#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 3.87 -4.77 3.42 2.85 -1.26 -5.01 115.26 114.36 1utf n ASN 6 Ca 0.00 -3.30 -0.30 0.00 -0.11 0.00 0.00 54.58 50.87 1utf n ASN 6 Cb 0.00 -0.77 0.10 0.00 1.24 0.00 0.00 39.78 40.35 1utf n ASN 6 CO 0.00 0.00 0.00 -0.44 -2.11 0.00 0.00 177.26 174.71 1utf s SER 7 N -0.93 4.24 0.76 1.20 0.01 -1.26 -5.02 113.70 112.69 1utf s SER 7 Ca 0.49 1.52 -0.12 0.00 1.31 0.00 0.00 55.95 59.15 1utf s SER 7 Cb 0.41 -2.25 0.05 0.00 0.21 0.00 0.00 66.02 64.44 1utf s SER 7 CO 0.10 -2.16 1.11 -0.62 0.41 0.00 0.00 173.24 172.08 1utf s ASP 8 N -3.61 4.48 0.24 2.44 -1.08 -1.26 -4.81 116.67 113.08 1utf s ASP 8 Ca 0.61 1.93 0.03 0.00 -0.52 0.00 0.00 52.55 54.60 1utf s ASP 8 Cb -0.16 -2.54 -0.05 0.00 -1.46 0.00 0.00 42.92 38.71 1utf s ASP 8 CO 0.56 -2.05 0.02 0.72 0.52 0.00 0.00 175.17 174.93 1utf s PHE 9 N -2.70 1.58 -0.02 -5.34 -0.71 -1.26 -1.29 117.98 108.24 1utf s PHE 9 Ca 0.64 -0.97 0.06 0.00 -1.04 0.00 0.00 56.93 55.62 1utf s PHE 9 Cb -0.19 -0.93 -0.01 0.00 -1.21 0.00 0.00 43.02 40.68 1utf s PHE 9 CO 0.52 -0.09 -0.20 0.08 -1.34 0.00 0.00 175.22 174.19 1utf s VAL 10 N -3.47 1.58 -0.18 -2.49 1.01 0.03 -4.61 120.40 112.27 1utf s VAL 10 Ca 0.30 -0.85 -0.08 0.00 0.00 0.00 0.00 61.98 61.35 1utf s VAL 10 Cb 0.06 -1.32 -0.04 0.00 0.00 0.00 0.00 36.38 35.08 1utf s VAL 10 CO 0.10 0.45 0.08 -0.69 0.00 0.00 0.00 175.10 175.04 1utf s VAL 11 N -0.43 4.99 -0.07 2.92 1.01 -0.32 -0.58 120.40 127.92 1utf s VAL 11 Ca 0.07 0.04 0.00 0.00 0.00 0.00 0.00 61.98 62.09 1utf s VAL 11 Cb -0.08 -3.25 0.02 0.00 0.00 0.00 0.00 36.38 33.08 1utf s VAL 11 CO -0.01 0.47 -0.05 -0.63 0.00 0.00 0.00 175.10 174.89 1utf s ILE 12 N 0.22 0.68 -0.20 2.22 1.01 -0.04 -1.07 121.20 124.02 1utf s ILE 12 Ca 0.06 -0.13 -0.00 0.00 0.00 0.00 0.00 60.65 60.57 1utf s ILE 12 Cb -0.12 -0.72 0.02 0.00 0.01 0.00 0.00 42.46 41.64 1utf s ILE 12 CO -0.00 0.28 -0.15 -0.75 0.00 0.00 0.00 174.94 174.32 1utf s LYS 13 N 1.37 3.02 0.18 2.79 2.20 -0.28 -0.19 119.74 128.83 1utf s LYS 13 Ca -0.03 -0.83 -0.31 0.00 -0.36 0.00 0.00 55.97 54.44 1utf s LYS 13 Cb -0.13 -2.72 -0.09 0.00 -1.51 0.00 0.00 37.83 33.37 1utf s LYS 13 CO -0.03 -0.24 1.44 0.00 -0.36 0.00 0.00 175.35 176.16 1utf s ALA 14 N 1.32 3.65 -2.35 3.13 0.00 -0.76 -0.88 121.76 125.86 1utf s ALA 14 Ca 0.04 1.25 0.21 0.00 0.00 0.00 0.00 51.96 53.46 1utf s ALA 14 Cb -0.14 -3.56 0.32 0.00 0.00 0.00 0.00 23.12 19.74 1utf s ALA 14 CO -0.10 -0.69 1.29 1.28 0.00 0.00 0.00 175.76 177.54 1utf n LEU 15 N 3.31 3.13 -3.72 0.00 4.77 0.85 -0.46 117.00 124.88 1utf n LEU 15 Ca 0.10 -1.36 -0.09 0.00 -0.03 0.00 0.00 56.01 54.63 1utf n LEU 15 Cb 0.41 -0.16 -0.03 0.00 -2.33 0.00 0.00 43.42 41.31 1utf n LEU 15 CO 0.60 0.64 0.35 -1.83 -1.33 0.00 0.00 177.39 175.82 1utf s GLU 16 N -1.50 1.48 0.73 3.23 -1.05 -1.21 -4.89 118.70 115.49 1utf s GLU 16 Ca 0.32 -0.84 -0.14 0.00 -0.15 0.00 0.00 54.97 54.16 1utf s GLU 16 Cb 0.20 0.56 0.04 0.00 -0.44 0.00 0.00 34.13 34.48 1utf s GLU 16 CO 0.28 -0.65 1.16 -0.51 0.95 0.00 0.00 175.26 176.49 1utf s ASP 17 N -2.87 4.42 -0.16 0.83 1.01 -1.26 -3.31 116.67 115.33 1utf s ASP 17 Ca 0.09 2.17 0.00 0.00 0.71 0.00 0.00 52.55 55.52 1utf s ASP 17 Cb -0.02 -2.57 0.00 0.00 1.01 0.00 0.00 42.92 41.34 1utf s ASP 17 CO -0.01 -2.10 0.00 0.61 0.21 0.00 0.00 175.17 173.87 1utf n GLY 18 N -0.07 0.50 3.76 0.21 0.00 -0.96 -4.88 105.19 103.75 1utf n GLY 18 Ca 0.12 -0.26 -0.41 0.00 0.00 0.00 0.00 46.02 45.47 1utf n GLY 18 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1utf n VAL 19 N -2.79 1.46 -4.28 1.61 0.31 -0.74 -4.78 118.33 109.11 1utf n VAL 19 Ca -0.02 -0.36 -0.34 0.00 -0.01 0.00 0.00 64.34 63.61 1utf n VAL 19 Cb 0.13 -1.98 -0.13 0.00 -0.91 0.00 0.00 33.84 30.95 1utf n VAL 19 CO 0.00 0.00 0.00 0.20 -1.32 0.00 0.00 176.83 175.71 1utf s ASN 20 N 0.23 4.49 -0.34 4.52 0.01 -0.16 -0.74 114.94 122.95 1utf s ASN 20 Ca 0.59 -0.26 -0.07 0.00 -0.71 0.00 0.00 52.86 52.41 1utf s ASN 20 Cb -0.48 -1.74 0.03 0.00 0.41 0.00 0.00 41.25 39.47 1utf s ASN 20 CO 0.55 0.09 0.12 -0.69 -1.51 0.00 0.00 177.10 175.67 1utf s VAL 21 N 0.80 3.96 -0.18 1.60 1.01 0.15 -1.35 120.40 126.39 1utf s VAL 21 Ca -0.02 -1.01 -0.04 0.00 0.00 0.00 0.00 61.98 60.91 1utf s VAL 21 Cb -0.15 -3.21 -0.03 0.00 0.00 0.00 0.00 36.38 33.00 1utf s VAL 21 CO 0.02 -0.15 -0.02 -0.63 0.00 0.00 0.00 175.10 174.32 1utf s ILE 22 N 1.45 3.94 -0.22 2.22 1.01 0.11 -0.41 121.20 129.29 1utf s ILE 22 Ca -0.00 -0.33 -0.18 0.00 0.00 0.00 0.00 60.65 60.14 1utf s ILE 22 Cb -0.19 -2.75 -0.03 0.00 0.01 