#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2akl s VAL 2 N 0.00 2.39 0.32 3.17 0.11 -1.26 -5.10 120.40 120.03 2akl s VAL 2 Ca 0.00 -1.47 -0.27 0.00 -2.93 0.00 0.00 61.98 57.30 2akl s VAL 2 Cb 0.00 -2.35 -0.09 0.00 -1.53 0.00 0.00 36.38 32.41 2akl s VAL 2 CO 0.00 0.02 1.05 -0.44 -3.33 0.00 0.00 175.10 172.40 2akl s SER 3 N 1.17 7.14 0.00 3.54 0.01 -1.26 -4.94 113.70 119.36 2akl s SER 3 Ca -0.06 2.12 0.25 0.00 1.31 0.00 0.00 55.95 59.57 2akl s SER 3 Cb -0.19 -2.61 0.39 0.00 0.21 0.00 0.00 66.02 63.82 2akl s SER 3 CO -0.05 -0.22 1.37 0.35 0.41 0.00 0.00 173.24 175.10 2akl n THR 4 N 0.75 0.06 -4.22 1.44 -2.24 -1.26 -4.91 114.28 103.90 2akl n THR 4 Ca 0.01 -0.47 -0.23 0.00 -2.27 0.00 0.00 64.05 61.08 2akl n THR 4 Cb 0.47 1.23 -0.06 0.00 -2.10 0.00 0.00 70.33 69.87 2akl n THR 4 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2akl s LEU 5 N -1.94 3.41 0.69 3.22 1.43 -1.26 -5.12 118.68 119.12 2akl s LEU 5 Ca 0.31 -0.47 -0.13 0.00 -1.03 0.00 0.00 54.13 52.82 2akl s LEU 5 Cb 0.20 -1.97 0.01 0.00 0.03 0.00 0.00 46.19 44.47 2akl s LEU 5 CO 0.31 0.01 1.09 -2.16 0.23 0.00 0.00 176.35 175.82 2akl s PRO 6 N -3.56 2.74 0.62 1.29 0.04 -1.26 -5.05 135.00 129.82 2akl s PRO 6 Ca 0.31 1.21 -0.10 0.00 0.04 0.00 0.00 61.00 62.45 2akl s PRO 6 Cb -0.07 -1.95 0.16 0.00 0.04 0.00 0.00 34.50 32.67 2akl s PRO 6 CO 0.21 -1.27 0.48 -2.30 0.04 0.00 0.00 177.00 174.16 2akl n PRO 7 N -2.83 -2.47 -3.62 0.56 -0.02 -1.26 -4.89 135.00 120.47 2akl n PRO 7 Ca 0.09 -0.78 -0.37 0.00 -2.02 0.00 0.00 63.50 60.42 2akl n PRO 7 Cb 0.53 -0.81 -0.10 0.00 -0.02 0.00 0.00 33.50 33.09 2akl n PRO 7 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2akl n PRO 9 N 4.58 0.50 -0.10 0.00 -0.04 -1.26 0.58 135.00 139.26 2akl n PRO 9 Ca -0.14 0.00 -0.18 0.00 -0.04 0.00 0.00 63.50 63.14 2akl n PRO 9 Cb 0.52 -1.14 -0.06 0.00 -0.04 0.00 0.00 33.50 32.78 2akl n PRO 9 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 2akl n GLN 10 N -0.64 0.48 -0.01 0.54 3.00 -1.26 -4.88 117.38 114.61 2akl n GLN 10 Ca 0.03 0.20 -0.01 0.00 -0.01 0.00 0.00 57.00 57.22 2akl n GLN 10 Cb 0.02 -1.32 -0.02 0.00 0.00 0.00 0.00 30.24 28.92 2akl n GLN 10 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 2akl n ASN 12 N -2.00 0.00 0.00 0.00 5.15 0.20 -4.85 115.26 113.75 2akl n ASN 12 Ca -0.03 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.95 2akl n ASN 12 Cb 0.49 -0.01 0.00 0.00 -0.53 0.00 0.00 39.78 39.72 2akl n ASN 12 CO 0.00 0.00 0.00 -1.54 1.40 0.00 0.00 177.26 177.12 2akl n SER 13 N 0.68 0.00 0.00 1.20 3.41 -1.26 -4.21 113.62 113.44 2akl n SER 13 Ca 0.00 0.42 0.00 0.00 -0.26 0.00 0.00 58.87 59.03 2akl n SER 13 Cb 0.00 -0.11 0.00 0.00 -0.26 0.00 0.00 64.21 63.84 2akl n SER 13 CO 0.00 0.00 0.00 -1.84 -0.16 0.00 0.00 175.04 173.04 2akl n GLU 14 N -1.44 0.00 -0.67 4.33 0.28 -1.26 -4.99 120.64 116.90 2akl n GLU 14 Ca 0.00 0.00 -0.05 0.00 -0.16 0.00 0.00 57.16 56.95 2akl n GLU 14 Cb 0.00 0.00 -0.03 0.00 1.43 0.00 0.00 31.44 32.84 2akl n GLU 14 CO 0.00 0.00 0.00 0.66 -0.16 0.00 0.00 177.13 177.63 2akl n TYR 15 N 0.00 0.18 -4.20 -1.84 4.02 -1.26 -4.80 117.16 109.27 2akl n TYR 15 Ca 0.00 -1.22 -0.31 0.00 -0.01 0.00 0.00 57.90 56.36 2akl n TYR 15 Cb 0.00 -0.80 -0.09 0.00 -0.02 0.00 0.00 39.34 38.43 2akl n TYR 15 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 176.86 176.84 2akl s THR 16 N -0.06 3.94 0.29 -0.72 2.01 -1.26 -3.84 115.64 116.00 2akl s THR 16 Ca 0.19 -0.93 -0.08 0.00 0.31 0.00 0.00 61.69 61.17 2akl s THR 16 Cb 0.10 -2.84 0.00 0.00 0.01 0.00 0.00 72.50 69.77 2akl s THR 16 CO -0.01 0.19 0.48 -0.72 -0.69 0.00 0.00 174.62 173.87 2akl s TYR 17 N -1.23 0.68 -0.32 4.92 -0.85 -1.12 -4.97 117.35 