#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kac s GLU 2 N 0.00 1.42 0.33 0.03 8.01 -1.26 -5.14 118.70 122.09 2kac s GLU 2 Ca 0.00 -1.53 0.03 0.00 0.01 0.00 0.00 54.97 53.48 2kac s GLU 2 Cb 0.00 -1.50 -0.02 0.00 -4.31 0.00 0.00 34.13 28.30 2kac s GLU 2 CO 0.00 0.30 0.49 -1.83 0.01 0.00 0.00 175.26 174.23 2kac s GLU 3 N -3.05 3.33 0.21 1.61 -1.05 -1.26 -4.47 118.70 114.02 2kac s GLU 3 Ca 0.21 -0.63 -0.04 0.00 -0.15 0.00 0.00 54.97 54.36 2kac s GLU 3 Cb -0.05 -2.75 -0.03 0.00 -0.44 0.00 0.00 34.13 30.86 2kac s GLU 3 CO 0.09 0.16 0.23 0.14 0.95 0.00 0.00 175.26 176.82 2kac s VAL 4 N -2.22 0.01 -0.12 1.83 -7.23 0.42 -4.96 120.40 108.13 2kac s VAL 4 Ca 0.40 -1.82 0.02 0.00 -1.81 0.00 0.00 61.98 58.78 2kac s VAL 4 Cb -0.09 -2.38 0.01 0.00 0.56 0.00 0.00 36.38 34.47 2kac s VAL 4 CO 0.33 -0.02 -0.18 -0.89 -0.31 0.00 0.00 175.10 174.03 2kac s THR 5 N -4.11 1.72 -0.13 5.32 2.01 -1.26 -1.70 115.64 117.48 2kac s THR 5 Ca 0.33 -0.78 0.00 0.00 0.31 0.00 0.00 61.69 61.56 2kac s THR 5 Cb 0.05 -1.54 0.02 0.00 0.01 0.00 0.00 72.50 71.04 2kac s THR 5 CO 0.10 0.48 -0.12 -0.63 -0.69 0.00 0.00 174.62 173.76 2kac s ILE 6 N 0.86 1.40 -0.14 1.82 1.01 -0.14 -4.75 121.20 121.25 2kac s ILE 6 Ca -0.08 -0.53 -0.03 0.00 0.00 0.00 0.00 60.65 60.01 2kac s ILE 6 Cb -0.15 -1.33 -0.03 0.00 0.01 0.00 0.00 42.46 40.96 2kac s ILE 6 CO -0.01 0.43 -0.04 -0.75 0.00 0.00 0.00 174.94 174.57 2kac s LYS 7 N 1.46 3.51 -0.40 2.79 2.20 -0.50 -0.80 119.74 128.00 2kac s LYS 7 Ca 0.03 -0.52 -0.15 0.00 -0.36 0.00 0.00 55.97 54.98 2kac s LYS 7 Cb -0.13 -2.86 0.02 0.00 -1.51 0.00 0.00 37.83 33.34 2kac s LYS 7 CO -0.08 0.33 0.29 0.00 -0.36 0.00 0.00 175.35 175.52 2kac s ALA 8 N 0.13 3.48 -0.45 3.13 0.00 0.37 -0.89 121.76 127.53 2kac s ALA 8 Ca -0.01 -1.69 -0.22 0.00 0.00 0.00 0.00 51.96 50.04 2kac s ALA 8 Cb -0.14 -2.86 0.03 0.00 0.00 0.00 0.00 23.12 20.15 2kac s ALA 8 CO 0.03 -1.41 0.72 -0.80 0.00 0.00 0.00 175.76 174.29 2kac s ASN 9 N 1.68 6.36 -0.14 0.00 0.01 0.03 -2.88 114.94 120.01 2kac s ASN 9 Ca 0.05 -0.25 -0.03 0.00 -0.71 0.00 0.00 52.86 51.92 2kac s ASN 9 Cb -0.19 -2.35 -0.03 0.00 0.41 0.00 0.00 41.25 39.09 2kac s ASN 9 CO 0.10 -0.86 -0.04 -0.76 -1.51 0.00 0.00 177.10 174.02 2kac s LEU 10 N 3.08 3.24 -0.10 0.60 1.43 -0.99 -1.14 118.68 124.80 2kac s LEU 10 Ca 0.26 -0.11 0.00 0.00 -1.03 0.00 0.00 54.13 53.25 2kac s LEU 10 Cb -0.13 -1.77 0.02 0.00 0.03 0.00 0.00 46.19 