#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ifb n PHE 2 N 0.00 0.00 -1.60 0.00 3.01 -1.26 -4.98 117.46 112.63 2ifb n PHE 2 Ca 0.00 0.00 -0.40 0.00 1.01 0.00 0.00 57.45 58.06 2ifb n PHE 2 Cb 0.00 0.00 0.03 0.00 -0.01 0.00 0.00 39.48 39.50 2ifb n PHE 2 CO 0.00 0.00 0.00 -0.25 1.01 0.00 0.00 176.76 177.52 2ifb n ASP 3 N 0.46 0.85 0.00 4.37 8.00 -1.26 -4.58 116.55 124.39 2ifb n ASP 3 Ca 0.09 0.92 0.00 0.00 0.71 0.00 0.00 54.79 56.51 2ifb n ASP 3 Cb 0.41 -1.35 0.00 0.00 -0.02 0.00 0.00 41.12 40.16 2ifb n ASP 3 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2ifb n GLY 4 N 1.28 0.83 3.36 0.44 0.00 0.41 -4.91 105.19 106.60 2ifb n GLY 4 Ca 0.11 -2.24 -0.34 0.00 0.00 0.00 0.00 46.02 43.54 2ifb n GLY 4 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2ifb s THR 5 N -0.91 3.43 -0.06 2.61 -1.32 -1.26 -0.66 115.64 117.47 2ifb s THR 5 Ca 0.00 -0.50 0.06 0.00 -1.21 0.00 0.00 61.69 60.05 2ifb s THR 5 Cb 0.00 -2.52 -0.01 0.00 -1.51 0.00 0.00 72.50 68.46 2ifb s THR 5 CO 0.00 0.46 -0.25 0.26 -2.21 0.00 0.00 174.62 172.88 2ifb s TRP 6 N 1.01 2.43 -0.08 9.09 0.52 -0.30 0.20 118.94 131.82 2ifb s TRP 6 Ca 0.00 -0.72 0.03 0.00 0.02 0.00 0.00 56.10 55.43 2ifb s TRP 6 Cb -0.15 -1.60 -0.02 0.00 -1.15 0.00 0.00 33.47 30.56 2ifb s TRP 6 CO 0.00 -0.21 -0.15 0.15 0.02 0.00 0.00 176.95 176.76 2ifb s LYS 7 N -0.18 2.82 0.32 4.98 1.02 -0.80 -0.23 119.74 127.67 2ifb s LYS 7 Ca -0.03 -0.72 -0.28 0.00 0.02 0.00 0.00 55.97 54.95 2ifb s LYS 7 Cb -0.14 -2.44 -0.13 0.00 -0.52 0.00 0.00 37.83 34.61 2ifb s LYS 7 CO 0.04 0.45 1.28 1.55 -0.92 0.00 0.00 175.35 177.74 2ifb n VAL 8 N 2.82 1.84 0.04 3.17 3.14 -0.39 -2.01 118.33 126.94 2ifb n VAL 8 Ca -0.18 -0.46 -0.00 0.00 -2.96 0.00 0.00 64.34 60.74 2ifb n VAL 8 Cb 0.52 -1.51 -0.00 0.00 -1.06 0.00 0.00 33.84 31.80 2ifb n VAL 8 CO 0.00 0.00 0.00 -0.67 -6.46 0.00 0.00 176.83 169.70 2ifb n ASP 9 N 1.02 0.87 -4.14 6.55 4.64 0.62 -4.81 116.55 121.30 2ifb n ASP 9 Ca 0.06 0.11 -0.10 0.00 -1.38 0.00 0.00 54.79 53.48 2ifb n ASP 9 Cb 0.35 -0.26 -0.10 0.00 -1.04 0.00 0.00 41.12 40.07 2ifb n ASP 9 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 2ifb s ARG 10 N -2.00 0.75 -0.03 -0.67 1.70 -0.66 -4.97 118.95 113.08 2ifb s ARG 10 Ca -0.00 -1.28 0.05 0.00 -0.47 0.00 0.00 55.73 54.03 2ifb s ARG 10 Cb 0.00 -0.08 -0.01 0.00 -0.57 0.00 0.00 34.95 34.29 2ifb s ARG 10 CO 0.00 -0.04 -0.17 -0.80 -1.08 0.00 0.00 175.30 173.21 2ifb s ASN 11 N -2.95 2.03 -0.13 -2.89 0.01 -1.26 -0.17 114.94 109.58 2ifb s ASN 11 Ca 0.10 -0.32 0.03 0.00 -0.71 0.00 0.00 52.86 51.95 2ifb s ASN 11 Cb 0.06 -0.40 0.01 0.00 0.41 0.00 0.00 41.25 41.33 2ifb s ASN 11 CO -0.06 0.18 -0.22 -0.70 -1.51 0.00 0.00 177.10 174.78 2ifb s GLU 12 N -0.17 3.01 0.00 -0.60 -6.30 0.19 -4.81 118.70 110.02 2ifb s GLU 12 Ca 0.01 -0.85 0.00 0.00 -2.50 0.00 0.00 54.97 51.63 2ifb s GLU 12 Cb -0.09 -2.40 0.00 0.00 0.00 0.00 0.00 34.13 31.64 2ifb s GLU 12 CO 0.01 0.02 0.00 -1.71 0.02 0.00 0.00 175.26 173.60 2ifb n ASN 13 N 3.97 -3.79 -0.28 -1.70 5.15 -1.26 -0.72 115.26 116.63 2ifb n ASN 13 Ca -0.20 0.00 -0.03 0.00 -0.60 0.00 0.00 54.58 53.75 2ifb n ASN 13 Cb 0.52 -2.08 0.08 0.00 -0.53 0.00 0.00 39.78 37.76 2ifb n ASN 13 CO 0.00 0.00 0.00 0.22 1.40 0.00 0.00 177.26 178.88 2ifb h TYR 14 N 0.00 0.96 -0.36 1.20 3.20 -1.87 -0.79 116.97 119.30 2ifb h TYR 14 Ca 0.00 0.02 -0.11 0.00 3.14 0.00 0.00 58.73 61.78 2ifb h TYR 14 Cb 0.46 -0.32 -0.01 0.00 1.54 0.00 0.00 36.73 38.40 2ifb h TYR 14 CO 0.29 0.58 -0.23 0.93 -1.64 0.00 0.00 178.16 178.09 2ifb h GLU 15 N 1.01 0.72 -0.59 1.82 5.08 -1.91 -1.27 114.58 119.45 2ifb h GLU 15 Ca 0.30 -0.29 -0.03 0.00 -1.00 0.00 0.00 59.36 58.34 2ifb h GLU 15 Cb -0.06 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.13 2ifb h GLU 15 CO -0.09 0.88 0.25 0.87 -1.00 0.00 0.00 179.01 179.93 2ifb h LYS 16 N 0.63 0.86 -0.33 2.33 1.57 -1.91 0.42 116.57 120.14 2ifb h LYS 16 Ca 0.09 -0.15 -0.00 0.00 -1.87 0.00 0.00 60.65 58.72 2ifb h LYS 16 Cb 0.72 -0.15 -0.02 0.00 0.08 0.00 0.00 32.23 32.87 2ifb h LYS 16 CO 0.06 0.73 0.19 0.35 -0.57 0.00 0.00 179.45 180.20 2ifb h PHE 17 N 0.80 0.44 -0.84 -1.35 3.57 -0.82 -2.15 116.94 116.59 2ifb h PHE 17 Ca 0.20 -0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.67 2ifb h PHE 17 Cb 0.17 -0.14 -0.04 0.00 2.79 0.00 0.00 35.95 38.73 2ifb h PHE 17 CO 0.01 0.34 0.44 0.52 -2.23 0.00 0.00 