#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 1.08 0.96 1.43 2.20 -1.26 -5.14 119.74 119.00 1o9a s LYS 18 Ca 0.00 -0.32 -0.12 0.00 -0.36 0.00 0.00 55.97 55.17 1o9a s LYS 18 Cb 0.00 -0.99 0.10 0.00 -1.51 0.00 0.00 37.83 35.44 1o9a s LYS 18 CO 0.00 0.10 0.75 -2.30 -0.36 0.00 0.00 175.35 173.55 1o9a n PRO 19 N 3.37 -0.55 0.00 4.03 -0.02 -1.26 -4.92 135.00 135.64 1o9a n PRO 19 Ca -0.19 -0.11 0.00 0.00 -2.02 0.00 0.00 63.50 61.18 1o9a n PRO 19 Cb 0.54 -2.10 0.00 0.00 -0.02 0.00 0.00 33.50 31.92 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 0.95 4.08 3.25 -1.23 0.00 -1.26 -5.01 105.19 105.96 1o9a n GLY 20 Ca 0.09 -1.36 -0.14 0.00 0.00 0.00 0.00 46.02 44.61 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 -3.79 0.40 0.70 0.00 6.14 -1.26 -3.57 117.35 115.96 1o9a s TYR 22 Ca 0.29 0.01 -0.07 0.00 0.64 0.00 0.00 57.07 57.94 1o9a s TYR 22 Cb 0.07 -0.61 0.05 0.00 0.42 0.00 0.00 41.96 41.90 1o9a s TYR 22 CO 0.07 -0.24 1.01 0.34 0.64 0.00 0.00 175.55 177.38 1o9a s ASP 23 N 1.80 4.90 -0.91 4.32 2.15 0.39 -4.86 116.67 124.46 1o9a s ASP 23 Ca 0.01 0.52 -0.13 0.00 0.43 0.00 0.00 52.55 53.38 1o9a s ASP 23 Cb -0.12 -1.20 -0.27 0.00 -0.30 0.00 0.00 42.92 41.02 1o9a s ASP 23 CO -0.04 -1.55 2.17 -3.20 -0.17 0.00 0.00 175.17 172.38 1o9a n ASN 24 N -2.90 -0.66 0.00 -0.34 4.05 -1.26 -1.09 115.26 113.07 1o9a n ASN 24 Ca 0.08 -0.85 0.00 0.00 0.45 0.00 0.00 54.58 54.26 1o9a n ASN 24 Cb 0.60 -0.83 0.00 0.00 1.23 0.00 0.00 39.78 40.78 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 5.79 2.76 3.57 8.20 0.00 -1.26 -4.97 105.19 119.27 1o9a n GLY 25 Ca 0.60 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 46.28 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 0.00 2.70 -0.13 1.61 1.02 -0.25 -5.11 119.74 119.57 1o9a s LYS 26 Ca 0.00 -0.58 -0.10 0.00 0.02 0.00 0.00 55.97 55.31 1o9a s LYS 26 Cb 0.00 -2.55 -0.05 0.00 -0.52 0.00 0.00 37.83 34.71 1o9a s LYS 26 CO 0.00 0.66 0.19 -3.38 -0.92 0.00 0.00 175.35 171.90 1o9a s HIS 27 N -0.80 3.55 0.24 3.18 0.00 -1.26 0.15 115.29 120.34 1o9a s HIS 27 Ca 0.12 0.54 0.05 0.00 -3.00 0.00 0.00 55.06 52.78 1o9a s HIS 27 Cb -0.11 -2.09 -0.05 0.00 -4.00 0.00 0.00 32.58 26.32 1o9a s HIS 27 CO 0.01 0.54 -0.05 0.71 -1.00 0.00 0.00 174.74 174.96 1o9a s TYR 28 N -0.47 1.72 0.78 0.38 2.02 -1.23 -4.89 117.35 115.66 1o9a s TYR 28 Ca 0.14 -0.78 -0.11 0.00 -0.37 0.00 0.00 57.07 55.96 1o9a s TYR 28 Cb -0.12 -0.97 0.06 0.00 -0.40 0.00 0.00 41.96 40.53 1o9a s TYR 28 CO 0.03 0.15 1.08 -0.65 -1.57 0.00 0.00 175.55 174.60 1o9a s GLN 29 N -3.77 2.24 0.31 -0.62 -1.52 -1.26 -4.12 119.66 110.91 1o9a s GLN 29 Ca 0.27 0.91 -0.29 0.00 -1.95 0.00 0.00 55.36 