#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 2.27 0.24 -1.46 -0.14 -1.26 -4.99 119.74 114.40 1o9a s LYS 18 Ca 0.00 -1.42 -0.05 0.00 -1.36 0.00 0.00 55.97 53.13 1o9a s LYS 18 Cb 0.00 -3.25 0.36 0.00 -1.68 0.00 0.00 37.83 33.26 1o9a s LYS 18 CO 0.00 -0.73 1.81 -1.35 -0.76 0.00 0.00 175.35 174.32 1o9a h PRO 19 N 7.97 0.75 0.00 -1.68 0.11 -2.00 -3.47 132.00 133.68 1o9a h PRO 19 Ca -0.18 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.88 1o9a h PRO 19 Cb 1.05 -0.17 0.00 0.00 0.11 0.00 0.00 31.00 32.00 1o9a h PRO 19 CO 0.56 0.49 0.00 0.41 -0.21 0.00 0.00 178.00 179.26 1o9a n GLY 20 N -1.31 0.32 3.26 -0.55 0.00 -1.26 -3.34 105.19 102.32 1o9a n GLY 20 Ca 0.12 -0.09 -0.14 0.00 0.00 0.00 0.00 46.02 45.91 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 -3.49 3.17 0.70 0.00 6.14 -1.26 -2.38 117.35 120.23 1o9a s TYR 22 Ca 0.22 -2.36 -0.08 0.00 0.64 0.00 0.00 57.07 55.48 1o9a s TYR 22 Cb 0.05 -2.09 0.05 0.00 0.42 0.00 0.00 41.96 40.38 1o9a s TYR 22 CO 0.03 -0.88 1.03 0.34 0.64 0.00 0.00 175.55 176.71 1o9a s ASP 23 N 1.13 4.94 -0.57 4.32 2.15 0.28 -4.84 116.67 124.08 1o9a s ASP 23 Ca -0.03 0.60 -0.11 0.00 0.43 0.00 0.00 52.55 53.45 1o9a s ASP 23 Cb -0.19 -1.30 -0.15 0.00 -0.30 0.00 0.00 42.92 40.97 1o9a s ASP 23 CO -0.07 -1.54 1.69 -3.20 -0.17 0.00 0.00 175.17 171.88 1o9a n ASN 24 N -2.94 -0.77 0.00 -0.34 2.85 -1.26 -1.12 115.26 111.68 1o9a n ASN 24 Ca 0.07 -1.40 0.00 0.00 -0.11 0.00 0.00 54.58 53.15 1o9a n ASN 24 Cb 0.60 -0.93 0.00 0.00 1.24 0.00 0.00 39.78 40.69 1o9a n ASN 24 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1o9a n GLY 25 N 5.36 2.98 3.63 8.20 0.00 -1.26 -4.99 105.19 119.12 1o9a n GLY 25 Ca 0.32 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.99 1o9a n GLY 25 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1o9a s LYS 26 N 0.00 3.17 -0.15 1.61 2.20 -0.28 -5.11 119.74 121.19 1o9a s LYS 26 Ca 0.00 -0.44 -0.06 0.00 -0.36 0.00 0.00 55.97 55.11 1o9a s LYS 26 Cb 0.00 -2.83 -0.04 0.00 -1.51 0.00 0.00 37.83 33.45 1o9a s LYS 26 CO 0.00 0.58 0.06 -3.38 -0.36 0.00 0.00 175.35 172.25 1o9a s HIS 27 N -0.54 3.30 0.25 4.03 -3.43 -1.26 0.99 115.29 118.62 1o9a s HIS 27 Ca 0.09 0.19 0.05 0.00 -0.80 0.00 0.00 55.06 54.59 1o9a s HIS 27 Cb -0.12 -1.98 -0.05 0.00 -1.43 0.00 0.00 32.58 29.00 1o9a s HIS 27 CO 0.02 0.35 -0.05 0.71 -2.00 0.00 0.00 174.74 173.77 1o9a s TYR 28 N -0.21 1.74 0.65 0.38 2.02 -1.00 -4.95 117.35 115.97 1o9a s TYR 28 Ca 0.08 -0.77 0.02 0.00 -0.37 0.00 0.00 57.07 56.03 1o9a s TYR 28 Cb -0.12 -0.98 0.10 0.00 -0.40 0.00 0.00 41.96 40.56 1o9a s TYR 28 CO 0.01 0.16 0.90 1.14 -1.57 0.00 0.00 175.55 176.19 1o9a s GLN 29 N -3.77 2.01 0.41 -0.62 -2.07 -1.26 -2.29 119.66 112.07 1o9a s GLN 