178.31 177.39 2ifb h MET 18 N 0.41 1.19 -0.28 1.11 2.86 -0.80 -1.53 114.93 117.88 2ifb h MET 18 Ca 0.12 -0.15 0.02 0.00 -2.06 0.00 0.00 59.70 57.63 2ifb h MET 18 Cb 0.04 -0.23 -0.03 0.00 0.06 0.00 0.00 31.60 31.45 2ifb h MET 18 CO -0.02 0.88 0.12 1.49 1.06 0.00 0.00 176.91 180.44 2ifb h GLU 19 N 1.19 0.25 -0.15 1.72 4.57 -0.74 -1.66 114.58 119.76 2ifb h GLU 19 Ca 0.30 -0.02 -0.01 0.00 -1.18 0.00 0.00 59.36 58.45 2ifb h GLU 19 Cb 0.06 -0.06 -0.01 0.00 -0.16 0.00 0.00 28.75 28.58 2ifb h GLU 19 CO -0.04 0.17 0.06 -0.22 -1.18 0.00 0.00 179.01 177.80 2ifb h LYS 20 N 0.26 0.20 0.00 1.92 1.63 -0.94 0.29 116.57 119.94 2ifb h LYS 20 Ca 0.12 -0.02 0.00 0.00 -0.85 0.00 0.00 60.65 59.90 2ifb h LYS 20 Cb 0.06 -0.04 0.00 0.00 -0.60 0.00 0.00 32.23 31.65 2ifb h LYS 20 CO -0.10 0.17 0.00 -1.33 -3.45 0.00 0.00 179.45 174.74 2ifb n MET 21 N -4.48 0.13 -1.81 1.90 2.81 -0.62 -4.88 117.12 110.18 2ifb n MET 21 Ca -0.01 0.11 -0.00 0.00 -1.81 0.00 0.00 57.70 55.99 2ifb n MET 21 Cb 0.11 -1.50 -0.00 0.00 -0.71 0.00 0.00 33.22 31.12 2ifb n MET 21 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2ifb n GLY 22 N 0.67 0.37 3.80 3.03 0.00 0.10 -5.04 105.19 108.12 2ifb n GLY 22 Ca 0.07 -0.92 -0.37 0.00 0.00 0.00 0.00 46.02 44.80 2ifb n GLY 22 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2ifb s ILE 23 N -2.01 4.45 0.63 -0.61 1.01 -0.69 -5.03 121.20 118.95 2ifb s ILE 23 Ca 0.00 1.48 -0.16 0.00 0.00 0.00 0.00 60.65 61.97 2ifb s ILE 23 Cb 0.00 -3.93 -0.01 0.00 0.01 0.00 0.00 42.46 38.53 2ifb s ILE 23 CO 0.00 0.22 1.11 0.54 0.00 0.00 0.00 174.94 176.81 2ifb s ASN 24 N -1.59 5.27 0.27 3.58 4.22 -1.26 -4.62 114.94 120.81 2ifb s ASN 24 Ca 0.44 2.02 -0.04 0.00 -2.14 0.00 0.00 52.86 53.14 2ifb s ASN 24 Cb -0.18 -2.56 0.54 0.00 1.28 0.00 0.00 41.25 40.34 2ifb s ASN 24 CO 0.22 -1.52 1.60 -0.37 -2.04 0.00 0.00 177.10 174.99 2ifb h VAL 25 N 0.28 0.18 -0.05 3.54 -1.51 -1.99 0.44 116.25 117.14 2ifb h VAL 25 Ca -0.47 -0.02 -0.01 0.00 -1.23 0.00 0.00 66.70 64.97 2ifb h VAL 25 Cb 1.25 0.12 -0.00 0.00 -2.13 0.00 0.00 31.29 30.53 2ifb h VAL 25 CO 0.55 0.01 -0.01 -0.37 -1.23 0.00 0.00 177.57 176.51 2ifb h VAL 26 N 0.05 1.30 -0.71 7.19 -1.51 -2.00 -2.55 116.25 118.02 2ifb h VAL 26 Ca 0.48 -0.93 -0.01 0.00 -1.23 0.00 0.00 66.70 65.02 2ifb h VAL 26 Cb 0.89 1.83 -0.03 0.00 -2.13 0.00 0.00 31.29 31.84 2ifb h VAL 26 CO -0.81 0.25 0.42 0.11 -1.23 0.00 0.00 177.57 176.31 2ifb h LYS 27 N -0.26 0.97 -0.53 5.19 1.57 -1.85 0.06 116.57 121.72 2ifb h LYS 27 Ca 0.01 -0.09 -0.01 0.00 -1.87 0.00 0.00 60.65 58.70 2ifb h LYS 27 Cb 0.41 -0.20 -0.03 0.00 0.08 0.00 0.00 32.23 32.49 2ifb h LYS 27 CO 0.01 0.69 0.30 0.00 -0.57 0.00 0.00 179.45 179.88 2ifb h ARG 28 N 0.98 0.73 -0.64 3.15 3.08 -0.89 0.65 114.38 121.45 2ifb h ARG 28 Ca 0.26 -0.08 -0.07 0.00 0.07 0.00 0.00 59.98 60.16 2ifb h ARG 28 Cb -0.02 -0.15 -0.03 0.00 0.08 0.00 0.00 29.97 29.85 2ifb h ARG 28 CO -0.05 0.55 0.13 0.87 -1.07 0.00 0.00 179.97 180.41 2ifb h LYS 29 N 0.71 1.02 -0.13 0.04 6.56 -0.95 -1.99 116.57 121.84 2ifb h LYS 29 Ca 0.19 -0.24 -0.10 0.00 -1.06 0.00 0.00 60.65 59.44 2ifb h LYS 29 Cb 0.03 -0.13 0.00 0.00 -0.57 0.00 0.00 32.23 31.55 2ifb h LYS 29 CO -0.03 0.92 -0.30 -0.07 -2.06 0.00 0.00 179.45 177.90 2ifb h LEU 30 N 0.97 0.49 -1.03 2.94 3.38 -0.75 -3.19 115.31 118.12 2ifb h LEU 30 Ca 0.20 -0.57 0.15 0.00 0.09 0.00 0.00 57.88 57.74 2ifb h LEU 30 Cb 0.37 -0.14 -0.09 0.00 0.09 0.00 0.00 40.66 40.89 2ifb h LEU 30 CO 0.00 0.97 0.62 1.23 0.09 0.00 0.00 178.44 181.36 2ifb h GLY 31 N 0.02 1.67 2.00 0.83 0.00 0.44 -0.94 103.07 107.09 2ifb h GLY 31 Ca -0.00 -0.40 0.00 0.00 0.00 0.00 0.00 47.33 46.93 2ifb h GLY 31 CO 0.07 0.08 0.00 0.00 0.00 0.00 0.00 176.54 176.69 2ifb h ALA 32 N 1.58 1.00 -0.55 3.60 0.00 -1.36 -2.98 119.26 120.55 2ifb h ALA 32 Ca 0.52 0.00 -0.40 0.00 0.00 0.00 0.00 54.91 55.03 2ifb h ALA 32 Cb 0.65 0.00 -0.32 0.00 0.00 0.00 0.00 17.79 18.12 2ifb h ALA 32 CO -0.30 0.00 -0.74 0.72 0.00 0.00 0.00 179.25 178.93 2ifb n HIS 33 N -2.67 2.02 1.10 0.00 8.25 -0.39 -4.89 115.22 118.65 2ifb n HIS 33 Ca 0.02 -2.03 0.14 0.00 -0.26 0.00 0.00 57.72 55.59 2ifb n HIS 33 Cb 0.30 -0.31 0.64 0.00 1.12 0.00 0.00 29.99 31.74 2ifb n HIS 33 CO 0.00 0.00 0.00 -0.40 0.64 0.00 0.00 176.34 176.58 2ifb n ASP 34 N -0.81 0.00 -3.79 0.41 3.85 -1.01 -4.91 116.55 110.28 2ifb n ASP 34 Ca 0.37 0.27 -0.27 0.00 -0.71 0.00 0.00 54.79 54.44 2ifb n ASP 34 Cb 0.90 -0.42 0.04 0.00 -1.35 0.00 0.00 41.12 40.29 2ifb n ASP 34 CO 0.00 0.00 0.00 0.59 -1.01 0.00 0.00 177.20 176.78 2ifb n ASN 35 N -1.42 -4.98 -4.72 -1.12 5.03 -1.26 -0.85 115.26 105.93 2ifb n ASN 35 Ca 0.09 -0.71 -0.42 0.00 0.87 0.00 0.00 54.58 54.42 2ifb n ASN 35 Cb 0.29 -4.28 -0.03 0.00 -1.02 0.00 0.00 39.78 34.74 2ifb n ASN 35 CO 0.00 0.00 0.00 -0.22 -1.83 0.00 0.00 177.26 175.21 2ifb s LEU 36 N -7.23 4.37 -0.06 3.41 2.96 -1.26 -4.58 118.68 116.29 2ifb s LEU 36 Ca 0.58 2.79 0.02 0.00 -0.22 0.00 0.00 54.13 57.30 2ifb s LEU 36 Cb -0.28 -3.60 0.01 0.00 0.50 0.00 0.00 46.19 42.83 2ifb s LEU 36 CO 0.80 -0.93 -0.10 -0.75 -1.32 0.00 0.00 176.35 174.04 2ifb s LYS 37 N 1.22 1.42 -0.11 1.98 2.20 0.15 -1.26 119.74 125.34 2ifb s LYS 37 Ca 0.74 -0.33 0.04 0.00 -0.36 0.00 0.00 55.97 56.05 2ifb s LYS 37 Cb -0.48 -1.22 0.00 0.00 -1.51 0.00 0.00 37.83 34.62 2ifb s LYS 37 CO 0.32 0.01 -0.23 -0.51 -0.36 0.00 0.00 175.35 174.58 2ifb s LEU 38 N 0.66 2.07 -0.27 5.43 1.02 0.68 -1.69 118.68 126.59 2ifb s LEU 38 Ca -0.13 -0.55 -0.05 0.00 0.02 0.00 0.00 54.13 53.42 2ifb s LEU 38 Cb -0.15 -1.38 0.01 0.00 0.02 0.00 0.00 46.19 44.69 2ifb s LEU 38 CO 0.03 0.14 0.01 -0.89 0.02 0.00 0.00 176.35 175.66 2ifb s THR 39 N 0.44 3.50 -0.10 5.49 2.01 -0.06 -1.15 115.64 125.77 2ifb s THR 39 Ca -0.17 -0.78 -0.01 0.00 0.31 0.00 0.00 61.69 61.05 2ifb s THR 39 Cb -0.17 -2.77 -0.03 0.00 0.01 0.00 0.00 72.50 69.54 2ifb s THR 39 CO 0.07 0.17 -0.07 -0.63 -0.69 0.00 0.00 174.62 173.47 2ifb s ILE 40 N 1.44 3.64 -0.16 1.82 1.01 0.16 -0.73 121.20 128.38 2ifb s ILE 40 Ca 0.02 -0.48 -0.03 0.00 0.00 0.00 0.00 60.65 60.16 2ifb s ILE 40 Cb -0.17 -2.52 0.05 0.00 0.01 0.00 0.00 42.46 39.83 2ifb s ILE 40 CO -0.01 0.56 0.04 -0.89 0.00 0.00 0.00 174.94 174.64 2ifb s THR 41 N -0.31 0.38 -0.21 2.92 2.01 -0.49 -0.45 115.64 119.50 2ifb s THR 41 Ca 0.04 -0.31 -0.11 0.00 0.31 0.00 0.00 61.69 61.62 2ifb s THR 41 Cb -0.13 -0.82 -0.05 0.00 0.01 0.00 0.00 72.50 71.51 2ifb s THR 41 CO 0.02 -0.10 0.19 -1.58 -0.69 0.00 0.00 174.62 172.46 2ifb s GLN 42 N 1.94 4.16 -0.47 4.92 0.74 -1.26 -1.02 119.66 128.65 2ifb s GLN 42 Ca 0.01 -0.16 0.03 0.00 0.05 0.00 0.00 55.36 55.29 2ifb s GLN 42 Cb -0.16 -3.47 0.14 0.00 1.10 0.00 0.00 33.01 30.62 2ifb s GLN 42 CO -0.07 0.17 0.29 -1.21 -0.55 0.00 0.00 175.29 173.92 2ifb s GLU 43 N 0.71 1.41 6.83 1.67 2.02 0.20 -5.00 118.70 126.55 2ifb s GLU 43 Ca 0.10 -2.22 0.00 0.00 0.02 0.00 0.00 54.97 52.87 2ifb s GLU 43 Cb -0.12 -2.38 0.00 0.00 0.10 0.00 0.00 34.13 31.73 2ifb s GLU 43 CO 0.02 -1.21 0.00 0.41 0.02 0.00 0.00 175.26 174.50 2ifb n GLY 44 N 3.22 1.50 0.70 -1.39 0.00 -1.26 -1.78 105.19 106.18 2ifb n GLY 44 Ca 0.13 -0.49 0.08 0.00 0.00 0.00 0.00 46.02 45.74 2ifb n GLY 44 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2ifb n ASN 45 N 6.96 2.05 -4.53 1.61 6.94 -1.26 -4.84 115.26 122.20 2ifb n ASN 45 Ca 0.00 -1.90 -0.34 0.00 -0.02 0.00 0.00 54.58 52.32 2ifb n ASN 45 Cb 0.00 -0.21 -0.12 0.00 -2.36 0.00 0.00 39.78 37.09 2ifb n ASN 45 CO 0.00 0.00 0.00 -0.75 -1.03 0.00 0.00 177.26 175.48 2ifb s LYS 46 N -1.58 3.23 -0.03 -3.83 2.20 -0.73 -1.77 119.74 117.23 2ifb s LYS 46 Ca 0.29 -0.54 0.07 0.00 -0.36 0.00 0.00 55.97 55.44 2ifb s LYS 46 Cb 0.16 -2.75 -0.02 0.00 -1.51 0.00 0.00 37.83 33.71 2ifb s LYS 46 CO 0.22 0.44 -0.25 -0.06 -0.36 0.00 0.00 175.35 175.33 2ifb s PHE 47 N -0.19 2.31 -0.14 4.03 0.08 -0.06 0.62 117.98 124.65 2ifb s PHE 47 Ca 0.03 -0.50 0.02 0.00 0.12 0.00 0.00 56.93 56.60 2ifb s PHE 47 Cb -0.13 -1.50 0.01 0.00 -0.57 0.00 0.00 43.02 40.83 2ifb s PHE 47 CO 0.03 -0.08 -0.22 -0.08 -0.10 0.00 0.00 175.22 174.77 2ifb s THR 48 N -0.49 2.12 -0.24 0.64 -1.32 -0.19 -1.59 115.64 114.57 2ifb s THR 48 Ca 0.06 -0.96 -0.04 0.00 -1.21 0.00 0.00 61.69 59.54 2ifb s THR 48 Cb -0.11 -1.85 0.00 0.00 -1.51 0.00 0.00 72.50 69.04 2ifb s THR 48 CO 0.00 0.55 -0.02 0.54 -2.21 0.00 0.00 174.62 173.48 2ifb s VAL 49 N 0.76 3.37 -0.38 5.08 0.11 0.18 -1.39 120.40 128.12 2ifb s VAL 49 Ca -0.08 -0.68 -0.20 0.00 -2.93 0.00 0.00 61.98 58.09 2ifb s VAL 49 Cb -0.16 -2.63 0.01 0.00 -1.53 0.00 0.00 36.38 32.08 2ifb s VAL 49 CO -0.00 0.29 0.59 -0.75 -3.33 0.00 0.00 175.10 171.89 2ifb s LYS 50 N 1.44 3.50 -0.34 1.54 2.36 0.09 0.35 119.74 128.69 2ifb s LYS 50 Ca 0.04 -0.20 -0.10 0.00 -2.55 0.00 0.00 