#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1c9s s ASP 8 N 0.00 4.24 0.06 -3.46 1.01 -1.26 -4.83 116.67 112.42 1c9s s ASP 8 Ca 0.00 1.91 -0.04 0.00 0.71 0.00 0.00 52.55 55.13 1c9s s ASP 8 Cb 0.00 -2.53 -0.02 0.00 1.01 0.00 0.00 42.92 41.37 1c9s s ASP 8 CO 0.00 -2.22 0.05 0.72 0.21 0.00 0.00 175.17 173.94 1c9s s PHE 9 N -2.81 0.35 0.04 4.23 -0.12 -1.26 -1.69 117.98 116.72 1c9s s PHE 9 Ca 0.63 -0.80 0.08 0.00 -0.05 0.00 0.00 56.93 56.79 1c9s s PHE 9 Cb -0.19 -0.24 -0.03 0.00 -0.63 0.00 0.00 43.02 41.93 1c9s s PHE 9 CO 0.55 -0.41 -0.23 0.14 -0.05 0.00 0.00 175.22 175.23 1c9s s VAL 10 N -3.50 2.44 -0.19 -2.49 -7.23 0.09 -4.61 120.40 104.91 1c9s s VAL 10 Ca 0.03 -1.30 -0.05 0.00 -1.81 0.00 0.00 61.98 58.85 1c9s s VAL 10 Cb 0.04 -1.99 -0.03 0.00 0.56 0.00 0.00 36.38 34.97 1c9s s VAL 10 CO -0.09 0.35 0.00 -0.69 -0.31 0.00 0.00 175.10 174.37 1c9s s VAL 11 N -0.86 4.04 -0.15 1.32 1.01 -0.36 -1.07 120.40 124.33 1c9s s VAL 11 Ca 0.13 -0.29 0.00 0.00 0.00 0.00 0.00 61.98 61.82 1c9s s VAL 11 Cb -0.10 -2.82 0.03 0.00 0.00 0.00 0.00 36.38 33.49 1c9s s VAL 11 CO 0.03 0.44 -0.12 -0.63 0.00 0.00 0.00 175.10 174.82 1c9s s ILE 12 N 0.83 1.49 -0.25 2.22 1.09 0.54 -1.30 121.20 125.82 1c9s s ILE 12 Ca 0.01 -0.65 -0.04 0.00 -1.10 0.00 0.00 60.65 58.88 1c9s s ILE 12 Cb -0.14 -1.45 0.01 0.00 -1.06 0.00 0.00 42.46 39.82 1c9s s ILE 12 CO 0.02 0.39 -0.02 -0.75 -0.10 0.00 0.00 174.94 174.48 1c9s s LYS 13 N 1.51 3.03 -0.02 2.79 2.20 -0.11 -0.79 119.74 128.36 1c9s s LYS 13 Ca 0.04 -0.86 -0.30 0.00 -0.36 0.00 0.00 55.97 54.49 1c9s s LYS 13 Cb -0.13 -3.09 -0.07 0.00 -1.51 0.00 0.00 37.83 33.03 1c9s s LYS 13 CO -0.10 -0.36 1.73 0.00 -0.36 0.00 0.00 175.35 176.26 1c9s s ALA 14 N 1.41 3.62 -2.41 3.13 0.00 -0.76 -0.84 121.76 125.91 1c9s s ALA 14 Ca 0.02 1.06 0.22 0.00 0.00 0.00 0.00 51.96 53.26 1c9s s ALA 14 Cb -0.16 -3.76 0.55 0.00 0.00 0.00 0.00 23.12 19.75 1c9s s ALA 14 CO -0.02 -1.40 1.46 1.28 0.00 0.00 0.00 175.76 177.07 1c9s n LEU 15 N 7.04 2.64 -3.84 0.00 4.77 0.24 -1.07 117.00 126.78 1c9s n LEU 15 Ca 0.18 -1.12 -0.08 0.00 -0.03 0.00 0.00 56.01 54.96 1c9s n LEU 15 Cb 0.42 -0.18 -0.03 0.00 -2.33 0.00 0.00 43.42 41.31 1c9s n LEU 15 CO 0.64 0.56 0.40 -1.83 -1.33 0.00 