#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2a36 s GLU 2 N 0.00 0.83 -0.05 2.12 2.02 -1.26 -3.83 118.70 118.53 2a36 s GLU 2 Ca 0.00 -0.36 -0.07 0.00 0.02 0.00 0.00 54.97 54.56 2a36 s GLU 2 Cb 0.00 -0.80 0.02 0.00 0.10 0.00 0.00 34.13 33.44 2a36 s GLU 2 CO 0.00 0.21 0.18 0.00 0.02 0.00 0.00 175.26 175.67 2a36 s ALA 3 N -0.20 -0.45 0.15 5.21 0.00 -0.74 -2.21 121.76 123.51 2a36 s ALA 3 Ca 0.03 0.39 0.05 0.00 0.00 0.00 0.00 51.96 52.43 2a36 s ALA 3 Cb -0.04 -0.21 -0.04 0.00 0.00 0.00 0.00 23.12 22.83 2a36 s ALA 3 CO -0.00 -0.12 0.13 -1.50 0.00 0.00 0.00 175.76 174.27 2a36 s ILE 4 N -0.25 4.52 -0.22 0.00 2.07 -0.90 0.07 121.20 126.48 2a36 s ILE 4 Ca -0.03 -1.02 -0.03 0.00 -1.41 0.00 0.00 60.65 58.15 2a36 s ILE 4 Cb -0.03 -3.28 0.11 0.00 0.13 0.00 0.00 42.46 39.39 2a36 s ILE 4 CO 0.01 -0.07 0.26 0.00 -1.91 0.00 0.00 174.94 173.23 2a36 s ALA 5 N -1.69 -0.47 -0.64 1.50 0.00 -1.15 -0.60 121.76 118.72 2a36 s ALA 5 Ca 0.31 0.35 -0.08 0.00 0.00 0.00 0.00 51.96 52.54 2a36 s ALA 5 Cb -0.10 -1.44 0.17 0.00 0.00 0.00 0.00 23.12 21.74 2a36 s ALA 5 CO 0.23 -1.26 0.51 0.21 0.00 0.00 0.00 175.76 175.45 2a36 s LYS 6 N 2.38 2.84 -0.30 0.00 2.20 0.03 -1.21 119.74 125.68 2a36 s LYS 6 Ca 0.08 -2.31 -0.15 0.00 -0.36 0.00 0.00 55.97 53.24 2a36 s LYS 6 Cb -0.16 -3.99 0.16 0.00 -1.51 0.00 0.00 37.83 32.34 2a36 s LYS 6 CO -0.15 -1.21 0.97 -1.01 -0.36 0.00 0.00 175.35 173.59 2a36 s HIS 7 N 0.38 -0.71 0.79 4.03 3.76 -1.20 -4.83 115.29 117.52 2a36 s HIS 7 Ca 0.14 1.25 -0.13 0.00 -0.15 0.00 0.00 55.06 56.16 2a36 s HIS 7 Cb -0.19 0.43 0.08 0.00 1.11 0.00 0.00 32.58 34.00 2a36 s HIS 7 CO -0.04 -0.35 1.21 0.16 -0.85 0.00 0.00 174.74 174.86 2a36 s ASP 8 N 2.37 3.69 -0.00 1.40 -4.77 -1.26 -4.25 116.67 113.85 2a36 s ASP 8 Ca -0.03 2.36 -0.29 0.00 -3.30 0.00 0.00 52.55 51.29 2a36 s ASP 8 Cb -0.06 -2.59 0.10 0.00 -1.09 0.00 0.00 42.92 39.28 2a36 s ASP 8 CO -0.17 -2.60 0.88 0.12 0.70 0.00 0.00 175.17 174.09 2a36 s PHE 9 N -2.13 -0.35 -0.26 2.11 5.36 -0.99 -4.95 117.98 116.76 2a36 s PHE 9 Ca 0.73 0.22 -0.03 0.00 -0.96 0.00 0.00 56.93 56.90 2a36 s PHE 9 Cb -0.29 0.54 0.11 0.00 -0.34 0.00 0.00 43.02 43.04 2a36 s PHE 9 CO 0.50 -0.55 0.20 -1.12 -1.46 0.00 0.00 175.22 172.79 2a36 