#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 4.23 0.15 1.12 0.11 -1.26 -5.01 120.40 119.74 2akl s VAL 2 Ca 0.00 1.79 -0.31 0.00 -2.93 0.00 0.00 61.98 60.53 2akl s VAL 2 Cb 0.00 -3.97 -0.09 0.00 -1.53 0.00 0.00 36.38 30.79 2akl s VAL 2 CO 0.00 0.10 1.44 -0.44 -3.33 0.00 0.00 175.10 172.87 2akl s SER 3 N -1.67 6.75 0.00 3.54 0.01 -1.26 -4.85 113.70 116.22 2akl s SER 3 Ca 0.51 2.44 0.00 0.00 1.31 0.00 0.00 55.95 60.22 2akl s SER 3 Cb -0.18 -2.59 0.00 0.00 0.21 0.00 0.00 66.02 63.46 2akl s SER 3 CO 0.23 -0.69 0.34 1.07 0.41 0.00 0.00 173.24 174.59 2akl n THR 4 N 3.69 0.00 -4.01 1.44 5.66 -1.26 -5.09 114.28 114.71 2akl n THR 4 Ca 0.11 0.00 -0.24 0.00 -3.05 0.00 0.00 64.05 60.87 2akl n THR 4 Cb 0.41 0.62 -0.03 0.00 -1.55 0.00 0.00 70.33 69.78 2akl n THR 4 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 175.07 171.26 2akl s LEU 5 N 0.00 4.15 0.69 1.09 1.43 -1.26 -5.10 118.68 119.68 2akl s LEU 5 Ca 0.00 0.02 -0.15 0.00 -1.03 0.00 0.00 54.13 52.97 2akl s LEU 5 Cb 0.00 -2.71 0.02 0.00 0.03 0.00 0.00 46.19 43.52 2akl s LEU 5 CO 0.00 0.01 1.13 -2.16 0.23 0.00 0.00 176.35 175.56 2akl s PRO 6 N -3.52 2.57 0.10 1.29 0.04 -1.26 -5.03 135.00 129.18 2akl s PRO 6 Ca 0.33 1.47 -0.02 0.00 0.04 0.00 0.00 61.00 62.83 2akl s PRO 6 Cb -0.10 -1.91 0.02 0.00 0.04 0.00 0.00 34.50 32.55 2akl s PRO 6 CO 0.27 -1.44 0.10 -2.30 0.04 0.00 0.00 177.00 173.67 2akl n PRO 7 N -2.58 -0.91 -3.54 0.56 -0.02 -1.26 -4.83 135.00 122.42 2akl n PRO 7 Ca 0.11 -0.16 -0.38 0.00 -2.02 0.00 0.00 63.50 61.06 2akl n PRO 7 Cb 0.52 -0.14 -0.09 0.00 -0.02 0.00 0.00 33.50 33.77 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 4.63 0.36 -0.03 0.00 -0.04 -1.26 0.56 135.00 139.22 2akl n PRO 9 Ca -0.12 0.00 -0.04 0.00 -0.04 0.00 0.00 63.50 63.30 2akl n PRO 9 Cb 0.52 -1.15 -0.03 0.00 -0.04 0.00 0.00 33.50 32.79 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 -0.65 0.55 -0.07 0.54 6.02 -1.26 -4.88 117.38 117.63 2akl n GLN 10 Ca 0.03 0.03 -0.15 0.00 -0.01 0.00 0.00 57.00 56.90 2akl n GLN 10 Cb 0.01 -1.12 -0.05 0.00 1.02 0.00 0.00 30.24 30.10 2akl n GLN 10 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2akl n ASN 12 N -3.52 0.00 0.00 0.00 2.85 0.19 -4.93 115.26 109.85 2akl n ASN 12 Ca -0.28 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.19 2akl n ASN 12 Cb 0.72 -0.92 0.00 0.00 1.24 0.00 0.00 39.78 40.82 2akl n ASN 12 CO 0.00 0.00 0.00 -1.54 -2.11 0.00 0.00 177.26 173.61 2akl n SER 13 N 0.00 0.00 0.00 1.20 3.41 -1.26 -4.70 113.62 112.27 2akl n SER 13 Ca 0.00 0.65 0.00 0.00 -0.26 0.00 0.00 58.87 59.26 2akl n SER 13 Cb 0.00 -0.15 0.00 0.00 -0.26 0.00 0.00 64.21 63.80 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 -1.32 0.00 -0.25 4.33 0.28 -1.26 -5.02 120.64 117.40 2akl n GLU 14 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.00 2akl n GLU 14 Cb 0.00 0.00 0.00 0.00 1.43 0.00 0.00 31.44 32.87 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 0.00 -3.74 -1.84 4.02 -1.26 -4.80 117.16 109.53 2akl n TYR 15 Ca 0.00 -0.72 -0.37 0.00 -0.01 0.00 0.00 57.90 56.80 2akl n TYR 15 Cb 0.00 -0.37 -0.06 0.00 -0.02 0.00 0.00 39.34 38.89 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 0.10 5.35 0.29 -0.72 2.01 -1.26 -4.01 115.64 117.40 2akl s THR 16 Ca 0.00 0.41 -0.04 0.00 0.31 0.00 0.00 61.69 62.37 2akl s THR 16 Cb 0.00 -3.51 -0.01 0.00 0.01 0.00 0.00 72.50 68.99 2akl s THR 16 CO 0.00 0.59 0.41 -0.72 -0.69 0.00 0.00 174.62 174.20 2akl s TYR 17 N -0.89 0.93 -0.15 4.92 1.13 -1.16 -4.91 117.35 117.22 2akl s TYR 17 Ca 0.17 -1.18 -0.04 0.00 -1.41 0.00 0.00 57.07 54.62 2akl s TYR 17 Cb -0.13 -0.12 -0.03 0.00 -1.10 0.00 0.00 41.96 40.57 2akl s TYR 17 CO 0.06 -1.00 -0.02 -1.83 -2.51 0.00 0.00 175.55 170.25 2akl s GLU 18 N -3.52 3.66 -0.59 -3.49 4.04 -1.26 -1.61 118.70 115.93 2akl s GLU 18 Ca 0.30 -0.48 0.04 0.00 0.04 0.00 0.00 54.97 54.87 2akl s GLU 18 Cb 0.01 -2.95 0.15 0.00 0.02 0.00 0.00 34.13 31.36 2akl s GLU 18 CO 0.16 0.29 0.38 0.34 -1.84 0.00 0.00 175.26 174.59 2akl s ASP 19 N 0.25 4.25 0.30 0.83 2.15 -1.13 -4.95 116.67 118.37 2akl s ASP 19 Ca -0.02 -3.38 0.00 0.00 0.43 0.00 0.00 52.55 49.59 2akl s ASP 19 Cb -0.14 -1.46 0.00 0.00 -0.30 0.00 0.00 42.92 41.02 2akl s ASP 19 CO 0.02 -0.16 0.00 0.61 -0.17 0.00 0.00 175.17 175.47 2akl n GLY 20 N 2.59 1.15 0.89 2.66 0.00 -1.26 -4.17 105.19 107.05 2akl n GLY 20 Ca 0.15 -0.75 0.09 0.00 0.00 0.00 0.00 46.02 45.50 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 2.99 -3.33 4.61 0.00 -1.26 -4.99 120.51 122.07 2akl n ALA 21 Ca 0.00 -2.31 -0.01 0.00 0.00 0.00 0.00 53.44 51.12 2akl n ALA 21 Cb 0.00 -0.71 0.01 0.00 0.00 0.00 0.00 19.45 18.74 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 -0.51 0.00 -4.45 0.00 -0.00 -1.26 -4.96 117.00 105.82 2akl n LEU 22 Ca 0.21 -1.03 -0.33 0.00 -0.00 0.00 0.00 56.01 54.87 2akl n LEU 22 Cb 0.89 1.38 -0.13 0.00 -0.00 0.00 0.00 43.42 45.56 2akl n LEU 22 CO 0.15 -0.32 -0.45 -0.76 -0.00 0.00 0.00 177.39 176.01 2akl s LEU 23 N 0.00 2.72 0.01 1.47 1.43 -0.44 -2.83 118.68 121.04 2akl s LEU 23 Ca 0.07 -0.23 0.05 0.00 -1.03 0.00 0.00 54.13 52.99 2akl s LEU 23 Cb -0.02 -1.57 -0.02 0.00 0.03 0.00 0.00 46.19 44.62 2akl s LEU 23 CO 0.05 0.30 -0.16 0.68 0.23 0.00 0.00 176.35 177.45 2akl s VAL 24 N -0.45 1.29 -0.40 -1.59 -7.23 -0.63 -0.46 120.40 110.92 2akl s VAL 24 Ca 0.06 -0.86 -0.09 0.00 -1.81 0.00 0.00 61.98 59.28 2akl s VAL 24 Cb -0.12 -1.11 0.06 0.00 0.56 0.00 0.00 36.38 35.78 2akl s VAL 24 CO 0.02 0.23 0.23 0.00 -0.31 0.00 0.00 175.10 175.27 2akl n PRO 26 N 4.93 0.01 0.07 0.00 -0.04 -1.26 -1.61 135.00 137.10 2akl n PRO 26 Ca -0.11 0.31 -0.04 0.00 -0.04 0.00 0.00 63.50 63.62 2akl n PRO 26 Cb 0.44 -1.51 -0.02 0.00 -0.04 0.00 0.00 33.50 32.37 2akl n PRO 26 CO 0.00 0.00 0.00 1.49 -0.04 0.00 0.00 175.50 176.95 2akl h GLU 27 N 0.00 -0.24 -0.68 0.54 4.81 -1.92 -3.36 114.58 113.73 2akl h GLU 27 Ca 0.00 0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.25 2akl h GLU 27 Cb 0.20 0.05 0.00 0.00 0.63 0.00 0.00 28.75 29.63 2akl h GLU 27 CO 0.00 -0.16 0.00 0.00 -0.73 0.00 0.00 179.01 178.12 2akl n ALA 29 N 1.53 -0.46 -2.97 0.00 0.00 -0.63 -4.99 120.51 112.99 2akl n ALA 29 Ca 0.23 0.20 -0.29 0.00 0.00 0.00 0.00 53.44 53.58 2akl n ALA 29 Cb 0.58 -1.96 -0.16 0.00 0.00 0.00 0.00 19.45 17.91 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 -2.84 2.09 0.45 0.00 3.76 -1.19 -5.00 115.29 112.56 2akl s HIS 30 Ca 0.00 -0.68 -0.02 0.00 -0.15 0.00 0.00 55.06 54.21 2akl s HIS 30 Cb 0.00 -1.40 -0.01 0.00 1.11 0.00 0.00 32.58 32.27 2akl s HIS 30 CO 0.00 -0.25 0.70 -1.21 -0.85 0.00 0.00 174.74 173.13 2akl s GLU 31 N 0.10 3.23 0.14 1.40 8.01 -1.26 -2.09 118.70 128.24 2akl s GLU 31 Ca -0.08 -0.24 -0.24 0.00 0.01 0.00 0.00 54.97 54.42 2akl s GLU 31 Cb -0.14 -2.50 0.07 0.00 -4.31 0.00 0.00 34.13 27.24 2akl s GLU 31 CO 0.04 -0.23 0.71 1.67 0.01 0.00 0.00 175.26 177.47 2akl s TRP 32 N -2.60 -0.40 -0.11 1.61 1.48 0.39 -4.95 118.94 114.35 2akl s TRP 32 Ca 0.47 0.16 -0.02 0.00 -1.06 0.00 0.00 56.10 55.65 2akl s TRP 32 Cb -0.10 0.59 -0.03 0.00 -1.16 0.00 0.00 33.47 32.77 2akl s TRP 32 CO 0.40 -0.85 -0.05 0.45 -4.06 0.00 0.00 176.95 172.84 2akl s SER 33 N -2.74 4.74 0.60 -2.66 0.15 -1.26 -1.33 113.70 111.21 2akl s SER 