54.31 1o9a s GLN 29 Cb 0.04 -1.91 -0.10 0.00 -0.22 0.00 0.00 33.01 30.82 1o9a s GLN 29 CO 0.09 -1.58 1.26 0.42 -0.25 0.00 0.00 175.29 175.23 1o9a s ILE 30 N -3.01 2.92 0.00 1.08 1.09 -1.26 -2.24 121.20 119.77 1o9a s ILE 30 Ca 0.61 0.91 0.00 0.00 -1.10 0.00 0.00 60.65 61.06 1o9a s ILE 30 Cb -0.16 -3.58 0.00 0.00 -1.06 0.00 0.00 42.46 37.66 1o9a s ILE 30 CO 0.55 0.21 0.00 0.59 -0.10 0.00 0.00 174.94 176.20 1o9a n ASN 31 N 1.03 -3.98 -4.87 3.58 3.02 -0.72 -4.94 115.26 108.36 1o9a n ASN 31 Ca 0.00 0.00 -0.30 0.00 -0.03 0.00 0.00 54.58 54.25 1o9a n ASN 31 Cb 0.42 -2.91 -0.03 0.00 -0.61 0.00 0.00 39.78 36.66 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 -1.53 3.78 0.26 3.52 0.74 -0.95 -4.64 119.66 120.84 1o9a s GLN 32 Ca 0.00 0.49 0.11 0.00 0.05 0.00 0.00 55.36 56.01 1o9a s GLN 32 Cb 0.00 -2.37 -0.05 0.00 1.10 0.00 0.00 33.01 31.69 1o9a s GLN 32 CO 0.00 -0.06 -0.19 -0.65 -0.55 0.00 0.00 175.29 173.83 1o9a s GLN 33 N -3.92 1.59 -0.09 1.67 -0.21 -1.26 -2.89 119.66 114.54 1o9a s GLN 33 Ca 0.52 -1.71 -0.25 0.00 0.02 0.00 0.00 55.36 53.94 1o9a s GLN 33 Cb -0.10 -1.63 0.06 0.00 1.00 0.00 0.00 33.01 32.34 1o9a s GLN 33 CO 0.32 0.30 0.59 1.67 -2.12 0.00 0.00 175.29 176.05 1o9a s TRP 34 N -2.53 -0.57 0.02 0.91 -2.14 -0.98 -4.99 118.94 108.67 1o9a s TRP 34 Ca 0.27 1.09 -0.23 0.00 2.66 0.00 0.00 56.10 59.90 1o9a s TRP 34 Cb -0.04 0.30 -0.05 0.00 -3.10 0.00 0.00 33.47 30.57 1o9a s TRP 34 CO 0.13 -0.49 0.67 -1.21 -2.66 0.00 0.00 176.95 173.39 1o9a s GLU 35 N -0.82 4.40 -0.08 3.25 2.02 -1.26 -1.41 118.70 124.80 1o9a s GLU 35 Ca -0.09 0.89 -0.21 0.00 0.02 0.00 0.00 54.97 55.58 1o9a s GLU 35 Cb -0.02 -3.35 0.05 0.00 0.10 0.00 0.00 34.13 30.90 1o9a s GLU 35 CO 0.06 0.33 0.50 -0.98 0.02 0.00 0.00 175.26 175.20 1o9a s ARG 36 N -0.14 0.79 0.00 1.61 1.70 -0.93 -4.99 118.95 116.99 1o9a s ARG 36 Ca 0.34 0.23 -0.01 0.00 -0.47 0.00 0.00 55.73 55.83 1o9a s ARG 36 Cb -0.19 0.37 -0.04 0.00 -0.57 0.00 0.00 34.95 34.52 1o9a s ARG 36 CO 0.20 -0.20 0.13 0.99 -1.08 0.00 0.00 175.30 175.34 1o9a s THR 37 N -0.81 5.04 -0.14 4.99 2.01 -1.26 0.22 115.64 125.70 1o9a s THR 37 Ca -0.09 -0.34 -0.01 0.00 0.31 0.00 0.00 61.69 61.56 1o9a s THR 37 Cb -0.03 -3.35 0.04 0.00 0.01 0.00 0.00 72.50 69.17 1o9a s THR 37 CO 0.05 0.31 -0.01 -0.47 -0.69 0.00 0.00 174.62 173.81 1o9a s TYR 38 N -1.28 1.17 0.00 4.92 5.04 0.19 -4.87 117.35 122.51 1o9a s TYR 38 Ca 0.26 -0.70 0.00 0.00 -2.44 0.00 0.00 57.07 54.19 1o9a s TYR 38 Cb -0.12 -1.07 0.00 0.00 0.35 0.00 0.00 41.96 41.12 1o9a s TYR 38 CO 0.17 -0.51 0.00 1.28 -1.34 0.00 0.00 175.55 175.15 1o9a n LEU 39 N 5.02 0.00 0.00 6.97 4.77 -1.26 -2.58 117.00 129.91 