#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2omj s SER 2 N 0.00 3.58 0.06 1.61 0.01 -1.26 -5.06 113.70 112.64 2omj s SER 2 Ca 0.00 -1.42 -0.06 0.00 1.31 0.00 0.00 55.95 55.78 2omj s SER 2 Cb 0.00 -0.19 -0.29 0.00 0.21 0.00 0.00 66.02 65.74 2omj s SER 2 CO 0.00 -0.55 1.07 0.45 0.41 0.00 0.00 173.24 174.62 2omj h HIS 3 N 1.79 0.56 -0.28 2.43 -0.00 -2.08 -3.42 115.15 114.15 2omj h HIS 3 Ca -0.43 -0.41 -0.10 0.00 -0.00 0.00 0.00 60.37 59.43 2omj h HIS 3 Cb 1.25 -0.02 -0.01 0.00 -0.00 0.00 0.00 27.41 28.63 2omj h HIS 3 CO 0.82 1.34 0.31 1.41 -0.00 0.00 0.00 177.93 181.82 2omj s MET 4 N -2.64 1.63 0.00 2.45 1.75 -1.26 -2.75 119.30 118.48 2omj s MET 4 Ca -0.06 -0.39 0.00 0.00 -1.25 0.00 0.00 55.69 53.99 2omj s MET 4 Cb 0.07 -5.00 0.00 0.00 2.84 0.00 0.00 34.83 32.73 2omj s MET 4 CO 0.89 -4.84 0.00 0.41 -0.65 0.00 0.00 175.02 170.83 2omj n GLY 5 N 6.27 0.26 2.80 2.11 0.00 -1.26 -4.97 105.19 110.40 2omj n GLY 5 Ca 0.43 0.04 -0.17 0.00 0.00 0.00 0.00 46.02 46.31 2omj n GLY 5 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2omj s LEU 6 N 0.00 -0.12 -0.17 0.99 1.02 -1.11 -4.62 118.68 114.68 2omj s LEU 6 Ca 0.00 0.00 -0.00 0.00 0.02 0.00 0.00 54.13 54.15 2omj s LEU 6 Cb 0.00 0.39 0.00 0.00 0.02 0.00 0.00 46.19 46.60 2omj s LEU 6 CO 0.00 -0.30 -0.15 -0.69 0.02 0.00 0.00 176.35 175.24 2omj s VAL 7 N 2.33 2.65 -0.17 -1.59 1.01 -1.26 -4.90 120.40 118.47 2omj s VAL 7 Ca 0.05 -0.76 -0.09 0.00 0.00 0.00 0.00 61.98 61.18 2omj s VAL 7 Cb -0.14 -2.13 -0.05 0.00 0.00 0.00 0.00 36.38 34.06 2omj s VAL 7 CO -0.10 0.51 0.12 -1.58 0.00 0.00 0.00 175.10 174.05 2omj s GLN 8 N 0.98 3.90 -0.08 2.72 0.74 -1.26 -1.38 119.66 125.27 2omj s GLN 8 Ca -0.02 -0.21 -0.04 0.00 0.05 0.00 0.00 55.36 55.14 2omj s GLN 8 Cb -0.15 -3.31 0.04 0.00 1.10 0.00 0.00 33.01 30.69 2omj s GLN 8 CO -0.03 0.46 0.19 0.50 -0.55 0.00 0.00 175.29 175.86 2omj s ARG 9 N -0.10 0.15 0.31 1.67 3.52 -0.72 -5.00 118.95 118.78 2omj s ARG 9 Ca 0.10 0.42 -0.25 0.00 -0.13 0.00 0.00 55.73 55.87 2omj s ARG 9 Cb -0.11 -0.13 -0.10 0.00 -1.56 0.00 0.00 34.95 33.04 2omj s ARG 9 CO 0.00 -0.15 0.92 0.00 -0.81 0.00 0.00 175.30 175.26 2omj s VAL 11 N -1.61 0.28 -0.22 0.00 -7.23 -1.23 -4.98 120.40 105.42 2omj s VAL 11 Ca 0.49 -0.11 -0.01 0.00 -1.81 0.00 0.00 61.98 60.55 2omj s VAL 11 Cb -0.18 -0.27 0.02 0.00 0.56 0.00 0.00 36.38 36.51 2omj s VAL 11 CO 0.23 0.10 -0.11 -0.63 -0.31 0.00 0.00 175.10 174.39 2omj s ILE 12 N 0.18 2.64 -0.05 -0.62 1.09 -1.26 -2.61 121.20 120.57 2omj s ILE 12 Ca -0.02 -0.95 -0.03 0.00 -1.10 0.00 0.00 60.65 58.55 2omj s ILE 12 Cb -0.05 -2.26 -0.04 0.00 -1.06 0.00 0.00 42.46 39.06 2omj s ILE 12 CO -0.00 0.33 0.13 -0.63 -0.10 0.00 0.00 174.94 174.67 2omj s ILE 13 N 1.32 5.18 -0.15 2.92 1.09 0.70 -4.37 121.20 127.90 2omj s ILE 13 Ca 0.02 -0.11 -0.01 0.00 -1.10 0.00 0.00 60.65 59.45 2omj s ILE 13 Cb -0.15 -3.33 -0.02 0.00 -1.06 0.00 0.00 42.46 37.90 2omj s ILE 13 CO -0.07 0.46 -0.10 -1.10 -0.10 0.00 0.00 174.94 174.02 2omj s GLN 14 N -1.49 3.44 0.44 2.79 -0.21 -1.26 -1.74 119.66 121.62 2omj s GLN 14 Ca 0.21 -0.65 -0.25 0.00 0.02 0.00 0.00 55.36 54.69 2omj s GLN 14 Cb -0.12 -2.73 -0.08 0.00 1.00 0.00 0.00 33.01 31.08 2omj s GLN 14 CO 0.11 0.17 1.29 0.21 -2.12 0.00 0.00 175.29 174.95 2omj s LYS 15 N 0.49 3.80 0.02 2.91 2.36 0.04 -4.71 119.74 124.65 2omj s LYS 15 Ca -0.07 2.11 0.00 0.00 -2.55 0.00 0.00 55.97 55.46 2omj s LYS 15 Cb -0.15 -2.62 0.00 0.00 -1.05 0.00 0.00 37.83 34.01 2omj s LYS 15 CO 0.04 -0.62 0.01 -0.25 1.55 0.00 0.00 175.35 176.08 2omj n ASP 16 N -0.16 1.57 0.25 1.43 9.92 -1.04 -4.96 116.55 123.56 2omj n ASP 16 Ca 0.05 -1.09 0.10 0.00 -0.53 0.00 0.00 54.79 53.32 2omj n ASP 16 Cb 0.44 0.01 0.69 0.00 -0.64 0.00 0.00 41.12 41.62 2omj n ASP 16 CO 0.00 0.00 0.00 -2.24 0.13 0.00 0.00 177.20 175.09 2omj h ASP 17 N 0.04 0.00 0.00 -2.24 3.04 -2.05 -3.01 116.42 112.20 2omj h ASP 17 Ca -0.02 0.00 -0.21 0.00 -3.24 0.00 0.00 57.03 53.56 2omj h ASP 17 Cb 0.06 0.00 -0.03 0.00 -1.04 0.00 0.00 39.33 38.31 2omj h ASP 17 CO 0.03 0.00 -1.15 0.78 -2.04 0.00 0.00 179.24 176.86 2omj h ASN 18 N 0.00 0.00 0.00 4.15 2.35 -2.01 -3.51 115.58 116.56 2omj h ASN 18 Ca 0.01 -0.54 0.00 0.00 -0.55 0.00 0.00 56.30 55.23 2omj h ASN 18 Cb 0.06 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.43 2omj h ASN 18 CO -0.00 1.44 0.00 0.61 -1.65 0.00 0.00 177.43 177.83 2omj n GLY 19 N 1.45 0.13 3.15 2.83 0.00 -1.14 -5.07 105.19 106.55 2omj n GLY 19 Ca -0.30 -0.57 -0.34 0.00 0.00 0.00 0.00 46.02 44.81 2omj n GLY 19 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2omj s PHE 20 N 0.00 3.09 0.27 1.61 0.40 -1.26 -2.50 117.98 119.58 2omj s PHE 20 Ca 0.00 -1.82 0.10 0.00 -0.60 0.00 0.00 56.93 54.62 2omj s PHE 20 Cb 0.00 -2.00 0.35 0.00 0.51 0.00 0.00 43.02 41.88 2omj s PHE 20 CO 0.00 -0.79 1.61 0.78 0.70 0.00 0.00 175.22 177.52 2omj h GLY 21 N 7.93 0.00 -6.55 4.36 0.00 -1.96 -3.44 103.07 103.42 2omj h GLY 21 Ca -0.30 0.00 -0.62 0.00 0.00 0.00 0.00 47.33 46.41 2omj h GLY 21 CO 0.55 0.00 1.34 1.04 0.00 0.00 0.00 176.54 179.47 2omj n LEU 22 N -3.80 2.98 -4.59 3.11 4.32 -1.26 -4.56 117.00 113.21 2omj n LEU 22 Ca -0.01 0.53 -0.37 0.00 -0.02 0.00 0.00 56.01 56.14 2omj n LEU 22 Cb 0.62 -1.40 -0.11 0.00 -1.62 0.00 0.00 43.42 40.91 2omj n LEU 22 CO 0.42 -0.48 -0.19 -0.89 -1.22 0.00 0.00 177.39 175.03 2omj s THR 23 N 6.58 5.14 0.00 -5.08 2.01 0.21 -4.97 115.64 119.52 2omj s THR 23 Ca 1.01 0.11 0.04 0.00 0.31 0.00 0.00 61.69 63.16 2omj s THR 23 Cb -0.62 -3.42 -0.01 0.00 0.01 0.00 0.00 72.50 68.46 2omj s THR 23 CO 0.45 0.31 -0.13 0.54 -0.69 0.00 0.00 174.62 175.10 2omj s VAL 24 N 1.41 1.03 -0.13 3.82 0.11 -1.26 -0.40 120.40 124.98 2omj s VAL 24 Ca 0.07 -0.66 -0.10 0.00 -2.93 0.00 0.00 61.98 58.36 2omj s VAL 24 Cb -0.15 -0.88 0.04 0.00 -1.53 0.00 0.00 36.38 33.86 2omj s VAL 24 CO 0.07 0.21 0.34 -0.44 -3.33 0.00 0.00 175.10 171.95 2omj s SER 25 N -0.52 -0.37 0.00 3.54 0.01 -1.19 -4.97 113.70 110.20 2omj s SER 25 Ca 0.04 0.70 0.00 0.00 1.31 0.00 0.00 55.95 58.00 2omj s SER 25 Cb -0.06 0.65 0.00 0.00 0.21 0.00 0.00 66.02 66.83 2omj s SER 25 CO -0.00 -0.14 0.00 0.61 0.41 0.00 0.00 173.24 174.11 2omj n GLY 26 N 3.48 1.57 0.00 3.44 0.00 -1.26 -4.31 105.19 108.11 2omj n GLY 26 Ca -0.18 0.08 0.00 0.00 0.00 0.00 0.00 46.02 45.92 2omj n GLY 26 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2omj n ASP 27 N 0.00 0.00 0.00 1.61 9.92 -1.26 -4.45 116.55 122.37 2omj n ASP 27 Ca 0.00 0.39 -0.02 0.00 -0.53 0.00 0.00 54.79 54.64 2omj n ASP 27 Cb 0.00 -0.01 -0.01 0.00 -0.64 0.00 0.00 41.12 40.46 2omj n ASP 27 CO 0.00 0.00 0.00 0.78 0.13 0.00 0.00 177.20 178.11 2omj h ASN 28 N 0.00 -0.09 -1.35 -2.24 2.35 -1.99 -3.39 115.58 108.87 2omj h ASN 28 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 2omj h ASN 28 Cb 0.00 0.02 0.00 0.00 0.05 0.00 0.00 38.32 38.39 2omj h ASN 28 CO 0.00 0.33 0.00 -0.81 -1.65 0.00 0.00 177.43 175.30 2omj n PRO 29 N -4.50 -0.01 -3.20 0.81 -0.04 -1.26 -4.80 135.00 121.99 2omj n PRO 29 Ca -0.01 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.45 2omj n PRO 29 Cb 0.04 0.00 -0.02 0.00 -0.04 0.00 0.00 33.50 33.48 2omj n PRO 29 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 2omj s VAL 30 N -0.74 -0.89 -0.04 0.52 -7.23 -1.26 -4.40 120.40 106.36 2omj s VAL 30 Ca 0.00 -0.06 0.06 0.00 -1.81 0.00 0.00 61.98 60.16 2omj s VAL 30 Cb 0.00 -0.98 -0.01 0.00 0.56 0.00 0.00 36.38 35.95 2omj s VAL 30 CO 0.00 -0.07 -0.21 0.72 -0.31 0.00 0.00 175.10 175.23 2omj s PHE 31 N 2.75 2.04 -0.23 2.82 -0.71 -1.26 -0.68 117.98 122.71 2omj s PHE 31 Ca 0.14 -0.54 -0.27 0.00 -1.04 0.00 0.00 56.93 55.22 2omj s PHE 31 Cb -0.13 -1.34 0.00 0.00 -1.21 0.00 0.00 43.02 40.35 2omj s PHE 31 CO -0.24 -0.14 0.95 0.08 -1.34 0.00 0.00 175.22 174.53 2omj s VAL 32 N -0.20 4.75 -0.02 -2.49 1.01 0.26 -3.18 120.40 120.54 2omj s VAL 32 Ca -0.00 1.85 0.12 0.00 0.00 0.00 0.00 61.98 63.94 2omj s VAL 32 Cb -0.11 -4.23 -0.20 0.00 0.00 0.00 0.00 36.38 31.83 2omj s VAL 32 CO 0.02 -0.13 0.87 -0.61 0.00 0.00 0.00 175.10 175.24 2omj h GLN 33 N 7.52 0.00 -4.81 2.72 4.15 -1.04 1.08 115.11 124.74 2omj h GLN 33 Ca -0.21 0.00 -0.33 0.00 0.77 0.00 0.00 58.65 58.88 2omj h GLN 33 Cb 1.08 0.00 -0.23 0.00 0.21 0.00 0.00 27.48 28.54 2omj h GLN 33 CO 0.93 0.59 -0.75 0.45 -1.93 0.00 0.00 178.83 178.12 2omj s SER 34 N -6.22 1.12 0.06 -0.69 0.15 -0.99 -3.79 113.70 103.33 2omj s SER 34 Ca -0.03 -0.50 0.02 0.00 0.70 0.00 0.00 55.95 56.14 2omj s SER 34 Cb 0.09 -0.01 -0.03 0.00 -1.71 0.00 0.00 66.02 64.35 2omj s SER 34 CO 0.82 -0.11 -0.07 0.68 1.20 0.00 0.00 173.24 175.76 2omj s VAL 35 N -1.15 0.51 -0.17 4.45 -7.23 -1.26 -0.62 120.40 114.94 2omj s VAL 35 Ca -0.05 -1.35 -0.29 0.00 -1.81 0.00 0.00 61.98 58.47 2omj s VAL 35 Cb -0.09 -0.93 -0.04 0.00 0.56 0.00 0.00 36.38 35.88 2omj s VAL 35 CO 0.01 -0.58 1.63 -0.75 -0.31 0.00 0.00 175.10 175.11 2omj s LYS 36 N -2.36 3.91 0.09 4.82 2.20 -1.26 -4.84 119.74 122.31 2omj s LYS 36 Ca -0.03 1.84 -0.28 0.00 -0.36 0.00 0.00 55.97 57.14 2omj s LYS 36 Cb -0.04 -4.02 -0.06 0.00 -1.51 0.00 0.00 37.83 32.20 2omj s LYS 36 CO -0.02 -1.16 0.88 -1.21 -0.36 0.00 0.00 175.35 173.49 2omj s GLU 37 N 4.48 4.62 -1.43 4.03 2.02 -1.26 -1.41 118.70 129.75 2omj s GLU 37 Ca 0.72 1.30 -0.04 0.00 0.02 0.00 0.00 54.97 56.98 2omj s GLU 37 Cb -0.28 -3.37 0.02 0.00 0.10 0.00 0.00 34.13 30.61 2omj s GLU 37 CO 0.29 0.26 0.32 -3.47 0.02 0.00 0.00 175.26 172.67 2omj n ASP 38 N 2.72 -5.07 0.00 -0.19 -0.08 -1.26 -4.90 116.55 107.78 2omj n ASP 38 Ca 0.00 -0.14 0.00 0.00 -1.51 0.00 0.00 54.79 53.14 2omj n ASP 38 Cb 0.49 -4.18 0.00 0.00 2.34 0.00 0.00 41.12 39.78 2omj n ASP 38 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2omj n GLY 39 N -1.18 5.52 0.22 0.27 0.00 -1.24 -4.95 105.19 103.83 2omj n GLY 39 Ca -0.13 -1.11 -0.07 0.00 0.00 0.00 0.00 46.02 44.71 2omj n GLY 39 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2omj h ALA 40 N 1.00 0.64 -0.20 4.61 0.00 -1.84 0.12 119.26 123.59 2omj h ALA 40 Ca 0.00 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.82 2omj h ALA 40 Cb 0.00 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 2omj h ALA 40 CO 0.00 0.14 0.05 0.00 0.00 0.00 0.00 179.25 179.44 2omj h ALA 41 N 1.14 0.26 -0.68 0.00 0.00 -1.91 0.43 119.26 118.49 2omj h ALA 41 Ca 0.18 -0.15 -0.05 0.00 0.00 0.00 0.00 54.91 54.89 2omj h ALA 41 Cb 0.00 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 2omj h ALA 41 CO -0.03 -0.10 0.23 1.98 0.00 0.00 0.00 179.25 181.33 2omj h MET 42 N 0.14 1.03 -0.02 0.00 -1.53 -1.07 -2.30 114.93 111.18 2omj h MET 42 Ca 0.06 -0.20 -0.12 0.00 -3.44 0.00 0.00 59.70 56.00 2omj h MET 42 Cb 0.26 -0.16 -0.02 0.00 -0.55 0.00 0.00 31.60 31.13 2omj h MET 42 CO -0.00 0.87 -0.56 0.00 0.14 0.00 0.00 176.91 177.36 2omj h ARG 43 N 1.00 0.07 0.00 0.39 3.08 -0.60 -2.77 114.38 115.55 2omj h ARG 43 Ca 0.22 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.23 2omj h ARG 43 Cb 0.26 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.31 2omj h ARG 43 CO -0.01 0.61 0.00 0.00 -1.07 0.00 0.00 179.97 179.50 2omj h ALA 44 N 1.38 1.00 -0.79 0.04 0.00 -0.40 -3.47 119.26 117.02 2omj h ALA 44 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2omj h ALA 44 Cb 1.