#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 5.11 -4.83 3.42 2.85 -1.26 -5.02 115.26 115.53 1gtf n ASN 6 Ca 0.00 -3.76 -0.30 0.00 -0.11 0.00 0.00 54.58 50.41 1gtf n ASN 6 Cb 0.00 -0.71 0.07 0.00 1.24 0.00 0.00 39.78 40.38 1gtf n ASN 6 CO 0.00 0.00 0.00 -0.44 -2.11 0.00 0.00 177.26 174.71 1gtf s SER 7 N -2.41 4.91 0.93 1.20 0.01 -1.26 -5.03 113.70 112.05 1gtf s SER 7 Ca 0.55 1.30 -0.11 0.00 1.31 0.00 0.00 55.95 58.99 1gtf s SER 7 Cb 0.45 -2.07 0.15 0.00 0.21 0.00 0.00 66.02 64.76 1gtf s SER 7 CO 0.02 -1.70 1.09 -0.62 0.41 0.00 0.00 173.24 172.44 1gtf s ASP 8 N -4.03 3.10 0.13 2.44 -1.08 -1.26 -4.80 116.67 111.17 1gtf s ASP 8 Ca 0.60 1.64 -0.02 0.00 -0.52 0.00 0.00 52.55 54.24 1gtf s ASP 8 Cb -0.13 -2.29 -0.04 0.00 -1.46 0.00 0.00 42.92 39.00 1gtf s ASP 8 CO 0.54 -2.90 0.08 0.72 0.52 0.00 0.00 175.17 174.13 1gtf s PHE 9 N -2.81 0.79 0.13 -5.34 -0.12 -1.26 -1.81 117.98 107.57 1gtf s PHE 9 Ca 0.64 -1.17 0.10 0.00 -0.05 0.00 0.00 56.93 56.45 1gtf s PHE 9 Cb -0.20 -0.43 -0.04 0.00 -0.63 0.00 0.00 43.02 41.73 1gtf s PHE 9 CO 0.58 -0.54 -0.24 0.14 -0.05 0.00 0.00 175.22 175.11 1gtf s VAL 10 N -4.03 2.09 -0.14 -2.49 -7.23 0.47 -4.65 120.40 104.42 1gtf s VAL 10 Ca 0.23 -1.75 -0.02 0.00 -1.81 0.00 0.00 61.98 58.63 1gtf s VAL 10 Cb 0.07 -1.89 -0.02 0.00 0.56 0.00 0.00 36.38 35.10 1gtf s VAL 10 CO 0.01 -0.01 -0.08 -0.69 -0.31 0.00 0.00 175.10 174.02 1gtf s VAL 11 N -1.24 3.44 -0.09 1.32 1.01 -0.22 -1.09 120.40 123.53 1gtf s VAL 11 Ca 0.13 -0.52 -0.00 0.00 0.00 0.00 0.00 61.98 61.59 1gtf s VAL 11 Cb -0.09 -2.48 0.02 0.00 0.00 0.00 0.00 36.38 33.83 1gtf s VAL 11 CO 0.06 0.51 -0.05 -0.63 0.00 0.00 0.00 175.10 174.99 1gtf s ILE 12 N 0.40 0.78 -0.21 2.22 1.01 0.08 -1.02 121.20 124.46 1gtf s ILE 12 Ca -0.07 -0.15 -0.05 0.00 0.00 0.00 0.00 60.65 60.38 1gtf s ILE 12 Cb -0.15 -0.84 -0.02 0.00 0.01 0.00 0.00 42.46 41.46 1gtf s ILE 12 CO 0.04 0.32 -0.02 -0.75 0.00 0.00 0.00 174.94 174.54 1gtf s LYS 13 N 1.68 3.50 0.07 2.79 2.20 0.28 -0.52 119.74 129.73 1gtf s LYS 13 Ca 0.03 -0.57 -0.31 0.00 -0.36 0.00 0.00 55.97 54.76 1gtf s LYS 13 Cb -0.13 -3.05 -0.06 0.00 -1.51 0.00 0.00 37.83 33.08 1gtf s LYS 13 CO -0.06 -0.09 1.26 0.00 -0.36 0.00 0.00 175.35 176.09 1gtf s ALA 14 N 1.25 3.46 -2.89 