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 0.49 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.58 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 3.25 -0.72 0.00 -1.26 -5.14 105.19 101.31 1o9a n GLY 40 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 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 2.89 -0.50 1.61 4.22 -1.07 -5.09 114.94 117.00 1o9a s ASN 41 Ca 0.00 -0.48 -0.25 0.00 -2.14 0.00 0.00 52.86 49.99 1o9a s ASN 41 Cb 0.00 -0.72 0.03 0.00 1.28 0.00 0.00 41.25 41.84 1o9a s ASN 41 CO 0.00 0.24 0.96 0.00 -2.04 0.00 0.00 177.10 176.26 1o9a s ALA 42 N -0.20 3.19 -0.08 3.54 0.00 -1.26 -0.64 121.76 126.32 1o9a s ALA 42 Ca -0.02 -0.91 0.02 0.00 0.00 0.00 0.00 51.96 51.06 1o9a s ALA 42 Cb -0.13 -3.71 -0.02 0.00 0.00 0.00 0.00 23.12 19.26 1o9a s ALA 42 CO 0.03 -2.20 -0.12 -0.51 0.00 0.00 0.00 175.76 172.95 1o9a s LEU 43 N 3.93 2.83 -0.03 0.00 2.01 0.13 -0.48 118.68 127.07 1o9a s LEU 43 Ca 0.36 -0.20 -0.23 0.00 0.01 0.00 0.00 54.13 54.07 1o9a s LEU 43 Cb -0.10 -1.60 -0.04 0.00 0.01 0.00 0.00 46.19 44.45 1o9a s LEU 43 CO 0.25 0.29 0.69 0.68 1.01 0.00 0.00 176.35 179.26 1o9a s VAL 44 N -0.39 4.95 0.14 -1.59 -7.23 0.29 -2.20 120.40 114.39 1o9a s VAL 44 Ca 0.04 1.43 0.05 0.00 -1.81 0.00 0.00 61.98 61.69 1o9a s VAL 44 Cb -0.12 -4.03 -0.04 0.00 0.56 0.00 0.00 36.38 32.75 1o9a s VAL 44 CO 0.02 0.31 0.12 0.00 -0.31 0.00 0.00 175.10 175.24 1o9a n THR 46 N -0.12 0.00 -3.67 0.00 -1.04 -0.67 -2.31 114.28 106.48 1o9a n THR 46 Ca -0.08 0.00 -0.10 0.00 -2.04 0.00 0.00 64.05 61.83 1o9a n THR 46 Cb 0.54 -0.79 -0.10 0.00 -1.82 0.00 0.00 70.33 68.15 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 5.01 0.00 0.00 0.00 4.01 -1.25 -1.75 117.16 123.18 1o9a n TYR 48 Ca -0.13 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.61 1o9a n TYR 48 Cb 0.51 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.54 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 0.93 3.00 0.00 2.72 0.00 -1.26 -4.62 105.19 105.96 1o9a n GLY 49 Ca 0.00 -2.01 0.08 0.00 0.00 0.00 0.00 46.02 44.09 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 -1.13 -0.63 0.08 -0.02 0.00 -0.69 -0.48 105.19 102.31 1o9a n GLY 50 Ca 0.00 -0.09 -0.02 0.00 0.00 0.00 0.00 46.02 45.90 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 -1.11 0.33 -0.21 1.61 7.64 -1.26 -4.36 113.62 116.26 1o9a n SER 51 Ca 0.11 0.15 0.03 0.00 1.01 0.00 0.00 58.87 60.16 1o9a n SER 51 Cb 0.08 0.88 0.02 0.00 -1.01 0.00 0.00 64.21 64.18 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 -2.71 -0.27 -0.87 1.43 1.74 -0.95 -5.12 116.66 109.91 1o9a n ARG 52 Ca -0.18 -0.81 0.12 0.00 -0.77 0.00 0.00 57.85 56.20 1o9a n ARG 