#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gtf n ASN 6 N 0.00 4.01 -4.78 3.42 4.05 -1.26 -5.02 115.26 115.68 1gtf n ASN 6 Ca 0.00 -3.56 -0.30 0.00 0.45 0.00 0.00 54.58 51.16 1gtf n ASN 6 Cb 0.00 -0.84 0.09 0.00 1.23 0.00 0.00 39.78 40.26 1gtf n ASN 6 CO 0.00 0.00 0.00 -0.44 -3.05 0.00 0.00 177.26 173.77 1gtf s SER 7 N -1.25 4.44 0.88 1.20 0.01 -1.26 -5.02 113.70 112.70 1gtf s SER 7 Ca 0.55 1.55 -0.12 0.00 1.31 0.00 0.00 55.95 59.24 1gtf s SER 7 Cb 0.46 -2.29 0.09 0.00 0.21 0.00 0.00 66.02 64.49 1gtf s SER 7 CO 0.10 -2.03 0.97 0.47 0.41 0.00 0.00 173.24 173.15 1gtf n ASP 8 N -3.50 -0.06 -4.11 2.44 8.00 -1.26 -4.76 116.55 113.30 1gtf n ASP 8 Ca 0.08 0.46 -0.09 0.00 0.71 0.00 0.00 54.79 55.95 1gtf n ASP 8 Cb 0.55 -1.41 -0.10 0.00 -0.02 0.00 0.00 41.12 40.13 1gtf n ASP 8 CO 0.00 0.00 0.00 0.72 -0.39 0.00 0.00 177.20 177.53 1gtf s PHE 9 N -2.39 0.71 0.15 1.24 -0.12 -1.26 -1.74 117.98 114.57 1gtf s PHE 9 Ca 0.67 -1.13 0.10 0.00 -0.05 0.00 0.00 56.93 56.52 1gtf s PHE 9 Cb -0.25 -0.40 -0.04 0.00 -0.63 0.00 0.00 43.02 41.69 1gtf s PHE 9 CO 0.58 -0.50 -0.23 0.14 -0.05 0.00 0.00 175.22 175.15 1gtf s VAL 10 N -4.00 2.12 -0.14 -2.49 -7.23 0.16 -4.66 120.40 104.16 1gtf s VAL 10 Ca 0.19 -1.85 -0.03 0.00 -1.81 0.00 0.00 61.98 58.47 1gtf s VAL 10 Cb 0.07 -1.94 -0.03 0.00 0.56 0.00 0.00 36.38 35.04 1gtf s VAL 10 CO -0.02 -0.08 -0.03 -0.69 -0.31 0.00 0.00 175.10 173.97 1gtf s VAL 11 N -1.47 3.95 -0.09 1.32 1.01 -0.45 -1.08 120.40 123.59 1gtf s VAL 11 Ca 0.15 -0.34 -0.01 0.00 0.00 0.00 0.00 61.98 61.78 1gtf s VAL 11 Cb -0.08 -2.72 0.03 0.00 0.00 0.00 0.00 36.38 33.60 1gtf s VAL 11 CO 0.07 0.51 -0.04 -0.63 0.00 0.00 0.00 175.10 175.02 1gtf s ILE 12 N 0.16 0.66 -0.20 2.22 1.01 0.24 -1.17 121.20 124.13 1gtf s ILE 12 Ca -0.01 -0.07 -0.04 0.00 0.00 0.00 0.00 60.65 60.53 1gtf s ILE 12 Cb -0.14 -0.75 -0.01 0.00 0.01 0.00 0.00 42.46 41.57 1gtf s ILE 12 CO 0.03 0.30 -0.04 -0.75 0.00 0.00 0.00 174.94 174.48 1gtf s LYS 13 N 1.76 3.45 0.16 2.79 2.20 0.84 -0.88 119.74 130.06 1gtf s LYS 13 Ca 0.03 -0.60 -0.30 0.00 -0.36 0.00 0.00 55.97 54.74 1gtf s LYS 13 Cb -0.13 -2.97 -0.07 0.00 -1.51 0.00 0.00 37.83 33.15 1gtf s LYS 13 CO -0.06 -0.07 1.12 0.00 -0.36 0.00 0.00 175.35 175.98 1gtf s ALA 14 N 1.16 3.37 -1.79 3.13 0.00 -0.45 -0.65 121.76 