0.00 0.00 42.46 39.50 1utf s ILE 22 CO 0.03 0.46 0.49 -0.83 0.00 0.00 0.00 174.94 175.10 1utf s GLY 23 N 0.66 1.99 -0.07 6.18 0.00 0.26 -0.83 107.32 115.50 1utf s GLY 23 Ca -0.01 -0.51 -0.07 0.00 0.00 0.00 0.00 44.72 44.13 1utf s GLY 23 CO 0.02 1.09 0.19 1.08 0.00 0.00 0.00 173.10 175.49 1utf s LEU 24 N 1.84 4.39 0.25 0.66 1.02 0.05 -0.89 118.68 126.00 1utf s LEU 24 Ca 0.22 0.52 -0.30 0.00 0.02 0.00 0.00 54.13 54.60 1utf s LEU 24 Cb -0.15 -2.28 -0.10 0.00 0.02 0.00 0.00 46.19 43.68 1utf s LEU 24 CO 0.09 0.36 1.39 0.42 0.02 0.00 0.00 176.35 178.64 1utf s THR 25 N -1.11 2.77 0.60 5.49 -4.23 -0.37 -2.64 115.64 116.15 1utf s THR 25 Ca 0.19 0.66 -0.18 0.00 -1.18 0.00 0.00 61.69 61.18 1utf s THR 25 Cb -0.13 -3.42 -0.03 0.00 1.34 0.00 0.00 72.50 70.26 1utf s THR 25 CO 0.09 0.11 1.18 -0.60 -0.54 0.00 0.00 174.62 174.86 1utf s ARG 26 N -0.54 2.98 0.00 3.99 3.52 -0.64 -4.55 118.95 123.71 1utf s ARG 26 Ca 0.57 1.73 0.00 0.00 -0.13 0.00 0.00 55.73 57.90 1utf s ARG 26 Cb -0.40 -1.94 0.00 0.00 -1.56 0.00 0.00 34.95 31.04 1utf s ARG 26 CO 0.44 -1.18 0.00 0.41 -0.81 0.00 0.00 175.30 174.16 1utf n GLY 27 N 0.32 -0.21 0.34 8.12 0.00 -1.26 -4.67 105.19 107.83 1utf n GLY 27 Ca 0.13 -2.27 0.15 0.00 0.00 0.00 0.00 46.02 44.03 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 2.24 -2.70 4.61 0.00 -2.05 -3.42 119.26 117.95 1utf h ALA 28 Ca 0.00 -0.01 -0.63 0.00 0.00 0.00 0.00 54.91 54.27 1utf h ALA 28 Cb 0.00 -0.00 -0.06 0.00 0.00 0.00 0.00 17.79 17.73 1utf h ALA 28 CO 0.00 -0.34 -0.38 0.34 0.00 0.00 0.00 179.25 178.87 1utf s ASP 29 N -6.46 6.52 -0.29 0.00 2.15 -1.26 -5.09 116.67 112.23 1utf s ASP 29 Ca -0.06 0.60 0.02 0.00 0.43 0.00 0.00 52.55 53.54 1utf s ASP 29 Cb 0.19 -2.11 0.08 0.00 -0.30 0.00 0.00 42.92 40.78 1utf s ASP 29 CO 0.72 0.29 0.00 -0.89 -0.17 0.00 0.00 175.17 175.13 1utf s THR 30 N -1.21 1.82 0.16 1.71 2.01 -1.26 -4.56 115.64 114.31 1utf s THR 30 Ca 0.24 -1.76 -0.06 0.00 0.31 0.00 0.00 61.69 60.42 1utf s THR 30 Cb -0.13 -2.21 -0.02 0.00 0.01 0.00 0.00 72.50 70.15 1utf s THR 30 CO 0.13 -0.38 0.21 0.00 -0.69 0.00 0.00 174.62 173.89 1utf s ARG 31 N 1.19 1.11 0.13 4.92 1.70 -1.26 -4.93 118.95 121.81 1utf s ARG 31 Ca 0.03 -1.29 -0.30 0.00 -0.47 0.00 0.00 55.73 53.70 1utf s ARG 31 Cb -0.19 0.33 -0.07 0.00 -0.57 0.00 0.00 34.95 34.45 1utf s ARG 31 CO -0.10 -0.38 1.25 -0.06 -1.08 0.00 0.00 175.30 174.93 1utf s PHE 32 N -4.01 3.37 -0.05 5.89 0.08 -1.26 -1.24 117.98 120.77 1utf s PHE 32 Ca 0.21 1.26 0.13 0.00 0.12 0.00 0.00 56.93 58.65 1utf s PHE 32 Cb 0.05 -3.50 -0.20 0.00 -0.57 0.00 0.00 43.02 38.80 1utf s PHE 32 CO 0.02 -1.55 0.24 -2.39 -0.10 0.00 0.00 175.22 171.43 1utf n HIS 33 N 3.32 0.00 -3.61 0.36 1.44 -0.07 -4.88 115.22 111.78 1utf n HIS 33 Ca 0.08 0.00 -0.15 0.00 -2.01 0.00 0.00 57.72 55.64 1utf n HIS 33 Cb 0.45 -0.40 -0.07 0.00 0.12 0.00 0.00 29.99 30.09 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 -2.80 -0.72 -0.20 -1.40 5.65 -1.23 -5.01 115.29 109.58 1utf s HIS 34 Ca -0.05 1.63 0.01 0.00 0.25 0.00 0.00 55.06 56.90 1utf s HIS 34 Cb 0.08 0.29 0.04 0.00 -1.18 0.00 0.00 32.58 31.81 1utf s HIS 34 CO 0.56 -0.43 -0.14 0.45 -0.65 0.00 0.00 174.74 174.54 1utf s SER 35 N -0.08 3.46 -0.27 9.88 0.15 -1.26 -0.57 113.70 125.00 1utf s SER 35 Ca -0.03 -0.88 -0.14 0.00 0.70 0.00 0.00 55.95 55.60 1utf s SER 35 Cb -0.04 -1.37 -0.04 0.00 -1.71 0.00 0.00 66.02 62.86 1utf s SER 35 CO 0.03 -0.10 0.33 -0.70 1.20 0.00 0.00 173.24 174.00 1utf s GLU 36 N 1.31 4.01 -0.11 5.44 2.56 0.45 -4.90 118.70 127.46 1utf s GLU 36 Ca -0.00 -0.04 -0.23 0.00 0.00 0.00 0.00 54.97 54.70 1utf s GLU 36 Cb -0.16 -3.65 -0.03 0.00 2.00 0.00 0.00 34.13 32.29 1utf s GLU 36 CO -0.09 -0.24 0.69 0.15 -0.56 0.00 0.00 175.26 175.20 1utf s LYS 37 N 1.95 4.37 -0.08 4.30 3.01 -1.26 -0.68 119.74 131.36 1utf s LYS 37 Ca 0.13 0.81 0.04 0.00 -1.01 0.00 0.00 55.97 55.94 1utf s LYS 37 Cb -0.16 -3.49 -0.01 0.00 -1.01 0.00 0.00 37.83 33.16 1utf s LYS 37 CO 0.10 -0.03 -0.20 -0.51 0.51 0.00 0.00 175.35 175.22 1utf s LEU 38 N 1.15 2.34 0.37 3.17 1.43 0.09 -4.97 118.68 122.26 1utf s LEU 38 Ca 0.35 -0.42 0.01 0.00 -1.03 0.00 0.00 54.13 53.03 1utf s LEU 38 Cb -0.17 -1.47 -0.02 0.00 0.03 0.00 0.00 46.19 44.56 1utf s LEU 38 CO 0.15 0.23 0.58 -1.81 0.23 0.00 0.00 176.35 175.73 1utf s ASP 39 N -0.05 6.16 0.16 2.29 1.01 -1.26 -1.79 116.67 123.19 1utf s ASP 39 Ca -0.05 0.39 -0.34 0.00 0.71 0.00 0.00 52.55 53.26 1utf s ASP 39 Cb -0.14 -1.88 -0.14 0.00 1.01 0.00 0.00 42.92 41.77 1utf s ASP 39 CO 0.05 -0.41 1.51 1.17 0.21 