#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ca7 n ASP 2 N 0.00 -2.47 -3.40 -5.58 2.03 -0.02 -4.94 116.55 102.17 2ca7 n ASP 2 Ca 0.00 0.16 -0.32 0.00 0.52 0.00 0.00 54.79 55.15 2ca7 n ASP 2 Cb 0.00 -1.40 0.03 0.00 -0.72 0.00 0.00 41.12 39.03 2ca7 n ASP 2 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 2ca7 n ARG 3 N 0.17 -1.88 -1.85 -0.67 1.74 -1.13 -4.82 116.66 108.22 2ca7 n ARG 3 Ca -0.01 1.48 -0.42 0.00 -0.77 0.00 0.00 57.85 58.13 2ca7 n ARG 3 Cb 0.02 -2.44 -0.03 0.00 -1.02 0.00 0.00 32.46 28.98 2ca7 n ARG 3 CO 0.00 0.00 0.00 -2.14 -1.52 0.00 0.00 177.63 173.97 2ca7 s PRO 4 N -2.35 4.18 0.27 5.56 0.02 -1.26 -4.84 135.00 136.58 2ca7 s PRO 4 Ca 0.34 2.45 0.17 0.00 0.02 0.00 0.00 61.00 63.97 2ca7 s PRO 4 Cb -0.04 -3.36 0.92 0.00 0.02 0.00 0.00 34.50 32.04 2ca7 s PRO 4 CO 0.80 -0.72 1.50 0.43 -0.33 0.00 0.00 177.00 178.67 2ca7 n SER 5 N 4.82 0.44 0.10 2.53 7.64 -1.26 -1.68 113.62 126.20 2ca7 n SER 5 Ca 0.16 0.68 0.13 0.00 1.01 0.00 0.00 58.87 60.85 2ca7 n SER 5 Cb 0.38 -0.72 0.44 0.00 -1.01 0.00 0.00 64.21 63.30 2ca7 n SER 5 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 2ca7 n LEU 6 N -2.10 0.71 0.18 -3.43 4.32 -1.26 -2.79 117.00 112.63 2ca7 n LEU 6 Ca -0.01 0.58 0.12 0.00 -0.02 0.00 0.00 56.01 56.68 2ca7 n LEU 6 Cb 0.08 -0.38 0.11 0.00 -1.62 0.00 0.00 43.42 41.62 2ca7 n LEU 6 CO 0.08 -0.23 0.55 0.00 -1.22 0.00 0.00 177.39 176.57 2ca7 n ASP 8 N -2.97 0.61 -4.77 0.00 2.03 -1.12 -4.51 116.55 105.83 2ca7 n ASP 8 Ca 0.03 0.24 -0.40 0.00 0.52 0.00 0.00 54.79 55.18 2ca7 n ASP 8 Cb 0.54 -0.17 -0.00 0.00 -0.72 0.00 0.00 41.12 40.77 2ca7 n ASP 8 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 2ca7 s LEU 9 N -3.97 4.23 0.85 -2.67 1.43 -1.21 -4.95 118.68 112.38 2ca7 s LEU 9 Ca 0.09 2.71 -0.11 0.00 -1.03 0.00 0.00 54.13 55.79 2ca7 s LEU 9 Cb 0.14 -3.87 0.10 0.00 0.03 0.00 0.00 46.19 42.59 2ca7 s LEU 9 CO 0.66 -0.86 1.09 -2.84 0.23 0.00 0.00 176.35 174.63 2ca7 s PRO 10 N -2.22 1.65 -0.34 1.29 0.02 -1.26 -4.84 135.00 129.30 2ca7 s PRO 10 Ca 0.56 0.80 -0.29 0.00 0.02 0.00 0.00 61.00 62.10 2ca7 s PRO 10 Cb -0.39 -1.85 0.01 0.00 0.02 0.00 0.00 34.50 32.29 2ca7 s PRO 10 CO 0.51 -1.97 1.17 0.00 -0.33 0.00 0.00 177.00 176.38 2ca7 s ALA 11 N -3.00 3.39 -0.17 -1.55 0.00 -1.26 -4.81 121.76 114.36 2ca7 s ALA 11 Ca 0.62 -0.07 -0.05 0.00 0.00 0.00 0.00 51.96 52.46 2ca7 s ALA 11 Cb -0.17 -3.75 -0.03 0.00 0.00 0.00 0.00 23.12 19.18 2ca7 s