29 Ca 0.27 -1.17 -0.26 0.00 -1.82 0.00 0.00 55.36 52.38 1o9a s GLN 29 Cb 0.04 -2.44 -0.09 0.00 -1.09 0.00 0.00 33.01 29.43 1o9a s GLN 29 CO 0.09 -1.15 1.36 0.42 -1.32 0.00 0.00 175.29 174.70 1o9a s ILE 30 N -2.94 2.40 0.00 3.63 1.09 -1.21 -2.14 121.20 122.03 1o9a s ILE 30 Ca 0.63 0.36 0.00 0.00 -1.10 0.00 0.00 60.65 60.54 1o9a s ILE 30 Cb -0.06 -3.22 0.00 0.00 -1.06 0.00 0.00 42.46 38.12 1o9a s ILE 30 CO 0.42 0.06 0.00 0.59 -0.10 0.00 0.00 174.94 175.90 1o9a n ASN 31 N 0.11 0.00 -4.77 3.58 4.13 -0.24 -4.95 115.26 113.12 1o9a n ASN 31 Ca 0.04 0.00 -0.39 0.00 1.68 0.00 0.00 54.58 55.91 1o9a n ASN 31 Cb 0.42 -1.55 -0.05 0.00 -1.54 0.00 0.00 39.78 37.06 1o9a n ASN 31 CO 0.00 0.00 0.00 -1.58 0.28 0.00 0.00 177.26 175.96 1o9a s GLN 32 N -0.50 4.54 0.22 3.52 0.74 -0.91 -4.65 119.66 122.62 1o9a s GLN 32 Ca 0.00 1.60 0.11 0.00 0.05 0.00 0.00 55.36 57.12 1o9a s GLN 32 Cb 0.00 -2.97 -0.05 0.00 1.10 0.00 0.00 33.01 31.09 1o9a s GLN 32 CO 0.00 0.18 -0.22 -0.65 -0.55 0.00 0.00 175.29 174.05 1o9a s GLN 33 N -1.78 1.56 0.28 1.67 1.11 -1.26 -3.23 119.66 118.01 1o9a s GLN 33 Ca 0.48 -1.60 -0.19 0.00 0.01 0.00 0.00 55.36 54.06 1o9a s GLN 33 Cb -0.26 -1.78 0.02 0.00 -1.01 0.00 0.00 33.01 29.97 1o9a s GLN 33 CO 0.33 0.37 0.67 1.67 0.01 0.00 0.00 175.29 178.34 1o9a s TRP 34 N -1.99 -0.06 -0.01 0.91 -2.14 -0.89 -4.98 118.94 109.77 1o9a s TRP 34 Ca 0.24 -0.39 -0.23 0.00 2.66 0.00 0.00 56.10 58.38 1o9a s TRP 34 Cb -0.07 0.60 -0.05 0.00 -3.10 0.00 0.00 33.47 30.85 1o9a s TRP 34 CO 0.11 -1.20 0.69 -1.21 -2.66 0.00 0.00 176.95 172.69 1o9a s GLU 35 N -3.89 4.42 -0.22 3.25 2.02 -1.26 -1.27 118.70 121.76 1o9a s GLU 35 Ca 0.14 0.90 -0.08 0.00 0.02 0.00 0.00 54.97 55.95 1o9a s GLU 35 Cb -0.05 -3.39 0.10 0.00 0.10 0.00 0.00 34.13 30.89 1o9a s GLU 35 CO 0.08 0.22 0.47 0.50 0.02 0.00 0.00 175.26 176.54 1o9a s ARG 36 N 0.25 0.38 0.22 1.61 3.00 -0.37 -4.92 118.95 119.12 1o9a s ARG 36 Ca 0.36 1.11 -0.14 0.00 -1.00 0.00 0.00 55.73 56.05 1o9a s ARG 36 Cb -0.19 0.42 -0.08 0.00 0.00 0.00 0.00 34.95 35.10 1o9a s ARG 36 CO 0.19 -0.23 0.63 0.99 0.00 0.00 0.00 175.30 176.88 1o9a s THR 37 N 2.59 4.77 -0.12 4.11 2.01 -1.26 -0.54 115.64 127.20 1o9a s THR 37 Ca -0.03 0.87 -0.02 0.00 0.31 0.00 0.00 61.69 62.81 1o9a s THR 37 Cb -0.12 -3.71 0.04 0.00 0.01 0.00 0.00 72.50 68.73 1o9a s THR 37 CO -0.14 0.07 0.03 -0.47 -0.69 0.00 0.00 174.62 173.42 1o9a s TYR 38 N -1.67 0.64 0.00 4.92 5.04 0.73 -4.91 117.35 122.10 1o9a s TYR 38 Ca 0.45 -0.36 0.00 0.00 -2.44 0.00 0.00 57.07 54.72 1o9a s TYR 38 Cb -0.13 -0.82 0.00 0.00 0.35 0.00 0.00 41.96 41.36 1o9a s TYR 38 CO 0.20 -0.43 0.00 1.28 -1.34 0.00 0.00 175.55 175.26 1o9a n LEU 39 N 5.16 0.00 0.00 6.97 4.77 -1.26 -2.60 117.00 130.04 