#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 5.06 -4.78 3.42 5.15 -1.26 -5.03 115.26 117.83 1gtf n ASN 6 Ca 0.00 -3.74 -0.30 0.00 -0.60 0.00 0.00 54.58 49.94 1gtf n ASN 6 Cb 0.00 -0.76 0.11 0.00 -0.53 0.00 0.00 39.78 38.59 1gtf n ASN 6 CO 0.00 0.00 0.00 -0.44 1.40 0.00 0.00 177.26 178.22 1gtf s SER 7 N -2.15 4.15 0.97 1.20 0.01 -1.26 -5.02 113.70 111.59 1gtf s SER 7 Ca 0.56 1.35 -0.11 0.00 1.31 0.00 0.00 55.95 59.07 1gtf s SER 7 Cb 0.46 -2.07 0.18 0.00 0.21 0.00 0.00 66.02 64.80 1gtf s SER 7 CO 0.03 -2.19 1.11 -1.81 0.41 0.00 0.00 173.24 170.79 1gtf s ASP 8 N -3.76 2.52 0.15 2.44 1.01 -1.26 -4.77 116.67 113.01 1gtf s ASP 8 Ca 0.62 1.98 -0.04 0.00 0.71 0.00 0.00 52.55 55.82 1gtf s ASP 8 Cb -0.15 -2.49 -0.03 0.00 1.01 0.00 0.00 42.92 41.26 1gtf s ASP 8 CO 0.55 -3.32 0.15 0.72 0.21 0.00 0.00 175.17 173.48 1gtf s PHE 9 N -2.63 0.76 0.14 4.23 -0.12 -1.26 -1.64 117.98 117.45 1gtf s PHE 9 Ca 0.67 -1.10 0.10 0.00 -0.05 0.00 0.00 56.93 56.54 1gtf s PHE 9 Cb -0.23 -0.35 -0.04 0.00 -0.63 0.00 0.00 43.02 41.78 1gtf s PHE 9 CO 0.59 -0.61 -0.24 0.14 -0.05 0.00 0.00 175.22 175.05 1gtf s VAL 10 N -4.04 2.10 -0.15 -2.49 -7.23 0.40 -4.65 120.40 104.33 1gtf s VAL 10 Ca 0.24 -1.78 -0.03 0.00 -1.81 0.00 0.00 61.98 58.61 1gtf s VAL 10 Cb 0.06 -1.90 -0.02 0.00 0.56 0.00 0.00 36.38 35.08 1gtf s VAL 10 CO 0.03 -0.03 -0.07 -0.69 -0.31 0.00 0.00 175.10 174.03 1gtf s VAL 11 N -1.31 3.57 -0.11 1.32 1.01 -0.21 -1.12 120.40 123.55 1gtf s VAL 11 Ca 0.14 -0.47 0.01 0.00 0.00 0.00 0.00 61.98 61.65 1gtf s VAL 11 Cb -0.09 -2.55 0.02 0.00 0.00 0.00 0.00 36.38 33.76 1gtf s VAL 11 CO 0.06 0.49 -0.12 -0.63 0.00 0.00 0.00 175.10 174.91 1gtf s ILE 12 N 0.49 1.28 -0.22 2.22 1.01 0.59 -1.18 121.20 125.40 1gtf s ILE 12 Ca -0.05 -0.48 -0.04 0.00 0.00 0.00 0.00 60.65 60.08 1gtf s ILE 12 Cb -0.15 -1.22 -0.01 0.00 0.01 0.00 0.00 42.46 41.09 1gtf s ILE 12 CO 0.03 0.40 -0.04 -0.75 0.00 0.00 0.00 174.94 174.59 1gtf s LYS 13 N 1.33 3.40 0.20 2.79 2.20 0.20 -0.26 119.74 129.60 1gtf s LYS 13 Ca -0.01 -0.62 -0.30 0.00 -0.36 0.00 0.00 55.97 54.69 1gtf s LYS 13 Cb -0.14 -3.01 -0.09 0.00 -1.51 0.00 0.00 37.83 33.09 1gtf s LYS 13 CO -0.05 -0.17 1.30 0.00 -0.36 0.00 0.00 175.35 176.06 1gtf s ALA 14 