ALA 11 CO 0.56 -1.71 0.00 0.34 0.00 0.00 0.00 175.76 174.95 2ca7 s ASP 12 N 2.19 5.09 0.11 0.00 -1.08 -1.26 -4.95 116.67 116.76 2ca7 s ASP 12 Ca 0.50 -0.07 0.22 0.00 -0.52 0.00 0.00 52.55 52.68 2ca7 s ASP 12 Cb -0.13 -1.85 -0.12 0.00 -1.46 0.00 0.00 42.92 39.36 2ca7 s ASP 12 CO 0.21 0.15 0.84 -0.24 0.52 0.00 0.00 175.17 176.65 2ca7 n SER 13 N 3.66 0.53 -0.86 -0.34 2.88 -1.26 -4.70 113.62 113.53 2ca7 n SER 13 Ca -0.17 0.17 0.11 0.00 -1.33 0.00 0.00 58.87 57.65 2ca7 n SER 13 Cb 0.52 1.02 -0.04 0.00 -0.75 0.00 0.00 64.21 64.97 2ca7 n SER 13 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2ca7 n GLY 14 N 1.22 -2.25 1.12 0.46 0.00 -0.99 -1.26 105.19 103.49 2ca7 n GLY 14 Ca -0.01 -1.27 -0.05 0.00 0.00 0.00 0.00 46.02 44.69 2ca7 n GLY 14 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2ca7 n SER 15 N -3.47 2.83 -3.29 1.61 7.64 -1.23 -4.79 113.62 112.92 2ca7 n SER 15 Ca -0.02 -3.85 -0.22 0.00 1.01 0.00 0.00 58.87 55.79 2ca7 n SER 15 Cb 0.40 -0.51 0.19 0.00 -1.01 0.00 0.00 64.21 63.28 2ca7 n SER 15 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2ca7 n GLY 16 N -1.01 -2.70 0.21 0.23 0.00 -1.25 -5.00 105.19 95.67 2ca7 n GLY 16 Ca 0.29 -1.48 0.10 0.00 0.00 0.00 0.00 46.02 44.93 2ca7 n GLY 16 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2ca7 n THR 17 N -4.27 0.00 -3.92 2.61 -2.24 -1.26 -4.96 114.28 100.23 2ca7 n THR 17 Ca 0.11 -0.13 -0.22 0.00 -2.27 0.00 0.00 64.05 61.54 2ca7 n THR 17 Cb 0.44 1.11 -0.05 0.00 -2.10 0.00 0.00 70.33 69.73 2ca7 n THR 17 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 2ca7 s LYS 18 N -2.68 2.46 -0.14 -0.78 2.20 -1.26 -5.12 119.74 114.41 2ca7 s LYS 18 Ca 0.12 -1.54 0.00 0.00 -0.36 0.00 0.00 55.97 54.19 2ca7 s LYS 18 Cb 0.16 -2.25 -0.01 0.00 -1.51 0.00 0.00 37.83 34.22 2ca7 s LYS 18 CO 0.71 0.00 -0.15 0.00 -0.36 0.00 0.00 175.35 175.55 2ca7 s ALA 19 N -2.44 2.53 -0.09 3.13 0.00 -1.26 -4.49 121.76 119.14 2ca7 s ALA 19 Ca 0.41 -0.98 -0.04 0.00 0.00 0.00 0.00 51.96 51.35 2ca7 s ALA 19 Cb -0.02 -1.20 0.05 0.00 0.00 0.00 0.00 23.12 21.94 2ca7 s ALA 19 CO 0.25 0.09 0.19 -2.00 0.00 0.00 0.00 175.76 174.29 2ca7 s GLU 20 N 0.61 0.12 -0.48 0.00 2.56 -1.04 -5.03 118.70 115.45 2ca7 s GLU 20 Ca -0.08 0.49 -0.22 0.00 0.00 0.00 0.00 54.97 55.16 2ca7 s GLU 20 Cb -0.16 -0.17 0.03 0.00 2.00 0.00 0.00 34.13 35.84 2ca7 s GLU 20 CO 0.03 -0.20 0.75 0.21 -0.56 0.00 0.00 175.26 175.48 2ca7 s LYS 21 N 1.54 3.31 0.27 4.30 