126.53 1gtf s ALA 14 Ca 0.02 0.83 0.18 0.00 0.00 0.00 0.00 51.96 52.99 1gtf s ALA 14 Cb -0.14 -3.37 0.02 0.00 0.00 0.00 0.00 23.12 19.63 1gtf s ALA 14 CO -0.01 -0.26 0.96 1.28 0.00 0.00 0.00 175.76 177.74 1gtf n LEU 15 N 2.62 1.91 -4.08 0.00 4.77 0.58 -0.71 117.00 122.09 1gtf n LEU 15 Ca 0.04 -0.81 -0.11 0.00 -0.03 0.00 0.00 56.01 55.10 1gtf n LEU 15 Cb 0.46 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.48 1gtf n LEU 15 CO 0.54 0.35 0.03 -1.83 -1.33 0.00 0.00 177.39 175.15 1gtf s GLU 16 N -1.99 1.46 0.59 3.23 -1.05 -1.22 -4.86 118.70 114.86 1gtf s GLU 16 Ca 0.16 -1.43 -0.16 0.00 -0.15 0.00 0.00 54.97 53.38 1gtf s GLU 16 Cb 0.15 0.40 -0.03 0.00 -0.44 0.00 0.00 34.13 34.20 1gtf s GLU 16 CO 0.42 -0.57 1.08 -0.51 0.95 0.00 0.00 175.26 176.63 1gtf s ASP 17 N -3.09 5.66 0.00 0.83 1.01 -1.26 -3.21 116.67 116.60 1gtf s ASP 17 Ca 0.29 1.91 0.00 0.00 0.71 0.00 0.00 52.55 55.47 1gtf s ASP 17 Cb 0.02 -2.55 0.00 0.00 1.01 0.00 0.00 42.92 41.40 1gtf s ASP 17 CO 0.11 -1.25 0.00 0.61 0.21 0.00 0.00 175.17 174.85 1gtf n GLY 18 N -0.66 0.71 3.72 0.21 0.00 -0.70 -4.88 105.19 103.59 1gtf n GLY 18 Ca 0.10 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.69 1gtf n GLY 18 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1gtf n VAL 19 N -2.49 0.99 -3.89 1.61 0.31 -0.98 -4.76 118.33 109.12 1gtf n VAL 19 Ca 0.00 -0.25 -0.35 0.00 -0.01 0.00 0.00 64.34 63.73 1gtf n VAL 19 Cb 0.00 -1.79 -0.14 0.00 -0.91 0.00 0.00 33.84 31.01 1gtf n VAL 19 CO 0.00 0.00 0.00 0.20 -1.32 0.00 0.00 176.83 175.71 1gtf s ASN 20 N 0.43 4.47 -0.37 4.52 0.02 -0.08 -0.06 114.94 123.86 1gtf s ASN 20 Ca 0.66 -0.58 -0.11 0.00 -1.02 0.00 0.00 52.86 51.80 1gtf s ASN 20 Cb -0.55 -1.75 0.02 0.00 0.02 0.00 0.00 41.25 38.99 1gtf s ASN 20 CO 0.49 -0.08 0.21 -0.69 0.02 0.00 0.00 177.10 177.05 1gtf s VAL 21 N 1.44 4.68 -0.20 1.60 1.01 -0.17 -0.65 120.40 128.11 1gtf s VAL 21 Ca 0.04 -0.78 -0.04 0.00 0.00 0.00 0.00 61.98 61.19 1gtf s VAL 21 Cb -0.15 -3.58 -0.02 0.00 0.00 0.00 0.00 36.38 32.62 1gtf s VAL 21 CO -0.02 -0.21 -0.02 -0.63 0.00 0.00 0.00 175.10 174.22 1gtf s ILE 22 N 1.58 3.75 -0.22 2.22 1.01 0.75 -0.91 121.20 129.38 1gtf s ILE 22 Ca 0.03 -0.38 -0.20 0.00 0.00 0.00 0.00 60.65 60.10 1gtf s ILE 22 Cb -0.19 -2.69 -0.02 0.00 0.01 0.00 0.00 42.46 39.56 1gtf s