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.79 2omj h ALA 44 CO 0.08 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.74 2omj n GLY 45 N 0.66 0.92 3.92 0.00 0.00 -0.91 -4.33 105.19 105.44 2omj n GLY 45 Ca 0.04 -0.63 -0.28 0.00 0.00 0.00 0.00 46.02 45.15 2omj n GLY 45 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2omj s VAL 46 N -2.79 5.19 0.00 1.61 0.11 -0.94 -4.96 120.40 118.62 2omj s VAL 46 Ca 0.00 -0.28 0.08 0.00 -2.93 0.00 0.00 61.98 58.85 2omj s VAL 46 Cb 0.00 -3.72 -0.02 0.00 -1.53 0.00 0.00 36.38 31.11 2omj s VAL 46 CO 0.00 -0.16 -0.26 -1.10 -3.33 0.00 0.00 175.10 170.25 2omj s GLN 47 N -3.26 1.99 0.24 1.54 1.11 -1.26 -4.77 119.66 115.25 2omj s GLN 47 Ca 0.39 -0.98 -0.31 0.00 0.01 0.00 0.00 55.36 54.47 2omj s GLN 47 Cb -0.11 -2.00 -0.11 0.00 -1.01 0.00 0.00 33.01 29.77 2omj s GLN 47 CO 0.29 0.54 1.64 -0.08 0.01 0.00 0.00 175.29 177.69 2omj s THR 48 N -0.67 2.13 -0.16 -0.19 -1.32 -1.26 -2.32 115.64 111.85 2omj s THR 48 Ca 0.10 0.10 -0.00 0.00 -1.21 0.00 0.00 61.69 60.68 2omj s THR 48 Cb -0.10 -3.06 0.00 0.00 -1.51 0.00 0.00 72.50 67.83 2omj s THR 48 CO 0.00 0.01 0.01 0.61 -2.21 0.00 0.00 174.62 173.05 2omj n GLY 49 N 3.11 0.36 3.83 6.08 0.00 0.37 -4.99 105.19 113.96 2omj n GLY 49 Ca 0.12 -0.78 -0.34 0.00 0.00 0.00 0.00 46.02 45.01 2omj n GLY 49 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2omj s ASP 50 N -2.93 6.90 -0.09 1.61 1.47 -0.81 -4.82 116.67 118.01 2omj s ASP 50 Ca 0.01 1.30 -0.17 0.00 1.18 0.00 0.00 52.55 54.86 2omj s ASP 50 Cb -0.00 -2.38 -0.05 0.00 -0.34 0.00 0.00 42.92 40.15 2omj s ASP 50 CO 0.01 -0.06 0.46 -0.13 0.68 0.00 0.00 175.17 176.13 2omj s ARG 51 N -2.40 4.25 -0.23 2.11 0.52 -0.95 -0.57 118.95 121.68 2omj s ARG 51 Ca 0.47 0.44 -0.13 0.00 -0.52 0.00 0.00 55.73 55.99 2omj s ARG 51 Cb -0.14 -3.38 -0.04 0.00 0.52 0.00 0.00 34.95 31.91 2omj s ARG 51 CO 0.19 0.29 0.29 0.42 0.02 0.00 0.00 175.30 176.52 2omj s ILE 52 N 0.19 5.26 -0.17 1.52 1.01 0.14 0.94 121.20 130.10 2omj s ILE 52 Ca 0.25 0.45 -0.09 0.00 0.00 0.00 0.00 60.65 61.26 2omj s ILE 52 Cb -0.16 -3.62 -0.23 0.00 0.01 0.00 0.00 42.46 38.46 2omj s ILE 52 CO 0.11 0.27 0.22 -0.38 0.00 0.00 0.00 174.94 175.16 2omj n ILE 53 N 4.51 1.68 -3.77 2.92 5.41 0.21 -4.48 119.36 125.83 2omj n ILE 53 Ca -0.11 -0.49 -0.13 0.00 1.00 0.00 0.00 62.75 63.02 2omj n ILE 53 Cb 0.51 -1.77 -0.10 0.00 -0.71 0.00 0.00 39.64 37.57 2omj n ILE 53 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 176.55 176.01 2omj s LYS 54 N -2.51 0.44 -0.24 0.38 1.02 -0.96 -4.88 119.74 112.99 2omj s LYS 54 Ca -0.26 0.22 -0.05 0.00 0.02 0.00 0.00 55.97 55.90 2omj s LYS 54 Cb 0.07 