#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 0.04 0.01 0.03 2.02 -1.26 -1.96 118.70 117.58 2a36 s GLU 2 Ca 0.00 0.13 -0.10 0.00 0.02 0.00 0.00 54.97 55.02 2a36 s GLU 2 Cb 0.00 -0.05 0.01 0.00 0.10 0.00 0.00 34.13 34.19 2a36 s GLU 2 CO 0.00 -0.06 0.20 0.00 0.02 0.00 0.00 175.26 175.42 2a36 s ALA 3 N 0.38 -0.46 0.15 5.21 0.00 -1.07 -4.08 121.76 121.88 2a36 s ALA 3 Ca -0.03 -0.03 0.03 0.00 0.00 0.00 0.00 51.96 51.93 2a36 s ALA 3 Cb -0.04 0.13 -0.04 0.00 0.00 0.00 0.00 23.12 23.18 2a36 s ALA 3 CO -0.01 -0.25 0.24 -1.50 0.00 0.00 0.00 175.76 174.24 2a36 s ILE 4 N -1.60 5.12 -0.28 0.00 2.07 0.29 -1.97 121.20 124.83 2a36 s ILE 4 Ca -0.13 -0.78 -0.03 0.00 -1.41 0.00 0.00 60.65 58.31 2a36 s ILE 4 Cb -0.06 -3.63 0.09 0.00 0.13 0.00 0.00 42.46 39.00 2a36 s ILE 4 CO 0.01 -0.09 0.11 0.00 -1.91 0.00 0.00 174.94 173.06 2a36 s ALA 5 N -1.74 0.92 -0.77 1.50 0.00 -1.07 0.03 121.76 120.64 2a36 s ALA 5 Ca 0.34 -1.16 -0.09 0.00 0.00 0.00 0.00 51.96 51.05 2a36 s ALA 5 Cb -0.11 -1.41 0.20 0.00 0.00 0.00 0.00 23.12 21.81 2a36 s ALA 5 CO 0.27 -1.56 0.66 0.21 0.00 0.00 0.00 175.76 175.34 2a36 s LYS 6 N 1.93 3.24 -0.30 0.00 2.20 -0.10 -1.55 119.74 125.16 2a36 s LYS 6 Ca 0.08 -2.56 -0.16 0.00 -0.36 0.00 0.00 55.97 52.97 2a36 s LYS 6 Cb -0.16 -4.16 0.17 0.00 -1.51 0.00 0.00 37.83 32.16 2a36 s LYS 6 CO -0.28 -1.25 1.03 -1.01 -0.36 0.00 0.00 175.35 173.49 2a36 s HIS 7 N -0.06 -0.57 0.79 4.03 3.76 -1.19 -4.84 115.29 117.22 2a36 s HIS 7 Ca 0.19 1.01 -0.14 0.00 -0.15 0.00 0.00 55.06 55.97 2a36 s HIS 7 Cb -0.14 0.34 0.07 0.00 1.11 0.00 0.00 32.58 33.97 2a36 s HIS 7 CO -0.07 -0.28 1.20 0.16 -0.85 0.00 0.00 174.74 174.90 2a36 s ASP 8 N 2.25 3.72 0.00 1.40 1.47 -1.26 -4.26 116.67 119.98 2a36 s ASP 8 Ca -0.03 2.36 -0.29 0.00 1.18 0.00 0.00 52.55 55.77 2a36 s ASP 8 Cb -0.05 -2.59 0.10 0.00 -0.34 0.00 0.00 42.92 40.04 2a36 s ASP 8 CO -0.17 -2.58 0.88 0.12 0.68 0.00 0.00 175.17 174.10 2a36 s PHE 9 N -2.13 -0.35 -0.24 2.11 5.36 -1.05 -4.92 117.98 116.76 2a36 s PHE 9 Ca 0.73 0.21 -0.03 0.00 -0.96 0.00 0.00 56.93 56.88 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 -0.56 0.23 -1.12 -1.46 0.00 0.00 175.22 172.81 2a36 s SER 10 N -2.49 1.80 