s SER 10 N -2.48 2.40 0.00 6.13 0.01 -1.26 -2.41 113.70 116.09 2a36 s SER 10 Ca 0.05 -0.86 0.00 0.00 1.31 0.00 0.00 55.95 56.45 2a36 s SER 10 Cb -0.01 0.09 0.00 0.00 0.21 0.00 0.00 66.02 66.31 2a36 s SER 10 CO -0.09 -0.39 0.00 0.00 0.41 0.00 0.00 173.24 173.16 2a36 n ALA 11 N 5.29 -1.11 0.57 1.44 0.00 -1.26 -4.90 120.51 120.55 2a36 n ALA 11 Ca -0.05 0.00 0.08 0.00 0.00 0.00 0.00 53.44 53.47 2a36 n ALA 11 Cb 0.45 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.81 2a36 n ALA 11 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 2a36 n THR 12 N 0.00 0.00 -4.17 0.00 -1.04 -1.26 -4.95 114.28 102.85 2a36 n THR 12 Ca 0.00 -0.18 -0.18 0.00 -2.04 0.00 0.00 64.05 61.65 2a36 n THR 12 Cb 0.00 0.81 -0.12 0.00 -1.82 0.00 0.00 70.33 69.20 2a36 n THR 12 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2a36 s ALA 13 N -2.62 1.18 0.45 2.41 0.00 -1.26 -5.04 121.76 116.88 2a36 s ALA 13 Ca 0.03 -1.03 0.11 0.00 0.00 0.00 0.00 51.96 51.07 2a36 s ALA 13 Cb 0.12 -0.08 1.03 0.00 0.00 0.00 0.00 23.12 24.18 2a36 s ALA 13 CO 0.65 0.14 2.09 0.38 0.00 0.00 0.00 175.76 179.02 2a36 h ASP 14 N 4.17 0.28 -0.24 0.00 2.03 -2.02 0.02 116.42 120.65 2a36 h ASP 14 Ca -0.40 -0.01 -0.02 0.00 -0.73 0.00 0.00 57.03 55.87 2a36 h ASP 14 Cb 1.19 -0.07 -0.01 0.00 -0.83 0.00 0.00 39.33 39.61 2a36 h ASP 14 CO 0.42 0.20 0.03 -0.90 -1.03 0.00 0.00 179.24 177.96 2a36 n ASP 15 N -4.50 2.88 -4.96 4.15 5.75 -1.26 -4.84 116.55 113.76 2a36 n ASP 15 Ca 0.01 -2.39 -0.23 0.00 -0.01 0.00 0.00 54.79 52.18 2a36 n ASP 15 Cb 0.08 -0.58 0.02 0.00 -1.03 0.00 0.00 41.12 39.62 2a36 n ASP 15 CO 0.00 0.00 0.00 -1.61 -0.11 0.00 0.00 177.20 175.48 2a36 s GLU 16 N -1.63 2.32 -0.05 0.11 8.01 -0.01 -1.48 118.70 125.96 2a36 s GLU 16 Ca 0.21 -1.80 -0.00 0.00 0.01 0.00 0.00 54.97 53.39 2a36 s GLU 16 Cb 0.16 -2.37 0.03 0.00 -4.31 0.00 0.00 34.13 27.64 2a36 s GLU 16 CO 0.06 -0.67 -0.01 -1.17 0.01 0.00 0.00 175.26 173.48 2a36 s LEU 17 N -4.43 0.89 0.57 1.80 1.98 0.36 -4.46 118.68 115.39 2a36 s LEU 17 Ca 0.48 -0.07 -0.06 0.00 -2.89 0.00 0.00 54.13 51.59 2a36 s LEU 17 Cb -0.04 -0.36 -0.01 0.00 0.66 0.00 0.00 46.19 46.45 2a36 s LEU 17 CO 0.30 -0.14 0.89 -0.44 -1.89 0.00 0.00 176.35 175.07 2a36 s SER 18 N 1.47 5.79 