#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1o9a s LYS 18 N 0.00 2.63 0.80 -1.46 1.02 -1.26 -5.11 119.74 116.36 1o9a s LYS 18 Ca 0.00 -0.64 -0.14 0.00 0.02 0.00 0.00 55.97 55.21 1o9a s LYS 18 Cb 0.00 -2.52 0.05 0.00 -0.52 0.00 0.00 37.83 34.84 1o9a s LYS 18 CO 0.00 0.64 0.96 -2.30 -0.92 0.00 0.00 175.35 173.72 1o9a n PRO 19 N 2.00 0.19 0.00 -1.68 -0.02 -1.26 -5.03 135.00 129.20 1o9a n PRO 19 Ca -0.17 0.13 0.00 0.00 -2.02 0.00 0.00 63.50 61.44 1o9a n PRO 19 Cb 0.53 -2.23 0.00 0.00 -0.02 0.00 0.00 33.50 31.77 1o9a n PRO 19 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1o9a n GLY 20 N 0.93 5.69 3.26 -1.23 0.00 -1.26 -4.80 105.19 107.78 1o9a n GLY 20 Ca 0.12 -0.92 -0.14 0.00 0.00 0.00 0.00 46.02 45.08 1o9a n GLY 20 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1o9a s TYR 22 N -3.61 1.22 0.65 0.00 5.04 -1.26 -1.84 117.35 117.56 1o9a s TYR 22 Ca 0.25 -0.55 -0.07 0.00 -2.44 0.00 0.00 57.07 54.27 1o9a s TYR 22 Cb 0.06 -1.08 0.03 0.00 0.35 0.00 0.00 41.96 41.32 1o9a s TYR 22 CO 0.05 -0.44 0.97 0.34 -1.34 0.00 0.00 175.55 175.14 1o9a s ASP 23 N 1.70 5.21 -0.91 4.32 -1.08 0.52 -4.88 116.67 121.55 1o9a s ASP 23 Ca 0.03 0.63 -0.17 0.00 -0.52 0.00 0.00 52.55 52.53 1o9a s ASP 23 Cb -0.13 -1.44 -0.26 0.00 -1.46 0.00 0.00 42.92 39.63 1o9a s ASP 23 CO -0.06 -1.34 2.30 -3.20 0.52 0.00 0.00 175.17 173.38 1o9a n ASN 24 N -2.78 -0.17 0.00 -0.34 4.05 -1.26 -0.51 115.26 114.25 1o9a n ASN 24 Ca 0.06 -0.74 0.00 0.00 0.45 0.00 0.00 54.58 54.35 1o9a n ASN 24 Cb 0.59 -0.95 0.00 0.00 1.23 0.00 0.00 39.78 40.65 1o9a n ASN 24 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1o9a n GLY 25 N 6.00 2.50 3.35 8.20 0.00 -1.26 -5.02 105.19 118.96 1o9a n GLY 25 Ca 0.60 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 46.43 1o9a n GLY 25 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1o9a s LYS 26 N -0.41 1.33 -0.28 1.61 1.02 0.33 -5.13 119.74 118.22 1o9a s LYS 26 Ca 0.00 -1.57 -0.09 0.00 0.02 0.00 0.00 55.97 54.33 1o9a s LYS 26 Cb 0.00 -1.17 -0.03 0.00 -0.52 0.00 0.00 37.83 36.11 1o9a s LYS 26 CO 0.00 0.20 0.13 -1.58 -0.92 0.00 0.00 175.35 173.18 1o9a s HIS 27 N -2.84 3.15 0.33 3.18 2.46 -1.26 0.19 115.29 120.51 1o9a s HIS 27 Ca 0.22 -0.31 0.08 0.00 0.47 0.00 0.00 55.06 55.52 1o9a s HIS 27 Cb -0.02 -2.32 -0.04 0.00 -0.13 0.00 0.00 32.58 30.08 1o9a s HIS 27 CO 0.07 -0.33 0.20 0.71 -2.47 0.00 0.00 174.74 172.92 1o9a s TYR 28 N 1.66 2.80 0.94 3.88 1.51 -0.77 -4.86 117.35 122.51 1o9a s TYR 28 Ca 0.06 -0.34 -0.15 0.00 -1.01 0.00 0.00 57.07 55.64 1o9a s TYR 28 Cb -0.16 -1.69 0.17 0.00 -0.11 0.00 0.00 41.96 40.17 1o9a s TYR 28 CO 0.07 0.29 1.23 -0.65 -1.11 0.00 0.00 175.55 175.37 1o9a s GLN 29 N -3.90 0.87 0.27 -0.62 -1.52 -1.26 -2.88 119.66 110.61 1o9a s GLN 29 Ca 0.39 -0.11 -0.29 0.00 -1.95 0.00 0.00 55.36 53.39 1o9a s GLN 29 Cb -0.04 -1.84 -0.09 0.00 -0.22 0.00 0.00 33.01 30.81 1o9a s GLN 29 CO 0.24 -2.31 1.24 0.42 -0.25 0.00 0.00 175.29 174.64 1o9a s ILE 30 N -3.61 3.14 -0.51 1.08 1.09 -1.26 -2.31 121.20 118.83 1o9a s ILE 30 Ca 0.69 1.07 0.00 0.00 -1.10 0.00 0.00 60.65 61.30 1o9a s ILE 30 Cb -0.08 -3.68 0.00 0.00 -1.06 0.00 0.00 42.46 37.64 1o9a s ILE 30 CO 0.52 0.22 0.00 0.59 -0.10 0.00 0.00 174.94 176.17 1o9a n ASN 31 N 1.58 -5.81 -4.72 3.58 3.02 -1.22 -4.92 115.26 106.77 1o9a n ASN 31 Ca 0.02 0.12 -0.42 0.00 -0.03 0.00 0.00 54.58 54.27 1o9a n ASN 31 Cb 0.43 -3.73 -0.03 0.00 -0.61 0.00 0.00 39.78 35.84 1o9a n ASN 31 CO 0.00 0.00 0.00 -1.58 -2.62 0.00 0.00 177.26 173.06 1o9a s GLN 32 N -2.36 4.42 0.16 3.52 0.74 -0.98 -4.71 119.66 120.45 1o9a s GLN 32 Ca 0.00 1.88 0.05 0.00 0.05 0.00 0.00 55.36 57.34 1o9a s GLN 32 Cb 0.00 -3.29 -0.04 0.00 1.10 0.00 0.00 33.01 30.78 1o9a s GLN 32 CO 0.00 -0.26 0.12 -0.65 -0.55 0.00 0.00 175.29 173.94 1o9a s GLN 33 N 0.73 2.83 -0.14 1.67 -0.21 -1.26 -2.92 119.66 120.35 1o9a s GLN 33 Ca 0.59 -0.90 -0.28 0.00 0.02 0.00 0.00 55.36 54.79 1o9a s GLN 33 Cb -0.32 -2.61 0.07 0.00 1.00 0.00 0.00 33.01 31.15 1o9a s GLN 33 CO 0.31 0.48 0.68 1.67 -2.12 0.00 0.00 175.29 176.32 1o9a s TRP 34 N -1.74 -0.70 -0.29 0.91 -2.14 -0.99 -5.00 118.94 108.99 1o9a s TRP 34 Ca 0.30 1.44 -0.22 0.00 2.66 0.00 0.00 56.10 60.28 1o9a s TRP 34 Cb -0.10 0.34 -0.01 0.00 -3.10 0.00 0.00 33.47 30.60 1o9a s TRP 34 CO 0.23 -0.50 0.73 -1.21 -2.66 0.00 0.00 176.95 173.53 1o9a s GLU 35 N -0.50 4.00 -0.01 3.25 2.02 -1.26 -1.39 118.70 124.81 1o9a s GLU 35 Ca -0.06 0.55 0.03 0.00 0.02 0.00 0.00 54.97 55.51 1o9a s GLU 35 Cb -0.02 -3.71 -0.01 0.00 0.10 0.00 0.00 34.13 30.49 1o9a s GLU 35 CO 0.06 -0.59 -0.09 -0.98 0.02 0.00 0.00 175.26 173.68 1o9a s ARG 36 N 2.78 0.73 0.05 1.61 1.70 -0.82 -4.97 118.95 120.03 1o9a s ARG 36 Ca 0.30 -0.32 -0.12 0.00 -0.47 0.00 0.00 55.73 55.12 1o9a s ARG 36 Cb -0.15 -0.71 -0.06 0.00 -0.57 0.00 0.00 34.95 33.47 1o9a s ARG 36 CO 0.11 0.19 0.40 0.99 -1.08 0.00 0.00 175.30 175.91 1o9a s THR 37 N -0.21 5.08 -0.18 4.99 2.01 -1.26 -0.74 115.64 125.32 1o9a s THR 37 Ca 0.03 0.60 -0.02 0.00 0.31 0.00 0.00 61.69 62.62 1o9a s THR 37 Cb -0.03 -3.66 0.05 0.00 0.01 0.00 0.00 72.50 68.86 1o9a s THR 37 CO -0.00 0.41 -0.00 -0.47 -0.69 0.00 0.00 174.62 173.86 1o9a s TYR 38 N -1.27 1.38 0.00 4.92 5.04 -0.17 -4.86 117.35 122.39 1o9a s TYR 38 Ca 0.29 -0.99 0.00 0.00 -2.44 0.00 0.00 57.07 53.93 1o9a s TYR 38 Cb -0.15 -1.16 0.00 0.00 0.35 0.00 0.00 41.96 41.00 1o9a s TYR 38 CO 0.16 -0.61 0.00 1.28 -1.34 0.00 0.00 175.55 175.04 1o9a n LEU 39 N 4.96 0.00 0.00 6.97 4.77 -1.26 -2.37 117.00 130.06 1o9a n LEU 39 Ca -0.10 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.88 