#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 0.90 -9.70 7.52 -0.00 -2.00 -3.42 115.31 108.60 4ayk h LEU 2 Ca 0.00 -0.14 -0.65 0.00 -0.00 0.00 0.00 57.88 57.08 4ayk h LEU 2 Cb 0.00 -0.23 -0.07 0.00 -0.00 0.00 0.00 40.66 40.36 4ayk h LEU 2 CO 0.00 0.79 -0.50 0.42 -0.00 0.00 0.00 178.44 179.16 4ayk s THR 3 N -5.66 5.39 -0.86 0.22 -4.23 -1.26 -5.03 115.64 104.20 4ayk s THR 3 Ca -0.13 -0.02 -0.25 0.00 -1.18 0.00 0.00 61.69 60.11 4ayk s THR 3 Cb 0.14 -3.43 0.04 0.00 1.34 0.00 0.00 72.50 70.59 4ayk s THR 3 CO 0.80 0.46 1.34 -0.70 -0.54 0.00 0.00 174.62 175.99 4ayk s GLU 4 N -1.50 3.37 -0.70 3.99 2.56 -1.26 -3.78 118.70 121.37 4ayk s GLU 4 Ca 0.21 -0.66 0.00 0.00 0.00 0.00 0.00 54.97 54.53 4ayk s GLU 4 Cb -0.12 -4.70 0.00 0.00 2.00 0.00 0.00 34.13 31.31 4ayk s GLU 4 CO 0.12 -2.16 0.00 0.41 -0.56 0.00 0.00 175.26 173.07 4ayk n GLY 5 N 6.02 0.63 2.59 -1.50 0.00 -1.26 -4.95 105.19 106.72 4ayk n GLY 5 Ca 0.16 -0.68 -0.12 0.00 0.00 0.00 0.00 46.02 45.37 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 0.78 -2.01 -4.72 1.61 4.13 -1.25 -5.14 115.26 108.67 4ayk n ASN 6 Ca -0.08 -3.16 -0.36 0.00 1.68 0.00 0.00 54.58 52.67 4ayk n ASN 6 Cb 0.35 1.15 0.09 0.00 -1.54 0.00 0.00 39.78 39.82 4ayk n ASN 6 CO 0.00 0.00 0.00 -2.84 0.28 0.00 0.00 177.26 174.70 4ayk s PRO 7 N 0.13 2.21 0.02 3.52 0.02 -1.26 -4.61 135.00 135.03 4ayk s PRO 7 Ca 0.33 1.96 -0.04 0.00 0.02 0.00 0.00 61.00 63.27 4ayk s PRO 7 Cb 0.22 -1.82 -0.01 0.00 0.02 0.00 0.00 34.50 32.91 4ayk s PRO 7 CO -0.20 -1.83 0.06 1.03 -0.33 0.00 0.00 177.00 175.72 4ayk s ARG 8 N -3.65 0.43 -0.09 5.54 0.52 -1.26 -4.78 118.95 115.65 4ayk s ARG 8 Ca 0.79 -0.55 -0.29 0.00 -0.52 0.00 0.00 55.73 55.16 4ayk s ARG 8 Cb -0.35 0.17 -0.02 0.00 0.52 0.00 0.00 34.95 35.27 4ayk s ARG 8 CO 0.44 -0.09 0.99 -1.58 0.02 0.00 0.00 175.30 175.07 4ayk s TRP 9 N -1.63 3.54 -1.00 -0.53 0.52 -1.26 -4.90 118.94 113.69 4ayk s TRP 9 Ca -0.14 1.60 0.28 0.00 0.02 0.00 0.00 56.10 57.86 4ayk s TRP 9 Cb -0.08 -3.16 1.02 0.00 -1.15 0.00 0.00 33.47 30.11 4ayk s TRP 9 CO -0.01 -0.18 1.78 0.39 0.02 0.00 0.00 176.95 178.96 4ayk n GLU 10 N 4.77 0.00 -2.79 4.98 1.02 -1.26 -4.84 120.64 122.52 4ayk n GLU 10 Ca 0.08 0.00 -0.33 0.00 -0.02 0.00 0.00 57.16 56.89 4ayk n GLU 10 Cb 0.49 -1.50 -0.07 0.00 -0.02 0.00 0.00 31.44 30.34 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 4.19 0.00 3.49 -1.52 -1.26 -4.94 119.66 116.62 4ayk s GLN 11 Ca 0.13 1.14 0.24 0.00 -1.95 0.00 0.00 55.36 54.92 4ayk s GLN 11 Cb 0.18 -2.17 0.29 0.00 -0.22 0.00 0.00 33.01 31.09 4ayk s GLN 11 CO 0.58 -0.07 1.28 0.25 -0.25 0.00 0.00 175.29 177.08 4ayk n THR 12 N -0.69 0.00 -4.61 -0.19 -2.24 -1.26 -4.85 114.28 100.44 4ayk n THR 12 Ca 0.07 -0.25 -0.22 0.00 -2.27 0.00 0.00 64.05 61.38 4ayk n THR 12 Cb 0.54 1.01 -0.15 0.00 -2.10 0.00 0.00 70.33 69.62 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 1.24 0.14 4.78 3.76 -1.26 -2.77 115.29 118.77 4ayk s HIS 13 Ca 0.22 -0.26 0.04 0.00 -0.15 0.00 0.00 55.06 54.91 4ayk s HIS 13 Cb 0.19 -0.82 -0.04 0.00 1.11 0.00 0.00 32.58 33.02 4ayk s HIS 13 CO 0.51 -0.05 -0.09 -0.51 -0.85 0.00 0.00 174.74 173.75 4ayk s LEU 14 N -0.19 2.53 0.14 0.89 1.43 -0.50 -4.96 118.68 118.01 4ayk s LEU 14 Ca 0.03 -1.01 0.08 0.00 -1.03 0.00 0.00 54.13 52.19 4ayk s LEU 14 Cb -0.07 -0.29 -0.04 0.00 0.03 0.00 0.00 46.19 45.83 4ayk s LEU 14 CO -0.00 -0.36 -0.18 0.42 0.23 0.00 0.00 176.35 176.47 4ayk s THR 15 N -3.38 1.67 0.05 5.49 -4.23 -1.26 -2.09 115.64 111.88 4ayk s THR 15 Ca 0.16 -1.79 -0.05 0.00 -1.18 0.00 0.00 61.69 58.82 4ayk s THR 15 Cb 0.03 -1.70 -0.01 0.00 1.34 0.00 0.00 72.50 72.15 4ayk s THR 15 CO -0.01 -0.29 0.09 -0.72 -0.54 0.00 0.00 174.62 173.15 4ayk s TYR 16 N -1.90 0.24 -0.14 3.99 1.13 -1.05 -2.16 117.35 117.47 4ayk s TYR 16 Ca 0.12 -0.60 -0.09 0.00 -1.41 0.00 0.00 57.07 55.09 4ayk s TYR 16 Cb -0.06 -0.17 0.05 0.00 -1.10 0.00 0.00 41.96 40.68 4ayk s TYR 16 CO 0.05 -0.39 0.35 0.50 -2.51 0.00 0.00 175.55 173.55 4ayk s ARG 17 N -2.94 0.34 -0.24 -3.49 3.52 -1.10 -2.36 118.95 112.68 4ayk s ARG 17 Ca -0.02 0.64 -0.21 0.00 -0.13 0.00 0.00 55.73 56.01 4ayk s ARG 17 Cb 0.01 -0.00 -0.02 0.00 -1.56 0.00 0.00 34.95 33.37 4ayk s ARG 17 CO -0.06 -0.14 0.64 0.42 -0.81 0.00 0.00 175.30 175.35 4ayk s ILE 18 N 1.09 4.99 0.20 4.11 1.01 -1.26 -2.53 121.20 128.81 4ayk s ILE 18 Ca -0.07 1.17 -0.08 0.00 0.00 0.00 0.00 60.65 61.67 4ayk s ILE 18 Cb -0.08 -3.95 0.11 0.00 0.01 0.00 0.00 42.46 38.56 4ayk s ILE 18 CO -0.09 0.05 1.71 -0.33 0.00 0.00 0.00 174.94 176.28 4ayk h GLU 19 N 7.76 1.10 -2.54 2.79 5.08 -1.68 -3.46 114.58 123.63 4ayk h GLU 19 Ca -0.28 -0.28 -0.01 0.00 -1.00 0.00 0.00 59.36 57.79 4ayk h GLU 19 Cb 1.13 -0.14 -0.15 0.00 0.50 0.00 0.00 28.75 30.09 4ayk h GLU 19 CO 0.78 0.99 0.27 0.54 -1.00 0.00 0.00 179.01 180.59 4ayk s ASN 20 N -6.50 -0.55 -0.11 1.42 4.22 -1.26 -5.11 114.94 107.04 4ayk s ASN 20 Ca -0.12 0.22 -0.06 0.00 -2.14 0.00 0.00 52.86 50.77 4ayk s ASN 20 Cb 0.15 0.54 -0.04 0.00 1.28 0.00 0.00 41.25 43.17 4ayk s ASN 20 CO 0.85 -0.79 0.10 -0.31 -2.04 0.00 0.00 177.10 174.91 4ayk s TYR 21 N -2.81 3.46 0.41 1.54 2.02 -1.26 -4.70 117.35 116.01 4ayk s TYR 21 Ca -0.02 0.42 -0.24 0.00 -0.37 0.00 0.00 57.07 56.86 4ayk s TYR 21 Cb -0.01 -1.91 -0.09 0.00 -0.40 0.00 0.00 41.96 39.56 4ayk s TYR 21 CO -0.05 0.64 1.08 -0.08 -1.57 0.00 0.00 175.55 175.56 4ayk s THR 22 N -0.91 3.58 -0.77 -0.71 -1.32 -1.26 -4.91 115.64 109.33 4ayk s THR 22 Ca 0.14 1.22 0.16 0.00 -1.21 0.00 0.00 61.69 62.00 4ayk s THR 22 Cb -0.12 -3.64 0.15 0.00 -1.51 0.00 0.00 72.50 67.38 4ayk s THR 22 CO 0.03 0.02 1.48 -0.81 -2.21 0.00 0.00 174.62 173.13 4ayk n PRO 23 N -0.10 0.07 -0.38 7.08 -0.04 -1.26 -2.91 135.00 137.46 4ayk n PRO 23 Ca 0.05 0.37 -0.02 0.00 -0.04 0.00 0.00 63.50 63.87 4ayk n PRO 23 Cb 0.49 -1.65 0.11 0.00 -0.04 0.00 0.00 33.50 32.41 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 -4.96 3.54 3.32 -1.95 -3.44 116.42 114.10 4ayk h ASP 24 Ca 0.00 -0.03 -0.19 0.00 0.02 0.00 0.00 57.03 56.83 4ayk h ASP 24 Cb 0.22 -0.29 -0.20 0.00 0.22 0.00 0.00 39.33 39.28 4ayk h ASP 24 CO 0.00 0.84 -0.70 -0.76 -1.72 0.00 0.00 179.24 176.90 4ayk s LEU 25 N -10.11 2.28 0.00 1.55 1.43 -1.15 -4.93 118.68 107.76 4ayk s LEU 25 Ca -0.13 -0.59 -0.13 0.00 -1.03 0.00 0.00 54.13 52.25 4ayk s LEU 25 Cb 0.18 0.05 0.19 0.00 0.03 0.00 0.00 46.19 46.65 4ayk s LEU 25 CO 0.82 -0.32 0.50 -0.81 0.23 0.00 0.00 176.35 176.77 4ayk n PRO 26 N 1.33 -3.15 0.00 1.29 -0.04 -1.26 -4.55 135.00 128.62 4ayk n PRO 26 Ca -0.22 -0.83 -0.20 0.00 -0.04 0.00 0.00 63.50 62.21 4ayk n PRO 26 Cb 0.56 -0.98 -0.14 0.00 -0.04 0.00 0.00 33.50 32.90 4ayk n PRO 26 CO 0.00 0.00 0.00 2.89 -0.04 0.00 0.00 175.50 178.35 4ayk n ARG 27 N -3.83 0.75 -0.19 0.54 1.85 -1.26 -3.25 116.66 111.27 4ayk n ARG 27 Ca 0.08 0.26 -0.04 0.00 -1.00 0.00 0.00 57.85 57.15 4ayk n ARG 27 Cb 0.32 -1.72 0.06 0.00 -1.05 0.00 0.00 32.46 30.07 4ayk n ARG 27 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 4ayk h ALA 28 N 0.18 0.72 -0.37 2.89 0.00 -1.99 0.61 119.26 121.30 4ayk h ALA 28 Ca -0.41 0.01 -0.15 0.00 0.00 0.00 0.00 54.91 54.36 4ayk h ALA 28 Cb 2.03 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 19.71 4ayk h ALA 28 CO 0.09 -0.03 -0.37 -0.44 0.00 0.00 0.00 179.25 178.50 4ayk h ASP 29 N 0.58 0.93 -0.30 0.00 3.32 -1.96 -2.24 116.42 116.75 4ayk h ASP 29 Ca 0.24 -0.41 -0.13 0.00 0.02 0.00 0.00 57.03 56.74 4ayk h ASP 29 Cb 0.12 -0.26 -0.00 0.00 0.22 0.00 0.00 39.33 39.41 4ayk h ASP 29 CO -0.15 1.19 -0.33 0.58 -1.72 0.00 0.00 179.24 178.82 4ayk h VAL 30 N 0.72 1.30 -0.96 -1.35 2.07 -1.36 -2.53 116.25 114.13 4ayk h VAL 30 Ca 0.06 -1.50 0.02 0.00 0.82 0.00 0.00 66.70 66.11 4ayk h VAL 30 Cb 0.95 1.56 -0.05 0.00 -1.52 0.00 0.00 31.29 32.23 4ayk h VAL 30 CO 0.09 0.48 0.63 -0.78 0.02 0.00 0.00 177.57 178.02 4ayk h ASP 31 N 0.51 1.08 -0.37 0.57 1.82 0.26 -0.68 116.42 119.60 4ayk h ASP 31 Ca 0.04 -0.02 0.00 0.00 -0.39 0.00 0.00 57.03 56.67 4ayk h ASP 31 Cb 0.90 -0.26 -0.02 0.00 0.68 0.00 0.00 39.33 40.64 4ayk h ASP 31 CO 0.08 0.76 0.24 -0.74 -1.61 0.00 0.00 179.24 177.97 4ayk h HIS 32 N 1.26 0.46 -0.60 0.28 2.76 -1.23 0.71 115.15 118.80 4ayk h HIS 32 Ca 0.37 0.01 -0.01 0.00 -2.20 0.00 0.00 60.37 58.54 4ayk h HIS 32 Cb -0.07 -0.16 -0.03 0.00 1.55 0.00 0.00 27.41 28.70 4ayk h HIS 32 CO -0.01 0.29 0.34 0.00 -1.30 0.00 0.00 177.93 177.26 4ayk h ALA 33 N 1.13 0.76 -0.35 5.26 0.00 -0.94 0.21 119.26 125.34 4ayk h ALA 33 Ca 0.13 -0.09 -0.16 0.00 0.00 0.00 0.00 54.91 54.80 4ayk h ALA 33 Cb -0.06 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.49 4ayk h ALA 33 CO -0.03 0.26 -0.42 0.82 0.00 0.00 0.00 179.25 179.89 4ayk h ILE 34 N 0.81 1.28 -0.50 0.00 1.08 -0.65 -2.89 117.51 116.63 4ayk h ILE 34 Ca 0.21 -1.59 -0.09 0.00 -0.39 0.00 0.00 64.86 63.00 4ayk h ILE 34 Cb 0.01 1.45 -0.02 0.00 -3.07 0.00 0.00 36.82 35.19 4ayk h ILE 34 CO -0.04 0.53 -0.03 -0.08 -0.69 0.00 0.00 178.15 177.84 4ayk h GLU 35 N 0.71 0.91 -0.90 2.37 4.81 0.77 -2.88 114.58 120.36 4ayk h GLU 35 Ca 0.05 -0.31 -0.00 0.00 -0.13 0.00 0.00 59.36 58.97 4ayk h GLU 35 Cb 1.00 -0.07 -0.04 0.00 0.63 0.00 0.00 28.75 30.26 4ayk h GLU 35 CO 0.10 0.95 0.56 0.87 -0.73 0.00 0.00 179.01 180.76 4ayk h LYS 36 N 0.77 1.22 -0.25 1.92 1.57 -0.93 -1.04 116.57 119.83 4ayk h LYS 36 Ca 0.14 -0.10 0.00 0.00 -1.87 0.00 0.00 60.65 58.82 4ayk h LYS 36 Cb 0.56 -0.26 -0.01 0.00 0.08 0.00 0.00 32.23 32.60 4ayk h LYS 36 CO 0.03 0.85 0.16 0.00 -0.57 0.00 0.00 179.45 179.92 4ayk h ALA 37 N 1.30 0.32 -0.82 3.86 0.00 -1.35 -0.43 119.26 122.13 4ayk h ALA 37 Ca 0.33 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 55.18 4ayk h ALA 37 Cb -0.07 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 17.58 4ayk h ALA 37 CO -0.06 -0.20 0.41 0.74 0.00 0.00 0.00 179.25 180.14 4ayk h PHE 38 N 0.34 1.18 -0.65 0.00 0.04 -1.26 -2.51 116.94 114.08 4ayk h PHE 38 Ca 0.09 -0.05 -0.00 0.00 2.80 0.00 0.00 57.97 60.81 4ayk h PHE 38 Cb -0.03 -0.37 -0.03 0.00 2.20 0.00 0.00 35.95 37.72 4ayk h PHE 38 CO -0.06 0.85 0.41 1.96 -0.60 0.00 0.00 178.31 180.87 4ayk h GLN 39 N 1.17 0.88 -0.74 1.51 4.20 -0.63 -0.97 115.11 120.53 4ayk h GLN 39 Ca 0.28 -0.07 0.01 0.00 0.06 0.00 0.00 58.65 58.94 4ayk h GLN 39 Cb 0.10 -0.19 -0.04 0.00 0.30 0.00 0.00 27.48 27.65 4ayk h GLN 39 CO -0.04 0.61 0.48 -0.07 -0.67 0.00 0.00 178.83 179.15 4ayk h LEU 40 N 0.89 0.83 -0.33 1.46 3.38 -0.67 0.27 115.31 121.14 4ayk h LEU 40 Ca 0.24 -0.02 -0.16 0.00 0.09 0.00 0.00 57.88 58.02 4ayk h LEU 40 Cb -0.05 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 40.49 4ayk h LEU 40 CO -0.05 0.60 -0.43 -0.50 0.09 0.00 0.00 178.44 178.15 4ayk h TRP 41 N 0.98 1.07 -0.09 1.13 4.06 -1.18 -3.12 115.95 118.80 4ayk h TRP 41 Ca 0.27 -0.35 -0.12 0.00 2.06 0.00 0.00 58.89 60.76 4ayk h TRP 41 Cb -0.09 -0.22 -0.01 0.00 -1.00 0.00 0.00 29.16 27.84 4ayk h TRP 41 CO -0.02 1.17 -0.46 1.03 -3.56 0.00 0.00 178.44 176.59 4ayk h SER 42 N 0.67 0.24 -0.47 -3.49 0.87 -0.81 -2.97 113.55 107.59 4ayk h SER 42 Ca 0.04 -0.11 0.06 0.00 -1.23 0.00 0.00 61.79 60.54 4ayk h SER 42 Cb 1.03 -0.07 -0.03 0.00 -0.44 0.00 0.00 62.40 62.90 4ayk h SER 42 CO 0.10 0.68 0.32 0.78 -0.53 0.00 0.00 176.83 178.18 4ayk h ASN 43 N 0.19 0.36 -0.53 6.23 2.35 -0.41 -1.84 115.58 121.92 4ayk h ASN 43 Ca 0.01 -0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.76 4ayk h ASN 43 Cb 0.89 -0.08 0.00 0.00 0.05 0.00 0.00 38.32 39.18 4ayk h ASN 43 CO 0.07 0.24 0.00 1.33 -1.65 0.00 0.00 177.43 177.42 4ayk n VAL 44 N -4.48 1.15 -3.83 2.81 0.24 -1.17 -4.97 118.33 108.08 4ayk n VAL 44 Ca 0.06 -1.06 -0.12 0.00 -2.04 0.00 0.00 64.34 61.18 4ayk n VAL 44 Cb 0.23 0.42 -0.09 0.00 -1.47 0.00 0.00 33.84 32.94 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 -1.18 0.08 -2.00 3.34 -4.23 -0.69 -4.24 115.64 106.72 4ayk s THR 45 Ca 0.38 -0.63 0.14 0.00 -1.18 0.00 0.00 61.69 60.40 4ayk s THR 45 Cb 0.21 -0.53 0.41 0.00 1.34 0.00 0.00 72.50 73.92 4ayk s THR 45 CO 0.24 -0.35 1.28 -0.81 -0.54 0.00 0.00 174.62 174.44 4ayk n PRO 46 N 1.32 0.52 -1.91 3.99 -0.04 -1.26 -4.61 135.00 133.02 4ayk n PRO 46 Ca -0.22 0.00 -0.34 0.00 -0.04 0.00 0.00 63.50 62.90 4ayk n PRO 46 Cb 0.56 -1.43 0.04 0.00 -0.04 0.00 0.00 33.50 32.63 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 -1.86 3.51 0.06 1.53 1.43 -1.26 -4.95 118.68 117.14 4ayk s LEU 47 Ca 0.22 2.10 0.04 0.00 -1.03 0.00 0.00 54.13 55.45 4ayk s LEU 47 Cb 0.10 -4.57 -0.03 0.00 0.03 0.00 0.00 46.19 41.73 4ayk s LEU 47 CO 0.17 -1.54 -0.11 0.42 0.23 0.00 0.00 176.35 175.51 4ayk s THR 48 N -2.10 0.85 0.08 5.49 -4.23 -1.12 -4.61 115.64 110.00 4ayk s THR 48 Ca 0.70 -1.20 0.06 0.00 -1.18 0.00 0.00 61.69 60.08 4ayk s THR 48 Cb -0.23 -0.86 -0.03 0.00 1.34 0.00 0.00 72.50 72.73 4ayk s THR 48 CO 0.37 -0.29 -0.17 -0.36 -0.54 0.00 0.00 174.62 173.62 4ayk s PHE 49 N -1.32 1.47 -0.18 3.99 0.08 -1.26 -1.41 117.98 119.34 4ayk s PHE 49 Ca -0.06 -0.43 -0.12 0.00 0.12 0.00 0.00 56.93 56.44 4ayk s PHE 49 Cb -0.10 -0.82 0.06 0.00 -0.57 0.00 0.00 43.02 41.59 4ayk s PHE 49 CO 0.01 0.12 0.46 0.99 -0.10 0.00 0.00 175.22 176.70 4ayk s THR 50 N -1.18 -0.01 0.36 0.64 2.01 -0.89 -4.97 115.64 111.59 4ayk s THR 50 Ca 0.02 0.05 -0.25 0.00 0.31 0.00 0.00 61.69 61.82 4ayk s THR 50 Cb -0.10 -0.67 -0.09 0.00 0.01 0.00 0.00 72.50 71.65 4ayk s THR 50 CO 0.03 0.02 1.05 -0.75 -0.69 0.00 0.00 174.62 174.28 4ayk s LYS 51 N 1.07 4.32 -0.03 4.92 2.20 -1.26 -2.53 119.74 128.43 4ayk s LYS 51 Ca -0.07 1.55 0.04 0.00 -0.36 0.00 0.00 55.97 57.14 4ayk s LYS 51 Cb -0.06 -2.72 -0.00 0.00 -1.51 0.00 0.00 37.83 33.53 4ayk s LYS 51 CO -0.09 -0.01 -0.16 0.14 -0.36 0.00 0.00 175.35 174.87 4ayk s VAL 52 N -1.54 1.29 -2.52 4.02 -7.23 -0.99 -4.89 120.40 108.52 4ayk s VAL 52 Ca 0.54 -0.65 0.25 0.00 -1.81 0.00 0.00 61.98 60.31 4ayk s VAL 52 Cb -0.24 -1.10 0.27 0.00 0.56 0.00 0.00 36.38 35.87 4ayk s VAL 52 CO 0.30 0.37 1.41 -0.24 -0.31 0.00 0.00 175.10 176.64 4ayk n SER 53 N 3.05 2.13 -3.88 4.85 2.88 -1.26 -4.68 113.62 116.72 4ayk n SER 53 Ca -0.17 -1.63 -0.09 0.00 -1.33 0.00 0.00 58.87 55.65 4ayk n SER 53 Cb 0.53 0.10 -0.08 0.00 -0.75 0.00 0.00 64.21 64.01 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 -2.15 0.73 0.04 -1.46 8.01 -1.26 -5.12 118.70 117.50 4ayk s GLU 54 Ca 0.29 -0.81 0.00 0.00 0.01 0.00 0.00 54.97 54.45 4ayk s GLU 54 Cb 0.20 0.30 0.00 0.00 -4.31 0.00 0.00 34.13 30.31 4ayk s GLU 54 CO 0.39 -0.21 0.00 0.41 0.01 0.00 0.00 175.26 175.85 4ayk n GLY 55 N 0.37 -2.69 3.74 -1.39 0.00 -1.26 -4.87 105.19 99.09 4ayk n GLY 55 Ca -0.17 -1.41 -0.41 0.00 0.00 0.00 0.00 46.02 44.03 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 -3.18 4.75 0.09 1.61 -0.21 -1.26 -5.04 119.66 116.42 4ayk s GLN 56 Ca 0.00 1.52 -0.02 0.00 0.02 0.00 0.00 55.36 56.88 4ayk s GLN 56 Cb 0.00 -3.31 -0.05 0.00 1.00 0.00 0.00 33.01 30.65 4ayk s GLN 56 CO 0.00 0.33 0.28 0.00 -2.12 0.00 0.00 175.29 173.77 4ayk s ALA 57 N -0.61 3.92 0.23 6.09 0.00 -1.26 -5.00 121.76 125.14 4ayk s ALA 57 Ca 0.45 -0.72 -0.08 0.00 0.00 0.00 0.00 51.96 51.61 4ayk s ALA 57 Cb -0.26 -1.96 0.21 0.00 0.00 0.00 0.00 23.12 21.12 4ayk s ALA 57 CO 0.32 0.76 1.90 -0.44 0.00 0.00 0.00 175.76 178.30 4ayk h ASP 58 N 3.02 1.04 -3.63 0.00 3.32 -1.90 -3.37 116.42 114.90 4ayk h ASP 58 Ca -0.46 -0.04 -0.70 0.00 0.02 0.00 0.00 57.03 55.86 4ayk h ASP 58 Cb 1.16 -0.26 -0.26 0.00 0.22 0.00 0.00 39.33 40.19 4ayk h ASP 58 CO 0.74 0.77 -0.57 -0.63 -1.72 0.00 0.00 179.24 177.83 4ayk s ILE 59 N -6.07 4.14 -0.16 0.35 1.01 -0.92 -4.79 121.20 114.76 4ayk s ILE 59 Ca -0.13 -0.91 -0.08 0.00 0.00 0.00 0.00 60.65 59.53 4ayk s ILE 59 Cb 0.17 -3.28 -0.04 0.00 0.01 0.00 0.00 42.46 39.32 4ayk s ILE 59 CO 0.81 -0.13 0.12 -0.04 0.00 0.00 0.00 174.94 175.69 4ayk s MET 60 N 1.49 3.76 -0.09 2.79 -1.94 -1.26 -2.69 119.30 121.36 4ayk s MET 60 Ca 0.01 -0.21 0.04 0.00 -1.71 0.00 0.00 55.69 53.82 4ayk s MET 60 Cb -0.19 -3.26 -0.00 0.00 2.01 0.00 0.00 34.83 33.39 4ayk s MET 60 CO 0.04 0.53 -0.24 0.42 -0.01 0.00 0.00 175.02 175.77 4ayk s ILE 61 N -0.32 2.13 0.11 2.53 1.01 -1.05 -0.42 121.20 125.19 4ayk s ILE 61 Ca 0.11 -1.01 -0.11 0.00 0.00 0.00 0.00 60.65 59.64 4ayk s ILE 61 Cb -0.12 -1.80 0.01 0.00 0.01 0.00 0.00 42.46 40.56 4ayk s ILE 61 CO 0.01 0.56 0.28 -0.94 0.00 0.00 0.00 174.94 174.85 4ayk s SER 62 N 0.21 -0.02 -0.08 3.58 1.04 -0.85 -1.51 113.70 116.07 4ayk s SER 62 Ca -0.14 -0.56 -0.00 0.00 0.48 0.00 0.00 55.95 55.73 4ayk s SER 62 Cb -0.17 0.40 -0.03 0.00 0.10 0.00 0.00 66.02 66.32 4ayk s SER 62 CO 0.07 -0.80 -0.06 -0.36 0.98 0.00 0.00 173.24 173.08 4ayk s PHE 63 N -3.85 2.98 0.21 5.02 0.08 -1.26 -2.36 117.98 118.79 4ayk s PHE 63 Ca 0.06 -0.00 0.02 0.00 0.12 