N 1.42 3.52 -1.95 3.13 0.00 -0.61 -1.22 121.76 126.05 1gtf s ALA 14 Ca 0.05 1.10 0.18 0.00 0.00 0.00 0.00 51.96 53.29 1gtf s ALA 14 Cb -0.14 -3.47 0.29 0.00 0.00 0.00 0.00 23.12 19.80 1gtf s ALA 14 CO -0.03 -0.52 1.22 1.28 0.00 0.00 0.00 175.76 177.71 1gtf n LEU 15 N 2.52 2.93 -3.89 0.00 4.77 0.12 -0.78 117.00 122.67 1gtf n LEU 15 Ca 0.06 -1.42 -0.08 0.00 -0.03 0.00 0.00 56.01 54.53 1gtf n LEU 15 Cb 0.43 -0.16 -0.04 0.00 -2.33 0.00 0.00 43.42 41.32 1gtf n LEU 15 CO 0.58 0.62 0.30 -1.83 -1.33 0.00 0.00 177.39 175.73 1gtf s GLU 16 N -1.30 1.60 0.49 3.23 -1.05 -1.22 -4.88 118.70 115.57 1gtf s GLU 16 Ca 0.28 -1.07 -0.21 0.00 -0.15 0.00 0.00 54.97 53.82 1gtf s GLU 16 Cb 0.17 0.53 -0.07 0.00 -0.44 0.00 0.00 34.13 34.32 1gtf s GLU 16 CO 0.24 -0.69 1.11 -0.51 0.95 0.00 0.00 175.26 176.35 1gtf s ASP 17 N -2.95 6.13 0.00 0.83 1.01 -1.26 -3.01 116.67 117.42 1gtf s ASP 17 Ca 0.15 2.13 0.00 0.00 0.71 0.00 0.00 52.55 55.54 1gtf s ASP 17 Cb -0.03 -2.58 0.00 0.00 1.01 0.00 0.00 42.92 41.32 1gtf s ASP 17 CO 0.06 -0.94 0.00 0.61 0.21 0.00 0.00 175.17 175.11 1gtf n GLY 18 N 0.16 0.51 3.74 0.21 0.00 -0.54 -4.87 105.19 104.40 1gtf n GLY 18 Ca 0.09 -0.51 -0.42 0.00 0.00 0.00 0.00 46.02 45.18 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 -2.87 1.17 -3.81 1.61 0.31 -0.95 -4.78 118.33 109.02 1gtf n VAL 19 Ca 0.00 -0.29 -0.36 0.00 -0.01 0.00 0.00 64.34 63.67 1gtf n VAL 19 Cb 0.00 -1.91 -0.13 0.00 -0.91 0.00 0.00 33.84 30.89 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 0.38 4.92 -0.37 4.52 0.01 -0.26 -0.42 114.94 123.72 1gtf s ASN 20 Ca 0.63 -0.67 -0.11 0.00 -0.71 0.00 0.00 52.86 52.00 1gtf s ASN 20 Cb -0.51 -1.83 0.02 0.00 0.41 0.00 0.00 41.25 39.34 1gtf s ASN 20 CO 0.51 -0.15 0.21 -0.69 -1.51 0.00 0.00 177.10 175.46 1gtf s VAL 21 N 1.48 4.64 -0.19 1.60 1.01 -0.23 -0.93 120.40 127.77 1gtf s VAL 21 Ca 0.03 -0.77 -0.03 0.00 0.00 0.00 0.00 61.98 61.21 1gtf s VAL 21 Cb -0.17 -3.55 -0.01 0.00 0.00 0.00 0.00 36.38 32.65 1gtf s VAL 21 CO 0.01 -0.19 -0.06 -0.63 0.00 0.00 0.00 175.10 174.23 1gtf s ILE 22 N 1.57 3.43 -0.21 2.22 1.01 0.69 -0.88 121.20 129.04 1gtf s ILE 22 Ca 0.03 -0.49 -0.25 0.00 0.00 0.00 0.00 60.65 59.93 1gtf s ILE 22 Cb -0.19 -2.53 -0.01 0.00 0.01 