55.97 53.16 2ifb s LYS 50 Cb -0.15 -3.86 0.01 0.00 -1.05 0.00 0.00 37.83 32.77 2ifb s LYS 50 CO -0.02 -0.81 0.17 -2.00 1.55 0.00 0.00 175.35 174.25 2ifb s GLU 51 N 2.62 3.14 -0.16 4.03 2.12 0.28 -0.89 118.70 129.84 2ifb s GLU 51 Ca 0.21 -0.86 0.01 0.00 0.36 0.00 0.00 54.97 54.69 2ifb s GLU 51 Cb -0.15 -3.63 0.02 0.00 0.26 0.00 0.00 34.13 30.63 2ifb s GLU 51 CO 0.16 -0.53 -0.17 0.45 -0.54 0.00 0.00 175.26 174.63 2ifb s SER 52 N 1.59 2.88 0.34 -1.70 0.15 -0.68 -1.10 113.70 115.18 2ifb s SER 52 Ca 0.04 -0.56 -0.06 0.00 0.70 0.00 0.00 55.95 56.07 2ifb s SER 52 Cb -0.18 -1.31 0.01 0.00 -1.71 0.00 0.00 66.02 62.83 2ifb s SER 52 CO 0.06 -0.03 0.53 -0.94 1.20 0.00 0.00 173.24 174.06 2ifb s SER 53 N 1.37 0.62 0.47 5.45 1.04 0.14 -0.68 113.70 122.11 2ifb s SER 53 Ca 0.04 -1.35 0.32 0.00 0.48 0.00 0.00 55.95 55.44 2ifb s SER 53 Cb -0.13 0.68 1.70 0.00 0.10 0.00 0.00 66.02 68.38 2ifb s SER 53 CO -0.11 -1.34 1.97 0.78 0.98 0.00 0.00 173.24 175.52 2ifb h ASN 54 N 2.11 0.00 0.14 7.02 2.35 -1.26 -2.99 115.58 122.96 2ifb h ASN 54 Ca -0.29 0.00 -0.29 0.00 -0.55 0.00 0.00 56.30 55.17 2ifb h ASN 54 Cb 1.24 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.61 2ifb h ASN 54 CO 0.39 0.00 -1.48 -0.26 -1.65 0.00 0.00 177.43 174.43 2ifb h PHE 55 N 0.00 0.52 -2.15 1.19 0.04 -1.95 -3.50 116.94 111.09 2ifb h PHE 55 Ca 0.00 -0.38 0.20 0.00 2.80 0.00 0.00 57.97 60.59 2ifb h PHE 55 Cb 0.02 -0.02 -0.10 0.00 2.20 0.00 0.00 35.95 38.06 2ifb h PHE 55 CO 0.00 1.58 0.56 -0.98 -0.60 0.00 0.00 178.31 178.86 2ifb s ARG 56 N -2.50 1.00 -0.32 1.51 1.70 -1.13 -5.12 118.95 114.09 2ifb s ARG 56 Ca -0.19 -0.54 0.01 0.00 -0.47 0.00 0.00 55.73 54.55 2ifb s ARG 56 Cb 0.04 0.35 0.10 0.00 -0.57 0.00 0.00 34.95 34.87 2ifb s ARG 56 CO 0.79 -0.45 0.08 -0.80 -1.08 0.00 0.00 175.30 173.84 2ifb s ASN 57 N -2.89 4.27 -0.03 -2.89 0.01 -1.26 -0.69 114.94 111.47 2ifb s ASN 57 Ca 0.12 -1.83 0.08 0.00 -0.71 0.00 0.00 52.86 50.52 2ifb s ASN 57 Cb -0.00 -1.12 -0.02 0.00 0.41 0.00 0.00 41.25 40.52 2ifb s ASN 57 CO -0.00 -0.40 -0.26 -0.63 -1.51 0.00 0.00 177.10 174.30 2ifb s ILE 58 N 1.36 2.03 -0.21 0.60 1.09 -0.26 -5.00 121.20 120.81 2ifb s ILE 58 Ca 0.10 -1.09 -0.06 0.00 -1.10 0.00 0.00 60.65 58.50 2ifb s ILE 58 Cb -0.18 -1.69 -0.03 0.00 -1.06 0.00 0.00 42.46 39.51 2ifb s ILE 58 CO -0.19 0.57 0.02 -1.81 -0.10 0.00 0.00 174.94 173.43 2ifb s ASP 59 N -0.53 4.94 -0.21 3.58 1.11 -1.26 -0.55 116.67 123.75 2ifb s ASP 59 Ca 0.08 -0.19 -0.03 0.00 0.18 0.00 0.00 52.55 52.59 2ifb s ASP 59 Cb -0.11 -1.86 -0.00 0.00 1.07 0.00 0.00 42.92 42.03 2ifb s ASP 59 CO -0.00 0.04 -0.08 -0.69 1.18 0.00 0.00 175.17 175.61 2ifb s VAL 60 N 1.16 3.04 -0.08 -1.27 1.01 0.16 -4.96 120.40 119.45 2ifb s VAL 60 Ca 0.03 -0.61 0.04 0.00 0.00 0.00 0.00 61.98 61.44 2ifb s VAL 60 Cb -0.14 -2.36 -0.01 0.00 0.00 0.00 0.00 36.38 33.86 2ifb s VAL 60 CO 0.02 0.45 -0.19 0.68 0.00 0.00 0.00 175.10 176.06 2ifb s VAL 61 N 1.40 2.56 0.09 2.92 -7.23 -1.26 0.48 120.40 119.35 2ifb s VAL 61 Ca 0.05 -0.87 -0.11 0.00 -1.81 0.00 0.00 61.98 59.24 2ifb s VAL 61 Cb -0.14 -2.00 0.01 0.00 0.56 0.00 0.00 36.38 34.81 2ifb s VAL 61 CO -0.05 0.56 0.24 0.72 -0.31 0.00 0.00 175.10 176.26 2ifb s PHE 62 N -0.09 0.05 0.02 2.82 -0.71 -0.62 -5.01 117.98 114.45 2ifb s PHE 62 Ca -0.04 -0.42 0.06 0.00 -1.04 0.00 0.00 56.93 55.49 2ifb s PHE 62 Cb -0.14 0.02 -0.03 0.00 -1.21 0.00 0.00 43.02 41.65 2ifb s PHE 62 CO 0.04 -0.56 -0.14 -1.21 -1.34 0.00 0.00 175.22 172.01 2ifb s GLU 63 N -3.61 2.25 0.29 1.99 2.02 -1.26 -0.88 118.70 119.50 2ifb s GLU 63 Ca 0.03 -0.88 -0.30 0.00 0.02 0.00 0.00 54.97 53.84 2ifb s GLU 63 Cb 0.03 -2.30 -0.13 0.00 0.10 0.00 0.00 34.13 31.84 2ifb s GLU 63 CO -0.10 0.56 1.34 1.28 0.02 0.00 0.00 175.26 178.37 2ifb n LEU 64 N 1.59 3.31 -0.27 1.80 4.77 -0.73 -2.15 117.00 125.32 2ifb n LEU 64 Ca -0.16 1.17 -0.04 0.00 -0.03 0.00 0.00 56.01 56.96 2ifb n LEU 64 Cb 0.52 -1.46 -0.02 0.00 -2.33 0.00 0.00 43.42 40.14 2ifb n LEU 64 CO 0.28 -0.50 -0.03 0.61 -1.33 0.00 0.00 177.39 176.42 2ifb n GLY 65 N 1.47 0.42 3.37 -0.72 0.00 -0.61 -4.97 105.19 104.15 2ifb n GLY 65 Ca 0.08 -0.04 -0.35 0.00 0.00 0.00 0.00 46.02 45.71 2ifb n GLY 65 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2ifb s VAL 66 N -1.48 3.56 0.42 1.61 -7.23 -0.91 -5.03 120.40 111.34 2ifb s VAL 66 Ca 0.00 -0.44 -0.26 0.00 -1.81 0.00 0.00 61.98 