ILE 22 CO 0.07 0.43 0.61 -0.83 0.00 0.00 0.00 174.94 175.22 1gtf s GLY 23 N 1.09 1.97 0.00 6.18 0.00 0.58 -0.75 107.32 116.39 1gtf s GLY 23 Ca 0.02 -0.36 -0.13 0.00 0.00 0.00 0.00 44.72 44.25 1gtf s GLY 23 CO 0.01 1.31 0.38 1.08 0.00 0.00 0.00 173.10 175.88 1gtf s LEU 24 N 2.08 4.44 0.17 0.66 1.02 0.16 -1.31 118.68 125.90 1gtf s LEU 24 Ca 0.27 0.88 -0.31 0.00 0.02 0.00 0.00 54.13 54.99 1gtf s LEU 24 Cb -0.16 -2.60 -0.09 0.00 0.02 0.00 0.00 46.19 43.36 1gtf s LEU 24 CO 0.10 0.31 1.41 0.42 0.02 0.00 0.00 176.35 178.60 1gtf s THR 25 N -1.13 3.07 0.35 5.49 -4.23 -0.16 -2.43 115.64 116.59 1gtf s THR 25 Ca 0.24 0.81 -0.28 0.00 -1.18 0.00 0.00 61.69 61.28 1gtf s THR 25 Cb -0.16 -3.52 -0.11 0.00 1.34 0.00 0.00 72.50 70.06 1gtf s THR 25 CO 0.13 0.09 1.44 -0.60 -0.54 0.00 0.00 174.62 175.14 1gtf s ARG 26 N 0.56 4.19 0.00 3.99 3.52 -0.45 -4.53 118.95 126.23 1gtf s ARG 26 Ca 0.63 2.46 0.00 0.00 -0.13 0.00 0.00 55.73 58.68 1gtf s ARG 26 Cb -0.39 -3.01 0.00 0.00 -1.56 0.00 0.00 34.95 30.00 1gtf s ARG 26 CO 0.34 -0.43 0.00 0.41 -0.81 0.00 0.00 175.30 174.81 1gtf n GLY 27 N 0.75 0.54 0.18 8.12 0.00 -1.26 -4.72 105.19 108.80 1gtf n GLY 27 Ca 0.01 -2.21 0.03 0.00 0.00 0.00 0.00 46.02 43.85 1gtf n GLY 27 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1gtf h ALA 28 N 0.00 1.35 -2.65 4.61 0.00 -2.05 -3.42 119.26 117.09 1gtf h ALA 28 Ca 0.00 -0.35 -0.58 0.00 0.00 0.00 0.00 54.91 53.98 1gtf h ALA 28 Cb 0.00 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 17.68 1gtf h ALA 28 CO 0.00 0.47 -0.14 0.34 0.00 0.00 0.00 179.25 179.92 1gtf s ASP 29 N -6.90 6.83 -0.52 0.00 2.15 -1.26 -5.06 116.67 111.91 1gtf s ASP 29 Ca -0.03 1.02 0.04 0.00 0.43 0.00 0.00 52.55 54.01 1gtf s ASP 29 Cb 0.14 -2.27 0.13 0.00 -0.30 0.00 0.00 42.92 40.63 1gtf s ASP 29 CO 0.72 0.21 0.27 -0.89 -0.17 0.00 0.00 175.17 175.32 1gtf s THR 30 N -1.28 2.36 0.45 1.71 2.01 -1.26 -4.57 115.64 115.05 1gtf s THR 30 Ca 0.31 -3.24 0.03 0.00 0.31 0.00 0.00 61.69 59.11 1gtf s THR 30 Cb -0.16 -2.63 -0.01 0.00 0.01 0.00 0.00 72.50 69.70 1gtf s THR 30 CO 0.17 -0.84 0.12 0.00 -0.69 0.00 0.00 174.62 173.38 1gtf s ARG 31 N -0.25 2.04 -0.07 4.92 1.70 -1.26 -4.88 118.95 121.15 1gtf s ARG 31 Ca 0.18 -2.27 -0.21 0.00 -0.47 0.00 0.00 55.73 52.96 1gtf s ARG 31 Cb -0.24 -0.75 -0.04 0.00 -0.57 0.00 0.00 34.95 33.35 1gtf s ARG 31 CO -0.01 -0.51 0.60 -0.06 -1.08 0.00 0.00 175.30 174.23 1gtf s PHE 32 N -3.12 3.58 -0.02 5.89 0.08 -1.26 -0.99 117.98 122.14 1gtf s PHE 32 Ca 0.18 1.11 0.11 0.00 0.12 0.00 0.00 56.93 58.45 1gtf s PHE 32 Cb 0.01 -2.67 -0.17 0.00 -0.57 0.00 0.00 43.02 39.63 1gtf s PHE 32 CO 0.12 0.18 0.23 -2.39 -0.10 0.00 0.00 175.22 173.27 1gtf n HIS 33 N 3.47 0.00 -3.68 0.36 1.44 -0.42 -4.90 115.22 111.48 1gtf n HIS 33 Ca -0.05 0.00 -0.14 0.00 -2.01 0.00 0.00 57.72 55.52 1gtf n HIS 33 Cb 0.51 -0.26 -0.08 0.00 0.12 0.00 0.00 29.99 30.28 1gtf n HIS 33 CO 0.00 0.00 0.00 -1.58 -2.81 0.00 0.00 176.34 171.95 1gtf s HIS 34 N -2.74 -0.49 -0.17 -1.40 5.65 -1.23 -5.02 115.29 109.89 1gtf s HIS 34 Ca -0.04 1.09 0.00 0.00 0.25 0.00 0.00 55.06 56.36 1gtf s HIS 34 Cb 0.07 0.21 0.03 0.00 -1.18 0.00 0.00 32.58 31.71 1gtf s HIS 34 CO 0.46 -0.35 -0.10 0.45 -0.65 0.00 0.00 174.74 174.54 1gtf s SER 35 N -0.30 2.98 -0.32 9.88 0.15 -1.26 -0.31 113.70 124.52 1gtf s SER 35 Ca -0.05 -0.68 -0.14 0.00 0.70 0.00 0.00 55.95 55.78 1gtf s SER 35 Cb -0.03 -1.13 -0.02 0.00 -1.71 0.00 0.00 66.02 63.13 1gtf s SER 35 CO 0.03 -0.12 0.33 -0.70 1.20 0.00 0.00 173.24 173.97 1gtf s GLU 36 N 1.49 3.66 -0.18 5.44 2.56 -0.09 -4.92 118.70 126.66 1gtf s GLU 36 Ca 0.02 -0.37 -0.23 0.00 0.00 0.00 0.00 54.97 54.38 1gtf s GLU 36 Cb -0.15 -3.77 -0.02 0.00 2.00 0.00 0.00 34.13 32.19 1gtf s GLU 36 CO -0.09 -0.44 0.73 0.15 -0.56 0.00 0.00 175.26 175.05 1gtf s LYS 37 N 1.96 4.27 -0.07 4.30 3.01 -1.26 -1.00 119.74 130.94 1gtf s LYS 37 Ca 0.11 0.82 0.01 0.00 -1.01 0.00 0.00 55.97 55.91 1gtf s LYS 37 Cb -0.16 -3.57 -0.03 0.00 -1.01 0.00 0.00 37.83 33.06 1gtf s LYS 37 CO 0.11 -0.26 -0.09 -0.51 0.51 0.00 0.00 175.35 175.11 1gtf s LEU 38 N 1.96 3.02 0.50 3.17 1.43 0.91 -4.97 118.68 124.70 1gtf s LEU 38 Ca 0.34 -0.09 -0.05 0.00 -1.03 0.00 0.00 54.13 53.30 1gtf s LEU 38 Cb -0.16 -1.65 -0.03 0.00 0.03 0.00 0.00 46.19 44.38 1gtf s LEU 38 CO 0.12 0.34 0.79 -1.81 0.23 0.00 0.00 176.35 176.01 1gtf s ASP 39 N -0.66 6.11 0.10 2.29 1.01 -1.26 -1.72 116.67 122.54 1gtf s ASP 39 Ca 0.10 0.83 -0.35 0.00 0.71 0.00 0.00 52.55 53.84 1gtf s ASP 39 Cb -0.11 -2.09 -0.15 0.00 1.01 0.00 0.00 42.92 41.58 1gtf s ASP 39 CO 0.01 -0.67 1.54 1.17 0.21 0.00 0.00 175.17 177.44 