0.00 6.13 0.01 -1.26 -2.31 113.70 115.57 2a36 s SER 10 Ca 0.05 -0.56 0.00 0.00 1.31 0.00 0.00 55.95 56.75 2a36 s SER 10 Cb -0.01 0.31 0.00 0.00 0.21 0.00 0.00 66.02 66.53 2a36 s SER 10 CO -0.09 -0.36 0.00 0.00 0.41 0.00 0.00 173.24 173.20 2a36 n ALA 11 N 5.31 -1.09 0.81 1.44 0.00 -1.26 -4.89 120.51 120.82 2a36 n ALA 11 Ca -0.04 0.00 0.08 0.00 0.00 0.00 0.00 53.44 53.48 2a36 n ALA 11 Cb 0.47 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.85 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 -4.03 0.00 -1.04 -1.26 -4.96 114.28 102.99 2a36 n THR 12 Ca 0.00 -0.15 -0.10 0.00 -2.04 0.00 0.00 64.05 61.76 2a36 n THR 12 Cb 0.00 1.06 -0.11 0.00 -1.82 0.00 0.00 70.33 69.46 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 -2.48 0.34 0.51 2.41 0.00 -1.26 -5.04 121.76 116.24 2a36 s ALA 13 Ca 0.09 -0.80 0.16 0.00 0.00 0.00 0.00 51.96 51.41 2a36 s ALA 13 Cb 0.13 0.15 1.25 0.00 0.00 0.00 0.00 23.12 24.66 2a36 s ALA 13 CO 0.64 -0.18 2.13 -0.44 0.00 0.00 0.00 175.76 177.91 2a36 h ASP 14 N 4.21 0.04 -0.21 0.00 3.32 -2.01 0.12 116.42 121.89 2a36 h ASP 14 Ca -0.33 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.72 2a36 h ASP 14 Cb 1.19 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 40.73 2a36 h ASP 14 CO 0.47 0.03 0.00 -0.90 -1.72 0.00 0.00 179.24 177.12 2a36 n ASP 15 N -4.52 2.29 -4.96 6.45 5.75 -1.26 -4.83 116.55 115.47 2a36 n ASP 15 Ca -0.01 -2.24 -0.22 0.00 -0.01 0.00 0.00 54.79 52.31 2a36 n ASP 15 Cb 0.14 -0.46 0.02 0.00 -1.03 0.00 0.00 41.12 39.79 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 -1.62 2.34 -0.06 0.11 2.02 0.41 -0.41 118.70 121.50 2a36 s GLU 16 Ca 0.18 -1.76 -0.01 0.00 0.02 0.00 0.00 54.97 53.40 2a36 s GLU 16 Cb 0.13 -2.40 0.03 0.00 0.10 0.00 0.00 34.13 31.99 2a36 s GLU 16 CO 0.07 -0.65 0.00 -1.17 0.02 0.00 0.00 175.26 173.53 2a36 s LEU 17 N -4.43 0.76 0.58 1.80 1.98 0.30 -4.39 118.68 115.29 2a36 s LEU 17 Ca 0.48 -0.06 -0.06 0.00 -2.89 0.00 0.00 54.13 51.60 2a36 s LEU 17 Cb -0.04 -0.37 -0.00 0.00 0.66 0.00 0.00 46.19 46.44 2a36 s LEU 17 CO 0.30 -0.16 0.90 -0.44 -1.89 0.00 0.00 176.35 175.06 2a36 s SER 18 N 1.65 5.74 0.19 3.68 0.01 -1.26 -4.39 113.70 119.33 2a36 s SER 18 Ca -0.00 