#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1utf n ASN 6 N 0.00 3.16 -4.89 3.42 4.05 -1.26 -5.02 115.26 114.73 1utf n ASN 6 Ca 0.00 -3.65 -0.30 0.00 0.45 0.00 0.00 54.58 51.08 1utf n ASN 6 Cb 0.00 -0.72 0.05 0.00 1.23 0.00 0.00 39.78 40.34 1utf n ASN 6 CO 0.00 0.00 0.00 -0.94 -3.05 0.00 0.00 177.26 173.27 1utf s SER 7 N -1.96 5.39 0.90 1.20 1.04 -1.26 -5.04 113.70 113.97 1utf s SER 7 Ca 0.50 1.08 -0.11 0.00 0.48 0.00 0.00 55.95 57.90 1utf s SER 7 Cb 0.43 -1.87 0.13 0.00 0.10 0.00 0.00 66.02 64.82 1utf s SER 7 CO 0.05 -1.37 1.11 -0.62 0.98 0.00 0.00 173.24 173.39 1utf s ASP 8 N -4.37 3.22 0.14 7.02 -1.08 -1.26 -4.77 116.67 115.57 1utf s ASP 8 Ca 0.58 1.89 0.01 0.00 -0.52 0.00 0.00 52.55 54.51 1utf s ASP 8 Cb -0.11 -2.46 -0.04 0.00 -1.46 0.00 0.00 42.92 38.85 1utf s ASP 8 CO 0.51 -2.86 0.00 0.72 0.52 0.00 0.00 175.17 174.06 1utf s PHE 9 N -2.75 1.02 0.11 -5.34 -0.12 -1.26 -1.50 117.98 108.13 1utf s PHE 9 Ca 0.65 -1.06 0.08 0.00 -0.05 0.00 0.00 56.93 56.55 1utf s PHE 9 Cb -0.21 -0.59 -0.03 0.00 -0.63 0.00 0.00 43.02 41.56 1utf s PHE 9 CO 0.58 -0.29 -0.19 0.14 -0.05 0.00 0.00 175.22 175.41 1utf s VAL 10 N -3.77 1.63 -0.13 -2.49 -7.23 0.08 -4.64 120.40 103.85 1utf s VAL 10 Ca 0.21 -1.56 -0.02 0.00 -1.81 0.00 0.00 61.98 58.79 1utf s VAL 10 Cb 0.06 -1.52 -0.03 0.00 0.56 0.00 0.00 36.38 35.46 1utf s VAL 10 CO 0.01 -0.12 -0.05 -0.69 -0.31 0.00 0.00 175.10 173.93 1utf s VAL 11 N -1.31 3.79 -0.06 1.32 1.01 -0.50 -0.94 120.40 123.72 1utf s VAL 11 Ca 0.06 -0.41 0.00 0.00 0.00 0.00 0.00 61.98 61.64 1utf s VAL 11 Cb -0.09 -2.63 0.02 0.00 0.00 0.00 0.00 36.38 33.68 1utf s VAL 11 CO 0.04 0.53 -0.04 -0.63 0.00 0.00 0.00 175.10 175.00 1utf s ILE 12 N 0.02 0.59 -0.18 2.22 1.01 0.62 -1.36 121.20 124.12 1utf s ILE 12 Ca -0.00 -0.11 -0.01 0.00 0.00 0.00 0.00 60.65 60.53 1utf s ILE 12 Cb -0.13 -0.63 0.00 0.00 0.01 0.00 0.00 42.46 41.70 1utf s ILE 12 CO 0.03 0.26 -0.13 -0.75 0.00 0.00 0.00 174.94 174.34 1utf s LYS 13 N 1.21 3.19 0.26 2.79 2.20 -0.03 -0.65 119.74 128.71 1utf s LYS 13 Ca -0.06 -0.74 -0.29 0.00 -0.36 0.00 0.00 55.97 54.52 1utf s LYS 13 Cb -0.14 -2.73 -0.09 0.00 -1.51 0.00 0.00 37.83 33.36 1utf s LYS 13 CO -0.02 -0.12 1.26 0.00 -0.36 0.00 0.00 175.35 176.11 1utf s ALA 14 N 1.18 3.49 -0.83 3.13 0.00 -0.68 -0.53 