1o9a n LEU 39 Cb 0.47 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.56 1o9a n LEU 39 CO 0.14 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 176.81 1o9a n GLY 40 N 0.00 0.00 3.22 -0.72 0.00 -1.26 -5.14 105.19 101.29 1o9a n GLY 40 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 1o9a n GLY 40 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1o9a s ASN 41 N 0.00 3.25 -0.42 1.61 0.01 -1.00 -5.09 114.94 113.29 1o9a s ASN 41 Ca 0.00 -0.55 -0.27 0.00 -0.71 0.00 0.00 52.86 51.33 1o9a s ASN 41 Cb 0.00 -1.46 0.02 0.00 0.41 0.00 0.00 41.25 40.22 1o9a s ASN 41 CO 0.00 0.12 1.00 0.00 -1.51 0.00 0.00 177.10 176.71 1o9a s ALA 42 N 0.60 3.29 0.02 0.60 0.00 -1.26 -1.00 121.76 124.00 1o9a s ALA 42 Ca -0.12 -0.52 0.03 0.00 0.00 0.00 0.00 51.96 51.36 1o9a s ALA 42 Cb -0.16 -3.69 -0.03 0.00 0.00 0.00 0.00 23.12 19.23 1o9a s ALA 42 CO 0.03 -1.92 -0.06 -0.51 0.00 0.00 0.00 175.76 173.30 1o9a s LEU 43 N 3.87 3.22 -0.58 0.00 1.02 0.08 -0.64 118.68 125.65 1o9a s LEU 43 Ca 0.41 -0.15 -0.24 0.00 0.02 0.00 0.00 54.13 54.18 1o9a s LEU 43 Cb -0.10 -1.86 0.05 0.00 0.02 0.00 0.00 46.19 44.29 1o9a s LEU 43 CO 0.25 0.27 0.96 -0.69 0.02 0.00 0.00 176.35 177.15 1o9a s VAL 44 N -1.04 4.36 0.31 -1.59 1.01 0.10 -1.95 120.40 121.60 1o9a s VAL 44 Ca 0.18 0.16 -0.27 0.00 0.00 0.00 0.00 61.98 62.05 1o9a s VAL 44 Cb -0.11 -4.58 -0.10 0.00 0.00 0.00 0.00 36.38 31.59 1o9a s VAL 44 CO 0.09 -1.20 0.96 0.00 0.00 0.00 0.00 175.10 174.94 1o9a s THR 46 N -1.53 1.14 0.65 0.00 2.01 -0.77 -2.35 115.64 114.80 1o9a s THR 46 Ca 0.49 -0.67 -0.12 0.00 0.31 0.00 0.00 61.69 61.70 1o9a s THR 46 Cb -0.21 -1.32 -0.02 0.00 0.01 0.00 0.00 72.50 70.97 1o9a s THR 46 CO 0.26 0.12 1.05 0.00 -0.69 0.00 0.00 174.62 175.36 1o9a n TYR 48 N -2.83 0.00 0.00 0.00 4.01 -1.23 -3.40 117.16 113.71 1o9a n TYR 48 Ca 0.07 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.81 1o9a n TYR 48 Cb 0.54 0.10 0.00 0.00 -0.31 0.00 0.00 39.34 39.67 1o9a n TYR 48 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1o9a n GLY 49 N 2.70 0.00 4.92 2.72 0.00 -1.26 -4.54 105.19 109.72 1o9a n GLY 49 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1o9a n GLY 49 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1o9a n GLY 50 N 0.00 1.54 0.30 -0.02 0.00 -1.16 -4.53 105.19 101.32 1o9a n GLY 50 Ca 0.00 -0.03 0.17 0.00 0.00 0.00 0.00 46.02 46.16 1o9a n GLY 50 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1o9a h SER 51 N 0.00 0.00 -0.26 1.61 0.02 -1.95 -1.18 113.55 111.79 1o9a h SER 51 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1o9a h SER 51 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 1o9a h SER 51 CO 0.00 0.04 0.00 0.54 -1.14 0.00 0.00 176.83 176.27 1o9a n ARG 52 N -3.51 2.22 -0.10 3.45 1.74 -1.26 -5.10 116.66 114.10 1o9a n ARG 