0.83 -0.22 0.00 1.31 0.00 0.00 55.95 57.87 2a36 s SER 18 Cb -0.13 -1.87 0.08 0.00 0.21 0.00 0.00 66.02 64.31 2a36 s SER 18 CO -0.03 -0.98 1.04 0.72 0.41 0.00 0.00 173.24 174.39 2a36 s PHE 19 N -2.98 0.09 0.42 2.43 -0.12 -0.98 -4.96 117.98 111.88 2a36 s PHE 19 Ca 0.53 -0.51 0.07 0.00 -0.05 0.00 0.00 56.93 56.97 2a36 s PHE 19 Cb -0.11 0.71 -0.04 0.00 -0.63 0.00 0.00 43.02 42.95 2a36 s PHE 19 CO 0.46 -0.95 0.23 1.03 -0.05 0.00 0.00 175.22 175.94 2a36 s ARG 20 N -2.07 2.29 0.25 1.99 1.81 -1.26 -2.52 118.95 119.44 2a36 s ARG 20 Ca 0.23 -1.79 -0.30 0.00 -1.72 0.00 0.00 55.73 52.15 2a36 s ARG 20 Cb -0.03 -2.07 -0.10 0.00 -0.45 0.00 0.00 34.95 32.30 2a36 s ARG 20 CO 0.06 -0.16 1.50 0.21 -0.68 0.00 0.00 175.30 176.23 2a36 s LYS 21 N -3.97 4.22 0.00 3.54 2.20 -1.26 -2.39 119.74 122.08 2a36 s LYS 21 Ca 0.42 2.39 0.00 0.00 -0.36 0.00 0.00 55.97 58.42 2a36 s LYS 21 Cb 0.02 -3.09 0.00 0.00 -1.51 0.00 0.00 37.83 33.25 2a36 s LYS 21 CO 0.23 -0.50 0.00 2.41 -0.36 0.00 0.00 175.35 177.13 2a36 n THR 22 N 2.51 0.00 -2.00 3.43 -1.04 -0.59 -4.90 114.28 111.69 2a36 n THR 22 Ca 0.08 0.00 -0.29 0.00 -2.04 0.00 0.00 64.05 61.80 2a36 n THR 22 Cb 0.39 0.00 0.05 0.00 -1.82 0.00 0.00 70.33 68.95 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 -0.03 2.72 -0.24 -2.82 0.74 -1.00 -4.74 119.66 114.29 2a36 s GLN 23 Ca 0.00 0.29 -0.08 0.00 0.05 0.00 0.00 55.36 55.62 2a36 s GLN 23 Cb 0.00 -2.06 -0.04 0.00 1.10 0.00 0.00 33.01 32.01 2a36 s GLN 23 CO 0.00 -1.06 0.10 -1.50 -0.55 0.00 0.00 175.29 172.28 2a36 s ILE 24 N -3.32 4.69 -0.04 -2.34 -1.16 -1.26 -2.59 121.20 115.17 2a36 s ILE 24 Ca 0.58 -0.05 0.02 0.00 -0.51 0.00 0.00 60.65 60.68 2a36 s ILE 24 Cb -0.11 -3.18 -0.03 0.00 0.61 0.00 0.00 42.46 39.75 2a36 s ILE 24 CO 0.50 0.35 -0.07 -0.76 -2.81 0.00 0.00 174.94 172.16 2a36 s LEU 25 N 1.27 3.18 -0.72 8.50 1.43 -0.83 -5.03 118.68 126.48 2a36 s LEU 25 Ca 0.05 -0.06 -0.24 0.00 -1.03 0.00 0.00 54.13 52.86 2a36 s LEU 25 Cb -0.14 -1.74 0.06 0.00 0.03 0.00 0.00 46.19 44.40 2a36 s LEU 25 CO 0.04 0.34 1.10 -0.54 0.23 0.00 0.00 176.35 177.52 2a36 s LYS 26 N -1.02 3.19 0.03 1.70 -0.14 -0.96 -2.61 119.74 119.92 2a36 s LYS 26 Ca 0.14 -0.70 -0.30 0.00 -1.36 