#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 1.92 0.70 1.43 2.20 -1.26 -5.12 119.74 119.61 1o9a s LYS 18 Ca 0.00 -1.32 -0.14 0.00 -0.36 0.00 0.00 55.97 54.15 1o9a s LYS 18 Cb 0.00 -2.83 0.02 0.00 -1.51 0.00 0.00 37.83 33.51 1o9a s LYS 18 CO 0.00 -0.64 1.12 -1.25 -0.36 0.00 0.00 175.35 174.22 1o9a s PRO 19 N 1.16 2.53 0.00 4.03 0.04 -1.26 -4.88 135.00 136.63 1o9a s PRO 19 Ca -0.05 1.40 0.00 0.00 0.04 0.00 0.00 61.00 62.40 1o9a s PRO 19 Cb -0.19 -1.92 0.00 0.00 0.04 0.00 0.00 34.50 32.43 1o9a s PRO 19 CO -0.06 -1.46 0.00 0.41 0.04 0.00 0.00 177.00 175.93 1o9a n GLY 20 N -0.50 1.09 1.95 0.56 0.00 -1.26 -4.70 105.19 102.33 1o9a n GLY 20 Ca 0.11 -0.68 -0.30 0.00 0.00 0.00 0.00 46.02 45.14 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 -0.26 3.16 0.80 0.00 5.04 -1.26 -3.72 117.35 121.10 1o9a s TYR 22 Ca 0.44 -0.14 -0.12 0.00 -2.44 0.00 0.00 57.07 54.81 1o9a s TYR 22 Cb -0.63 -2.16 0.07 0.00 0.35 0.00 0.00 41.96 39.59 1o9a s TYR 22 CO 0.32 -0.09 1.13 0.34 -1.34 0.00 0.00 175.55 175.91 1o9a s ASP 23 N 0.97 4.59 0.00 4.32 2.15 -0.01 -4.88 116.67 123.82 1o9a s ASP 23 Ca 0.04 1.04 0.01 0.00 0.43 0.00 0.00 52.55 54.06 1o9a s ASP 23 Cb -0.14 -1.69 0.05 0.00 -0.30 0.00 0.00 42.92 40.84 1o9a s ASP 23 CO 0.03 -1.88 0.34 -3.20 -0.17 0.00 0.00 175.17 170.29 1o9a n ASN 24 N -3.34 0.00 0.01 -0.34 5.15 -1.26 -3.77 115.26 111.72 1o9a n ASN 24 Ca 0.07 -0.07 0.00 0.00 -0.60 0.00 0.00 54.58 53.99 1o9a n ASN 24 Cb 0.58 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.83 1o9a n ASN 24 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1o9a n GLY 25 N -0.70 -0.38 3.40 8.20 0.00 -1.26 -5.15 105.19 109.30 1o9a n GLY 25 Ca 0.01 0.05 -0.21 0.00 0.00 0.00 0.00 46.02 45.86 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 -2.00 1.47 -0.13 1.61 2.47 -1.25 -5.14 119.74 116.78 1o9a s LYS 26 Ca 0.00 -1.65 -0.02 0.00 -1.56 0.00 0.00 55.97 52.73 1o9a s LYS 26 Cb 0.00 -1.40 -0.03 0.00 -1.46 0.00 0.00 37.83 34.94 1o9a s LYS 26 CO 0.00 0.25 -0.04 -3.38 0.16 0.00 0.00 175.35 172.34 1o9a s HIS 27 N -2.73 3.01 0.25 4.03 -3.43 -1.26 -0.83 115.29 114.33 1o9a s HIS 27 Ca 0.25 -0.17 0.05 0.00 -0.80 0.00 0.00 55.06 54.39 1o9a s HIS 27 Cb -0.03 -1.88 -0.05 0.00 -1.43 0.00 0.00 32.58 29.19 1o9a s HIS 27 CO 0.10 0.11 -0.05 0.71 -2.00 0.00 0.00 174.74 173.61 1o9a s TYR 28 N -0.07 1.74 1.00 0.38 2.02 -1.24 -5.00 117.35 116.18 1o9a s TYR 28 Ca 0.02 -0.78 -0.18 0.00 -0.37 0.00 0.00 57.07 55.76 1o9a s TYR 28 Cb -0.13 -0.98 -0.08 0.00 -0.40 0.00 0.00 41.96 40.37 1o9a s TYR 28 CO 0.03 0.15 -0.54 1.04 -1.57 0.00 0.00 175.55 174.66 1o9a n GLN 29 N -0.48 -0.26 0.07 -0.62 6.02 -1.26 -4.29 117.38 116.56 1o9a n GLN 29 Ca -0.06 -0.06 