1o9a n LEU 39 Ca -0.07 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.91 1o9a n LEU 39 Cb 0.49 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.58 1o9a n LEU 39 CO 0.11 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 176.78 1o9a n GLY 40 N 0.00 0.17 3.28 -0.72 0.00 -1.26 -5.14 105.19 101.51 1o9a n GLY 40 Ca 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.74 1o9a n GLY 40 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1o9a s ASN 41 N 0.00 2.73 -0.51 1.61 2.20 -1.07 -4.92 114.94 114.98 1o9a s ASN 41 Ca 0.00 -0.50 -0.21 0.00 -0.94 0.00 0.00 52.86 51.21 1o9a s ASN 41 Cb 0.00 -0.26 0.05 0.00 -2.00 0.00 0.00 41.25 39.03 1o9a s ASN 41 CO 0.00 0.23 0.72 0.00 -2.94 0.00 0.00 177.10 175.12 1o9a s ALA 42 N -0.69 3.31 -0.09 3.54 0.00 -1.26 -0.20 121.76 126.37 1o9a s ALA 42 Ca 0.09 -1.49 0.01 0.00 0.00 0.00 0.00 51.96 50.56 1o9a s ALA 42 Cb -0.09 -3.46 -0.03 0.00 0.00 0.00 0.00 23.12 19.55 1o9a s ALA 42 CO 0.01 -2.08 -0.09 -0.51 0.00 0.00 0.00 175.76 173.09 1o9a s LEU 43 N 3.05 2.99 -0.36 0.00 2.01 0.30 -1.94 118.68 124.74 1o9a s LEU 43 Ca 0.21 -0.13 -0.24 0.00 0.01 0.00 0.00 54.13 53.98 1o9a s LEU 43 Cb -0.16 -1.66 0.01 0.00 0.01 0.00 0.00 46.19 44.39 1o9a s LEU 43 CO 0.15 0.29 0.81 0.68 1.01 0.00 0.00 176.35 179.29 1o9a s VAL 44 N -0.41 4.72 0.43 -1.59 -7.23 0.46 -1.24 120.40 115.54 1o9a s VAL 44 Ca 0.05 0.96 -0.12 0.00 -1.81 0.00 0.00 61.98 61.07 1o9a s VAL 44 Cb -0.12 -4.22 -0.07 0.00 0.56 0.00 0.00 36.38 32.53 1o9a s VAL 44 CO 0.02 -0.43 0.81 0.00 -0.31 0.00 0.00 175.10 175.20 1o9a n THR 46 N -1.34 0.00 -3.64 0.00 -1.04 -0.45 -2.10 114.28 105.70 1o9a n THR 46 Ca 0.03 0.00 -0.08 0.00 -2.04 0.00 0.00 64.05 61.96 1o9a n THR 46 Cb 0.54 -0.25 -0.07 0.00 -1.82 0.00 0.00 70.33 68.73 1o9a n THR 46 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1o9a n TYR 48 N 3.74 0.00 -0.91 0.00 4.01 -1.24 -1.08 117.16 121.68 1o9a n TYR 48 Ca -0.18 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.56 1o9a n TYR 48 Cb 0.58 -0.62 0.00 0.00 -0.31 0.00 0.00 39.34 38.98 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 2.30 -1.89 0.00 2.72 0.00 -1.24 -4.81 105.19 102.27 1o9a n GLY 49 Ca -0.22 -0.60 0.00 0.00 0.00 0.00 0.00 46.02 45.21 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 0.53 0.13 0.49 -0.02 0.00 -0.94 -4.67 105.19 100.72 1o9a n GLY 50 Ca 0.00 -1.66 0.13 0.00 0.00 0.00 0.00 46.02 44.49 1o9a n GLY 50 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1o9a n SER 51 N 0.00 1.63 0.01 1.61 7.64 -1.26 -3.97 113.62 119.28 1o9a n SER 51 Ca 0.00 -1.42 0.11 0.00 1.01 0.00 0.00 58.87 58.56 1o9a n SER 51 Cb 0.00 0.06 0.46 0.00 -1.01 0.00 0.00 64.21 63.73 1o9a n SER 51 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1o9a