0.00 177.39 175.83 1c9s s GLU 16 N -1.64 1.68 0.49 3.23 -1.05 -1.23 -4.88 118.70 115.29 1c9s s GLU 16 Ca 0.35 -0.98 -0.21 0.00 -0.15 0.00 0.00 54.97 53.99 1c9s s GLU 16 Cb 0.20 0.58 -0.08 0.00 -0.44 0.00 0.00 34.13 34.40 1c9s s GLU 16 CO 0.29 -0.75 1.09 -0.51 0.95 0.00 0.00 175.26 176.33 1c9s s ASP 17 N -2.92 6.16 0.00 0.83 1.01 -1.26 -3.13 116.67 117.36 1c9s s ASP 17 Ca 0.12 2.08 0.00 0.00 0.71 0.00 0.00 52.55 55.46 1c9s s ASP 17 Cb -0.04 -2.58 0.00 0.00 1.01 0.00 0.00 42.92 41.31 1c9s s ASP 17 CO 0.05 -0.91 0.00 0.61 0.21 0.00 0.00 175.17 175.13 1c9s n GLY 18 N 0.06 0.40 3.77 0.21 0.00 -0.86 -4.89 105.19 103.89 1c9s n GLY 18 Ca 0.09 -1.01 -0.41 0.00 0.00 0.00 0.00 46.02 44.70 1c9s n GLY 18 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1c9s n VAL 19 N -2.98 2.19 -4.37 1.61 0.31 -0.53 -4.74 118.33 109.83 1c9s n VAL 19 Ca 0.00 -0.50 -0.34 0.00 -0.01 0.00 0.00 64.34 63.49 1c9s n VAL 19 Cb 0.00 -1.93 -0.15 0.00 -0.91 0.00 0.00 33.84 30.86 1c9s n VAL 19 CO 0.00 0.00 0.00 0.20 -1.32 0.00 0.00 176.83 175.71 1c9s s ASN 20 N -0.22 3.96 -0.35 4.52 0.01 -0.50 0.27 114.94 122.62 1c9s s ASN 20 Ca 0.55 -0.41 -0.10 0.00 -0.71 0.00 0.00 52.86 52.19 1c9s s ASN 20 Cb -0.47 -1.63 0.02 0.00 0.41 0.00 0.00 41.25 39.57 1c9s s ASN 20 CO 0.62 0.07 0.18 -0.69 -1.51 0.00 0.00 177.10 175.78 1c9s s VAL 21 N 0.91 4.51 -0.14 1.60 1.01 0.26 -1.27 120.40 127.27 1c9s s VAL 21 Ca -0.03 -0.76 -0.04 0.00 0.00 0.00 0.00 61.98 61.16 1c9s s VAL 21 Cb -0.15 -3.46 -0.03 0.00 0.00 0.00 0.00 36.38 32.74 1c9s s VAL 21 CO -0.00 -0.14 -0.01 -0.63 0.00 0.00 0.00 175.10 174.31 1c9s s ILE 22 N 1.56 4.16 -0.19 2.22 1.01 0.58 -0.58 121.20 129.95 1c9s s ILE 22 Ca 0.02 -0.27 -0.13 0.00 0.00 0.00 0.00 60.65 60.27 1c9s s ILE 22 Cb -0.19 -2.82 -0.05 0.00 0.01 0.00 0.00 42.46 39.42 1c9s s ILE 22 CO 0.06 0.51 0.27 -0.83 0.00 0.00 0.00 174.94 174.95 1c9s s GLY 23 N 0.07 2.11 -0.08 6.18 0.00 -0.51 -0.55 107.32 114.53 1c9s s GLY 23 Ca 0.01 -0.60 -0.07 0.00 0.00 0.00 0.00 44.72 44.06 1c9s s GLY 23 CO 0.02 0.48 0.19 1.08 0.00 0.00 0.00 173.10 174.87 1c9s s LEU 24 N 0.79 4.39 0.11 0.66 1.02 -0.04 -0.86 118.68 124.74 1c9s s LEU 24 Ca 0.14 0.51 -0.31 0.00 0.02 0.00 0.00 54.13 54.49 1c9s s LEU 24 Cb -0.13 -2.28 -0.09 0.00 0.02 0.00 0.00 46.19 43.71 1c9s s LEU 24 CO 0.04 0.36 1.53 0.42 0.02 0.00 0.00 176.35 178.72 1c9s s THR 25 N -1.11 3.00 0.25 5.49 -4.23 -0.30 -2.19 115.64 116.55 1c9s s THR 25 Ca 0.19 0.63 -0.30 0.00 -1.18 0.00 0.00 61.69 61.04 1c9s s THR 25 Cb -0.13 -3.41 -0.10 0.00 1.34 0.00 0.00 72.50 70.21 1c9s s THR 25 CO 0.09 0.03 1.38 -0.60 -0.54 0.00 0.00 174.62 174.98 1c9s s ARG 26 N 1.68 4.32 0.00 3.99 3.52 -0.24 -4.57 118.95 127.64 1c9s s ARG 26 Ca 0.69 2.22 0.00 0.00 -0.13 0.00 0.00 55.73 58.51 1c9s s ARG 26 Cb -0.40 -3.12 0.00 0.00 -1.56 0.00 0.00 34.95 29.87 1c9s s ARG 26 CO 0.31 -0.33 0.00 0.41 -0.81 0.00 0.00 175.30 174.88 1c9s n GLY 27 N 1.94 0.90 0.31 8.12 0.00 -1.26 -4.81 105.19 110.39 1c9s n GLY 27 Ca 0.05 -1.99 -0.01 0.00 0.00 0.00 0.00 46.02 44.08 1c9s n GLY 27 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1c9s h ALA 28 N 0.00 1.37 -2.69 4.61 0.00 -2.05 -3.42 119.26 117.07 1c9s h ALA 28 Ca 0.00 -0.14 -0.57 0.00 0.00 0.00 0.00 54.91 54.20 1c9s h ALA 28 Cb 0.00 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.53 1c9s h ALA 28 CO 0.00 0.48 -0.34 -0.51 0.00 0.00 0.00 179.25 178.88 1c9s s ASP 29 N -6.56 6.44 -0.10 0.00 1.01 -1.26 -5.11 116.67 111.09 1c9s s ASP 29 Ca -0.10 0.49 0.01 0.00 0.71 0.00 0.00 52.55 53.67 1c9s s ASP 29 Cb 0.16 -2.05 0.02 0.00 1.01 0.00 0.00 42.92 42.06 1c9s s ASP 29 CO 0.78 0.04 -0.12 -0.89 0.21 0.00 0.00 175.17 175.19 1c9s s THR 30 N -1.70 1.27 0.24 -1.27 2.01 -1.26 -4.66 115.64 110.27 1c9s s THR 30 Ca 0.39 -0.51 -0.22 0.00 0.31 0.00 0.00 61.69 61.67 1c9s s THR 30 Cb -0.12 -1.19 0.04 0.00 0.01 0.00 0.00 72.50 71.24 1c9s s THR 30 CO 0.26 0.40 0.67 0.00 -0.69 0.00 0.00 174.62 175.26 1c9s s ARG 31 N 1.07 1.60 0.13 4.92 1.70 -1.26 -4.97 118.95 122.14 1c9s s ARG 31 Ca -0.06 -0.80 -0.30 0.00 -0.47 0.00 0.00 55.73 54.10 1c9s s ARG 31 Cb -0.15 0.60 -0.07 0.00 -0.57 0.00 0.00 34.95 34.77 1c9s s ARG 31 CO -0.02 -0.72 1.09 -0.06 -1.08 0.00 0.00 175.30 174.51 1c9s s PHE 32 N -3.86 3.60 -0.17 5.89 0.08 -1.26 -1.15 117.98 121.12 1c9s s PHE 32 Ca 0.07 1.58 0.10 0.00 0.12 0.00 0.00 56.93 58.81 1c9s s PHE 32 Cb -0.04 -3.26 -0.14 0.00 -0.57 0.00 0.00 43.02 39.01 1c9s s PHE 32 CO -0.00 -0.56 0.29 -2.39 -0.10 0.00 0.00 175.22 172.45 1c9s n HIS 33 N 2.85 0.00 -3.59 0.36 1.44 -0.04 -4.92 115.22 111.32 1c9s n HIS 33 Ca 0.04 0.00 -0.16 0.00 -2.01 0.00 0.00 57.72 55.59 1c9s n HIS 33 Cb 0.47 -0.15 -0.07 0.00 0.12 0.00 0.00 29.99 30.36 1c9s n HIS 33 CO 0.00 0.00 0.00 -1.58 -2.81 0.00 0.00 176.34 171.95 1c9s s HIS 34 N -2.43 -0.63 -0.18 -1.40 5.65 -1.24 -5.02 115.29 110.04 1c9s s HIS 34 Ca -0.01 1.25 -0.01 0.00 0.25 0.00 0.00 55.06 56.54 1c9s s HIS 34 Cb 0.07 0.32 0.05 0.00 -1.18 0.00 0.00 32.58 31.83 1c9s s HIS 34 CO 0.41 -0.49 -0.03 0.45 -0.65 0.00 0.00 174.74 174.43 1c9s s SER 35 N -0.67 2.95 -0.21 9.88 0.15 -1.26 -1.42 113.70 123.11 1c9s s SER 35 Ca -0.07 -0.76 -0.16 0.00 0.70 0.00 0.00 55.95 55.66 1c9s s SER 35 Cb -0.02 -0.84 -0.04 0.00 -1.71 0.00 0.00 66.02 63.41 1c9s s SER 35 CO 0.06 -0.23 0.40 -0.70 1.20 0.00 0.00 173.24 173.98 1c9s s GLU 36 N 1.67 4.15 -0.12 5.44 2.56 0.25 -4.89 118.70 127.76 1c9s s GLU 36 Ca -0.01 0.19 -0.17 0.00 0.00 0.00 0.00 54.97 54.98 1c9s s GLU 36 Cb -0.16 -3.56 -0.04 0.00 2.00 0.00 0.00 34.13 32.37 1c9s s GLU 36 CO -0.07 -0.08 0.43 0.21 -0.56 0.00 0.00 175.26 175.19 1c9s s LYS 37 N 1.44 4.31 -0.08 4.30 2.20 -1.26 -0.58 119.74 130.08 1c9s s LYS 37 Ca 0.19 0.37 0.04 0.00 -0.36 0.00 0.00 55.97 56.21 1c9s s LYS 37 Cb -0.15 -3.43 -0.00 0.00 -1.51 0.00 0.00 37.83 32.74 1c9s s LYS 37 CO 0.08 0.19 -0.22 -0.51 -0.36 0.00 0.00 175.35 174.54 1c9s s LEU 38 N 0.53 2.01 0.42 5.43 1.43 0.14 -4.96 118.68 123.68 1c9s s LEU 38 Ca 0.24 -0.49 0.01 0.00 -1.03 0.00 0.00 54.13 52.86 1c9s s LEU 38 Cb -0.15 -1.27 -0.01 0.00 0.03 0.00 0.00 46.19 44.79 1c9s s LEU 38 CO 0.09 0.17 0.63 -1.81 0.23 0.00 0.00 176.35 175.66 1c9s s ASP 39 N 0.18 5.95 0.03 2.29 1.01 -1.26 -1.46 116.67 123.41 1c9s s ASP 39 Ca -0.12 0.28 -0.37 0.00 0.71 0.00 0.00 52.55 53.06 1c9s s ASP 39 Cb -0.16 -1.61 -0.16 0.00 1.01 0.00 0.00 42.92 42.00 1c9s s ASP 39 CO 0.06 -0.59 1.49 1.17 0.21 0.00 0.00 175.17 177.51 1c9s n LYS 40 N -1.98 1.40 0.00 8.23 4.81 -1.18 -1.22 118.16 128.22 1c9s n LYS 40 Ca -0.00 0.51 0.00 0.00 -0.87 0.00 0.00 58.31 57.95 1c9s n LYS 40 Cb 0.57 -2.20 0.00 0.00 0.02 0.00 0.00 35.03 33.43 1c9s n LYS 40 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1c9s