59.47 2ifb s VAL 66 Cb 0.00 -2.60 -0.09 0.00 0.56 0.00 0.00 36.38 34.25 2ifb s VAL 66 CO 0.00 0.44 1.35 -1.81 -0.31 0.00 0.00 175.10 174.77 2ifb s ASP 67 N 1.14 6.16 0.21 4.85 1.11 -1.26 -4.61 116.67 124.27 2ifb s ASP 67 Ca 0.02 2.76 -0.01 0.00 0.18 0.00 0.00 52.55 55.50 2ifb s ASP 67 Cb -0.15 -2.64 -0.04 0.00 1.07 0.00 0.00 42.92 41.16 2ifb s ASP 67 CO -0.00 -0.96 0.16 0.72 1.18 0.00 0.00 175.17 176.26 2ifb s PHE 68 N -1.23 1.15 -0.02 4.23 -0.12 -0.34 -4.94 117.98 116.71 2ifb s PHE 68 Ca 0.58 -1.36 0.01 0.00 -0.05 0.00 0.00 56.93 56.11 2ifb s PHE 68 Cb -0.40 -0.53 -0.03 0.00 -0.63 0.00 0.00 43.02 41.42 2ifb s PHE 68 CO 0.52 -0.67 -0.02 0.00 -0.05 0.00 0.00 175.22 175.00 2ifb s ALA 69 N -4.10 3.20 -0.00 1.99 0.00 -1.26 -1.47 121.76 120.11 2ifb s ALA 69 Ca 0.38 -0.94 -0.00 0.00 0.00 0.00 0.00 51.96 51.40 2ifb s ALA 69 Cb 0.06 -1.31 0.00 0.00 0.00 0.00 0.00 23.12 21.88 2ifb s ALA 69 CO 0.13 0.63 0.01 -0.47 0.00 0.00 0.00 175.76 176.05 2ifb s TYR 70 N -1.02 -0.01 -0.07 0.00 6.14 -0.24 -5.00 117.35 117.15 2ifb s TYR 70 Ca 0.18 0.03 0.00 0.00 0.64 0.00 0.00 57.07 57.91 2ifb s TYR 70 Cb -0.11 -0.01 -0.03 0.00 0.42 0.00 0.00 41.96 42.23 2ifb s TYR 70 CO 0.08 -0.01 -0.05 -1.12 0.64 0.00 0.00 175.55 175.09 2ifb s SER 71 N 0.05 4.76 0.76 4.32 0.01 -1.26 -0.96 113.70 121.37 2ifb s SER 71 Ca -0.00 0.01 -0.12 0.00 1.31 0.00 0.00 55.95 57.15 2ifb s SER 71 Cb -0.01 -1.25 0.05 0.00 0.21 0.00 0.00 66.02 65.02 2ifb s SER 71 CO -0.00 0.36 1.10 -0.76 0.41 0.00 0.00 173.24 174.35 2ifb s LEU 72 N -0.77 2.72 0.63 2.44 1.02 0.13 -4.89 118.68 119.96 2ifb s LEU 72 Ca 0.12 1.19 0.31 0.00 0.02 0.00 0.00 54.13 55.78 2ifb s LEU 72 Cb -0.11 -3.88 1.72 0.00 0.02 0.00 0.00 46.19 43.94 2ifb s LEU 72 CO 0.02 -1.70 2.02 0.00 0.02 0.00 0.00 176.35 176.71 2ifb h ALA 73 N -0.90 1.55 -0.66 4.21 0.00 -1.99 0.68 119.26 122.14 2ifb h ALA 73 Ca -0.46 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.44 2ifb h ALA 73 Cb 1.27 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.07 2ifb h ALA 73 CO 0.62 -0.35 0.00 -0.40 0.00 0.00 0.00 179.25 179.12 2ifb n ASP 74 N -3.28 3.87 0.00 0.00 5.75 -1.26 -4.94 116.55 116.69 2ifb n ASP 74 Ca 0.01 -2.00 0.00 0.00 -0.01 0.00 0.00 54.79 52.79 2ifb n ASP 74 Cb 0.38 -0.44 0.00 0.00 -1.03 0.00 0.00 41.12 40.03 2ifb n ASP 74 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2ifb n GLY 75 N 1.65 0.70 3.71 6.12 0.00 0.23 -5.05 105.19 112.55 2ifb n GLY 75 Ca 0.24 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.84 2ifb n GLY 75 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2ifb s THR 76 N -2.42 4.68 0.11 2.61 -1.32 -1.26 -4.66 115.64 113.39 2ifb s THR 76 Ca 0.00 1.93 -0.21 0.00 -1.21 0.00 0.00 61.69 62.20 2ifb s THR 76 Cb 0.00 -4.24 -0.07 0.00 -1.51 0.00 0.00 72.50 66.68 2ifb s THR 76 CO 0.00 0.14 0.64 -1.61 -2.21 0.00 0.00 174.62 171.58 2ifb s GLU 77 N 1.07 4.31 0.08 7.08 2.02 -1.26 0.17 118.70 132.16 2ifb s GLU 77 Ca 0.53 0.86 0.03 0.00 0.02 0.00 0.00 54.97 56.42 2ifb s GLU 77 Cb -0.23 -3.22 -0.03 0.00 0.10 0.00 0.00 34.13 30.75 2ifb s GLU 77 CO 0.28 0.60 -0.10 -0.51 0.02 0.00 0.00 175.26 175.55 2ifb s LEU 78 N -1.19 2.35 0.02 1.80 1.02 -0.14 -1.16 118.68 121.38 2ifb s LEU 78 Ca 0.32 -0.72 0.02 0.00 0.02 0.00 0.00 54.13 53.77 2ifb s LEU 78 Cb -0.20 -0.28 -0.01 0.00 0.02 0.00 0.00 46.19 45.71 2ifb s LEU 78 CO 0.21 -0.23 -0.07 -0.89 0.02 0.00 0.00 176.35 175.39 2ifb s THR 79 N -2.03 0.56 -1.12 5.49 2.01 -0.44 -1.08 115.64 119.03 2ifb s THR 79 Ca 0.00 -0.60 0.00 0.00 0.31 0.00 0.00 61.69 61.40 2ifb s THR 79 Cb -0.05 -0.53 0.00 0.00 0.01 0.00 0.00 72.50 71.93 2ifb s THR 79 CO 0.00 -0.05 0.00 0.61 -0.69 0.00 0.00 174.62 174.49 2ifb n GLY 80 N 2.35 -0.64 3.07 4.40 0.00 -0.55 -0.80 105.19 113.02 2ifb n GLY 80 Ca -0.17 -0.73 -0.08 0.00 0.00 0.00 0.00 46.02 45.04 2ifb n GLY 80 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2ifb s THR 81 N -3.00 0.19 -0.07 2.61 -4.23 -0.78 -1.20 115.64 109.17 2ifb s THR 81 Ca 0.00 -1.57 0.00 0.00 -1.18 0.00 0.00 61.69 58.95 2ifb s THR 81 Cb 0.00 -1.20 -0.03 0.00 1.34 0.00 0.00 72.50 72.61 2ifb s THR 81 CO 0.00 -0.86 -0.05 0.26 -0.54 0.00 0.00 174.62 173.42 2ifb s TRP 82 N -3.30 2.98 0.07 3.99 0.52 -1.26 -1.30 118.94 120.63 2ifb s TRP 82 Ca 0.01 0.05 0.04 0.00 0.02 0.00 0.00 56.10 56.22 2ifb s TRP 82 Cb 0.03 -1.72 -0.03 0.00 -1.15 0.00 0.00 33.47 30.61 