0.00 0.00 56.93 57.13 4ayk s PHE 63 Cb 0.04 -1.76 -0.05 0.00 -0.57 0.00 0.00 43.02 40.68 4ayk s PHE 63 CO -0.10 0.30 0.01 0.14 -0.10 0.00 0.00 175.22 175.47 4ayk s VAL 64 N -0.65 0.81 0.03 -0.44 -7.23 -1.08 -4.92 120.40 106.91 4ayk s VAL 64 Ca 0.10 -2.00 -0.00 0.00 -1.81 0.00 0.00 61.98 58.26 4ayk s VAL 64 Cb -0.12 -2.28 -0.03 0.00 0.56 0.00 0.00 36.38 34.52 4ayk s VAL 64 CO 0.02 -0.35 -0.03 -0.13 -0.31 0.00 0.00 175.10 174.29 4ayk s ARG 65 N -3.91 0.43 0.39 4.82 0.52 -1.26 -2.45 118.95 117.48 4ayk s ARG 65 Ca 0.27 -0.83 0.00 0.00 -0.52 0.00 0.00 55.73 54.66 4ayk s ARG 65 Cb 0.06 0.11 0.00 0.00 0.52 0.00 0.00 34.95 35.64 4ayk s ARG 65 CO 0.07 -0.06 0.00 0.41 0.02 0.00 0.00 175.30 175.74 4ayk n GLY 66 N 1.08 0.93 3.72 -3.53 0.00 -1.26 -4.27 105.19 101.87 4ayk n GLY 66 Ca -0.20 -0.55 -0.42 0.00 0.00 0.00 0.00 46.02 44.84 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 6.59 -0.39 1.61 -1.08 -1.26 -4.23 116.67 113.91 4ayk s ASP 67 Ca 0.00 2.64 0.12 0.00 -0.52 0.00 0.00 52.55 54.79 4ayk s ASP 67 Cb 0.00 -2.60 0.38 0.00 -1.46 0.00 0.00 42.92 39.24 4ayk s ASP 67 CO 0.00 -0.81 0.83 0.00 0.52 0.00 0.00 175.17 175.71 4ayk n HIS 68 N 3.67 1.08 -3.63 -5.34 1.44 -1.26 -4.96 115.22 106.22 4ayk n HIS 68 Ca 0.13 -3.56 -0.23 0.00 -2.01 0.00 0.00 57.72 52.05 4ayk n HIS 68 Cb 0.39 -0.40 0.04 0.00 0.12 0.00 0.00 29.99 30.14 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 0.09 -3.66 -3.93 -1.40 1.74 -1.26 -4.99 116.66 103.25 4ayk n ARG 69 Ca 0.23 0.62 -0.08 0.00 -0.77 0.00 0.00 57.85 57.84 4ayk n ARG 69 Cb 0.66 -5.02 -0.08 0.00 -1.02 0.00 0.00 32.46 27.00 4ayk n ARG 69 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 4ayk s ASP 70 N -4.02 0.22 0.00 0.55 -1.08 -1.26 -5.02 116.67 106.06 4ayk s ASP 70 Ca 0.18 -0.72 0.12 0.00 -0.52 0.00 0.00 52.55 51.60 4ayk s ASP 70 Cb -0.05 0.29 0.35 0.00 -1.46 0.00 0.00 42.92 42.05 4ayk s ASP 70 CO 0.81 -0.67 1.29 0.59 0.52 0.00 0.00 175.17 177.72 4ayk n ASN 71 N 0.10 1.91 -3.31 -0.34 3.02 -1.26 -4.38 115.26 111.00 4ayk n ASN 71 Ca -0.15 -1.98 -0.25 0.00 -0.03 0.00 0.00 54.58 52.17 4ayk n ASN 71 Cb 0.61 -0.23 -0.08 0.00 -0.61 0.00 0.00 39.78 39.47 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 0.54 0.53 -4.72 6.41 7.64 -1.26 -5.12 113.62 117.63 4ayk n SER 72 Ca 0.12 -2.71 -0.33 0.00 1.01 0.00 0.00 58.87 56.96 4ayk n SER 72 Cb 0.31 -0.62 0.11 0.00 -1.01 0.00 0.00 64.21 62.99 4ayk n SER 72 CO 0.00 0.00 0.00 -2.84 -3.01 0.00 0.00 175.04 169.19 4ayk s PRO 73 N -1.00 1.96 0.46 1.43 0.02 -1.26 -4.99 135.00 131.62 4ayk s PRO 73 Ca 0.34 1.65 -0.20 0.00 0.02 0.00 0.00 61.00 62.81 4ayk s PRO 73 Cb 0.12 -1.82 -0.10 0.00 0.02 0.00 0.00 34.50 32.72 4ayk s PRO 73 CO -0.13 -1.95 1.00 -0.06 -0.33 0.00 0.00 177.00 175.53 4ayk s PHE 74 N -2.21 3.16 -0.67 6.54 0.08 -1.26 -4.98 117.98 118.63 4ayk s PHE 74 Ca 0.71 1.59 0.05 0.00 0.12 0.00 0.00 56.93 59.40 4ayk s PHE 74 Cb -0.26 -2.95 0.19 0.00 -0.57 0.00 0.00 43.02 39.42 4ayk s PHE 74 CO 0.48 -0.48 0.55 -3.47 -0.10 0.00 0.00 175.22 172.20 4ayk n ASP 75 N -0.85 3.01 -0.94 1.36 -0.08 -1.26 -4.86 116.55 112.93 4ayk n ASP 75 Ca 0.08 -3.22 0.04 0.00 -1.51 0.00 0.00 54.79 50.18 4ayk n ASP 75 Cb 0.53 -0.73 -0.01 0.00 2.34 0.00 0.00 41.12 43.25 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 1.72 -1.31 0.15 0.27 0.00 -1.26 -3.14 105.19 101.62 4ayk n GLY 76 Ca 0.23 -1.10 0.08 0.00 0.00 0.00 0.00 46.02 45.23 4ayk n GLY 76 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 4ayk n PRO 77 N -2.19 0.10 -2.54 1.61 -0.02 -1.26 -4.63 135.00 126.08 4ayk n PRO 77 Ca 0.00 0.58 -0.24 0.00 -2.02 0.00 0.00 63.50 61.83 4ayk n PRO 77 Cb 0.14 -1.99 0.12 0.00 -0.02 0.00 0.00 33.50 31.74 4ayk n PRO 77 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 4ayk s GLY 78 N -3.28 1.76 0.00 -1.23 0.00 -1.19 -4.95 107.32 98.43 4ayk s GLY 78 Ca -0.02 -1.72 0.00 0.00 0.00 0.00 0.00 44.72 42.98 4ayk s GLY 78 CO 0.14 -1.12 0.00 0.61 0.00 0.00 0.00 173.10 172.73 4ayk n GLY 79 N -2.93 -0.75 3.75 0.20 0.00 -1.26 -4.11 105.19 100.09 4ayk n GLY 79 Ca 0.15 -1.39 -0.41 0.00 0.00 0.00 0.00 46.02 44.37 4ayk n GLY 79 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 4ayk s ASN 80 N -4.00 7.10 0.10 1.61 2.47 -1.26 -4.94 114.94 116.03 4ayk s ASN 80 Ca 0.00 2.28 0.22 0.00 0.42 0.00 0.00 52.86 55.78 4ayk s ASN 80 Cb 0.00 -2.62 -0.14 0.00 -1.45 0.00 0.00 41.25 37.04 4ayk s ASN 80 CO 0.00 -0.33 0.81 0.18 -3.72 0.00 0.00 177.10 174.04 4ayk n LEU 81 N 2.04 0.49 -3.52 3.21 4.77 -1.26 -4.90 117.00 117.82 4ayk n LEU 81 Ca 0.03 0.18 -0.08 0.00 -0.03 0.00 0.00 56.01 56.11 4ayk n LEU 81 Cb 0.44 -0.04 -0.02 0.00 -2.33 0.00 0.00 43.42 41.48 4ayk n LEU 81 CO 0.56 -0.11 0.74 0.00 -1.33 0.00 0.00 177.39 177.25 4ayk s ALA 82 N -3.43 -1.87 0.32 -1.18 0.00 -1.26 -2.25 121.76 112.09 4ayk s ALA 82 Ca -0.04 1.15 -0.17 0.00 0.00 0.00 0.00 51.96 52.91 4ayk s ALA 82 Cb 0.11 0.23 0.07 0.00 0.00 0.00 0.00 23.12 23.53 4ayk s ALA 82 CO 0.84 -0.64 0.88 -2.39 0.00 0.00 0.00 175.76 174.45 4ayk n HIS 83 N -0.13 -2.01 -3.72 0.00 1.44 -1.06 -5.02 115.22 104.72 4ayk n HIS 83 Ca -0.08 -1.64 -0.06 0.00 -2.01 0.00 0.00 57.72 53.93 4ayk n HIS 83 Cb 0.61 0.82 -0.02 0.00 0.12 0.00 0.00 29.99 31.52 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 -2.06 -1.56 0.16 1.59 0.00 -1.26 -1.27 121.76 117.36 4ayk s ALA 84 Ca 0.18 0.16 -0.00 0.00 0.00 0.00 0.00 51.96 52.30 4ayk s ALA 84 Cb -0.04 0.68 -0.04 0.00 0.00 0.00 0.00 23.12 23.72 4ayk s ALA 84 CO 0.10 -0.97 0.34 -0.06 0.00 0.00 0.00 175.76 175.16 4ayk s PHE 85 N -3.46 3.49 