52 Cb 0.93 -1.10 -0.03 0.00 -1.02 0.00 0.00 32.46 31.24 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 0.29 -1.56 3.21 -0.13 0.00 0.37 -4.85 105.19 102.51 1o9a n GLY 53 Ca 0.03 -1.11 -0.29 0.00 0.00 0.00 0.00 46.02 44.65 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 -1.36 2.08 -0.19 1.61 -0.12 -1.26 -3.76 117.98 114.97 1o9a s PHE 54 Ca 0.00 -0.58 -0.08 0.00 -0.05 0.00 0.00 56.93 56.22 1o9a s PHE 54 Cb 0.00 -1.37 -0.04 0.00 -0.63 0.00 0.00 43.02 40.98 1o9a s PHE 54 CO 0.00 -0.17 0.08 1.21 -0.05 0.00 0.00 175.22 176.29 1o9a s ASN 55 N -0.14 5.76 0.08 1.98 3.04 -1.26 -4.87 114.94 119.53 1o9a s ASN 55 Ca -0.02 0.11 0.04 0.00 0.04 0.00 0.00 52.86 53.03 1o9a s ASN 55 Cb -0.12 -1.99 -0.04 0.00 -1.54 0.00 0.00 41.25 37.56 1o9a s ASN 55 CO 0.02 0.17 0.04 0.00 -3.04 0.00 0.00 177.10 174.29 1o9a s GLU 57 N -2.30 0.06 0.31 0.00 2.02 -0.19 -4.92 118.70 113.67 1o9a s GLU 57 Ca 0.27 0.16 -0.25 0.00 0.02 0.00 0.00 54.97 55.17 1o9a s GLU 57 Cb -0.12 -0.06 -0.15 0.00 0.10 0.00 0.00 34.13 33.90 1o9a s GLU 57 CO 0.20 -0.07 0.54 0.45 0.02 0.00 0.00 175.26 176.39 1o9a n SER 58 N 3.48 -0.99 -4.86 -0.19 2.88 -1.26 -0.55 113.62 112.13 1o9a n SER 58 Ca -0.18 1.03 -0.35 0.00 -1.33 0.00 0.00 58.87 58.04 1o9a n SER 58 Cb 0.56 -1.04 -0.06 0.00 -0.75 0.00 0.00 64.21 62.93 1o9a n SER 58 CO 0.00 0.00 0.00 -1.59 -1.23 0.00 0.00 175.04 172.22 1o9a s LYS 59 N -1.24 3.85 0.67 -1.46 0.00 0.37 -4.65 119.74 117.27 1o9a s LYS 59 Ca 0.62 0.30 -0.13 0.00 0.00 0.00 0.00 55.97 56.76 1o9a s LYS 59 Cb -0.76 -2.98 0.00 0.00 0.00 0.00 0.00 37.83 34.10 1o9a s LYS 59 CO 0.58 0.53 1.07 -1.25 0.00 0.00 0.00 175.35 176.29 1o9a s PRO 60 N -1.91 2.92 0.00 1.78 0.04 -1.26 -4.95 135.00 131.61 1o9a s PRO 60 Ca 0.35 1.13 0.00 0.00 0.04 0.00 0.00 61.00 62.51 1o9a s PRO 60 Cb -0.14 -1.98 0.00 0.00 0.04 0.00 0.00 34.50 32.41 1o9a s PRO 60 CO 0.18 -1.12 0.00 -0.85 0.04 0.00 0.00 177.00 175.25 1o9a n GLU 61 N -2.75 0.59 0.10 4.56 0.28 -1.26 -5.02 120.64 117.14 1o9a n GLU 61 Ca 0.09 0.00 -0.04 0.00 -0.16 0.00 0.00 57.16 57.04 1o9a n GLU 61 Cb 0.53 0.00 -0.02 0.00 1.43 0.00 0.00 31.44 33.38 1o9a n GLU 61 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1o9a h ALA 62 N -2.00 -0.50 -3.00 -1.84 0.00 -2.03 -3.48 119.26 106.41 1o9a h ALA 62 Ca 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1o9a h ALA 62 Cb 0.00 0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.90 1o9a h ALA 62 CO 0.00 -0.48 0.00 0.39 0.00 0.00 0.00 179.25 179.16 1o9a n GLU 63 N -3.59 0.00 -3.47 0.00 -0.58 -1.26 -5.13 120.64 106.62 1o9a n GLU 63 Ca -0.04 0.00 -0.14 0.00 -0.42 0.00 0.00 57.16 56.56 1o9a n GLU 63 Cb 0.12 0.00 -0.11 0.00 -0.57 