0.04 0.00 -0.01 0.00 0.00 57.00 56.91 1o9a n GLN 29 Cb 0.63 -1.30 0.21 0.00 1.02 0.00 0.00 30.24 30.80 1o9a n GLN 29 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 177.06 175.16 1o9a n ILE 30 N -3.19 1.35 -2.42 5.09 5.41 -1.26 -2.49 119.36 121.84 1o9a n ILE 30 Ca 0.01 0.60 -0.03 0.00 1.00 0.00 0.00 62.75 64.33 1o9a n ILE 30 Cb 0.60 -1.60 0.03 0.00 -0.71 0.00 0.00 39.64 37.95 1o9a n ILE 30 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 176.55 176.09 1o9a n ASN 31 N -1.75 -0.46 -4.69 4.38 0.23 -1.24 -2.36 115.26 109.37 1o9a n ASN 31 Ca -0.01 -2.08 -0.26 0.00 -0.53 0.00 0.00 54.58 51.71 1o9a n ASN 31 Cb 0.10 0.22 0.10 0.00 -2.08 0.00 0.00 39.78 38.13 1o9a n ASN 31 CO 0.00 0.00 0.00 -1.10 -0.93 0.00 0.00 177.26 175.23 1o9a s GLN 32 N -0.51 1.73 0.13 -3.83 -0.21 -1.04 -4.58 119.66 111.36 1o9a s GLN 32 Ca 0.12 -0.52 0.07 0.00 0.02 0.00 0.00 55.36 55.06 1o9a s GLN 32 Cb 0.26 -2.15 -0.04 0.00 1.00 0.00 0.00 33.01 32.08 1o9a s GLN 32 CO -0.08 -1.54 -0.16 -0.65 -2.12 0.00 0.00 175.29 170.75 1o9a s GLN 33 N -5.35 1.11 0.10 2.91 1.11 -1.26 -1.42 119.66 116.86 1o9a s GLN 33 Ca 0.65 -1.28 -0.19 0.00 0.01 0.00 0.00 55.36 54.55 1o9a s GLN 33 Cb -0.08 -1.10 0.04 0.00 -1.01 0.00 0.00 33.01 30.87 1o9a s GLN 33 CO 0.46 0.22 0.46 1.67 0.01 0.00 0.00 175.29 178.11 1o9a s TRP 34 N -1.98 -0.31 0.07 0.91 -2.14 -0.97 -4.99 118.94 109.53 1o9a s TRP 34 Ca 0.11 0.13 -0.23 0.00 2.66 0.00 0.00 56.10 58.78 1o9a s TRP 34 Cb -0.06 0.31 -0.06 0.00 -3.10 0.00 0.00 33.47 30.56 1o9a s TRP 34 CO 0.04 -0.69 0.68 -1.21 -2.66 0.00 0.00 176.95 173.11 1o9a s GLU 35 N -3.28 4.40 0.14 3.25 2.02 -1.26 -1.15 118.70 122.81 1o9a s GLU 35 Ca -0.01 0.92 -0.13 0.00 0.02 0.00 0.00 54.97 55.78 1o9a s GLU 35 Cb 0.00 -3.30 0.02 0.00 0.10 0.00 0.00 34.13 30.95 1o9a s GLU 35 CO -0.08 0.47 0.36 0.50 0.02 0.00 0.00 175.26 176.52 1o9a s ARG 36 N -0.63 1.10 0.03 1.61 3.52 -0.71 -4.93 118.95 118.93 1o9a s ARG 36 Ca 0.34 -0.88 0.06 0.00 -0.13 0.00 0.00 55.73 55.12 1o9a s ARG 36 Cb -0.20 0.43 -0.02 0.00 -1.56 0.00 0.00 34.95 33.60 1o9a s ARG 36 CO 0.21 -0.42 -0.19 0.99 -0.81 0.00 0.00 175.30 175.09 1o9a s THR 37 N -3.86 1.49 -0.20 4.11 2.01 -1.26 0.14 115.64 118.07 1o9a s THR 37 Ca 0.07 -1.03 -0.02 0.00 0.31 0.00 0.00 61.69 61.02 1o9a s THR 37 Cb 0.02 -1.29 0.06 0.00 0.01 0.00 0.00 72.50 71.30 1o9a s THR 37 CO -0.08 0.23 0.01 -0.47 -0.69 0.00 0.00 174.62 173.62 1o9a s TYR 38 N -0.70 1.38 0.00 4.92 5.04 0.49 -4.85 117.35 123.63 1o9a s TYR 38 Ca 0.06 -1.06 0.00 0.00 -2.44 0.00 0.00 57.07 53.63 1o9a s TYR 38 Cb -0.08 -1.17 0.00 0.00 0.35 0.00 0.00 41.96 41.06 1o9a s TYR 38 CO 0.01 -0.64 0.00 1.28 -1.34 0.00 0.00 175.55 174.86 1o9a n LEU 39 N 4.95 