33 Ca 0.05 -0.07 0.33 0.00 0.70 0.00 0.00 55.95 56.96 2akl s SER 33 Cb -0.02 -1.51 1.95 0.00 -1.71 0.00 0.00 66.02 64.73 2akl s SER 33 CO -0.07 0.27 2.27 1.55 1.20 0.00 0.00 173.24 178.45 2akl h PRO 34 N 5.98 0.00 0.00 5.44 0.13 -1.93 -3.05 132.00 138.58 2akl h PRO 34 Ca -0.40 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.73 2akl h PRO 34 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 2akl h PRO 34 CO 0.57 0.01 -0.44 0.09 -0.23 0.00 0.00 178.00 178.00 2akl n ASN 35 N -3.63 1.45 -0.00 1.44 3.02 -1.26 -4.83 115.26 111.44 2akl n ASN 35 Ca -0.03 0.00 0.16 0.00 -0.03 0.00 0.00 54.58 54.68 2akl n ASN 35 Cb 0.09 0.00 0.92 0.00 -0.61 0.00 0.00 39.78 40.18 2akl n ASN 35 CO 0.00 0.00 0.00 1.21 -2.62 0.00 0.00 177.26 175.85 2akl n GLU 36 N -2.08 0.92 0.00 3.52 0.00 -1.25 -2.95 120.64 118.79 2akl n GLU 36 Ca 0.00 -0.01 0.10 0.00 0.00 0.00 0.00 57.16 57.25 2akl n GLU 36 Cb 0.22 -1.50 0.49 0.00 0.00 0.00 0.00 31.44 30.65 2akl n GLU 36 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2akl n ALA 37 N -1.04 2.04 0.28 4.31 0.00 -1.15 -2.37 120.51 122.59 2akl n ALA 37 Ca 0.22 -0.09 0.17 0.00 0.00 0.00 0.00 53.44 53.75 2akl n ALA 37 Cb 0.13 -1.32 0.73 0.00 0.00 0.00 0.00 19.45 19.00 2akl n ALA 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2akl h ALA 38 N 2.93 1.01 -2.59 0.00 0.00 -1.83 -3.44 119.26 115.34 2akl h ALA 38 Ca 0.00 -0.01 -0.52 0.00 0.00 0.00 0.00 54.91 54.38 2akl h ALA 38 Cb 0.18 -0.00 0.12 0.00 0.00 0.00 0.00 17.79 18.08 2akl h ALA 38 CO 0.00 0.02 0.40 0.99 0.00 0.00 0.00 179.25 180.65 2akl s THR 39 N -3.73 2.89 -0.20 0.00 2.01 -1.00 -5.04 115.64 110.57 2akl s THR 39 Ca 0.00 0.45 -0.01 0.00 0.31 0.00 0.00 61.69 62.44 2akl s THR 39 Cb 0.09 -3.02 0.06 0.00 0.01 0.00 0.00 72.50 69.64 2akl s THR 39 CO 0.53 -0.22 -0.01 0.00 -0.69 0.00 0.00 174.62 174.24 2akl s ALA 40 N -2.07 1.37 -0.72 7.40 0.00 -1.26 -5.08 121.76 121.40 2akl s ALA 40 Ca 0.71 -0.91 -0.26 0.00 0.00 0.00 0.00 51.96 51.50 2akl s ALA 40 Cb -0.25 -1.24 0.04 0.00 0.00 0.00 0.00 23.12 21.67 2akl s ALA 40 CO 0.40 -1.10 1.21 -1.12 0.00 0.00 0.00 175.76 175.14 2akl s SER 41 N 1.68 6.18 -0.01 0.00 0.01 -1.26 -4.97 113.70 115.33 2akl s SER 41 Ca -0.02 -0.54 -0.07 0.00 1.31 0.00 0.00 55.95 56.63 2akl s SER 41 Cb -0.17 -2.53 0.00 0.00 0.21 0.00 0.00 66.02 63.53 2akl s SER 41 CO -0.07 -1.74 0.14 -0.62 0.41 0.00 0.00 173.24 171.36 2akl s ASP 42 N 3.69 -0.01 0.00 2.44 2.15 -1.26 -5.03 116.67 118.64 2akl s ASP 42 Ca 0.33 -0.10 0.00 0.00 0.43 0.00 0.00 52.55 53.20 2akl s ASP 42 Cb -0.10 0.23 0.00 0.00 -0.30 0.00 0.00 42.92 42.75 2akl s ASP 42 CO 0.14 -0.31 0.00 -0.67 -0.17 0.00 0.00 175.17 174.17 2akl n ASP 43 N 1.75 1.79 -2.67 -0.34 2.03 -1.26 -4.96 116.55 112.88 2akl n ASP 43 Ca -0.21 0.00 -0.02 0.00 0.52 0.00 0.00 54.79 55.08 2akl n ASP 43 Cb 0.56 0.00 0.13 0.00 -0.72 0.00 0.00 41.12 41.09 2akl n ASP 43 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2akl n GLY 44 N 2.52 2.05 0.05 0.27 0.00 -1.26 -4.92 105.19 103.90 2akl n GLY 44 Ca 0.00 -0.18 -0.05 0.00 0.00 0.00 0.00 46.02 45.79 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 -1.54 2.13 -4.11 1.61 5.02 -1.26 -4.74 118.16 115.26 2akl n LYS 45 Ca -0.18 0.01 -0.32 0.00 -2.02 0.00 0.00 58.31 55.80 2akl n LYS 45 Cb 0.88 -1.24 -0.07 0.00 -0.02 0.00 0.00 35.03 34.58 2akl n LYS 45 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2akl s VAL 46 N -2.23 4.57 0.04 -0.18 1.01 -1.26 -4.79 120.40 117.56 2akl s VAL 46 Ca -0.06 -0.56 -0.24 0.00 0.00 0.00 0.00 61.98 61.11 2akl s VAL 46 Cb 0.03 -3.12 -0.05 0.00 0.00 0.00 0.00 36.38 33.24 2akl s VAL 46 CO 