114.46 2akl s TYR 17 Ca 0.23 -1.01 -0.11 0.00 -0.52 0.00 0.00 57.07 55.67 2akl s TYR 17 Cb -0.12 0.08 -0.01 0.00 0.38 0.00 0.00 41.96 42.29 2akl s TYR 17 CO 0.15 -1.07 0.18 -1.83 -1.52 0.00 0.00 175.55 171.47 2akl s GLU 18 N -3.50 3.40 -0.60 -3.49 1.03 -1.26 -1.77 118.70 112.50 2akl s GLU 18 Ca 0.26 -0.69 0.04 0.00 0.03 0.00 0.00 54.97 54.62 2akl s GLU 18 Cb -0.00 -3.65 0.16 0.00 -0.80 0.00 0.00 34.13 29.83 2akl s GLU 18 CO 0.14 -0.42 0.40 0.34 -1.33 0.00 0.00 175.26 174.38 2akl s ASP 19 N 1.65 4.27 0.20 0.83 2.15 -1.14 -4.99 116.67 119.64 2akl s ASP 19 Ca 0.05 -3.45 0.00 0.00 0.43 0.00 0.00 52.55 49.58 2akl s ASP 19 Cb -0.17 -1.47 0.00 0.00 -0.30 0.00 0.00 42.92 40.98 2akl s ASP 19 CO 0.08 -0.15 0.00 0.61 -0.17 0.00 0.00 175.17 175.54 2akl n GLY 20 N 2.49 0.97 1.57 2.66 0.00 -1.26 -4.18 105.19 107.45 2akl n GLY 20 Ca 0.16 -1.16 0.08 0.00 0.00 0.00 0.00 46.02 45.10 2akl n GLY 20 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2akl n ALA 21 N 3.54 3.38 -3.46 4.61 0.00 -1.26 -4.95 120.51 122.37 2akl n ALA 21 Ca 0.00 -1.84 -0.07 0.00 0.00 0.00 0.00 53.44 51.54 2akl n ALA 21 Cb 0.00 -0.99 -0.02 0.00 0.00 0.00 0.00 19.45 18.45 2akl n ALA 21 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.50 178.97 2akl n LEU 22 N 0.62 0.00 -4.28 0.00 -0.00 -1.26 -4.94 117.00 107.15 2akl n LEU 22 Ca 0.25 -1.24 -0.31 0.00 -0.00 0.00 0.00 56.01 54.72 2akl n LEU 22 Cb 1.01 0.99 -0.16 0.00 -0.00 0.00 0.00 43.42 45.26 2akl n LEU 22 CO 0.26 -0.26 -0.56 -0.76 -0.00 0.00 0.00 177.39 176.06 2akl s LEU 23 N 0.00 2.06 0.03 1.47 1.43 -0.41 -2.90 118.68 120.36 2akl s LEU 23 Ca 0.13 -0.49 0.07 0.00 -1.03 0.00 0.00 54.13 52.81 2akl s LEU 23 Cb -0.00 -1.35 -0.02 0.00 0.03 0.00 0.00 46.19 44.85 2akl s LEU 23 CO 0.09 0.27 -0.20 0.68 0.23 0.00 0.00 176.35 177.42 2akl s VAL 24 N -0.30 1.59 -0.45 -1.59 -7.23 -0.73 -0.73 120.40 110.96 2akl s VAL 24 Ca 0.01 -1.08 -0.12 0.00 -1.81 0.00 0.00 61.98 58.98 2akl s VAL 24 Cb -0.12 -1.37 0.08 0.00 0.56 0.00 0.00 36.38 35.53 2akl s VAL 24 CO 0.02 0.26 0.32 0.00 -0.31 0.00 0.00 175.10 175.39 2akl h PRO 26 N 8.55 0.00 0.29 0.00 0.13 -1.87 -1.05 132.00 138.04 2akl h PRO 26 Ca -0.25 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.87 2akl h PRO 26 Cb 1.09 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.22 2akl h PRO 26 CO 0.82 0.02 -0.14 1.49 -0.23 0.00 0.00 178.00 179.96 2akl h GLU 27 N 0.00 -0.37 0.00 0.86 4.57 -1.92 -3.30 114.58 114.42 2akl h GLU 27 Ca -0.00 0.03 0.00 0.00 -1.18 0.00 0.00 59.36 58.21 2akl h GLU 27 Cb 0.09 0.09 0.00 0.00 -0.16 0.00 0.00 28.75 28.76 2akl h GLU 27 CO 0.00 -0.23 0.00 0.00 -1.18 0.00 0.00 179.01 177.60 2akl n ALA 29 N -1.50 -1.64 -3.69 0.00 0.00 -0.42 -5.00 120.51 108.27 2akl n ALA 29 Ca 0.05 0.08 -0.15 0.00 0.00 0.00 0.00 53.44 53.42 2akl n ALA 29 Cb 0.24 -3.53 -0.14 0.00 0.00 0.00 0.00 19.45 16.02 2akl n ALA 29 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 2akl s HIS 30 N -3.44 -0.28 0.36 0.00 3.76 -1.11 -5.03 115.29 109.55 2akl s HIS 30 Ca 0.33 0.75 -0.03 0.00 -0.15 0.00 0.00 55.06 55.96 2akl s HIS 30 Cb -0.16 -0.11 -0.04 0.00 1.11 0.00 0.00 32.58 33.38 2akl s HIS 30 CO 0.79 -0.28 0.62 -1.21 -0.85 0.00 0.00 174.74 173.81 2akl s GLU 31 N 2.02 3.56 0.19 1.40 8.01 -1.26 -2.04 118.70 130.58 2akl s GLU 31 Ca -0.01 -0.06 -0.21 0.00 0.01 0.00 0.00 54.97 54.71 2akl s GLU 31 Cb -0.12 -2.58 0.05 0.00 -4.31 0.00 0.00 34.13 27.17 2akl s GLU 31 CO -0.07 0.08 0.58 1.67 0.01 0.00 0.00 175.26 177.53 2akl s TRP 32 N -2.34 -0.33 -0.11 1.61 1.48 0.09 -4.95 118.94 114.39 2akl s TRP 32 Ca 0.44 0.03 0.01 0.00 -1.06 0.00 0.00 56.10 55.52 2akl s TRP 32 Cb -0.10 0.52 0.02 0.00 -1.16 0.00 0.00 33.47 32.74 2akl s