n GLY 41 N 3.09 2.74 3.78 3.14 0.00 -0.24 -4.95 105.19 112.74 1c9s n GLY 41 Ca 0.20 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.88 1c9s n GLY 41 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1c9s s GLU 42 N -0.54 2.97 -0.07 1.61 2.02 -0.36 -4.81 118.70 119.53 1c9s s GLU 42 Ca 0.00 1.41 0.03 0.00 0.02 0.00 0.00 54.97 56.43 1c9s s GLU 42 Cb 0.00 -1.97 0.01 0.00 0.10 0.00 0.00 34.13 32.27 1c9s s GLU 42 CO 0.00 -1.12 -0.16 0.08 0.02 0.00 0.00 175.26 174.08 1c9s s VAL 43 N -2.24 1.45 -0.11 2.63 1.01 -1.26 -1.83 120.40 120.05 1c9s s VAL 43 Ca 0.68 -0.68 0.03 0.00 0.00 0.00 0.00 61.98 62.01 1c9s s VAL 43 Cb -0.21 -1.29 -0.01 0.00 0.00 0.00 0.00 36.38 34.88 1c9s s VAL 43 CO 0.38 0.42 -0.21 -0.22 0.00 0.00 0.00 175.10 175.48 1c9s s LEU 44 N 0.46 2.29 -0.26 3.92 2.96 0.03 -4.98 118.68 123.11 1c9s s LEU 44 Ca -0.14 -0.48 -0.04 0.00 -0.22 0.00 0.00 54.13 53.25 1c9s s LEU 44 Cb -0.16 -1.47 0.01 0.00 0.50 0.00 0.00 46.19 45.07 1c9s s LEU 44 CO 0.05 0.17 -0.02 -0.63 -1.32 0.00 0.00 176.35 174.60 1c9s s ILE 45 N 0.30 3.30 -0.06 6.68 1.09 -1.26 -0.34 121.20 130.91 1c9s s ILE 45 Ca -0.15 -0.81 0.02 0.00 -1.10 0.00 0.00 60.65 58.61 1c9s s ILE 45 Cb -0.17 -2.65 0.01 0.00 -1.06 0.00 0.00 42.46 38.60 1c9s s ILE 45 CO 0.08 0.21 -0.11 0.00 -0.10 0.00 0.00 174.94 175.02 1c9s s ALA 46 N 1.41 1.12 0.60 9.38 0.00 -0.23 -4.94 121.76 129.09 1c9s s ALA 46 Ca 0.02 -0.35 -0.06 0.00 0.00 0.00 0.00 51.96 51.57 1c9s s ALA 46 Cb -0.16 -0.51 0.01 0.00 0.00 0.00 0.00 23.12 22.46 1c9s s ALA 46 CO -0.02 0.10 0.92 -0.65 0.00 0.00 0.00 175.76 176.11 1c9s s GLN 47 N 0.62 2.90 0.36 0.00 -0.21 -1.26 -0.73 119.66 121.34 1c9s s GLN 47 Ca -0.12 0.02 -0.22 0.00 0.02 0.00 0.00 55.36 55.06 1c9s s GLN 47 Cb -0.15 -2.25 -0.10 0.00 1.00 0.00 0.00 33.01 31.51 1c9s s GLN 47 CO 0.03 -0.73 0.89 -0.06 -2.12 0.00 0.00 175.29 173.30 1c9s s PHE 48 N -3.02 3.48 0.35 0.91 0.08 -0.68 -4.94 117.98 114.16 1c9s s PHE 48 Ca 0.54 1.59 0.00 0.00 0.12 0.00 0.00 56.93 59.18 1c9s s PHE 48 Cb -0.11 -2.80 -0.00 0.00 -0.57 0.00 0.00 43.02 39.54 1c9s s PHE 48 CO 0.46 0.08 0.44 0.95 -0.10 0.00 0.00 175.22 177.05 1c9s s THR 49 N -1.89 0.00 0.25 0.64 -4.23 -0.53 -4.75 115.64 105.14 1c9s s THR 49 Ca 0.55 -1.68 -0.03 0.00 -1.18 0.00 0.00 61.69 59.35 1c9s s THR 49 Cb -0.13 -2.64 0.24 0.00 1.34 0.00 0.00 72.50 71.30 1c9s s THR 49 CO 0.18 0.00 1.72 -0.08 -0.54 0.00 0.00 174.62 175.90 1c9s h GLU 50 N 2.09 0.41 0.00 3.99 4.81 -2.02 -2.83 114.58 121.02 1c9s h GLU 50 Ca -0.27 -0.02 -0.12 0.00 -0.13 0.00 0.00 59.36 58.81 1c9s h GLU 50 Cb 1.24 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 30.51 1c9s h GLU 50 CO 0.38 0.27 -1.18 0.45 -0.73 0.00 0.00 179.01 178.19 1c9s h HIS 51 N 0.42 0.00 -3.83 0.92 3.86 -1.95 -3.42 115.15 111.15 1c9s h HIS 51 Ca 0.45 0.00 -0.67 0.00 -1.16 0.00 0.00 60.37 58.98 1c9s h HIS 51 Cb 0.72 0.00 -0.36 0.00 1.06 0.00 0.00 27.41 28.83 1c9s h HIS 51 CO -0.17 0.43 -0.77 0.99 0.86 0.00 0.00 177.93 179.27 1c9s s THR 52 N -3.03 2.36 -1.41 2.45 2.01 -1.07 -1.08 115.64 115.87 1c9s s THR 52 Ca -0.01 -1.64 0.14 0.00 0.31 0.00 0.00 61.69 60.49 1c9s s THR 52 Cb 0.09 -2.41 0.02 0.00 0.01 0.00 0.00 72.50 70.20 1c9s s THR 52 CO 0.80 -0.10 0.82 -1.54 -0.69 0.00 0.00 174.62 173.91 1c9s n SER 53 N 4.46 1.64 -3.68 3.53 3.41 -0.93 -1.45 113.62 120.60 1c9s n SER 53 Ca -0.12 -1.32 -0.14 0.00 -0.26 0.00 0.00 58.87 57.02 1c9s n SER 53 Cb 0.42 0.38 -0.08 0.00 -0.26 0.00 0.00 64.21 64.67 1c9s n SER 53 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1c9s s ALA 54 N -1.64 -1.24 -0.08 7.33 0.00 -1.25 -5.01 121.76 119.87 1c9s s ALA 54 Ca 0.13 1.13 0.02 0.00 0.00 0.00 0.00 51.96 53.24 1c9s s ALA 54 Cb 0.12 -0.43 0.01 0.00 0.00 0.00 0.00 23.12 22.82 1c9s s ALA 54 CO 0.32 -0.27 -0.13 0.42 0.00 0.00 0.00 175.76 176.10 1c9s s ILE 55 N -0.44 1.26 -0.10 0.00 1.01 -1.26 -0.87 121.20 120.80 1c9s s ILE 55 Ca -0.06 -0.54 0.00 0.00 0.00 0.00 0.00 60.65 60.06 1c9s s ILE 55 Cb -0.03 -1.16 -0.02 0.00 0.01 0.00 0.00 42.46 41.26 1c9s s ILE 55 CO 0.04 0.39 -0.09 -0.75 0.00 0.00 0.00 174.94 174.52 1c9s s LYS 56 N 0.78 3.08 -0.16 2.79 2.20 0.28 -4.95 119.74 123.76 1c9s s LYS 56 Ca -0.12 -0.61 -0.01 0.00 -0.36 0.00 0.00 55.97 54.87 1c9s s LYS 56 Cb -0.16 -2.63 -0.01 0.00 -1.51 0.00 0.00 37.83 33.53 1c9s s LYS 56 CO 0.02 0.44 -0.12 0.08 -0.36 0.00 0.00 175.35 175.42 1c9s s VAL 57 N -0.22 2.98 -0.11 4.02 1.01 -1.26 -0.31 120.40 126.51 1c9s s VAL 57 Ca 0.02 -0.66 0.03 0.00 