1gtf n LYS 40 N -2.29 1.84 0.00 8.23 4.81 -1.20 -1.23 118.16 128.31 1gtf n LYS 40 Ca 0.01 0.66 0.00 0.00 -0.87 0.00 0.00 58.31 58.11 1gtf n LYS 40 Cb 0.56 -2.40 0.00 0.00 0.02 0.00 0.00 35.03 33.21 1gtf n LYS 40 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1gtf n GLY 41 N 3.27 3.00 3.77 3.14 0.00 0.11 -4.97 105.19 113.51 1gtf n GLY 41 Ca 0.18 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.83 1gtf n GLY 41 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1gtf s GLU 42 N -0.64 3.69 -0.07 1.61 2.02 -0.37 -4.71 118.70 120.23 1gtf s GLU 42 Ca 0.00 1.80 0.05 0.00 0.02 0.00 0.00 54.97 56.84 1gtf s GLU 42 Cb 0.00 -2.37 -0.00 0.00 0.10 0.00 0.00 34.13 31.85 1gtf s GLU 42 CO 0.00 -0.62 -0.22 0.08 0.02 0.00 0.00 175.26 174.52 1gtf s VAL 43 N -1.54 1.84 -0.11 2.63 1.01 -1.26 -1.35 120.40 121.63 1gtf s VAL 43 Ca 0.65 -0.92 0.03 0.00 0.00 0.00 0.00 61.98 61.74 1gtf s VAL 43 Cb -0.29 -1.58 -0.00 0.00 0.00 0.00 0.00 36.38 34.50 1gtf s VAL 43 CO 0.35 0.51 -0.23 -0.22 0.00 0.00 0.00 175.10 175.52 1gtf s LEU 44 N 0.15 2.17 -0.28 3.92 2.96 -0.06 -4.98 118.68 122.56 1gtf s LEU 44 Ca -0.10 -0.54 -0.01 0.00 -0.22 0.00 0.00 54.13 53.25 1gtf s LEU 44 Cb -0.15 -1.44 0.04 0.00 0.50 0.00 0.00 46.19 45.14 1gtf s LEU 44 CO 0.05 0.15 -0.03 -0.63 -1.32 0.00 0.00 176.35 174.58 1gtf s ILE 45 N 0.39 2.91 -0.06 6.68 1.01 -1.26 -0.59 121.20 130.27 1gtf s ILE 45 Ca -0.17 -1.26 0.02 0.00 0.00 0.00 0.00 60.65 59.25 1gtf s ILE 45 Cb -0.18 -2.60 0.01 0.00 0.01 0.00 0.00 42.46 39.71 1gtf s ILE 45 CO 0.08 0.01 -0.12 0.00 0.00 0.00 0.00 174.94 174.91 1gtf s ALA 46 N 1.27 1.25 0.48 9.38 0.00 -0.24 -4.94 121.76 128.96 1gtf s ALA 46 Ca -0.03 -0.42 -0.13 0.00 0.00 0.00 0.00 51.96 51.38 1gtf s ALA 46 Cb -0.19 -0.55 -0.06 0.00 0.00 0.00 0.00 23.12 22.32 1gtf s ALA 46 CO -0.02 0.12 0.90 -0.65 0.00 0.00 0.00 175.76 176.11 1gtf s GLN 47 N 0.61 3.81 0.39 0.00 -0.21 -1.26 -0.66 119.66 122.34 1gtf s GLN 47 Ca -0.13 0.69 -0.24 0.00 0.02 0.00 0.00 55.36 55.69 1gtf s GLN 47 Cb -0.15 -2.24 -0.09 0.00 1.00 0.00 0.00 33.01 31.53 1gtf s GLN 47 CO 0.03 -0.22 1.06 -0.06 -2.12 0.00 0.00 175.29 173.99 1gtf s PHE 48 N -2.61 3.27 0.34 0.91 0.08 -0.71 -4.95 117.98 114.30 1gtf s PHE 48 Ca 0.55 1.64 0.01 0.00 0.12 0.00 0.00 56.93 59.25 1gtf s PHE 48 Cb -0.10 -3.15 -0.00 0.00 -0.57 0.00 0.00 43.02 39.20 1gtf s PHE 48 CO 0.35 -0.66 0.42 0.25 -0.10 0.00 0.00 175.22 175.48 1gtf n THR 49 N 0.00 0.00 -0.23 0.64 -2.24 -0.58 -4.71 114.28 107.16 1gtf n THR 49 Ca 0.05 -1.91 0.15 0.00 -2.27 0.00 0.00 64.05 60.06 1gtf n THR 49 Cb 0.49 1.10 0.44 0.00 -2.10 0.00 0.00 70.33 70.27 1gtf n THR 49 CO 0.00 0.00 0.00 -0.08 -0.57 0.00 0.00 175.07 174.42 1gtf h GLU 50 N 0.00 0.53 0.00 -0.78 4.81 -2.03 -2.80 114.58 114.31 1gtf h GLU 50 Ca -0.26 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 58.94 1gtf h GLU 50 Cb 1.16 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 30.42 1gtf h GLU 50 CO 0.35 0.35 -1.36 0.72 -0.73 0.00 0.00 179.01 178.35 1gtf n HIS 51 N -4.53 0.60 -3.94 0.92 8.25 -1.26 -4.62 115.22 110.63 1gtf n HIS 51 Ca 0.17 0.17 -0.29 0.00 -0.26 0.00 0.00 57.72 57.51 1gtf n HIS 51 Cb 0.54 -0.78 -0.16 0.00 1.12 0.00 0.00 29.99 30.71 1gtf n HIS 51 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 1gtf s THR 52 N -3.41 1.37 -0.54 1.59 2.01 -1.06 -1.34 115.64 114.26 1gtf s THR 52 Ca -0.03 -0.82 0.05 0.00 0.31 0.00 0.00 61.69 61.20 1gtf s THR 52 Cb 0.11 -1.50 0.06 0.00 0.01 0.00 0.00 72.50 71.19 1gtf s THR 52 CO 0.83 0.15 0.78 -1.54 -0.69 0.00 0.00 174.62 174.14 1gtf n SER 53 N 4.78 1.67 -3.61 3.53 3.41 -1.02 -1.53 113.62 120.85 1gtf n SER 53 Ca -0.13 -1.42 -0.16 0.00 -0.26 0.00 0.00 58.87 56.91 1gtf n SER 53 Cb 0.47 -0.03 -0.07 0.00 -0.26 0.00 0.00 64.21 64.32 1gtf n SER 53 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1gtf s ALA 54 N -0.56 -1.55 -0.07 7.33 0.00 -1.25 -5.01 121.76 120.66 1gtf s ALA 54 Ca 0.07 1.36 0.02 0.00 0.00 0.00 0.00 51.96 53.41 1gtf s ALA 54 Cb 0.04 -0.41 0.02 0.00 0.00 0.00 0.00 23.12 22.77 1gtf s ALA 54 CO 0.06 -0.33 -0.10 0.42 0.00 0.00 0.00 175.76 175.82 1gtf s ILE 55 N -0.60 1.00 -0.13 0.00 1.01 -1.26 -0.66 121.20 120.56 1gtf s ILE 55 Ca -0.07 -0.38 -0.02 0.00 0.00 0.00 0.00 60.65 60.17 1gtf s ILE 55 Cb -0.03 -0.95 -0.03 0.00 0.01 0.00 0.00 42.46 41.47 1gtf s ILE 55 CO 0.06 0.33 -0.04 -0.75 0.00 0.00 0.00 174.94 174.53 1gtf s LYS 56 N 0.86 3.43 -0.20 2.79 2.20 0.07 -4.94 119.74 123.95 1gtf s LYS 56 Ca -0.11 -0.52 -0.03 0.00 -0.36 0.00 0.00 55.97 54.95 1gtf s LYS 56 Cb -0.15 -2.83 -0.01 0.00 -1.51 0.00 0.00 37.83 33.33 1gtf s LYS 56 CO 0.01 0.36 -0.07 0.08 -0.36 0.00 0.00 175.35 175.37 1gtf s VAL 57 N 0.03 3.22 -0.12 4.02 1.01 -1.26 -0.18 120.40 127.13 1gtf s VAL 57 Ca -0.00 -0.56 0.01 0.00 0.00 0.00 0.00 61.98 61.44 1gtf s VAL 57 Cb -0.13 -2.44 -0.01 0.00 0.00 0.00 0.00 36.38 33.80 1gtf s VAL 57 CO 0.03 0.46 -0.17 -0.13 0.00 0.00 0.00 175.10 175.29 1gtf s ARG 58 N 1.19 3.27 0.00 2.72 0.52 0.18 -4.95 118.95 121.89 1gtf s ARG 58 Ca 0.02 -0.75 0.00 0.00 -0.52 0.00 0.00 55.73 54.48 1gtf s ARG 58 Cb -0.14 -2.52 0.00 0.00 0.52 0.00 0.00 34.95 32.81 1gtf s ARG 58 CO -0.02 0.20 0.00 0.41 0.02 0.00 0.00 175.30 175.91 1gtf n GLY 59 N 3.52 1.00 3.65 -3.53 0.00 -1.26 -0.90 105.19 107.67 1gtf n GLY 59 Ca -0.18 -2.05 -0.43 0.00 0.00 0.00 0.00 46.02 43.35 1gtf n GLY 59 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1gtf s LYS 60 N -1.60 4.16 0.07 1.61 2.20 -1.26 -3.87 119.74 121.05 1gtf s LYS 60 Ca 0.00 1.22 -0.15 0.00 -0.36 0.00 0.00 55.97 56.68 1gtf s LYS 60 Cb 0.00 -3.70 0.03 0.00 -1.51 0.00 0.00 37.83 32.65 1gtf s LYS 60 CO 0.00 -0.78 0.36 0.00 -0.36 0.00 0.00 175.35 174.57 1gtf s ALA 61 N 3.46 -0.82 -0.15 3.13 0.00 -1.02 -0.31 121.76 126.05 1gtf s ALA 61 Ca 0.45 0.04 -0.07 0.00 0.00 0.00 0.00 51.96 52.39 1gtf s ALA 61 Cb -0.14 0.44 -0.04 0.00 0.00 0.00 0.00 23.12 23.38 1gtf s ALA 61 CO 0.11 -0.49 0.08 -0.47 0.00 0.00 0.00 175.76 174.98 1gtf s TYR 62 N -2.96 3.33 -0.08 0.00 5.04 0.18 -0.72 117.35 122.14 1gtf s TYR 62 Ca -0.02 0.23 0.01 0.00 -2.44 0.00 0.00 57.07 54.84 1gtf s TYR 62 Cb 0.00 -2.01 0.02 0.00 0.35 0.00 0.00 41.96 40.33 1gtf s TYR 62 CO -0.06 0.36 -0.08 0.42 -1.34 0.00 0.00 175.55 174.85 1gtf s ILE 63 N -0.17 0.95 -0.13 3.14 1.01 0.11 -0.11 121.20 126.00 1gtf s ILE 63 Ca 0.08 -0.31 -0.01 0.00 0.00 0.00 0.00 60.65 60.42 1gtf s ILE 63 Cb -0.12 -0.94 -0.02 0.00 0.01 0.00 0.00 42.46 41.40 1gtf s ILE 63 CO 0.01 0.33 -0.11 -1.10 0.00 0.00 0.00 174.94 174.08 1gtf s GLN 64 N 1.22 3.40 0.36 2.79 -0.21 -0.32 -1.29 119.66 125.61 1gtf s GLN 64 Ca -0.05 -0.64 0.05 0.00 0.02 0.00 0.00 55.36 54.74 1gtf s GLN 64 Cb -0.14 -2.69 -0.03 0.00 1.00 0.00 0.00 33.01 31.15 1gtf s GLN 64 CO -0.02 0.25 0.19 0.95 -2.12 0.00 0.00 175.29 174.54 1gtf s THR 65 N 0.27 0.32 0.57 -0.19 -4.23 -0.36 -1.34 115.64 110.68 1gtf s THR 65 Ca -0.08 -2.00 0.28 0.00 -1.18 0.00 0.00 61.69 58.71 