0.00 0.00 31.44 30.87 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 2.40 0.24 0.32 3.49 2.02 -1.26 -5.10 118.70 120.82 1o9a s GLU 64 Ca 0.00 0.39 -0.02 0.00 0.02 0.00 0.00 54.97 55.36 1o9a s GLU 64 Cb 0.00 -0.80 0.01 0.00 0.10 0.00 0.00 34.13 33.44 1o9a s GLU 64 CO 0.00 -0.60 0.47 0.25 0.02 0.00 0.00 175.26 175.39 1o9a n THR 65 N 5.34 0.00 -3.69 3.63 -2.24 -1.26 -1.94 114.28 114.12 1o9a n THR 65 Ca -0.05 -1.58 -0.11 0.00 -2.27 0.00 0.00 64.05 60.04 1o9a n THR 65 Cb 0.50 1.00 -0.11 0.00 -2.10 0.00 0.00 70.33 69.62 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 1.61 3.57 -0.29 0.00 5.36 -1.26 -1.02 117.98 125.95 1o9a s PHE 67 Ca -0.08 0.48 -0.05 0.00 -0.96 0.00 0.00 56.93 56.33 1o9a s PHE 67 Cb -0.09 -1.92 0.02 0.00 -0.34 0.00 0.00 43.02 40.69 1o9a s PHE 67 CO -0.12 0.65 0.03 0.34 -1.46 0.00 0.00 175.22 174.67 1o9a s ASP 68 N -1.64 4.90 0.00 6.13 2.15 -0.38 -4.95 116.67 122.88 1o9a s ASP 68 Ca 0.25 -0.90 0.18 0.00 0.43 0.00 0.00 52.55 52.50 1o9a s ASP 68 Cb -0.13 -1.79 1.01 0.00 -0.30 0.00 0.00 42.92 41.71 1o9a s ASP 68 CO 0.14 -0.21 1.66 0.29 -0.17 0.00 0.00 175.17 176.89 1o9a n LYS 69 N 4.77 1.09 -0.00 4.34 4.01 -1.26 -0.04 118.16 131.05 1o9a n LYS 69 Ca -0.15 -0.13 -0.17 0.00 -0.51 0.00 0.00 58.31 57.36 1o9a n LYS 69 Cb 0.46 -1.29 -0.14 0.00 -0.51 0.00 0.00 35.03 33.56 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 -0.64 1.16 0.04 2.13 4.02 -1.26 -4.50 117.16 118.10 1o9a n TYR 70 Ca 0.14 0.30 0.01 0.00 -0.01 0.00 0.00 57.90 58.34 1o9a n TYR 70 Cb 0.09 -1.17 -0.02 0.00 -0.02 0.00 0.00 39.34 38.22 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 -3.33 0.00 -1.59 -0.72 -2.24 -1.20 -5.02 114.28 100.18 1o9a n THR 71 Ca -0.27 -0.17 -0.00 0.00 -2.27 0.00 0.00 64.05 61.34 1o9a n THR 71 Cb 1.05 0.60 -0.00 0.00 -2.10 0.00 0.00 70.33 69.88 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 1.97 0.38 3.51 3.38 0.00 0.94 -5.06 105.19 110.31 1o9a n GLY 72 Ca -0.00 -0.97 -0.28 0.00 0.00 0.00 0.00 46.02 44.77 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 -3.00 3.97 -0.04 1.61 0.01 -1.17 -4.94 114.94 111.39 1o9a s ASN 73 Ca 0.00 -0.63 0.02 0.00 -0.71 0.00 0.00 52.86 51.53 1o9a s ASN 73 Cb 0.00 -0.57 -0.03 0.00 0.41 0.00 0.00 41.25 41.06 1o9a s ASN 73 CO 0.00 0.13 -0.06 -0.89 -1.51 0.00 0.00 177.10 174.77 1o9a s THR 74 N -1.53 3.72 0.22 1.60 2.01 -1.26 -1.24 115.64 119.16 1o9a s THR 74 Ca 0.22 -0.60 0.07 0.00 0.31 0.00 0.00 61.69 61.69 1o9a s THR 74 Cb -0.09 -2.57 -0.05 0.00 0.01 0.00 0.00 72.50 69.80 1o9a s THR 74 CO 0.12 0.50 -0.11 -0.31 -0.69 0.00 0.00 174.62 174.14 1o9a s TYR 75 N -0.90 1.71 0.16 4.92 1.51 -0.19 -4.99 117.35 119.57 1o9a