TRP 32 CO 0.36 -0.93 -0.14 0.45 -4.06 0.00 0.00 176.95 172.62 2akl s SER 33 N -2.82 2.44 0.50 -2.66 0.15 -1.26 -1.29 113.70 108.76 2akl s SER 33 Ca 0.05 -0.43 0.18 0.00 0.70 0.00 0.00 55.95 56.46 2akl s SER 33 Cb -0.02 -1.08 1.24 0.00 -1.71 0.00 0.00 66.02 64.45 2akl s SER 33 CO -0.06 -0.00 2.06 1.55 1.20 0.00 0.00 173.24 177.98 2akl h PRO 34 N 7.55 0.11 0.00 5.44 0.13 -1.93 -0.36 132.00 142.94 2akl h PRO 34 Ca -0.32 -0.01 -0.15 0.00 -0.87 0.00 0.00 66.00 64.65 2akl h PRO 34 Cb 1.17 -0.03 -0.03 0.00 0.13 0.00 0.00 31.00 32.24 2akl h PRO 34 CO 0.49 0.07 -1.56 0.27 -0.23 0.00 0.00 178.00 177.04 2akl n ASN 35 N -4.47 2.96 -0.26 1.44 6.94 -1.26 -4.61 115.26 116.01 2akl n ASN 35 Ca 0.04 0.00 0.13 0.00 -0.02 0.00 0.00 54.58 54.73 2akl n ASN 35 Cb 0.31 0.71 0.40 0.00 -2.36 0.00 0.00 39.78 38.84 2akl n ASN 35 CO 0.00 0.00 0.00 1.21 -1.03 0.00 0.00 177.26 177.44 2akl n GLU 36 N -2.30 0.90 0.08 -3.83 2.13 -1.14 -3.78 120.64 112.69 2akl n GLU 36 Ca -0.13 -0.52 -0.01 0.00 0.66 0.00 0.00 57.16 57.15 2akl n GLU 36 Cb 0.76 -1.49 0.26 0.00 0.27 0.00 0.00 31.44 31.25 2akl n GLU 36 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2akl h ALA 37 N 3.73 1.22 0.11 4.31 0.00 -1.32 -3.14 119.26 124.17 2akl h ALA 37 Ca 0.00 -0.34 -0.01 0.00 0.00 0.00 0.00 54.91 54.57 2akl h ALA 37 Cb 0.50 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.19 2akl h ALA 37 CO 0.00 0.52 -0.05 0.00 0.00 0.00 0.00 179.25 179.71 2akl h ALA 38 N 1.43 -0.15 -0.19 0.00 0.00 -1.83 -3.45 119.26 115.07 2akl h ALA 38 Ca 0.04 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2akl h ALA 38 Cb 0.65 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.50 2akl h ALA 38 CO 0.05 -0.56 0.00 2.41 0.00 0.00 0.00 179.25 181.15 2akl n THR 39 N -5.13 0.00 -3.37 0.00 -1.04 -1.19 -4.37 114.28 99.17 2akl n THR 39 Ca -0.08 0.00 -0.02 0.00 -2.04 0.00 0.00 64.05 61.91 2akl n THR 39 Cb 0.10 0.00 -0.04 0.00 -1.82 0.00 0.00 70.33 68.57 2akl n THR 39 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2akl s ALA 40 N -0.38 -1.79 -0.99 2.41 0.00 -1.26 -5.09 121.76 114.66 2akl s ALA 40 Ca 0.00 1.69 -0.22 0.00 0.00 0.00 0.00 51.96 53.43 2akl s ALA 40 Cb 0.00 -1.85 0.07 0.00 0.00 0.00 0.00 23.12 21.34 2akl s ALA 40 CO 0.00 -1.15 1.36 -1.12 0.00 0.00 0.00 175.76 174.85 2akl s SER 41 N 2.76 6.53 0.56 0.00 0.01 -1.26 -4.99 113.70 117.30 2akl s SER 41 Ca 0.10 -1.60 -0.19 0.00 1.31 0.00 0.00 55.95 55.58 2akl s SER 41 Cb -0.14 -2.52 -0.05 0.00 0.21 0.00 0.00 66.02 63.51 2akl s SER 41 CO -0.18 -1.39 1.13 -0.62 0.41 0.00 0.00 173.24 172.58 2akl s ASP 42 N 4.60 5.64 -0.70 2.44 2.15 -1.26 -5.00 116.67 124.53 2akl s ASP 42 Ca 0.42 2.17 0.04 0.00 0.43 0.00 0.00 52.55 55.61 2akl s ASP 42 Cb -0.01 -2.58 0.17 0.00 -0.30 0.00 0.00 42.92 40.20 2akl s ASP 42 CO -0.09 -1.28 0.50 -0.62 -0.17 0.00 0.00 175.17 173.51 2akl s ASP 43 N -1.85 4.90 -0.68 -0.34 2.15 -1.26 -4.86 116.67 114.73 2akl s ASP 43 Ca 0.72 -3.74 -0.01 0.00 0.43 0.00 0.00 52.55 49.95 2akl s ASP 43 Cb -0.24 -1.67 0.43 0.00 -0.30 0.00 0.00 42.92 41.15 2akl s ASP 43 CO 0.29 -0.11 1.98 0.61 -0.17 0.00 0.00 175.17 177.77 2akl n GLY 44 N 2.15 5.85 0.01 2.66 0.00 -1.26 -4.43 105.19 110.16 2akl n GLY 44 Ca 0.18 -2.36 0.08 0.00 0.00 0.00 0.00 46.02 43.92 2akl n GLY 44 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2akl n LYS 45 N -0.84 0.54 -3.80 1.61 5.02 -1.09 -3.44 118.16 116.17 2akl n LYS 45 Ca 0.60 -0.15 -0.13 0.00 -2.02 0.00 0.00 58.31 56.61 2akl n LYS 45 Cb 0.60 -1.41 -0.12 0.00 -0.02 0.00 0.00 35.03 34.08 2akl n LYS 45 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2akl s VAL 46 N -3.18 -0.00 -0.29 -0.18 0.11 -0.15 -4.31 120.40 112.40 2akl s VAL 46 Ca -0.06 