0.00 0.00 42.46 39.75 1gtf s ILE 22 CO 0.07 0.45 0.84 -0.83 0.00 0.00 0.00 174.94 175.47 1gtf s GLY 23 N 1.04 1.93 -0.02 6.18 0.00 0.21 -0.82 107.32 115.83 1gtf s GLY 23 Ca 0.01 -0.04 -0.16 0.00 0.00 0.00 0.00 44.72 44.53 1gtf s GLY 23 CO -0.00 1.75 0.44 1.08 0.00 0.00 0.00 173.10 176.38 1gtf s LEU 24 N 2.51 4.44 0.31 0.66 1.02 0.07 -0.98 118.68 126.70 1gtf s LEU 24 Ca 0.37 0.97 -0.29 0.00 0.02 0.00 0.00 54.13 55.19 1gtf s LEU 24 Cb -0.16 -2.65 -0.11 0.00 0.02 0.00 0.00 46.19 43.30 1gtf s LEU 24 CO 0.10 0.25 1.44 0.42 0.02 0.00 0.00 176.35 178.57 1gtf s THR 25 N -0.69 2.44 0.44 5.49 -4.23 0.21 -2.56 115.64 116.74 1gtf s THR 25 Ca 0.25 0.40 -0.24 0.00 -1.18 0.00 0.00 61.69 60.92 1gtf s THR 25 Cb -0.17 -3.26 -0.08 0.00 1.34 0.00 0.00 72.50 70.34 1gtf s THR 25 CO 0.13 0.08 1.21 -0.60 -0.54 0.00 0.00 174.62 174.91 1gtf s ARG 26 N -1.18 3.82 0.00 3.99 3.52 -0.33 -4.58 118.95 124.18 1gtf s ARG 26 Ca 0.56 1.92 0.00 0.00 -0.13 0.00 0.00 55.73 58.07 1gtf s ARG 26 Cb -0.43 -2.54 0.00 0.00 -1.56 0.00 0.00 34.95 30.42 1gtf s ARG 26 CO 0.51 -0.54 0.00 0.41 -0.81 0.00 0.00 175.30 174.87 1gtf n GLY 27 N 0.57 0.62 0.21 8.12 0.00 -1.26 -4.71 105.19 108.75 1gtf n GLY 27 Ca 0.06 -2.20 0.08 0.00 0.00 0.00 0.00 46.02 43.95 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 1.16 -2.81 4.61 0.00 -2.05 -3.42 119.26 116.75 1gtf h ALA 28 Ca 0.00 -0.25 -0.66 0.00 0.00 0.00 0.00 54.91 54.00 1gtf h ALA 28 Cb 0.00 -0.04 -0.07 0.00 0.00 0.00 0.00 17.79 17.67 1gtf h ALA 28 CO 0.00 0.35 -0.51 0.34 0.00 0.00 0.00 179.25 179.43 1gtf s ASP 29 N -6.42 6.20 -0.45 0.00 2.15 -1.26 -5.08 116.67 111.79 1gtf s ASP 29 Ca -0.01 0.37 0.03 0.00 0.43 0.00 0.00 52.55 53.37 1gtf s ASP 29 Cb 0.12 -1.94 0.12 0.00 -0.30 0.00 0.00 42.92 40.92 1gtf s ASP 29 CO 0.66 0.35 0.21 -0.89 -0.17 0.00 0.00 175.17 175.32 1gtf s THR 30 N -1.13 2.14 0.40 1.71 2.01 -1.26 -4.58 115.64 114.94 1gtf s THR 30 Ca 0.19 -2.84 0.04 0.00 0.31 0.00 0.00 61.69 59.39 1gtf s THR 30 Cb -0.12 -2.51 -0.03 0.00 0.01 0.00 0.00 72.50 69.85 1gtf s THR 30 CO 0.09 -0.78 0.11 0.00 -0.69 0.00 0.00 174.62 173.35 1gtf s ARG 31 N 0.20 1.91 -0.08 4.92 1.70 -1.26 -4.90 118.95 121.44 1gtf s ARG 31 Ca 0.16 -2.16 -0.23 0.00 -0.47 0.00 0.00 55.73 