121.76 127.51 1utf s ALA 14 Ca 0.02 1.11 0.08 0.00 0.00 0.00 0.00 51.96 53.16 1utf s ALA 14 Cb -0.14 -3.45 0.12 0.00 0.00 0.00 0.00 23.12 19.66 1utf s ALA 14 CO -0.05 -0.49 0.93 1.28 0.00 0.00 0.00 175.76 177.42 1utf n LEU 15 N 1.68 2.06 -3.82 0.00 4.77 -0.01 -0.39 117.00 121.29 1utf n LEU 15 Ca 0.02 -1.42 -0.08 0.00 -0.03 0.00 0.00 56.01 54.51 1utf n LEU 15 Cb 0.43 -0.07 -0.03 0.00 -2.33 0.00 0.00 43.42 41.42 1utf n LEU 15 CO 0.57 0.47 0.39 -1.83 -1.33 0.00 0.00 177.39 175.67 1utf s GLU 16 N -0.79 1.65 0.44 3.23 -1.05 -1.22 -4.92 118.70 116.05 1utf s GLU 16 Ca 0.12 -0.96 -0.25 0.00 -0.15 0.00 0.00 54.97 53.73 1utf s GLU 16 Cb 0.07 0.58 -0.08 0.00 -0.44 0.00 0.00 34.13 34.26 1utf s GLU 16 CO 0.10 -0.74 1.30 -0.51 0.95 0.00 0.00 175.26 176.37 1utf s ASP 17 N -2.91 6.08 -0.54 0.83 1.01 -1.26 -3.12 116.67 116.76 1utf s ASP 17 Ca 0.12 2.65 0.00 0.00 0.71 0.00 0.00 52.55 56.02 1utf s ASP 17 Cb -0.04 -2.63 0.00 0.00 1.01 0.00 0.00 42.92 41.25 1utf s ASP 17 CO 0.04 -1.00 0.00 0.61 0.21 0.00 0.00 175.17 175.03 1utf n GLY 18 N 0.63 0.24 3.77 0.21 0.00 -1.08 -4.90 105.19 104.06 1utf n GLY 18 Ca 0.05 -0.66 -0.37 0.00 0.00 0.00 0.00 46.02 45.04 1utf n GLY 18 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1utf s VAL 19 N -2.29 3.02 -0.09 1.61 1.01 -0.62 -4.85 120.40 118.19 1utf s VAL 19 Ca 0.00 0.78 0.02 0.00 0.00 0.00 0.00 61.98 62.78 1utf s VAL 19 Cb 0.00 -3.40 0.01 0.00 0.00 0.00 0.00 36.38 32.99 1utf s VAL 19 CO 0.00 0.01 -0.15 0.20 0.00 0.00 0.00 175.10 175.16 1utf s ASN 20 N -1.28 2.28 -0.29 3.32 0.01 -0.05 -0.92 114.94 118.02 1utf s ASN 20 Ca 0.63 -0.39 -0.05 0.00 -0.71 0.00 0.00 52.86 52.34 1utf s ASN 20 Cb -0.30 -1.03 0.02 0.00 0.41 0.00 0.00 41.25 40.35 1utf s ASN 20 CO 0.37 0.03 0.03 -0.69 -1.51 0.00 0.00 177.10 175.33 1utf s VAL 21 N 0.84 3.53 -0.19 1.60 1.01 -0.46 -0.98 120.40 125.75 1utf s VAL 21 Ca -0.10 -0.92 -0.03 0.00 0.00 0.00 0.00 61.98 60.93 1utf s VAL 21 Cb -0.15 -2.86 -0.01 0.00 0.00 0.00 0.00 36.38 33.36 1utf s VAL 21 CO 0.01 0.06 -0.07 -0.63 0.00 0.00 0.00 175.10 174.47 1utf s ILE 22 N 1.41 3.35 -0.11 2.22 1.01 0.56 -0.49 121.20 129.15 1utf s ILE 22 Ca 0.00 -0.52 -0.22 0.00 0.00 0.00 0.00 60.65 59.91 1utf s ILE 22 Cb -0.18 -2.49 -0.03 0.00 0.01 0.00 0.00 42.46 39.78 1utf s ILE 22 CO 0.00 