1gtf s THR 65 Cb -0.15 -2.43 0.38 0.00 1.34 0.00 0.00 72.50 71.64 1gtf s THR 65 CO 0.05 0.00 1.97 -0.09 -0.54 0.00 0.00 174.62 176.01 1gtf h ARG 66 N 2.01 0.00 -0.29 3.99 2.43 -2.01 -2.36 114.38 118.16 1gtf h ARG 66 Ca -0.31 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.86 1gtf h ARG 66 Cb 1.25 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.80 1gtf h ARG 66 CO 0.49 0.00 0.00 0.72 -1.51 0.00 0.00 179.97 179.67 1gtf n HIS 67 N -3.91 0.36 0.00 2.20 8.25 -1.26 -5.05 115.22 115.82 1gtf n HIS 67 Ca 0.07 -0.18 0.00 0.00 -0.26 0.00 0.00 57.72 57.35 1gtf n HIS 67 Cb 0.57 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.68 1gtf n HIS 67 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1gtf n GLY 68 N 1.33 0.56 3.50 -1.41 0.00 -0.89 -5.09 105.19 103.19 1gtf n GLY 68 Ca 0.18 -2.23 -0.25 0.00 0.00 0.00 0.00 46.02 43.71 1gtf n GLY 68 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1gtf s VAL 69 N -0.42 2.70 -0.04 1.61 -7.23 -1.26 -1.22 120.40 114.54 1gtf s VAL 69 Ca 0.00 -2.07 -0.29 0.00 -1.81 0.00 0.00 61.98 57.81 1gtf s VAL 69 Cb 0.00 -2.37 0.09 0.00 0.56 0.00 0.00 36.38 34.66 1gtf s VAL 69 CO 0.00 -0.24 0.77 -0.51 -0.31 0.00 0.00 175.10 174.80 1gtf s ILE 70 N -2.05 0.00 -0.09 -0.62 2.07 -0.41 -5.02 121.20 115.08 1gtf s ILE 70 Ca 0.26 0.00 0.03 0.00 -1.41 0.00 0.00 60.65 59.53 1gtf s ILE 70 Cb -0.07 -1.00 -0.01 0.00 0.13 0.00 0.00 42.46 41.51 1gtf s ILE 70 CO 0.14 0.00 -0.21 -1.61 -1.91 0.00 0.00 174.94 171.35 1gtf s GLU 71 N -1.78 2.99 0.51 3.50 2.02 -1.26 -0.71 118.70 123.97 1gtf s GLU 71 Ca -0.05 -0.82 -0.09 0.00 0.02 0.00 0.00 54.97 54.03 1gtf s GLU 71 Cb -0.00 -2.36 -0.05 0.00 0.10 0.00 0.00 34.13 31.82 1gtf s GLU 71 CO 0.02 0.26 0.87 -1.54 0.02 0.00 0.00 175.26 174.90 1gtf s SER 72 N 0.16 6.34 0.05 -0.19 1.04 0.11 -4.92 113.70 116.29 1gtf s SER 72 Ca -0.11 1.18 0.06 0.00 0.48 0.00 0.00 55.95 57.55 1gtf s SER 72 Cb -0.16 -2.35 -0.02 0.00 0.10 0.00 0.00 66.02 63.58 1gtf s SER 72 CO 0.06 -0.63 -0.16 -1.61 0.98 0.00 0.00 173.24 171.89 1gtf s GLU 73 N -4.62 1.00 0.00 4.02 2.02 -1.25 -2.44 118.70 117.43 1gtf s GLU 73 Ca 0.52 -0.86 0.07 0.00 0.02 0.00 0.00 54.97 54.72 1gtf s GLU 73 Cb -0.10 -1.05 0.05 0.00 0.10 0.00 0.00 34.13 33.13 1gtf s GLU 73 CO 0.43 0.25 0.71 0.41 0.02 0.00 0.00 175.26 177.09