3.13 0.00 -0.48 -0.73 121.76 125.49 1gtf s ALA 14 Ca 0.03 0.91 0.24 0.00 0.00 0.00 0.00 51.96 53.14 1gtf s ALA 14 Cb -0.14 -3.48 0.29 0.00 0.00 0.00 0.00 23.12 19.78 1gtf s ALA 14 CO 0.00 -0.52 1.31 1.28 0.00 0.00 0.00 175.76 177.83 1gtf n LEU 15 N 4.07 2.77 -3.76 0.00 4.77 0.08 -0.40 117.00 124.53 1gtf n LEU 15 Ca 0.10 -0.92 -0.09 0.00 -0.03 0.00 0.00 56.01 55.06 1gtf n LEU 15 Cb 0.45 -0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.50 1gtf n LEU 15 CO 0.56 0.46 0.28 -1.83 -1.33 0.00 0.00 177.39 175.54 1gtf s GLU 16 N -2.02 1.41 0.53 3.23 -1.05 -1.22 -4.89 118.70 114.69 1gtf s GLU 16 Ca 0.29 -0.89 -0.19 0.00 -0.15 0.00 0.00 54.97 54.03 1gtf s GLU 16 Cb 0.20 0.52 -0.06 0.00 -0.44 0.00 0.00 34.13 34.35 1gtf s GLU 16 CO 0.32 -0.60 1.09 -0.51 0.95 0.00 0.00 175.26 176.51 1gtf s ASP 17 N -2.88 5.90 -0.01 0.83 1.01 -1.26 -3.23 116.67 117.03 1gtf s ASP 17 Ca 0.10 2.05 0.00 0.00 0.71 0.00 0.00 52.55 55.41 1gtf s ASP 17 Cb -0.01 -2.57 0.00 0.00 1.01 0.00 0.00 42.92 41.35 1gtf s ASP 17 CO -0.02 -1.09 0.00 0.61 0.21 0.00 0.00 175.17 174.88 1gtf n GLY 18 N -0.11 0.44 3.77 0.21 0.00 -0.83 -4.90 105.19 103.77 1gtf n GLY 18 Ca 0.11 -0.54 -0.41 0.00 0.00 0.00 0.00 46.02 45.17 1gtf n GLY 18 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1gtf s VAL 19 N -2.00 2.14 -0.17 1.61 1.01 -0.91 -4.77 120.40 117.31 1gtf s VAL 19 Ca 0.00 0.14 -0.01 0.00 0.00 0.00 0.00 61.98 62.11 1gtf s VAL 19 Cb 0.00 -3.09 -0.00 0.00 0.00 0.00 0.00 36.38 33.29 1gtf s VAL 19 CO 0.00 0.03 -0.12 0.20 0.00 0.00 0.00 175.10 175.21 1gtf s ASN 20 N 0.02 3.89 -0.33 3.32 0.01 -0.30 -0.40 114.94 121.15 1gtf s ASN 20 Ca 0.56 -0.43 -0.08 0.00 -0.71 0.00 0.00 52.86 52.19 1gtf s ASN 20 Cb -0.46 -1.62 0.02 0.00 0.41 0.00 0.00 41.25 39.60 1gtf s ASN 20 CO 0.57 0.06 0.12 -0.69 -1.51 0.00 0.00 177.10 175.65 1gtf s VAL 21 N 1.00 4.13 -0.19 1.60 1.01 -0.29 -1.40 120.40 126.26 1gtf s VAL 21 Ca -0.01 -0.82 -0.04 0.00 0.00 0.00 0.00 61.98 61.12 1gtf s VAL 21 Cb -0.15 -3.22 -0.02 0.00 0.00 0.00 0.00 36.38 32.99 1gtf s VAL 21 CO -0.02 -0.06 -0.04 -0.63 0.00 0.00 0.00 175.10 174.35 1gtf s ILE 22 N 1.50 3.58 -0.14 2.22 1.01 0.40 -0.69 121.20 129.07 1gtf s ILE 22 Ca 0.02 -0.44 -0.18 0.00 0.00 0.00 0.00 60.65 60.04 1gtf s ILE 22 