0.46 0.66 -0.83 0.00 0.00 0.00 174.94 175.23 1utf s GLY 23 N 1.01 2.41 -0.09 6.18 0.00 -0.31 -1.09 107.32 115.43 1utf s GLY 23 Ca -0.00 -0.02 -0.11 0.00 0.00 0.00 0.00 44.72 44.60 1utf s GLY 23 CO -0.00 1.18 0.25 1.08 0.00 0.00 0.00 173.10 175.61 1utf s LEU 24 N 1.13 4.38 0.27 0.66 1.02 -0.29 -1.58 118.68 124.28 1utf s LEU 24 Ca 0.34 0.62 -0.31 0.00 0.02 0.00 0.00 54.13 54.80 1utf s LEU 24 Cb -0.17 -2.28 -0.12 0.00 0.02 0.00 0.00 46.19 43.63 1utf s LEU 24 CO 0.15 0.32 1.50 0.35 0.02 0.00 0.00 176.35 178.69 1utf n THR 25 N 2.29 1.00 -2.34 5.49 -2.24 -0.19 -2.58 114.28 115.70 1utf n THR 25 Ca -0.17 -0.25 -0.35 0.00 -2.27 0.00 0.00 64.05 61.01 1utf n THR 25 Cb 0.53 -1.73 -0.01 0.00 -2.10 0.00 0.00 70.33 67.02 1utf n THR 25 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 1utf s ARG 26 N -0.48 3.58 0.00 -0.78 3.52 -0.46 -4.57 118.95 119.75 1utf s ARG 26 Ca 0.66 1.57 0.00 0.00 -0.13 0.00 0.00 55.73 57.83 1utf s ARG 26 Cb -0.57 -2.12 0.00 0.00 -1.56 0.00 0.00 34.95 30.70 1utf s ARG 26 CO 0.49 -0.66 0.00 0.41 -0.81 0.00 0.00 175.30 174.73 1utf n GLY 27 N 0.12 0.25 0.22 8.12 0.00 -1.26 -4.67 105.19 107.96 1utf n GLY 27 Ca 0.10 -2.30 0.07 0.00 0.00 0.00 0.00 46.02 43.89 1utf n GLY 27 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1utf h ALA 28 N 0.00 1.46 -2.68 4.61 0.00 -2.05 -3.42 119.26 117.17 1utf h ALA 28 Ca 0.00 -0.21 -0.62 0.00 0.00 0.00 0.00 54.91 54.08 1utf h ALA 28 Cb 0.00 -0.04 -0.05 0.00 0.00 0.00 0.00 17.79 17.70 1utf h ALA 28 CO 0.00 0.29 -0.32 0.34 0.00 0.00 0.00 179.25 179.55 1utf s ASP 29 N -6.72 6.59 -0.39 0.00 2.15 -1.26 -5.08 116.67 111.96 1utf s ASP 29 Ca -0.03 0.70 0.03 0.00 0.43 0.00 0.00 52.55 53.68 1utf s ASP 29 Cb 0.14 -2.15 0.11 0.00 -0.30 0.00 0.00 42.92 40.73 1utf s ASP 29 CO 0.67 0.28 0.13 -0.89 -0.17 0.00 0.00 175.17 175.19 1utf s THR 30 N -1.22 2.06 0.32 1.71 2.01 -1.26 -4.57 115.64 114.69 1utf s THR 30 Ca 0.25 -2.47 0.03 0.00 0.31 0.00 0.00 61.69 59.81 1utf s THR 30 Cb -0.14 -2.50 -0.05 0.00 0.01 0.00 0.00 72.50 69.83 1utf s THR 30 CO 0.14 -0.69 0.10 0.00 -0.69 0.00 0.00 174.62 173.48 1utf s ARG 31 N 0.65 1.64 0.19 4.92 1.70 -1.26 -4.92 118.95 121.88 1utf s ARG 31 Ca 0.13 -1.93 -0.30 0.00 -0.47 0.00 0.00 55.73 53.16 1utf s ARG 31 Cb -0.21 -0.51 -0.08 0.00 -0.57 0.00 0.00 