2.20 -1.26 -0.57 119.74 129.53 2ca7 s LYS 21 Ca -0.06 -0.34 0.01 0.00 -0.36 0.00 0.00 55.97 55.22 2ca7 s LYS 21 Cb -0.11 -3.99 -0.00 0.00 -1.51 0.00 0.00 37.83 32.21 2ca7 s LYS 21 CO -0.07 -1.17 0.05 0.54 -0.36 0.00 0.00 175.35 174.33 2ca7 n ARG 22 N 6.64 0.99 -4.14 4.03 5.12 -0.63 -4.96 116.66 123.70 2ca7 n ARG 22 Ca -0.00 -2.15 -0.15 0.00 -1.93 0.00 0.00 57.85 53.62 2ca7 n ARG 22 Cb 0.47 0.87 -0.14 0.00 -1.16 0.00 0.00 32.46 32.50 2ca7 n ARG 22 CO 0.00 0.00 0.00 -1.50 -1.93 0.00 0.00 177.63 174.20 2ca7 s ILE 23 N -2.29 0.39 0.07 0.55 2.07 -0.28 -1.57 121.20 120.15 2ca7 s ILE 23 Ca 0.06 -0.26 0.07 0.00 -1.41 0.00 0.00 60.65 59.11 2ca7 s ILE 23 Cb 0.00 -0.34 -0.03 0.00 0.13 0.00 0.00 42.46 42.22 2ca7 s ILE 23 CO 0.05 0.08 -0.18 -0.72 -1.91 0.00 0.00 174.94 172.25 2ca7 s TYR 24 N -0.19 1.59 -0.75 3.50 1.13 0.57 -0.96 117.35 122.23 2ca7 s TYR 24 Ca 0.01 -0.40 -0.26 0.00 -1.41 0.00 0.00 57.07 55.01 2ca7 s TYR 24 Cb -0.02 -0.91 0.02 0.00 -1.10 0.00 0.00 41.96 39.94 2ca7 s TYR 24 CO -0.00 0.11 1.46 -0.47 -2.51 0.00 0.00 175.55 174.14 2ca7 s TYR 25 N -1.01 2.15 -0.07 -3.49 5.04 -1.26 -0.42 117.35 118.30 2ca7 s TYR 25 Ca 0.04 0.07 -0.30 0.00 -2.44 0.00 0.00 57.07 54.44 2ca7 s TYR 25 Cb -0.09 -4.49 -0.05 0.00 0.35 0.00 0.00 41.96 37.67 2ca7 s TYR 25 CO 0.03 -2.10 1.68 1.21 -1.34 0.00 0.00 175.55 175.03 2ca7 s ASN 26 N 5.06 6.61 0.07 4.32 3.84 -0.23 -4.87 114.94 129.74 2ca7 s ASN 26 Ca 0.45 2.20 -0.15 0.00 0.21 0.00 0.00 52.86 55.57 2ca7 s ASN 26 Cb -0.08 -2.53 -0.17 0.00 -0.55 0.00 0.00 41.25 37.91 2ca7 s ASN 26 CO 0.12 -0.98 1.26 0.77 -2.79 0.00 0.00 177.10 175.48 2ca7 h SER 27 N 9.80 0.80 -0.15 -4.21 4.64 -1.83 -1.13 113.55 121.47 2ca7 h SER 27 Ca -0.39 -0.65 -0.21 0.00 -0.47 0.00 0.00 61.79 60.07 2ca7 h SER 27 Cb 1.18 -0.24 0.01 0.00 -0.31 0.00 0.00 62.40 63.04 2ca7 h SER 27 CO 0.96 1.32 -0.73 0.00 -0.87 0.00 0.00 176.83 177.51 2ca7 h ALA 28 N 0.50 0.36 0.00 5.18 0.00 -1.94 -2.68 119.26 120.68 2ca7 h ALA 28 Ca -0.05 -0.58 0.00 0.00 0.00 0.00 0.00 54.91 54.27 2ca7 h ALA 28 Cb 1.32 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.08 2ca7 h ALA 28 CO 0.14 0.69 0.00 0.54 0.00 0.00 0.00 179.25 180.62 2ca7 n ARG 29 N -3.94 0.20 -2.13 0.00 5.12 -1.24 -4.90 116.66 109.77 2ca7 n ARG 29 Ca -0.07 0.22 -0.20 0.00 -1.93 0.00 0.00 57.85 55.88 2ca7 n ARG 29 Cb 0.72 -1.76 -0.03 0.00 -1.16 0.00 0.00 32.46 30.23 2ca7 n ARG 29 CO 0.00 0.00 0.00 1.17 -1.93 0.00 