2ifb s TRP 82 CO -0.08 0.36 -0.11 -0.08 0.02 0.00 0.00 176.95 177.07 2ifb s THR 83 N -0.84 0.87 -0.28 2.01 -1.32 0.20 -1.58 115.64 114.70 2ifb s THR 83 Ca 0.13 -1.31 -0.22 0.00 -1.21 0.00 0.00 61.69 59.08 2ifb s THR 83 Cb -0.11 -0.98 -0.01 0.00 -1.51 0.00 0.00 72.50 69.89 2ifb s THR 83 CO 0.02 -0.36 0.70 -0.32 -2.21 0.00 0.00 174.62 172.45 2ifb s MET 84 N -1.94 4.01 -0.36 7.08 1.75 -1.26 0.19 119.30 128.76 2ifb s MET 84 Ca -0.03 0.52 0.00 0.00 -1.25 0.00 0.00 55.69 54.93 2ifb s MET 84 Cb -0.08 -3.70 0.10 0.00 2.84 0.00 0.00 34.83 33.99 2ifb s MET 84 CO 0.01 -0.55 0.11 -1.83 -0.65 0.00 0.00 175.02 172.10 2ifb s GLU 85 N 2.71 1.84 5.91 4.11 4.04 0.92 -4.92 118.70 133.30 2ifb s GLU 85 Ca 0.29 -1.77 0.00 0.00 0.04 0.00 0.00 54.97 53.53 2ifb s GLU 85 Cb -0.15 -3.36 0.00 0.00 0.02 0.00 0.00 34.13 30.64 2ifb s GLU 85 CO 0.11 -0.95 0.00 0.41 -1.84 0.00 0.00 175.26 172.98 2ifb n GLY 86 N 4.45 3.50 0.00 -3.83 0.00 -1.26 -1.09 105.19 106.96 2ifb n GLY 86 Ca -0.01 0.02 0.14 0.00 0.00 0.00 0.00 46.02 46.17 2ifb n GLY 86 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2ifb n ASN 87 N 5.04 0.00 -4.69 1.61 0.23 -1.26 -4.82 115.26 111.36 2ifb n ASN 87 Ca 0.00 -0.31 -0.25 0.00 -0.53 0.00 0.00 54.58 53.49 2ifb n ASN 87 Cb 0.00 -0.21 -0.07 0.00 -2.08 0.00 0.00 39.78 37.42 2ifb n ASN 87 CO 0.00 0.00 0.00 -0.54 -0.93 0.00 0.00 177.26 175.79 2ifb s LYS 88 N -2.43 2.49 -0.28 -3.83 1.02 -0.25 -4.59 119.74 111.87 2ifb s LYS 88 Ca 0.31 -1.14 -0.09 0.00 0.02 0.00 0.00 55.97 55.06 2ifb s LYS 88 Cb 0.19 -2.37 -0.02 0.00 -0.52 0.00 0.00 37.83 35.10 2ifb s LYS 88 CO 0.40 0.43 0.13 -1.17 -0.92 0.00 0.00 175.35 174.22 2ifb s LEU 89 N -3.22 3.85 -0.19 3.17 2.96 -0.17 -0.05 118.68 125.03 2ifb s LEU 89 Ca 0.29 -0.29 -0.03 0.00 -0.22 0.00 0.00 54.13 53.88 2ifb s LEU 89 Cb -0.09 -2.00 -0.01 0.00 0.50 0.00 0.00 46.19 44.59 2ifb s LEU 89 CO 0.20 -0.11 -0.07 -0.69 -1.32 0.00 0.00 176.35 174.36 2ifb s VAL 90 N 1.65 3.27 -0.24 1.68 1.01 0.51 -1.41 120.40 126.87 2ifb s VAL 90 Ca 0.06 -0.54 -0.07 0.00 0.00 0.00 0.00 61.98 61.43 2ifb s VAL 90 Cb -0.16 -2.45 -0.03 0.00 0.00 0.00 0.00 36.38 33.74 2ifb s VAL 90 CO 0.06 0.46 0.06 -0.83 0.00 0.00 0.00 175.10 174.85 2ifb s GLY 91 N 1.10 1.75 -0.25 4.51 0.00 0.34 0.58 107.32 115.34 2ifb s GLY 91 Ca 0.01 -1.13 0.03 0.00 0.00 0.00 0.00 44.72 43.63 2ifb s GLY 91 CO -0.01 0.51 -0.11 0.54 0.00 0.00 0.00 173.10 174.03 2ifb s LYS 92 N 1.57 2.30 0.17 2.90 1.02 -0.42 -0.34 119.74 126.94 2ifb s LYS 92 Ca 0.06 -1.31 0.07 0.00 0.02 0.00 0.00 55.97 54.82 2ifb s LYS 92 Cb -0.15 -2.87 -0.04 0.00 -0.52 0.00 0.00 37.83 34.25 2ifb s LYS 92 CO 0.03 -0.54 -0.15 -0.06 -0.92 0.00 0.00 175.35 173.70 2ifb s PHE 93 N 1.12 1.66 -0.05 3.18 0.40 0.24 -1.86 117.98 122.67 2ifb s PHE 93 Ca -0.08 -0.54 0.05 0.00 -0.60 0.00 0.00 56.93 55.76 2ifb s PHE 93 Cb -0.19 -0.81 -0.01 0.00 0.51 0.00 0.00 43.02 42.52 2ifb s PHE 93 CO -0.06 0.29 -0.19 0.15 0.70 0.00 0.00 175.22 176.11 2ifb s LYS 94 N -3.12 1.95 0.09 0.44 1.02 0.02 -0.53 119.74 119.61 2ifb s LYS 94 Ca 0.17 -0.68 -0.31 0.00 0.02 0.00 0.00 55.97 55.17 2ifb s LYS 94 Cb -0.03 -1.69 -0.07 0.00 -0.52 0.00 0.00 37.83 35.52 2ifb s LYS 94 CO 0.06 0.28 1.27 1.03 -0.92 0.00 0.00 175.35 177.07 2ifb s ARG 95 N -0.02 4.39 0.48 1.68 0.52 -0.17 -1.33 118.95 124.49 2ifb s ARG 95 Ca -0.03 1.89 0.24 0.00 -0.52 0.00 0.00 55.73 57.30 2ifb s ARG 95 Cb -0.12 -3.31 1.21 0.00 0.52 0.00 0.00 34.95 33.25 2ifb s ARG 95 CO 0.02 -0.32 1.98 0.28 0.02 0.00 0.00 175.30 177.29 2ifb h VAL 96 N 4.39 0.71 0.09 3.52 2.07 -1.48 0.07 116.25 125.62 2ifb h VAL 96 Ca -0.42 -0.77 -0.16 0.00 0.82 0.00 0.00 66.70 66.17 2ifb h VAL 96 Cb 1.21 1.48 0.01 0.00 -1.52 0.00 0.00 31.29 32.47 2ifb h VAL 96 CO 0.83 0.18 -0.77 -2.24 0.02 0.00 0.00 177.57 175.60 2ifb h ASP 97 N 0.00 0.31 -0.00 0.57 -0.00 -1.91 -3.39 116.42 111.99 2ifb h ASP 97 Ca -0.00 -0.92 0.00 0.00 -0.00 0.00 0.00 57.03 56.11 2ifb h ASP 97 Cb 0.47 -0.10 0.00 0.00 -0.00 0.00 0.00 39.33 39.69 2ifb h ASP 97 CO 0.02 1.35 0.00 -0.46 -0.00 0.00 0.00 179.24 180.15 2ifb n ASN 98 N -4.22 1.29 -0.19 4.15 2.04 -1.24 -5.00 115.26 112.09 2ifb n ASN 98 Ca -0.16 -1.27 -0.03 0.00 -0.44 0.00 0.00 54.58 52.68 2ifb n ASN 98 Cb 0.75 -0.00 -0.01 0.00 -2.53 0.00 0.00 39.78 37.99 2ifb n ASN 98 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 2ifb n GLY 99 N -0.11 