0.00 0.00 175.17 177.69 1utf n LYS 40 N -1.86 1.96 0.00 8.23 4.81 -1.21 -1.92 118.16 128.16 1utf n LYS 40 Ca -0.03 0.70 0.00 0.00 -0.87 0.00 0.00 58.31 58.11 1utf n LYS 40 Cb 0.57 -2.43 0.00 0.00 0.02 0.00 0.00 35.03 33.18 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 3.06 2.39 3.78 3.14 0.00 0.40 -4.95 105.19 113.01 1utf n GLY 41 Ca 0.16 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.82 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 -0.49 3.86 -0.08 1.61 2.02 -0.81 -4.76 118.70 120.06 1utf s GLU 42 Ca 0.00 1.59 0.05 0.00 0.02 0.00 0.00 54.97 56.62 1utf s GLU 42 Cb 0.00 -2.35 -0.01 0.00 0.10 0.00 0.00 34.13 31.87 1utf s GLU 42 CO 0.00 -0.42 -0.23 0.08 0.02 0.00 0.00 175.26 174.71 1utf s VAL 43 N -1.69 2.22 -0.09 2.63 1.01 -1.26 -1.83 120.40 121.38 1utf s VAL 43 Ca 0.63 -0.99 0.03 0.00 0.00 0.00 0.00 61.98 61.65 1utf s VAL 43 Cb -0.23 -1.83 -0.01 0.00 0.00 0.00 0.00 36.38 34.30 1utf s VAL 43 CO 0.28 0.56 -0.20 -0.22 0.00 0.00 0.00 175.10 175.53 1utf s LEU 44 N 0.02 2.36 -0.27 3.92 2.96 0.73 -4.99 118.68 123.41 1utf s LEU 44 Ca -0.08 -0.43 0.01 0.00 -0.22 0.00 0.00 54.13 53.40 1utf s LEU 44 Cb -0.15 -1.48 0.05 0.00 0.50 0.00 0.00 46.19 45.11 1utf s LEU 44 CO 0.05 0.21 -0.06 -0.63 -1.32 0.00 0.00 176.35 174.60 1utf s ILE 45 N 0.07 2.56 -0.09 6.68 1.01 -1.26 -0.86 121.20 129.31 1utf s ILE 45 Ca -0.09 -1.46 0.02 0.00 0.00 0.00 0.00 60.65 59.12 1utf s ILE 45 Cb -0.15 -2.46 0.01 0.00 0.01 0.00 0.00 42.46 39.87 1utf s ILE 45 CO 0.05 -0.02 -0.13 0.00 0.00 0.00 0.00 174.94 174.84 1utf s ALA 46 N 1.19 1.43 0.54 9.38 0.00 0.25 -4.92 121.76 129.62 1utf s ALA 46 Ca -0.06 -0.55 -0.15 0.00 0.00 0.00 0.00 51.96 51.20 1utf s ALA 46 Cb -0.19 -0.71 -0.07 0.00 0.00 0.00 0.00 23.12 22.15 1utf s ALA 46 CO -0.04 -0.02 0.98 -0.65 0.00 0.00 0.00 175.76 176.03 1utf s GLN 47 N 0.92 3.85 0.29 0.00 -0.21 -1.26 -0.79 119.66 122.45 1utf s GLN 47 Ca -0.09 0.87 -0.29 0.00 0.02 0.00 0.00 55.36 55.86 1utf s GLN 47 Cb -0.15 -2.14 -0.10 0.00 1.00 0.00 0.00 33.01 31.63 1utf s GLN 47 CO 0.00 -0.33 1.11 -0.06 -2.12 0.00 0.00 175.29 173.89 1utf s PHE 48 N -2.76 3.53 0.33 0.91 0.08 -0.41 -4.94 117.98 114.72 1utf s PHE 48 Ca 0.57 1.68 0.06 0.00 0.12 0.00 0.00 56.93 59.36 1utf s PHE 48 Cb -0.10 -3.31 -0.03 0.00 -0.57 0.00 0.00 43.02 39.01 1utf s PHE 48 CO 0.37 -0.65 0.29 0.95 -0.10 0.00 0.00 175.22 176.09 1utf s THR 49 N -1.17 0.00 0.29 0.64 -4.23 -0.35 -4.67 115.64 106.14 1utf s THR 49 Ca 0.45 -1.96 0.04 0.00 -1.18 0.00 0.00 61.69 59.04 1utf s THR 49 Cb -0.32 -2.52 0.28 0.00 1.34 0.00 0.00 72.50 71.29 1utf s THR 49 CO 0.42 0.00 1.72 -0.08 -0.54 0.00 0.00 174.62 176.14 1utf h GLU 50 N 2.16 0.51 0.00 3.99 4.81 -2.03 -2.92 114.58 121.09 1utf h GLU 50 Ca -0.26 -0.03 -0.06 0.00 -0.13 0.00 0.00 59.36 58.88 1utf h GLU 50 Cb 1.23 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 30.49 1utf h GLU 50 CO 0.37 0.33 -0.99 0.45 -0.73 0.00 0.00 179.01 178.45 1utf h HIS 51 N 0.52 0.00 -3.56 0.92 3.86 -1.95 -3.42 115.15 111.52 1utf h HIS 51 Ca 0.56 0.00 -0.63 0.00 -1.16 0.00 0.00 60.37 59.14 1utf h HIS 51 Cb 0.99 0.00 -0.37 0.00 1.06 0.00 0.00 27.41 29.09 1utf h HIS 51 CO -0.09 0.21 -0.80 0.99 0.86 0.00 0.00 177.93 179.10 1utf s THR 52 N -3.19 1.71 -0.78 2.45 2.01 -1.10 -1.63 115.64 115.11 1utf s THR 52 Ca -0.00 -1.19 0.09 0.00 0.31 0.00 0.00 61.69 60.90 1utf s THR 52 Cb 0.09 -1.85 -0.00 0.00 0.01 0.00 0.00 72.50 70.75 1utf s THR 52 CO 0.78 0.06 0.58 -1.54 -0.69 0.00 0.00 174.62 173.81 1utf n SER 53 N 4.63 1.10 -3.75 3.53 3.41 -1.08 -1.21 113.62 120.25 1utf n SER 53 Ca -0.14 -1.05 -0.13 0.00 -0.26 0.00 0.00 58.87 57.29 1utf n SER 53 Cb 0.45 0.48 -0.09 0.00 -0.26 0.00 0.00 64.21 64.79 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 -1.25 -0.87 -0.07 7.33 0.00 -1.24 -5.01 121.76 120.65 1utf s ALA 54 Ca 0.07 0.65 0.02 0.00 0.00 0.00 0.00 51.96 52.70 1utf s ALA 54 Cb 0.07 -0.20 0.01 0.00 0.00 0.00 0.00 23.12 23.00 1utf s ALA 54 CO 0.22 -0.23 -0.13 0.42 0.00 0.00 0.00 175.76 176.04 1utf s ILE 55 N -0.71 1.22 -0.12 0.00 1.01 -1.26 -0.77 121.20 120.57 1utf s ILE 55 Ca -0.08 -0.52 -0.01 0.00 0.00 0.00 0.00 60.65 60.04 1utf s ILE 55 Cb -0.04 -1.11 -0.02 0.00 0.01 0.00 0.00 42.46 41.30 1utf s ILE 55 CO 0.03 0.37 -0.08 -0.75 0.00 0.00 0.00 174.94 174.52 1utf s LYS 56 N 0.68 3.31 -0.21 2.79 2.20 -0.01 -4.95 119.74 123.55 1utf s LYS 56 Ca -0.14 -0.58 -0.04 0.00 -0.36 0.00 0.00 55.97 54.85 1utf s LYS 56 Cb -0.16 -2.73 -0.01 0.00 -1.51 0.00 0.00 37.83 33.42 1utf s LYS 56 CO 0.04 0.36 -0.04 0.08 -0.36 0.00 0.00 175.35 175.43 1utf s VAL 57 N 0.01 3.47 -0.07 4.02 1.01 -1.26 0.06 120.40 127.64 1utf s VAL 57 Ca -0.01 -0.47 0.01 0.00 0.00 0.00 0.00 61.98 61.52 1utf s VAL 57 Cb -0.14 -2.57 -0.03 0.00 0.00 0.00 0.00 36.38 33.65 1utf s VAL 57 CO 0.03 0.43 -0.10 -0.13 0.00 0.00 0.00 175.10 175.33 1utf s ARG 58 N 1.29 2.80 0.00 2.72 0.52 -0.46 -4.96 118.95 120.87 1utf s ARG 58 Ca 0.04 -0.62 0.00 0.00 -0.52 0.00 0.00 55.73 54.62 1utf s ARG 58 Cb -0.14 -2.53 0.00 0.00 0.52 0.00 0.00 34.95 32.79 1utf s ARG 58 CO -0.01 0.56 0.00 0.41 0.02 0.00 0.00 175.30 176.27 1utf n GLY 59 N 2.52 0.51 3.61 -3.53 0.00 -1.26 -0.98 105.19 106.06 1utf n GLY 59 Ca -0.18 -2.01 -0.41 0.00 0.00 0.00 0.00 46.02 43.41 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 -1.37 3.99 0.07 1.61 2.20 -1.26 -3.95 119.74 121.03 1utf s LYS 60 Ca 0.00 0.54 -0.13 0.00 -0.36 0.00 0.00 55.97 56.02 1utf s LYS 60 Cb 0.00 -3.71 0.02 0.00 -1.51 0.00 0.00 37.83 32.63 1utf s LYS 60 CO 0.00 -0.60 0.31 0.00 -0.36 0.00 0.00 175.35 174.70 1utf s ALA 61 N 2.79 -0.66 -0.14 3.13 0.00 -1.11 -0.11 121.76 125.66 1utf s ALA 61 Ca 0.30 -0.11 -0.02 0.00 0.00 0.00 0.00 51.96 52.12 1utf s ALA 61 Cb -0.15 0.43 -0.02 0.00 0.00 0.00 0.00 23.12 23.38 1utf s ALA 61 CO 0.11 -0.48 -0.07 -0.47 0.00 0.00 0.00 175.76 174.86 1utf s TYR 62 N -3.05 2.96 -0.06 0.00 5.04 -0.06 -1.53 117.35 120.65 1utf s TYR 62 Ca -0.01 -0.35 0.05 0.00 -2.44 0.00 0.00 57.07 54.31 1utf s TYR 62 Cb 0.01 -1.89 -0.00 0.00 0.35 0.00 0.00 41.96 40.42 1utf s TYR 62 CO -0.06 -0.03 -0.20 0.42 -1.34 0.00 0.00 175.55 174.33 1utf s ILE 63 N 0.20 1.70 -0.09 3.14 1.01 0.42 -1.13 121.20 126.44 1utf s ILE 63 Ca -0.04 -0.85 0.04 0.00 0.00 0.00 0.00 60.65 59.80 1utf s ILE 63 Cb -0.14 -1.46 -0.00 0.00 0.01 0.00 0.00 42.46 40.86 1utf s ILE 63 CO 0.04 0.48 -0.24 -1.10 0.00 0.00 0.00 174.94 174.11 1utf s GLN 64 N 0.11 2.94 0.33 2.79 -0.21 -0.23 -1.38 119.66 124.02 1utf s GLN 64 Ca -0.08 -0.88 0.05 0.00 0.02 0.00 0.00 55.36 54.47 1utf s GLN 64 Cb -0.14 -2.27 -0.02 0.00 1.00 0.00 0.00 33.01 31.59 1utf s GLN 64 CO 0.04 0.21 0.19 0.25 -2.12 0.00 0.00 175.29 173.87 1utf n THR 65 N 3.42 0.00 -0.09 -0.19 -2.24 -0.45 -1.17 114.28 113.56 1utf n THR 65 Ca -0.19 -2.16 0.25 0.00 -2.27 0.00 0.00 64.05 