0.62 0.00 0.08 -1.05 -5.00 117.98 112.66 4ayk s PHE 85 Ca 0.10 0.30 -0.19 0.00 0.12 0.00 0.00 56.93 57.26 4ayk s PHE 85 Cb -0.02 -1.81 -0.03 0.00 -0.57 0.00 0.00 43.02 40.59 4ayk s PHE 85 CO 0.01 0.44 1.22 1.04 -0.10 0.00 0.00 175.22 177.83 4ayk n GLN 86 N -0.43 1.14 -1.53 0.44 6.02 -1.26 -2.49 117.38 119.28 4ayk n GLN 86 Ca -0.05 0.44 -0.42 0.00 -0.01 0.00 0.00 57.00 56.96 4ayk n GLN 86 Cb 0.53 -2.44 -0.06 0.00 1.02 0.00 0.00 30.24 29.29 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 -1.54 1.09 -3.80 -1.09 -0.04 -1.26 -1.82 135.00 126.54 4ayk n PRO 87 Ca 0.15 0.18 -0.09 0.00 -0.04 0.00 0.00 63.50 63.70 4ayk n PRO 87 Cb 0.47 -2.89 -0.03 0.00 -0.04 0.00 0.00 33.50 31.01 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 9.77 -0.03 1.37 0.55 0.00 -1.25 -4.66 107.32 113.07 4ayk s GLY 88 Ca 1.07 -0.30 -0.23 0.00 0.00 0.00 0.00 44.72 45.25 4ayk s GLY 88 CO 0.37 -0.22 0.95 -1.55 0.00 0.00 0.00 173.10 172.64 4ayk n PRO 89 N -0.40 -4.25 0.00 2.90 -0.04 -1.26 -2.93 135.00 129.03 4ayk n PRO 89 Ca -0.07 -1.56 0.00 0.00 -0.04 0.00 0.00 63.50 61.83 4ayk n PRO 89 Cb 0.61 -1.79 0.00 0.00 -0.04 0.00 0.00 33.50 32.28 4ayk n PRO 89 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 4ayk n GLY 90 N -5.38 4.04 0.00 0.55 0.00 -1.26 -1.12 105.19 102.02 4ayk n GLY 90 Ca 0.14 0.05 0.13 0.00 0.00 0.00 0.00 46.02 46.34 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 0.01 -1.75 -0.61 3.06 -1.26 -4.86 119.36 113.94 4ayk n ILE 91 Ca 0.00 -0.00 -0.42 0.00 -2.50 0.00 0.00 62.75 59.83 4ayk n ILE 91 Cb 0.00 -0.31 -0.00 0.00 0.54 0.00 0.00 39.64 39.87 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 1.50 0.98 2.23 4.50 0.00 -0.28 -1.50 105.19 112.62 4ayk n GLY 92 Ca 0.07 0.32 0.00 0.00 0.00 0.00 0.00 46.02 46.41 4ayk n GLY 92 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 4ayk n GLY 93 N 0.64 2.65 3.70 -0.02 0.00 -0.76 -3.93 105.19 107.48 4ayk n GLY 93 Ca 0.03 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.63 4ayk n GLY 93 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 4ayk s ASP 94 N -1.90 6.61 -0.22 1.61 1.01 -0.56 -3.98 116.67 119.25 4ayk s ASP 94 Ca 0.00 2.52 -0.10 0.00 0.71 0.00 0.00 52.55 55.68 4ayk s ASP 94 Cb 0.00 -2.58 -0.05 0.00 1.01 0.00 0.00 42.92 41.31 4ayk s ASP 94 CO 0.00 -0.84 0.13 0.00 0.21 0.00 0.00 175.17 174.67 4ayk s ALA 95 N 1.93 3.60 -0.08 5.23 0.00 0.43 -2.52 121.76 130.36 4ayk s ALA 95 Ca 0.72 -0.80 0.01 0.00 0.00 0.00 0.00 51.96 51.88 4ayk s ALA 95 Cb -0.41 -2.20 -0.03 0.00 0.00 0.00 0.00 23.12 20.48 4ayk s ALA 95 CO 0.32 -0.02 -0.08 -1.01 0.00 0.00 0.00 175.76 174.96 4ayk s HIS 96 N 0.73 2.89 -0.06 0.00 3.76 -0.40 -2.02 115.29 120.19 4ayk s HIS 96 Ca 0.07 -0.07 0.06 0.00 -0.15 0.00 0.00 55.06 54.96 4ayk s HIS 96 Cb -0.12 -1.72 -0.01 0.00 1.11 0.00 0.00 32.58 31.83 4ayk s HIS 96 CO 0.02 0.25 -0.25 -0.06 -0.85 0.00 0.00 174.74 173.84 4ayk s PHE 97 N -0.63 2.46 -0.06 1.40 0.40 -1.00 -2.57 117.98 117.97 4ayk s PHE 97 Ca 0.09 -0.78 -0.30 0.00 -0.60 0.00 0.00 56.93 55.35 4ayk s PHE 97 Cb -0.11 -1.62 -0.05 0.00 0.51 0.00 0.00 43.02 41.75 4ayk s PHE 97 CO 0.02 -0.25 1.61 0.34 0.70 0.00 0.00 175.22 177.63 4ayk s ASP 98 N -0.08 6.70 0.00 1.36 -1.08 -0.95 -2.64 116.67 119.98 4ayk s ASP 98 Ca -0.06 2.18 0.24 0.00 -0.52 0.00 0.00 52.55 54.38 4ayk s ASP 98 Cb -0.14 -2.53 0.28 0.00 -1.46 0.00 0.00 42.92 39.06 4ayk s ASP 98 CO 0.05 -0.90 1.31 1.21 0.52 0.00 0.00 175.17 177.35 4ayk n GLU 99 N 7.04 2.35 0.25 4.34 2.13 -1.03 -4.18 120.64 131.54 4ayk n GLU 99 Ca 0.17 -1.98 0.15 0.00 0.66 0.00 0.00 57.16 56.15 4ayk n GLU 99 Cb 0.43 -1.47 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 4.57 0.00 -2.18 4.31 3.32 -1.89 -3.44 116.42 121.10 4ayk h ASP 100 Ca 0.00 0.00 -0.47 0.00 0.02 0.00 0.00 57.03 56.58 4ayk h ASP 100 Cb 0.98 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.51 4ayk h ASP 100 CO 0.00 0.00 -0.46 -1.61 -1.72 0.00 0.00 179.24 175.45 4ayk s GLU 101 N -3.45 3.27 -0.24 3.56 2.02 -1.26 -4.92 118.70 117.67 4ayk s GLU 101 Ca 0.04 -0.86 -0.24 0.00 0.02 0.00 0.00 54.97 53.93 4ayk s GLU 101 Cb 0.07 -2.79 -0.01 0.00 0.10 0.00 0.00 34.13 31.51 4ayk s GLU 101 CO 0.59 0.41 0.79 0.50 0.02 0.00 0.00 175.26 177.58 4ayk s ARG 102 N -3.94 4.17 0.19 1.61 3.52 -1.26 -5.04 118.95 118.20 4ayk s ARG 102 Ca 0.34 0.87 -0.14 0.00 -0.13 0.00 0.00 55.73 56.67 4ayk s ARG 102 Cb -0.09 -3.64 -0.07 0.00 -1.56 0.00 0.00 34.95 29.59 4ayk s ARG 102 CO 0.28 -0.49 0.58 -1.58 -0.81 0.00 0.00 175.30 173.28 4ayk s TRP 103 N 2.76 3.54 0.26 5.12 0.52 -1.26 -4.72 118.94 125.17 4ayk s TRP 103 Ca 0.33 1.06 0.09 0.00 0.02 0.00 0.00 56.10 57.61 4ayk s TRP 103 Cb -0.15 -2.38 -0.05 0.00 -1.15 0.00 0.00 33.47 29.73 4ayk s TRP 103 CO 0.08 0.35 -0.15 0.95 0.02 0.00 0.00 176.95 178.19 4ayk s THR 104 N -1.61 2.07 -0.31 2.01 -4.23 -1.20 -4.77 115.64 107.60 4ayk s THR 104 Ca 0.42 -2.28 0.08 0.00 -1.18 0.00 0.00 61.69 58.74 4ayk s THR 104 Cb -0.14 -2.26 0.53 0.00 1.34 0.00 0.00 72.50 71.97 4ayk s THR 104 CO 0.20 -0.44 1.52 0.59 -0.54 0.00 0.00 174.62 175.95 4ayk n ASN 105 N -0.55 2.68 -0.50 3.99 5.03 -1.26 -3.18 115.26 121.47 4ayk n ASN 105 Ca -0.06 -3.74 0.00 0.00 0.87 0.00 0.00 54.58 51.65 4ayk n ASN 105 Cb 0.61 -0.66 0.00 0.00 -1.02 0.00 0.00 39.78 38.71 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 -1.10 0.00 -1.12 6.41 2.04 -1.26 -5.01 115.26 115.22 4ayk n ASN 106 Ca 0.36 -0.50 -0.01 0.00 -0.44 0.00 0.00 54.58 53.99 4ayk n ASN 106 Cb 1.11 0.00 0.01 0.00 -2.53 0.00 0.00 39.78 38.37 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 