44.34 2kac s LEU 10 CO 0.21 0.20 -0.08 -0.63 0.23 0.00 0.00 176.35 176.28 2kac s ILE 11 N 0.16 0.96 0.12 -0.59 1.09 -1.20 -0.84 121.20 120.90 2kac s ILE 11 Ca -0.02 -0.28 -0.02 0.00 -1.10 0.00 0.00 60.65 59.24 2kac s ILE 11 Cb -0.14 -0.97 -0.05 0.00 -1.06 0.00 0.00 42.46 40.25 2kac s ILE 11 CO 0.03 0.35 0.31 -0.36 -0.10 0.00 0.00 174.94 175.16 2kac s PHE 12 N 1.47 3.49 -0.98 3.97 0.08 0.09 -2.47 117.98 123.64 2kac s PHE 12 Ca 0.00 0.36 0.12 0.00 0.12 0.00 0.00 56.93 57.53 2kac s PHE 12 Cb -0.13 -1.86 0.50 0.00 -0.57 0.00 0.00 43.02 40.96 2kac s PHE 12 CO -0.05 0.49 1.37 0.00 -0.10 0.00 0.00 175.22 176.93 2kac n ALA 13 N -0.01 1.51 0.72 5.36 0.00 -1.26 -2.25 120.51 124.58 2kac n ALA 13 Ca -0.04 -0.03 0.10 0.00 0.00 0.00 0.00 53.44 53.47 2kac n ALA 13 Cb 0.52 -1.19 0.45 0.00 0.00 0.00 0.00 19.45 19.23 2kac n ALA 13 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2kac n ASN 14 N -1.53 0.04 -0.08 0.00 4.13 -1.26 -4.87 115.26 111.69 2kac n ASN 14 Ca 0.03 0.51 0.00 0.00 1.68 0.00 0.00 54.58 56.79 2kac n ASN 14 Cb 0.13 -0.52 0.00 0.00 -1.54 0.00 0.00 39.78 37.86 2kac n ASN 14 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2kac n GLY 15 N 0.69 0.95 3.07 7.41 0.00 -0.96 -5.08 105.19 111.28 2kac n GLY 15 Ca 0.05 -0.55 -0.21 0.00 0.00 0.00 0.00 46.02 45.32 2kac n GLY 15 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2kac s SER 16 N -2.65 1.38 0.37 1.61 0.01 -1.25 -5.04 113.70 108.14 2kac s SER 16 Ca 0.00 -0.22 0.06 0.00 1.31 0.00 0.00 55.95 57.10 2kac s SER 16 Cb 0.00 -0.15 -0.07 0.00 0.21 0.00 0.00 66.02 66.00 2kac s SER 16 CO 0.00 0.14 0.01 0.42 0.41 0.00 0.00 173.24 174.23 2kac s THR 17 N -0.29 1.74 -0.03 1.44 -4.23 -1.26 -0.74 115.64 112.27 2kac s THR 17 Ca 0.04 -2.02 -0.16 0.00 -1.18 0.00 0.00 61.69 58.38 2kac s THR 17 Cb -0.05 -2.88 0.03 0.00 1.34 0.00 0.00 72.50 70.94 2kac s THR 17 CO -0.00 -0.03 0.34 -1.58 -0.54 0.00 0.00 174.62 172.80 2kac s GLN 18 N -3.76 0.67 -0.31 3.99 2.00 -0.02 -4.97 119.66 117.25 2kac s GLN 18 Ca 0.35 -0.09 -0.04 0.00 -2.00 0.00 0.00 55.36 53.58 2kac s GLN 18 Cb 0.09 0.30 0.04 0.00 0.80 0.00 0.00 33.01 34.24 2kac s GLN 18 CO 0.17 -0.18 0.04 0.99 -0.50 0.00 0.00 175.29 175.81 2kac s THR 19 N -1.17 3.32 0.01 -0.34 2.01 -1.26 -2.35 115.64 115.86 2kac s THR 19 Ca -0.12 -1.26 0.02 0.00 0.31 0.00 0.00 61.69 60.64 2kac s THR 19 Cb -0.05 -2.89 -0.01 0.00 0.01 0.00 0.00 72.50 69.57 2kac s THR 19 CO 