59.68 1utf n THR 65 Cb 0.53 0.92 0.72 0.00 -2.10 0.00 0.00 70.33 70.40 1utf n THR 65 CO 0.00 0.00 0.00 -0.09 -0.57 0.00 0.00 175.07 174.41 1utf h ARG 66 N 0.00 0.00 -0.23 -0.78 2.43 -2.01 -2.41 114.38 111.38 1utf h ARG 66 Ca -0.25 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.92 1utf h ARG 66 Cb 1.09 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.64 1utf h ARG 66 CO 0.38 0.00 0.00 0.72 -1.51 0.00 0.00 179.97 179.56 1utf n HIS 67 N -4.22 0.28 0.00 2.20 8.25 -1.26 -5.05 115.22 115.43 1utf n HIS 67 Ca 0.14 -0.14 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 1utf n HIS 67 Cb 0.81 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.92 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 1.38 0.72 3.55 -1.41 0.00 -0.91 -5.09 105.19 103.43 1utf n GLY 68 Ca 0.17 -2.08 -0.24 0.00 0.00 0.00 0.00 46.02 43.87 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 -1.38 2.92 -0.03 1.61 -7.23 -1.26 -1.35 120.40 113.68 1utf s VAL 69 Ca 0.00 -2.12 -0.30 0.00 -1.81 0.00 0.00 61.98 57.75 1utf s VAL 69 Cb 0.00 -2.53 0.08 0.00 0.56 0.00 0.00 36.38 34.49 1utf s VAL 69 CO 0.00 -0.35 0.73 -0.51 -0.31 0.00 0.00 175.10 174.66 1utf s ILE 70 N -2.31 0.00 -0.09 -0.62 2.07 -0.48 -5.02 121.20 114.75 1utf s ILE 70 Ca 0.30 0.00 0.03 0.00 -1.41 0.00 0.00 60.65 59.56 1utf s ILE 70 Cb -0.06 -1.00 -0.01 0.00 0.13 0.00 0.00 42.46 41.52 1utf s ILE 70 CO 0.17 0.00 -0.18 -1.61 -1.91 0.00 0.00 174.94 171.40 1utf s GLU 71 N -1.66 2.99 0.47 3.50 2.02 -1.26 -0.44 118.70 124.32 1utf s GLU 71 Ca -0.07 -0.78 -0.18 0.00 0.02 0.00 0.00 54.97 53.96 1utf s GLU 71 Cb -0.00 -2.41 -0.09 0.00 0.10 0.00 0.00 34.13 31.72 1utf s GLU 71 CO 0.04 0.30 0.96 -1.54 0.02 0.00 0.00 175.26 175.05 1utf s SER 72 N 0.07 6.77 -0.05 -0.19 1.04 -0.58 -4.96 113.70 115.80 1utf s SER 72 Ca -0.08 1.61 0.05 0.00 0.48 0.00 0.00 55.95 58.01 1utf s SER 72 Cb -0.15 -2.52 -0.00 0.00 0.10 0.00 0.00 66.02 63.45 1utf s SER 72 CO 0.05 -0.47 -0.19 -1.61 0.98 0.00 0.00 173.24 172.00 1utf s GLU 73 N -3.64 1.94 0.00 4.02 2.02 -1.25 -2.77 118.70 119.01 1utf s GLU 73 Ca 0.60 -0.67 0.20 0.00 0.02 0.00 0.00 54.97 55.12 1utf s GLU 73 Cb -0.09 -1.68 0.16 0.00 0.10 0.00 0.00 34.13 32.62 1utf s GLU 73 CO 0.23 0.27 1.14 0.41 0.02 0.00 0.00 175.26 177.33