0.36 0.28 0.75 -0.63 0.00 0.00 0.00 175.10 175.86 2akl s ILE 47 N -1.24 4.74 0.09 2.22 -1.09 -1.26 -4.95 121.20 119.72 2akl s ILE 47 Ca 0.24 1.58 0.06 0.00 -2.23 0.00 0.00 60.65 60.31 2akl s ILE 47 Cb -0.12 -4.09 -0.04 0.00 -1.58 0.00 0.00 42.46 36.63 2akl s ILE 47 CO 0.16 0.37 -0.08 -0.54 -1.23 0.00 0.00 174.94 173.62 2akl s LYS 48 N -0.09 2.23 0.66 2.79 1.02 -1.26 -2.23 119.74 122.85 2akl s LYS 48 Ca 0.38 -0.97 0.03 0.00 0.02 0.00 0.00 55.97 55.43 2akl s LYS 48 Cb -0.20 -2.36 0.11 0.00 -0.52 0.00 0.00 37.83 34.86 2akl s LYS 48 CO 0.22 0.52 0.91 -0.51 -0.92 0.00 0.00 175.35 175.58 2akl s ASP 49 N -2.14 4.64 0.00 2.83 1.11 0.40 -4.47 116.67 119.04 2akl s ASP 49 Ca 0.22 -0.54 0.19 0.00 0.18 0.00 0.00 52.55 52.59 2akl s ASP 49 Cb -0.11 0.08 0.89 0.00 1.07 0.00 0.00 42.92 44.85 2akl s ASP 49 CO 0.14 -1.65 1.59 -0.24 1.18 0.00 0.00 175.17 176.18 2akl n SER 50 N -2.60 0.00 0.06 0.27 2.88 -0.68 -1.90 113.62 111.64 2akl n SER 50 Ca 0.15 0.21 0.12 0.00 -1.33 0.00 0.00 58.87 58.02 2akl n SER 50 Cb 0.61 -0.37 0.19 0.00 -0.75 0.00 0.00 64.21 63.89 2akl n SER 50 CO 0.00 0.00 0.00 0.52 -1.23 0.00 0.00 175.04 174.33 2akl n VAL 51 N -1.37 0.33 -0.37 2.46 0.31 -1.26 -4.92 118.33 113.51 2akl n VAL 51 Ca 0.07 -0.25 0.00 0.00 -0.01 0.00 0.00 64.34 64.15 2akl n VAL 51 Cb 0.18 -0.11 0.00 0.00 -0.91 0.00 0.00 33.84 33.00 2akl n VAL 51 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2akl n GLY 52 N 1.35 0.71 3.94 2.92 0.00 -0.80 -5.06 105.19 108.25 2akl n GLY 52 Ca 0.04 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.81 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 -2.83 6.31 -0.12 1.61 6.03 -1.26 -4.83 114.94 119.87 2akl s ASN 53 Ca 0.00 0.46 -0.02 0.00 -1.03 0.00 0.00 52.86 52.27 2akl s ASN 53 Cb 0.00 -2.04 -0.03 0.00 -3.03 0.00 0.00 41.25 36.16 2akl s ASN 53 CO 0.00 -0.26 -0.03 -0.69 -2.03 0.00 0.00 177.10 174.08 2akl s VAL 54 N -2.26 3.97 0.74 3.54 1.01 -1.26 -0.45 120.40 125.69 2akl s VAL 54 Ca 0.40 -0.35 -0.01 0.00 0.00 0.00 0.00 61.98 62.02 2akl s VAL 54 Cb -0.10 -2.69 0.14 0.00 0.00 0.00 0.00 36.38 33.73 2akl s VAL 54 CO 0.35 0.55 1.01 -0.76 0.00 0.00 0.00 175.10 176.25 2akl s LEU 55 N -0.26 2.95 0.15 3.92 1.43 -0.95 -5.01 118.68 120.91 2akl s LEU 55 Ca 0.05 -0.45 0.08 0.00 -1.03 0.00 0.00 54.13 52.78 2akl s LEU 55 Cb -0.13 -1.82 -0.04 0.00 0.03 0.00 0.00 46.19 44.23 2akl s LEU 55 CO 0.02 -1.94 -0.17 0.00 0.23 0.00 0.00 176.35 174.48 2akl s GLN 56 N -5.17 1.21 -0.46 1.70 -2.07 -1.26 -4.80 119.66 108.81 2akl s GLN 56 Ca 0.67 -1.35 -0.27 0.00 -1.82 0.00 0.00 55.36 52.59 2akl s GLN 56 Cb -0.05 -1.24 -0.03 0.00 -1.09 0.00 0.00 33.01 30.61 2akl s GLN 56 CO 0.45 0.25 1.97 0.34 -1.32 0.00 0.00 175.29 176.98 2akl s ASP 57 N -2.57 5.36 0.00 12.60 2.15 -1.26 -1.20 116.67 131.74 2akl s ASP 57 Ca 0.14 0.95 0.00 0.00 0.43 0.00 0.00 52.55 54.07 2akl s ASP 57 Cb -0.06 -2.52 0.00 0.00 -0.30 0.00 0.00 42.92 40.04 2akl s ASP 57 CO 0.06 -2.20 0.00 0.61 -0.17 0.00 0.00 175.17 173.47 2akl n GLY 58 N 5.66 0.82 3.88 2.66 0.00 0.22 -4.93 105.19 113.50 2akl n GLY 58 Ca 0.25 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.98 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 -1.12 4.02 -0.11 1.61 -1.08 -0.34 -3.12 116.67 116.52 2akl s ASP 59 Ca 0.00 0.72 -0.03 0.00 -0.52 0.00 0.00 52.55 52.71 2akl s ASP 59 Cb 0.00 -1.13 -0.03 0.00 -1.46 0.00 0.00 42.92 40.29 2akl s ASP 59 CO 0.00 -2.21 0.02 -0.89 0.52 0.00 0.00 175.17 172.61 2akl s THR 60 N -3.57 4.42 0.37 1.71 2.01 -1.26 -0.47 115.64 118.84 2akl s THR 60 Ca 0.65 -0.20 0.08 0.00 0.31 0.00 0.00 61.69 62.53 2akl s THR 60 Cb -0.10 -2.89 -0.07 0.00 0.01 0.00 0.00 72.50 69.45 2akl s THR 60 CO 0.51 0.58 -0.03 0.27 -0.69 0.00 0.00 174.62 175.25 2akl s ILE 61 N -0.59 2.03 -0.18 1.82 -5.25 0.68 -1.51 121.20 118.20 2akl s ILE 61 Ca 0.10 -2.09 -0.05 0.00 -0.99 0.00 0.00 60.65 57.62 2akl s ILE 61 Cb -0.12 -2.82 0.09 0.00 2.95 0.00 0.00 42.46 42.56 2akl s ILE 61 CO 0.02 -0.10 0.33 -0.89 -1.79 0.00 0.00 174.94 172.52 2akl s THR 62 N -2.72 -0.52 0.19 8.37 2.01 0.16 -1.75 115.64 121.36 2akl s THR 62 Ca 0.34 0.14 -0.32 0.00 0.31 0.00 0.00 61.69 62.16 2akl s THR 62 Cb 0.07 -0.61 -0.12 0.00 0.01 0.00 0.00 72.50 71.85 2akl s THR 62 CO 0.17 0.03 1.75 0.55 -0.69 0.00 0.00 174.62 176.42 2akl n VAL 63 N 5.36 0.09 -0.77 3.82 3.14 -1.15 -0.53 118.33 128.29 2akl n VAL 63 Ca -0.06 -0.02 0.08 0.00 -2.96 0.00 0.00 64.34 61.38 2akl n VAL 63 Cb 0.50 -2.01 0.38 0.00 -1.06 0.00 0.00 33.84 31.65 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 4.13 2.29 -4.16 1.55 -0.00 -0.52 -0.14 119.36 122.51 2akl n ILE 64 Ca 0.17 -1.32 -0.10 0.00 -0.00 0.00 0.00 62.75 61.49 2akl n ILE 64 Cb 0.35 -0.07 -0.10 0.00 -0.00 0.00 0.00 39.64 39.82 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 -2.31 0.86 -0.47 6.28 3.01 -1.25 -4.80 119.74 121.06 2akl s LYS 65 Ca 0.53 -1.37 -0.26 0.00 -1.01 0.00 0.00 55.97 53.86 2akl s LYS 65 Cb 0.37 -0.04 0.03 0.00 -1.01 0.00 0.00 37.83 37.18 2akl s LYS 65 CO 0.20 -0.11 0.97 0.16 0.51 0.00 0.00 175.35 177.08 2akl s ASP 66 N -3.04 6.51 0.05 2.83 -4.77 -1.26 -2.36 116.67 114.63 2akl s ASP 66 Ca 0.15 0.16 0.06 0.00 -3.30 0.00 0.00 52.55 49.63 2akl s ASP 66 Cb 0.07 -2.47 -0.02 0.00 -1.09 0.00 0.00 42.92 39.40 2akl s ASP 66 CO -0.03 -1.11 -0.18 -0.76 0.70 0.00 0.00 175.17 173.80 2akl s LEU 67 N 3.92 2.19 0.69 2.11 1.43 0.15 -5.02 118.68 124.15 2akl s LEU 67 Ca 0.39 -0.52 -0.02 0.00 -1.03 0.00 0.00 54.13 52.95 2akl s LEU 67 Cb -0.10 -0.80 0.10 0.00 0.03 0.00 0.00 46.19 45.42 2akl s LEU 67 CO 0.27 0.09 0.96 -1.59 0.23 0.00 0.00 176.35 176.32 2akl s LYS 68 N -1.26 1.89 -0.09 1.70 -2.85 -1.26 0.45 119.74 118.33 2akl s LYS 68 Ca 0.05 -0.86 0.03 0.00 -1.00 0.00 0.00 55.97 54.19 2akl s LYS 68 Cb -0.09 -2.31 0.00 0.00 -2.06 0.00 0.00 37.83 33.37 2akl s LYS 68 CO 0.02 -1.30 -0.20 0.08 0.10 0.00 0.00 175.35 174.05 2akl s VAL 69 N -3.11 1.72 -0.03 1.79 1.01 -1.13 -4.62 120.40 116.01 2akl s VAL 69 Ca 0.64 -0.82 -0.08 0.00 0.00 0.00 0.00 61.98 61.72 2akl s VAL 69 Cb -0.07 -1.50 -0.04 0.00 0.00 0.00 0.00 36.38 34.76 2akl s VAL 69 CO 0.43 0.48 0.43 0.11 0.00 0.00 0.00 175.10 176.56 2akl h LYS 70 N 6.78 -0.28 0.00 2.72 1.57 -2.00 -3.35 116.57 122.02 2akl h LYS 70 Ca -0.24 0.02 -0.03 0.00 -1.87 0.00 0.00 60.65 58.53 2akl h LYS 70 Cb 1.22 0.06 -0.00 0.00 0.08 0.00 0.00 32.23 33.59 2akl h LYS 70 CO 0.47 -0.18 -0.14 0.78 -0.57 0.00 0.00 179.45 179.80 2akl h GLY 71 N -0.75 0.00 -4.11 3.86 0.00 -1.97 -3.44 103.07 96.66 2akl h GLY 71 Ca -0.03 0.00 -0.65 0.00 0.00 0.00 0.00 47.33 46.65 2akl h GLY 71 CO 0.05 0.00 -0.72 -0.56 0.00 0.00 0.00 176.54 175.30 2akl s SER 72 N -6.03 4.46 0.00 0.19 0.01 -1.26 -4.99 113.70 106.09 2akl s SER 72 Ca -0.00 -0.40 0.23 0.00 1.31 0.00 0.00 55.95 57.09 2akl s SER 72 Cb 0.11 -0.87 1.37 0.00 0.21 0.00 0.00 66.02 66.84 2akl s SER 72 CO 0.60 0.16 1.75 -1.20 0.41 0.00 0.00 173.24 174.95 2akl n SER 73 N 0.52 0.00 -4.77 2.44 7.64 -1.26 -4.51 113.62 113.67 2akl n SER 73 Ca -0.12 -0.70 -0.38 0.00 1.01 0.00 0.00 58.87 58.68 2akl n SER 73 Cb 0.53 -0.01 -0.06 0.00 -1.01 0.00 0.00 64.21 63.66 2akl n SER 73 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2akl s LEU 74 N -2.02 4.38 -0.13 -3.43 2.01 -1.26 -4.99 118.68 