Cb -0.18 -2.60 -0.04 0.00 0.01 0.00 0.00 42.46 39.65 1gtf s ILE 22 CO 0.04 0.45 0.49 -0.83 0.00 0.00 0.00 174.94 175.10 1gtf s GLY 23 N 0.96 2.29 -0.01 6.18 0.00 -0.16 -0.50 107.32 116.08 1gtf s GLY 23 Ca 0.00 -0.25 -0.06 0.00 0.00 0.00 0.00 44.72 44.41 1gtf s GLY 23 CO 0.01 0.88 0.23 1.08 0.00 0.00 0.00 173.10 175.30 1gtf s LEU 24 N 0.96 4.37 0.26 0.66 1.02 0.38 -1.71 118.68 124.64 1gtf s LEU 24 Ca 0.26 0.49 -0.30 0.00 0.02 0.00 0.00 54.13 54.60 1gtf s LEU 24 Cb -0.15 -2.58 -0.10 0.00 0.02 0.00 0.00 46.19 43.38 1gtf s LEU 24 CO 0.10 0.28 1.48 0.42 0.02 0.00 0.00 176.35 178.64 1gtf s THR 25 N -1.27 2.50 0.36 5.49 -4.23 -0.12 -2.50 115.64 115.87 1gtf s THR 25 Ca 0.26 0.42 -0.27 0.00 -1.18 0.00 0.00 61.69 60.92 1gtf s THR 25 Cb -0.13 -3.27 -0.09 0.00 1.34 0.00 0.00 72.50 70.35 1gtf s THR 25 CO 0.15 0.07 1.21 -0.60 -0.54 0.00 0.00 174.62 174.91 1gtf s ARG 26 N -0.48 4.23 0.00 3.99 3.52 -0.79 -4.59 118.95 124.84 1gtf s ARG 26 Ca 0.60 1.96 0.00 0.00 -0.13 0.00 0.00 55.73 58.16 1gtf s ARG 26 Cb -0.43 -2.88 0.00 0.00 -1.56 0.00 0.00 34.95 30.08 1gtf s ARG 26 CO 0.45 -0.20 0.00 0.41 -0.81 0.00 0.00 175.30 175.15 1gtf n GLY 27 N 0.78 0.42 0.19 8.12 0.00 -1.26 -4.71 105.19 108.73 1gtf n GLY 27 Ca 0.02 -2.26 0.06 0.00 0.00 0.00 0.00 46.02 43.84 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 0.98 -2.80 4.61 0.00 -2.05 -3.42 119.26 116.58 1gtf h ALA 28 Ca 0.00 -0.33 -0.62 0.00 0.00 0.00 0.00 54.91 53.96 1gtf h ALA 28 Cb 0.00 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 17.69 1gtf h ALA 28 CO 0.00 0.46 -0.44 0.34 0.00 0.00 0.00 179.25 179.61 1gtf s ASP 29 N -6.42 6.41 -0.50 0.00 2.15 -1.26 -5.07 116.67 111.99 1gtf s ASP 29 Ca 0.00 0.41 0.03 0.00 0.43 0.00 0.00 52.55 53.43 1gtf s ASP 29 Cb 0.11 -2.02 0.14 0.00 -0.30 0.00 0.00 42.92 40.84 1gtf s ASP 29 CO 0.68 0.20 0.27 -0.89 -0.17 0.00 0.00 175.17 175.27 1gtf s THR 30 N -1.42 2.10 0.45 1.71 2.01 -1.26 -4.60 115.64 114.62 1gtf s THR 30 Ca 0.32 -3.09 0.03 0.00 0.31 0.00 0.00 61.69 59.25 1gtf s THR 30 Cb -0.13 -2.46 -0.03 0.00 0.01 0.00 0.00 72.50 69.90 1gtf s THR 30 CO 0.22 -0.86 0.06 0.00 -0.69 0.00 0.00 174.62 173.34 1gtf s ARG 31 N -0.13 2.03 0.02 4.92 1.70 -1.26 -4.90 118.95 121.32 1gtf s ARG 31 Ca 0.18 -2.25 -0.27 