0.04 -0.12 -0.07 0.00 -0.69 0.00 0.00 174.62 173.78 2kac s ALA 20 N 1.32 0.57 0.09 7.40 0.00 -1.14 -5.07 121.76 124.93 2kac s ALA 20 Ca -0.04 -0.45 -0.13 0.00 0.00 0.00 0.00 51.96 51.34 2kac s ALA 20 Cb -0.20 -0.08 0.02 0.00 0.00 0.00 0.00 23.12 22.86 2kac s ALA 20 CO 0.01 0.09 0.31 -1.83 0.00 0.00 0.00 175.76 174.34 2kac s GLU 21 N -0.64 0.93 0.05 0.00 4.04 -1.26 -0.48 118.70 121.34 2kac s GLU 21 Ca -0.01 -0.71 0.01 0.00 0.04 0.00 0.00 54.97 54.29 2kac s GLU 21 Cb -0.05 0.40 -0.03 0.00 0.02 0.00 0.00 34.13 34.47 2kac s GLU 21 CO 0.00 -0.33 -0.05 -0.06 -1.84 0.00 0.00 175.26 172.98 2kac s PHE 22 N -3.43 0.57 -0.01 4.83 0.40 0.02 -4.98 117.98 115.38 2kac s PHE 22 Ca 0.01 -0.67 0.03 0.00 -0.60 0.00 0.00 56.93 55.70 2kac s PHE 22 Cb 0.02 -0.36 -0.01 0.00 0.51 0.00 0.00 43.02 43.18 2kac s PHE 22 CO -0.09 -0.17 -0.10 -1.21 0.70 0.00 0.00 175.22 174.34 2kac s GLU 23 N -2.33 0.83 0.00 0.44 2.02 -1.26 -0.97 118.70 117.43 2kac s GLU 23 Ca -0.05 -0.38 0.00 0.00 0.02 0.00 0.00 54.97 54.56 2kac s GLU 23 Cb -0.04 -0.80 0.00 0.00 0.10 0.00 0.00 34.13 33.39 2kac s GLU 23 CO -0.03 0.22 0.00 0.41 0.02 0.00 0.00 175.26 175.88 2kac n GLY 24 N 2.78 -0.33 3.60 -1.39 0.00 -0.69 -4.78 105.19 104.39 2kac n GLY 24 Ca -0.14 -1.33 -0.29 0.00 0.00 0.00 0.00 46.02 44.26 2kac n GLY 24 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2kac s THR 25 N -2.93 1.78 -1.61 2.61 -4.23 -1.26 -0.44 115.64 109.56 2kac s THR 25 Ca 0.00 0.00 0.13 0.00 -1.18 0.00 0.00 61.69 60.64 2kac s THR 25 Cb 0.00 -2.42 0.27 0.00 1.34 0.00 0.00 72.50 71.69 2kac s THR 25 CO 0.00 0.00 1.29 0.33 -0.54 0.00 0.00 174.62 175.70 2kac n PHE 26 N -4.61 0.00 0.21 3.99 7.35 -1.26 -1.99 117.46 121.15 2kac n PHE 26 Ca 0.09 0.00 0.02 0.00 -0.76 0.00 0.00 57.45 56.80 2kac n PHE 26 Cb 0.58 -0.19 0.00 0.00 0.35 0.00 0.00 39.48 40.22 2kac n PHE 26 CO 0.00 0.00 0.00 -0.85 -0.76 0.00 0.00 176.76 175.15 2kac n GLU 27 N -1.19 2.20 -0.12 -4.13 0.28 -1.26 -4.61 120.64 111.80 2kac n GLU 27 Ca 0.07 -0.46 0.05 0.00 -0.16 0.00 0.00 57.16 56.67 2kac n GLU 27 Cb 0.08 -0.93 0.12 0.00 1.43 0.00 0.00 31.44 32.14 2kac n GLU 27 CO 0.00 0.00 0.00 -1.91 -0.16 0.00 0.00 177.13 175.06 2kac n GLU 28 N -0.31 2.26 0.00 3.44 4.07 -0.84 -4.58 120.64 124.68 2kac n GLU 28 Ca 0.02 -1.78 0.00 0.00 -0.06 0.00 0.00 57.16 55.34 2kac n GLU 28 Cb 0.10 -1.24 0.00 0.00 -0.06 0.00 0.00 31.44 30.25 2kac n GLU 28 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 