0.00 -0.29 0.00 -2.93 0.00 0.00 61.98 58.70 2akl s VAL 46 Cb 0.11 -0.31 0.01 0.00 -1.53 0.00 0.00 36.38 34.66 2akl s VAL 46 CO 0.71 0.00 1.13 -0.63 -3.33 0.00 0.00 175.10 172.99 2akl s ILE 47 N 0.13 4.44 0.06 7.04 -1.09 -1.19 -4.68 121.20 125.91 2akl s ILE 47 Ca -0.00 1.68 0.00 0.00 -2.23 0.00 0.00 60.65 60.10 2akl s ILE 47 Cb -0.02 -4.32 -0.04 0.00 -1.58 0.00 0.00 42.46 36.51 2akl s ILE 47 CO 0.00 -0.41 0.21 -0.54 -1.23 0.00 0.00 174.94 172.98 2akl s LYS 48 N 3.67 3.44 0.73 2.79 1.02 -1.26 -2.04 119.74 128.09 2akl s LYS 48 Ca 0.48 -0.44 -0.02 0.00 0.02 0.00 0.00 55.97 56.00 2akl s LYS 48 Cb -0.14 -3.04 0.12 0.00 -0.52 0.00 0.00 37.83 34.25 2akl s LYS 48 CO 0.15 0.61 1.01 -0.51 -0.92 0.00 0.00 175.35 175.69 2akl s ASP 49 N -2.53 4.34 0.00 2.83 1.11 -0.57 -4.58 116.67 117.27 2akl s ASP 49 Ca 0.35 -0.23 0.25 0.00 0.18 0.00 0.00 52.55 53.11 2akl s ASP 49 Cb -0.13 -0.18 1.18 0.00 1.07 0.00 0.00 42.92 44.86 2akl s ASP 49 CO 0.28 -1.87 1.83 -0.24 1.18 0.00 0.00 175.17 176.35 2akl n SER 50 N -2.89 0.00 -0.64 0.27 2.88 -0.84 -1.78 113.62 110.62 2akl n SER 50 Ca 0.14 0.22 0.12 0.00 -1.33 0.00 0.00 58.87 58.03 2akl n SER 50 Cb 0.60 -0.40 0.16 0.00 -0.75 0.00 0.00 64.21 63.83 2akl n SER 50 CO 0.00 0.00 0.00 0.55 -1.23 0.00 0.00 175.04 174.36 2akl n VAL 51 N -1.40 0.00 -0.60 2.46 3.14 -1.26 -4.95 118.33 115.72 2akl n VAL 51 Ca 0.09 -0.34 0.00 0.00 -2.96 0.00 0.00 64.34 61.13 2akl n VAL 51 Cb 0.25 1.13 0.00 0.00 -1.06 0.00 0.00 33.84 34.16 2akl n VAL 51 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 2akl n GLY 52 N 1.35 0.76 3.91 7.55 0.00 -0.73 -5.05 105.19 112.97 2akl n GLY 52 Ca 0.13 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.87 2akl n GLY 52 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2akl s ASN 53 N -2.61 6.43 -0.42 1.61 6.03 -1.26 -4.83 114.94 119.90 2akl s ASN 53 Ca 0.00 0.67 -0.16 0.00 -1.03 0.00 0.00 52.86 52.33 2akl s ASN 53 Cb 0.00 -2.12 0.02 0.00 -3.03 0.00 0.00 41.25 36.12 2akl s ASN 53 CO 0.00 -0.18 0.37 -0.69 -2.03 0.00 0.00 177.10 174.57 2akl s VAL 54 N -2.06 5.17 0.52 3.54 1.01 -1.26 -1.52 120.40 125.81 2akl s VAL 54 Ca 0.43 -0.51 -0.22 0.00 0.00 0.00 0.00 61.98 61.68 2akl s VAL 54 Cb -0.11 -3.99 -0.06 0.00 0.00 0.00 0.00 36.38 32.22 2akl s VAL 54 CO 0.30 -0.37 1.31 0.18 0.00 0.00 0.00 175.10 176.51 2akl n LEU 55 N 5.39 5.06 -4.37 3.92 4.77 -0.86 -5.03 117.00 125.88 2akl n LEU 55 Ca -0.09 0.99 -0.29 0.00 -0.03 0.00 0.00 56.01 56.60 2akl n LEU 55 Cb 0.47 -1.55 -0.13 0.00 -2.33 0.00 0.00 43.42 39.88 2akl n LEU 55 CO 0.44 -0.69 -0.56 -1.58 -1.33 0.00 0.00 177.39 173.66 2akl s GLN 56 N -2.72 1.44 0.10 3.23 0.74 -1.26 -4.59 119.66 116.60 2akl s GLN 56 Ca 0.69 -1.29 -0.31 0.00 0.05 0.00 0.00 55.36 54.51 2akl s GLN 56 Cb -0.44 -1.86 -0.09 0.00 1.10 0.00 0.00 33.01 31.72 2akl s GLN 56 CO 0.51 0.45 1.66 0.34 -0.55 0.00 0.00 175.29 177.70 2akl s ASP 57 N -1.89 6.57 0.00 6.67 2.15 -1.26 -1.26 116.67 127.65 2akl s ASP 57 Ca 0.13 2.56 0.00 0.00 0.43 0.00 0.00 52.55 55.67 2akl s ASP 57 Cb -0.10 -2.57 0.00 0.00 -0.30 0.00 0.00 42.92 39.95 2akl s ASP 57 CO 0.05 -0.89 0.00 0.61 -0.17 0.00 0.00 175.17 174.77 2akl n GLY 58 N 3.97 0.77 3.92 2.66 0.00 0.51 -4.91 105.19 112.11 2akl n GLY 58 Ca 0.16 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.89 2akl n GLY 58 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2akl s ASP 59 N -2.80 4.00 -0.11 1.61 -1.08 -0.39 -3.15 116.67 114.75 2akl s ASP 59 Ca 0.00 0.45 -0.06 0.00 -0.52 0.00 0.00 52.55 52.42 2akl s ASP 59 Cb 0.00 -0.79 -0.04 0.00 -1.46 0.00 0.00 42.92 40.64 2akl s ASP 59 CO 0.00 -2.18 0.11 -0.89 0.52 0.00 0.00 175.17 172.73 2akl s THR 60 N -3.62 5.23 0.30 1.71 2.01 -1.26 