0.00 -0.47 0.00 0.00 55.73 52.92 1gtf s ARG 31 Cb -0.23 -1.14 -0.04 0.00 -0.57 0.00 0.00 34.95 32.97 1gtf s ARG 31 CO -0.02 -0.36 0.87 -0.06 -1.08 0.00 0.00 175.30 174.65 1gtf s PHE 32 N -3.02 3.69 -0.02 5.89 0.08 -1.26 -0.94 117.98 122.40 1gtf s PHE 32 Ca 0.18 1.57 0.12 0.00 0.12 0.00 0.00 56.93 58.92 1gtf s PHE 32 Cb 0.03 -2.97 -0.18 0.00 -0.57 0.00 0.00 43.02 39.33 1gtf s PHE 32 CO 0.10 0.12 0.26 -2.39 -0.10 0.00 0.00 175.22 173.21 1gtf n HIS 33 N 3.38 0.00 -3.65 0.36 1.44 -0.69 -4.87 115.22 111.19 1gtf n HIS 33 Ca 0.02 0.00 -0.14 0.00 -2.01 0.00 0.00 57.72 55.59 1gtf n HIS 33 Cb 0.50 -0.27 -0.07 0.00 0.12 0.00 0.00 29.99 30.27 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 -2.82 -0.75 -0.17 -1.40 5.65 -1.23 -5.02 115.29 109.55 1gtf s HIS 34 Ca -0.04 1.82 -0.01 0.00 0.25 0.00 0.00 55.06 57.08 1gtf s HIS 34 Cb 0.08 0.27 -0.00 0.00 -1.18 0.00 0.00 32.58 31.74 1gtf s HIS 34 CO 0.49 -0.36 -0.13 -1.12 -0.65 0.00 0.00 174.74 172.97 1gtf s SER 35 N 0.40 3.80 -0.21 9.88 0.01 -1.26 -0.99 113.70 125.33 1gtf s SER 35 Ca -0.00 -0.44 -0.20 0.00 1.31 0.00 0.00 55.95 56.61 1gtf s SER 35 Cb -0.05 -1.60 -0.03 0.00 0.21 0.00 0.00 66.02 64.56 1gtf s SER 35 CO 0.00 0.07 0.59 -0.70 0.41 0.00 0.00 173.24 173.62 1gtf s GLU 36 N 0.90 4.18 -0.21 12.44 2.56 0.13 -4.92 118.70 133.78 1gtf s GLU 36 Ca -0.03 0.53 -0.18 0.00 0.00 0.00 0.00 54.97 55.29 1gtf s GLU 36 Cb -0.15 -3.59 -0.03 0.00 2.00 0.00 0.00 34.13 32.35 1gtf s GLU 36 CO -0.01 -0.26 0.49 0.15 -0.56 0.00 0.00 175.26 175.07 1gtf s LYS 37 N 2.00 4.16 -0.08 4.30 1.02 -1.26 -1.14 119.74 128.75 1gtf s LYS 37 Ca 0.27 0.36 0.02 0.00 0.02 0.00 0.00 55.97 56.63 1gtf s LYS 37 Cb -0.16 -3.57 -0.03 0.00 -0.52 0.00 0.00 37.83 33.55 1gtf s LYS 37 CO 0.10 -0.17 -0.11 -0.51 -0.92 0.00 0.00 175.35 173.74 1gtf s LEU 38 N 1.70 2.90 0.53 3.17 1.43 0.46 -4.97 118.68 123.89 1gtf s LEU 38 Ca 0.23 -0.16 -0.06 0.00 -1.03 0.00 0.00 54.13 53.10 1gtf s LEU 38 Cb -0.15 -1.62 -0.03 0.00 0.03 0.00 0.00 46.19 44.42 1gtf s LEU 38 CO 0.09 0.31 0.84 -1.81 0.23 0.00 0.00 176.35 176.01 1gtf s ASP 39 N -0.49 6.08 0.02 2.29 1.01 -1.26 -1.97 116.67 122.35 1gtf s ASP 39 Ca 0.07 0.93 -0.34 0.00 0.71 0.00 0.00 52.55 53.92 1gtf s ASP 39 Cb -0.12 -2.13 -0.12 0.00 1.01 0.00 