53.03 1gtf s ARG 31 Cb -0.24 -0.73 -0.04 0.00 -0.57 0.00 0.00 34.95 33.38 1gtf s ARG 31 CO -0.03 -0.42 0.67 -0.06 -1.08 0.00 0.00 175.30 174.37 1gtf s PHE 32 N -3.20 3.56 -0.19 5.89 0.08 -1.26 -0.62 117.98 122.25 1gtf s PHE 32 Ca 0.24 1.19 0.15 0.00 0.12 0.00 0.00 56.93 58.64 1gtf s PHE 32 Cb 0.03 -2.77 -0.22 0.00 -0.57 0.00 0.00 43.02 39.50 1gtf s PHE 32 CO 0.14 0.10 0.42 -2.39 -0.10 0.00 0.00 175.22 173.38 1gtf n HIS 33 N 3.79 0.00 -3.63 0.36 1.44 -0.15 -4.86 115.22 112.16 1gtf n HIS 33 Ca -0.02 0.00 -0.13 0.00 -2.01 0.00 0.00 57.72 55.56 1gtf n HIS 33 Cb 0.51 -0.27 -0.07 0.00 0.12 0.00 0.00 29.99 30.29 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 -2.91 -0.75 -0.17 -1.40 5.65 -1.23 -5.02 115.29 109.46 1gtf s HIS 34 Ca -0.03 1.81 0.00 0.00 0.25 0.00 0.00 55.06 57.09 1gtf s HIS 34 Cb 0.10 0.29 0.03 0.00 -1.18 0.00 0.00 32.58 31.83 1gtf s HIS 34 CO 0.64 -0.36 -0.10 0.45 -0.65 0.00 0.00 174.74 174.72 1gtf s SER 35 N 0.39 2.92 -0.22 9.88 0.15 -1.26 -0.62 113.70 124.93 1gtf s SER 35 Ca 0.00 -0.65 -0.13 0.00 0.70 0.00 0.00 55.95 55.87 1gtf s SER 35 Cb -0.05 -1.11 -0.04 0.00 -1.71 0.00 0.00 66.02 63.11 1gtf s SER 35 CO -0.01 -0.12 0.27 -0.70 1.20 0.00 0.00 173.24 173.88 1gtf s GLU 36 N 1.51 4.12 -0.23 5.44 2.56 -0.06 -4.92 118.70 127.11 1gtf s GLU 36 Ca 0.02 -0.06 -0.17 0.00 0.00 0.00 0.00 54.97 54.76 1gtf s GLU 36 Cb -0.15 -3.54 -0.03 0.00 2.00 0.00 0.00 34.13 32.41 1gtf s GLU 36 CO -0.09 0.01 0.44 0.15 -0.56 0.00 0.00 175.26 175.22 1gtf s LYS 37 N 1.18 4.12 -0.08 4.30 3.01 -1.26 -1.07 119.74 129.93 1gtf s LYS 37 Ca 0.13 0.23 0.00 0.00 -1.01 0.00 0.00 55.97 55.32 1gtf s LYS 37 Cb -0.14 -3.60 -0.03 0.00 -1.01 0.00 0.00 37.83 33.06 1gtf s LYS 37 CO 0.06 -0.19 -0.07 -0.51 0.51 0.00 0.00 175.35 175.15 1gtf s LEU 38 N 1.78 3.13 0.38 3.17 1.43 0.44 -4.97 118.68 124.04 1gtf s LEU 38 Ca 0.19 -0.06 -0.08 0.00 -1.03 0.00 0.00 54.13 53.16 1gtf s LEU 38 Cb -0.15 -1.69 -0.06 0.00 0.03 0.00 0.00 46.19 44.32 1gtf s LEU 38 CO 0.09 0.33 0.71 -1.81 0.23 0.00 0.00 176.35 175.89 1gtf s ASP 39 N -0.60 6.47 -0.06 2.29 1.01 -1.26 -1.47 116.67 123.04 1gtf s ASP 39 Ca 0.09 0.98 -0.38 0.00 0.71 0.00 0.00 52.55 53.94 1gtf s ASP 39 Cb -0.12 -2.26 -0.16 0.00 1.01 0.00 