34.95 33.58 1utf s ARG 31 CO -0.08 -0.33 0.97 -0.06 -1.08 0.00 0.00 175.30 174.72 1utf s PHE 32 N -3.46 3.89 -0.06 5.89 0.08 -1.26 -1.02 117.98 122.03 1utf s PHE 32 Ca 0.34 1.85 0.09 0.00 0.12 0.00 0.00 56.93 59.32 1utf s PHE 32 Cb 0.06 -3.04 -0.13 0.00 -0.57 0.00 0.00 43.02 39.35 1utf s PHE 32 CO 0.15 0.26 0.10 -2.39 -0.10 0.00 0.00 175.22 173.24 1utf n HIS 33 N 1.97 0.00 -3.72 0.36 1.44 -0.61 -4.86 115.22 109.79 1utf n HIS 33 Ca -0.00 0.00 -0.14 0.00 -2.01 0.00 0.00 57.72 55.57 1utf n HIS 33 Cb 0.48 -0.36 -0.09 0.00 0.12 0.00 0.00 29.99 30.14 1utf n HIS 33 CO 0.00 0.00 0.00 -1.58 -2.81 0.00 0.00 176.34 171.95 1utf s HIS 34 N -2.38 -0.38 -0.24 -1.40 5.65 -1.24 -5.02 115.29 110.27 1utf s HIS 34 Ca -0.04 0.83 0.02 0.00 0.25 0.00 0.00 55.06 56.12 1utf s HIS 34 Cb 0.04 0.16 0.06 0.00 -1.18 0.00 0.00 32.58 31.66 1utf s HIS 34 CO 0.38 -0.32 -0.10 0.45 -0.65 0.00 0.00 174.74 174.50 1utf s SER 35 N -0.45 4.10 -0.31 9.88 0.15 -1.26 -1.16 113.70 124.66 1utf s SER 35 Ca -0.06 -1.24 -0.21 0.00 0.70 0.00 0.00 55.95 55.14 1utf s SER 35 Cb -0.03 -1.41 -0.01 0.00 -1.71 0.00 0.00 66.02 62.86 1utf s SER 35 CO 0.03 -0.19 0.65 -0.70 1.20 0.00 0.00 173.24 174.23 1utf s GLU 36 N 1.22 3.90 -0.12 5.44 2.56 0.36 -4.89 118.70 127.17 1utf s GLU 36 Ca -0.07 0.33 -0.23 0.00 0.00 0.00 0.00 54.97 55.00 1utf s GLU 36 Cb -0.19 -3.73 -0.03 0.00 2.00 0.00 0.00 34.13 32.18 1utf s GLU 36 CO -0.06 -0.59 0.71 0.15 -0.56 0.00 0.00 175.26 174.91 1utf s LYS 37 N 2.65 4.35 -0.12 4.30 3.01 -1.26 -1.36 119.74 131.32 1utf s LYS 37 Ca 0.26 0.84 0.02 0.00 -1.01 0.00 0.00 55.97 56.08 1utf s LYS 37 Cb -0.15 -3.51 -0.01 0.00 -1.01 0.00 0.00 37.83 33.16 1utf s LYS 37 CO 0.12 -0.10 -0.19 -0.51 0.51 0.00 0.00 175.35 175.18 1utf s LEU 38 N 1.38 2.40 0.60 3.17 1.43 -0.09 -4.98 118.68 122.59 1utf s LEU 38 Ca 0.35 -0.45 -0.05 0.00 -1.03 0.00 0.00 54.13 52.96 1utf s LEU 38 Cb -0.17 -1.51 0.02 0.00 0.03 0.00 0.00 46.19 44.56 1utf s LEU 38 CO 0.15 0.16 0.90 -1.81 0.23 0.00 0.00 176.35 175.98 1utf s ASP 39 N 0.36 5.37 0.17 2.29 1.01 -1.26 -1.58 116.67 123.02 1utf s ASP 39 Ca -0.15 0.53 -0.34 0.00 0.71 0.00 0.00 52.55 53.31 1utf s ASP 39 Cb -0.17 -1.45 -0.14 0.00 1.01 0.00 0.00 42.92 42.18 1utf s ASP 39 CO 0.07 -1.18 1.55 1.17 0.21 0.00 0.00 175.17 176.99 1utf n LYS 