#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gtf s ASP 8 N 0.00 4.25 0.15 -3.46 1.01 -1.26 -4.81 116.67 112.55 1gtf s ASP 8 Ca 0.00 2.04 -0.01 0.00 0.71 0.00 0.00 52.55 55.29 1gtf s ASP 8 Cb 0.00 -2.55 -0.04 0.00 1.01 0.00 0.00 42.92 41.34 1gtf s ASP 8 CO 0.00 -2.21 0.06 0.72 0.21 0.00 0.00 175.17 173.95 1gtf s PHE 9 N -2.56 0.97 0.06 4.23 -0.71 -1.26 -1.71 117.98 117.00 1gtf s PHE 9 Ca 0.66 -1.22 0.07 0.00 -1.04 0.00 0.00 56.93 55.40 1gtf s PHE 9 Cb -0.21 -0.53 -0.03 0.00 -1.21 0.00 0.00 43.02 41.03 1gtf s PHE 9 CO 0.51 -0.49 -0.20 0.14 -1.34 0.00 0.00 175.22 173.84 1gtf s VAL 10 N -4.00 1.62 -0.13 -2.49 -7.23 -0.21 -4.64 120.40 103.33 1gtf s VAL 10 Ca 0.26 -1.30 -0.02 0.00 -1.81 0.00 0.00 61.98 59.12 1gtf s VAL 10 Cb 0.07 -1.44 -0.03 0.00 0.56 0.00 0.00 36.38 35.55 1gtf s VAL 10 CO 0.04 0.09 -0.05 -0.69 -0.31 0.00 0.00 175.10 174.17 1gtf s VAL 11 N -0.94 3.77 -0.13 1.32 1.01 -0.04 -1.37 120.40 124.02 1gtf s VAL 11 Ca 0.06 -0.42 0.00 0.00 0.00 0.00 0.00 61.98 61.63 1gtf s VAL 11 Cb -0.09 -2.61 0.02 0.00 0.00 0.00 0.00 36.38 33.70 1gtf s VAL 11 CO 0.03 0.53 -0.11 -0.63 0.00 0.00 0.00 175.10 174.91 1gtf s ILE 12 N -0.00 1.32 -0.20 2.22 1.09 0.05 -0.89 121.20 124.80 1gtf s ILE 12 Ca 0.00 -0.48 -0.04 0.00 -1.10 0.00 0.00 60.65 59.03 1gtf s ILE 12 Cb -0.13 -1.27 -0.02 0.00 -1.06 0.00 0.00 42.46 39.98 1gtf s ILE 12 CO 0.03 0.42 -0.04 -0.75 -0.10 0.00 0.00 174.94 174.50 1gtf s LYS 13 N 1.51 3.50 0.15 2.79 2.20 0.70 -1.14 119.74 129.45 1gtf s LYS 13 Ca 0.03 -0.58 -0.30 0.00 -0.36 0.00 0.00 55.97 54.76 1gtf s LYS 13 Cb -0.13 -2.98 -0.07 0.00 -1.51 0.00 0.00 37.83 33.13 1gtf s LYS 13 CO -0.08 -0.02 1.23 0.00 -0.36 0.00 0.00 175.35 176.11 1gtf s ALA 14 N 1.05 3.45 -1.77 3.13 0.00 -0.59 -0.76 121.76 126.26 1gtf s ALA 14 Ca 0.01 0.95 0.15 0.00 0.00 0.00 0.00 51.96 53.07 1gtf s ALA 14 Cb -0.15 -3.44 0.15 0.00 0.00 0.00 0.00 23.12 19.69 1gtf s ALA 14 CO 0.01 -0.42 1.01 1.28 0.00 0.00 0.00 175.76 177.64 1gtf n LEU 15 N 3.01 2.35 -3.96 0.00 4.77 0.60 -0.88 117.00 122.90 1gtf n LEU 15 Ca 0.06 -1.12 -0.09 0.00 -0.03 0.00 0.00 56.01 54.83 1gtf n LEU 15 Cb 0.45 -0.04 -0.05 0.00 -2.33 0.00 0.00 43.42 41.45 1gtf n LEU 15 CO 0.56 