s TYR 75 Ca 0.15 -0.65 0.03 0.00 -1.01 0.00 0.00 57.07 55.59 1o9a s TYR 75 Cb -0.11 -0.86 -0.04 0.00 -0.11 0.00 0.00 41.96 40.84 1o9a s TYR 75 CO 0.04 0.28 0.25 0.50 -1.11 0.00 0.00 175.55 175.51 1o9a s ARG 76 N -3.69 3.29 0.41 -0.62 6.06 -1.26 -0.48 118.95 122.66 1o9a s ARG 76 Ca 0.24 -0.69 0.11 0.00 -2.50 0.00 0.00 55.73 52.89 1o9a s ARG 76 Cb 0.01 -2.87 0.59 0.00 0.06 0.00 0.00 34.95 32.74 1o9a s ARG 76 CO 0.07 0.50 1.21 -0.24 -2.50 0.00 0.00 175.30 174.35 1o9a h VAL 77 N 1.69 0.00 -1.31 7.11 3.04 -1.55 0.24 116.25 125.46 1o9a h VAL 77 Ca -0.49 0.00 -0.59 0.00 -1.01 0.00 0.00 66.70 64.62 1o9a h VAL 77 Cb 1.20 0.24 -0.41 0.00 -2.01 0.00 0.00 31.29 30.31 1o9a h VAL 77 CO 0.66 0.00 -0.66 0.61 -1.01 0.00 0.00 177.57 177.18 1o9a n GLY 78 N -1.28 6.10 3.30 3.17 0.00 -1.26 -4.10 105.19 111.11 1o9a n GLY 78 Ca -0.01 -2.72 -0.10 0.00 0.00 0.00 0.00 46.02 43.19 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 -3.43 0.11 0.05 1.61 1.11 0.07 -5.09 116.67 111.10 1o9a s ASP 79 Ca 0.49 -1.11 -0.00 0.00 0.18 0.00 0.00 52.55 52.12 1o9a s ASP 79 Cb 0.41 0.41 -0.03 0.00 1.07 0.00 0.00 42.92 44.77 1o9a s ASP 79 CO -0.13 -0.88 -0.04 0.42 1.18 0.00 0.00 175.17 175.72 1o9a s THR 80 N -4.05 0.29 0.07 -1.27 -4.23 -1.26 -2.08 115.64 103.11 1o9a s THR 80 Ca 0.26 -1.53 -0.17 0.00 -1.18 0.00 0.00 61.69 59.06 1o9a s THR 80 Cb 0.05 -1.14 0.03 0.00 1.34 0.00 0.00 72.50 72.78 1o9a s THR 80 CO 0.05 -0.80 0.40 -0.72 -0.54 0.00 0.00 174.62 173.02 1o9a s TYR 81 N -3.02 -0.23 -0.23 3.99 1.13 -0.94 -5.00 117.35 113.05 1o9a s TYR 81 Ca 0.00 0.10 -0.05 0.00 -1.41 0.00 0.00 57.07 55.71 1o9a s TYR 81 Cb 0.01 0.22 -0.02 0.00 -1.10 0.00 0.00 41.96 41.08 1o9a s TYR 81 CO -0.06 -0.61 0.00 -1.21 -2.51 0.00 0.00 175.55 171.17 1o9a s GLU 82 N -2.89 3.52 -0.07 -3.49 2.02 -1.26 -2.47 118.70 114.06 1o9a s GLU 82 Ca -0.03 -0.56 -0.03 0.00 0.02 0.00 0.00 54.97 54.38 1o9a s GLU 82 Cb 0.00 -3.13 0.04 0.00 0.10 0.00 0.00 34.13 31.14 1o9a s GLU 82 CO -0.05 -0.16 0.07 0.50 0.02 0.00 0.00 175.26 175.64 1o9a s ARG 83 N 1.44 -0.04 1.01 1.61 3.00 -0.37 -5.00 118.95 120.59 1o9a s ARG 83 Ca 0.05 0.28 -0.11 0.00 -1.00 0.00 0.00 55.73 54.95 1o9a s ARG 83 Cb -0.15 -0.80 0.20 0.00 0.00 0.00 0.00 34.95 34.20 1o9a s ARG 83 CO 0.00 -0.40 1.09 -2.14 0.00 0.00 0.00 175.30 173.85 1o9a s PRO 84 N 2.16 0.32 -0.29 5.12 0.02 -1.26 -1.47 135.00 139.59 1o9a s PRO 84 Ca 0.04 1.15 -0.25 0.00 0.02 0.00 0.00 61.00 61.97 1o9a s PRO 84 Cb -0.13 -1.67 0.17 0.00 0.02 0.00 0.00 34.50 32.89 1o9a s PRO 84 CO -0.04 -2.98 1.34 0.15 -0.33 0.00 0.00 177.00 175.13 1o9a s LYS 85 N -4.63 0.17 -1.31 5.54 1.02 0.08 -4.66 119.74 115.94 1o9a s LYS 85 Ca 0.67 