0.00 42.92 41.39 1gtf s ASP 39 CO 0.02 -0.36 1.49 1.17 0.21 0.00 0.00 175.17 177.70 1gtf n LYS 40 N -1.32 1.10 0.00 8.23 4.81 -1.16 -1.47 118.16 128.35 1gtf n LYS 40 Ca 0.01 0.40 0.00 0.00 -0.87 0.00 0.00 58.31 57.85 1gtf n LYS 40 Cb 0.54 -2.05 0.00 0.00 0.02 0.00 0.00 35.03 33.54 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 3.14 3.12 3.76 3.14 0.00 0.04 -4.96 105.19 113.44 1gtf n GLY 41 Ca 0.22 0.00 -0.39 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 -0.27 3.67 -0.09 1.61 2.02 -0.54 -4.72 118.70 120.37 1gtf s GLU 42 Ca 0.00 2.20 0.03 0.00 0.02 0.00 0.00 54.97 57.21 1gtf s GLU 42 Cb 0.00 -2.57 -0.01 0.00 0.10 0.00 0.00 34.13 31.65 1gtf s GLU 42 CO 0.00 -0.75 -0.18 0.08 0.02 0.00 0.00 175.26 174.43 1gtf s VAL 43 N -1.29 2.67 -0.09 2.63 1.01 -1.26 -1.57 120.40 122.50 1gtf s VAL 43 Ca 0.62 -0.82 0.04 0.00 0.00 0.00 0.00 61.98 61.82 1gtf s VAL 43 Cb -0.39 -2.06 -0.00 0.00 0.00 0.00 0.00 36.38 33.93 1gtf s VAL 43 CO 0.49 0.55 -0.23 -0.22 0.00 0.00 0.00 175.10 175.69 1gtf s LEU 44 N 0.01 2.14 -0.24 3.92 2.96 0.64 -4.98 118.68 123.13 1gtf s LEU 44 Ca -0.06 -0.52 -0.00 0.00 -0.22 0.00 0.00 54.13 53.33 1gtf s LEU 44 Cb -0.15 -1.42 0.03 0.00 0.50 0.00 0.00 46.19 45.16 1gtf s LEU 44 CO 0.05 0.19 -0.10 -0.63 -1.32 0.00 0.00 176.35 174.54 1gtf s ILE 45 N 0.19 2.57 -0.04 6.68 1.01 -1.26 -0.30 121.20 130.05 1gtf s ILE 45 Ca -0.14 -1.16 0.03 0.00 0.00 0.00 0.00 60.65 59.38 1gtf s ILE 45 Cb -0.17 -2.32 0.01 0.00 0.01 0.00 0.00 42.46 39.99 1gtf s ILE 45 CO 0.07 0.20 -0.10 0.00 0.00 0.00 0.00 174.94 175.11 1gtf s ALA 46 N 1.26 1.01 0.39 9.38 0.00 -0.28 -4.94 121.76 128.58 1gtf s ALA 46 Ca -0.01 -0.37 -0.06 0.00 0.00 0.00 0.00 51.96 51.52 1gtf s ALA 46 Cb -0.17 -0.39 -0.05 0.00 0.00 0.00 0.00 23.12 22.51 1gtf s ALA 46 CO -0.06 0.15 0.68 -0.65 0.00 0.00 0.00 175.76 175.88 1gtf s GLN 47 N 0.30 3.62 0.35 0.00 -0.21 -1.26 -0.46 119.66 122.00 1gtf s GLN 47 Ca -0.06 0.14 -0.26 0.00 0.02 0.00 0.00 55.36 55.20 1gtf s GLN 47 Cb -0.11 -2.50 -0.09 0.00 1.00 0.00 0.00 33.01 31.32 1gtf s GLN 47 CO 0.01 0.01 1.08 -0.06 -2.12 0.00 0.00 175.29 174.20 1gtf s PHE 48 N -2.40 3.38 0.33 0.91 0.08 -0.65 -4.94 117.98 114.68 1gtf s PHE 48 Ca 0.46 1.66 0.00 0.00 0.12 0.00 0.00 