0.45 0.22 -1.83 -1.33 0.00 0.00 177.39 175.47 1gtf s GLU 16 N -1.20 1.56 0.59 3.23 -1.05 -1.21 -4.90 118.70 115.71 1gtf s GLU 16 Ca 0.19 -1.18 -0.15 0.00 -0.15 0.00 0.00 54.97 53.68 1gtf s GLU 16 Cb 0.13 0.49 -0.04 0.00 -0.44 0.00 0.00 34.13 34.27 1gtf s GLU 16 CO 0.19 -0.66 1.04 -0.51 0.95 0.00 0.00 175.26 176.27 1gtf s ASP 17 N -2.99 5.98 -0.62 0.83 1.01 -1.26 -3.26 116.67 116.35 1gtf s ASP 17 Ca 0.20 1.71 0.00 0.00 0.71 0.00 0.00 52.55 55.16 1gtf s ASP 17 Cb -0.01 -2.52 0.00 0.00 1.01 0.00 0.00 42.92 41.40 1gtf s ASP 17 CO 0.08 -1.03 0.00 0.61 0.21 0.00 0.00 175.17 175.03 1gtf n GLY 18 N -1.36 0.82 3.76 0.21 0.00 -0.98 -4.90 105.19 102.74 1gtf n GLY 18 Ca 0.08 -0.79 -0.41 0.00 0.00 0.00 0.00 46.02 44.90 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 -2.22 2.28 -0.17 1.61 1.01 -0.73 -4.79 120.40 117.39 1gtf s VAL 19 Ca 0.00 0.24 -0.02 0.00 0.00 0.00 0.00 61.98 62.20 1gtf s VAL 19 Cb 0.00 -3.16 -0.02 0.00 0.00 0.00 0.00 36.38 33.21 1gtf s VAL 19 CO 0.00 0.04 -0.08 0.20 0.00 0.00 0.00 175.10 175.27 1gtf s ASN 20 N 0.26 4.30 -0.33 3.32 0.02 -0.18 -0.38 114.94 121.95 1gtf s ASN 20 Ca 0.59 -0.30 -0.07 0.00 -1.02 0.00 0.00 52.86 52.06 1gtf s ASN 20 Cb -0.45 -1.70 0.03 0.00 0.02 0.00 0.00 41.25 39.15 1gtf s ASN 20 CO 0.50 0.11 0.11 -0.69 0.02 0.00 0.00 177.10 177.14 1gtf s VAL 21 N 0.72 3.92 -0.18 1.60 1.01 0.04 -1.53 120.40 125.99 1gtf s VAL 21 Ca -0.04 -0.96 -0.04 0.00 0.00 0.00 0.00 61.98 60.95 1gtf s VAL 21 Cb -0.15 -3.15 -0.02 0.00 0.00 0.00 0.00 36.38 33.06 1gtf s VAL 21 CO 0.02 -0.09 -0.04 -0.63 0.00 0.00 0.00 175.10 174.36 1gtf s ILE 22 N 1.45 3.69 -0.10 2.22 1.01 0.64 -0.97 121.20 129.14 1gtf s ILE 22 Ca 0.00 -0.41 -0.18 0.00 0.00 0.00 0.00 60.65 60.06 1gtf s ILE 22 Cb -0.19 -2.64 -0.04 0.00 0.01 0.00 0.00 42.46 39.60 1gtf s ILE 22 CO 0.03 0.46 0.47 -0.83 0.00 0.00 0.00 174.94 175.07 1gtf s GLY 23 N 0.85 2.41 -0.13 6.18 0.00 -0.30 -0.59 107.32 115.74 1gtf s GLY 23 Ca -0.01 -0.18 -0.06 0.00 0.00 0.00 0.00 44.72 44.47 1gtf s GLY 23 CO 0.02 0.71 0.09 1.08 0.00 0.00 0.00 173.10 174.99 1gtf s LEU 24 N 0.42 4.05 0.38 0.66 1.02 -0.16 -1.22 118.68 123.83 1gtf s LEU 24 Ca 0.26 0.28 -0.28 0.00 0.02 0.00 0.00 