0.20 -0.01 0.00 0.02 0.00 0.00 55.97 56.85 1o9a s LYS 85 Cb -0.23 0.08 -0.00 0.00 -0.52 0.00 0.00 37.83 37.16 1o9a s LYS 85 CO 0.60 -0.02 0.66 -0.25 -0.92 0.00 0.00 175.35 175.42 1o9a n ASP 86 N 1.78 -1.21 0.00 2.83 9.92 -1.26 -0.73 116.55 127.88 1o9a n ASP 86 Ca -0.11 -0.86 0.00 0.00 -0.53 0.00 0.00 54.79 53.29 1o9a n ASP 86 Cb 0.57 -3.89 0.00 0.00 -0.64 0.00 0.00 41.12 37.16 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 -3.04 0.00 -0.44 -2.24 2.88 -1.26 -4.92 113.62 104.60 1o9a n SER 87 Ca -0.29 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.25 1o9a n SER 87 Cb 0.68 -1.59 0.00 0.00 -0.75 0.00 0.00 64.21 62.55 1o9a n SER 87 CO 0.00 0.00 0.00 0.23 -1.23 0.00 0.00 175.04 174.04 1o9a n MET 88 N -2.00 3.24 -3.76 -1.46 2.81 0.09 -5.14 117.12 110.89 1o9a n MET 88 Ca 0.00 0.00 -0.20 0.00 -1.81 0.00 0.00 57.70 55.69 1o9a n MET 88 Cb 0.00 0.00 -0.17 0.00 -0.71 0.00 0.00 33.22 32.34 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 0.95 0.11 -0.22 2.02 1.10 -1.26 -0.74 121.20 123.15 1o9a s ILE 89 Ca 0.00 0.25 -0.07 0.00 -0.51 0.00 0.00 60.65 60.32 1o9a s ILE 89 Cb 0.00 -0.30 -0.03 0.00 0.15 0.00 0.00 42.46 42.28 1o9a s ILE 89 CO 0.00 0.19 0.06 0.26 -2.11 0.00 0.00 174.94 173.34 1o9a s TRP 90 N 1.81 3.12 -1.31 3.50 0.52 -0.54 -0.64 118.94 125.38 1o9a s TRP 90 Ca 0.01 -0.28 -0.09 0.00 0.02 0.00 0.00 56.10 55.77 1o9a s TRP 90 Cb -0.12 -2.17 0.14 0.00 -1.15 0.00 0.00 33.47 30.17 1o9a s TRP 90 CO -0.03 -0.19 2.06 -3.47 0.02 0.00 0.00 176.95 175.33 1o9a n ASP 91 N 4.42 5.87 -4.76 2.95 -0.08 0.20 -1.24 116.55 123.91 1o9a n ASP 91 Ca -0.16 -3.08 -0.41 0.00 -1.51 0.00 0.00 54.79 49.62 1o9a n ASP 91 Cb 0.52 -1.46 -0.01 0.00 2.34 0.00 0.00 41.12 42.51 1o9a n ASP 91 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1o9a s THR 93 N -0.58 2.91 -0.24 0.00 -4.23 0.17 -2.23 115.64 111.46 1o9a s THR 93 Ca 0.57 -0.80 -0.15 0.00 -1.18 0.00 0.00 61.69 60.13 1o9a s THR 93 Cb -0.46 -2.13 -0.04 0.00 1.34 0.00 0.00 72.50 71.20 1o9a s THR 93 CO 0.55 0.57 0.36 0.00 -0.54 0.00 0.00 174.62 175.57 1o9a n ILE 95 N 4.68 0.00 0.00 0.00 2.08 -0.94 -4.16 119.36 121.02 1o9a n ILE 95 Ca -0.09 0.00 0.00 0.00 0.56 0.00 0.00 62.75 63.22 1o9a n ILE 95 Cb 0.51 -0.56 0.00 0.00 -0.75 0.00 0.00 39.64 38.84 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 0.70 0.30 7.39 0.00 -1.25 -4.15 105.19 113.17 1o9a n GLY 96 Ca 0.00 -0.03 0.14 0.00 0.00 0.00 0.00 46.02 46.13 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 0.00 0.46 0.11 4.61 0.00 -1.26 0.00 120.51 124.43 1o9a n ALA 97 Ca 0.00 0.92 -0.13 0.00 0.00 0.00 0.00 53.44 54.23 1o9a n ALA 97 Cb 0.00 -0.69 -0.08 0.00 0.00 0.00 0.00 19.45 