113.25 2akl s LEU 74 Ca 0.34 1.94 -0.03 0.00 0.01 0.00 0.00 54.13 56.39 2akl s LEU 74 Cb 0.16 -3.93 -0.03 0.00 0.01 0.00 0.00 46.19 42.40 2akl s LEU 74 CO 0.27 -0.11 -0.01 -0.69 1.01 0.00 0.00 176.35 176.82 2akl s VAL 75 N -1.50 4.17 -0.62 -1.59 1.01 -1.26 -2.85 120.40 117.77 2akl s VAL 75 Ca 0.49 -0.28 -0.22 0.00 0.00 0.00 0.00 61.98 61.97 2akl s VAL 75 Cb -0.22 -2.80 0.07 0.00 0.00 0.00 0.00 36.38 33.43 2akl s VAL 75 CO 0.28 0.54 0.89 -0.69 0.00 0.00 0.00 175.10 176.12 2akl s VAL 76 N -0.21 4.45 0.04 2.92 1.01 0.17 -4.97 120.40 123.81 2akl s VAL 76 Ca 0.05 -0.33 0.01 0.00 0.00 0.00 0.00 61.98 61.71 2akl s VAL 76 Cb -0.13 -4.60 -0.04 0.00 0.00 0.00 0.00 36.38 31.62 2akl s VAL 76 CO 0.02 -1.29 0.09 -1.59 0.00 0.00 0.00 175.10 172.33 2akl s LYS 77 N 3.73 3.00 -0.76 2.72 0.00 -1.26 0.34 119.74 127.51 2akl s LYS 77 Ca 0.22 -0.58 -0.25 0.00 0.00 0.00 0.00 55.97 55.36 2akl s LYS 77 Cb -0.17 -2.81 -0.16 0.00 0.00 0.00 0.00 37.83 34.69 2akl s LYS 77 CO 0.11 0.61 2.46 1.55 0.00 0.00 0.00 175.35 180.09 2akl n VAL 78 N 0.78 -0.04 0.00 1.79 3.14 -1.00 0.23 118.33 123.24 2akl n VAL 78 Ca -0.10 -0.48 0.00 0.00 -2.96 0.00 0.00 64.34 60.80 2akl n VAL 78 Cb 0.52 -1.61 0.00 0.00 -1.06 0.00 0.00 33.84 31.69 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 6.23 0.02 3.58 7.55 0.00 0.81 -4.93 105.19 118.44 2akl n GLY 79 Ca 0.51 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 46.14 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 -0.92 3.12 -0.36 2.61 2.01 0.13 -4.86 115.64 117.38 2akl s THR 80 Ca 0.00 0.10 -0.20 0.00 0.31 0.00 0.00 61.69 61.90 2akl s THR 80 Cb 0.00 -3.22 0.00 0.00 0.01 0.00 0.00 72.50 69.29 2akl s THR 80 CO 0.00 -0.18 0.61 -0.75 -0.69 0.00 0.00 174.62 173.61 2akl s LYS 81 N 7.06 3.62 -0.18 4.92 2.20 -1.26 -2.92 119.74 133.18 2akl s LYS 81 Ca 0.92 -0.04 0.01 0.00 -0.36 0.00 0.00 55.97 56.50 2akl s LYS 81 Cb -0.23 -3.83 0.03 0.00 -1.51 0.00 0.00 37.83 32.29 2akl s LYS 81 CO 0.30 -0.75 -0.16 0.08 -0.36 0.00 0.00 175.35 174.45 2akl s VAL 82 N 2.66 1.85 0.20 4.02 1.01 -0.72 -4.98 120.40 124.44 2akl s VAL 82 Ca 0.23 -0.90 0.02 0.00 0.00 0.00 0.00 61.98 61.32 2akl s VAL 82 Cb -0.15 -1.75 -0.04 0.00 0.00 0.00 0.00 36.38 34.45 2akl s VAL 82 CO 0.15 0.42 0.35 -1.59 0.00 0.00 0.00 175.10 174.43 2akl s LYS 83 N 1.35 3.47 -1.02 2.72 -2.85 -1.26 -0.23 119.74 121.93 2akl s LYS 83 Ca 0.03 -0.53 -0.00 0.00 -1.00 0.00 0.00 55.97 54.47 2akl s LYS 83 Cb -0.14 -2.89 0.00 0.00 -2.06 0.00 0.00 37.83 32.75 2akl s LYS 83 CO -0.11 0.43 0.85 0.09 0.10 0.00 0.00 175.35 176.71 2akl n ASN 84 N -0.85 -2.07 -3.83 0.03 3.02 0.37 -4.77 115.26 107.16 2akl n ASN 84 Ca -0.06 -0.52 -0.30 0.00 -0.03 0.00 0.00 54.58 53.66 2akl n ASN 84 Cb 0.55 -4.42 0.26 0.00 -0.61 0.00 0.00 39.78 35.56 2akl n ASN 84 CO 0.00 0.00 0.00 0.27 -2.62 0.00 0.00 177.26 174.91 2akl s ILE 85 N -3.30 1.53 -0.09 2.41 -4.36 -0.74 -4.51 121.20 112.13 2akl s ILE 85 Ca 0.00 0.00 -0.00 0.00 -0.26 0.00 0.00 60.65 60.39 2akl s ILE 85 Cb -0.00 -2.24 0.02 0.00 1.25 0.00 0.00 42.46 41.49 2akl s ILE 85 CO 0.62 0.00 -0.06 -0.60 0.24 0.00 0.00 174.94 175.14 2akl s ARG 86 N -5.08 1.22 -0.13 0.37 6.06 -0.57 -0.61 118.95 120.22 2akl s ARG 86 Ca 0.69 -0.15 -0.24 0.00 -2.50 0.00 0.00 55.73 53.53 2akl s ARG 86 Cb -0.14 -1.33 -0.03 0.00 0.06 0.00 0.00 34.95 33.51 2akl s ARG 86 CO 0.58 -0.23 0.75 -0.51 -2.50 0.00 0.00 175.30 173.39 2akl s LEU 87 N 1.61 4.23 0.00 -0.88 1.43 -1.26 -0.80 118.68 123.01 2akl s LEU 87 Ca 0.02 1.13 0.08 0.00 -1.03 0.00 0.00 54.13 54.33 2akl s LEU 87 Cb -0.13 -3.12 0.08 0.00 0.03 0.00 0.00 46.19 43.05 2akl s LEU 87 CO -0.05 -0.26 0.69 0.52 0.23 0.00 0.00 176.35 177.47 2akl n VAL 88 N 4.33 0.00 -0.22 -1.59 0.31 -0.96 -4.97 118.33 115.23 2akl n VAL 88 Ca 0.01 -2.08 -0.07 0.00 -0.01 0.00 0.00 64.34 62.20 2akl n VAL 88 Cb 0.50 -0.33 0.04 0.00 -0.91 0.00 0.00 33.84 33.14 2akl n VAL 88 CO 0.00 0.00 0.00 0.44 -1.32 0.00 0.00 176.83 175.95 2akl h ASP 89 N 0.30 0.83 -4.09 4.52 5.19 -1.86 -3.44 116.42 117.86 2akl h ASP 89 Ca -0.31 -0.14 -0.49 0.00 -0.62 0.00 0.00 57.03 55.47 2akl h ASP 89 Cb 1.29 -0.21 0.06 0.00 0.18 0.00 0.00 39.33 40.65 2akl h ASP 89 CO 0.45 0.73 0.31 -0.83 -3.12 0.00 0.00 179.24 176.79 2akl s GLY 90 N -3.08 1.61 0.25 2.75 0.00 -1.26 -4.68 107.32 102.91 2akl s GLY 90 Ca -0.13 -0.36 0.07 0.00 0.00 0.00 0.00 44.72 44.30 2akl s GLY 90 CO 0.79 -0.08 1.59 -0.55 0.00 0.00 0.00 173.10 174.84 2akl h ASP 91 N -0.27 0.14 -0.80 1.64 5.19 -1.85 -3.16 116.42 117.32 2akl h ASP 91 Ca -0.45 -0.08 -0.42 0.00 -0.62 0.00 0.00 57.03 55.45 2akl h ASP 91 Cb 1.22 -0.04 -0.16 0.00 0.18 0.00 0.00 39.33 40.53 2akl h ASP 91 CO 0.62 0.72 0.37 0.00 -3.12 0.00 0.00 179.24 177.82 2akl n HIS 92 N -3.85 1.51 -3.36 4.55 1.44 -1.26 -4.41 115.22 109.85 2akl n HIS 92 Ca -0.02 -1.94 -0.21 0.00 -2.01 0.00 0.00 57.72 53.55 2akl n HIS 92 Cb 0.61 -1.24 -0.09 0.00 0.12 0.00 0.00 29.99 29.40 2akl n HIS 92 CO 0.00 0.00 0.00 -0.51 -2.81 0.00 0.00 176.34 173.02 2akl s ASP 93 N 0.35 1.49 -0.27 4.39 1.01 -1.19 -4.76 116.67 117.68 2akl s ASP 93 Ca 0.49 -1.97 0.03 0.00 0.71 0.00 0.00 52.55 51.81 2akl s ASP 93 Cb 0.33 0.26 0.06 0.00 1.01 0.00 0.00 42.92 44.58 2akl s ASP 93 CO -0.13 -0.24 -0.09 -0.63 0.21 0.00 0.00 175.17 174.28 2akl s ILE 94 N 1.09 2.19 -0.52 0.77 1.01 -1.16 -2.27 121.20 122.31 2akl s ILE 94 Ca 0.20 -1.72 -0.18 0.00 0.00 0.00 0.00 60.65 58.96 2akl s ILE 94 Cb -0.14 -2.33 0.08 0.00 0.01 0.00 0.00 42.46 40.08 2akl s ILE 94 CO -0.04 -0.09 0.60 -0.62 0.00 0.00 0.00 174.94 174.78 2akl s ASP 95 N 1.08 6.20 0.22 3.58 -1.08 0.02 -1.54 116.67 125.15 2akl s ASP 95 Ca -0.07 -1.17 0.07 0.00 -0.52 0.00 0.00 52.55 50.86 2akl s ASP 95 Cb -0.20 -2.27 -0.04 0.00 -1.46 0.00 0.00 42.92 38.95 2akl s ASP 95 CO -0.05 -0.90 0.13 0.00 0.52 0.00 0.00 175.17 174.86 2akl s LYS 97 N -3.48 2.38 -0.29 0.00 -2.85 -1.26 0.02 119.74 114.26 2akl s LYS 97 Ca 0.31 -0.85 0.02 0.00 -1.00 0.00 0.00 55.97 54.46 2akl s LYS 97 Cb -0.08 -2.19 0.08 0.00 -2.06 0.00 0.00 37.83 33.57 2akl s LYS 97 CO 0.23 0.52 0.00 0.42 0.10 0.00 0.00 175.35 176.62 2akl s ILE 98 N -0.50 1.74 -0.51 3.79 1.09 0.37 -4.86 121.20 122.32 2akl s ILE 98 Ca 0.06 -1.68 -0.26 0.00 -1.10 0.00 0.00 60.65 57.67 2akl s ILE 98 Cb -0.11 -2.13 -0.05 0.00 -1.06 0.00 0.00 42.46 39.10 2akl s ILE 98 CO 0.01 -0.36 2.25 -1.81 -0.10 0.00 0.00 174.94 174.93 2akl s ASP 99 N 1.23 4.71 0.00 3.58 1.01 -1.26 -1.45 116.67 124.49 2akl s ASP 99 Ca 0.02 0.91 0.00 0.00 0.71 0.00 0.00 52.55 54.19 2akl s ASP 99 Cb -0.19 -2.51 0.00 0.00 1.01 0.00 0.00 42.92 41.23 2akl s ASP 99 CO -0.10 -2.70 0.00 0.61 0.21 0.00 0.00 175.17 173.19 2akl n GLY 100 N 5.91 1.75 0.12 0.21 0.00 -1.26 -4.92 105.19 106.98 2akl n GLY 100 Ca 0.32 -0.22 -0.22 0.00 0.00 0.00 0.00 46.02 45.90 2akl n GLY 100 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 173.32 173.48 2akl h ILE 101 N 0.00 0.82 0.00 -0.61 3.07 -1.96 -3.51 117.51 115.33 2akl h ILE 101 Ca 0.00 -2.24 0.00 0.00 1.55 0.00 0.00 64.86 64.17 2akl h ILE 101 Cb 0.00 2.32 0.00 0.00 -0.27 0.00 0.00 36.82 38.87 2akl h ILE 101 CO 0.00 0.50 0.00 0.61 -1.05 0.00 0.00 178.15 178.21 2akl n GLY 102 N 1.61 0.64 3.84 0.16 0.00 -0.53 -5.04 105.19 105.87 2akl n GLY 102 Ca -0.32 -1.73 -0.33 