n ARG 52 N 0.13 0.02 0.00 1.43 1.74 -1.26 -5.00 116.66 113.71 1o9a n ARG 52 Ca 0.16 0.14 0.00 0.00 -0.77 0.00 0.00 57.85 57.38 1o9a n ARG 52 Cb 0.40 -1.52 0.00 0.00 -1.02 0.00 0.00 32.46 30.31 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 0.73 -0.52 3.27 -0.13 0.00 -1.25 -4.85 105.19 102.43 1o9a n GLY 53 Ca 0.05 -0.93 -0.26 0.00 0.00 0.00 0.00 46.02 44.88 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 0.00 1.90 -0.13 1.61 -0.12 -1.26 -3.65 117.98 116.33 1o9a s PHE 54 Ca 0.00 -0.38 -0.02 0.00 -0.05 0.00 0.00 56.93 56.48 1o9a s PHE 54 Cb 0.00 -1.14 -0.03 0.00 -0.63 0.00 0.00 43.02 41.23 1o9a s PHE 54 CO 0.00 0.09 -0.06 1.21 -0.05 0.00 0.00 175.22 176.41 1o9a s ASN 55 N -1.17 4.64 0.26 1.98 2.47 -1.26 -4.87 114.94 116.99 1o9a s ASN 55 Ca 0.08 -0.13 -0.04 0.00 0.42 0.00 0.00 52.86 53.19 1o9a s ASN 55 Cb -0.09 -1.62 -0.05 0.00 -1.45 0.00 0.00 41.25 38.04 1o9a s ASN 55 CO 0.02 0.22 0.51 0.00 -3.72 0.00 0.00 177.10 174.12 1o9a s GLU 57 N -3.46 -0.02 0.18 0.00 2.02 -0.69 -4.89 118.70 111.84 1o9a s GLU 57 Ca 0.42 0.44 -0.31 0.00 0.02 0.00 0.00 54.97 55.55 1o9a s GLU 57 Cb -0.11 -0.36 -0.17 0.00 0.10 0.00 0.00 34.13 33.59 1o9a s GLU 57 CO 0.29 -0.29 0.84 -1.13 0.02 0.00 0.00 175.26 174.99 1o9a n SER 58 N 5.14 -0.01 -4.87 -0.19 3.41 -1.26 -0.40 113.62 115.43 1o9a n SER 58 Ca -0.08 1.15 -0.33 0.00 -0.26 0.00 0.00 58.87 59.35 1o9a n SER 58 Cb 0.50 -1.07 -0.05 0.00 -0.26 0.00 0.00 64.21 63.33 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 -0.81 3.80 -1.24 4.33 -2.85 -0.82 -4.75 119.74 117.40 1o9a s LYS 59 Ca 0.69 0.23 -0.15 0.00 -1.00 0.00 0.00 55.97 55.74 1o9a s LYS 59 Cb -0.92 -2.85 -0.04 0.00 -2.06 0.00 0.00 37.83 31.96 1o9a s LYS 59 CO 0.56 0.45 2.21 -0.35 0.10 0.00 0.00 175.35 178.33 1o9a n PRO 60 N 0.42 2.49 0.00 1.78 -0.04 -1.26 -4.93 135.00 133.46 1o9a n PRO 60 Ca -0.04 -2.25 0.00 0.00 -0.04 0.00 0.00 63.50 61.17 1o9a n PRO 60 Cb 0.52 -3.07 0.00 0.00 -0.04 0.00 0.00 33.50 30.91 1o9a n PRO 60 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 1o9a n GLU 61 N 5.95 -0.12 0.00 0.54 0.28 -1.26 -5.04 120.64 120.99 1o9a n GLU 61 Ca 0.54 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.54 1o9a n GLU 61 Cb 0.36 0.00 0.00 0.00 1.43 0.00 0.00 31.44 33.23 1o9a n GLU 61 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1o9a n ALA 62 N -3.00 0.34 0.84 -1.84 0.00 -1.26 -4.88 120.51 110.71 1o9a n ALA 62 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.42 1o9a n ALA 62 Cb 0.00 0.00 0.01 0.00 0.00 0.00 0.00 19.45 19.46 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 -0.35 1.09 -1.26 0.00 -0.58 -1.26 -4.91 120.64 113.36 1o9a n GLU 63 Ca 0.00 -0.21 -0.32 0.00 -0.42 0.00 0.00 57.16 