52 Ca -0.02 -1.82 0.01 0.00 -0.77 0.00 0.00 57.85 55.25 1o9a n ARG 52 Cb 0.15 -1.26 -0.00 0.00 -1.02 0.00 0.00 32.46 30.32 1o9a n ARG 52 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1o9a n GLY 53 N 0.59 -0.81 3.21 -0.13 0.00 -0.45 -4.86 105.19 102.73 1o9a n GLY 53 Ca 0.11 -0.81 -0.24 0.00 0.00 0.00 0.00 46.02 45.08 1o9a n GLY 53 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1o9a s PHE 54 N -0.17 1.59 -0.19 1.61 -0.12 -1.26 -3.49 117.98 115.94 1o9a s PHE 54 Ca 0.00 -0.36 -0.08 0.00 -0.05 0.00 0.00 56.93 56.44 1o9a s PHE 54 Cb 0.00 -0.95 -0.04 0.00 -0.63 0.00 0.00 43.02 41.40 1o9a s PHE 54 CO 0.00 0.06 0.08 1.21 -0.05 0.00 0.00 175.22 176.52 1o9a s ASN 55 N -1.09 5.78 -0.10 1.98 2.47 -1.07 -4.86 114.94 118.05 1o9a s ASN 55 Ca 0.05 0.12 -0.04 0.00 0.42 0.00 0.00 52.86 53.41 1o9a s ASN 55 Cb -0.08 -2.00 -0.04 0.00 -1.45 0.00 0.00 41.25 37.68 1o9a s ASN 55 CO 0.01 0.17 0.05 0.00 -3.72 0.00 0.00 177.10 173.62 1o9a s GLU 57 N -0.91 0.11 0.03 0.00 2.02 -1.20 -4.93 118.70 113.82 1o9a s GLU 57 Ca 0.14 0.08 -0.30 0.00 0.02 0.00 0.00 54.97 54.91 1o9a s GLU 57 Cb -0.12 0.05 -0.15 0.00 0.10 0.00 0.00 34.13 34.01 1o9a s GLU 57 CO 0.03 -0.01 0.76 -1.13 0.02 0.00 0.00 175.26 174.92 1o9a n SER 58 N 2.97 -0.21 -4.92 -0.19 3.41 -1.26 0.00 113.62 113.42 1o9a n SER 58 Ca -0.13 0.91 -0.27 0.00 -0.26 0.00 0.00 58.87 59.13 1o9a n SER 58 Cb 0.59 -0.73 -0.02 0.00 -0.26 0.00 0.00 64.21 63.78 1o9a n SER 58 CO 0.00 0.00 0.00 -1.59 -0.16 0.00 0.00 175.04 173.29 1o9a s LYS 59 N -0.16 3.57 -0.24 4.33 0.00 0.18 -4.52 119.74 122.90 1o9a s LYS 59 Ca 0.68 -0.14 -0.17 0.00 0.00 0.00 0.00 55.97 56.34 1o9a s LYS 59 Cb -0.95 -2.67 -0.03 0.00 0.00 0.00 0.00 37.83 34.18 1o9a s LYS 59 CO 0.45 0.21 0.48 -1.25 0.00 0.00 0.00 175.35 175.24 1o9a s PRO 60 N -3.77 4.10 0.00 1.78 0.04 -1.26 -4.90 135.00 130.99 1o9a s PRO 60 Ca 0.42 0.28 0.00 0.00 0.04 0.00 0.00 61.00 61.75 1o9a s PRO 60 Cb -0.10 -3.62 0.00 0.00 0.04 0.00 0.00 34.50 30.82 1o9a s PRO 60 CO 0.32 -0.26 0.00 0.39 0.04 0.00 0.00 177.00 177.49 1o9a n GLU 61 N 5.22 2.95 0.00 4.56 1.02 -1.26 -5.11 120.64 128.01 1o9a n GLU 61 Ca -0.05 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.09 1o9a n GLU 61 Cb 0.50 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.92 1o9a n GLU 61 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1o9a n ALA 62 N -3.00 1.82 -1.47 0.62 0.00 -1.26 -4.94 120.51 112.28 1o9a n ALA 62 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 53.09 1o9a n ALA 62 Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.41 1o9a n ALA 62 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1o9a n GLU 63 N -1.77 3.64 -1.79 0.00 -0.58 -1.26 -4.96 120.64 113.92 1o9a n GLU 63 Ca 0.00 -2.40 -0.38 0.00 -0.42 0.00 0.00 57.16 53.97 1o9a n GLU 63 Cb 