54.13 54.41 1gtf s LEU 24 Cb -0.15 -1.99 -0.11 0.00 0.02 0.00 0.00 46.19 43.96 1gtf s LEU 24 CO 0.11 0.33 1.47 0.42 0.02 0.00 0.00 176.35 178.69 1gtf s THR 25 N -0.53 2.10 0.28 5.49 -4.23 -0.06 -2.47 115.64 116.21 1gtf s THR 25 Ca 0.11 0.10 -0.29 0.00 -1.18 0.00 0.00 61.69 60.43 1gtf s THR 25 Cb -0.12 -3.06 -0.09 0.00 1.34 0.00 0.00 72.50 70.56 1gtf s THR 25 CO 0.02 0.02 1.04 -0.60 -0.54 0.00 0.00 174.62 174.56 1gtf s ARG 26 N -2.09 4.66 0.00 3.99 3.52 -1.10 -4.62 118.95 123.31 1gtf s ARG 26 Ca 0.53 1.65 0.00 0.00 -0.13 0.00 0.00 55.73 57.78 1gtf s ARG 26 Cb -0.46 -3.13 0.00 0.00 -1.56 0.00 0.00 34.95 29.80 1gtf s ARG 26 CO 0.62 0.27 0.00 0.41 -0.81 0.00 0.00 175.30 175.80 1gtf n GLY 27 N 1.16 0.63 0.20 8.12 0.00 -1.26 -4.73 105.19 109.30 1gtf n GLY 27 Ca -0.01 -2.12 0.07 0.00 0.00 0.00 0.00 46.02 43.97 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 -3.02 4.61 0.00 -2.05 -3.43 119.26 116.36 1gtf h ALA 28 Ca 0.00 -0.29 -0.64 0.00 0.00 0.00 0.00 54.91 53.99 1gtf h ALA 28 Cb 0.00 -0.05 -0.07 0.00 0.00 0.00 0.00 17.79 17.67 1gtf h ALA 28 CO 0.00 0.40 -0.55 -0.51 0.00 0.00 0.00 179.25 178.59 1gtf s ASP 29 N -6.34 5.96 -0.22 0.00 1.01 -1.26 -5.09 116.67 110.74 1gtf s ASP 29 Ca 0.01 0.17 0.00 0.00 0.71 0.00 0.00 52.55 53.44 1gtf s ASP 29 Cb 0.10 -1.75 0.06 0.00 1.01 0.00 0.00 42.92 42.34 1gtf s ASP 29 CO 0.67 0.21 -0.05 -0.89 0.21 0.00 0.00 175.17 175.32 1gtf s THR 30 N -1.37 1.41 0.22 -1.27 2.01 -1.26 -4.59 115.64 110.79 1gtf s THR 30 Ca 0.29 -1.06 -0.14 0.00 0.31 0.00 0.00 61.69 61.09 1gtf s THR 30 Cb -0.12 -1.66 0.00 0.00 0.01 0.00 0.00 72.50 70.73 1gtf s THR 30 CO 0.21 -0.04 0.47 0.00 -0.69 0.00 0.00 174.62 174.57 1gtf s ARG 31 N 1.46 1.46 -0.02 4.92 1.70 -1.26 -4.95 118.95 122.26 1gtf s ARG 31 Ca -0.04 -1.14 -0.29 0.00 -0.47 0.00 0.00 55.73 53.79 1gtf s ARG 31 Cb -0.18 0.47 -0.03 0.00 -0.57 0.00 0.00 34.95 34.65 1gtf s ARG 31 CO -0.07 -0.60 0.96 -0.06 -1.08 0.00 0.00 175.30 174.45 1gtf s PHE 32 N -3.97 3.63 -0.10 5.89 0.08 -1.26 -0.88 117.98 121.36 1gtf s PHE 32 Ca 0.18 1.64 0.14 0.00 0.12 0.00 0.00 56.93 59.02 1gtf s PHE 32 Cb -0.00 -3.10 -0.22 0.00 -0.57 0.00 0.00 43.02 39.13 1gtf s PHE 32 CO 0.05 -0.03 0.35 -2.39 -0.10 0.00 0.00 175.22 173.10 1gtf n HIS 33 N 4.04 0.00 -3.62 0.36 1.44 -0.36 -4.93 115.22 112.15 1gtf n HIS 33 Ca 0.06 0.00 -0.13 0.00 -2.01 0.00 0.00 57.72 55.63 1gtf n HIS 33 Cb 0.51 -0.29 -0.07 0.00 0.12 0.00 0.00 29.99 30.26 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 -2.92 -0.71 -0.24 -1.40 5.65 -1.24 -5.02 115.29 109.42 1gtf s HIS 34 Ca -0.04 1.68 0.01 0.00 0.25 0.00 0.00 55.06 56.96 1gtf s HIS 34 Cb 0.09 0.30 0.06 0.00 -1.18 0.00 0.00 32.58 31.86 1gtf s HIS 34 CO 0.60 -0.37 -0.05 0.45 -0.65 0.00 0.00 174.74 174.73 1gtf s SER 35 N 0.19 3.84 -0.20 9.88 0.15 -1.26 -1.16 113.70 125.14 1gtf s SER 35 Ca -0.00 -1.19 -0.20 0.00 0.70 0.00 0.00 55.95 55.25 1gtf s SER 35 Cb -0.04 -1.16 -0.03 0.00 -1.71 0.00 0.00 66.02 63.08 1gtf s SER 35 CO 0.00 -0.24 0.60 -0.70 1.20 0.00 0.00 173.24 174.10 1gtf s GLU 36 N 1.41 4.21 -0.13 5.44 2.56 -0.14 -4.88 118.70 127.17 1gtf s GLU 36 Ca -0.05 0.57 -0.19 0.00 0.00 0.00 0.00 54.97 55.30 1gtf s GLU 36 Cb -0.19 -3.57 -0.04 0.00 2.00 0.00 0.00 34.13 32.33 1gtf s GLU 36 CO -0.07 -0.22 0.53 0.21 -0.56 0.00 0.00 175.26 175.16 1gtf s LYS 37 N 1.84 4.32 -0.11 4.30 2.20 -1.26 -0.78 119.74 130.25 1gtf s LYS 37 Ca 0.28 0.52 0.01 0.00 -0.36 0.00 0.00 55.97 56.42 1gtf s LYS 37 Cb -0.16 -3.47 -0.02 0.00 -1.51 0.00 0.00 37.83 32.67 1gtf s LYS 37 CO 0.10 0.05 -0.14 -0.51 -0.36 0.00 0.00 175.35 174.49 1gtf s LEU 38 N 0.95 2.68 0.55 5.43 1.43 0.49 -4.96 118.68 125.25 1gtf s LEU 38 Ca 0.28 -0.31 0.01 0.00 -1.03 0.00 0.00 54.13 53.08 1gtf s LEU 38 Cb -0.16 -1.58 0.03 0.00 0.03 0.00 0.00 46.19 44.51 1gtf s LEU 38 CO 0.11 0.20 0.77 -1.81 0.23 0.00 0.00 176.35 175.86 1gtf s ASP 39 N 0.11 5.28 0.10 2.29 1.01 -1.26 -1.78 116.67 122.42 1gtf s ASP 39 Ca -0.07 -0.03 -0.34 0.00 0.71 0.00 0.00 52.55 52.83 1gtf s ASP 39 Cb -0.15 -0.85 -0.13 0.00 1.01 0.00 0.00 42.92 42.80 1gtf s ASP 39 CO 0.05 -1.14 1.69 1.17 0.21 0.00 0.00 175.17 177.15 1gtf n LYS 40 N -2.33 2.27 0.00 8.23 4.81 -1.20 -1.38 118.16 128.56 1gtf n LYS 40 Ca 0.08 0.82 0.00 0.00 -0.87 0.00 0.00 58.31 58.34 1gtf n LYS 40 Cb 0.60 -2.63 0.00 0.00 0.02 0.00 0.00 35.03 33.02 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 3.78 1.65 3.79 