0.14 3.68 0.01 -1.26 -4.41 113.70 119.12 2a36 s SER 18 Ca -0.03 0.84 -0.19 0.00 1.31 0.00 0.00 55.95 57.88 2a36 s SER 18 Cb -0.13 -1.90 0.07 0.00 0.21 0.00 0.00 66.02 64.26 2a36 s SER 18 CO -0.03 -0.95 0.93 2.22 0.41 0.00 0.00 173.24 175.82 2a36 n PHE 19 N -2.54 -1.17 -4.25 2.43 1.16 -1.01 -4.96 117.46 107.12 2a36 n PHE 19 Ca 0.04 -1.06 -0.25 0.00 -1.87 0.00 0.00 57.45 54.31 2a36 n PHE 19 Cb 0.57 0.52 -0.08 0.00 -1.61 0.00 0.00 39.48 38.87 2a36 n PHE 19 CO 0.00 0.00 0.00 0.50 -1.87 0.00 0.00 176.76 175.39 2a36 s ARG 20 N -2.04 2.16 0.28 3.97 3.52 -1.26 -2.36 118.95 123.22 2a36 s ARG 20 Ca 0.21 -1.79 -0.30 0.00 -0.13 0.00 0.00 55.73 53.72 2a36 s ARG 20 Cb -0.02 -1.95 -0.11 0.00 -1.56 0.00 0.00 34.95 31.31 2a36 s ARG 20 CO 0.04 0.02 1.51 0.15 -0.81 0.00 0.00 175.30 176.21 2a36 s LYS 21 N -3.80 4.20 0.00 5.12 1.02 -1.26 -2.55 119.74 122.46 2a36 s LYS 21 Ca 0.38 2.43 0.00 0.00 0.02 0.00 0.00 55.97 58.80 2a36 s LYS 21 Cb 0.02 -3.06 0.00 0.00 -0.52 0.00 0.00 37.83 34.27 2a36 s LYS 21 CO 0.21 -0.51 0.00 2.41 -0.92 0.00 0.00 175.35 176.53 2a36 n THR 22 N 2.16 0.00 -2.77 2.17 -1.04 -0.35 -4.89 114.28 109.55 2a36 n THR 22 Ca 0.07 0.00 -0.36 0.00 -2.04 0.00 0.00 64.05 61.72 2a36 n THR 22 Cb 0.39 -0.07 -0.06 0.00 -1.82 0.00 0.00 70.33 68.76 2a36 n THR 22 CO 0.00 0.00 0.00 -1.58 -0.64 0.00 0.00 175.07 172.85 2a36 s GLN 23 N -0.14 4.42 -0.32 -2.82 0.74 -1.06 -4.75 119.66 115.73 2a36 s GLN 23 Ca 0.00 1.28 -0.24 0.00 0.05 0.00 0.00 55.36 56.44 2a36 s GLN 23 Cb 0.00 -2.56 0.01 0.00 1.10 0.00 0.00 33.01 31.55 2a36 s GLN 23 CO 0.00 0.13 0.84 0.96 -0.55 0.00 0.00 175.29 176.67 2a36 s ILE 24 N -1.81 4.73 -0.04 -2.34 -4.36 -1.26 -2.92 121.20 113.19 2a36 s ILE 24 Ca 0.55 1.25 -0.01 0.00 -0.26 0.00 0.00 60.65 62.19 2a36 s ILE 24 Cb -0.16 -4.21 -0.04 0.00 1.25 0.00 0.00 42.46 39.31 2a36 s ILE 24 CO 0.20 -0.32 0.04 -0.76 0.24 0.00 0.00 174.94 174.34 2a36 s LEU 25 N 3.11 3.73 -0.71 0.37 1.43 0.11 -4.95 118.68 121.78 2a36 s LEU 25 Ca 0.35 0.13 -0.24 0.00 -1.03 0.00 0.00 54.13 53.34 2a36 s LEU 25 Cb -0.14 -2.05 0.06 0.00 0.03 0.00 0.00 46.19 44.09 2a36 s LEU 25 CO 0.14 0.32 1.07 -0.54 0.23 0.00 0.00 176.35 177.56 2a36 s LYS 26 N -1.39 3.17 0.06 1.70 -0.14 -0.97 -1.79 