0.00 0.00 55.97 53.75 2a36 s LYS 26 Cb -0.11 -4.30 -0.04 0.00 -1.68 0.00 0.00 37.83 31.69 2a36 s LYS 26 CO 0.04 -1.95 1.06 0.42 -0.76 0.00 0.00 175.35 174.16 2a36 s ILE 27 N 4.59 4.55 0.00 2.17 1.09 -0.83 0.12 121.20 132.89 2a36 s ILE 27 Ca 0.28 1.84 0.00 0.00 -1.10 0.00 0.00 60.65 61.67 2a36 s ILE 27 Cb -0.12 -4.18 0.00 0.00 -1.06 0.00 0.00 42.46 37.10 2a36 s ILE 27 CO 0.10 0.15 0.00 0.18 -0.10 0.00 0.00 174.94 175.27 2a36 n LEU 28 N 3.86 0.00 -3.41 2.97 4.77 -0.95 -3.78 117.00 120.46 2a36 n LEU 28 Ca 0.07 0.00 -0.14 0.00 -0.03 0.00 0.00 56.01 55.91 2a36 n LEU 28 Cb 0.49 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.48 2a36 n LEU 28 CO 0.53 0.00 -0.13 0.21 -1.33 0.00 0.00 177.39 176.68 2a36 s ASN 29 N -0.55 0.84 -0.07 -1.43 2.47 -0.81 -5.02 114.94 110.36 2a36 s ASN 29 Ca 0.00 -0.06 0.02 0.00 0.42 0.00 0.00 52.86 53.24 2a36 s ASN 29 Cb 0.00 0.76 0.01 0.00 -1.45 0.00 0.00 41.25 40.57 2a36 s ASN 29 CO 0.00 -0.32 -0.14 0.00 -3.72 0.00 0.00 177.10 172.92 2a36 s MET 30 N 2.44 1.89 0.00 0.43 0.23 -1.26 -1.20 119.30 121.83 2a36 s MET 30 Ca 0.10 -0.47 0.00 0.00 -1.03 0.00 0.00 55.69 54.29 2a36 s MET 30 Cb -0.15 -1.55 0.00 0.00 -1.53 0.00 0.00 34.83 31.60 2a36 s MET 30 CO -0.16 0.03 0.00 -0.85 -2.03 0.00 0.00 175.02 172.01 2a36 n GLU 31 N 3.84 0.00 0.00 3.16 0.28 -1.26 -4.93 120.64 121.73 2a36 n GLU 31 Ca -0.22 0.00 0.12 0.00 -0.16 0.00 0.00 57.16 56.90 2a36 n GLU 31 Cb 0.52 0.00 0.57 0.00 1.43 0.00 0.00 31.44 33.96 2a36 n GLU 31 CO 0.00 0.00 0.00 -0.40 -0.16 0.00 0.00 177.13 176.57 2a36 n ASP 32 N 0.00 0.00 -3.33 -1.84 5.75 -1.26 -4.09 116.55 111.78 2a36 n ASP 32 Ca 0.00 0.20 -0.25 0.00 -0.01 0.00 0.00 54.79 54.74 2a36 n ASP 32 Cb 0.00 -0.39 -0.09 0.00 -1.03 0.00 0.00 41.12 39.61 2a36 n ASP 32 CO 0.00 0.00 0.00 -1.81 -0.11 0.00 0.00 177.20 175.28 2a36 s ASP 33 N -2.78 1.24 0.00 -1.12 1.01 -1.26 -4.99 116.67 108.77 2a36 s ASP 33 Ca 0.18 -2.81 0.00 0.00 0.71 0.00 0.00 52.55 50.63 2a36 s ASP 33 Cb 0.16 -0.16 0.00 0.00 1.01 0.00 0.00 42.92 43.93 2a36 s ASP 33 CO 0.41 -0.17 0.08 -0.24 0.21 0.00 0.00 175.17 175.45 2a36 n SER 34 N 3.00 0.21 0.00 0.27 2.88 -1.26 -2.44 113.62 116.29 2a36 n SER 34 Ca 0.27 -0.20 0.00 