2kac n ALA 29 N 0.48 1.27 -0.03 4.31 0.00 -1.22 -4.65 120.51 120.66 2kac n ALA 29 Ca 0.10 0.00 -0.22 0.00 0.00 0.00 0.00 53.44 53.32 2kac n ALA 29 Cb 0.37 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 19.69 2kac n ALA 29 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 2kac n THR 30 N -0.88 1.70 0.23 0.00 -1.04 -1.26 -3.34 114.28 109.69 2kac n THR 30 Ca 0.00 -0.50 0.11 0.00 -2.04 0.00 0.00 64.05 61.62 2kac n THR 30 Cb 0.00 -1.79 0.51 0.00 -1.82 0.00 0.00 70.33 67.23 2kac n THR 30 CO 0.00 0.00 0.00 -1.28 -0.64 0.00 0.00 175.07 173.15 2kac h SER 31 N -0.21 0.00 -0.03 8.00 0.87 -1.89 -2.09 113.55 118.21 2kac h SER 31 Ca -0.43 0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.13 2kac h SER 31 Cb 1.85 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 63.81 2kac h SER 31 CO -0.01 0.20 -0.01 -0.33 -0.53 0.00 0.00 176.83 176.15 2kac h GLU 32 N 0.00 0.05 -0.84 2.24 4.39 -1.83 0.62 114.58 119.21 2kac h GLU 32 Ca -0.00 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.68 2kac h GLU 32 Cb 0.68 -0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 29.29 2kac h GLU 32 CO 0.03 0.41 0.53 0.00 -1.16 0.00 0.00 179.01 178.82 2kac h ALA 33 N 0.63 1.07 -0.03 3.43 0.00 -1.49 0.12 119.26 123.00 2kac h ALA 33 Ca 0.01 -0.08 -0.14 0.00 0.00 0.00 0.00 54.91 54.70 2kac h ALA 33 Cb 0.40 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 2kac h ALA 33 CO 0.00 0.51 -0.62 1.88 0.00 0.00 0.00 179.25 181.02 2kac h TYR 34 N 1.15 0.13 -0.07 0.00 0.05 -1.28 -1.82 116.97 115.13 2kac h TYR 34 Ca 0.31 -0.05 -0.14 0.00 0.05 0.00 0.00 58.73 58.90 2kac h TYR 34 Cb -0.09 -0.02 0.01 0.00 1.01 0.00 0.00 36.73 37.64 2kac h TYR 34 CO -0.01 0.69 -0.49 0.00 -1.05 0.00 0.00 178.16 177.31 2kac h ALA 35 N 1.29 0.15 -0.73 3.88 0.00 -0.33 0.80 119.26 124.32 2kac h ALA 35 Ca -0.01 -0.51 0.07 0.00 0.00 0.00 0.00 54.91 54.47 2kac h ALA 35 Cb 1.12 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.85 2kac h ALA 35 CO 0.09 0.33 0.41 -0.92 0.00 0.00 0.00 179.25 179.16 2kac h TYR 36 N -0.00 0.75 -0.01 0.00 5.03 -0.75 -1.41 116.97 120.57 2kac h TYR 36 Ca -0.04 0.03 -0.17 0.00 2.58 0.00 0.00 58.73 61.12 2kac h TYR 36 Cb 1.15 -0.23 -0.01 0.00 1.55 0.00 0.00 36.73 39.19 2kac h TYR 36 CO 0.13 0.34 -0.78 0.00 -1.32 0.00 0.00 178.16 176.52 2kac h ALA 37 N 1.39 0.66 -0.40 1.82 0.00 -1.21 -3.21 119.26 118.32 2kac h ALA 37 Ca 0.34 -0.68 -0.03 