3.14 0.00 -0.06 -4.99 105.19 112.50 1gtf n GLY 41 Ca 0.18 0.00 -0.35 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 -0.74 4.10 -0.07 1.61 2.02 -0.48 -4.82 118.70 120.31 1gtf s GLU 42 Ca 0.00 1.41 0.05 0.00 0.02 0.00 0.00 54.97 56.45 1gtf s GLU 42 Cb 0.00 -2.39 -0.01 0.00 0.10 0.00 0.00 34.13 31.84 1gtf s GLU 42 CO 0.00 -0.18 -0.24 0.08 0.02 0.00 0.00 175.26 174.93 1gtf s VAL 43 N -1.81 2.03 -0.09 2.63 1.01 -1.26 -1.55 120.40 121.36 1gtf s VAL 43 Ca 0.61 -1.03 0.04 0.00 0.00 0.00 0.00 61.98 61.60 1gtf s VAL 43 Cb -0.19 -1.73 -0.00 0.00 0.00 0.00 0.00 36.38 34.46 1gtf s VAL 43 CO 0.23 0.56 -0.24 -0.22 0.00 0.00 0.00 175.10 175.44 1gtf s LEU 44 N 0.06 2.07 -0.21 3.92 2.96 -0.29 -4.99 118.68 122.20 1gtf s LEU 44 Ca -0.10 -0.54 -0.01 0.00 -0.22 0.00 0.00 54.13 53.26 1gtf s LEU 44 Cb -0.15 -1.38 0.02 0.00 0.50 0.00 0.00 46.19 45.17 1gtf s LEU 44 CO 0.06 0.16 -0.12 -0.63 -1.32 0.00 0.00 176.35 174.50 1gtf s ILE 45 N 0.29 2.55 -0.08 6.68 1.09 -1.26 -0.77 121.20 129.71 1gtf s ILE 45 Ca -0.17 -0.93 0.02 0.00 -1.10 0.00 0.00 60.65 58.47 1gtf s ILE 45 Cb -0.17 -2.19 0.01 0.00 -1.06 0.00 0.00 42.46 39.05 1gtf s ILE 45 CO 0.08 0.38 -0.13 0.00 -0.10 0.00 0.00 174.94 175.17 1gtf s ALA 46 N 1.32 1.38 0.53 9.38 0.00 -0.47 -4.95 121.76 128.95 1gtf s ALA 46 Ca 0.03 -0.50 -0.06 0.00 0.00 0.00 0.00 51.96 51.43 1gtf s ALA 46 Cb -0.15 -0.65 -0.02 0.00 0.00 0.00 0.00 23.12 22.30 1gtf s ALA 46 CO -0.08 0.04 0.85 -0.65 0.00 0.00 0.00 175.76 175.92 1gtf s GLN 47 N 0.80 3.33 0.36 0.00 -0.21 -1.26 -1.04 119.66 121.64 1gtf s GLN 47 Ca -0.12 0.18 -0.24 0.00 0.02 0.00 0.00 55.36 55.20 1gtf s GLN 47 Cb -0.15 -2.31 -0.10 0.00 1.00 0.00 0.00 33.01 31.44 1gtf s GLN 47 CO 0.02 -0.41 0.96 -0.06 -2.12 0.00 0.00 175.29 173.68 1gtf s PHE 48 N -2.87 3.54 0.29 0.91 0.08 -0.70 -4.95 117.98 114.28 1gtf s PHE 48 Ca 0.50 1.72 0.01 0.00 0.12 0.00 0.00 56.93 59.28 1gtf s PHE 48 Cb -0.10 -2.93 -0.00 0.00 -0.57 0.00 0.00 43.02 39.41 1gtf s PHE 48 CO 0.46 0.02 0.36 0.25 -0.10 0.00 0.00 175.22 176.21 1gtf n THR 49 N 0.17 0.00 0.16 0.64 -2.24 -0.47 -4.75 114.28 107.79 1gtf n THR 49 Ca 0.04 -1.63 0.13 0.00 -2.27 0.00 0.00 64.05 60.31 1gtf n THR 49 Cb 0.51 0.94 