56.93 59.18 1gtf s PHE 48 Cb -0.10 -3.21 -0.00 0.00 -0.57 0.00 0.00 43.02 39.14 1gtf s PHE 48 CO 0.36 -0.64 0.42 0.25 -0.10 0.00 0.00 175.22 175.51 1gtf n THR 49 N 0.43 0.00 -0.10 0.64 -2.24 -0.66 -4.67 114.28 107.69 1gtf n THR 49 Ca 0.03 -1.85 0.09 0.00 -2.27 0.00 0.00 64.05 60.05 1gtf n THR 49 Cb 0.47 1.08 0.45 0.00 -2.10 0.00 0.00 70.33 70.23 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 0.51 0.00 -0.78 4.81 -2.03 -2.82 114.58 114.27 1gtf h GLU 50 Ca -0.25 -0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 58.93 1gtf h GLU 50 Cb 1.14 -0.12 -0.00 0.00 0.63 0.00 0.00 28.75 30.40 1gtf h GLU 50 CO 0.35 0.34 -1.55 0.72 -0.73 0.00 0.00 179.01 178.14 1gtf n HIS 51 N -4.48 0.46 -4.07 0.92 8.25 -1.26 -4.61 115.22 110.44 1gtf n HIS 51 Ca 0.09 0.14 -0.32 0.00 -0.26 0.00 0.00 57.72 57.37 1gtf n HIS 51 Cb 0.29 -0.74 -0.16 0.00 1.12 0.00 0.00 29.99 30.51 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 1.97 -0.14 1.59 2.01 -1.06 -1.19 115.64 115.41 1gtf s THR 52 Ca -0.05 -1.15 0.01 0.00 0.31 0.00 0.00 61.69 60.82 1gtf s THR 52 Cb 0.12 -1.93 0.01 0.00 0.01 0.00 0.00 72.50 70.70 1gtf s THR 52 CO 0.85 0.28 0.51 -1.54 -0.69 0.00 0.00 174.62 174.04 1gtf n SER 53 N 4.59 1.05 -3.74 3.53 3.41 -1.06 -1.65 113.62 119.74 1gtf n SER 53 Ca -0.17 -1.02 -0.14 0.00 -0.26 0.00 0.00 58.87 57.28 1gtf n SER 53 Cb 0.47 0.05 -0.08 0.00 -0.26 0.00 0.00 64.21 64.38 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 -0.14 -0.88 -0.05 7.33 0.00 -1.24 -5.01 121.76 121.76 1gtf s ALA 54 Ca 0.01 0.44 0.02 0.00 0.00 0.00 0.00 51.96 52.43 1gtf s ALA 54 Cb 0.01 0.04 0.01 0.00 0.00 0.00 0.00 23.12 23.19 1gtf s ALA 54 CO 0.02 -0.27 -0.09 0.42 0.00 0.00 0.00 175.76 175.83 1gtf s ILE 55 N -1.26 0.91 -0.10 0.00 1.01 -1.26 -0.75 121.20 119.74 1gtf s ILE 55 Ca -0.13 -0.35 0.02 0.00 0.00 0.00 0.00 60.65 60.19 1gtf s ILE 55 Cb -0.05 -0.85 -0.01 0.00 0.01 0.00 0.00 42.46 41.56 1gtf s ILE 55 CO 0.05 0.30 -0.17 -0.75 0.00 0.00 0.00 174.94 174.37 1gtf s LYS 56 N 0.69 3.06 -0.18 2.79 2.20 -0.00 -4.95 119.74 123.34 1gtf s LYS 56 Ca -0.13 -0.75 -0.01 0.00 -0.36 0.00 0.00 55.97 54.73 1gtf s LYS 56 Cb -0.15 -2.47 -0.00 0.00 -1.51 0.00 0.00 37.83 33.70 1gtf s LYS 56 CO 0.02 0.31 -0.13 0.08 -0.36 0.00 0.00 175.35 175.27 1gtf s VAL 57 N 0.08 2.79 -0.10 4.02 1.01 -1.26 -0.22 120.40 126.71 1gtf s VAL 57 Ca -0.07 -0.71 0.03 0.00 0.00 0.00 0.00 61.98 61.23 1gtf s VAL 57 Cb -0.15 -2.20 -0.01 0.00 0.00 0.00 0.00 36.38 34.02 1gtf s VAL 57 CO 0.05 0.49 -0.20 -0.13 0.00 0.00 0.00 175.10 175.32 1gtf s ARG 58 N 1.05 3.05 0.00 2.72 0.52 -0.11 -4.96 118.95 121.22 1gtf s ARG 58 Ca -0.01 -0.81 0.00 0.00 -0.52 0.00 0.00 55.73 54.40 1gtf s ARG 58 Cb -0.15 -2.40 0.00 0.00 0.52 0.00 0.00 34.95 32.93 1gtf s ARG 58 CO -0.03 0.25 0.00 0.41 0.02 0.00 0.00 175.30 175.95 1gtf n GLY 59 N 3.35 1.42 3.65 -3.53 0.00 -1.26 -1.10 105.19 107.71 1gtf n GLY 59 Ca -0.18 -2.06 -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 -1.82 4.13 0.00 1.61 2.20 -1.26 -4.01 119.74 120.58 1gtf s LYS 60 Ca 0.00 1.26 -0.16 0.00 -0.36 0.00 0.00 55.97 56.70 1gtf s LYS 60 Cb 0.00 -3.73 0.03 0.00 -1.51 0.00 0.00 37.83 32.62 1gtf s LYS 60 CO 0.00 -0.82 0.35 0.00 -0.36 0.00 0.00 175.35 174.52 1gtf s ALA 61 N 3.59 -0.88 -0.21 3.13 0.00 -1.08 0.12 121.76 126.43 1gtf s ALA 61 Ca 0.48 0.35 -0.10 0.00 0.00 0.00 0.00 51.96 52.69 1gtf s ALA 61 Cb -0.15 0.15 -0.05 0.00 0.00 0.00 0.00 23.12 23.07 1gtf s ALA 61 CO 0.13 -0.32 0.13 -0.47 0.00 0.00 0.00 175.76 175.24 1gtf s TYR 62 N -1.68 3.39 -0.08 0.00 5.04 -0.36 -1.20 117.35 122.45 1gtf s TYR 62 Ca -0.11 0.30 0.02 0.00 -2.44 0.00 0.00 57.07 54.84 1gtf s TYR 62 Cb -0.03 -2.18 0.01 0.00 0.35 0.00 0.00 41.96 40.11 1gtf s TYR 62 CO 0.03 0.24 -0.14 0.42 -1.34 0.00 0.00 175.55 174.76 1gtf s ILE 63 N 0.49 1.33 -0.13 3.14 1.01 0.60 -0.63 121.20 127.01 1gtf s ILE 63 Ca 0.08 -0.58 0.00 0.00 0.00 0.00 0.00 60.65 60.15 1gtf s ILE 63 Cb -0.12 -1.21 -0.01 0.00 0.01 0.00 0.00 42.46 41.14 1gtf s ILE 63 CO -0.01 0.40 -0.15 -1.10 0.00 0.00 0.00 174.94 174.09 1gtf s GLN 64 N 0.74 3.31 0.33 2.79 -0.21 -0.32 -1.25 119.66 125.04 1gtf s GLN 64 Ca -0.13 -0.72 0.04 0.00 0.02 0.00 0.00 55.36 54.57 1gtf s GLN 64 Cb -0.16 -2.60 -0.04 0.00 1.00 0.00 0.00 33.01 31.22 1gtf s GLN 64 CO 0.03 0.16 0.15 0.95 -2.12 0.00 0.00 175.29 174.46 1gtf s THR 65 N 0.48 0.43 0.52 -0.19 -4.23 -0.42 -1.04 115.64 111.18 1gtf s THR 65 Ca -0.10 -2.00 0.28 0.00 -1.18 0.00 0.00 61.69 58.69 1gtf s