0.00 177.63 176.87 2ca7 n LYS 30 N -2.10 -1.65 -3.93 5.56 3.00 -0.49 -4.97 118.16 113.58 2ca7 n LYS 30 Ca 0.05 1.03 -0.12 0.00 -0.00 0.00 0.00 58.31 59.27 2ca7 n LYS 30 Cb 0.36 -5.59 -0.13 0.00 0.00 0.00 0.00 35.03 29.67 2ca7 n LYS 30 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.40 176.75 2ca7 s GLN 31 N -4.59 0.12 0.18 1.64 -1.52 -0.82 -4.96 119.66 109.72 2ca7 s GLN 31 Ca 0.00 -0.15 -0.30 0.00 -1.95 0.00 0.00 55.36 52.96 2ca7 s GLN 31 Cb 0.00 -0.04 -0.08 0.00 -0.22 0.00 0.00 33.01 32.67 2ca7 s GLN 31 CO 0.00 0.01 1.01 0.00 -0.25 0.00 0.00 175.29 176.06 2ca7 s LEU 33 N -0.57 2.24 0.20 0.00 1.43 0.44 -4.86 118.68 117.57 2ca7 s LEU 33 Ca 0.46 -0.51 -0.28 0.00 -1.03 0.00 0.00 54.13 52.77 2ca7 s LEU 33 Cb -0.27 0.03 -0.08 0.00 0.03 0.00 0.00 46.19 45.90 2ca7 s LEU 33 CO 0.33 -0.27 0.88 -0.60 0.23 0.00 0.00 176.35 176.92 2ca7 s ARG 34 N -1.47 4.74 0.20 1.70 3.00 -1.26 -0.32 118.95 125.54 2ca7 s ARG 34 Ca -0.14 1.36 -0.10 0.00 -1.00 0.00 0.00 55.73 55.85 2ca7 s ARG 34 Cb -0.10 -3.28 -0.01 0.00 0.00 0.00 0.00 34.95 31.56 2ca7 s ARG 34 CO -0.01 0.51 0.34 -0.59 0.00 0.00 0.00 175.30 175.56 2ca7 s PHE 35 N -1.07 0.45 -0.27 5.12 -0.71 -0.61 -4.95 117.98 115.95 2ca7 s PHE 35 Ca 0.39 -0.79 -0.16 0.00 -1.04 0.00 0.00 56.93 55.33 2ca7 s PHE 35 Cb -0.25 -0.01 -0.03 0.00 -1.21 0.00 0.00 43.02 41.52 2ca7 s PHE 35 CO 0.30 -0.81 0.42 -0.51 -1.34 0.00 0.00 175.22 173.28 2ca7 s ASP 36 N -3.00 6.31 -0.19 1.98 1.01 -1.26 -1.60 116.67 119.91 2ca7 s ASP 36 Ca 0.21 0.35 -0.07 0.00 0.71 0.00 0.00 52.55 53.76 2ca7 s ASP 36 Cb 0.02 -2.24 -0.04 0.00 1.01 0.00 0.00 42.92 41.68 2ca7 s ASP 36 CO 0.04 -0.23 0.04 -0.47 0.21 0.00 0.00 175.17 174.77 2ca7 s TYR 37 N 2.16 3.16 -0.49 4.23 5.04 0.26 -4.41 117.35 127.30 2ca7 s TYR 37 Ca 0.17 -0.12 0.03 0.00 -2.44 0.00 0.00 57.07 54.71 2ca7 s TYR 37 Cb -0.16 -2.10 0.62 0.00 0.35 0.00 0.00 41.96 40.68 2ca7 s TYR 37 CO 0.10 -0.01 1.92 0.25 -1.34 0.00 0.00 175.55 176.47 2ca7 n THR 38 N 3.89 3.26 0.00 4.34 -2.24 -0.39 -2.50 114.28 120.64 2ca7 n THR 38 Ca -0.17 -2.16 0.00 0.00 -2.27 0.00 0.00 64.05 59.46 2ca7 n THR 38 Cb 0.52 -0.60 0.00 0.00 -2.10 0.00 0.00 70.33 68.15 2ca7 n THR 38 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2ca7 n GLY 39 N -1.10 0.55 2.91 3.38 0.00 -1.26 -4.10 105.19 105.58 2ca7 n GLY 39 Ca 0.59 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 46.44 2ca7 n GLY 39 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2ca7 