0.00 -2.61 0.05 0.00 -0.57 0.00 0.00 31.44 28.31 1o9a n GLU 63 CO 0.00 0.00 0.00 -1.21 -0.48 0.00 0.00 177.13 175.44 1o9a s GLU 64 N 0.85 2.98 0.19 3.49 2.02 -1.26 -5.01 118.70 121.95 1o9a s GLU 64 Ca 0.65 2.16 -0.01 0.00 0.02 0.00 0.00 54.97 57.78 1o9a s GLU 64 Cb 0.21 -2.13 0.01 0.00 0.10 0.00 0.00 34.13 32.32 1o9a s GLU 64 CO -0.07 -1.29 0.27 0.25 0.02 0.00 0.00 175.26 174.43 1o9a n THR 65 N -1.30 0.00 -3.68 3.63 -2.24 -1.26 -3.32 114.28 106.11 1o9a n THR 65 Ca 0.12 -0.91 -0.14 0.00 -2.27 0.00 0.00 64.05 60.86 1o9a n THR 65 Cb 0.46 0.57 -0.14 0.00 -2.10 0.00 0.00 70.33 69.13 1o9a n THR 65 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1o9a s PHE 67 N 2.11 3.56 -0.27 0.00 5.36 -1.26 -0.99 117.98 126.48 1o9a s PHE 67 Ca -0.01 0.47 -0.03 0.00 -0.96 0.00 0.00 56.93 56.40 1o9a s PHE 67 Cb -0.12 -1.92 0.03 0.00 -0.34 0.00 0.00 43.02 40.68 1o9a s PHE 67 CO -0.08 0.61 -0.01 0.34 -1.46 0.00 0.00 175.22 174.62 1o9a s ASP 68 N -1.90 4.66 0.00 6.13 2.15 -0.44 -4.95 116.67 122.32 1o9a s ASP 68 Ca 0.29 -0.95 0.20 0.00 0.43 0.00 0.00 52.55 52.52 1o9a s ASP 68 Cb -0.13 -1.73 1.06 0.00 -0.30 0.00 0.00 42.92 41.83 1o9a s ASP 68 CO 0.18 -0.18 1.70 0.29 -0.17 0.00 0.00 175.17 177.00 1o9a n LYS 69 N 4.70 1.22 -0.00 4.34 4.01 -1.26 -0.19 118.16 130.98 1o9a n LYS 69 Ca -0.15 -0.32 -0.16 0.00 -0.51 0.00 0.00 58.31 57.16 1o9a n LYS 69 Cb 0.46 -1.34 -0.14 0.00 -0.51 0.00 0.00 35.03 33.50 1o9a n LYS 69 CO 0.00 0.00 0.00 0.66 -1.11 0.00 0.00 177.40 176.95 1o9a n TYR 70 N -0.48 1.18 -0.00 2.13 4.02 -1.26 -4.53 117.16 118.22 1o9a n TYR 70 Ca 0.15 0.31 0.01 0.00 -0.01 0.00 0.00 57.90 58.36 1o9a n TYR 70 Cb 0.15 -1.18 -0.02 0.00 -0.02 0.00 0.00 39.34 38.27 1o9a n TYR 70 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 176.86 176.10 1o9a n THR 71 N -3.31 0.04 -1.27 -0.72 -2.24 -1.22 -5.03 114.28 100.52 1o9a n THR 71 Ca -0.26 -0.08 0.00 0.00 -2.27 0.00 0.00 64.05 61.44 1o9a n THR 71 Cb 1.05 0.16 0.00 0.00 -2.10 0.00 0.00 70.33 69.44 1o9a n THR 71 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1o9a n GLY 72 N 2.43 0.76 3.43 3.38 0.00 0.74 -5.08 105.19 110.86 1o9a n GLY 72 Ca -0.01 -0.68 -0.29 0.00 0.00 0.00 0.00 46.02 45.04 1o9a n GLY 72 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1o9a s ASN 73 N -2.72 3.57 -0.06 1.61 0.01 -1.17 -4.94 114.94 111.24 1o9a s ASN 73 Ca 0.00 -0.66 0.00 0.00 -0.71 0.00 0.00 52.86 51.49 1o9a s ASN 73 Cb 0.00 -0.37 -0.03 0.00 0.41 0.00 0.00 41.25 41.26 1o9a s ASN 73 CO 0.00 0.18 -0.03 -0.89 -1.51 0.00 0.00 177.10 174.85 1o9a s THR 74 N -1.10 4.00 0.22 1.60 2.01 -1.26 -1.33 115.64 119.78 1o9a s THR 74 Ca 0.16 -0.42 0.07 0.00 0.31 0.00 0.00 61.69 61.81 1o9a s THR 74 Cb -0.10 -2.68 -0.05 0.00 0.01 0.00 0.00 72.50 69.68 1o9a s THR 74 CO 0.08 0.56 -0.13 -0.31 -0.69 