0.15 115.64 120.16 2akl s THR 60 Ca 0.67 0.11 0.07 0.00 0.31 0.00 0.00 61.69 62.84 2akl s THR 60 Cb -0.08 -3.27 -0.06 0.00 0.01 0.00 0.00 72.50 69.11 2akl s THR 60 CO 0.50 0.61 -0.05 0.27 -0.69 0.00 0.00 174.62 175.25 2akl s ILE 61 N -0.97 1.75 -0.20 1.82 -5.25 0.70 -1.14 121.20 117.90 2akl s ILE 61 Ca 0.14 -2.13 -0.05 0.00 -0.99 0.00 0.00 60.65 57.63 2akl s ILE 61 Cb -0.12 -2.54 0.10 0.00 2.95 0.00 0.00 42.46 42.86 2akl s ILE 61 CO 0.04 -0.25 0.37 -0.89 -1.79 0.00 0.00 174.94 172.42 2akl s THR 62 N -2.94 -0.58 0.19 8.37 2.01 0.20 -1.61 115.64 121.28 2akl s THR 62 Ca 0.31 0.08 -0.33 0.00 0.31 0.00 0.00 61.69 62.06 2akl s THR 62 Cb 0.04 -0.69 -0.13 0.00 0.01 0.00 0.00 72.50 71.74 2akl s THR 62 CO 0.13 -0.01 1.67 0.55 -0.69 0.00 0.00 174.62 176.27 2akl n VAL 63 N 5.37 0.00 -0.78 3.82 3.14 -1.14 -0.52 118.33 128.22 2akl n VAL 63 Ca -0.06 -0.00 0.08 0.00 -2.96 0.00 0.00 64.34 61.40 2akl n VAL 63 Cb 0.50 -1.81 0.35 0.00 -1.06 0.00 0.00 33.84 31.82 2akl n VAL 63 CO 0.00 0.00 0.00 2.30 -6.46 0.00 0.00 176.83 172.67 2akl n ILE 64 N 3.76 2.24 -4.22 1.55 -0.00 0.41 0.04 119.36 123.13 2akl n ILE 64 Ca 0.16 -1.41 -0.13 0.00 -0.00 0.00 0.00 62.75 61.38 2akl n ILE 64 Cb 0.32 -0.08 -0.10 0.00 -0.00 0.00 0.00 39.64 39.78 2akl n ILE 64 CO 0.00 0.00 0.00 -0.54 -0.00 0.00 0.00 176.55 176.01 2akl s LYS 65 N -2.34 0.99 -0.43 6.28 3.01 -1.23 -4.80 119.74 121.21 2akl s LYS 65 Ca 0.49 -1.43 -0.25 0.00 -1.01 0.00 0.00 55.97 53.77 2akl s LYS 65 Cb 0.35 -0.35 0.02 0.00 -1.01 0.00 0.00 37.83 36.85 2akl s LYS 65 CO 0.18 -0.03 0.89 0.16 0.51 0.00 0.00 175.35 177.06 2akl s ASP 66 N -3.12 6.53 -0.06 2.83 -4.77 -1.26 -2.23 116.67 114.58 2akl s ASP 66 Ca 0.17 0.20 0.04 0.00 -3.30 0.00 0.00 52.55 49.67 2akl s ASP 66 Cb 0.05 -2.44 -0.00 0.00 -1.09 0.00 0.00 42.92 39.44 2akl s ASP 66 CO -0.00 -0.96 -0.19 -0.76 0.70 0.00 0.00 175.17 173.95 2akl s LEU 67 N 3.58 1.93 0.71 2.11 1.43 0.16 -5.02 118.68 123.58 2akl s LEU 67 Ca 0.36 -0.40 -0.04 0.00 -1.03 0.00 0.00 54.13 53.01 2akl s LEU 67 Cb -0.11 -1.09 0.09 0.00 0.03 0.00 0.00 46.19 45.12 2akl s LEU 67 CO 0.23 0.16 1.00 -1.59 0.23 0.00 0.00 176.35 176.38 2akl s LYS 68 N 0.12 1.93 -0.12 1.70 -2.85 -1.26 0.75 119.74 120.02 2akl s LYS 68 Ca -0.07 -0.63 -0.00 0.00 -1.00 0.00 0.00 55.97 54.26 2akl s LYS 68 Cb -0.13 -2.24 0.02 0.00 -2.06 0.00 0.00 37.83 33.42 2akl s LYS 68 CO 0.04 -1.33 -0.08 0.08 0.10 0.00 0.00 175.35 174.15 2akl s VAL 69 N -3.19 1.09 -2.20 1.79 1.01 -1.19 -4.64 120.40 113.08 2akl s VAL 69 Ca 0.63 -0.33 0.26 0.00 0.00 0.00 0.00 61.98 62.54 2akl s VAL 69 Cb -0.08 -1.10 0.29 0.00 0.00 0.00 0.00 36.38 35.49 2akl s VAL 69 CO 0.44 0.38 1.49 2.29 0.00 0.00 0.00 175.10 179.70 2akl n LYS 70 N 4.90 1.35 -0.48 2.72 -0.00 -1.26 -3.60 118.16 121.80 2akl n LYS 70 Ca -0.13 -0.92 0.07 0.00 -0.00 0.00 0.00 58.31 57.32 2akl n LYS 70 Cb 0.50 -1.48 0.17 0.00 -0.00 0.00 0.00 35.03 34.22 2akl n LYS 70 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2akl n GLY 71 N 1.31 4.60 2.66 2.58 0.00 -1.26 -5.04 105.19 110.04 2akl n GLY 71 Ca 0.14 -1.17 -0.13 0.00 0.00 0.00 0.00 46.02 44.86 2akl n GLY 71 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2akl n SER 72 N -1.07 -0.96 -0.00 1.61 7.64 -1.24 -5.02 113.62 114.58 2akl n SER 72 Ca 0.16 -2.57 0.10 0.00 1.01 0.00 0.00 58.87 57.57 2akl n SER 72 Cb 0.71 1.86 -0.12 0.00 -1.01 0.00 0.00 64.21 65.64 2akl n SER 72 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2akl n SER 73 N -1.78 0.80 -4.77 6.43 3.41 -1.26 -4.92 113.62 111.53 2akl n SER 73 Ca 0.02 -0.77 -0.38 0.00 -0.26 0.00 0.00 58.87 57.47 2akl n SER 73 Cb 0.47 1.20 -0.06 0.00 -0.26 0.00 0.00 64.21 65.57 2akl n SER 73 