40 N -2.60 2.10 0.00 8.23 4.81 -1.18 -1.85 118.16 127.66 1utf n LYS 40 Ca 0.05 0.75 0.00 0.00 -0.87 0.00 0.00 58.31 58.25 1utf n LYS 40 Cb 0.59 -2.50 0.00 0.00 0.02 0.00 0.00 35.03 33.13 1utf n LYS 40 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1utf n GLY 41 N 3.22 3.05 3.76 3.14 0.00 0.48 -4.98 105.19 113.86 1utf n GLY 41 Ca 0.16 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.79 1utf n GLY 41 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1utf s GLU 42 N -0.30 3.52 -0.06 1.61 2.02 -0.77 -4.72 118.70 120.00 1utf s GLU 42 Ca 0.00 2.33 0.06 0.00 0.02 0.00 0.00 54.97 57.38 1utf s GLU 42 Cb 0.00 -2.52 -0.01 0.00 0.10 0.00 0.00 34.13 31.70 1utf s GLU 42 CO 0.00 -0.92 -0.24 0.08 0.02 0.00 0.00 175.26 174.19 1utf s VAL 43 N -1.25 2.13 -0.04 2.63 1.01 -1.26 -1.69 120.40 121.93 1utf s VAL 43 Ca 0.64 -1.04 0.06 0.00 0.00 0.00 0.00 61.98 61.64 1utf s VAL 43 Cb -0.42 -1.77 -0.01 0.00 0.00 0.00 0.00 36.38 34.18 1utf s VAL 43 CO 0.53 0.57 -0.21 -0.22 0.00 0.00 0.00 175.10 175.77 1utf s LEU 44 N -0.20 2.01 -0.22 3.92 2.96 0.18 -4.98 118.68 122.34 1utf s LEU 44 Ca -0.02 -0.42 0.01 0.00 -0.22 0.00 0.00 54.13 53.48 1utf s LEU 44 Cb -0.13 -1.15 0.05 0.00 0.50 0.00 0.00 46.19 45.46 1utf s LEU 44 CO 0.03 0.22 -0.08 -0.63 -1.32 0.00 0.00 176.35 174.57 1utf s ILE 45 N -0.20 1.63 -0.04 6.68 1.01 -1.26 -0.27 121.20 128.74 1utf s ILE 45 Ca -0.00 -1.13 0.01 0.00 0.00 0.00 0.00 60.65 59.53 1utf s ILE 45 Cb -0.11 -1.78 0.02 0.00 0.01 0.00 0.00 42.46 40.60 1utf s ILE 45 CO 0.02 0.05 -0.04 0.00 0.00 0.00 0.00 174.94 174.96 1utf s ALA 46 N 1.38 0.65 0.52 9.38 0.00 -0.12 -4.94 121.76 128.63 1utf s ALA 46 Ca -0.04 -0.04 -0.06 0.00 0.00 0.00 0.00 51.96 51.82 1utf s ALA 46 Cb -0.18 -0.42 -0.03 0.00 0.00 0.00 0.00 23.12 22.50 1utf s ALA 46 CO -0.07 -0.02 0.84 -0.65 0.00 0.00 0.00 175.76 175.85 1utf s GLN 47 N 0.93 3.44 0.30 0.00 -0.21 -1.26 -0.74 119.66 122.12 1utf s GLN 47 Ca -0.11 0.23 -0.28 0.00 0.02 0.00 0.00 55.36 55.22 1utf s GLN 47 Cb -0.14 -2.32 -0.09 0.00 1.00 0.00 0.00 33.01 31.45 1utf s GLN 47 CO -0.00 -0.34 1.01 -0.06 -2.12 0.00 0.00 175.29 173.78 1utf s PHE 48 N -2.84 3.66 0.34 0.91 0.08 -0.57 -4.94 117.98 114.63 1utf s PHE 48 Ca 0.49 1.77 0.02 0.00 0.12 0.00 0.00 56.93 59.33 1utf s PHE 48 Cb -0.10 -3.08 -0.00 