119.74 120.39 2a36 s LYS 26 Ca 0.19 -0.74 -0.30 0.00 -1.36 0.00 0.00 55.97 53.75 2a36 s LYS 26 Cb -0.12 -4.29 -0.05 0.00 -1.68 0.00 0.00 37.83 31.70 2a36 s LYS 26 CO 0.09 -1.91 1.03 0.42 -0.76 0.00 0.00 175.35 174.21 2a36 s ILE 27 N 4.45 4.50 0.00 2.17 -1.09 -1.25 0.14 121.20 130.13 2a36 s ILE 27 Ca 0.27 1.90 0.00 0.00 -2.23 0.00 0.00 60.65 60.58 2a36 s ILE 27 Cb -0.13 -4.21 0.00 0.00 -1.58 0.00 0.00 42.46 36.53 2a36 s ILE 27 CO 0.10 0.20 0.00 0.00 -1.23 0.00 0.00 174.94 174.01 2a36 n LEU 28 N 3.46 0.00 -3.40 2.97 -0.00 -0.99 -4.26 117.00 114.78 2a36 n LEU 28 Ca 0.05 0.00 -0.13 0.00 -0.00 0.00 0.00 56.01 55.93 2a36 n LEU 28 Cb 0.49 0.00 -0.09 0.00 -0.00 0.00 0.00 43.42 43.82 2a36 n LEU 28 CO 0.53 0.00 -0.12 0.21 -0.00 0.00 0.00 177.39 178.00 2a36 s ASN 29 N 0.00 0.90 -0.06 1.45 3.84 -0.36 -5.01 114.94 115.71 2a36 s ASN 29 Ca 0.00 -0.19 0.02 0.00 0.21 0.00 0.00 52.86 52.90 2a36 s ASN 29 Cb 0.00 0.77 0.01 0.00 -0.55 0.00 0.00 41.25 41.48 2a36 s ASN 29 CO 0.00 -0.33 -0.12 0.00 -2.79 0.00 0.00 177.10 173.85 2a36 s MET 30 N 2.44 1.65 0.00 0.43 0.23 -1.26 -0.14 119.30 122.65 2a36 s MET 30 Ca 0.10 -0.42 0.00 0.00 -1.03 0.00 0.00 55.69 54.34 2a36 s MET 30 Cb -0.15 -1.37 0.00 0.00 -1.53 0.00 0.00 34.83 31.78 2a36 s MET 30 CO -0.20 0.05 0.00 -0.85 -2.03 0.00 0.00 175.02 171.98 2a36 n GLU 31 N 3.73 0.00 0.00 3.16 0.28 -1.26 -4.94 120.64 121.61 2a36 n GLU 31 Ca -0.22 0.00 0.11 0.00 -0.16 0.00 0.00 57.16 56.89 2a36 n GLU 31 Cb 0.52 0.00 0.53 0.00 1.43 0.00 0.00 31.44 33.92 2a36 n GLU 31 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 2a36 n ASP 32 N 0.00 0.00 -3.37 -1.84 8.00 -1.26 -4.08 116.55 114.00 2a36 n ASP 32 Ca 0.00 0.34 -0.26 0.00 0.71 0.00 0.00 54.79 55.58 2a36 n ASP 32 Cb 0.00 -0.44 -0.10 0.00 -0.02 0.00 0.00 41.12 40.57 2a36 n ASP 32 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2a36 s ASP 33 N -2.87 1.46 0.00 -2.24 2.15 -1.26 -4.99 116.67 108.91 2a36 s ASP 33 Ca 0.15 -2.84 0.00 0.00 0.43 0.00 0.00 52.55 50.28 2a36 s ASP 33 Cb 0.15 -0.28 0.00 0.00 -0.30 0.00 0.00 42.92 42.49 2a36 s ASP 33 CO 0.41 -0.19 0.03 -1.20 -0.17 0.00 0.00 175.17 174.05 2a36 n SER 34 N 3.05 0.09 0.00 -0.34 7.64 -1.26 -2.46 113.62 120.34 2a36 n SER 34 Ca 0.26 -0.09 0.00 0.00 1.01 0.00 0.00 58.87 60.05 2a36 n SER 34 Cb 0.47 -0.02 0.00 0.00 -1.01 0.00 0.00 64.21 63.64 2a36 n SER 34 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 2a36 n ASN 35 N 0.72 0.00 -4.01 6.43 4.05 -1.26 -5.04 115.26 116.15 2a36 n ASN 35 Ca 0.00 0.00 -0.30 0.00 0.45 0.00 0.00 54.58 54.73 2a36 n ASN 35 Cb 0.02 0.00 -0.16 0.00 1.23 0.00 0.00 39.78 40.86 2a36 n ASN 35 CO 0.00 0.00 0.00 0.26 -3.05 0.00 0.00 177.26 174.47 2a36 s TRP 36 N -0.99 2.13 0.18 1.20 0.52 -1.03 -0.51 118.94 120.44 2a36 s TRP 36 Ca 0.00 -1.20 -0.05 0.00 0.02 0.00 0.00 56.10 54.87 2a36 s TRP 36 Cb 0.00 -1.57 -0.06 0.00 -1.15 0.00 0.00 33.47 30.69 2a36 s TRP 36 CO 0.00 -0.66 0.43 0.71 0.02 0.00 0.00 176.95 177.44 2a36 s TYR 37 N 1.50 3.47 -0.55 -1.98 2.02 -1.09 -4.69 117.35 116.02 2a36 s TYR 37 Ca 0.05 0.60 -0.18 0.00 -0.37 0.00 0.00 57.07 57.17 2a36 s TYR 37 Cb -0.13 -2.05 0.11 0.00 -0.40 0.00 0.00 41.96 39.49 2a36 s TYR 37 CO -0.11 0.37 0.59 1.03 -1.57 0.00 0.00 175.55 175.87 2a36 s ARG 38 N -2.84 3.02 0.42 -0.62 0.52 0.81 0.14 118.95 120.40 2a36 s ARG 38 Ca 0.42 -1.43 0.08 0.00 -0.52 0.00 0.00 55.73 54.28 2a36 s ARG 38 Cb -0.12 -4.25 -0.03 0.00 0.52 0.00 0.00 34.95 31.07 2a36 s ARG 38 CO 0.25 -1.39 0.33 0.00 0.02 0.00 0.00 175.30 174.51 2a36 s ALA 39 N 2.19 3.96 0.09 2.13 0.00 -0.03 -1.22 121.76 128.88 2a36 s ALA 39 Ca 0.08 -1.93 0.10 0.00 0.00 0.00 0.00 51.96 50.21 2a36 s ALA 39 Cb -0.26 -0.85 -0.04 0.00 0.00 0.00 0.00 23.12 21.97 2a36 s ALA 39 CO 0.06 -0.22 -0.26 -1.21 0.00 0.00 0.00 175.76 174.13 2a36 s GLU 40 N -4.08 1.60 -0.27 0.00 2.02 0.38 -0.24 118.70 118.11 2a36 s GLU 40 Ca 0.46 -1.23 -0.15 0.00 0.02 0.00 0.00 54.97 54.07 2a36 s GLU 40 Cb -0.01 -1.95 0.08 0.00 0.10 0.00 0.00 34.13 32.35 2a36 s GLU 40 CO 0.26 0.48 0.65 -1.17 0.02 0.00 0.00 175.26 175.50 2a36 s LEU 41 N -1.70 -0.86 0.00 1.80 2.96 -0.96 -2.29 118.68 117.63 2a36 s LEU 41 Ca 0.13 1.44 0.00 0.00 -0.22 0.00 0.00 54.13 55.48 2a36 s LEU 41 Cb -0.10 2.24 0.00 0.00 0.50 0.00 0.00 46.19 48.83 2a36 s LEU 41 CO 0.04 -0.23 0.00 0.47 -1.32 0.00 0.00 176.35 175.31 2a36 n ASP 42 N 4.42 0.00 -2.11 3.68 9.92 -1.26 -1.58 116.55 129.62 2a36 n ASP 42 Ca -0.20 0.00 -0.03 0.00 -0.53 0.00 0.00 54.79 