0.00 42.92 41.55 1gtf s ASP 39 CO 0.02 -0.74 1.76 1.17 0.21 0.00 0.00 175.17 177.59 1gtf n LYS 40 N -2.40 2.21 0.00 8.23 4.81 -1.20 -1.75 118.16 128.05 1gtf n LYS 40 Ca 0.02 0.81 0.00 0.00 -0.87 0.00 0.00 58.31 58.27 1gtf n LYS 40 Cb 0.56 -2.63 0.00 0.00 0.02 0.00 0.00 35.03 32.98 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 4.01 2.46 3.76 3.14 0.00 0.46 -4.97 105.19 114.06 1gtf n GLY 41 Ca 0.20 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.85 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 -0.73 3.44 -0.04 1.61 2.02 -0.72 -4.75 118.70 119.53 1gtf s GLU 42 Ca 0.00 1.91 0.07 0.00 0.02 0.00 0.00 54.97 56.97 1gtf s GLU 42 Cb 0.00 -2.27 -0.02 0.00 0.10 0.00 0.00 34.13 31.94 1gtf s GLU 42 CO 0.00 -0.85 -0.25 0.08 0.02 0.00 0.00 175.26 174.26 1gtf s VAL 43 N -1.49 2.14 -0.11 2.63 1.01 -1.26 -1.38 120.40 121.94 1gtf s VAL 43 Ca 0.68 -1.06 0.02 0.00 0.00 0.00 0.00 61.98 61.63 1gtf s VAL 43 Cb -0.32 -1.76 0.01 0.00 0.00 0.00 0.00 36.38 34.31 1gtf s VAL 43 CO 0.38 0.58 -0.16 -0.22 0.00 0.00 0.00 175.10 175.67 1gtf s LEU 44 N -0.40 1.78 -0.28 3.92 2.96 0.32 -4.98 118.68 122.00 1gtf s LEU 44 Ca 0.04 -0.44 -0.04 0.00 -0.22 0.00 0.00 54.13 53.47 1gtf s LEU 44 Cb -0.12 -1.12 0.03 0.00 0.50 0.00 0.00 46.19 45.48 1gtf s LEU 44 CO 0.01 0.04 0.01 -0.63 -1.32 0.00 0.00 176.35 174.46 1gtf s ILE 45 N 0.87 3.29 -0.07 6.68 1.01 -1.26 -0.74 121.20 130.98 1gtf s ILE 45 Ca -0.09 -1.04 0.02 0.00 0.00 0.00 0.00 60.65 59.55 1gtf s ILE 45 Cb -0.15 -2.75 0.01 0.00 0.01 0.00 0.00 42.46 39.58 1gtf s ILE 45 CO 0.00 0.05 -0.14 0.00 0.00 0.00 0.00 174.94 174.85 1gtf s ALA 46 N 1.36 1.36 0.49 9.38 0.00 -0.25 -4.94 121.76 129.16 1gtf s ALA 46 Ca -0.01 -0.47 -0.10 0.00 0.00 0.00 0.00 51.96 51.38 1gtf s ALA 46 Cb -0.18 -0.59 -0.05 0.00 0.00 0.00 0.00 23.12 22.30 1gtf s ALA 46 CO -0.01 0.13 0.86 -0.65 0.00 0.00 0.00 175.76 176.10 1gtf s GLN 47 N 0.63 3.68 0.34 0.00 -0.21 -1.26 -0.40 119.66 122.44 1gtf s GLN 47 Ca -0.15 0.51 -0.27 0.00 0.02 0.00 0.00 55.36 55.46 1gtf s GLN 47 Cb -0.16 -2.28 -0.09 0.00 1.00 0.00 0.00 33.01 31.47 1gtf s GLN 47 CO 0.04 -0.24 1.12 -0.06 -2.12 0.00 0.00 175.29 174.03 1gtf s PHE 48 N -2.71 3.36 0.32 0.91 0.08 -0.75 -4.95 117.98 114.24 1gtf s PHE 48 Ca 0.52 1.64 