0.68 0.00 -2.10 0.00 0.00 70.33 70.36 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 0.00 0.00 -0.78 4.81 -2.03 -2.77 114.58 113.81 1gtf h GLU 50 Ca -0.22 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.01 1gtf h GLU 50 Cb 0.99 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.37 1gtf h GLU 50 CO 0.30 0.00 -0.95 0.72 -0.73 0.00 0.00 179.01 178.36 1gtf n HIS 51 N -4.41 0.00 -3.81 0.92 8.25 -1.26 -4.60 115.22 110.30 1gtf n HIS 51 Ca 0.02 0.00 -0.28 0.00 -0.26 0.00 0.00 57.72 57.20 1gtf n HIS 51 Cb 0.29 -0.00 -0.16 0.00 1.12 0.00 0.00 29.99 31.23 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 -2.89 0.82 -0.28 1.59 2.01 -1.04 -2.71 115.64 113.15 1gtf s THR 52 Ca 0.08 -0.61 0.02 0.00 0.31 0.00 0.00 61.69 61.49 1gtf s THR 52 Cb 0.15 -1.17 0.02 0.00 0.01 0.00 0.00 72.50 71.51 1gtf s THR 52 CO 0.82 -0.05 0.56 -1.54 -0.69 0.00 0.00 174.62 173.72 1gtf n SER 53 N 4.95 1.16 -3.61 3.53 3.41 -1.03 -1.37 113.62 120.67 1gtf n SER 53 Ca -0.10 -1.08 -0.16 0.00 -0.26 0.00 0.00 58.87 57.27 1gtf n SER 53 Cb 0.47 0.02 -0.07 0.00 -0.26 0.00 0.00 64.21 64.37 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 -0.21 -1.47 -0.04 7.33 0.00 -1.25 -5.03 121.76 121.09 1gtf s ALA 54 Ca 0.03 1.17 0.02 0.00 0.00 0.00 0.00 51.96 53.17 1gtf s ALA 54 Cb 0.02 -0.22 0.01 0.00 0.00 0.00 0.00 23.12 22.94 1gtf s ALA 54 CO 0.03 -0.32 -0.07 0.42 0.00 0.00 0.00 175.76 175.81 1gtf s ILE 55 N -0.87 0.71 -0.06 0.00 1.01 -1.26 -0.98 121.20 119.75 1gtf s ILE 55 Ca -0.09 -0.27 0.05 0.00 0.00 0.00 0.00 60.65 60.34 1gtf s ILE 55 Cb -0.02 -0.67 -0.02 0.00 0.01 0.00 0.00 42.46 41.76 1gtf s ILE 55 CO 0.06 0.25 -0.19 -0.75 0.00 0.00 0.00 174.94 174.31 1gtf s LYS 56 N 0.57 2.57 -0.13 2.79 2.20 0.24 -4.95 119.74 123.03 1gtf s LYS 56 Ca -0.09 -0.80 0.00 0.00 -0.36 0.00 0.00 55.97 54.73 1gtf s LYS 56 Cb -0.12 -2.29 -0.01 0.00 -1.51 0.00 0.00 37.83 33.90 1gtf s LYS 56 CO 0.01 0.48 -0.15 0.08 -0.36 0.00 0.00 175.35 175.41 1gtf s VAL 57 N -0.39 2.84 -0.09 4.02 1.01 -1.26 -0.26 120.40 126.27 1gtf s VAL 57 Ca 0.04 -0.73 0.03 0.00 0.00 0.00 0.00 61.98 61.32 1gtf s VAL 57 Cb -0.12 -2.19 0.01 0.00 0.00 0.00 0.00 36.38 34.08 1gtf s VAL 57 CO 0.02 0.52 -0.18 -0.60 0.00 0.00 0.00 175.10 174.87 1gtf s ARG 58 N 0.49 2.36 0.00 2.72 3.52 -0.58 -4.97 118.95 122.49 1gtf s ARG 58 Ca -0.10 -0.63 0.00 0.00 -0.13 0.00 0.00 55.73 54.86 1gtf s ARG 58 Cb -0.16 -1.87 0.00 0.00 -1.56 0.00 0.00 34.95 31.36 1gtf s ARG 58 CO 0.04 0.07 0.00 0.41 -0.81 0.00 0.00 175.30 175.01 1gtf n GLY 59 N 3.78 2.23 3.66 8.12 0.00 -1.26 -1.01 105.19 120.71 1gtf n GLY 59 Ca -0.21 -2.03 -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 -2.33 4.21 -0.00 1.61 2.20 -1.26 -3.95 119.74 120.23 1gtf s LYS 60 Ca 0.00 1.67 -0.17 0.00 -0.36 0.00 0.00 55.97 57.11 1gtf s LYS 60 Cb 0.00 -3.79 0.03 0.00 -1.51 0.00 0.00 37.83 32.57 1gtf s LYS 60 CO 0.00 -0.74 0.38 0.00 -0.36 0.00 0.00 175.35 174.63 1gtf s ALA 61 N 3.59 -0.94 -0.23 3.13 0.00 -0.93 -0.29 121.76 126.08 1gtf s ALA 61 Ca 0.56 0.42 -0.08 0.00 0.00 0.00 0.00 51.96 52.86 1gtf s ALA 61 Cb -0.22 0.14 -0.04 0.00 0.00 0.00 0.00 23.12 23.00 1gtf s ALA 61 CO 0.16 -0.32 0.08 -0.47 0.00 0.00 0.00 175.76 175.20 1gtf s TYR 62 N -1.63 3.15 -0.05 0.00 5.04 0.06 -1.87 117.35 122.04 1gtf s TYR 62 Ca -0.11 -0.19 0.06 0.00 -2.44 0.00 0.00 57.07 54.39 1gtf s TYR 62 Cb -0.03 -2.19 -0.02 0.00 0.35 0.00 0.00 41.96 40.07 1gtf s TYR 62 CO 0.03 -0.16 -0.22 0.42 -1.34 0.00 0.00 175.55 174.28 1gtf s ILE 63 N 1.19 2.32 -0.07 3.14 1.01 -0.19 -0.22 121.20 128.38 1gtf s ILE 63 Ca 0.05 -0.98 0.04 0.00 0.00 0.00 0.00 60.65 59.76 1gtf s ILE 63 Cb -0.14 -1.86 -0.00 0.00 0.01 0.00 0.00 42.46 40.47 1gtf s ILE 63 CO 0.04 0.57 -0.20 -1.10 0.00 0.00 0.00 174.94 174.25 1gtf s GLN 64 N -0.32 2.35 0.31 2.79 -0.21 -0.07 -1.11 119.66 123.41 1gtf s GLN 64 Ca 0.01 -0.72 0.03 0.00 0.02 0.00 0.00 55.36 54.71 1gtf s GLN 64 Cb -0.13 -1.90 -0.01 0.00 1.00 0.00 0.00 33.01 31.97 1gtf s GLN 64 CO 0.02 0.20 0.12 0.25 -2.12 0.00 0.00 175.29 173.77 1gtf n THR 65 N 3.37 0.00 0.30 -0.19 -2.24 -0.58 -0.86 114.28 114.08 1gtf n THR 65 Ca -0.19 -1.83 0.19 0.00 -2.27 0.00 0.00 64.05 59.94 1gtf n THR 65 Cb 0.53 0.67 0.93 0.00 -2.10 0.00 0.00 70.33 70.36 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 -0.01 -0.78 2.43 -2.01 -1.97 114.38 112.04 1gtf h ARG 66 Ca -0.24 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.93 