0.00 -0.57 0.00 0.00 43.02 39.26 1utf s PHE 48 CO 0.46 -0.10 0.42 0.25 -0.10 0.00 0.00 175.22 176.15 1utf n THR 49 N 0.85 0.00 -0.31 0.64 -2.24 -0.50 -4.70 114.28 108.02 1utf n THR 49 Ca 0.01 -2.01 0.11 0.00 -2.27 0.00 0.00 64.05 59.89 1utf n THR 49 Cb 0.48 1.14 0.34 0.00 -2.10 0.00 0.00 70.33 70.18 1utf n THR 49 CO 0.00 0.00 0.00 -0.08 -0.57 0.00 0.00 175.07 174.42 1utf h GLU 50 N 0.00 0.75 0.00 -0.78 4.81 -2.03 -3.09 114.58 114.24 1utf h GLU 50 Ca -0.26 -0.05 -0.06 0.00 -0.13 0.00 0.00 59.36 58.86 1utf h GLU 50 Cb 1.19 -0.17 -0.01 0.00 0.63 0.00 0.00 28.75 30.39 1utf h GLU 50 CO 0.36 0.50 -1.18 0.72 -0.73 0.00 0.00 179.01 178.68 1utf n HIS 51 N -4.60 0.96 -3.97 0.92 8.25 -1.26 -4.56 115.22 110.96 1utf n HIS 51 Ca 0.19 0.29 -0.31 0.00 -0.26 0.00 0.00 57.72 57.64 1utf n HIS 51 Cb 0.46 -1.00 -0.16 0.00 1.12 0.00 0.00 29.99 30.42 1utf n HIS 51 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 1utf s THR 52 N -3.21 1.63 -0.85 1.59 2.01 -1.17 -1.36 115.64 114.28 1utf s THR 52 Ca -0.02 -1.23 0.09 0.00 0.31 0.00 0.00 61.69 60.85 1utf s THR 52 Cb 0.09 -1.84 0.01 0.00 0.01 0.00 0.00 72.50 70.78 1utf s THR 52 CO 0.80 -0.04 0.62 -1.54 -0.69 0.00 0.00 174.62 173.77 1utf n SER 53 N 4.65 1.23 -3.80 3.53 3.41 -1.07 -1.41 113.62 120.16 1utf n SER 53 Ca -0.13 -1.11 -0.13 0.00 -0.26 0.00 0.00 58.87 57.24 1utf n SER 53 Cb 0.44 0.39 -0.09 0.00 -0.26 0.00 0.00 64.21 64.69 1utf n SER 53 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1utf s ALA 54 N -1.16 -0.62 -0.05 7.33 0.00 -1.24 -5.02 121.76 121.01 1utf s ALA 54 Ca 0.08 0.24 0.04 0.00 0.00 0.00 0.00 51.96 52.31 1utf s ALA 54 Cb 0.07 0.01 0.00 0.00 0.00 0.00 0.00 23.12 23.20 1utf s ALA 54 CO 0.20 -0.22 -0.15 0.42 0.00 0.00 0.00 175.76 176.00 1utf s ILE 55 N -1.13 1.30 -0.07 0.00 1.01 -1.26 -1.13 121.20 119.91 1utf s ILE 55 Ca -0.12 -0.62 0.05 0.00 0.00 0.00 0.00 60.65 59.96 1utf s ILE 55 Cb -0.06 -1.13 -0.01 0.00 0.01 0.00 0.00 42.46 41.27 1utf s ILE 55 CO 0.03 0.38 -0.24 -0.75 0.00 0.00 0.00 174.94 174.36 1utf s LYS 56 N 0.23 2.74 -0.19 2.79 2.20 -0.25 -4.93 119.74 122.32 1utf s LYS 56 Ca -0.07 -0.89 -0.02 0.00 -0.36 0.00 0.00 55.97 54.62 1utf s LYS 56 Cb -0.12 -2.22 -0.01 0.00 -1.51 0.00 0.00 37.83 33.97 1utf s LYS 56 CO 0.03 0.31 -0.09 0.08 -0.36 0.00 0.00 175.35 