0.11 -0.48 -2.53 1.16 -1.26 -4.65 117.46 109.81 4ayk n PHE 107 Ca 0.00 -0.63 0.00 0.00 -1.87 0.00 0.00 57.45 54.95 4ayk n PHE 107 Cb 0.00 -0.31 0.00 0.00 -1.61 0.00 0.00 39.48 37.56 4ayk n PHE 107 CO 0.00 0.00 0.00 0.54 -1.87 0.00 0.00 176.76 175.43 4ayk n ARG 108 N 0.60 -0.02 -0.03 3.97 1.74 -1.26 -4.92 116.66 116.73 4ayk n ARG 108 Ca 0.02 0.00 -0.13 0.00 -0.77 0.00 0.00 57.85 56.97 4ayk n ARG 108 Cb 0.53 0.00 -0.08 0.00 -1.02 0.00 0.00 32.46 31.90 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 -0.49 -5.29 5.56 5.08 -1.97 -3.40 114.58 114.08 4ayk h GLU 109 Ca 0.00 0.03 -0.63 0.00 -1.00 0.00 0.00 59.36 57.76 4ayk h GLU 109 Cb 0.00 0.11 -0.20 0.00 0.50 0.00 0.00 28.75 29.16 4ayk h GLU 109 CO 0.00 -0.33 -0.64 0.71 -1.00 0.00 0.00 179.01 177.76 4ayk s TYR 110 N -5.79 3.09 -0.36 4.33 2.02 -1.26 -5.03 117.35 114.34 4ayk s TYR 110 Ca -0.15 -0.20 -0.12 0.00 -0.37 0.00 0.00 57.07 56.23 4ayk s TYR 110 Cb 0.09 -2.00 0.01 0.00 -0.40 0.00 0.00 41.96 39.66 4ayk s TYR 110 CO 0.63 0.01 0.22 -0.80 -1.57 0.00 0.00 175.55 174.04 4ayk s ASN 111 N 0.38 5.84 0.12 2.29 0.01 -1.26 -3.23 114.94 119.09 4ayk s ASN 111 Ca -0.02 -0.73 -0.13 0.00 -0.71 0.00 0.00 52.86 51.27 4ayk s ASN 111 Cb -0.14 -2.07 -0.05 0.00 0.41 0.00 0.00 41.25 39.40 4ayk s ASN 111 CO 0.02 -0.32 1.47 0.25 -1.51 0.00 0.00 177.10 177.01 4ayk h LEU 112 N 8.47 0.88 -0.88 0.60 5.85 -1.87 -3.00 115.31 125.36 4ayk h LEU 112 Ca -0.29 -0.45 0.01 0.00 0.84 0.00 0.00 57.88 58.00 4ayk h LEU 112 Cb 1.13 -0.25 -0.05 0.00 0.37 0.00 0.00 40.66 41.87 4ayk h LEU 112 CO 0.66 1.14 0.58 -0.74 -0.34 0.00 0.00 178.44 179.74 4ayk h HIS 113 N 0.62 1.09 -0.66 1.25 2.76 -1.90 -0.20 115.15 118.11 4ayk h HIS 113 Ca 0.06 0.03 0.01 0.00 -2.20 0.00 0.00 60.37 58.27 4ayk h HIS 113 Cb 0.87 -0.37 -0.03 0.00 1.55 0.00 0.00 27.41 29.43 4ayk h HIS 113 CO 0.06 0.68 0.44 -0.09 -1.30 0.00 0.00 177.93 177.72 4ayk h ARG 114 N 1.17 0.86 -0.37 5.26 2.43 -1.95 -1.20 114.38 120.57 4ayk h ARG 114 Ca 0.33 -0.05 -0.16 0.00 -0.81 0.00 0.00 59.98 59.28 4ayk h ARG 114 Cb -0.11 -0.19 -0.01 0.00 -0.42 0.00 0.00 29.97 29.24 4ayk h ARG 114 CO -0.08 0.57 -0.40 0.28 -1.51 0.00 0.00 179.97 178.83 4ayk h VAL 115 N 0.89 1.27 -0.80 0.20 2.07 -1.28 -2.67 116.25 115.93 4ayk h VAL 115 Ca 0.25 -1.58 0.01 0.00 0.82 0.00 0.00 66.70 66.20 4ayk h VAL 115 Cb -0.09 1.41 -0.04 0.00 -1.52 0.00 0.00 31.29 31.05 4ayk h VAL 115 CO -0.06 0.53 0.53 0.00 0.02 0.00 0.00 177.57 178.58 4ayk h ALA 116 N 0.78 1.02 -0.87 1.67 0.00 -0.66 -0.69 119.26 120.51 4ayk h ALA 116 Ca 0.06 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 4ayk h ALA 116 Cb 1.00 -0.31 -0.04 0.00 0.00 0.00 0.00 17.79 18.43 4ayk h ALA 116 CO 0.10 0.41 0.47 0.00 0.00 0.00 0.00 179.25 180.23 4ayk h ALA 117 N 1.30 1.18 -0.05 0.00 0.00 -1.10 -0.24 119.26 120.36 4ayk h ALA 117 Ca 0.30 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 55.07 4ayk h ALA 117 Cb -0.10 -0.35 -0.00 0.00 0.00 0.00 0.00 17.79 17.34 4ayk h ALA 117 CO -0.07 0.65 -0.00 1.25 0.00 0.00 0.00 179.25 181.08 4ayk h HIS 118 N 1.22 0.09 -0.87 0.00 6.17 -1.00 -1.47 115.15 119.31 4ayk h HIS 118 Ca 0.31 -0.02 0.01 0.00 0.71 0.00 0.00 60.37 61.38 4ayk h HIS 118 Cb 0.04 -0.02 -0.04 0.00 2.52 0.00 0.00 27.41 29.90 4ayk h HIS 118 CO 0.01 0.39 0.57 0.93 0.71 0.00 0.00 177.93 180.55 4ayk h GLU 119 N -0.23 1.12 -0.61 5.26 5.08 -0.91 -0.79 114.58 123.50 4ayk h GLU 119 Ca 0.01 -0.07 -0.04 0.00 -1.00 0.00 0.00 59.36 58.27 4ayk h GLU 119 Cb 0.36 -0.25 -0.03 0.00 0.50 0.00 0.00 28.75 29.33 4ayk h GLU 119 CO 0.00 0.74 0.24 -0.07 -1.00 0.00 0.00 179.01 178.92 4ayk h LEU 120 N 1.16 0.82 -0.85 1.33 3.38 -0.94 -1.89 115.31 118.32 4ayk h LEU 120 Ca 0.32 -0.11 0.07 0.00 0.09 0.00 0.00 57.88 58.25 4ayk h LEU 120 Cb -0.11 -0.21 -0.07 0.00 0.09 0.00 0.00 40.66 40.36 4ayk h LEU 120 CO -0.08 0.74 0.52 1.23 0.09 0.00 0.00 178.44 180.94 4ayk h GLY 121 N 0.99 1.30 1.45 0.83 0.00 -0.05 0.11 103.07 107.70 4ayk h GLY 121 Ca 0.21 -0.37 -0.06 0.00 0.00 0.00 0.00 47.33 47.12 4ayk h GLY 121 CO -0.02 0.22 0.04 0.45 0.00 0.00 0.00 176.54 177.24 4ayk h HIS 122 N 0.92 0.72 0.00 5.60 3.86 -0.89 -0.15 115.15 125.21 4ayk h HIS 122 Ca 0.38 -0.08 -0.06 0.00 -1.16 0.00 0.00 60.37 59.46 4ayk h HIS 122 Cb 0.23 -0.21 -0.01 0.00 1.06 0.00 0.00 27.41 28.49 4ayk h HIS 122 CO -0.04 0.65 -0.29 0.77 0.86 0.00 0.00 177.93 179.88 4ayk h SER 123 N 0.66 0.00 0.31 2.45 0.02 -0.35 -1.89 113.55 114.75 4ayk h SER 123 Ca 0.14 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.09 4ayk h SER 123 Cb 0.35 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.89 4ayk h SER 123 CO 0.01 0.29 -0.12 0.18 -1.14 0.00 0.00 176.83 176.06 4ayk n LEU 124 N -3.68 0.57 0.00 5.07 4.77 -0.07 -4.69 117.00 118.97 4ayk n LEU 124 Ca -0.01 -0.05 0.00 0.00 -0.03 0.00 0.00 56.01 55.92 4ayk n LEU 124 Cb 0.40 -0.16 0.00 0.00 -2.33 0.00 0.00 43.42 41.34 4ayk n LEU 124 CO 0.35 0.11 0.00 0.61 -1.33 0.00 0.00 177.39 177.13 4ayk n GLY 125 N 1.27 0.68 3.70 -0.72 0.00 -0.71 -5.00 105.19 104.41 4ayk n GLY 125 Ca 0.15 -0.29 -0.41 0.00 0.00 0.00 0.00 46.02 45.47 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 0.70 0.99 1.43 -0.16 -5.00 118.68 120.93 4ayk s LEU 126 Ca 0.00 1.32 -0.04 0.00 -1.03 0.00 0.00 54.13 54.38 4ayk s LEU 126 Cb 0.00 -3.26 0.09 0.00 0.03 0.00 0.00 46.19 43.05 4ayk s LEU 126 CO 0.00 -0.22 0.98 -0.44 0.23 0.00 0.00 176.35 176.90 4ayk s SER 127 N 0.94 4.62 0.73 2.29 0.01 -1.26 -4.18 113.70 116.84 4ayk s SER 127 Ca 0.42 0.09 -0.13 0.00 1.31 0.00 0.00 55.95 57.64 4ayk