0.00 0.00 0.00 61.98 61.37 1c9s s VAL 57 Cb -0.13 -2.28 0.01 0.00 0.00 0.00 0.00 36.38 33.98 1c9s s VAL 57 CO 0.03 0.50 -0.20 -0.60 0.00 0.00 0.00 175.10 174.83 1c9s s ARG 58 N 0.81 2.69 0.00 2.72 3.52 -0.39 -4.96 118.95 123.35 1c9s s ARG 58 Ca -0.04 -0.74 0.00 0.00 -0.13 0.00 0.00 55.73 54.82 1c9s s ARG 58 Cb -0.15 -2.15 0.00 0.00 -1.56 0.00 0.00 34.95 31.09 1c9s s ARG 58 CO 0.01 0.04 0.00 0.41 -0.81 0.00 0.00 175.30 174.95 1c9s n GLY 59 N 3.90 1.72 3.64 8.12 0.00 -1.26 -1.41 105.19 119.90 1c9s n GLY 59 Ca -0.20 -2.13 -0.42 0.00 0.00 0.00 0.00 46.02 43.26 1c9s n GLY 59 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1c9s s LYS 60 N -1.73 4.16 -0.02 1.61 2.20 -1.26 -3.86 119.74 120.84 1c9s s LYS 60 Ca 0.00 1.04 -0.15 0.00 -0.36 0.00 0.00 55.97 56.49 1c9s s LYS 60 Cb 0.00 -3.67 0.02 0.00 -1.51 0.00 0.00 37.83 32.68 1c9s s LYS 60 CO 0.00 -0.63 0.32 0.00 -0.36 0.00 0.00 175.35 174.69 1c9s s ALA 61 N 3.08 -0.82 -0.20 3.13 0.00 -0.95 -0.59 121.76 125.40 1c9s s ALA 61 Ca 0.39 0.37 -0.15 0.00 0.00 0.00 0.00 51.96 52.56 1c9s s ALA 61 Cb -0.15 0.07 -0.04 0.00 0.00 0.00 0.00 23.12 23.01 1c9s s ALA 61 CO 0.09 -0.26 0.36 -0.47 0.00 0.00 0.00 175.76 175.48 1c9s s TYR 62 N -1.32 3.37 -0.04 0.00 5.04 -0.02 -1.60 117.35 122.79 1c9s s TYR 62 Ca -0.13 0.56 0.05 0.00 -2.44 0.00 0.00 57.07 55.11 1c9s s TYR 62 Cb -0.05 -2.48 -0.01 0.00 0.35 0.00 0.00 41.96 39.77 1c9s s TYR 62 CO 0.04 0.01 -0.19 0.42 -1.34 0.00 0.00 175.55 174.49 1c9s s ILE 63 N 1.24 1.58 -0.10 3.14 1.01 0.57 -0.93 121.20 127.71 1c9s s ILE 63 Ca 0.17 -0.81 0.03 0.00 0.00 0.00 0.00 60.65 60.04 1c9s s ILE 63 Cb -0.14 -1.35 -0.01 0.00 0.01 0.00 0.00 42.46 40.97 1c9s s ILE 63 CO 0.07 0.45 -0.21 -1.10 0.00 0.00 0.00 174.94 174.15 1c9s s GLN 64 N -0.08 3.06 0.24 2.79 -0.21 -0.42 -1.19 119.66 123.84 1c9s s GLN 64 Ca -0.02 -0.83 0.02 0.00 0.02 0.00 0.00 55.36 54.56 1c9s s GLN 64 Cb -0.11 -2.37 -0.01 0.00 1.00 0.00 0.00 33.01 31.51 1c9s s GLN 64 CO 0.02 0.23 0.09 0.25 -2.12 0.00 0.00 175.29 173.75 1c9s n THR 65 N 3.41 0.00 0.29 -0.19 -2.24 -0.28 -1.22 114.28 114.06 1c9s n THR 65 Ca -0.19 -1.38 0.17 0.00 -2.27 0.00 0.00 64.05 60.38 1c9s n THR 65 Cb 0.53 0.50 0.90 0.00 -2.10 0.00 0.00 70.33 70.16 1c9s n