THR 65 Cb -0.16 -2.49 0.45 0.00 1.34 0.00 0.00 72.50 71.64 1gtf s THR 65 CO 0.05 0.00 1.90 -0.09 -0.54 0.00 0.00 174.62 175.94 1gtf h ARG 66 N 2.11 0.07 -0.11 3.99 2.43 -2.01 -2.36 114.38 118.51 1gtf h ARG 66 Ca -0.34 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.83 1gtf h ARG 66 Cb 1.25 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.79 1gtf h ARG 66 CO 0.53 0.05 0.00 0.72 -1.51 0.00 0.00 179.97 179.76 1gtf n HIS 67 N -4.33 0.12 0.00 2.20 8.25 -1.26 -5.04 115.22 115.16 1gtf n HIS 67 Ca 0.17 -0.06 0.00 0.00 -0.26 0.00 0.00 57.72 57.57 1gtf n HIS 67 Cb 0.85 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.96 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 1.20 0.68 3.46 -1.41 0.00 -0.89 -5.09 105.19 103.14 1gtf n GLY 68 Ca 0.17 -2.10 -0.26 0.00 0.00 0.00 0.00 46.02 43.84 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 -1.21 2.50 0.07 1.61 -7.23 -1.26 -1.30 120.40 113.59 1gtf s VAL 69 Ca 0.00 -2.08 -0.26 0.00 -1.81 0.00 0.00 61.98 57.83 1gtf s VAL 69 Cb 0.00 -2.24 0.07 0.00 0.56 0.00 0.00 36.38 34.78 1gtf s VAL 69 CO 0.00 -0.19 0.65 -0.51 -0.31 0.00 0.00 175.10 174.74 1gtf s ILE 70 N -1.90 0.00 -0.10 -0.62 2.07 -0.38 -5.01 121.20 115.26 1gtf s ILE 70 Ca 0.24 0.00 0.04 0.00 -1.41 0.00 0.00 60.65 59.51 1gtf s ILE 70 Cb -0.07 -1.00 0.00 0.00 0.13 0.00 0.00 42.46 41.52 1gtf s ILE 70 CO 0.12 0.00 -0.21 -1.61 -1.91 0.00 0.00 174.94 171.32 1gtf s GLU 71 N -2.80 2.77 0.53 3.50 2.02 -1.26 -0.29 118.70 123.17 1gtf s GLU 71 Ca -0.03 -0.78 -0.17 0.00 0.02 0.00 0.00 54.97 54.01 1gtf s GLU 71 Cb -0.01 -2.13 -0.07 0.00 0.10 0.00 0.00 34.13 32.03 1gtf s GLU 71 CO -0.05 0.14 1.01 -1.54 0.02 0.00 0.00 175.26 174.84 1gtf s SER 72 N 0.44 6.37 0.10 -0.19 1.04 -0.34 -4.94 113.70 116.17 1gtf s SER 72 Ca -0.17 1.67 0.09 0.00 0.48 0.00 0.00 55.95 58.02 1gtf s SER 72 Cb -0.17 -2.52 -0.03 0.00 0.10 0.00 0.00 66.02 63.39 1gtf s SER 72 CO 0.07 -0.76 -0.24 -1.61 0.98 0.00 0.00 173.24 171.68 1gtf s GLU 73 N -3.98 1.32 0.00 4.02 2.02 -1.26 -2.63 118.70 118.18 1gtf s GLU 73 Ca 0.61 -1.20 0.32 0.00 0.02 0.00 0.00 54.97 54.72 1gtf s GLU 73 Cb -0.12 -1.64 1.90 0.00 0.10 0.00 0.00 34.13 34.37 1gtf s GLU 73 CO 0.31 0.39 2.23 0.41 0.02 0.00 0.00 175.26 178.63