0.04 0.00 0.12 0.00 0.00 56.93 59.25 1gtf s PHE 48 Cb -0.10 -3.30 -0.02 0.00 -0.57 0.00 0.00 43.02 39.03 1gtf s PHE 48 CO 0.41 -0.83 0.33 0.25 -0.10 0.00 0.00 175.22 175.28 1gtf n THR 49 N 0.65 0.00 -0.32 0.64 -2.24 -0.53 -4.71 114.28 107.76 1gtf n THR 49 Ca 0.01 -2.09 0.13 0.00 -2.27 0.00 0.00 64.05 59.83 1gtf n THR 49 Cb 0.46 1.11 0.35 0.00 -2.10 0.00 0.00 70.33 70.14 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 0.72 0.00 -0.78 4.81 -2.03 -2.87 114.58 114.43 1gtf h GLU 50 Ca -0.23 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 58.96 1gtf h GLU 50 Cb 1.12 -0.16 0.00 0.00 0.63 0.00 0.00 28.75 30.34 1gtf h GLU 50 CO 0.33 0.48 -1.06 0.72 -0.73 0.00 0.00 179.01 178.74 1gtf n HIS 51 N -4.65 0.39 -3.94 0.92 8.25 -1.26 -4.62 115.22 110.31 1gtf n HIS 51 Ca 0.21 0.11 -0.29 0.00 -0.26 0.00 0.00 57.72 57.48 1gtf n HIS 51 Cb 0.53 -0.55 -0.16 0.00 1.12 0.00 0.00 29.99 30.93 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 -3.25 1.38 -0.64 1.59 2.01 -1.09 -1.88 115.64 113.77 1gtf s THR 52 Ca 0.02 -0.88 0.05 0.00 0.31 0.00 0.00 61.69 61.19 1gtf s THR 52 Cb 0.13 -1.54 0.05 0.00 0.01 0.00 0.00 72.50 71.15 1gtf s THR 52 CO 0.80 0.10 0.69 -1.54 -0.69 0.00 0.00 174.62 173.98 1gtf n SER 53 N 4.77 1.49 -3.63 3.53 3.41 -1.04 -1.45 113.62 120.69 1gtf n SER 53 Ca -0.13 -1.26 -0.15 0.00 -0.26 0.00 0.00 58.87 57.07 1gtf n SER 53 Cb 0.47 -0.01 -0.07 0.00 -0.26 0.00 0.00 64.21 64.33 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 -0.47 -1.44 -0.06 7.33 0.00 -1.24 -5.01 121.76 120.87 1gtf s ALA 54 Ca 0.06 1.25 0.02 0.00 0.00 0.00 0.00 51.96 53.30 1gtf s ALA 54 Cb 0.04 -0.37 0.01 0.00 0.00 0.00 0.00 23.12 22.80 1gtf s ALA 54 CO 0.07 -0.31 -0.12 0.42 0.00 0.00 0.00 175.76 175.81 1gtf s ILE 55 N -0.61 1.13 -0.09 0.00 1.01 -1.26 -0.47 121.20 120.91 1gtf s ILE 55 Ca -0.07 -0.48 0.01 0.00 0.00 0.00 0.00 60.65 60.11 1gtf s ILE 55 Cb -0.03 -1.03 -0.02 0.00 0.01 0.00 0.00 42.46 41.39 1gtf s ILE 55 CO 0.05 0.35 -0.11 -0.75 0.00 0.00 0.00 174.94 174.48 1gtf s LYS 56 N 0.63 2.92 -0.19 2.79 2.20 0.35 -4.96 119.74 123.48 1gtf s LYS 56 Ca -0.14 -0.64 -0.01 0.00 -0.36 0.00 0.00 55.97 54.82 1gtf s LYS 56 Cb -0.15 -2.55 0.01 0.00 -1.51 0.00 0.00 37.83 33.62 1gtf s LYS 56 CO 0.04 0.48 -0.14 