175.32 1utf s VAL 57 N 0.02 3.09 -0.11 4.02 1.01 -1.26 -0.32 120.40 126.86 1utf s VAL 57 Ca -0.09 -0.60 0.01 0.00 0.00 0.00 0.00 61.98 61.30 1utf s VAL 57 Cb -0.15 -2.37 -0.02 0.00 0.00 0.00 0.00 36.38 33.84 1utf s VAL 57 CO 0.06 0.47 -0.15 -0.13 0.00 0.00 0.00 175.10 175.34 1utf s ARG 58 N 1.19 3.15 0.00 2.72 0.52 -0.15 -4.93 118.95 121.44 1utf s ARG 58 Ca 0.02 -0.71 0.00 0.00 -0.52 0.00 0.00 55.73 54.51 1utf s ARG 58 Cb -0.14 -2.53 0.00 0.00 0.52 0.00 0.00 34.95 32.80 1utf s ARG 58 CO -0.03 0.30 0.00 0.41 0.02 0.00 0.00 175.30 176.00 1utf n GLY 59 N 3.26 1.18 3.64 -3.53 0.00 -1.26 -0.87 105.19 107.61 1utf n GLY 59 Ca -0.18 -2.10 -0.43 0.00 0.00 0.00 0.00 46.02 43.32 1utf n GLY 59 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1utf s LYS 60 N -1.58 4.06 -0.01 1.61 2.20 -1.26 -3.80 119.74 120.96 1utf s LYS 60 Ca 0.00 1.04 -0.13 0.00 -0.36 0.00 0.00 55.97 56.52 1utf s LYS 60 Cb 0.00 -3.74 0.02 0.00 -1.51 0.00 0.00 37.83 32.60 1utf s LYS 60 CO 0.00 -0.89 0.28 0.00 -0.36 0.00 0.00 175.35 174.37 1utf s ALA 61 N 3.62 -0.70 -0.22 3.13 0.00 -0.99 -0.83 121.76 125.77 1utf s ALA 61 Ca 0.45 0.24 -0.10 0.00 0.00 0.00 0.00 51.96 52.55 1utf s ALA 61 Cb -0.12 0.08 -0.05 0.00 0.00 0.00 0.00 23.12 23.03 1utf s ALA 61 CO 0.15 -0.25 0.13 -0.47 0.00 0.00 0.00 175.76 175.32 1utf s TYR 62 N -1.33 3.32 -0.08 0.00 5.04 0.31 -1.02 117.35 123.59 1utf s TYR 62 Ca -0.14 0.20 0.04 0.00 -2.44 0.00 0.00 57.07 54.73 1utf s TYR 62 Cb -0.06 -2.20 0.00 0.00 0.35 0.00 0.00 41.96 40.05 1utf s TYR 62 CO 0.04 0.13 -0.21 0.42 -1.34 0.00 0.00 175.55 174.58 1utf s ILE 63 N 0.75 1.83 -0.08 3.14 1.01 0.32 -0.85 121.20 127.31 1utf s ILE 63 Ca 0.07 -0.89 0.04 0.00 0.00 0.00 0.00 60.65 59.86 1utf s ILE 63 Cb -0.13 -1.59 -0.02 0.00 0.01 0.00 0.00 42.46 40.74 1utf s ILE 63 CO 0.02 0.51 -0.19 -1.10 0.00 0.00 0.00 174.94 174.18 1utf s GLN 64 N 0.34 2.80 0.34 2.79 -0.21 -0.46 -1.47 119.66 123.79 1utf s GLN 64 Ca -0.16 -0.79 0.05 0.00 0.02 0.00 0.00 55.36 54.49 1utf s GLN 64 Cb -0.17 -2.36 -0.03 0.00 1.00 0.00 0.00 33.01 31.46 1utf s GLN 64 CO 0.07 0.38 0.21 0.95 -2.12 0.00 0.00 175.29 174.78 1utf s THR 65 N -0.13 0.20 0.66 -0.19 -4.23 -0.45 -1.40 115.64 110.09 1utf s THR 65 Ca -0.03 -2.00 0.27 0.00 -1.18 0.00 0.00 61.69 58.75 1utf s THR 65 Cb -0.14 -2.46 0.28 0.00 1.34 0.00 0.00 72.50 71.52 1utf s THR 65 CO 0.04 0.00 1.83 -0.09 -0.54 0.00 0.00 174.62 175.86 1utf h ARG 66 N 2.09 0.00 -0.01 3.99 2.43 -2.01 -2.59 114.38 118.27 1utf h ARG 66 Ca -0.30 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.87 1utf h ARG 66 Cb 1.25 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.80 1utf h ARG 66 CO 0.45 0.00 -0.27 0.72 -1.51 0.00 0.00 179.97 179.36 1utf n HIS 67 N -2.91 0.00 0.00 2.20 8.25 -1.26 -5.07 115.22 116.43 1utf n HIS 67 Ca -0.01 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.45 1utf n HIS 67 Cb 0.46 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.57 1utf n HIS 67 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1utf n GLY 68 N 1.15 0.96 3.63 -1.41 0.00 -0.98 -5.11 105.19 103.44 1utf n GLY 68 Ca 0.08 -1.91 -0.23 0.00 0.00 0.00 0.00 46.02 43.95 1utf n GLY 68 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1utf s VAL 69 N -2.44 3.09 -0.10 1.61 -7.23 -1.26 -1.34 120.40 112.73 1utf s VAL 69 Ca 0.00 -1.96 -0.30 0.00 -1.81 0.00 0.00 61.98 57.91 1utf s VAL 69 Cb 0.00 -2.78 0.11 0.00 0.56 0.00 0.00 36.38 34.27 1utf s VAL 69 CO 0.00 -0.32 0.92 -0.51 -0.31 0.00 0.00 175.10 174.88 1utf s ILE 70 N -2.40 0.00 -0.09 -0.62 2.07 -0.54 -5.01 121.20 114.61 1utf s ILE 70 Ca 0.33 0.00 0.03 0.00 -1.41 0.00 0.00 60.65 59.60 1utf s ILE 70 Cb -0.04 -1.00 -0.02 0.00 0.13 0.00 0.00 42.46 41.53 1utf s ILE 70 CO 0.19 0.00 -0.17 -1.61 -1.91 0.00 0.00 174.94 171.44 1utf s GLU 71 N -1.63 2.91 0.33 3.50 2.02 -1.26 -0.53 118.70 124.04 1utf s GLU 71 Ca -0.02 -0.76 -0.17 0.00 0.02 0.00 0.00 54.97 54.05 1utf s GLU 71 Cb -0.01 -2.42 -0.09 0.00 0.10 0.00 0.00 34.13 31.71 1utf s GLU 71 CO 0.00 0.37 0.78 -1.54 0.02 0.00 0.00 175.26 174.89 1utf s SER 72 N -0.08 6.84 -0.01 -0.19 1.04 -0.19 -4.96 113.70 116.16 1utf s SER 72 Ca -0.03 1.38 0.07 0.00 0.48 0.00 0.00 55.95 57.84 1utf s SER 72 Cb -0.14 -2.41 -0.02 0.00 0.10 0.00 0.00 66.02 63.55 1utf s SER 72 CO 0.04 -0.21 -0.21 -1.61 0.98 0.00 0.00 173.24 172.23 1utf s GLU 73 N -2.91 1.64 0.00 4.02 2.02 -1.25 -2.36 118.70 119.86 1utf s GLU 73 Ca 0.55 -0.77 0.00 0.00 0.02 0.00 0.00 54.97 54.76 1utf s GLU 73 Cb -0.11 -1.61 0.00 0.00 0.10 0.00 0.00 34.13 32.51 1utf s GLU 73 CO 0.17 0.44 0.00 0.41 0.02 0.00 0.00 175.26 176.30