56.20 1o9a n GLU 63 Cb 0.00 -1.09 0.10 0.00 -0.57 0.00 0.00 31.44 29.88 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 -0.25 1.99 0.35 3.49 2.02 -1.26 -5.01 118.70 120.04 1o9a s GLU 64 Ca 0.04 1.50 -0.17 0.00 0.02 0.00 0.00 54.97 56.36 1o9a s GLU 64 Cb 0.03 -1.84 0.05 0.00 0.10 0.00 0.00 34.13 32.47 1o9a s GLU 64 CO 0.01 -1.89 0.79 0.95 0.02 0.00 0.00 175.26 175.14 1o9a s THR 65 N -2.43 0.00 -0.10 3.63 -4.23 -1.26 -3.31 115.64 107.94 1o9a s THR 65 Ca 0.68 -0.97 -0.05 0.00 -1.18 0.00 0.00 61.69 60.16 1o9a s THR 65 Cb -0.23 -2.69 0.04 0.00 1.34 0.00 0.00 72.50 70.96 1o9a s THR 65 CO 0.50 0.00 0.24 0.00 -0.54 0.00 0.00 174.62 174.82 1o9a s PHE 67 N 1.08 3.43 -0.32 0.00 5.36 -1.26 -0.85 117.98 125.42 1o9a s PHE 67 Ca -0.08 0.36 -0.05 0.00 -0.96 0.00 0.00 56.93 56.20 1o9a s PHE 67 Cb -0.09 -1.85 0.04 0.00 -0.34 0.00 0.00 43.02 40.78 1o9a s PHE 67 CO -0.07 0.63 0.06 0.34 -1.46 0.00 0.00 175.22 174.72 1o9a s ASP 68 N -1.29 5.12 0.00 6.13 2.15 -0.34 -4.95 116.67 123.49 1o9a s ASP 68 Ca 0.18 -1.12 0.12 0.00 0.43 0.00 0.00 52.55 52.16 1o9a s ASP 68 Cb -0.12 -1.81 0.73 0.00 -0.30 0.00 0.00 42.92 41.42 1o9a s ASP 68 CO 0.08 -0.28 1.40 0.29 -0.17 0.00 0.00 175.17 176.48 1o9a n LYS 69 N 4.75 0.91 0.07 4.34 4.01 -1.26 -0.19 118.16 130.79 1o9a n LYS 69 Ca -0.13 0.00 0.06 0.00 -0.51 0.00 0.00 58.31 57.73 1o9a n LYS 69 Cb 0.45 -1.21 -0.04 0.00 -0.51 0.00 0.00 35.03 33.72 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 -0.71 0.97 0.00 2.13 4.02 -1.26 -4.46 117.16 117.85 1o9a n TYR 70 Ca 0.09 0.30 0.00 0.00 -0.01 0.00 0.00 57.90 58.28 1o9a n TYR 70 Cb 0.04 -1.01 0.00 0.00 -0.02 0.00 0.00 39.34 38.35 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 -2.77 0.00 -2.10 -0.72 -2.24 -1.14 -5.03 114.28 100.28 1o9a n THR 71 Ca -0.04 -0.08 -0.05 0.00 -2.27 0.00 0.00 64.05 61.60 1o9a n THR 71 Cb 0.68 0.96 -0.00 0.00 -2.10 0.00 0.00 70.33 69.86 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 0.18 0.15 3.52 3.38 0.00 0.73 -5.05 105.19 108.10 1o9a n GLY 72 Ca 0.00 -0.66 -0.28 0.00 0.00 0.00 0.00 46.02 45.08 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 -2.76 4.00 -0.00 1.61 0.01 -1.16 -4.95 114.94 111.69 1o9a s ASN 73 Ca 0.00 -0.62 0.04 0.00 -0.71 0.00 0.00 52.86 51.57 1o9a s ASN 73 Cb 0.00 -0.59 -0.03 0.00 0.41 0.00 0.00 41.25 41.04 1o9a s ASN 73 CO 0.00 0.13 -0.09 -0.89 -1.51 0.00 0.00 177.10 174.74 1o9a s THR 74 N -1.51 3.45 0.23 1.60 2.01 -1.26 -1.20 115.64 118.96 1o9a s THR 74 Ca 0.22 -0.80 0.04 0.00 0.31 0.00 0.00 61.69 61.46 1o9a s THR 74 Cb -0.09 -2.47 -0.05 0.00 0.01 0.00 0.00 72.50 69.90 1o9a s THR 74 CO 0.13 0.43 -0.02 -0.31 -0.69 0.00 0.00 174.62 174.16 1o9a s TYR 75 N -0.93 1.57 0.24 4.92 1.51 -0.03 -4.99 