s GLN 40 N 0.00 0.58 0.00 1.61 0.74 -1.26 -4.89 119.66 116.44 2ca7 s GLN 40 Ca 0.00 -0.12 0.00 0.00 0.05 0.00 0.00 55.36 55.29 2ca7 s GLN 40 Cb 0.00 -0.60 0.00 0.00 1.10 0.00 0.00 33.01 33.51 2ca7 s GLN 40 CO 0.00 -0.00 0.00 0.41 -0.55 0.00 0.00 175.29 175.15 2ca7 n GLY 41 N 3.58 0.97 3.99 2.59 0.00 -1.26 -3.58 105.19 111.48 2ca7 n GLY 41 Ca -0.20 -0.27 -0.23 0.00 0.00 0.00 0.00 46.02 45.31 2ca7 n GLY 41 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2ca7 s GLY 42 N -2.39 1.77 0.04 -0.02 0.00 -1.26 -2.34 107.32 103.11 2ca7 s GLY 42 Ca 0.00 -1.65 -0.06 0.00 0.00 0.00 0.00 44.72 43.01 2ca7 s GLY 42 CO 0.00 -1.12 0.12 -1.31 0.00 0.00 0.00 173.10 170.79 2ca7 s ASN 43 N -4.69 0.15 0.11 1.64 -0.87 -1.26 -5.00 114.94 105.01 2ca7 s ASN 43 Ca 0.65 -0.51 0.16 0.00 -1.57 0.00 0.00 52.86 51.60 2ca7 s ASN 43 Cb -0.06 0.25 0.70 0.00 -0.02 0.00 0.00 41.25 42.12 2ca7 s ASN 43 CO 0.44 -0.53 1.50 -0.62 -2.57 0.00 0.00 177.10 175.32 2ca7 n GLU 44 N 0.71 0.07 -2.89 -0.60 1.02 -1.26 -3.91 120.64 113.78 2ca7 n GLU 44 Ca -0.19 0.37 -0.44 0.00 -0.02 0.00 0.00 57.16 56.88 2ca7 n GLU 44 Cb 0.59 -1.65 -0.00 0.00 -0.02 0.00 0.00 31.44 30.35 2ca7 n GLU 44 CO 0.00 0.00 0.00 1.21 1.18 0.00 0.00 177.13 179.52 2ca7 s ASN 45 N -3.48 7.03 -0.24 1.62 3.84 -1.26 -4.83 114.94 117.62 2ca7 s ASN 45 Ca 0.05 -2.90 -0.04 0.00 0.21 0.00 0.00 52.86 50.18 2ca7 s ASN 45 Cb 0.08 -2.43 0.09 0.00 -0.55 0.00 0.00 41.25 38.44 2ca7 s ASN 45 CO 0.27 -0.82 0.17 0.21 -2.79 0.00 0.00 177.10 174.14 2ca7 s ASN 46 N 3.06 2.33 -0.05 -4.21 2.47 -1.25 -4.78 114.94 112.51 2ca7 s ASN 46 Ca 0.44 -0.74 0.03 0.00 0.42 0.00 0.00 52.86 53.02 2ca7 s ASN 46 Cb -0.02 0.03 -0.03 0.00 -1.45 0.00 0.00 41.25 39.78 2ca7 s ASN 46 CO 0.01 -0.38 -0.12 -0.36 -3.72 0.00 0.00 177.10 172.53 2ca7 s PHE 47 N 2.22 2.76 -0.51 0.43 0.08 -0.14 -4.97 117.98 117.85 2ca7 s PHE 47 Ca 0.07 -0.11 0.22 0.00 0.12 0.00 0.00 56.93 57.22 2ca7 s PHE 47 Cb -0.16 -1.64 -0.22 0.00 -0.57 0.00 0.00 43.02 40.44 2ca7 s PHE 47 CO -0.23 0.23 0.75 -2.13 -0.10 0.00 0.00 175.22 173.75 2ca7 n ARG 48 N 2.20 0.34 -4.07 0.44 3.00 -1.26 -1.13 116.66 116.19 2ca7 n ARG 48 Ca -0.17 -0.08 -0.14 0.00 -0.00 0.00 0.00 57.85 57.46 2ca7 n ARG 48 Cb 0.52 -1.53 -0.13 0.00 0.00 0.00 0.00 32.46 31.32 2ca7 n ARG 48 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.63 178.13 2ca7 s ARG 49 N -3.26 0.40 0.16 -0.14 3.52 -1.26 -4.86 118.95 113.50 