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2akl s LEU 74 N -3.27 4.46 -0.18 1.04 1.02 -1.26 -5.00 118.68 115.49 2akl s LEU 74 Ca 0.04 1.93 -0.04 0.00 0.02 0.00 0.00 54.13 56.09 2akl s LEU 74 Cb 0.15 -3.84 -0.02 0.00 0.02 0.00 0.00 46.19 42.50 2akl s LEU 74 CO 0.84 -0.01 -0.04 -0.69 0.02 0.00 0.00 176.35 176.47 2akl s VAL 75 N -1.42 3.72 -0.58 -1.59 1.01 -1.26 -3.17 120.40 117.11 2akl s VAL 75 Ca 0.47 -0.40 -0.28 0.00 0.00 0.00 0.00 61.98 61.76 2akl s VAL 75 Cb -0.23 -2.65 0.02 0.00 0.00 0.00 0.00 36.38 33.52 2akl s VAL 75 CO 0.29 0.46 1.34 -0.69 0.00 0.00 0.00 175.10 176.50 2akl s VAL 76 N 0.74 3.85 0.09 2.92 1.01 0.23 -4.97 120.40 124.27 2akl s VAL 76 Ca -0.02 0.72 0.04 0.00 0.00 0.00 0.00 61.98 62.72 2akl s VAL 76 Cb -0.14 -4.57 -0.04 0.00 0.00 0.00 0.00 36.38 31.63 2akl s VAL 76 CO 0.02 -1.28 0.06 -1.59 0.00 0.00 0.00 175.10 172.31 2akl s LYS 77 N 5.37 2.79 -0.76 2.72 0.00 -1.26 0.36 119.74 128.97 2akl s LYS 77 Ca 0.48 -0.75 -0.25 0.00 0.00 0.00 0.00 55.97 55.46 2akl s LYS 77 Cb -0.09 -2.67 -0.16 0.00 0.00 0.00 0.00 37.83 34.91 2akl s LYS 77 CO 0.24 0.55 2.45 1.55 0.00 0.00 0.00 175.35 180.14 2akl n VAL 78 N 0.43 -0.03 0.00 1.79 3.14 -0.95 -0.19 118.33 122.52 2akl n VAL 78 Ca -0.09 -0.50 0.00 0.00 -2.96 0.00 0.00 64.34 60.79 2akl n VAL 78 Cb 0.52 -1.67 0.00 0.00 -1.06 0.00 0.00 33.84 31.63 2akl n VAL 78 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 2akl n GLY 79 N 6.24 -0.15 3.58 7.55 0.00 0.11 -4.94 105.19 117.58 2akl n GLY 79 Ca 0.51 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 46.13 2akl n GLY 79 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2akl s THR 80 N -0.77 3.13 -0.25 2.61 2.01 0.74 -4.85 115.64 118.27 2akl s THR 80 Ca 0.00 0.11 -0.19 0.00 0.31 0.00 0.00 61.69 61.92 2akl s THR 80 Cb 0.00 -3.24 -0.02 0.00 0.01 0.00 0.00 72.50 69.24 2akl s THR 80 CO 0.00 -0.20 0.57 -0.75 -0.69 0.00 0.00 174.62 173.55 2akl s LYS 81 N 7.02 4.10 -0.15 4.92 2.20 -1.26 -2.90 119.74 133.67 2akl s LYS 81 Ca 0.92 0.43 -0.01 0.00 -0.36 0.00 0.00 55.97 56.95 2akl s LYS 81 Cb -0.23 -3.64 0.04 0.00 -1.51 0.00 0.00 37.83 32.49 2akl s LYS 81 CO 0.30 -0.35 -0.05 0.08 -0.36 0.00 0.00 175.35 174.96 2akl s VAL 82 N 2.31 1.03 0.24 4.02 1.01 -0.64 -4.99 120.40 123.39 2akl s VAL 82 Ca 0.24 -0.49 0.06 0.00 0.00 0.00 0.00 61.98 61.78 2akl s VAL 82 Cb -0.16 -1.17 -0.03 0.00 0.00 0.00 0.00 36.38 35.02 2akl s VAL 82 CO 0.09 0.19 0.27 -1.59 0.00 0.00 0.00 175.10 174.06 2akl s LYS 83 N 1.68 3.18 -0.90 2.72 -2.85 -1.26 -0.22 119.74 122.09 2akl s LYS 83 Ca 0.02 -0.89 -0.01 0.00 -1.00 0.00 0.00 55.97 54.09 2akl s LYS 83 Cb -0.14 -2.73 0.00 0.00 -2.06 0.00 0.00 37.83 32.89 2akl s LYS 83 CO -0.08 0.42 0.76 0.09 0.10 0.00 0.00 175.35 176.64 2akl n ASN 84 N -1.21 -2.50 -3.41 0.03 3.02 0.12 -4.88 115.26 106.43 2akl n ASN 84 Ca -0.08 -0.45 -0.27 0.00 -0.03 0.00 0.00 54.58 53.74 2akl n ASN 84 Cb 0.57 -3.91 0.24 0.00 -0.61 0.00 0.00 39.78 36.07 2akl n ASN 84 CO 0.00 0.00 0.00 2.30 -2.62 0.00 0.00 177.26 176.94 2akl n ILE 85 N -3.46 0.00 -3.87 2.41 -5.35 -0.91 -4.45 119.36 103.72 2akl n ILE 85 Ca -0.18 -0.36 -0.20 0.00 -0.27 0.00 0.00 62.75 61.74 2akl n ILE 85 Cb 0.61 -1.16 -0.17 0.00 -1.74 0.00 0.00 39.64 37.19 2akl n ILE 85 CO 0.00 0.00 0.00 -0.60 -1.76 0.00 0.00 176.55 174.19 2akl s ARG 86 N -5.19 0.48 -0.10 6.28 6.06 0.18 -0.37 118.95 126.29 2akl s ARG 86 Ca 0.64 0.09 -0.30 0.00 -2.50 0.00 0.00 55.73 53.67 2akl s ARG 86 Cb -0.07 -0.76 -0.01 0.00 0.06 0.00 0.00 34.95 34.16 2akl s ARG 86 CO 0.50 -0.22 1.01 -0.51 -2.50 0.00 0.00 175.30 173.58 2akl s LEU 87 N 1.55 4.25 -0.24 -0.88 1.43 -1.26 0.24 118.68 123.76 2akl s LEU 87 Ca -0.02 1.54 -0.07 0.00 -1.03 0.00 0.00 54.13 