0.00 0.00 174.62 174.14 1o9a s TYR 75 N -0.88 1.74 0.18 4.92 1.51 -0.16 -4.99 117.35 119.67 1o9a s TYR 75 Ca 0.14 -0.61 0.04 0.00 -1.01 0.00 0.00 57.07 55.63 1o9a s TYR 75 Cb -0.11 -0.85 -0.03 0.00 -0.11 0.00 0.00 41.96 40.85 1o9a s TYR 75 CO 0.03 0.33 0.26 1.03 -1.11 0.00 0.00 175.55 176.09 1o9a s ARG 76 N -3.67 3.28 -0.17 -0.62 3.00 -1.26 -0.54 118.95 118.98 1o9a s ARG 76 Ca 0.24 -0.72 -0.29 0.00 0.00 0.00 0.00 55.73 54.96 1o9a s ARG 76 Cb 0.00 -2.85 -0.06 0.00 0.00 0.00 0.00 34.95 32.04 1o9a s ARG 76 CO 0.08 0.49 2.18 0.28 0.00 0.00 0.00 175.30 178.32 1o9a n VAL 77 N -0.71 0.43 0.00 3.52 0.31 -1.21 -2.23 118.33 118.44 1o9a n VAL 77 Ca -0.08 -0.40 0.00 0.00 -0.01 0.00 0.00 64.34 63.86 1o9a n VAL 77 Cb 0.55 -2.51 0.00 0.00 -0.91 0.00 0.00 33.84 30.97 1o9a n VAL 77 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1o9a n GLY 78 N 5.53 1.60 3.72 2.92 0.00 -0.96 -5.00 105.19 112.99 1o9a n GLY 78 Ca 0.28 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 46.01 1o9a n GLY 78 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1o9a s ASP 79 N -2.00 4.11 0.05 1.61 1.01 -0.95 -5.01 116.67 115.50 1o9a s ASP 79 Ca 0.00 -1.43 -0.01 0.00 0.71 0.00 0.00 52.55 51.82 1o9a s ASP 79 Cb 0.00 0.02 -0.04 0.00 1.01 0.00 0.00 42.92 43.91 1o9a s ASP 79 CO 0.00 -0.67 -0.03 0.42 0.21 0.00 0.00 175.17 175.10 1o9a s THR 80 N -2.77 0.22 0.09 -1.27 -4.23 -1.26 -0.84 115.64 105.58 1o9a s THR 80 Ca 0.24 -1.61 -0.18 0.00 -1.18 0.00 0.00 61.69 58.96 1o9a s THR 80 Cb 0.05 -1.25 0.04 0.00 1.34 0.00 0.00 72.50 72.68 1o9a s THR 80 CO 0.13 -0.88 0.43 -0.72 -0.54 0.00 0.00 174.62 173.03 1o9a s TYR 81 N -3.36 -0.27 -0.23 3.99 1.13 -1.05 -4.96 117.35 112.61 1o9a s TYR 81 Ca 0.02 0.09 -0.05 0.00 -1.41 0.00 0.00 57.07 55.73 1o9a s TYR 81 Cb 0.04 0.27 -0.01 0.00 -1.10 0.00 0.00 41.96 41.16 1o9a s TYR 81 CO -0.08 -0.66 -0.02 -1.21 -2.51 0.00 0.00 175.55 171.08 1o9a s GLU 82 N -3.20 3.41 -0.03 -3.49 2.02 -1.26 -2.96 118.70 113.18 1o9a s GLU 82 Ca -0.01 -0.61 -0.01 0.00 0.02 0.00 0.00 54.97 54.36 1o9a s GLU 82 Cb 0.01 -3.09 0.03 0.00 0.10 0.00 0.00 34.13 31.18 1o9a s GLU 82 CO -0.08 -0.21 0.05 1.03 0.02 0.00 0.00 175.26 176.08 1o9a s ARG 83 N 1.50 -0.04 0.97 1.61 3.00 -0.04 -5.00 118.95 120.95 1o9a s ARG 83 Ca 0.06 0.27 -0.13 0.00 0.00 0.00 0.00 55.73 55.92 1o9a s ARG 83 Cb -0.15 -0.31 0.17 0.00 0.00 0.00 0.00 34.95 34.66 1o9a s ARG 83 CO -0.02 -0.22 1.14 -1.25 0.00 0.00 0.00 175.30 174.96 1o9a s PRO 84 N 1.43 0.66 -0.29 3.54 0.04 -1.26 -0.43 135.00 138.69 1o9a s PRO 84 Ca -0.05 0.23 -0.18 0.00 0.04 0.00 0.00 61.00 61.04 1o9a s PRO 84 Cb -0.13 -1.79 0.16 0.00 0.04 0.00 0.00 34.50 32.78 1o9a s PRO 84 CO -0.03 -2.51 1.07 0.15 0.04 0.00 0.00 177.00 175.72 1o9a s LYS 85 N -5.28 0.31 0.00 4.56 1.02 0.01 -4.67 119.74 115.68 1o9a