0.00 0.00 0.00 0.00 46.02 43.64 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 3.22 0.05 4.61 0.00 -1.26 -0.48 121.76 126.91 2akl s ALA 103 Ca 0.00 0.18 0.02 0.00 0.00 0.00 0.00 51.96 52.16 2akl s ALA 103 Cb 0.00 -2.91 -0.03 0.00 0.00 0.00 0.00 23.12 20.18 2akl s ALA 103 CO 0.00 0.26 -0.06 1.41 0.00 0.00 0.00 175.76 177.36 2akl s MET 104 N -2.99 0.59 0.02 0.00 0.00 0.10 -4.90 119.30 112.11 2akl s MET 104 Ca 0.56 -0.93 -0.04 0.00 0.00 0.00 0.00 55.69 55.29 2akl s MET 104 Cb -0.10 -0.17 -0.04 0.00 0.00 0.00 0.00 34.83 34.51 2akl s MET 104 CO 0.16 0.01 0.23 0.15 0.00 0.00 0.00 175.02 175.57 2akl s LYS 105 N -2.36 3.50 -0.04 4.11 -0.14 -1.26 -1.22 119.74 122.32 2akl s LYS 105 Ca -0.04 -0.24 0.03 0.00 -1.36 0.00 0.00 55.97 54.37 2akl s LYS 105 Cb -0.04 -3.06 0.00 0.00 -1.68 0.00 0.00 37.83 33.05 2akl s LYS 105 CO -0.02 0.64 -0.12 -0.51 -0.76 0.00 0.00 175.35 174.58 2akl s LEU 106 N -2.01 1.78 -0.36 3.17 1.43 -0.59 -4.98 118.68 117.12 2akl s LEU 106 Ca 0.29 -0.26 -0.28 0.00 -1.03 0.00 0.00 54.13 52.86 2akl s LEU 106 Cb -0.13 -0.73 0.02 0.00 0.03 0.00 0.00 46.19 45.38 2akl s LEU 106 CO 0.19 0.08 1.04 -0.75 0.23 0.00 0.00 176.35 177.14 2akl s LYS 107 N 0.26 3.94 0.35 1.70 2.20 -1.26 -2.98 119.74 123.96 2akl s LYS 107 Ca -0.06 0.83 0.10 0.00 -0.36 0.00 0.00 55.97 56.49 2akl s LYS 107 Cb -0.11 -3.79 0.86 0.00 -1.51 0.00 0.00 37.83 33.28 2akl s LYS 107 CO 0.02 -1.00 1.84 0.66 -0.36 0.00 0.00 175.35 176.51 2akl h SER 108 N 8.40 0.64 0.22 1.43 4.64 -1.83 0.33 113.55 127.37 2akl h SER 108 Ca -0.22 0.06 0.00 0.00 -0.47 0.00 0.00 61.79 61.16 2akl h SER 108 Cb 1.07 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 63.09 2akl h SER 108 CO 1.03 0.28 0.00 -0.62 -0.87 0.00 0.00 176.83 176.65 2akl n GLU 109 N -4.60 0.35 -0.01 4.77 1.02 -1.26 -1.97 120.64 118.93 2akl n GLU 109 Ca 0.20 0.08 0.01 0.00 -0.02 0.00 0.00 57.16 57.43 2akl n GLU 109 Cb 0.56 -1.50 0.01 0.00 -0.02 0.00 0.00 31.44 30.49 2akl n GLU 109 CO 0.00 0.00 0.00 1.19 1.18 0.00 0.00 177.13 179.50 2akl n PHE 110 N -1.19 0.03 -4.48 -0.32 3.72 0.11 -4.43 117.46 110.90 2akl n PHE 110 Ca 0.10 -0.22 -0.29 0.00 -0.05 0.00 0.00 57.45 56.98 2akl n PHE 110 Cb 0.11 -0.02 -0.07 0.00 -0.94 0.00 0.00 39.48 38.56 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 -0.53 1.61 -0.09 -4.37 -7.23 -0.84 -1.44 120.40 107.51 2akl s VAL 111 Ca 0.03 -1.86 -0.10 0.00 -1.81 0.00 0.00 61.98 58.24 2akl s VAL 111 Cb 0.02 -2.47 0.03 0.00 0.56 0.00 0.00 36.38 34.51 2akl s VAL 111 CO 0.02 0.00 0.27 -0.60 -0.31 0.00 0.00 175.10 174.48 2akl s ARG 112 N -3.92 0.37 -0.09 4.82 3.52 0.31 -1.69 118.95 122.27 2akl s ARG 112 Ca 0.22 0.28 -0.30 0.00 -0.13 0.00 0.00 55.73 55.81 2akl s ARG 112 Cb 0.03 0.17 -0.03 0.00 -1.56 0.00 0.00 34.95 33.56 2akl s ARG 112 CO 0.12 -0.06 1.37 0.21 -0.81 0.00 0.00 175.30 176.13 2akl s LYS 113 N -0.09 4.25 -0.13 5.12 2.20 -1.26 0.36 119.74 130.19 2akl s LYS 113 Ca -0.02 1.84 -0.16 0.00 -0.36 0.00 0.00 55.97 57.27 2akl s LYS 113 Cb -0.03 -3.74 -0.14 0.00 -1.51 0.00 0.00 37.83 32.42 2akl s LYS 113 CO 0.01 -0.67 0.38 0.28 -0.36 0.00 0.00 175.35 174.98 2akl h VAL 114 N 5.31 0.92 0.00 4.02 2.07 -1.57 -3.47 116.25 123.53 2akl h VAL 114 Ca -0.33 -1.72 0.00 0.00 0.82 0.00 0.00 66.70 65.47 2akl h VAL 114 Cb 1.14 1.77 0.00 0.00 -1.52 0.00 0.00 31.29 32.68 2akl h VAL 114 CO 0.94 0.31 0.00 0.61 0.02 0.00 0.00 177.57 179.45 2akl n GLY 115 N 1.67 0.23 0.00 2.17 0.00 -1.24 -5.06 105.19 102.96 2akl n GLY 115 Ca -0.07 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.08 2akl n GLY 115 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76