18.68 1o9a n ALA 97 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1o9a h GLY 98 N 0.00 -0.27 0.00 0.00 0.00 -1.98 -3.47 103.07 97.35 1o9a h GLY 98 Ca 0.53 0.10 0.00 0.00 0.00 0.00 0.00 47.33 47.96 1o9a h GLY 98 CO -0.81 -0.10 0.00 -2.13 0.00 0.00 0.00 176.54 173.50 1o9a n ARG 99 N -5.09 0.00 0.00 4.80 0.00 0.10 -5.07 116.66 111.40 1o9a n ARG 99 Ca -0.09 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.76 1o9a n ARG 99 Cb 0.21 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.67 1o9a n ARG 99 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1o9a n GLY 100 N -1.01 -1.66 3.39 5.14 0.00 -1.20 -4.90 105.19 104.94 1o9a n GLY 100 Ca 0.00 0.65 -0.27 0.00 0.00 0.00 0.00 46.02 46.39 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 1.41 -0.29 1.61 1.70 -1.26 -4.95 118.95 117.17 1o9a s ARG 101 Ca 0.00 -1.40 0.01 0.00 -0.47 0.00 0.00 55.73 53.86 1o9a s ARG 101 Cb 0.00 -1.78 0.06 0.00 -0.57 0.00 0.00 34.95 32.66 1o9a s ARG 101 CO 0.00 0.40 -0.03 0.42 -1.08 0.00 0.00 175.30 175.01 1o9a s ILE 102 N -1.38 2.61 -0.11 4.99 1.01 -1.26 -2.23 121.20 124.82 1o9a s ILE 102 Ca 0.16 -1.59 -0.23 0.00 0.00 0.00 0.00 60.65 58.98 1o9a s ILE 102 Cb -0.09 -2.56 -0.03 0.00 0.01 0.00 0.00 42.46 39.80 1o9a s ILE 102 CO 0.07 -0.14 0.72 -0.44 0.00 0.00 0.00 174.94 175.16 1o9a s SER 103 N 1.19 6.93 -0.27 3.58 0.01 -0.71 -4.97 113.70 119.45 1o9a s SER 103 Ca -0.05 1.12 -0.01 0.00 1.31 0.00 0.00 55.95 58.32 1o9a s SER 103 Cb -0.20 -2.41 0.04 0.00 0.21 0.00 0.00 66.02 63.66 1o9a s SER 103 CO -0.03 -0.21 -0.04 0.00 0.41 0.00 0.00 173.24 173.37 1o9a s THR 105 N 1.28 4.32 0.41 0.00 2.01 -1.25 -4.92 115.64 117.49 1o9a s THR 105 Ca -0.03 -0.75 -0.15 0.00 0.31 0.00 0.00 61.69 61.08 1o9a s THR 105 Cb -0.18 -3.02 -0.08 0.00 0.01 0.00 0.00 72.50 69.22 1o9a s THR 105 CO -0.03 0.21 0.83 -0.51 -0.69 0.00 0.00 174.62 174.43 1o9a s ILE 106 N -1.27 4.65 -0.41 1.82 -1.16 -1.26 0.61 121.20 124.17 1o9a s ILE 106 Ca 0.25 0.96 0.02 0.00 -0.51 0.00 0.00 60.65 61.37 1o9a s ILE 106 Cb -0.12 -3.68 0.26 0.00 0.61 0.00 0.00 42.46 39.54 1o9a s ILE 106 CO 0.17 -0.43 1.08 0.00 -2.81 0.00 0.00 174.94 172.94 1o9a n ALA 107 N -1.00 -2.46 -1.99 1.50 0.00 0.18 -4.63 120.51 112.11 1o9a n ALA 107 Ca 0.04 -0.86 -0.41 0.00 0.00 0.00 0.00 53.44 52.21 1o9a n ALA 107 Cb 0.54 -2.28 -0.03 0.00 0.00 0.00 0.00 19.45 17.68 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 -0.96 5.65 0.00 0.00 2.47 -1.23 -4.58 114.94 116.29 1o9a s ASN 108 Ca 0.28 1.03 0.11 0.00 0.42 0.00 0.00 52.86 54.71 1o9a s ASN 108 Cb 0.22 -2.53 0.09 0.00 -1.45 0.00 0.00 41.25 37.59 1o9a s ASN 108 CO -0.16 -1.95 0.85 0.54 -3.72 0.00 0.00 177.10 172.66