0.00 0.00 0.00 0.00 54.91 54.54 2kac h ALA 37 Cb 0.25 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 2kac h ALA 37 CO -0.21 0.89 0.11 -0.44 0.00 0.00 0.00 179.25 179.60 2kac h ASP 38 N 0.09 0.53 0.39 0.00 3.32 0.19 0.17 116.42 121.11 2kac h ASP 38 Ca -0.03 -0.07 0.00 0.00 0.02 0.00 0.00 57.03 56.95 2kac h ASP 38 Cb 1.37 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 40.79 2kac h ASP 38 CO 0.11 0.52 0.00 1.07 -1.72 0.00 0.00 179.24 179.23 2kac n THR 39 N -4.34 1.09 0.62 0.35 5.66 -0.73 -1.43 114.28 115.50 2kac n THR 39 Ca 0.02 0.40 0.06 0.00 -3.05 0.00 0.00 64.05 61.49 2kac n THR 39 Cb 0.18 -1.32 -0.07 0.00 -1.55 0.00 0.00 70.33 67.57 2kac n THR 39 CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 175.07 172.20 2kac n LEU 40 N -1.98 0.70 -0.20 1.09 4.77 -0.03 -4.47 117.00 116.88 2kac n LEU 40 Ca 0.01 -0.53 -0.08 0.00 -0.03 0.00 0.00 56.01 55.39 2kac n LEU 40 Cb 0.13 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.25 2kac n LEU 40 CO 0.13 0.17 0.98 -0.08 -1.33 0.00 0.00 177.39 177.26 2kac h GLU 41 N 0.15 0.86 -0.51 3.23 4.81 -0.45 -1.93 114.58 120.75 2kac h GLU 41 Ca 0.00 -0.15 -0.00 0.00 -0.13 0.00 0.00 59.36 59.07 2kac h GLU 41 Cb 0.32 -0.14 -0.02 0.00 0.63 0.00 0.00 28.75 29.54 2kac h GLU 41 CO 0.00 0.74 0.30 1.49 -0.73 0.00 0.00 179.01 180.81 2kac h GLU 42 N 0.79 0.70 0.00 1.92 4.81 -1.78 0.20 114.58 121.22 2kac h GLU 42 Ca 0.19 -0.07 0.00 0.00 -0.13 0.00 0.00 59.36 59.36 2kac h GLU 42 Cb 0.20 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 29.43 2kac h GLU 42 CO -0.02 0.51 0.00 -0.25 -0.73 0.00 0.00 179.01 178.53 2kac n ASP 43 N -4.68 0.00 0.08 1.04 8.00 -1.07 -4.62 116.55 115.30 2kac n ASP 43 Ca 0.02 0.44 0.00 0.00 0.71 0.00 0.00 54.79 55.96 2kac n ASP 43 Cb 0.06 -0.48 0.00 0.00 -0.02 0.00 0.00 41.12 40.68 2kac n ASP 43 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 2kac n ASN 44 N -1.48 0.17 0.00 -2.24 3.02 -0.75 -5.10 115.26 108.88 2kac n ASN 44 Ca 0.07 0.26 0.00 0.00 -0.03 0.00 0.00 54.58 54.88 2kac n ASN 44 Cb 0.29 0.12 0.00 0.00 -0.61 0.00 0.00 39.78 39.58 2kac n ASN 44 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2kac n GLY 45 N 2.16 -1.80 3.73 7.41 0.00 0.67 -4.40 105.19 112.97 2kac n GLY 45 Ca 0.00 -1.48 -0.36 0.00 0.00 0.00 0.00 46.02 44.19 2kac n GLY 45 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2kac s GLU 46 N -1.78 2.43 0.38 1.61 8.01 -1.26 -4.49 118.70 