0.00 0.00 6.97 4.32 -1.26 -2.48 117.00 129.50 1o9a n LEU 39 Ca -0.10 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.89 1o9a n LEU 39 Cb 0.47 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.27 1o9a n LEU 39 CO 0.14 0.00 0.00 0.61 -1.22 0.00 0.00 177.39 176.92 1o9a n GLY 40 N 0.00 0.00 3.51 -0.72 0.00 -1.26 -5.15 105.19 101.57 1o9a n GLY 40 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 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 4.42 -0.49 1.61 2.20 -1.04 -5.08 114.94 116.56 1o9a s ASN 41 Ca 0.00 -0.13 -0.23 0.00 -0.94 0.00 0.00 52.86 51.55 1o9a s ASN 41 Cb 0.00 -1.28 0.03 0.00 -2.00 0.00 0.00 41.25 38.00 1o9a s ASN 41 CO 0.00 0.29 0.83 0.00 -2.94 0.00 0.00 177.10 175.28 1o9a s ALA 42 N -0.39 3.26 -0.05 3.54 0.00 -1.26 -0.38 121.76 126.48 1o9a s ALA 42 Ca 0.05 -1.14 0.04 0.00 0.00 0.00 0.00 51.96 50.91 1o9a s ALA 42 Cb -0.12 -3.55 -0.02 0.00 0.00 0.00 0.00 23.12 19.42 1o9a s ALA 42 CO 0.02 -2.08 -0.15 -0.51 0.00 0.00 0.00 175.76 173.04 1o9a s LEU 43 N 3.46 2.70 -0.21 0.00 2.01 0.36 -1.57 118.68 125.44 1o9a s LEU 43 Ca 0.29 -0.22 -0.23 0.00 0.01 0.00 0.00 54.13 53.98 1o9a s LEU 43 Cb -0.13 -1.55 -0.02 0.00 0.01 0.00 0.00 46.19 44.51 1o9a s LEU 43 CO 0.21 0.33 0.74 0.68 1.01 0.00 0.00 176.35 179.32 1o9a s VAL 44 N -0.66 4.93 0.22 -1.59 -7.23 0.11 -1.74 120.40 114.44 1o9a s VAL 44 Ca 0.10 1.41 -0.07 0.00 -1.81 0.00 0.00 61.98 61.61 1o9a s VAL 44 Cb -0.11 -4.05 -0.06 0.00 0.56 0.00 0.00 36.38 32.72 1o9a s VAL 44 CO 0.01 0.03 0.51 0.00 -0.31 0.00 0.00 175.10 175.33 1o9a s THR 46 N -1.84 3.77 0.03 0.00 2.01 0.19 -2.28 115.64 117.52 1o9a s THR 46 Ca 0.45 -1.51 0.01 0.00 0.31 0.00 0.00 61.69 60.95 1o9a s THR 46 Cb -0.11 -2.94 -0.04 0.00 0.01 0.00 0.00 72.50 69.42 1o9a s THR 46 CO 0.24 -0.19 0.09 0.00 -0.69 0.00 0.00 174.62 174.07 1o9a n TYR 48 N 0.82 0.00 -0.53 0.00 4.01 -0.99 -3.66 117.16 116.81 1o9a n TYR 48 Ca -0.11 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.63 1o9a n TYR 48 Cb 0.52 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.55 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 1.64 -2.46 0.00 2.72 0.00 -1.26 -4.68 105.19 101.16 1o9a n GLY 49 Ca 0.00 -0.80 0.00 0.00 0.00 0.00 0.00 46.02 45.22 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 0.61 -0.19 0.00 -0.02 0.00 -1.26 -4.42 105.19 99.91 1o9a n GLY 50 Ca 0.00 -1.95 0.10 0.00 0.00 0.00 0.00 46.02 44.17 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 0.00 0.14 1.61 7.64 -1.26 -2.81 113.62 118.94 1o9a n SER 51 Ca 0.00 -0.46 0.13 0.00 1.01 0.00 0.00 58.87 59.55 1o9a n SER 51 Cb 0.00 -0.09 0.45 0.00 -1.01 0.00 0.00 64.21 63.56 1o9a n SER 51 CO 0.00 0.00 0.00 0.03 -3.01 0.00 0.00 175.04 