s SER 127 Cb -0.18 -0.66 0.03 0.00 0.21 0.00 0.00 66.02 65.42 4ayk s SER 127 CO 0.20 -1.68 1.12 -1.00 0.41 0.00 0.00 173.24 172.28 4ayk s HIS 128 N -3.17 2.47 0.28 2.43 0.09 -1.26 -5.00 115.29 111.14 4ayk s HIS 128 Ca 0.63 1.58 0.07 0.00 -0.00 0.00 0.00 55.06 57.33 4ayk s HIS 128 Cb -0.08 -3.17 -0.06 0.00 -0.00 0.00 0.00 32.58 29.27 4ayk s HIS 128 CO 0.44 -1.91 -0.07 0.45 -0.00 0.00 0.00 174.74 173.65 4ayk s SER 129 N -2.81 2.87 0.00 1.40 0.15 -1.26 -5.03 113.70 109.02 4ayk s SER 129 Ca 0.66 -1.18 0.23 0.00 0.70 0.00 0.00 55.95 56.36 4ayk s SER 129 Cb -0.20 -0.19 0.48 0.00 -1.71 0.00 0.00 66.02 64.40 4ayk s SER 129 CO 0.48 -0.31 1.43 0.35 1.20 0.00 0.00 173.24 176.39 4ayk n THR 130 N -0.59 0.38 -2.79 6.45 -2.24 -1.26 -4.67 114.28 109.55 4ayk n THR 130 Ca -0.05 -0.62 -0.42 0.00 -2.27 0.00 0.00 64.05 60.68 4ayk n THR 130 Cb 0.63 0.89 -0.03 0.00 -2.10 0.00 0.00 70.33 69.72 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 -1.57 7.12 0.25 3.42 -1.08 -1.26 -4.93 116.67 118.62 4ayk s ASP 131 Ca 0.36 1.37 -0.06 0.00 -0.52 0.00 0.00 52.55 53.70 4ayk s ASP 131 Cb 0.21 -2.51 0.26 0.00 -1.46 0.00 0.00 42.92 39.42 4ayk s ASP 131 CO 0.30 -0.41 1.92 0.40 0.52 0.00 0.00 175.17 177.90 4ayk h ILE 132 N 5.12 1.26 0.00 4.11 2.04 -1.98 -1.59 117.51 126.47 4ayk h ILE 132 Ca -0.31 -0.50 0.00 0.00 1.00 0.00 0.00 64.86 65.05 4ayk h ILE 132 Cb 1.14 -0.17 0.00 0.00 -0.74 0.00 0.00 36.82 37.05 4ayk h ILE 132 CO 0.84 0.26 0.00 0.61 0.00 0.00 0.00 178.15 179.86 4ayk n GLY 133 N -1.33 -0.89 3.79 5.37 0.00 -1.26 -4.81 105.19 106.06 4ayk n GLY 133 Ca 0.11 -0.08 -0.38 0.00 0.00 0.00 0.00 46.02 45.68 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 3.38 0.27 4.61 0.00 -0.60 -4.69 121.76 122.73 4ayk s ALA 134 Ca 0.19 0.32 -0.05 0.00 0.00 0.00 0.00 51.96 52.42 4ayk s ALA 134 Cb 0.09 -2.95 0.32 0.00 0.00 0.00 0.00 23.12 20.58 4ayk s ALA 134 CO 0.14 0.28 1.94 -0.07 0.00 0.00 0.00 175.76 178.05 4ayk h LEU 135 N 3.71 1.09 -6.23 0.00 3.38 -1.87 -3.23 115.31 112.16 4ayk h LEU 135 Ca -0.47 -0.03 -0.60 0.00 0.09 0.00 0.00 57.88 56.88 4ayk h LEU 135 Cb 1.20 -0.27 0.04 0.00 0.09 0.00 0.00 40.66 41.72 4ayk h LEU 135 CO 0.65 0.78 2.40 0.23 0.09 0.00 0.00 178.44 182.60 4ayk n MET 136 N -4.40 1.68 -2.27 1.13 2.81 -1.26 -4.87 117.12 109.94 4ayk n MET 136 Ca 0.12 -1.79 -0.42 0.00 -1.81 0.00 0.00 57.70 53.79 4ayk n MET 136 Cb 0.03 -2.83 -0.03 0.00 -0.71 0.00 0.00 33.22 29.68 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 4.58 2.90 -1.12 2.03 6.14 -1.22 -3.99 117.35 126.66 4ayk s TYR 137 Ca 0.53 0.89 0.00 0.00 0.64 0.00 0.00 57.07 59.13 4ayk s TYR 137 Cb 0.13 -3.62 0.00 0.00 0.42 0.00 0.00 41.96 38.90 4ayk s TYR 137 CO 0.08 -2.23 0.37 -2.30 0.64 0.00 0.00 175.55 172.11 4ayk n PRO 138 N 5.42 0.00 -3.67 4.97 -0.02 -1.26 -4.59 135.00 135.84 4ayk n PRO 138 Ca 0.13 0.04 -0.04 0.00 -2.02 0.00 0.00 63.50 61.61 4ayk n PRO 138 Cb 0.44 -1.53 -0.01 0.00 -0.02 0.00 0.00 33.50 32.38 4ayk n PRO 138 CO 0.00 0.00 0.00 -1.12 1.98 0.00 0.00 175.50 176.36 4ayk s SER 139 N -1.75 -0.22 0.08 2.55 0.01 -1.26 -5.14 113.70 107.97 4ayk s SER 139 Ca 0.00 -0.26 -0.24 0.00 1.31 0.00 0.00 55.95 56.76 4ayk s SER 139 Cb 0.00 0.42 -0.06 0.00 0.21 0.00 0.00 66.02 66.59 4ayk s SER 139 CO 0.00 -0.76 0.72 -0.47 0.41 0.00 0.00 173.24 173.15 4ayk s TYR 140 N -3.14 3.79 0.00 2.43 6.14 -1.26 -5.03 117.35 120.27 4ayk s TYR 140 Ca 0.10 1.46 0.00 0.00 0.64 0.00 0.00 57.07 59.27 4ayk s TYR 140 Cb -0.01 -2.74 0.00 0.00 0.42 0.00 0.00 41.96 39.64 4ayk s TYR 140 CO -0.02 0.39 0.00 0.25 0.64 0.00 0.00 175.55 176.82 4ayk n THR 141 N 2.31 0.00 -1.70 4.34 -2.24 -1.26 -5.11 114.28 110.62 4ayk n THR 141 Ca -0.05 0.00 -0.44 0.00 -2.27 0.00 0.00 64.05 61.29 4ayk n THR 141 Cb 0.50 0.00 -0.03 0.00 -2.10 0.00 0.00 70.33 68.70 4ayk n THR 141 CO 0.00 0.00 0.00 0.33 -0.57 0.00 0.00 175.07 174.83 4ayk n PHE 142 N 0.00 2.52 -3.97 4.78 -0.00 -1.26 -4.96 117.46 114.57 4ayk n PHE 142 Ca 0.00 0.23 -0.35 0.00 -0.00 0.00 0.00 57.45 57.33 4ayk n PHE 142 Cb 0.00 -2.58 -0.11 0.00 -0.00 0.00 0.00 39.48 36.79 4ayk n PHE 142 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.76 177.21 4ayk s SER 143 N 0.79 5.32 0.00 -2.13 0.15 -1.26 -5.07 113.70 111.51 4ayk s SER 143 Ca 0.73 -0.06 0.00 0.00 0.70 0.00 0.00 55.95 57.32 4ayk s SER 143 Cb -0.59 -1.93 0.00 0.00 -1.71 0.00 0.00 66.02 61.80 4ayk s SER 143 CO 0.40 0.09 0.00 0.61 1.20 0.00 0.00 173.24 175.54 4ayk n GLY 144 N 4.10 0.65 3.74 9.45 0.00 -1.26 -5.03 105.19 116.84 4ayk n GLY 144 Ca -0.16 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.45 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 -0.76 7.41 -0.48 1.61 1.01 -1.26 -5.00 116.67 119.21 4ayk s ASP 145 Ca 0.00 1.69 -0.22 0.00 0.71 0.00 0.00 52.55 54.72 4ayk s ASP 145 Cb 0.00 -2.55 0.03 0.00 1.01 0.00 0.00 42.92 41.42 4ayk s ASP 145 CO 0.00 -0.00 0.76 -0.69 0.21 0.00 0.00 175.17 175.45 4ayk s VAL 146 N -0.20 4.67 0.09 -1.27 1.01 -1.26 -5.01 120.40 118.43 4ayk s VAL 146 Ca 0.43 0.19 -0.11 0.00 0.00 0.00 0.00 61.98 62.49 4ayk s VAL 146 Cb -0.23 -4.34 0.01 0.00 0.00 0.00 0.00 36.38 31.82 4ayk s VAL 146 CO 0.28 -0.79 0.25 -1.10 0.00 0.00 0.00 175.10 173.73 4ayk s GLN 147 N 3.23 0.89 0.37 2.72 -0.21 -1.26 -5.14 119.66 120.25 4ayk s GLN 147 Ca 0.26 -0.86 -0.25 0.00 0.02 0.00 0.00 55.36 54.53 4ayk s GLN 147 Cb -0.14 0.37 -0.09 0.00 1.00 0.00 0.00 33.01 34.15 4ayk s GLN 147 CO 0.20 -0.30 1.07 -0.51 -2.12 0.00 0.00 175.29 173.62 4ayk s LEU 148 N -2.76 4.24 0.42 2.90 1.43 -1.26 -4.80 118.68 118.84 4ayk s LEU 148 Ca 