0.08 -0.36 0.00 0.00 175.35 175.45 1gtf s VAL 57 N -0.35 2.56 -0.10 4.02 1.01 -1.26 -0.46 120.40 125.83 1gtf s VAL 57 Ca 0.04 -0.78 0.02 0.00 0.00 0.00 0.00 61.98 61.26 1gtf s VAL 57 Cb -0.12 -2.11 -0.02 0.00 0.00 0.00 0.00 36.38 34.13 1gtf s VAL 57 CO 0.02 0.50 -0.14 -0.13 0.00 0.00 0.00 175.10 175.35 1gtf s ARG 58 N 1.27 3.02 0.00 2.72 0.52 -0.49 -4.94 118.95 121.04 1gtf s ARG 58 Ca 0.03 -0.70 0.00 0.00 -0.52 0.00 0.00 55.73 54.54 1gtf s ARG 58 Cb -0.14 -2.51 0.00 0.00 0.52 0.00 0.00 34.95 32.82 1gtf s ARG 58 CO -0.08 0.37 0.00 0.41 0.02 0.00 0.00 175.30 176.02 1gtf n GLY 59 N 3.05 1.74 3.65 -3.53 0.00 -1.26 -1.15 105.19 107.69 1gtf n GLY 59 Ca -0.18 -1.97 -0.43 0.00 0.00 0.00 0.00 46.02 43.44 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 -2.37 4.09 0.05 1.61 2.20 -1.26 -3.85 119.74 120.21 1gtf s LYS 60 Ca 0.00 1.50 -0.17 0.00 -0.36 0.00 0.00 55.97 56.94 1gtf s LYS 60 Cb 0.00 -3.82 0.03 0.00 -1.51 0.00 0.00 37.83 32.53 1gtf s LYS 60 CO 0.00 -0.89 0.39 0.00 -0.36 0.00 0.00 175.35 174.49 1gtf s ALA 61 N 3.90 -0.94 -0.18 3.13 0.00 -1.02 -0.74 121.76 125.91 1gtf s ALA 61 Ca 0.56 0.24 -0.08 0.00 0.00 0.00 0.00 51.96 52.68 1gtf s ALA 61 Cb -0.20 0.35 -0.04 0.00 0.00 0.00 0.00 23.12 23.23 1gtf s ALA 61 CO 0.18 -0.45 0.08 -0.47 0.00 0.00 0.00 175.76 175.10 1gtf s TYR 62 N -2.53 3.32 -0.07 0.00 5.04 0.09 -1.23 117.35 121.96 1gtf s TYR 62 Ca -0.05 0.19 0.02 0.00 -2.44 0.00 0.00 57.07 54.78 1gtf s TYR 62 Cb -0.01 -2.07 0.02 0.00 0.35 0.00 0.00 41.96 40.25 1gtf s TYR 62 CO -0.03 0.26 -0.11 0.42 -1.34 0.00 0.00 175.55 174.75 1gtf s ILE 63 N 0.16 1.09 -0.12 3.14 1.01 0.09 -0.56 121.20 126.01 1gtf s ILE 63 Ca 0.06 -0.43 0.01 0.00 0.00 0.00 0.00 60.65 60.29 1gtf s ILE 63 Cb -0.12 -1.01 -0.01 0.00 0.01 0.00 0.00 42.46 41.33 1gtf s ILE 63 CO 0.00 0.35 -0.17 -1.10 0.00 0.00 0.00 174.94 174.02 1gtf s GLN 64 N 0.81 3.25 0.35 2.79 -0.21 -0.19 -1.10 119.66 125.36 1gtf s GLN 64 Ca -0.12 -0.76 0.05 0.00 0.02 0.00 0.00 55.36 54.56 1gtf s GLN 64 Cb -0.15 -2.52 -0.02 0.00 1.00 0.00 0.00 33.01 31.32 1gtf s GLN 64 CO 0.02 0.18 0.19 0.25 -2.12 0.00 0.00 175.29 173.81 1gtf n THR 65 N 3.59 0.00 0.23 -0.19 -2.24 -0.50 -1.05 114.28 114.11 1gtf n THR 65 Ca -0.19 -2.25 0.15 0.00 -2.27 0.00 0.00 