172.06 1o9a h ARG 52 N 0.00 0.00 0.00 1.43 3.08 -1.94 -3.48 114.38 113.46 1o9a h ARG 52 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1o9a h ARG 52 Cb 0.06 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.11 1o9a h ARG 52 CO 0.00 0.00 0.00 0.41 -1.07 0.00 0.00 179.97 179.31 1o9a n GLY 53 N 0.63 0.91 3.06 0.04 0.00 -1.13 -4.76 105.19 103.94 1o9a n GLY 53 Ca 0.04 -0.77 -0.23 0.00 0.00 0.00 0.00 46.02 45.05 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 1.35 -0.19 1.61 -0.71 -1.26 -3.82 117.98 114.96 1o9a s PHE 54 Ca 0.00 -0.39 -0.08 0.00 -1.04 0.00 0.00 56.93 55.42 1o9a s PHE 54 Cb 0.00 -0.94 -0.04 0.00 -1.21 0.00 0.00 43.02 40.83 1o9a s PHE 54 CO 0.00 -0.16 0.07 1.21 -1.34 0.00 0.00 175.22 175.01 1o9a s ASN 55 N 0.21 5.71 0.08 1.98 2.47 -1.20 -4.85 114.94 119.33 1o9a s ASN 55 Ca -0.05 0.09 -0.03 0.00 0.42 0.00 0.00 52.86 53.30 1o9a s ASN 55 Cb -0.11 -1.98 -0.05 0.00 -1.45 0.00 0.00 41.25 37.66 1o9a s ASN 55 CO 0.02 0.17 0.27 0.00 -3.72 0.00 0.00 177.10 173.83 1o9a s GLU 57 N -2.42 0.01 0.02 0.00 2.02 -0.00 -4.88 118.70 113.45 1o9a s GLU 57 Ca 0.35 0.24 -0.35 0.00 0.02 0.00 0.00 54.97 55.23 1o9a s GLU 57 Cb -0.13 -0.98 -0.18 0.00 0.10 0.00 0.00 34.13 32.94 1o9a s GLU 57 CO 0.25 -0.47 0.92 0.43 0.02 0.00 0.00 175.26 176.40 1o9a n SER 58 N 5.30 -0.16 -4.87 -0.19 7.64 -1.26 -0.71 113.62 119.37 1o9a n SER 58 Ca -0.05 1.06 -0.33 0.00 1.01 0.00 0.00 58.87 60.56 1o9a n SER 58 Cb 0.50 -0.85 -0.05 0.00 -1.01 0.00 0.00 64.21 62.79 1o9a n SER 58 CO 0.00 0.00 0.00 -1.59 -3.01 0.00 0.00 175.04 170.44 1o9a s LYS 59 N -0.12 3.81 -0.05 1.43 -2.85 -0.61 -4.74 119.74 116.62 1o9a s LYS 59 Ca 0.80 0.25 -0.30 0.00 -1.00 0.00 0.00 55.97 55.72 1o9a s LYS 59 Cb -1.13 -2.84 -0.04 0.00 -2.06 0.00 0.00 37.83 31.77 1o9a s LYS 59 CO 0.52 0.44 1.32 -1.25 0.10 0.00 0.00 175.35 176.48 1o9a s PRO 60 N -2.35 4.30 0.00 1.78 0.04 -1.26 -4.96 135.00 132.54 1o9a s PRO 60 Ca 0.40 1.83 0.00 0.00 0.04 0.00 0.00 61.00 63.27 1o9a s PRO 60 Cb -0.13 -3.62 0.00 0.00 0.04 0.00 0.00 34.50 30.80 1o9a s PRO 60 CO 0.20 -0.56 0.00 0.39 0.04 0.00 0.00 177.00 177.07 1o9a n GLU 61 N 5.57 2.63 0.00 4.56 -0.58 -1.26 -5.08 120.64 126.49 1o9a n GLU 61 Ca 0.13 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.87 1o9a n GLU 61 Cb 0.45 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.32 1o9a n GLU 61 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1o9a n ALA 62 N -3.00 0.32 -2.50 0.62 0.00 -1.26 -4.96 120.51 109.73 1o9a n ALA 62 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 53.44 53.03 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 -0.42 5.03 -1.79 0.00 1.02 -1.26 -5.01 120.64 118.21 1o9a n GLU 63 Ca 0.00 -4.29 -0.42 0.00 -0.02 0.00 0.00 57.16 52.43 1o9a n GLU 63 Cb 0.00 -2.54 -0.02 0.00 -0.02 0.00 0.00 31.44 28.86 1o9a n GLU 63 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 1o9a s GLU 64 N -3.11 4.14 0.21 3.49 2.02 -1.26 -5.00 118.70 119.19 1o9a s GLU 64 Ca 0.42 2.55 -0.00 0.00 0.02 0.00 0.00 54.97 57.95 1o9a s GLU 64 Cb 0.17 -3.05 -0.04 0.00 0.10 0.00 0.00 34.13 31.30 1o9a s GLU 64 CO -0.08 -0.65 0.12 0.95 0.02 0.00 0.00 175.26 175.61 1o9a s THR 65 N 0.39 0.14 -0.08 3.63 -4.23 -1.26 -2.98 115.64 111.25 1o9a s THR 65 Ca 0.66 -1.99 0.01 0.00 -1.18 0.00 0.00 61.69 59.19 1o9a s THR 65 Cb -0.48 -2.49 0.02 0.00 1.34 0.00 0.00 72.50 70.89 1o9a s THR 65 CO 0.42 -0.04 -0.09 0.00 -0.54 0.00 0.00 174.62 174.38 1o9a s PHE 67 N 1.16 3.49 -0.23 0.00 5.36 -1.26 -0.56 117.98 125.94 1o9a s PHE 67 Ca -0.06 0.23 -0.01 0.00 -0.96 0.00 0.00 56.93 56.13 1o9a s PHE 67 Cb -0.14 -1.76 0.07 0.00 -0.34 0.00 0.00 43.02 40.85 1o9a s PHE 67 CO -0.02 0.48 0.03 0.34 -1.46 0.00 0.00 175.22 174.59 1o9a s ASP 68 N -3.05 3.44 0.00 6.13 2.15 -0.85 -4.97 116.67 119.52 1o9a s ASP 68 Ca 0.36 -1.13 0.18 0.00 0.43 0.00 0.00 52.55 52.39 1o9a s ASP 68 Cb -0.11 -0.81 1.05 0.00 -0.30 0.00 0.00 42.92 42.74 1o9a s ASP 68 CO 0.28 -0.32 1.46 0.29 -0.17 0.00 0.00 175.17 176.71 1o9a n LYS 69 N 4.90 0.59 -0.00 4.34 4.01 -1.26 -0.43 118.16 130.30 1o9a n LYS 69 Ca -0.08 0.00 -0.17 0.00 -0.51 0.00 0.00 58.31 57.55 1o9a n LYS 69 Cb 0.45 -1.47 -0.14 0.00 -0.51 0.00 0.00 35.03 33.36 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 -0.97 1.16 0.58 2.13 4.02 -1.26 -4.32 117.16 118.50 1o9a n TYR 70 Ca 0.13 0.30 0.06 0.00 -0.01 0.00 0.00 57.90 58.38 1o9a n TYR 70 Cb 0.06 -1.17 -0.06 0.00 -0.02 0.00 0.00 39.34 38.15 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 -1.83 -0.72 -2.24 -1.05 -4.99 114.28 100.12 1o9a n THR 71 Ca -0.27 -0.23 -0.14 0.00 -2.27 0.00 0.00 64.05 61.13 1o9a n THR 71 Cb 1.05 1.02 -0.04 0.00 -2.10 0.00 0.00 70.33 70.27 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 1.25 0.66 3.45 3.38 0.00 0.43 -5.00 105.19 109.36 1o9a n GLY 72 Ca 0.03 -0.31 -0.22 0.00 0.00 0.00 0.00 46.02 45.52 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 -2.61 2.81 0.19 1.61 0.01 -1.20 -5.00 114.94 110.76 1o9a s ASN 73 Ca 0.00 -1.22 0.09 0.00 -0.71 0.00 0.00 52.86 51.02 1o9a s ASN 73 Cb 0.00 -0.18 -0.04 0.00 0.41 0.00 0.00 41.25 41.44 1o9a s ASN 73 CO 0.00 -0.37 -0.12 -0.89 -1.51 0.00 0.00 177.10 174.21 1o9a s THR 74 N -3.01 3.06 0.21 1.60 2.01 -1.26 -2.01 115.64 116.23 1o9a s THR 74 Ca 0.31 -1.73 0.02 0.00 0.31 0.00 0.00 61.69 60.60 1o9a s THR 74 Cb 0.05 -2.51 -0.05 0.00 0.01 0.00 0.00 72.50 69.99 1o9a s THR 74 CO 0.13 -0.12 0.03 -0.31 -0.69 0.00 0.00 174.62 173.66 1o9a s TYR 75 N -1.72 1.35 0.39 4.92 2.02 0.28 -4.98 117.35 119.61 1o9a s TYR 75 Ca 0.24 -1.06 0.08 0.00 -0.37 0.00 0.00 57.07 55.96 1o9a s TYR 75 Cb -0.09 -0.78 -0.05 0.00 -0.40 0.00 0.00 41.96 40.65 1o9a s TYR 75 CO 0.14 -0.23 0.17 0.50 -1.57 0.00 0.00 175.55 174.57 1o9a s ARG 76 N -3.95 2.26 -0.35 -0.62 3.00 -1.26 -0.35 118.95 117.68 1o9a s ARG 76 Ca 0.29 -1.75 -0.28 0.00 -1.00 0.00 0.00 55.73 52.98 1o9a s ARG 76 Cb 0.07 -2.04 -0.01 0.00 0.00 0.00 0.00 34.95 32.96 1o9a s ARG 76 CO 0.07 -0.06 1.75 0.08 0.00 0.00 0.00 175.30 177.15 1o9a s VAL 77 N -2.55 3.53 0.00 7.11 1.01 -1.16 -2.87 120.40 125.47 1o9a s VAL 77 Ca 0.40 0.53 0.00 0.00 0.00 0.00 0.00 61.98 62.91 1o9a s VAL 77 Cb 0.02 -3.73 0.00 0.00 0.00 0.00 0.00 36.38 32.67 1o9a s VAL 77 CO 0.23 -0.48 0.00 0.61 0.00 0.00 0.00 175.10 175.46 1o9a n GLY 78 N 5.39 1.42 3.46 4.51 0.00 -1.07 -5.00 105.19 113.90 1o9a n GLY 78 Ca 0.22 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.98 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 -1.78 3.62 0.05 1.61 1.11 -1.14 -5.02 116.67 115.14 1o9a s ASP 79 Ca 0.00 -0.85 0.05 0.00 0.18 0.00 0.00 52.55 51.93 1o9a s ASP 79 Cb 0.00 -0.35 -0.02 0.00 1.07 0.00 0.00 42.92 43.61 1o9a s ASP 79 CO 0.00 0.10 -0.14 0.42 1.18 0.00 0.00 175.17 176.72 1o9a s THR 80 N -1.88 1.14 -0.01 -1.27 -4.23 -1.26 -0.52 115.64 107.62 1o9a s THR 80 Ca 0.24 -1.13 -0.07 0.00 -1.18 0.00 0.00 61.69 59.55 1o9a s THR 80 Cb -0.07 -1.06 0.00 0.00 1.34 0.00 0.00 72.50 72.71 1o9a s THR 80 CO 0.12 -0.07 0.14 -0.31 -0.54 0.00 0.00 174.62 173.96 1o9a s TYR 81 N -1.00 0.01 -0.24 3.99 1.51 -1.04 -4.98 117.35 115.60 1o9a s TYR 81 Ca 0.01 -0.05 -0.06 0.00 -1.01 0.00 0.00 57.07 55.96 1o9a s TYR 81 Cb -0.09 -0.03 -0.02 0.00 -0.11 0.00 0.00 41.96 41.71 1o9a s TYR 81 CO 0.02 -0.26 0.01 -1.21 -1.11 0.00 0.00 175.55 173.00 1o9a s GLU 82 N -1.19 3.50 0.02 -0.62 2.02 -1.26 -0.30 118.70 120.87 1o9a s GLU 82 Ca -0.13 -0.56 0.01 0.00 0.02 0.00 0.00 54.97 54.31 1o9a s GLU 82 Cb -0.07 -3.17 -0.02 0.00 0.10 0.00 0.00 34.13 30.98 1o9a s GLU 82 CO 0.01 -0.20 -0.05 1.03 0.02 0.00 0.00 175.26 176.07 1o9a s ARG 83 N 1.54 0.40 0.42 1.61 3.00 0.14 -4.97 118.95 121.09 1o9a s ARG 83 Ca 0.06 -0.54 -0.13 0.00 0.00 0.00 0.00 55.73 55.12 1o9a s ARG 83 Cb -0.15 -0.17 -0.07 0.00 0.00 0.00 0.00 34.95 34.56 1o9a s ARG 83 CO 0.00 0.03 0.83 -1.25 0.00 0.00 0.00 175.30 174.91 1o9a s PRO 84 N -1.13 3.87 -0.29 3.54 0.05 -1.26 -0.09 135.00 139.69 1o9a s PRO 84 Ca -0.08 0.64 -0.14 0.00 0.05 0.00 0.00 61.00 61.47 1o9a s PRO 84 Cb -0.08 -2.32 0.12 0.00 0.05 0.00 0.00 34.50 32.27 1o9a s PRO 84 CO -0.00 -0.07 0.75 0.15 0.05 0.00 0.00 177.00 177.88 1o9a s