THR 65 CO 0.00 0.00 0.00 -0.09 -0.57 0.00 0.00 175.07 174.41 1c9s h ARG 66 N 0.00 0.00 -0.15 -0.78 2.43 -2.01 0.13 114.38 114.00 1c9s h ARG 66 Ca -0.18 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.99 1c9s h ARG 66 Cb 0.70 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.25 1c9s h ARG 66 CO 0.29 0.05 0.00 0.72 -1.51 0.00 0.00 179.97 179.52 1c9s n HIS 67 N -3.39 0.19 0.00 2.20 8.25 -1.26 -5.04 115.22 116.17 1c9s n HIS 67 Ca -0.02 -0.09 0.00 0.00 -0.26 0.00 0.00 57.72 57.35 1c9s n HIS 67 Cb 0.18 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.29 1c9s n HIS 67 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1c9s n GLY 68 N 1.21 0.16 3.92 -1.41 0.00 0.03 -5.05 105.19 104.05 1c9s n GLY 68 Ca 0.17 -2.21 -0.31 0.00 0.00 0.00 0.00 46.02 43.67 1c9s n GLY 68 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1c9s s VAL 69 N 0.00 5.37 -0.00 1.61 -7.23 -1.26 -1.13 120.40 117.75 1c9s s VAL 69 Ca 0.00 -0.36 -0.14 0.00 -1.81 0.00 0.00 61.98 59.68 1c9s s VAL 69 Cb 0.00 -3.63 0.02 0.00 0.56 0.00 0.00 36.38 33.33 1c9s s VAL 69 CO 0.00 0.13 0.28 -0.51 -0.31 0.00 0.00 175.10 174.69 1c9s s ILE 70 N -1.53 0.07 -0.08 -0.62 2.07 -0.34 -5.01 121.20 115.76 1c9s s ILE 70 Ca 0.36 -0.54 0.03 0.00 -1.41 0.00 0.00 60.65 59.09 1c9s s ILE 70 Cb -0.13 -0.64 0.01 0.00 0.13 0.00 0.00 42.46 41.83 1c9s s ILE 70 CO 0.28 -0.30 -0.19 -1.61 -1.91 0.00 0.00 174.94 171.21 1c9s s GLU 71 N -1.51 2.43 0.25 3.50 2.02 -1.26 -0.32 118.70 123.80 1c9s s GLU 71 Ca -0.13 -0.67 -0.09 0.00 0.02 0.00 0.00 54.97 54.11 1c9s s GLU 71 Cb -0.05 -1.89 -0.07 0.00 0.10 0.00 0.00 34.13 32.23 1c9s s GLU 71 CO 0.03 0.11 0.56 -1.54 0.02 0.00 0.00 175.26 174.44 1c9s s SER 72 N 0.49 6.59 0.00 -0.19 1.04 -0.62 -4.96 113.70 116.05 1c9s s SER 72 Ca -0.17 0.90 0.06 0.00 0.48 0.00 0.00 55.95 57.22 1c9s s SER 72 Cb -0.17 -2.22 -0.02 0.00 0.10 0.00 0.00 66.02 63.72 1c9s s SER 72 CO 0.07 -0.11 -0.20 -1.61 0.98 0.00 0.00 173.24 172.37 1c9s s GLU 73 N -2.99 1.51 0.00 4.02 0.41 -1.25 -2.25 118.70 118.15 1c9s s GLU 73 Ca 0.47 -0.76 0.11 0.00 -0.41 0.00 0.00 54.97 54.38 1c9s s GLU 73 Cb -0.11 -1.50 0.64 0.00 -1.78 0.00 0.00 34.13 31.38 1c9s s GLU 73 CO 0.23 0.40 1.08 0.41 -0.49 0.00 0.00 175.26 176.90