54.55 2akl s LEU 87 Cb -0.13 -3.56 -0.03 0.00 0.03 0.00 0.00 46.19 42.50 2akl s LEU 87 CO -0.03 -0.45 0.07 -0.69 0.23 0.00 0.00 176.35 175.47 2akl s VAL 88 N 2.03 4.39 0.00 -1.59 1.01 -1.09 -4.46 120.40 120.69 2akl s VAL 88 Ca 0.49 -0.15 0.00 0.00 0.00 0.00 0.00 61.98 62.32 2akl s VAL 88 Cb -0.18 -3.04 0.00 0.00 0.00 0.00 0.00 36.38 33.16 2akl s VAL 88 CO 0.18 0.36 0.00 0.47 0.00 0.00 0.00 175.10 176.11 2akl n ASP 89 N 4.70 0.00 0.00 3.32 8.00 -1.26 -2.73 116.55 128.58 2akl n ASP 89 Ca -0.16 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.34 2akl n ASP 89 Cb 0.52 -1.27 0.00 0.00 -0.02 0.00 0.00 41.12 40.34 2akl n ASP 89 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2akl n GLY 90 N -2.00 0.00 0.00 0.44 0.00 -1.26 -4.62 105.19 97.75 2akl n GLY 90 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2akl n GLY 90 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2akl n ASP 91 N -0.06 0.00 -2.92 1.61 2.03 -1.10 -0.98 116.55 115.12 2akl n ASP 91 Ca 0.00 0.00 -0.34 0.00 0.52 0.00 0.00 54.79 54.97 2akl n ASP 91 Cb 0.04 0.00 0.01 0.00 -0.72 0.00 0.00 41.12 40.45 2akl n ASP 91 CO 0.00 0.00 0.00 1.57 -1.92 0.00 0.00 177.20 176.85 2akl n HIS 92 N 0.00 3.27 -3.63 -0.67 -0.00 -1.26 -4.52 115.22 108.40 2akl n HIS 92 Ca 0.00 -2.90 -0.06 0.00 0.46 0.00 0.00 57.72 55.21 2akl n HIS 92 Cb 0.00 -0.73 -0.06 0.00 -0.12 0.00 0.00 29.99 29.08 2akl n HIS 92 CO 0.00 0.00 0.00 -0.51 0.46 0.00 0.00 176.34 176.29 2akl s ASP 93 N -2.31 -0.24 -0.11 0.26 1.01 -1.26 -4.77 116.67 109.26 2akl s ASP 93 Ca 0.48 0.41 -0.03 0.00 0.71 0.00 0.00 52.55 54.11 2akl s ASP 93 Cb 0.35 0.39 0.04 0.00 1.01 0.00 0.00 42.92 44.72 2akl s ASP 93 CO -0.25 -0.12 0.07 -0.63 0.21 0.00 0.00 175.17 174.45 2akl s ILE 94 N -0.25 -0.03 -0.07 0.77 1.01 -0.98 -2.67 121.20 118.98 2akl s ILE 94 Ca 0.05 0.10 -0.17 0.00 0.00 0.00 0.00 60.65 60.63 2akl s ILE 94 Cb -0.04 -0.41 -0.05 0.00 0.01 0.00 0.00 42.46 41.98 2akl s ILE 94 CO -0.08 -0.03 0.44 -0.62 0.00 0.00 0.00 174.94 174.64 2akl s ASP 95 N 2.12 6.72 0.03 3.58 2.15 0.14 -1.51 116.67 129.90 2akl s ASP 95 Ca 0.03 0.85 -0.04 0.00 0.43 0.00 0.00 52.55 53.82 2akl s ASP 95 Cb -0.14 -2.27 -0.01 0.00 -0.30 0.00 0.00 42.92 40.20 2akl s ASP 95 CO -0.06 0.14 0.06 0.00 -0.17 0.00 0.00 175.17 175.14 2akl s LYS 97 N -2.49 2.06 -0.22 0.00 1.02 -1.26 -0.36 119.74 118.48 2akl s LYS 97 Ca -0.06 -0.61 0.02 0.00 0.02 0.00 0.00 55.97 55.34 2akl s LYS 97 Cb -0.02 -1.68 0.05 0.00 -0.52 0.00 0.00 37.83 35.65 2akl s LYS 97 CO -0.04 0.16 -0.12 0.42 -0.92 0.00 0.00 175.35 174.85 2akl s ILE 98 N 0.32 1.87 -0.57 2.17 1.01 0.82 -4.93 121.20 121.89 2akl s ILE 98 Ca -0.11 -1.21 -0.27 0.00 0.00 0.00 0.00 60.65 59.06 2akl s ILE 98 Cb -0.15 -1.92 -0.03 0.00 0.01 0.00 0.00 42.46 40.37 2akl s ILE 98 CO 0.04 0.14 1.97 -1.81 0.00 0.00 0.00 174.94 175.28 2akl s ASP 99 N 1.29 5.14 0.00 3.58 1.01 -1.26 -1.31 116.67 125.11 2akl s ASP 99 Ca -0.03 0.55 0.00 0.00 0.71 0.00 0.00 52.55 53.78 2akl s ASP 99 Cb -0.17 -2.52 0.00 0.00 1.01 0.00 0.00 42.92 41.24 2akl s ASP 99 CO -0.08 -2.43 0.00 0.61 0.21 0.00 0.00 175.17 173.48 2akl n GLY 100 N 5.74 1.55 0.13 0.21 0.00 -1.26 -4.92 105.19 106.64 2akl n GLY 100 Ca 0.24 -0.15 -0.24 0.00 0.00 0.00 0.00 46.02 45.87 2akl n GLY 100 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2akl n ILE 101 N 0.00 1.56 -0.21 -0.61 -5.35 -1.17 -5.12 119.36 108.47 2akl n ILE 101 Ca 0.00 -0.38 0.00 0.00 -0.27 0.00 0.00 62.75 62.10 2akl n ILE 101 Cb 0.00 -1.80 0.00 0.00 -1.74 0.00 0.00 39.64 36.10 2akl n ILE 101 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2akl n GLY 102 N 1.64 0.75 3.79 3.28 0.00 -0.43 -5.03 105.19 109.19 2akl n GLY 102 Ca -0.44 -1.69 -0.36 0.00 0.00 0.00 0.00 46.02 43.53 2akl n GLY 102 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2akl s ALA 103 N -1.00 3.27 0.06 4.61 0.00 -1.26 -0.13 121.76 127.31 2akl s ALA 103 Ca 0.00 0.40 0.00 0.00 0.00 0.00 0.00 51.96 52.36 2akl s ALA 103 Cb 0.00 -3.06 -0.04 0.00 0.00 0.00 0.00 23.12 20.02 2akl s ALA 103 CO 0.00 0.22 -0.04 1.41 0.00 0.00 0.00 175.76 177.35 2akl s MET 104 N -2.09 0.65 -0.09 0.00 0.00 0.51 -4.90 119.30 113.38 2akl s MET 104 Ca 0.49 -1.19 0.00 0.00 0.00 0.00 0.00 55.69 54.99 2akl s MET 104 Cb -0.17 0.05 -0.03 0.00 0.00 0.00 0.00 34.83 34.68 2akl s MET 104 CO 0.22 -0.07 -0.08 -1.59 0.00 0.00 0.00 175.02 173.50 2akl s LYS 105 N -3.61 2.94 0.01 4.11 0.00 -1.26 -1.99 119.74 119.94 2akl s LYS 105 Ca 0.06 -0.58 0.07 0.00 0.00 0.00 0.00 55.97 55.52 2akl s LYS 105 Cb 0.05 -2.62 -0.02 0.00 0.00 0.00 0.00 37.83 35.24 2akl s LYS 105 CO -0.07 0.54 -0.21 -0.51 0.00 0.00 0.00 175.35 175.09 2akl s LEU 106 N -0.47 2.09 -0.25 2.77 1.43 -0.57 -4.99 118.68 118.70 2akl s LEU 106 Ca 0.07 -0.44 -0.17 0.00 -1.03 0.00 0.00 54.13 52.55 2akl s LEU 106 Cb -0.12 -1.06 -0.03 0.00 0.03 0.00 0.00 46.19 45.01 2akl s LEU 106 CO 0.02 0.22 0.48 -0.54 0.23 0.00 0.00 176.35 176.77 2akl s LYS 107 N -0.78 4.09 0.36 1.70 3.01 -1.26 -2.32 119.74 124.54 2akl s LYS 107 Ca 0.08 0.29 0.11 0.00 -1.01 0.00 0.00 55.97 55.44 2akl s LYS 107 Cb -0.08 -3.63 0.89 0.00 -1.01 0.00 0.00 37.83 34.00 2akl s LYS 107 CO 0.00 -0.28 1.82 0.66 0.51 0.00 0.00 175.35 178.07 2akl h SER 108 N 7.88 0.62 0.41 2.83 4.64 -1.86 0.18 113.55 128.25 2akl h SER 108 Ca -0.31 0.07 0.00 0.00 -0.47 0.00 0.00 61.79 61.08 2akl h SER 108 Cb 1.15 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 63.19 2akl h SER 108 CO 0.71 0.24 0.00 -1.84 -0.87 0.00 0.00 176.83 175.07 2akl n GLU 109 N -4.63 0.20 0.00 4.77 0.00 -1.26 -1.99 120.64 117.73 2akl n GLU 109 Ca 0.21 0.13 0.05 0.00 0.00 0.00 0.00 57.16 57.55 2akl n GLU 109 Cb 0.62 -1.50 0.00 0.00 0.00 0.00 0.00 31.44 30.56 2akl n GLU 109 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.13 178.32 2akl n PHE 110 N -1.34 0.00 -4.28 -1.84 3.72 0.62 -4.50 117.46 109.84 2akl n PHE 110 Ca 0.08 0.00 -0.28 0.00 -0.05 0.00 0.00 57.45 57.20 2akl n PHE 110 Cb 0.16 0.00 -0.06 0.00 -0.94 0.00 0.00 39.48 38.64 2akl n PHE 110 CO 0.00 0.00 0.00 0.14 -0.05 0.00 0.00 176.76 176.85 2akl s VAL 111 N -1.24 1.72 -0.17 -4.37 -7.23 -0.90 -0.44 120.40 107.77 2akl s VAL 111 Ca 0.08 -1.74 -0.10 0.00 -1.81 0.00 0.00 61.98 58.41 2akl s VAL 111 Cb 0.08 -2.46 0.06 0.00 0.56 0.00 0.00 36.38 34.61 2akl s VAL 111 CO 0.22 0.00 0.41 -0.60 -0.31 0.00 0.00 175.10 174.82 2akl s ARG 112 N -4.00 0.40 -0.01 4.82 3.52 0.32 -2.14 118.95 121.86 2akl s ARG 112 Ca 0.27 0.77 -0.30 0.00 -0.13 0.00 0.00 55.73 56.34 2akl s ARG 112 Cb 0.02 -0.00 -0.06 0.00 -1.56 0.00 0.00 34.95 33.34 2akl s ARG 112 CO 0.16 -0.15 1.63 0.21 -0.81 0.00 0.00 175.30 176.33 2akl s LYS 113 N 1.28 4.20 -0.05 5.12 2.20 -1.26 0.61 119.74 131.85 2akl s LYS 113 Ca -0.09 2.21 -0.21 0.00 -0.36 0.00 0.00 55.97 57.52 2akl s LYS 113 Cb -0.08 -3.82 -0.31 0.00 -1.51 0.00 0.00 37.83 32.11 2akl s LYS 113 CO -0.11 -0.78 0.88 0.28 -0.36 0.00 0.00 175.35 175.25 2akl h VAL 114 N 5.26 1.47 0.00 4.02 2.07 -1.43 -3.47 116.25 124.17 2akl h VAL 114 Ca -0.40 -2.54 0.00 0.00 0.82 0.00 0.00 66.70 64.58 2akl h VAL 114 Cb 1.19 3.16 0.00 0.00 -1.52 0.00 0.00 31.29 34.12 2akl h VAL 114 CO 0.94 0.72 0.00 0.61 0.02 0.00 0.00 177.57 179.86 2akl n GLY 115 N 1.68 0.53 0.00 2.17 0.00 -1.23 -5.03 105.19 103.31 2akl n GLY 115 Ca -0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.87 2akl n GLY 115 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06