123.60 2kac s GLU 46 Ca 0.00 1.93 0.05 0.00 0.01 0.00 0.00 54.97 56.96 2kac s GLU 46 Cb 0.00 -1.85 -0.06 0.00 -4.31 0.00 0.00 34.13 27.91 2kac s GLU 46 CO 0.00 -1.65 0.04 1.67 0.01 0.00 0.00 175.26 175.33 2kac s TRP 47 N -1.63 2.13 0.12 1.61 1.48 -1.26 -3.50 118.94 117.89 2kac s TRP 47 Ca 0.79 -0.89 0.03 0.00 -1.06 0.00 0.00 56.10 54.97 2kac s TRP 47 Cb -0.34 -1.48 -0.04 0.00 -1.16 0.00 0.00 33.47 30.45 2kac s TRP 47 CO 0.41 0.15 -0.07 0.95 -4.06 0.00 0.00 176.95 174.33 2kac s THR 48 N -3.04 0.88 -0.04 0.66 -4.23 -0.50 -5.01 115.64 104.35 2kac s THR 48 Ca 0.32 -1.99 -0.10 0.00 -1.18 0.00 0.00 61.69 58.73 2kac s THR 48 Cb 0.08 -1.79 0.02 0.00 1.34 0.00 0.00 72.50 72.14 2kac s THR 48 CO 0.15 -0.78 0.24 0.54 -0.54 0.00 0.00 174.62 174.23 2kac s VAL 49 N -3.51 0.04 -0.28 2.29 0.11 -1.26 -1.69 120.40 116.10 2kac s VAL 49 Ca 0.15 -0.34 0.02 0.00 -2.93 0.00 0.00 61.98 58.87 2kac s VAL 49 Cb 0.04 -0.47 0.06 0.00 -1.53 0.00 0.00 36.38 34.49 2kac s VAL 49 CO -0.02 -0.19 -0.06 -1.81 -3.33 0.00 0.00 175.10 169.69 2kac s ASP 50 N -0.76 4.60 -0.37 3.54 1.01 0.25 -4.98 116.67 119.97 2kac s ASP 50 Ca -0.08 -1.46 -0.28 0.00 0.71 0.00 0.00 52.55 51.43 2kac s ASP 50 Cb -0.05 -1.60 0.02 0.00 1.01 0.00 0.00 42.92 42.30 2kac s ASP 50 CO 0.02 -0.23 1.05 -0.69 0.21 0.00 0.00 175.17 175.53 2kac s VAL 51 N 1.12 4.46 0.30 -1.27 1.01 -1.26 -1.65 120.40 123.10 2kac s VAL 51 Ca -0.06 1.49 0.04 0.00 0.00 0.00 0.00 61.98 63.46 2kac s VAL 51 Cb -0.20 -4.44 -0.01 0.00 0.00 0.00 0.00 36.38 31.73 2kac s VAL 51 CO -0.04 -0.61 0.31 0.00 0.00 0.00 0.00 175.10 174.76 2kac n ALA 52 N 7.06 0.33 -3.64 5.51 0.00 -1.02 -4.88 120.51 123.87 2kac n ALA 52 Ca 0.11 -1.64 -0.28 0.00 0.00 0.00 0.00 53.44 51.63 2kac n ALA 52 Cb 0.48 1.32 0.04 0.00 0.00 0.00 0.00 19.45 21.29 2kac n ALA 52 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2kac n ASP 53 N -1.78 -5.01 -1.14 0.00 9.92 -1.26 -1.50 116.55 115.78 2kac n ASP 53 Ca 0.05 -0.96 -0.15 0.00 -0.53 0.00 0.00 54.79 53.20 2kac n ASP 53 Cb 0.53 -3.65 -0.06 0.00 -0.64 0.00 0.00 41.12 37.29 2kac n ASP 53 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 2kac n GLU 54 N -4.07 -1.61 -0.12 -1.24 -0.58 -1.26 -1.24 120.64 110.51 2kac n GLU 54 Ca -0.11 1.01 0.00 0.00 -0.42 0.00 0.00 57.16 57.64 2kac n GLU 54 Cb 0.60 -5.43 0.00 0.00 -0.57 0.00 0.00 31.44 26.05 2kac n GLU 54 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2kac n GLY 