0.00 -1.33 0.00 0.00 58.87 57.61 2a36 n SER 34 Cb 0.48 -0.05 0.00 0.00 -0.75 0.00 0.00 64.21 63.89 2a36 n SER 34 CO 0.00 0.00 0.00 -3.20 -1.23 0.00 0.00 175.04 170.61 2a36 n ASN 35 N 0.74 0.00 -3.96 -3.46 2.85 -1.26 -5.02 115.26 105.15 2a36 n ASN 35 Ca 0.00 0.00 -0.29 0.00 -0.11 0.00 0.00 54.58 54.18 2a36 n ASN 35 Cb 0.04 0.00 -0.16 0.00 1.24 0.00 0.00 39.78 40.90 2a36 n ASN 35 CO 0.00 0.00 0.00 0.26 -2.11 0.00 0.00 177.26 175.41 2a36 s TRP 36 N -0.83 2.05 0.19 1.20 0.52 -1.02 -0.18 118.94 120.88 2a36 s TRP 36 Ca 0.00 -1.27 -0.06 0.00 0.02 0.00 0.00 56.10 54.80 2a36 s TRP 36 Cb 0.00 -1.49 -0.06 0.00 -1.15 0.00 0.00 33.47 30.77 2a36 s TRP 36 CO 0.00 -0.67 0.45 0.71 0.02 0.00 0.00 176.95 177.46 2a36 s TYR 37 N 1.52 3.46 -0.57 -1.98 2.02 -1.10 -4.67 117.35 116.03 2a36 s TYR 37 Ca 0.01 0.63 -0.18 0.00 -0.37 0.00 0.00 57.07 57.17 2a36 s TYR 37 Cb -0.15 -2.07 0.11 0.00 -0.40 0.00 0.00 41.96 39.46 2a36 s TYR 37 CO -0.09 0.35 0.62 0.50 -1.57 0.00 0.00 175.55 175.36 2a36 s ARG 38 N -2.89 3.02 0.43 -0.62 6.06 -0.34 0.51 118.95 125.12 2a36 s ARG 38 Ca 0.43 -1.48 0.07 0.00 -2.50 0.00 0.00 55.73 52.25 2a36 s ARG 38 Cb -0.12 -4.28 -0.02 0.00 0.06 0.00 0.00 34.95 30.59 2a36 s ARG 38 CO 0.25 -1.46 0.34 0.00 -2.50 0.00 0.00 175.30 171.94 2a36 s ALA 39 N 2.25 4.01 0.10 6.12 0.00 -0.68 -1.93 121.76 131.63 2a36 s ALA 39 Ca 0.08 -1.87 0.10 0.00 0.00 0.00 0.00 51.96 50.27 2a36 s ALA 39 Cb -0.27 -0.85 -0.04 0.00 0.00 0.00 0.00 23.12 21.97 2a36 s ALA 39 CO 0.05 -0.25 -0.26 -2.00 0.00 0.00 0.00 175.76 173.30 2a36 s GLU 40 N -4.11 1.50 -0.27 0.00 -6.30 0.32 0.24 118.70 110.08 2a36 s GLU 40 Ca 0.45 -1.27 -0.14 0.00 -2.50 0.00 0.00 54.97 51.52 2a36 s GLU 40 Cb -0.02 -1.89 0.09 0.00 0.00 0.00 0.00 34.13 32.31 2a36 s GLU 40 CO 0.26 0.46 0.65 -1.17 0.02 0.00 0.00 175.26 175.48 2a36 s LEU 41 N -1.80 -0.90 0.00 2.70 2.96 -0.89 -2.27 118.68 118.48 2a36 s LEU 41 Ca 0.13 1.46 0.00 0.00 -0.22 0.00 0.00 54.13 55.50 2a36 s LEU 41 Cb -0.10 2.26 0.00 0.00 0.50 0.00 0.00 46.19 48.85 2a36 s LEU 41 CO 0.05 -0.23 0.00 0.47 -1.32 0.00 0.00 176.35 175.32 2a36 n ASP 42 N 4.54 0.00 -1.81 3.68 9.92 -1.26 -1.54 116.55 130.07 2a36 n ASP 42 Ca -0.19 0.00 -0.04 0.00 -0.53 0.00 0.00 54.79 54.04 2a36 n ASP 42 Cb 0.57 0.00 0.02 0.00 -0.64 0.00 0.00 41.12 41.07 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 1.24 2.94 0.44 0.00 -1.26 -5.13 105.19 103.42 2a36 n GLY 43 Ca 0.00 -0.19 -0.12 0.00 0.00 0.00 0.00 46.02 45.71 2a36 n GLY 43 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2a36 s LYS 44 N -0.17 0.24 -0.47 1.61 2.47 -0.59 -5.12 119.74 117.72 2a36 s LYS 44 Ca 0.07 -0.31 -0.16 0.00 -1.56 0.00 0.00 55.97 54.01 2a36 s LYS 44 Cb 0.23 -0.08 0.06 0.00 -1.46 0.00 0.00 37.83 36.57 2a36 s LYS 44 CO -0.07 0.01 0.44 -2.00 0.16 0.00 0.00 175.35 173.89 2a36 s GLU 45 N -0.65 3.02 -0.02 4.03 2.12 -1.26 -2.10 118.70 123.84 2a36 s GLU 45 Ca -0.05 -1.18 0.03 0.00 0.36 0.00 0.00 54.97 54.13 2a36 s GLU 45 Cb -0.05 -4.10 -0.00 0.00 0.26 0.00 0.00 34.13 30.25 2a36 s GLU 45 CO -0.00 -1.02 -0.09 0.20 -0.54 0.00 0.00 175.26 173.80 2a36 s GLY 46 N 2.46 0.51 0.56 -1.50 0.00 0.14 -4.80 107.32 104.69 2a36 s GLY 46 Ca 0.07 -0.37 -0.21 0.00 0.00 0.00 0.00 44.72 44.21 2a36 s GLY 46 CO 0.09 -0.19 1.35 1.08 0.00 0.00 0.00 173.10 175.43 2a36 s LEU 47 N 0.03 3.80 -0.14 0.66 1.43 0.45 -1.69 118.68 123.22 2a36 s LEU 47 Ca -0.00 2.75 -0.04 0.00 -1.03 0.00 0.00 54.13 55.80 2a36 s LEU 47 Cb -0.07 -4.33 0.07 0.00 0.03 0.00 0.00 46.19 41.89 2a36 s LEU 47 CO 0.00 -1.65 0.24 0.27 0.23 0.00 0.00 176.35 175.44 2a36 s ILE 48 N -1.32 -0.38 0.09 -0.59 -5.25 0.18 0.11 121.20 114.05 2a36 s ILE 48 Ca 0.74 0.19 -0.12 0.00 -0.99 0.00 0.00 60.65 60.46 2a36 s ILE 48 Cb -0.40 -0.49 -0.08 0.00 2.95 0.00 0.00 42.46 44.44 2a36 s ILE 48 CO 0.46 0.04 0.22 -2.65 -1.79 0.00 0.00 174.94 171.23 2a36 n PRO 49 N 5.34 0.00 0.03 0.37 -0.01 -1.26 -2.71 135.00 136.75 2a36 n PRO 49 Ca -0.06 0.00 -0.19 0.00 -0.01 0.00 0.00 63.50 63.25 2a36 n PRO 49 Cb 0.50 -0.44 -0.13 0.00 -0.01 0.00 0.00 33.50 33.42 2a36 n PRO 49 CO 0.00 0.00 0.00 0.66 -0.01 0.00 0.00 175.50 176.15 2a36 h SER 50 N 0.43 0.51 0.54 2.55 4.64 -0.92 -3.37 113.55 117.94 2a36 h SER 50 Ca -0.13 -0.85 0.00 0.00 -0.47 0.00 0.00 61.79 60.35 2a36 h SER 50 Cb 0.64 -0.16 0.00 0.00 -0.31 0.00 0.00 62.40 62.57 2a36 h SER 50 CO 0.25 1.30 0.00 0.78 -0.87 0.00 0.00 176.83 178.29 2a36 