54.03 2a36 n ASP 42 Cb 0.58 0.00 0.06 0.00 -0.64 0.00 0.00 41.12 41.12 2a36 n ASP 42 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2a36 n GLY 43 N 0.00 1.52 2.96 0.44 0.00 -1.26 -5.13 105.19 103.72 2a36 n GLY 43 Ca 0.00 -0.15 -0.13 0.00 0.00 0.00 0.00 46.02 45.73 2a36 n GLY 43 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2a36 s LYS 44 N -0.03 0.33 -0.42 1.61 -0.14 -0.61 -5.12 119.74 115.35 2a36 s LYS 44 Ca 0.07 -0.31 -0.13 0.00 -1.36 0.00 0.00 55.97 54.24 2a36 s LYS 44 Cb 0.30 -0.22 0.05 0.00 -1.68 0.00 0.00 37.83 36.27 2a36 s LYS 44 CO -0.09 0.05 0.29 -2.00 -0.76 0.00 0.00 175.35 172.85 2a36 s GLU 45 N -0.56 2.85 0.02 1.68 2.12 -1.26 -2.27 118.70 121.29 2a36 s GLU 45 Ca -0.03 -1.22 0.01 0.00 0.36 0.00 0.00 54.97 54.09 2a36 s GLU 45 Cb -0.04 -3.91 -0.02 0.00 0.26 0.00 0.00 34.13 30.42 2a36 s GLU 45 CO -0.00 -0.85 -0.04 0.20 -0.54 0.00 0.00 175.26 174.03 2a36 s GLY 46 N 1.98 0.26 0.56 -1.50 0.00 0.67 -4.89 107.32 104.40 2a36 s GLY 46 Ca 0.03 -0.49 -0.21 0.00 0.00 0.00 0.00 44.72 44.06 2a36 s GLY 46 CO 0.06 -0.53 1.31 1.08 0.00 0.00 0.00 173.10 175.03 2a36 s LEU 47 N -1.08 3.81 -0.15 0.66 1.02 -0.55 -0.85 118.68 121.53 2a36 s LEU 47 Ca -0.10 2.65 -0.04 0.00 0.02 0.00 0.00 54.13 56.66 2a36 s LEU 47 Cb -0.07 -4.36 0.07 0.00 0.02 0.00 0.00 46.19 41.85 2a36 s LEU 47 CO -0.00 -1.56 0.21 0.27 0.02 0.00 0.00 176.35 175.29 2a36 s ILE 48 N -1.38 -0.33 0.05 -0.59 -4.36 0.37 0.13 121.20 115.10 2a36 s ILE 48 Ca 0.73 0.11 -0.11 0.00 -0.26 0.00 0.00 60.65 61.12 2a36 s ILE 48 Cb -0.37 -0.51 -0.06 0.00 1.25 0.00 0.00 42.46 42.76 2a36 s ILE 48 CO 0.43 -0.03 0.24 -2.65 0.24 0.00 0.00 174.94 173.17 2a36 n PRO 49 N 5.33 0.00 -0.03 0.37 -0.02 -1.26 -2.67 135.00 136.72 2a36 n PRO 49 Ca -0.05 0.00 -0.15 0.00 -2.02 0.00 0.00 63.50 61.27 2a36 n PRO 49 Cb 0.50 -0.41 -0.09 0.00 -0.02 0.00 0.00 33.50 33.48 2a36 n PRO 49 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 2a36 h SER 50 N 0.56 0.53 0.71 2.55 0.87 -1.12 -3.33 113.55 114.31 2a36 h SER 50 Ca -0.12 -0.63 0.00 0.00 -1.23 0.00 0.00 61.79 59.81 2a36 h SER 50 Cb 0.51 -0.16 0.00 0.00 -0.44 0.00 0.00 62.40 62.32 2a36 h SER 50 CO 0.21 1.07 0.00 -1.13 -0.53 0.00 0.00 176.83 176.45 2a36 h ASN 51 N 0.02 