h PRO 138 Cb 1.20 0.04 0.09 0.00 0.11 0.00 0.00 31.00 32.44 4ayk h PRO 138 CO 0.86 -0.12 0.15 -1.12 -0.21 0.00 0.00 178.00 177.57 4ayk s SER 139 N -3.24 4.30 -0.09 -2.05 0.01 -1.26 -5.04 113.70 106.33 4ayk s SER 139 Ca -0.05 -0.16 -0.24 0.00 1.31 0.00 0.00 55.95 56.81 4ayk s SER 139 Cb 0.02 -0.25 -0.03 0.00 0.21 0.00 0.00 66.02 65.97 4ayk s SER 139 CO 0.18 -1.90 0.74 -0.47 0.41 0.00 0.00 173.24 172.21 4ayk s TYR 140 N -3.23 3.54 0.13 2.43 6.14 -1.26 -5.04 117.35 120.06 4ayk s TYR 140 Ca 0.66 1.26 -0.11 0.00 0.64 0.00 0.00 57.07 59.52 4ayk s TYR 140 Cb -0.06 -2.87 0.01 0.00 0.42 0.00 0.00 41.96 39.46 4ayk s TYR 140 CO 0.45 -0.00 0.30 0.95 0.64 0.00 0.00 175.55 177.89 4ayk s THR 141 N 1.15 0.09 -0.09 4.34 -4.23 -1.26 -5.13 115.64 110.52 4ayk s THR 141 Ca 0.38 -1.04 -0.30 0.00 -1.18 0.00 0.00 61.69 59.56 4ayk s THR 141 Cb -0.18 -1.45 -0.02 0.00 1.34 0.00 0.00 72.50 72.20 4ayk s THR 141 CO 0.17 -0.42 1.04 -0.36 -0.54 0.00 0.00 174.62 174.52 4ayk s PHE 142 N -3.88 3.46 -0.68 3.99 0.40 -1.26 -4.90 117.98 115.11 4ayk s PHE 142 Ca 0.08 1.53 0.12 0.00 -0.60 0.00 0.00 56.93 58.05 4ayk s PHE 142 Cb 0.03 -3.23 0.35 0.00 0.51 0.00 0.00 43.02 40.68 4ayk s PHE 142 CO -0.08 -0.42 1.28 -1.13 0.70 0.00 0.00 175.22 175.57 4ayk n SER 143 N 5.01 3.11 0.00 1.36 3.41 -1.26 -5.07 113.62 120.17 4ayk n SER 143 Ca 0.09 -2.26 0.00 0.00 -0.26 0.00 0.00 58.87 56.44 4ayk n SER 143 Cb 0.48 -0.30 0.00 0.00 -0.26 0.00 0.00 64.21 64.13 4ayk n SER 143 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 4ayk n GLY 144 N 0.18 1.69 3.80 5.00 0.00 -1.26 -4.76 105.19 109.84 4ayk n GLY 144 Ca 0.13 -0.48 -0.35 0.00 0.00 0.00 0.00 46.02 45.32 4ayk n GLY 144 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 4ayk s ASP 145 N -4.00 7.18 -0.51 1.61 1.01 -1.26 -4.99 116.67 115.71 4ayk s ASP 145 Ca 0.00 1.78 -0.25 0.00 0.71 0.00 0.00 52.55 54.79 4ayk s ASP 145 Cb 0.00 -2.56 0.03 0.00 1.01 0.00 0.00 42.92 41.40 4ayk s ASP 145 CO 0.00 -0.18 0.94 -0.69 0.21 0.00 0.00 175.17 175.45 4ayk s VAL 146 N -1.84 4.42 0.08 -1.27 1.01 -1.26 -5.00 120.40 116.54 4ayk s VAL 146 Ca 0.55 0.49 -0.07 0.00 0.00 0.00 0.00 61.98 62.95 4ayk s VAL 146 Cb -0.15 -4.50 -0.01 0.00 0.00 0.00 0.00 36.38 31.73 4ayk s VAL 146 CO 0.20 -0.99 0.15 -1.10 0.00 0.00 0.00 175.10 173.35 4ayk s GLN 147 N 3.88 0.79 0.32 2.72 -0.21 -1.26 -5.14 119.66 120.76 4ayk s GLN 147 Ca 0.33 -1.01 -0.27 0.00 0.02 0.00 0.00 55.36 54.43 4ayk s GLN 147 Cb -0.11 0.31 -0.09 0.00 1.00 0.00 0.00 33.01 34.12 4ayk s GLN 147 CO 0.22 -0.23 1.05 -0.51 -2.12 0.00 0.00 175.29 173.70 4ayk s LEU 148 N -2.86 4.41 0.42 2.90 1.43 -1.26 -4.72 118.68 119.00 4ayk s LEU 148 Ca 0.05 2.13 0.03 0.00 -1.03 0.00 0.00 54.13 55.31 4ayk s LEU 148 Cb 0.05 -3.84 0.00 0.00 0.03 0.00 0.00 46.19 42.44 4ayk s LEU 148 CO -0.11 -0.22 0.61 0.00 0.23 0.00 0.00 176.35 176.86 4ayk s ALA 149 N -1.36 3.98 0.27 4.21 0.00 -1.26 -4.93 121.76 122.67 4ayk s ALA 149 Ca 0.49 -1.26 -0.04 0.00 0.00 0.00 0.00 51.96 51.15 4ayk s ALA 149 Cb -0.27 -1.95 0.35 0.00 0.00 0.00 0.00 23.12 21.25 4ayk s ALA 149 CO 0.34 -0.30 1.90 0.37 0.00 0.00 0.00 175.76 178.07 4ayk h GLN 150 N 0.54 1.10 -0.95 0.00 4.15 -1.96 -0.25 115.11 117.74 4ayk h GLN 150 Ca -0.45 -0.11 0.04 0.00 0.77 0.00 0.00 58.65 58.89 4ayk h GLN 150 Cb 1.26 -0.22 -0.06 0.00 0.21 0.00 0.00 27.48 28.67 4ayk h GLN 150 CO 0.54 0.80 0.62 0.22 -1.93 0.00 0.00 178.83 179.08 4ayk h ASP 151 N 1.12 1.03 -0.03 -0.69 1.82 -1.97 0.28 116.42 117.97 4ayk h ASP 151 Ca 0.29 -0.01 -0.23 0.00 -0.39 0.00 0.00 57.03 56.68 4ayk h ASP 151 Cb 0.00 -0.23 0.02 0.00 0.68 0.00 0.00 39.33 39.80 4ayk h ASP 151 CO -0.05 0.70 -0.88 0.44 -1.61 0.00 0.00 179.24 177.84 4ayk h ASP 152 N 1.20 0.84 0.23 2.28 3.32 -1.74 -0.52 116.42 122.02 4ayk h ASP 152 Ca 0.38 -0.72 -0.01 0.00 0.02 0.00 0.00 57.03 56.70 4ayk h ASP 152 Cb 0.00 -0.25 0.00 0.00 0.22 0.00 0.00 39.33 39.30 4ayk h ASP 152 CO -0.12 1.44 -0.11 0.40 -1.72 0.00 0.00 179.24 179.13 4ayk h ILE 153 N 0.32 0.84 -0.77 0.35 2.04 -0.62 -1.97 117.51 117.70 4ayk h ILE 153 Ca -0.10 -0.59 -0.06 0.00 1.00 0.00 0.00 64.86 65.11 4ayk h ILE 153 Cb 1.54 1.17 -0.03 0.00 -0.74 0.00 0.00 36.82 38.76 4ayk h ILE 153 CO 0.18 0.13 0.26 0.44 0.00 0.00 0.00 178.15 179.15 4ayk h ASP 154 N -0.62 1.10 0.50 1.72 3.32 -0.57 -1.40 116.42 120.47 4ayk h ASP 154 Ca -0.03 -0.20 -0.02 0.00 0.02 0.00 0.00 57.03 56.80 4ayk h ASP 154 Cb 0.44 -0.29 -0.01 0.00 0.22 0.00 0.00 39.33 39.70 4ayk h ASP 154 CO 0.05 1.00 -0.34 1.23 -1.72 0.00 0.00 179.24 179.47 4ayk h GLY 155 N 1.14 -1.03 1.02 2.75 0.00 -1.02 0.72 103.07 106.64 4ayk h GLY 155 Ca 0.25 0.44 -0.00 0.00 0.00 0.00 0.00 47.33 48.02 4ayk h GLY 155 CO -0.01 -0.34 0.57 1.19 0.00 0.00 0.00 176.54 177.95 4ayk h ILE 156 N -0.80 1.25 -0.71 2.60 6.09 -1.38 -2.04 117.51 122.52 4ayk h ILE 156 Ca -0.07 -0.51 -0.07 0.00 -1.37 0.00 0.00 64.86 62.85 4ayk h ILE 156 Cb 0.65 -0.07 -0.03 0.00 0.47 0.00 0.00 36.82 37.84 4ayk h ILE 156 CO 0.05 0.25 0.19 1.56 -3.07 0.00 0.00 178.15 177.12 4ayk h GLN 157 N 1.26 1.13 -0.78 2.19 4.20 -1.10 -2.58 115.11 119.42 4ayk h GLN 157 Ca 0.33 -0.26 0.01 0.00 0.06 0.00 0.00 58.65 58.79 4ayk h GLN 157 Cb -0.08 -0.15 -0.04 0.00 0.30 0.00 0.00 27.48 27.50 4ayk h GLN 157 CO -0.07 0.98 0.52 0.00 -0.67 0.00 0.00 178.83 179.59 4ayk h ALA 158 N 1.12 1.00 0.01 3.87 0.00 0.11 2.98 119.26 128.35 4ayk h ALA 158 Ca 0.23 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 55.08 4ayk h ALA 158 Cb 0.35 