h ASN 51 N -0.21 0.00 0.09 4.97 4.21 -1.91 -2.69 115.58 120.03 2a36 h ASN 51 Ca -0.11 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.40 2a36 h ASN 51 Cb 1.47 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.67 2a36 h ASN 51 CO 0.14 0.00 -0.17 -1.22 -1.29 0.00 0.00 177.43 174.88 2a36 n TYR 52 N -2.30 0.00 -3.99 1.19 4.02 -1.26 -4.94 117.16 109.88 2a36 n TYR 52 Ca 0.01 0.00 -0.09 0.00 -0.01 0.00 0.00 57.90 57.81 2a36 n TYR 52 Cb 0.18 -0.05 -0.08 0.00 -0.02 0.00 0.00 39.34 39.37 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 -2.27 0.10 0.05 -0.72 -1.16 -1.01 -0.93 121.20 115.25 2a36 s ILE 53 Ca 0.28 -1.49 -0.10 0.00 -0.51 0.00 0.00 60.65 58.83 2a36 s ILE 53 Cb 0.20 -1.78 0.01 0.00 0.61 0.00 0.00 42.46 41.49 2a36 s ILE 53 CO 0.44 -0.44 0.22 -1.61 -2.81 0.00 0.00 174.94 170.75 2a36 s GLU 54 N -3.96 0.76 0.00 3.50 8.01 0.10 -4.90 118.70 122.21 2a36 s GLU 54 Ca 0.16 -0.67 -0.30 0.00 0.01 0.00 0.00 54.97 54.17 2a36 s GLU 54 Cb 0.05 0.32 -0.06 0.00 -4.31 0.00 0.00 34.13 30.12 2a36 s GLU 54 CO -0.02 -0.23 1.55 1.41 0.01 0.00 0.00 175.26 177.98 2a36 s MET 55 N -2.85 4.22 0.00 1.61 -2.45 -1.26 -0.55 119.30 118.03 2a36 s MET 55 Ca -0.03 2.14 0.00 0.00 -1.25 0.00 0.00 55.69 56.55 2a36 s MET 55 Cb 0.00 -3.70 0.00 0.00 1.25 0.00 0.00 34.83 32.38 2a36 s MET 55 CO -0.05 -0.71 0.00 1.17 1.05 0.00 0.00 175.02 176.48 2a36 n LYS 56 N 5.96 0.00 -1.69 4.11 4.81 -1.26 -4.79 118.16 125.31 2a36 n LYS 56 Ca 0.15 0.00 -0.44 0.00 -0.87 0.00 0.00 58.31 57.15 2a36 n LYS 56 Cb 0.42 0.00 -0.03 0.00 0.02 0.00 0.00 35.03 35.44 2a36 n LYS 56 CO 0.00 0.00 0.00 0.27 1.17 0.00 0.00 177.40 178.84 2a36 n ASN 57 N 0.00 3.81 0.00 3.14 6.94 -1.26 -4.27 115.26 123.62 2a36 n ASN 57 Ca 0.00 1.00 0.00 0.00 -0.02 0.00 0.00 54.58 55.56 2a36 n ASN 57 Cb 0.00 -1.50 0.00 0.00 -2.36 0.00 0.00 39.78 35.92 2a36 n ASN 57 CO 0.00 0.00 0.00 1.57 -1.03 0.00 0.00 177.26 177.80 2a36 n HIS 58 N 5.38 0.00 -0.23 -2.53 -0.00 -1.26 -4.82 115.22 111.76 2a36 n HIS 58 Ca 0.18 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.36 2a36 n HIS 58 Cb 0.35 0.00 0.00 0.00 -0.12 0.00 0.00 29.99 30.22 2a36 n HIS 58 CO 0.00 0.00 0.00 -3.47 0.46 0.00 0.00 176.34 173.33