0.40 3.85 4.83 0.00 0.01 -5.01 105.19 109.16 2ifb n GLY 99 Ca 0.00 -0.07 -0.32 0.00 0.00 0.00 0.00 46.02 45.64 2ifb n GLY 99 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ifb s LYS 100 N -1.66 3.98 -0.01 1.61 1.02 -1.26 -4.66 119.74 118.76 2ifb s LYS 100 Ca 0.00 0.74 -0.16 0.00 0.02 0.00 0.00 55.97 56.57 2ifb s LYS 100 Cb 0.00 -2.33 -0.06 0.00 -0.52 0.00 0.00 37.83 34.92 2ifb s LYS 100 CO 0.00 0.01 0.44 -2.00 -0.92 0.00 0.00 175.35 172.88 2ifb s GLU 101 N -3.40 4.03 -0.19 1.68 2.12 -1.26 -1.00 118.70 120.67 2ifb s GLU 101 Ca 0.55 0.46 0.01 0.00 0.36 0.00 0.00 54.97 56.36 2ifb s GLU 101 Cb -0.10 -3.26 0.03 0.00 0.26 0.00 0.00 34.13 31.06 2ifb s GLU 101 CO 0.22 0.60 -0.18 -1.17 -0.54 0.00 0.00 175.26 174.19 2ifb s LEU 102 N -0.82 2.36 -0.14 2.70 1.98 0.31 -4.43 118.68 120.64 2ifb s LEU 102 Ca 0.25 -0.78 -0.04 0.00 -2.89 0.00 0.00 54.13 50.67 2ifb s LEU 102 Cb -0.17 -1.48 -0.03 0.00 0.66 0.00 0.00 46.19 45.17 2ifb s LEU 102 CO 0.14 -0.04 -0.02 -0.63 -1.89 0.00 0.00 176.35 173.91 2ifb s ILE 103 N 1.26 4.07 -0.04 6.68 -1.09 -0.77 -0.59 121.20 130.71 2ifb s ILE 103 Ca 0.02 -0.30 0.05 0.00 -2.23 0.00 0.00 60.65 58.19 2ifb s ILE 103 Cb -0.14 -2.77 -0.01 0.00 -1.58 0.00 0.00 42.46 37.96 2ifb s ILE 103 CO -0.11 0.51 -0.19 0.00 -1.23 0.00 0.00 174.94 173.92 2ifb s ALA 104 N 0.09 1.66 -0.05 9.38 0.00 0.53 -1.50 121.76 131.88 2ifb s ALA 104 Ca 0.00 -0.78 0.06 0.00 0.00 0.00 0.00 51.96 51.24 2ifb s ALA 104 Cb -0.13 -0.53 -0.01 0.00 0.00 0.00 0.00 23.12 22.45 2ifb s ALA 104 CO 0.02 0.32 -0.23 0.08 0.00 0.00 0.00 175.76 175.96 2ifb s VAL 105 N -0.06 1.85 -0.18 0.00 1.01 0.79 -0.50 120.40 123.30 2ifb s VAL 105 Ca -0.02 -0.96 0.01 0.00 0.00 0.00 0.00 61.98 61.01 2ifb s VAL 105 Cb -0.11 -1.56 0.02 0.00 0.00 0.00 0.00 36.38 34.72 2ifb s VAL 105 CO 0.02 0.52 -0.19 -0.13 0.00 0.00 0.00 175.10 175.32 2ifb s ARG 106 N -0.14 3.02 0.01 2.72 0.52 -0.50 -0.98 118.95 123.60 2ifb s ARG 106 Ca -0.02 -0.81 0.03 0.00 -0.52 0.00 0.00 55.73 54.40 2ifb s ARG 106 Cb -0.13 -2.61 -0.01 0.00 0.52 0.00 0.00 34.95 32.72 2ifb s ARG 106 CO 0.03 -0.21 -0.09 -1.83 0.02 0.00 0.00 175.30 173.22 2ifb s GLU 107 N 1.31 0.64 0.07 3.54 -1.05 -0.79 -1.00 118.70 121.41 2ifb s GLU 107 Ca 0.05 -0.46 -0.07 0.00 -0.15 0.00 0.00 54.97 54.34 2ifb s GLU 107 Cb -0.13 -0.58 -0.05 0.00 -0.44 0.00 0.00 34.13 32.93 2ifb s GLU 107 CO -0.12 0.15 0.34 -1.50 0.95 0.00 0.00 175.26 175.07 2ifb s ILE 108 N -0.56 5.20 -0.33 1.83 2.07 -1.26 -1.34 121.20 126.82 2ifb s ILE 108 Ca -0.00 0.21 -0.02 0.00 -1.41 0.00 0.00 60.65 59.43 2ifb s ILE 108 Cb -0.05 -3.61 0.12 0.00 0.13 0.00 0.00 42.46 39.05 2ifb s ILE 108 CO 0.00 0.25 0.18 -0.44 -1.91 0.00 0.00 174.94 173.02 2ifb s SER 109 N -1.93 3.24 0.00 4.50 0.01 0.35 -4.95 113.70 114.92 2ifb s SER 109 Ca 0.33 -1.83 0.00 0.00 1.31 0.00 0.00 55.95 55.76 2ifb s SER 109 Cb -0.13 -0.41 0.00 0.00 0.21 0.00 0.00 66.02 65.69 2ifb s SER 109 CO 0.19 -0.36 0.00 0.61 0.41 0.00 0.00 173.24 174.09 2ifb n GLY 110 N 4.53 0.00 3.67 3.44 0.00 -1.26 -0.34 105.19 115.23 2ifb n GLY 110 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.06 2ifb n GLY 110 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2ifb n ASN 111 N 1.33 0.00 -4.43 1.61 4.05 -1.26 -5.02 115.26 111.54 2ifb n ASN 111 Ca 0.00 0.00 -0.32 0.00 0.45 0.00 0.00 54.58 54.71 2ifb n ASN 111 Cb 0.03 0.00 -0.14 0.00 1.23 0.00 0.00 39.78 40.90 2ifb n ASN 111 CO 0.00 0.00 0.00 -1.61 -3.05 0.00 0.00 177.26 172.60 2ifb s GLU 112 N -0.08 2.44 -0.23 1.20 2.02 0.54 -2.35 118.70 122.25 2ifb s GLU 112 Ca 0.00 -0.76 -0.07 0.00 0.02 0.00 0.00 54.97 54.16 2ifb s GLU 112 Cb 0.00 -2.30 -0.03 0.00 0.10 0.00 0.00 34.13 31.90 2ifb s GLU 112 CO 0.00 0.58 0.05 -1.17 0.02 0.00 0.00 175.26 174.74 2ifb s LEU 113 N -0.64 3.44 -0.15 1.80 2.96 -0.57 0.13 118.68 125.65 2ifb s LEU 113 Ca 0.10 -0.17 -0.04 0.00 -0.22 0.00 0.00 54.13 53.80 2ifb s LEU 113 Cb -0.11 -1.90 -0.03 0.00 0.50 0.00 0.00 46.19 44.65 2ifb s LEU 113 CO 0.00 0.02 -0.03 -0.63 -1.32 0.00 0.00 176.35 174.40 2ifb s ILE 114 N 1.27 3.99 -0.16 6.68 -1.09 -0.45 -0.87 121.20 130.58 2ifb s ILE 114 Ca 0.04 -0.33 0.01 0.00 -2.23 0.00 0.00 60.65 58.15 2ifb s ILE 114 Cb -0.15 -2.75 0.01 0.00 -1.58 0.00 0.00 42.46 37.99 2ifb s ILE 114 CO 0.03 0.50 -0.18 -1.10 -1.23 0.00 0.00 174.94 172.96 2ifb s GLN 115 N 0.25 3.12 -0.08 2.79 -0.21 0.55 -1.89 