2ca7 s ARG 49 Ca 0.00 -0.42 -0.03 0.00 -0.13 0.00 0.00 55.73 55.15 2ca7 s ARG 49 Cb 0.15 -0.26 0.00 0.00 -1.56 0.00 0.00 34.95 33.29 2ca7 s ARG 49 CO 0.87 0.06 1.39 1.15 -0.81 0.00 0.00 175.30 177.96 2ca7 h THR 50 N 4.80 1.37 -0.38 4.11 2.02 -1.97 -2.89 112.91 119.97 2ca7 h THR 50 Ca -0.31 -2.18 -0.06 0.00 0.77 0.00 0.00 66.41 64.62 2ca7 h THR 50 Cb 1.20 2.16 -0.02 0.00 -1.74 0.00 0.00 68.15 69.75 2ca7 h THR 50 CO 0.46 0.66 -0.03 0.22 0.37 0.00 0.00 175.52 177.20 2ca7 h TYR 51 N 0.30 0.66 -0.02 3.16 3.20 -1.98 -2.01 116.97 120.28 2ca7 h TYR 51 Ca -0.04 -0.08 0.00 0.00 3.14 0.00 0.00 58.73 61.75 2ca7 h TYR 51 Cb 1.37 -0.18 -0.00 0.00 1.54 0.00 0.00 36.73 39.45 2ca7 h TYR 51 CO 0.05 0.65 -0.01 -0.44 -1.64 0.00 0.00 178.16 176.78 2ca7 h ASP 52 N 0.59 -0.02 -0.15 -2.11 3.32 -1.94 0.38 116.42 116.47 2ca7 h ASP 52 Ca 0.12 0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.17 2ca7 h ASP 52 Cb 0.42 0.02 -0.01 0.00 0.22 0.00 0.00 39.33 39.98 2ca7 h ASP 52 CO 0.02 -0.01 0.06 0.00 -1.72 0.00 0.00 179.24 177.59 2ca7 h GLN 54 N 0.09 -0.27 0.27 0.00 4.15 -1.25 -2.21 115.11 115.89 2ca7 h GLN 54 Ca 0.05 0.02 -0.01 0.00 0.77 0.00 0.00 58.65 59.48 2ca7 h GLN 54 Cb 0.18 0.06 0.00 0.00 0.21 0.00 0.00 27.48 27.93 2ca7 h GLN 54 CO -0.00 -0.18 -0.13 -0.09 -1.93 0.00 0.00 178.83 176.50 2ca7 h ARG 55 N -0.28 -0.35 -0.06 1.69 2.43 -0.29 -2.36 114.38 115.16 2ca7 h ARG 55 Ca 0.05 0.02 -0.11 0.00 -0.81 0.00 0.00 59.98 59.13 2ca7 h ARG 55 Cb 0.33 0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 29.95 2ca7 h ARG 55 CO -0.14 -0.04 -0.47 0.00 -1.51 0.00 0.00 179.97 177.81 2ca7 h THR 56 N -0.69 1.34 -0.13 0.20 1.03 -1.44 -2.70 112.91 110.52 2ca7 h THR 56 Ca -0.04 -1.66 0.00 0.00 -0.01 0.00 0.00 66.41 64.70 2ca7 h THR 56 Cb 0.48 1.83 0.00 0.00 -1.07 0.00 0.00 68.15 69.38 2ca7 h THR 56 CO 0.06 0.49 0.00 0.00 -0.01 0.00 0.00 175.52 176.06 2ca7 n LEU 58 N 0.64 2.10 -3.19 0.00 7.94 -0.89 -4.65 117.00 118.95 2ca7 n LEU 58 Ca 0.17 -0.71 -0.36 0.00 -1.11 0.00 0.00 56.01 54.00 2ca7 n LEU 58 Cb 0.43 -0.02 -0.02 0.00 0.53 0.00 0.00 43.42 44.34 2ca7 n LEU 58 CO 0.15 0.37 2.08 -1.22 -1.11 0.00 0.00 177.39 177.65 2ca7 n TYR 59 N 0.38 2.33 0.62 1.96 4.01 -1.16 -4.98 117.16 120.32 2ca7 n TYR 59 Ca 0.13 -2.54 0.07 0.00 -0.16 0.00 0.00 57.90 55.41 2ca7 n TYR 59 Cb 0.47 -1.64 0.06 0.00 -0.31 0.00 0.00 39.34 37.92 2ca7 n TYR 59 CO 0.00 0.00 0.00 -2.37 -0.46 0.00 0.00 176.86 174.03