55 N 0.01 0.65 0.05 0.62 0.00 -0.56 -4.97 105.19 101.00 2kac n GLY 55 Ca -0.15 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.00 2kac n GLY 55 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2kac n TYR 56 N -2.00 0.48 -4.03 1.61 4.01 -0.38 -4.56 117.16 112.29 2kac n TYR 56 Ca 0.00 0.14 -0.31 0.00 -0.16 0.00 0.00 57.90 57.57 2kac n TYR 56 Cb 0.00 -0.69 -0.15 0.00 -0.31 0.00 0.00 39.34 38.19 2kac n TYR 56 CO 0.00 0.00 0.00 0.99 -0.46 0.00 0.00 176.86 177.39 2kac s THR 57 N -3.06 2.20 -0.43 -0.72 2.01 -0.97 -1.41 115.64 113.25 2kac s THR 57 Ca 0.11 -2.11 -0.20 0.00 0.31 0.00 0.00 61.69 59.80 2kac s THR 57 Cb 0.15 -2.54 0.02 0.00 0.01 0.00 0.00 72.50 70.15 2kac s THR 57 CO 0.60 -0.44 0.59 -0.76 -0.69 0.00 0.00 174.62 173.92 2kac s LEU 58 N 0.98 4.59 -0.63 4.42 1.43 -0.06 -2.44 118.68 126.96 2kac s LEU 58 Ca 0.05 -0.42 -0.20 0.00 -1.03 0.00 0.00 54.13 52.53 2kac s LEU 58 Cb -0.19 -2.64 0.10 0.00 0.03 0.00 0.00 46.19 43.48 2kac s LEU 58 CO -0.08 -0.73 0.80 0.20 0.23 0.00 0.00 176.35 176.77 2kac s ASN 59 N 1.95 6.21 -0.14 2.29 0.01 -0.66 -0.79 114.94 123.82 2kac s ASN 59 Ca 0.20 -1.36 -0.11 0.00 -0.71 0.00 0.00 52.86 50.88 2kac s ASN 59 Cb -0.15 -2.34 -0.05 0.00 0.41 0.00 0.00 41.25 39.13 2kac s ASN 59 CO 0.18 -1.20 0.22 -0.63 -1.51 0.00 0.00 177.10 174.15 2kac s ILE 60 N 3.04 5.36 -0.07 0.60 1.01 -0.29 -0.58 121.20 130.27 2kac s ILE 60 Ca 0.16 0.38 0.00 0.00 0.00 0.00 0.00 60.65 61.19 2kac s ILE 60 Cb -0.21 -3.52 0.02 0.00 0.01 0.00 0.00 42.46 38.76 2kac s ILE 60 CO 0.06 0.50 -0.05 -0.70 0.00 0.00 0.00 174.94 174.75 2kac s GLU 61 N -0.26 1.09 0.49 2.79 2.12 -0.68 -3.23 118.70 121.02 2kac s GLU 61 Ca 0.15 -0.13 -0.03 0.00 0.36 0.00 0.00 54.97 55.32 2kac s GLU 61 Cb -0.13 -1.16 -0.01 0.00 0.26 0.00 0.00 34.13 33.09 2kac s GLU 61 CO 0.04 -0.18 0.76 -0.06 -0.54 0.00 0.00 175.26 175.28 2kac s PHE 62 N 1.38 3.32 0.02 5.30 0.40 -1.03 -1.42 117.98 125.94 2kac s PHE 62 Ca -0.03 0.48 -0.01 0.00 -0.60 0.00 0.00 56.93 56.77 2kac s PHE 62 Cb -0.13 -2.42 -0.01 0.00 0.51 0.00 0.00 43.02 40.97 2kac s PHE 62 CO -0.03 -0.46 -0.02 0.00 0.70 0.00 0.00 175.22 175.41 2kac n ALA 63 N -2.26 2.89 -0.45 5.36 0.00 -1.23 -4.49 120.51 120.35 2kac n ALA 63 Ca 0.02 -0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.40 2kac n ALA 63 Cb 0.57 0.40 0.00 0.00 0.00 0.00 0.00 19.45 20.42 2kac n ALA 63 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91