LYS 85 N -3.78 0.56 0.00 4.56 1.02 -0.28 -4.87 119.74 116.95 1o9a s LYS 85 Ca 0.54 1.17 0.00 0.00 0.02 0.00 0.00 55.97 57.70 1o9a s LYS 85 Cb -0.10 0.45 0.00 0.00 -0.52 0.00 0.00 37.83 37.66 1o9a s LYS 85 CO 0.29 -0.15 0.00 -3.47 -0.92 0.00 0.00 175.35 171.10 1o9a n ASP 86 N 4.75 0.00 0.00 2.83 -0.08 -1.26 -2.28 116.55 120.51 1o9a n ASP 86 Ca -0.15 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.13 1o9a n ASP 86 Cb 0.54 0.00 0.00 0.00 2.34 0.00 0.00 41.12 44.00 1o9a n ASP 86 CO 0.00 0.00 0.00 -1.20 0.12 0.00 0.00 177.20 176.12 1o9a n SER 87 N 3.09 0.00 -4.41 1.67 7.64 -1.26 -5.16 113.62 115.20 1o9a n SER 87 Ca 0.00 -0.12 -0.20 0.00 1.01 0.00 0.00 58.87 59.56 1o9a n SER 87 Cb 0.00 0.00 -0.10 0.00 -1.01 0.00 0.00 64.21 63.10 1o9a n SER 87 CO 0.00 0.00 0.00 -0.04 -3.01 0.00 0.00 175.04 171.99 1o9a s MET 88 N 0.00 1.53 -0.14 1.43 1.00 -0.97 -5.13 119.30 117.01 1o9a s MET 88 Ca 0.00 -1.80 -0.16 0.00 0.00 0.00 0.00 55.69 53.73 1o9a s MET 88 Cb 0.00 -0.91 -0.04 0.00 0.00 0.00 0.00 34.83 33.88 1o9a s MET 88 CO 0.00 -0.08 0.39 0.42 0.00 0.00 0.00 175.02 175.76 1o9a s ILE 89 N -3.22 5.24 -0.16 2.53 -1.09 -1.26 -1.13 121.20 122.11 1o9a s ILE 89 Ca 0.31 0.76 -0.00 0.00 -2.23 0.00 0.00 60.65 59.49 1o9a s ILE 89 Cb 0.06 -3.73 -0.00 0.00 -1.58 0.00 0.00 42.46 37.21 1o9a s ILE 89 CO 0.12 0.35 -0.13 0.26 -1.23 0.00 0.00 174.94 174.31 1o9a s TRP 90 N 0.62 2.82 -1.22 3.97 0.52 0.88 -0.68 118.94 125.85 1o9a s TRP 90 Ca 0.21 -0.99 -0.12 0.00 0.02 0.00 0.00 56.10 55.21 1o9a s TRP 90 Cb -0.14 -1.92 0.18 0.00 -1.15 0.00 0.00 33.47 30.44 1o9a s TRP 90 CO 0.07 -0.46 1.50 -3.47 0.02 0.00 0.00 176.95 174.61 1o9a n ASP 91 N 4.13 5.25 -4.55 2.95 -0.08 0.25 -0.69 116.55 123.81 1o9a n ASP 91 Ca -0.19 -3.02 -0.29 0.00 -1.51 0.00 0.00 54.79 49.79 1o9a n ASP 91 Cb 0.52 -1.54 -0.04 0.00 2.34 0.00 0.00 41.12 42.40 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 12.38 4.36 -0.26 0.00 -4.23 0.49 -2.49 115.64 125.89 1o9a s THR 93 Ca 0.90 1.81 -0.15 0.00 -1.18 0.00 0.00 61.69 63.07 1o9a s THR 93 Cb -0.14 -4.16 -0.04 0.00 1.34 0.00 0.00 72.50 69.50 1o9a s THR 93 CO 0.18 0.21 0.38 0.00 -0.54 0.00 0.00 174.62 174.84 1o9a n ILE 95 N 4.99 0.00 0.00 0.00 2.08 -1.24 -2.60 119.36 122.58 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 -0.22 0.00 0.00 -0.75 0.00 0.00 39.64 39.18 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 1.13 0.33 7.39 0.00 -1.26 -4.22 105.19 113.56 1o9a n GLY 96 Ca 0.00 -0.07 0.22 0.00 0.00 0.00 0.00 46.02 46.17 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 0.00 1.62 -2.50 4.61 0.00 -1.96 -2.81 119.26 118.22 1o9a h ALA 97 Ca 0.00 0.30 0.00 0.00 0.00 0.00 0.00 54.91 55.21 1o9a h ALA 97 Cb 0.00 