1gtf h ARG 66 Cb 0.93 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.48 1gtf h ARG 66 CO 0.38 0.03 -0.06 0.72 -1.51 0.00 0.00 179.97 179.53 1gtf n HIS 67 N -3.23 0.00 0.00 2.20 8.25 -1.26 -5.05 115.22 116.13 1gtf n HIS 67 Ca -0.02 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.44 1gtf n HIS 67 Cb 0.19 -0.03 0.00 0.00 1.12 0.00 0.00 29.99 31.27 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 1.21 0.63 3.88 -1.41 0.00 -0.74 -5.06 105.19 103.70 1gtf n GLY 68 Ca 0.18 -2.17 -0.35 0.00 0.00 0.00 0.00 46.02 43.67 1gtf n GLY 68 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1gtf s VAL 69 N -0.86 5.35 0.04 1.61 1.01 -1.26 -1.53 120.40 124.75 1gtf s VAL 69 Ca 0.00 0.21 -0.08 0.00 0.00 0.00 0.00 61.98 62.10 1gtf s VAL 69 Cb 0.00 -3.53 0.00 0.00 0.00 0.00 0.00 36.38 32.85 1gtf s VAL 69 CO 0.00 0.45 0.17 -0.51 0.00 0.00 0.00 175.10 175.21 1gtf s ILE 70 N -1.20 0.11 -0.07 2.22 2.07 -0.27 -5.02 121.20 119.04 1gtf s ILE 70 Ca 0.24 -0.91 0.05 0.00 -1.41 0.00 0.00 60.65 58.61 1gtf s ILE 70 Cb -0.13 -0.86 -0.00 0.00 0.13 0.00 0.00 42.46 41.60 1gtf s ILE 70 CO 0.13 -0.50 -0.22 -1.61 -1.91 0.00 0.00 174.94 170.82 1gtf s GLU 71 N -2.45 2.50 0.27 3.50 2.02 -1.26 -1.02 118.70 122.26 1gtf s GLU 71 Ca -0.06 -0.79 -0.10 0.00 0.02 0.00 0.00 54.97 54.03 1gtf s GLU 71 Cb -0.02 -2.02 -0.07 0.00 0.10 0.00 0.00 34.13 32.12 1gtf s GLU 71 CO -0.03 0.25 0.61 -1.54 0.02 0.00 0.00 175.26 174.57 1gtf s SER 72 N 0.13 6.63 -0.00 -0.19 1.04 -0.78 -4.96 113.70 115.57 1gtf s SER 72 Ca -0.10 1.00 0.06 0.00 0.48 0.00 0.00 55.95 57.39 1gtf s SER 72 Cb -0.15 -2.26 -0.02 0.00 0.10 0.00 0.00 66.02 63.69 1gtf s SER 72 CO 0.05 -0.14 -0.18 -1.61 0.98 0.00 0.00 173.24 172.34 1gtf s GLU 73 N -3.02 1.42 0.83 4.02 2.02 -1.25 -2.19 118.70 120.53 1gtf s GLU 73 Ca 0.49 -0.69 -0.07 0.00 0.02 0.00 0.00 54.97 54.72 1gtf s GLU 73 Cb -0.11 -1.40 0.16 0.00 0.10 0.00 0.00 34.13 32.89 1gtf s GLU 73 CO 0.22 0.38 1.14 0.20 0.02 0.00 0.00 175.26 177.22 1gtf s GLY 74 N -0.57 1.77 0.00 -1.39 0.00 -1.26 -4.40 107.32 101.47 1gtf s GLY 74 Ca 0.07 -1.58 0.15 0.00 0.00 0.00 0.00 44.72 43.36 1gtf s GLY 74 CO -0.00 -0.90 1.31 0.28 0.00 0.00 0.00 173.10 173.78