117.35 119.64 1o9a s TYR 75 Ca 0.16 -0.88 0.07 0.00 -1.01 0.00 0.00 57.07 55.40 1o9a s TYR 75 Cb -0.11 -0.89 -0.04 0.00 -0.11 0.00 0.00 41.96 40.81 1o9a s TYR 75 CO 0.06 0.01 0.21 0.50 -1.11 0.00 0.00 175.55 175.22 1o9a s ARG 76 N -3.83 2.99 -0.10 -0.62 3.00 -1.26 -0.39 118.95 118.73 1o9a s ARG 76 Ca 0.27 -1.00 -0.29 0.00 -1.00 0.00 0.00 55.73 53.71 1o9a s ARG 76 Cb 0.05 -2.61 -0.05 0.00 0.00 0.00 0.00 34.95 32.34 1o9a s ARG 76 CO 0.08 0.41 1.72 0.54 0.00 0.00 0.00 175.30 178.05 1o9a s VAL 77 N -2.08 3.50 0.00 7.11 0.11 -1.21 -2.47 120.40 125.37 1o9a s VAL 77 Ca 0.33 0.59 0.00 0.00 -2.93 0.00 0.00 61.98 59.97 1o9a s VAL 77 Cb -0.08 -3.44 0.00 0.00 -1.53 0.00 0.00 36.38 31.33 1o9a s VAL 77 CO 0.25 -0.11 0.00 0.61 -3.33 0.00 0.00 175.10 172.52 1o9a n GLY 78 N 4.43 1.10 3.78 6.54 0.00 -0.93 -4.96 105.19 115.14 1o9a n GLY 78 Ca 0.19 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.96 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 -1.28 4.51 0.05 1.61 1.01 -1.03 -5.01 116.67 116.53 1o9a s ASP 79 Ca 0.00 -1.09 -0.00 0.00 0.71 0.00 0.00 52.55 52.17 1o9a s ASP 79 Cb 0.00 -0.31 -0.03 0.00 1.01 0.00 0.00 42.92 43.58 1o9a s ASP 79 CO 0.00 -0.65 -0.04 0.42 0.21 0.00 0.00 175.17 175.11 1o9a s THR 80 N -2.62 0.28 0.11 -1.27 -4.23 -1.26 -1.55 115.64 105.10 1o9a s THR 80 Ca 0.39 -1.50 -0.21 0.00 -1.18 0.00 0.00 61.69 59.18 1o9a s THR 80 Cb 0.02 -1.10 0.06 0.00 1.34 0.00 0.00 72.50 72.82 1o9a s THR 80 CO 0.22 -0.78 0.53 -0.72 -0.54 0.00 0.00 174.62 173.33 1o9a s TYR 81 N -2.94 -0.43 -0.18 3.99 1.13 -0.34 -4.98 117.35 113.59 1o9a s TYR 81 Ca -0.00 0.29 0.01 0.00 -1.41 0.00 0.00 57.07 55.95 1o9a s TYR 81 Cb 0.01 0.42 0.02 0.00 -1.10 0.00 0.00 41.96 41.31 1o9a s TYR 81 CO -0.06 -0.75 -0.19 -1.21 -2.51 0.00 0.00 175.55 170.83 1o9a s GLU 82 N -3.32 2.92 -0.14 -3.49 2.02 -1.26 -0.24 118.70 115.19 1o9a s GLU 82 Ca -0.01 -0.84 -0.00 0.00 0.02 0.00 0.00 54.97 54.14 1o9a s GLU 82 Cb -0.00 -2.56 0.03 0.00 0.10 0.00 0.00 34.13 31.70 1o9a s GLU 82 CO -0.09 -0.23 -0.07 1.03 0.02 0.00 0.00 175.26 175.92 1o9a s ARG 83 N 1.29 1.57 0.76 1.61 3.00 0.13 -4.93 118.95 122.39 1o9a s ARG 83 Ca 0.04 -0.40 -0.15 0.00 0.00 0.00 0.00 55.73 55.22 1o9a s ARG 83 Cb -0.13 -1.83 0.01 0.00 0.00 0.00 0.00 34.95 33.00 1o9a s ARG 83 CO -0.12 -0.33 0.81 -2.30 0.00 0.00 0.00 175.30 173.35 1o9a n PRO 84 N 4.89 0.30 -3.64 3.54 -0.02 -1.26 -2.30 135.00 136.50 1o9a n PRO 84 Ca -0.13 0.16 -0.04 0.00 -2.02 0.00 0.00 63.50 61.47 1o9a n PRO 84 Cb 0.49 -2.10 -0.07 0.00 -0.02 0.00 0.00 33.50 31.80 1o9a n PRO 84 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 1o9a s LYS 85 N -3.33 0.36 -1.12 -0.52 2.20 0.26 -4.78 119.74 112.82 1o9a s LYS 85 Ca 0.69 0.54 -0.11 0.00 -0.36 0.00 0.00 55.97 56.74 1o9a s LYS 85 Cb -0.32 0.11 -0.04 0.00 -1.51 0.00 0.00 37.83 36.07 1o9a s LYS 85 CO 0.55 -0.06 0.85 -0.25 -0.36 0.00 0.00 175.35 176.08 1o9a n ASP 86 N 3.09 -5.37 -0.02 1.43 9.92 -1.26 -1.13 116.55 123.22 1o9a n ASP 86 Ca -0.16 -0.83 -0.00 0.00 -0.53 0.00 0.00 54.79 53.26 1o9a n ASP 86 Cb 0.57 -4.41 -0.00 0.00 -0.64 0.00 0.00 41.12 36.64 1o9a n ASP 86 CO 0.00 0.00 0.00 -0.24 0.13 0.00 0.00 177.20 177.09 1o9a n SER 87 N -3.00 -4.84 -1.08 -2.24 2.88 -1.26 -4.87 113.62 99.21 1o9a n SER 87 Ca -0.11 0.01 0.00 0.00 -1.33 0.00 0.00 58.87 57.43 1o9a n SER 87 Cb 0.62 -2.94 0.00 0.00 -0.75 0.00 0.00 64.21 61.14 1o9a n SER 87 CO 0.00 0.00 0.00 0.80 -1.23 0.00 0.00 175.04 174.61 1o9a n MET 88 N 0.77 2.64 -3.72 -1.46 0.00 -0.28 -5.16 117.12 109.90 1o9a n MET 88 Ca -0.00 0.00 -0.14 0.00 0.00 0.00 0.00 57.70 57.56 1o9a n MET 88 Cb 0.41 0.00 -0.14 0.00 0.00 0.00 0.00 33.22 33.48 1o9a n MET 88 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 175.97 174.47 1o9a s ILE 89 N -0.24 -0.11 -0.12 1.12 1.10 -1.26 -0.57 121.20 121.12 1o9a s ILE 89 Ca 0.00 0.20 0.00 0.00 -0.51 0.00 0.00 60.65 60.34 1o9a s ILE 89 Cb 0.00 -0.31 -0.02 0.00 0.15 0.00 0.00 42.46 42.28 1o9a s ILE 89 CO 0.00 0.08 -0.12 0.26 -2.11 0.00 0.00 174.94 173.06 1o9a s TRP 90 N 1.47 2.83 -1.22 3.50 0.52 -0.97 -2.28 118.94 122.79 1o9a s TRP 90 Ca -0.07 -0.49 -0.04 0.00 0.02 0.00 0.00 56.10 55.53 1o9a s TRP 90 Cb -0.11 -1.82 0.18 0.00 -1.15 0.00 0.00 33.47 30.57 1o9a s TRP 90 CO -0.07 -0.10 2.21 -0.25 0.02 0.00 0.00 176.95 178.76 1o9a n ASP 91 N 3.27 7.82 -4.58 2.95 9.92 0.12 0.18 116.55 136.23 1o9a n ASP 91 Ca -0.18 -3.32 -0.49 0.00 -0.53 0.00 0.00 54.79 50.27 1o9a n ASP 91 Cb 0.53 -1.30 -0.04 0.00 -0.64 0.00 0.00 41.12 39.67 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 -0.21 4.41 -0.26 0.00 -4.23 0.38 -1.20 115.64 114.52 1o9a s THR 93 Ca 0.73 -0.19 -0.15 0.00 -1.18 0.00 0.00 61.69 60.89 1o9a s THR 93 Cb -0.84 -2.92 -0.04 0.00 1.34 0.00 0.00 72.50 70.04 1o9a s THR 93 CO 0.52 0.53 0.40 0.00 -0.54 0.00 0.00 174.62 175.53 1o9a n ILE 95 N 5.09 0.00 -1.02 0.00 2.08 -1.21 -2.19 119.36 122.10 1o9a n ILE 95 Ca -0.08 0.00 -0.17 0.00 0.56 0.00 0.00 62.75 63.07 1o9a n ILE 95 Cb 0.51 -0.92 -0.13 0.00 -0.75 0.00 0.00 39.64 38.34 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 5.00 3.17 0.35 7.39 0.00 -1.24 -4.22 105.19 115.65 1o9a n GLY 96 Ca 0.00 -1.22 0.11 0.00 0.00 0.00 0.00 46.02 44.91 1o9a n GLY 96 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1o9a h ALA 97 N 3.54 1.78 0.00 4.61 0.00 -1.48 0.22 119.26 127.92 1o9a h ALA 97 Ca 0.32 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.23 1o9a h ALA 97 Cb 1.21 