s LYS 85 Ca 0.66 0.50 0.00 0.00 0.02 0.00 0.00 55.97 57.15 1o9a s LYS 85 Cb -0.14 0.09 0.00 0.00 -0.52 0.00 0.00 37.83 37.26 1o9a s LYS 85 CO 0.54 -0.06 0.00 -0.25 -0.92 0.00 0.00 175.35 174.67 1o9a n ASP 86 N 3.20 0.00 0.00 2.83 8.00 -1.26 -1.86 116.55 127.46 1o9a n ASP 86 Ca -0.17 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.33 1o9a n ASP 86 Cb 0.57 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.67 1o9a n ASP 86 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1o9a n SER 87 N 2.80 0.00 -1.24 -2.24 7.64 -1.26 -5.15 113.62 114.17 1o9a n SER 87 Ca 0.00 -0.39 0.00 0.00 1.01 0.00 0.00 58.87 59.49 1o9a n SER 87 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 1o9a n SER 87 CO 0.00 0.00 0.00 0.23 -3.01 0.00 0.00 175.04 172.26 1o9a n MET 88 N 0.00 2.72 -4.23 1.43 2.81 -0.78 -5.15 117.12 113.93 1o9a n MET 88 Ca 0.00 0.00 -0.25 0.00 -1.81 0.00 0.00 57.70 55.64 1o9a n MET 88 Cb 0.10 0.00 -0.17 0.00 -0.71 0.00 0.00 33.22 32.45 1o9a n MET 88 CO 0.00 0.00 0.00 -1.50 1.51 0.00 0.00 175.97 175.98 1o9a s ILE 89 N -0.19 1.03 -0.20 2.02 1.10 -1.26 -0.81 121.20 122.89 1o9a s ILE 89 Ca 0.00 -0.36 -0.06 0.00 -0.51 0.00 0.00 60.65 59.72 1o9a s ILE 89 Cb 0.00 -1.00 -0.03 0.00 0.15 0.00 0.00 42.46 41.58 1o9a s ILE 89 CO 0.00 0.35 0.03 0.26 -2.11 0.00 0.00 174.94 173.47 1o9a s TRP 90 N 1.18 3.11 -1.25 3.50 0.52 0.43 -1.45 118.94 124.98 1o9a s TRP 90 Ca -0.05 -0.25 -0.04 0.00 0.02 0.00 0.00 56.10 55.78 1o9a s TRP 90 Cb -0.14 -2.10 0.17 0.00 -1.15 0.00 0.00 33.47 30.25 1o9a s TRP 90 CO -0.02 -0.11 2.23 -0.25 0.02 0.00 0.00 176.95 178.82 1o9a n ASP 91 N 4.05 7.80 -4.76 2.95 9.92 0.82 -0.87 116.55 136.47 1o9a n ASP 91 Ca -0.17 -3.27 -0.41 0.00 -0.53 0.00 0.00 54.79 50.41 1o9a n ASP 91 Cb 0.52 -1.32 0.01 0.00 -0.64 0.00 0.00 41.12 39.69 1o9a n ASP 91 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1o9a s THR 93 N -1.15 3.72 -0.27 0.00 -4.23 0.22 -2.52 115.64 111.42 1o9a s THR 93 Ca 0.56 -0.94 -0.15 0.00 -1.18 0.00 0.00 61.69 59.99 1o9a s THR 93 Cb -0.48 -2.69 -0.04 0.00 1.34 0.00 0.00 72.50 70.63 1o9a s THR 93 CO 0.61 0.25 0.38 0.00 -0.54 0.00 0.00 174.62 175.32 1o9a n ILE 95 N 5.08 0.00 0.03 0.00 2.08 -0.78 -2.27 119.36 123.49 1o9a n ILE 95 Ca -0.08 0.00 0.00 0.00 0.56 0.00 0.00 62.75 63.23 1o9a n ILE 95 Cb 0.51 0.00 0.00 0.00 -0.75 0.00 0.00 39.64 39.40 1o9a n ILE 95 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1o9a n GLY 96 N 3.89 -0.71 3.62 7.39 0.00 -1.24 -3.28 105.19 114.86 1o9a n GLY 96 Ca 0.00 0.20 -0.21 0.00 0.00 0.00 0.00 46.02 46.01 1o9a n GLY 96 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1o9a n ALA 97 N -2.51 -2.08 -1.10 4.61 0.00 -1.26 -0.92 120.51 117.24 1o9a n ALA 97 Ca 0.00 -0.13 -0.03 0.00 0.00 0.00 0.00 53.44 53.27 1o9a n ALA 97 Cb 0.00 -2.41 -0.01 0.00 0.00 0.00 0.00 19.45 17.03 1o9a n ALA 97 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1o9a n GLY 98 N -1.48 0.50 0.17 0.00 0.00 -1.26 -4.76 105.19 98.35 1o9a n GLY 98 Ca -0.27 -0.11 0.00 0.00 0.00 0.00 0.00 46.02 45.64 1o9a n GLY 98 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1o9a n ARG 99 N -1.08 0.00 0.00 1.61 1.74 -0.10 -4.60 116.66 114.23 1o9a n ARG 99 Ca -0.03 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.05 1o9a n ARG 99 Cb 0.34 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.78 1o9a n ARG 99 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1o9a n GLY 100 N 2.33 -0.07 3.59 -0.13 0.00 -0.27 -4.88 105.19 105.77 1o9a n GLY 100 Ca 0.00 -0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.77 1o9a n GLY 100 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1o9a s ARG 101 N 0.00 1.98 -0.19 1.61 1.04 -1.20 -4.89 118.95 117.29 1o9a s ARG 101 Ca 0.00 -1.79 -0.01 0.00 -1.04 0.00 0.00 55.73 52.89 1o9a s ARG 101 Cb 0.00 -1.86 0.05 0.00 -2.04 0.00 0.00 34.95 31.10 1o9a s ARG 101 CO 0.00 0.17 -0.03 0.42 -0.04 0.00 0.00 175.30 175.82 1o9a s ILE 102 N -2.53 1.08 -0.01 4.99 1.01 -1.26 -1.87 121.20 122.59 1o9a s ILE 102 Ca 0.33 -0.77 -0.23 0.00 0.00 0.00 0.00 60.65 59.99 1o9a s ILE 102 Cb -0.00 -1.36 -0.05 0.00 0.01 0.00 0.00 42.46 41.07 1o9a s ILE 102 CO 0.18 -0.01 0.70 -0.55 0.00 0.00 0.00 174.94 175.26 1o9a s SER 103 N 1.63 7.06 -0.20 3.58 0.15 -0.34 -4.96 113.70 120.62 1o9a s SER 103 Ca -0.01 1.27 0.01 0.00 0.70 0.00 0.00 55.95 57.92 1o9a s SER 103 Cb -0.17 -2.42 0.03 0.00 -1.71 0.00 0.00 66.02 61.75 1o9a s SER 103 CO -0.07 -0.02 -0.17 0.00 1.20 0.00 0.00 173.24 174.18 1o9a s THR 105 N 1.27 2.06 0.38 0.00 2.01 -1.26 -4.93 115.64 115.18 1o9a s THR 105 Ca 0.01 -1.75 -0.14 0.00 0.31 0.00 0.00 61.69 60.12 1o9a s THR 105 Cb -0.15 -1.87 -0.08 0.00 0.01 0.00 0.00 72.50 70.41 1o9a s THR 105 CO -0.11 -0.03 0.80 -0.63 -0.69 0.00 0.00 174.62 173.96 1o9a s ILE 106 N -1.28 4.67 -0.44 1.82 -1.09 -1.26 -0.12 121.20 123.48 1o9a s ILE 106 Ca 0.13 0.93 0.04 0.00 -2.23 0.00 0.00 60.65 59.52 1o9a s ILE 106 Cb -0.09 -3.66 0.27 0.00 -1.58 0.00 0.00 42.46 37.40 1o9a s ILE 106 CO 0.06 -0.37 1.03 0.00 -1.23 0.00 0.00 174.94 174.44 1o9a n ALA 107 N -0.84 -1.77 -2.16 9.38 0.00 -0.53 -4.66 120.51 119.94 1o9a n ALA 107 Ca 0.04 -1.16 -0.43 0.00 0.00 0.00 0.00 53.44 51.89 1o9a n ALA 107 Cb 0.54 -1.74 -0.02 0.00 0.00 0.00 0.00 19.45 18.22 1o9a n ALA 107 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 1o9a s ASN 108 N -1.26 6.47 0.00 0.00 2.47 -1.25 -4.72 114.94 116.65 1o9a s ASN 108 Ca 0.28 1.62 0.21 0.00 0.42 0.00 0.00 52.86 55.39 1o9a s ASN 108 Cb 0.24 -2.53 1.23 0.00 -1.45 0.00 0.00 41.25 38.74 1o9a s ASN 108 CO -0.17 -1.18 1.62 -1.14 -3.72 0.00 0.00 177.10 172.50