0.03 2.11 0.01 0.00 -1.03 0.00 0.00 54.13 55.25 4ayk s LEU 148 Cb 0.04 -4.05 -0.01 0.00 0.03 0.00 0.00 46.19 42.20 4ayk s LEU 148 CO -0.10 -0.43 0.63 0.00 0.23 0.00 0.00 176.35 176.68 4ayk s ALA 149 N -1.53 3.76 0.25 4.21 0.00 -1.26 -4.91 121.76 122.28 4ayk s ALA 149 Ca 0.55 -1.03 -0.06 0.00 0.00 0.00 0.00 51.96 51.42 4ayk s ALA 149 Cb -0.25 -2.12 0.26 0.00 0.00 0.00 0.00 23.12 21.01 4ayk s ALA 149 CO 0.31 -0.26 1.93 0.37 0.00 0.00 0.00 175.76 178.11 4ayk h GLN 150 N 0.52 1.30 -0.87 0.00 4.15 -1.96 0.48 115.11 118.73 4ayk h GLN 150 Ca -0.47 -0.08 0.02 0.00 0.77 0.00 0.00 58.65 58.89 4ayk h GLN 150 Cb 1.24 -0.29 -0.05 0.00 0.21 0.00 0.00 27.48 28.59 4ayk h GLN 150 CO 0.58 0.86 0.58 0.22 -1.93 0.00 0.00 178.83 179.14 4ayk h ASP 151 N 1.34 0.98 -0.16 -0.69 1.82 -1.98 0.26 116.42 117.99 4ayk h ASP 151 Ca 0.36 -0.02 -0.21 0.00 -0.39 0.00 0.00 57.03 56.77 4ayk h ASP 151 Cb -0.15 -0.24 0.01 0.00 0.68 0.00 0.00 39.33 39.63 4ayk h ASP 151 CO -0.08 0.70 -0.74 0.44 -1.61 0.00 0.00 179.24 177.96 4ayk h ASP 152 N 1.16 0.93 -0.00 2.28 3.32 -1.72 -1.10 116.42 121.29 4ayk h ASP 152 Ca 0.33 -0.62 -0.00 0.00 0.02 0.00 0.00 57.03 56.76 4ayk h ASP 152 Cb -0.10 -0.27 -0.00 0.00 0.22 0.00 0.00 39.33 39.18 4ayk h ASP 152 CO -0.08 1.40 0.00 0.40 -1.72 0.00 0.00 179.24 179.24 4ayk h ILE 153 N 0.52 1.20 -0.68 0.35 2.04 -0.51 -1.53 117.51 118.90 4ayk h ILE 153 Ca -0.05 -0.58 -0.07 0.00 1.00 0.00 0.00 64.86 65.16 4ayk h ILE 153 Cb 1.37 1.59 -0.03 0.00 -0.74 0.00 0.00 36.82 39.01 4ayk h ILE 153 CO 0.15 0.15 0.13 0.44 0.00 0.00 0.00 178.15 179.03 4ayk h ASP 154 N -0.24 1.06 0.36 1.72 3.32 -0.55 -1.99 116.42 120.11 4ayk h ASP 154 Ca 0.00 -0.24 -0.02 0.00 0.02 0.00 0.00 57.03 56.79 4ayk h ASP 154 Cb 0.25 -0.28 0.00 0.00 0.22 0.00 0.00 39.33 39.52 4ayk h ASP 154 CO 0.00 1.03 -0.17 1.23 -1.72 0.00 0.00 179.24 179.61 4ayk h GLY 155 N 1.06 -0.51 1.16 2.75 0.00 -1.11 0.13 103.07 106.55 4ayk h GLY 155 Ca 0.21 0.19 0.00 0.00 0.00 0.00 0.00 47.33 47.73 4ayk h GLY 155 CO 0.01 -0.19 0.53 1.19 0.00 0.00 0.00 176.54 178.08 4ayk h ILE 156 N -0.73 1.23 -0.25 2.60 6.09 -1.30 -1.28 117.51 123.86 4ayk h ILE 156 Ca -0.05 -0.45 -0.11 0.00 -1.37 0.00 0.00 64.86 62.88 4ayk h ILE 156 Cb 0.50 0.01 -0.01 0.00 0.47 0.00 0.00 36.82 37.79 4ayk h ILE 156 CO 0.08 0.23 -0.30 1.56 -3.07 0.00 0.00 178.15 176.65 4ayk h GLN 157 N 1.15 0.50 -0.99 2.19 4.20 -1.27 -2.73 115.11 118.16 4ayk h GLN 157 Ca 0.30 -0.21 0.01 0.00 0.06 0.00 0.00 58.65 58.81 4ayk h GLN 157 Cb -0.09 -0.02 -0.05 0.00 0.30 0.00 0.00 27.48 27.62 4ayk h GLN 157 CO -0.06 0.75 0.65 0.00 -0.67 0.00 0.00 178.83 179.50 4ayk h ALA 158 N 1.24 1.25 0.05 3.87 0.00 0.43 2.26 119.26 128.36 4ayk h ALA 158 Ca 0.06 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 4ayk h ALA 158 Cb 0.75 -0.40 0.00 0.00 0.00 0.00 0.00 17.79 18.14 4ayk h ALA 158 CO 0.06 0.65 -0.02 0.82 0.00 0.00 0.00 179.25 180.76 4ayk h ILE 159 N 1.34 1.11 0.00 0.00 2.04 -1.15 -3.40 117.51 117.45 4ayk h ILE 159 Ca 0.36 -0.49 0.00 0.00 1.00 0.00 0.00 64.86 65.73 4ayk h ILE 159 Cb -0.15 1.43 0.00 0.00 -0.74 0.00 0.00 36.82 37.37 4ayk h ILE 159 CO -0.08 0.12 0.00 -1.22 0.00 0.00 0.00 178.15 176.98 4ayk n TYR 160 N -5.01 0.00 -3.88 1.37 4.01 -0.97 -5.14 117.16 107.54 4ayk n TYR 160 Ca -0.08 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.66 4ayk n TYR 160 Cb 0.14 -0.03 0.00 0.00 -0.31 0.00 0.00 39.34 39.14 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 1.90 -1.31 3.85 2.72 0.00 0.76 -5.02 105.19 108.09 4ayk n GLY 161 Ca 0.00 -1.17 -0.35 0.00 0.00 0.00 0.00 46.02 44.50 4ayk n GLY 161 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 4ayk s ARG 162 N -1.75 3.88 -1.09 1.61 0.52 -1.26 -4.42 118.95 116.44 4ayk s ARG 162 Ca 0.00 0.34 -0.22 0.00 -0.52 0.00 0.00 55.73 55.33 4ayk s ARG 162 Cb 0.00 -2.99 -0.02 0.00 0.52 0.00 0.00 34.95 32.46 4ayk s ARG 162 CO 0.00 0.53 1.81 -1.12 0.02 0.00 0.00 175.30 176.54 4ayk s SER 163 N -1.68 5.68 -0.41 0.23 0.01 -1.26 -4.74 113.70 111.53 4ayk s SER 163 Ca 0.34 -1.46 0.01 0.00 1.31 0.00 0.00 55.95 56.15 4ayk s SER 163 Cb -0.15 -2.57 0.43 0.00 0.21 0.00 0.00 66.02 63.93 4ayk s SER 163 CO 0.18 -2.32 1.84 0.00 0.41 0.00 0.00 173.24 173.35 4ayk n GLN 164 N 8.60 2.08 -3.05 12.44 6.02 -1.26 -4.54 117.38 137.66 4ayk n GLN 164 Ca 0.42 -2.34 -0.18 0.00 -0.01 0.00 0.00 57.00 54.88 4ayk n GLN 164 Cb 0.47 -1.92 -0.03 0.00 1.02 0.00 0.00 30.24 29.78 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 -0.54 -1.10 -2.10 1.08 3.02 -1.26 -5.00 115.26 109.36 4ayk n ASN 165 Ca 0.46 -2.85 -0.15 0.00 -0.03 0.00 0.00 54.58 52.01 4ayk n ASN 165 Cb 1.04 0.28 -0.12 0.00 -0.61 0.00 0.00 39.78 40.37 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 1.78 2.04 -3.17 3.52 -0.04 -1.26 -4.92 135.00 132.96 4ayk n PRO 166 Ca 0.18 -1.32 -0.39 0.00 -0.04 0.00 0.00 63.50 61.93 4ayk n PRO 166 Cb 0.56 -1.97 -0.06 0.00 -0.04 0.00 0.00 33.50 31.99 4ayk n PRO 166 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 4ayk s VAL 167 N -0.03 4.88 0.49 0.52 -7.23 -1.26 -5.05 120.40 112.71 4ayk s VAL 167 Ca 0.60 1.31 -0.21 0.00 -1.81 0.00 0.00 61.98 61.86 4ayk s VAL 167 Cb 0.32 -3.96 -0.08 0.00 0.56 0.00 0.00 36.38 33.22 4ayk s VAL 167 CO -0.06 0.41 1.08 -1.10 -0.31 0.00 0.00 175.10 175.12 4ayk s GLN 168 N -0.18 3.72 0.00 4.82 -0.21 -1.26 -5.27 119.66 121.28 4ayk s GLN 168 Ca 0.32 1.51 0.00 0.00 0.02 0.00 0.00 55.36 57.22 4ayk s GLN 168 Cb -0.19 -2.18 0.00 0.00 1.00 0.00 0.00 33.01 31.65 4ayk s GLN 168 CO 0.18 -0.52 0.45 -0.35 -2.12 0.00 0.00 175.29 172.93