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.01 1o9a h ALA 97 CO 0.56 -0.72 0.22 0.41 0.00 0.00 0.00 179.25 179.72 1o9a n GLY 98 N -1.39 -0.68 0.00 0.00 0.00 -1.25 -3.50 105.19 98.37 1o9a n GLY 98 Ca 0.02 0.14 0.00 0.00 0.00 0.00 0.00 46.02 46.18 1o9a n GLY 98 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1o9a n ARG 99 N -2.11 0.79 0.00 1.61 1.85 -0.08 -4.59 116.66 114.13 1o9a n ARG 99 Ca -0.01 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.84 1o9a n ARG 99 Cb 0.25 -0.09 0.00 0.00 -1.05 0.00 0.00 32.46 31.57 1o9a n ARG 99 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1o9a n GLY 100 N -0.09 -0.28 0.00 2.89 0.00 0.58 -5.06 105.19 103.22 1o9a n GLY 100 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1o9a n GLY 100 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1o9a n ARG 101 N -1.02 -0.64 -3.95 1.61 -4.01 -1.25 -4.82 116.66 102.59 1o9a n ARG 101 Ca 0.00 0.00 -0.28 0.00 -1.04 0.00 0.00 57.85 56.53 1o9a n ARG 101 Cb 0.00 0.00 -0.17 0.00 -3.04 0.00 0.00 32.46 29.25 1o9a n ARG 101 CO 0.00 0.00 0.00 -1.50 -3.04 0.00 0.00 177.63 173.09 1o9a s ILE 102 N -3.00 1.20 -0.12 8.89 2.07 -1.26 -1.55 121.20 127.43 1o9a s ILE 102 Ca 0.00 -0.40 -0.24 0.00 -1.41 0.00 0.00 60.65 58.60 1o9a s ILE 102 Cb 0.00 -1.18 -0.03 0.00 0.13 0.00 0.00 42.46 41.38 1o9a s ILE 102 CO 0.00 0.40 0.76 -0.55 -1.91 0.00 0.00 174.94 173.64 1o9a s SER 103 N 1.62 6.96 -0.19 4.50 0.15 -0.05 -4.91 113.70 121.78 1o9a s SER 103 Ca 0.05 1.16 -0.01 0.00 0.70 0.00 0.00 55.95 57.85 1o9a s SER 103 Cb -0.13 -2.43 0.00 0.00 -1.71 0.00 0.00 66.02 61.76 1o9a s SER 103 CO -0.09 -0.26 -0.12 0.00 1.20 0.00 0.00 173.24 173.97 1o9a s THR 105 N 1.23 1.64 0.46 0.00 2.01 -1.26 -4.94 115.64 114.78 1o9a s THR 105 Ca 0.03 -1.63 -0.13 0.00 0.31 0.00 0.00 61.69 60.26 1o9a s THR 105 Cb -0.14 -1.58 -0.07 0.00 0.01 0.00 0.00 72.50 70.72 1o9a s THR 105 CO -0.05 -0.17 0.88 -0.63 -0.69 0.00 0.00 174.62 173.95 1o9a s ILE 106 N -1.48 4.67 -0.45 1.82 -1.09 -1.26 -0.71 121.20 122.69 1o9a s ILE 106 Ca 0.08 0.90 0.05 0.00 -2.23 0.00 0.00 60.65 59.45 1o9a s ILE 106 Cb -0.08 -3.73 0.27 0.00 -1.58 0.00 0.00 42.46 37.33 1o9a s ILE 106 CO 0.05 -0.62 1.02 0.00 -1.23 0.00 0.00 174.94 174.16 1o9a n ALA 107 N -1.48 -1.63 -2.05 9.38 0.00 -0.96 -4.66 120.51 119.10 1o9a n ALA 107 Ca 0.04 -1.22 -0.42 0.00 0.00 0.00 0.00 53.44 51.84 1o9a n ALA 107 Cb 0.54 -1.64 -0.03 0.00 0.00 0.00 0.00 19.45 18.33 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 -1.32 6.70 0.00 0.00 3.84 -1.26 -4.82 114.94 118.07 1o9a s ASN 108 Ca 0.28 2.19 0.25 0.00 0.21 0.00 0.00 52.86 55.79 1o9a s ASN 108 Cb 0.25 -2.54 0.51 0.00 -0.55 0.00 0.00 41.25 38.92 1o9a s ASN 108 CO -0.18 -0.90 1.44 0.54 -2.79 0.00 0.00 177.10 175.21