0.00 0.47 6.23 -0.73 -1.90 -2.68 115.58 116.99 2a36 h ASN 51 Ca -0.02 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.15 2a36 h ASN 51 Cb 1.05 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.64 2a36 h ASN 51 CO 0.09 0.00 -0.76 -1.22 -0.37 0.00 0.00 177.43 175.17 2a36 n TYR 52 N -2.35 0.17 -4.19 0.67 4.02 -1.25 -4.92 117.16 109.31 2a36 n TYR 52 Ca 0.02 0.05 -0.12 0.00 -0.01 0.00 0.00 57.90 57.84 2a36 n TYR 52 Cb 0.22 -0.34 -0.10 0.00 -0.02 0.00 0.00 39.34 39.10 2a36 n TYR 52 CO 0.00 0.00 0.00 -1.50 -1.01 0.00 0.00 176.86 174.35 2a36 s ILE 53 N -3.09 0.55 0.02 -0.72 2.07 -1.01 -0.79 121.20 118.23 2a36 s ILE 53 Ca 0.07 -1.94 -0.09 0.00 -1.41 0.00 0.00 60.65 57.28 2a36 s ILE 53 Cb 0.16 -1.95 0.00 0.00 0.13 0.00 0.00 42.46 40.80 2a36 s ILE 53 CO 0.76 -0.62 0.18 -1.61 -1.91 0.00 0.00 174.94 171.73 2a36 s GLU 54 N -3.92 0.61 0.08 3.50 0.41 0.23 -4.82 118.70 114.80 2a36 s GLU 54 Ca 0.19 -0.52 -0.31 0.00 -0.41 0.00 0.00 54.97 53.93 2a36 s GLU 54 Cb 0.06 0.25 -0.09 0.00 -1.78 0.00 0.00 34.13 32.57 2a36 s GLU 54 CO 0.00 -0.16 1.80 -1.64 -0.49 0.00 0.00 175.26 174.77 2a36 s MET 55 N -2.04 4.16 0.00 1.61 -1.94 -1.26 -2.12 119.30 117.70 2a36 s MET 55 Ca -0.09 2.51 0.00 0.00 -1.71 0.00 0.00 55.69 56.39 2a36 s MET 55 Cb -0.04 -3.72 0.00 0.00 2.01 0.00 0.00 34.83 33.09 2a36 s MET 55 CO -0.01 -0.83 0.00 1.17 -0.01 0.00 0.00 175.02 175.33 2a36 n LYS 56 N 6.07 3.06 -3.84 2.03 4.81 -0.94 -4.76 118.16 124.59 2a36 n LYS 56 Ca 0.18 0.00 -0.28 0.00 -0.87 0.00 0.00 58.31 57.33 2a36 n LYS 56 Cb 0.40 0.00 0.01 0.00 0.02 0.00 0.00 35.03 35.45 2a36 n LYS 56 CO 0.00 0.00 0.00 -1.71 1.17 0.00 0.00 177.40 176.86 2a36 n ASN 57 N 0.00 -2.32 0.00 3.14 2.85 -1.22 -4.44 115.26 113.28 2a36 n ASN 57 Ca 0.00 -1.01 0.00 0.00 -0.11 0.00 0.00 54.58 53.46 2a36 n ASN 57 Cb 0.00 -3.19 0.00 0.00 1.24 0.00 0.00 39.78 37.83 2a36 n ASN 57 CO 0.00 0.00 0.00 1.57 -2.11 0.00 0.00 177.26 176.72 2a36 n HIS 58 N -4.34 0.00 -0.78 1.20 -0.00 -1.26 -5.00 115.22 105.04 2a36 n HIS 58 Ca -0.22 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.50 2a36 n HIS 58 Cb 0.65 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.64 2a36 n HIS 58 CO 0.00 0.00 0.00 -3.47 -0.00 0.00 0.00 176.34 172.87