0.46 0.00 0.00 0.00 0.00 0.00 17.79 18.25 1o9a h ALA 97 CO 0.00 -0.73 0.00 0.41 0.00 0.00 0.00 179.25 178.93 1o9a n GLY 98 N -1.39 -1.55 2.68 0.00 0.00 -1.26 -4.92 105.19 98.75 1o9a n GLY 98 Ca 0.30 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.26 1o9a n GLY 98 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1o9a n ARG 99 N -0.75 0.26 -2.93 1.61 0.63 -1.06 -5.07 116.66 109.34 1o9a n ARG 99 Ca 0.00 -0.93 -0.00 0.00 -0.92 0.00 0.00 57.85 56.00 1o9a n ARG 99 Cb 0.00 -0.46 -0.00 0.00 0.45 0.00 0.00 32.46 32.45 1o9a n ARG 99 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1o9a n GLY 100 N 1.67 -2.35 2.97 5.14 0.00 -1.23 -5.03 105.19 106.36 1o9a n GLY 100 Ca 0.04 0.29 -0.06 0.00 0.00 0.00 0.00 46.02 46.29 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 -1.29 0.42 -0.42 1.61 1.04 -1.26 -5.02 118.95 114.03 1o9a s ARG 101 Ca -0.01 0.49 -0.29 0.00 -1.04 0.00 0.00 55.73 54.88 1o9a s ARG 101 Cb 0.00 -0.20 0.02 0.00 -2.04 0.00 0.00 34.95 32.73 1o9a s ARG 101 CO 0.42 -0.79 1.25 -1.50 -0.04 0.00 0.00 175.30 174.65 1o9a s ILE 102 N 2.62 4.11 -0.16 4.99 2.07 -1.26 -3.70 121.20 129.88 1o9a s ILE 102 Ca 0.13 1.17 -0.23 0.00 -1.41 0.00 0.00 60.65 60.31 1o9a s ILE 102 Cb -0.14 -4.39 -0.02 0.00 0.13 0.00 0.00 42.46 38.04 1o9a s ILE 102 CO -0.22 -0.81 0.73 -0.55 -1.91 0.00 0.00 174.94 172.19 1o9a s SER 103 N 2.96 6.87 -0.33 4.50 0.15 0.05 -4.98 113.70 122.93 1o9a s SER 103 Ca 0.54 1.06 0.00 0.00 0.70 0.00 0.00 55.95 58.25 1o9a s SER 103 Cb -0.11 -2.41 0.08 0.00 -1.71 0.00 0.00 66.02 61.87 1o9a s SER 103 CO 0.30 -0.29 0.05 0.00 1.20 0.00 0.00 173.24 174.49 1o9a s THR 105 N 1.10 4.78 0.49 0.00 2.01 -1.21 -4.90 115.64 117.92 1o9a s THR 105 Ca 0.02 -0.78 -0.15 0.00 0.31 0.00 0.00 61.69 61.09 1o9a s THR 105 Cb -0.20 -3.37 -0.07 0.00 0.01 0.00 0.00 72.50 68.86 1o9a s THR 105 CO -0.04 0.03 0.93 -0.51 -0.69 0.00 0.00 174.62 174.34 1o9a s ILE 106 N -1.56 4.61 -0.41 1.82 -1.16 -1.26 0.87 121.20 124.10 1o9a s ILE 106 Ca 0.31 1.04 0.02 0.00 -0.51 0.00 0.00 60.65 61.52 1o9a s ILE 106 Cb -0.12 -3.73 0.26 0.00 0.61 0.00 0.00 42.46 39.49 1o9a s ILE 106 CO 0.24 -0.67 1.07 0.00 -2.81 0.00 0.00 174.94 172.78 1o9a n ALA 107 N -1.56 -2.34 -2.04 1.50 0.00 0.15 -4.63 120.51 111.58 1o9a n ALA 107 Ca 0.05 -0.91 -0.43 0.00 0.00 0.00 0.00 53.44 52.15 1o9a n ALA 107 Cb 0.54 -2.19 -0.03 0.00 0.00 0.00 0.00 19.45 17.78 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 -1.02 5.99 0.00 0.00 3.84 -1.24 -4.60 114.94 117.90 1o9a s ASN 108 Ca 0.28 1.28 0.30 0.00 0.21 0.00 0.00 52.86 54.94 1o9a s ASN 108 Cb 0.23 -2.53 1.51 0.00 -0.55 0.00 0.00 41.25 39.91 1o9a s ASN 108 CO -0.17 -1.64 2.00 0.54 -2.79 0.00 0.00 177.10 175.05