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.83 4ayk h ALA 158 CO -0.00 0.40 -0.01 0.82 0.00 0.00 0.00 179.25 180.46 4ayk h ILE 159 N 1.05 0.99 0.00 0.00 2.04 -1.05 -3.38 117.51 117.16 4ayk h ILE 159 Ca 0.29 -0.01 0.00 0.00 1.00 0.00 0.00 64.86 66.14 4ayk h ILE 159 Cb -0.11 1.00 0.00 0.00 -0.74 0.00 0.00 36.82 36.97 4ayk h ILE 159 CO -0.07 0.00 -0.20 -1.22 0.00 0.00 0.00 178.15 176.67 4ayk n TYR 160 N -5.09 0.05 0.00 1.37 4.01 -0.98 -5.13 117.16 111.38 4ayk n TYR 160 Ca -0.07 0.02 0.00 0.00 -0.16 0.00 0.00 57.90 57.69 4ayk n TYR 160 Cb 0.04 -0.18 0.00 0.00 -0.31 0.00 0.00 39.34 38.89 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 1.55 -0.42 3.84 2.72 0.00 0.99 -5.04 105.19 108.83 4ayk n GLY 161 Ca -0.03 -1.21 -0.33 0.00 0.00 0.00 0.00 46.02 44.45 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 -2.00 4.03 -1.08 1.61 0.52 -1.26 -4.43 118.95 116.35 4ayk s ARG 162 Ca 0.00 0.67 -0.23 0.00 -0.52 0.00 0.00 55.73 55.66 4ayk s ARG 162 Cb 0.00 -2.52 -0.03 0.00 0.52 0.00 0.00 34.95 32.92 4ayk s ARG 162 CO 0.00 0.21 1.84 -1.12 0.02 0.00 0.00 175.30 176.25 4ayk s SER 163 N -2.17 5.55 -0.67 0.23 0.01 -1.26 -4.81 113.70 110.58 4ayk s SER 163 Ca 0.52 -1.40 -0.07 0.00 1.31 0.00 0.00 55.95 56.30 4ayk s SER 163 Cb -0.11 -2.57 -0.17 0.00 0.21 0.00 0.00 66.02 63.37 4ayk s SER 163 CO 0.18 -2.46 3.10 0.00 0.41 0.00 0.00 173.24 174.47 4ayk n GLN 164 N 8.59 2.53 -2.96 12.44 6.02 -1.26 -4.41 117.38 138.32 4ayk n GLN 164 Ca 0.42 -1.43 -0.14 0.00 -0.01 0.00 0.00 57.00 55.84 4ayk n GLN 164 Cb 0.47 -2.31 -0.01 0.00 1.02 0.00 0.00 30.24 29.41 4ayk n GLN 164 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 4ayk n ASN 165 N 3.07 -1.83 -1.28 1.08 3.02 -1.26 -4.99 115.26 113.07 4ayk n ASN 165 Ca 0.54 -2.93 -0.00 0.00 -0.03 0.00 0.00 54.58 52.16 4ayk n ASN 165 Cb 0.55 0.81 0.00 0.00 -0.61 0.00 0.00 39.78 40.53 4ayk n ASN 165 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 4ayk n PRO 166 N 2.01 1.02 -3.14 3.52 -0.04 -1.26 -4.85 135.00 132.26 4ayk n PRO 166 Ca 0.17 -0.05 -0.40 0.00 -0.04 0.00 0.00 63.50 63.18 4ayk n PRO 166 Cb 0.57 -1.02 -0.06 0.00 -0.04 0.00 0.00 33.50 32.95 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 -0.06 5.01 0.41 0.52 1.01 -1.26 -5.05 120.40 120.98 4ayk s VAL 167 Ca 0.01 1.10 -0.23 0.00 0.00 0.00 0.00 61.98 62.86 4ayk s VAL 167 Cb 0.01 -3.92 -0.09 0.00 0.00 0.00 0.00 36.38 32.38 4ayk s VAL 167 CO 0.00 0.06 1.03 -1.10 0.00 0.00 0.00 175.10 175.09 4ayk s GLN 168 N 2.29 4.13 0.00 2.72 -0.21 -1.26 -5.27 119.66 122.06 4ayk s GLN 168 Ca 0.26 1.42 0.00 0.00 0.02 0.00 0.00 55.36 57.06 4ayk s GLN 168 Cb -0.16 -2.43 0.00 0.00 1.00 0.00 0.00 33.01 31.43 4ayk s GLN 168 CO 0.09 -0.15 0.19 -2.30 -2.12 0.00 0.00 175.29 171.00