64.05 59.50 1gtf n THR 65 Cb 0.53 0.95 0.82 0.00 -2.10 0.00 0.00 70.33 70.53 1gtf n THR 65 CO 0.00 0.00 0.00 -0.09 -0.57 0.00 0.00 175.07 174.41 1gtf h ARG 66 N 0.00 0.00 -0.29 -0.78 2.43 -2.01 -2.35 114.38 111.38 1gtf h ARG 66 Ca -0.26 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.91 1gtf h ARG 66 Cb 1.13 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.68 1gtf h ARG 66 CO 0.40 0.00 0.00 0.72 -1.51 0.00 0.00 179.97 179.58 1gtf n HIS 67 N -3.98 0.37 0.00 2.20 8.25 -1.26 -5.05 115.22 115.75 1gtf n HIS 67 Ca -0.00 -0.18 0.00 0.00 -0.26 0.00 0.00 57.72 57.28 1gtf n HIS 67 Cb 0.22 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.33 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 1.37 0.73 3.50 -1.41 0.00 -0.89 -5.09 105.19 103.41 1gtf n GLY 68 Ca 0.18 -2.10 -0.26 0.00 0.00 0.00 0.00 46.02 43.85 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 -1.37 2.72 0.03 1.61 -7.23 -1.26 -1.41 120.40 113.48 1gtf s VAL 69 Ca 0.00 -2.01 -0.27 0.00 -1.81 0.00 0.00 61.98 57.89 1gtf s VAL 69 Cb 0.00 -2.36 0.07 0.00 0.56 0.00 0.00 36.38 34.65 1gtf s VAL 69 CO 0.00 -0.21 0.63 -0.51 -0.31 0.00 0.00 175.10 174.70 1gtf s ILE 70 N -1.94 0.01 -0.11 -0.62 2.07 -0.26 -5.02 121.20 115.33 1gtf s ILE 70 Ca 0.25 -0.05 0.01 0.00 -1.41 0.00 0.00 60.65 59.45 1gtf s ILE 70 Cb -0.07 -0.99 -0.02 0.00 0.13 0.00 0.00 42.46 41.51 1gtf s ILE 70 CO 0.13 -0.03 -0.15 -1.61 -1.91 0.00 0.00 174.94 171.38 1gtf s GLU 71 N -2.12 3.15 0.47 3.50 2.02 -1.26 -0.73 118.70 123.73 1gtf s GLU 71 Ca -0.07 -0.71 -0.06 0.00 0.02 0.00 0.00 54.97 54.15 1gtf s GLU 71 Cb -0.00 -2.54 -0.04 0.00 0.10 0.00 0.00 34.13 31.65 1gtf s GLU 71 CO 0.01 0.30 0.78 -1.54 0.02 0.00 0.00 175.26 174.84 1gtf s SER 72 N 0.11 6.29 0.01 -0.19 1.04 -0.36 -4.94 113.70 115.66 1gtf s SER 72 Ca -0.07 0.95 0.02 0.00 0.48 0.00 0.00 55.95 57.34 1gtf s SER 72 Cb -0.15 -2.26 -0.01 0.00 0.10 0.00 0.00 66.02 63.70 1gtf s SER 72 CO 0.05 -0.56 -0.08 -1.61 0.98 0.00 0.00 173.24 172.02 1gtf s GLU 73 N -4.63 0.59 0.00 4.02 2.02 -1.25 -2.45 118.70 117.00 1gtf s GLU 73 Ca 0.48 -0.43 0.10 0.00 0.02 0.00 0.00 54.97 55.14 1gtf s GLU 73 Cb -0.10 -0.52 0.08 0.00 0.10 0.00 0.00 34.13 33.69 1gtf s GLU 73 CO 0.43 0.13 0.83 0.41 0.02 0.00 0.00 175.26 177.08