119.66 124.19 2ifb s GLN 115 Ca -0.02 -0.79 0.05 0.00 0.02 0.00 0.00 55.36 54.61 2ifb s GLN 115 Cb -0.14 -2.58 -0.01 0.00 1.00 0.00 0.00 33.01 31.28 2ifb s GLN 115 CO 0.03 -0.05 -0.22 0.95 -2.12 0.00 0.00 175.29 173.87 2ifb s THR 116 N 0.94 2.28 -0.03 -0.19 -4.23 -0.15 -0.52 115.64 113.74 2ifb s THR 116 Ca -0.03 -0.97 0.07 0.00 -1.18 0.00 0.00 61.69 59.58 2ifb s THR 116 Cb -0.15 -1.86 -0.02 0.00 1.34 0.00 0.00 72.50 71.81 2ifb s THR 116 CO -0.03 0.56 -0.26 -0.31 -0.54 0.00 0.00 174.62 174.05 2ifb s TYR 117 N -0.03 2.33 -0.01 3.99 2.02 0.08 -0.15 117.35 125.58 2ifb s TYR 117 Ca -0.07 -0.50 0.03 0.00 -0.37 0.00 0.00 57.07 56.16 2ifb s TYR 117 Cb -0.15 -1.51 -0.00 0.00 -0.40 0.00 0.00 41.96 39.90 2ifb s TYR 117 CO 0.05 -0.08 -0.10 0.95 -1.57 0.00 0.00 175.55 174.80 2ifb s THR 118 N -0.50 0.82 -0.26 -0.71 -4.23 -0.56 -0.14 115.64 110.06 2ifb s THR 118 Ca 0.07 -0.42 -0.09 0.00 -1.18 0.00 0.00 61.69 60.06 2ifb s THR 118 Cb -0.11 -0.70 0.11 0.00 1.34 0.00 0.00 72.50 73.14 2ifb s THR 118 CO 0.00 0.24 0.57 -0.47 -0.54 0.00 0.00 174.62 174.42 2ifb s TYR 119 N -0.10 -1.12 -1.39 3.99 5.04 0.09 -1.85 117.35 122.02 2ifb s TYR 119 Ca 0.02 2.01 -0.05 0.00 -2.44 0.00 0.00 57.07 56.61 2ifb s TYR 119 Cb -0.06 0.61 0.03 0.00 0.35 0.00 0.00 41.96 42.89 2ifb s TYR 119 CO -0.00 -0.59 0.76 0.39 -1.34 0.00 0.00 175.55 174.78 2ifb n GLU 120 N 5.30 -4.94 -0.97 4.97 -0.58 -1.26 -1.49 120.64 121.67 2ifb n GLU 120 Ca -0.12 0.59 0.00 0.00 -0.42 0.00 0.00 57.16 57.21 2ifb n GLU 120 Cb 0.50 -5.21 0.00 0.00 -0.57 0.00 0.00 31.44 26.16 2ifb n GLU 120 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2ifb n GLY 121 N -1.65 0.54 3.47 0.62 0.00 -1.26 -5.02 105.19 101.90 2ifb n GLY 121 Ca -0.19 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.50 2ifb n GLY 121 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2ifb s VAL 122 N -2.36 3.47 -0.06 1.61 1.01 -0.56 -5.10 120.40 118.41 2ifb s VAL 122 Ca 0.00 -0.53 0.06 0.00 0.00 0.00 0.00 61.98 61.50 2ifb s VAL 122 Cb 0.00 -2.46 -0.01 0.00 0.00 0.00 0.00 36.38 33.92 2ifb s VAL 122 CO 0.00 0.54 -0.24 -0.70 0.00 0.00 0.00 175.10 174.70 2ifb s GLU 123 N -0.06 2.57 0.09 2.72 2.12 -1.26 -0.73 118.70 124.15 2ifb s GLU 123 Ca -0.01 -0.87 0.01 0.00 0.36 0.00 0.00 54.97 54.46 2ifb s GLU 123 Cb -0.14 -2.13 -0.04 0.00 0.26 0.00 0.00 34.13 32.08 2ifb s GLU 123 CO 0.03 0.33 -0.06 0.00 -0.54 0.00 0.00 175.26 175.03 2ifb s ALA 124 N -0.06 0.87 0.02 6.30 0.00 0.80 -4.78 121.76 124.90 2ifb s ALA 124 Ca -0.06 -1.31 0.02 0.00 0.00 0.00 0.00 51.96 50.60 2ifb s ALA 124 Cb -0.14 0.18 -0.01 0.00 0.00 0.00 0.00 23.12 23.15 2ifb s ALA 124 CO 0.04 -0.26 -0.06 0.15 0.00 0.00 0.00 175.76 175.63 2ifb s LYS 125 N -3.83 0.44 -0.09 0.00 1.02 0.10 -0.74 119.74 116.64 2ifb s LYS 125 Ca 0.11 -0.43 0.04 0.00 0.02 0.00 0.00 55.97 55.71 2ifb s LYS 125 Cb 0.06 -0.32 -0.00 0.00 -0.52 0.00 0.00 37.83 37.04 2ifb s LYS 125 CO -0.06 0.08 -0.24 1.03 -0.92 0.00 0.00 175.35 175.24 2ifb s ARG 126 N -0.77 2.89 -0.14 1.68 0.52 0.32 0.56 118.95 124.02 2ifb s ARG 126 Ca -0.04 -0.87 0.00 0.00 -0.52 0.00 0.00 55.73 54.30 2ifb s ARG 126 Cb -0.06 -2.24 -0.01 0.00 0.52 0.00 0.00 34.95 33.16 2ifb s ARG 126 CO 0.00 0.22 -0.14 0.42 0.02 0.00 0.00 175.30 175.82 2ifb s ILE 127 N 0.23 2.87 0.08 1.52 -1.09 0.76 -0.33 121.20 125.24 2ifb s ILE 127 Ca -0.15 -0.72 0.09 0.00 -2.23 0.00 0.00 60.65 57.64 2ifb s ILE 127 Cb -0.17 -2.20 -0.03 0.00 -1.58 0.00 0.00 42.46 38.47 2ifb s ILE 127 CO 0.08 0.52 -0.22 -0.36 -1.23 0.00 0.00 174.94 173.73 2ifb s PHE 128 N 0.50 2.44 -0.06 3.97 0.08 -0.05 0.23 117.98 125.09 2ifb s PHE 128 Ca -0.10 -0.32 0.02 0.00 0.12 0.00 0.00 56.93 56.65 2ifb s PHE 128 Cb -0.16 -1.37 -0.03 0.00 -0.57 0.00 0.00 43.02 40.89 2ifb s PHE 128 CO 0.04 0.27 -0.12 0.15 -0.10 0.00 0.00 175.22 175.47 2ifb s LYS 129 N -1.69 2.67 0.25 0.44 1.02 -0.85 -1.51 119.74 120.07 2ifb s LYS 129 Ca 0.15 -0.65 -0.31 0.00 0.02 0.00 0.00 55.97 55.18 2ifb s LYS 129 Cb -0.10 -2.47 -0.12 0.00 -0.52 0.00 0.00 37.83 34.62 2ifb s LYS 129 CO 0.06 0.60 1.67 0.21 -0.92 0.00 0.00 175.35 176.96 2ifb s LYS 130 N -0.65 4.12 0.00 1.68 2.20 -0.99 -1.91 119.74 124.19 2ifb s LYS 130 Ca 0.10 2.60 0.23 0.00 -0.36 0.00 0.00 55.97 58.54 2ifb s LYS 130 Cb -0.11 -3.05 1.38 0.00 -1.51 0.00 0.00 37.83 34.54 2ifb s LYS 130 CO 0.01 -0.71 1.75 -1.91 -0.36 0.00 0.00 175.35 174.14