0.20 -0.01 0.00 -0.52 0.00 0.00 37.83 37.58 2omj s LYS 54 CO 0.69 -0.08 -0.01 0.14 -0.92 0.00 0.00 175.35 175.17 2omj s VAL 55 N -0.29 3.55 -1.62 3.17 -7.23 -1.25 0.33 120.40 117.07 2omj s VAL 55 Ca -0.04 -0.52 -0.02 0.00 -1.81 0.00 0.00 61.98 59.59 2omj s VAL 55 Cb -0.03 -2.67 0.00 0.00 0.56 0.00 0.00 36.38 34.24 2omj s VAL 55 CO 0.01 0.34 0.30 0.59 -0.31 0.00 0.00 175.10 176.04 2omj n ASN 56 N 4.82 -5.89 -1.81 4.85 4.13 0.10 -1.56 115.26 119.89 2omj n ASN 56 Ca -0.17 -0.15 -0.18 0.00 1.68 0.00 0.00 54.58 55.76 2omj n ASN 56 Cb 0.50 -4.81 -0.03 0.00 -1.54 0.00 0.00 39.78 33.91 2omj n ASN 56 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2omj n GLY 57 N -1.27 0.30 2.67 7.41 0.00 -1.25 -4.97 105.19 108.08 2omj n GLY 57 Ca -0.17 -0.15 -0.22 0.00 0.00 0.00 0.00 46.02 45.47 2omj n GLY 57 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2omj s THR 58 N -2.81 -0.24 0.13 2.61 -1.32 -0.60 -5.14 115.64 108.26 2omj s THR 58 Ca 0.00 -0.41 0.06 0.00 -1.21 0.00 0.00 61.69 60.13 2omj s THR 58 Cb 0.00 -0.84 -0.04 0.00 -1.51 0.00 0.00 72.50 70.11 2omj s THR 58 CO 0.00 -0.44 -0.00 -0.22 -2.21 0.00 0.00 174.62 171.75 2omj s LEU 59 N 2.25 3.37 0.25 9.08 2.96 -1.26 -3.77 118.68 131.56 2omj s LEU 59 Ca 0.07 -0.29 -0.03 0.00 -0.22 0.00 0.00 54.13 53.66 2omj s LEU 59 Cb -0.15 -2.07 -0.02 0.00 0.50 0.00 0.00 46.19 44.44 2omj s LEU 59 CO -0.25 0.13 0.29 0.68 -1.32 0.00 0.00 176.35 175.89 2omj s VAL 60 N -1.50 0.00 0.01 1.68 -7.23 -1.26 -5.07 120.40 107.03 2omj s VAL 60 Ca 0.26 -1.79 -0.20 0.00 -1.81 0.00 0.00 61.98 58.44 2omj s VAL 60 Cb -0.11 -2.44 -0.21 0.00 0.56 0.00 0.00 36.38 34.18 2omj s VAL 60 CO 0.18 0.00 1.15 0.74 -0.31 0.00 0.00 175.10 176.86 2omj h THR 61 N 2.39 1.43 -3.24 5.32 2.02 -2.00 -3.44 112.91 115.39 2omj h THR 61 Ca -0.31 -1.90 -0.67 0.00 0.77 0.00 0.00 66.41 64.30 2omj h THR 61 Cb 1.25 2.44 -0.32 0.00 -1.74 0.00 0.00 68.15 69.78 2omj h THR 61 CO 0.44 0.55 -0.83 -1.38 0.37 0.00 0.00 175.52 174.68 2omj s HIS 62 N -3.44 2.75 0.27 3.16 -3.43 -1.26 -4.95 115.29 108.39 2omj s HIS 62 Ca -0.14 -1.17 0.00 0.00 -0.80 0.00 0.00 55.06 52.96 2omj s HIS 62 Cb 0.04 -1.87 0.00 0.00 -1.43 0.00 0.00 32.58 29.32 2omj s HIS 62 CO 0.80 -0.54 0.00 -1.13 -2.00 0.00 0.00 174.74 171.87 2omj n SER 63 N 4.10 -0.54 -0.43 7.38 3.41 -1.26 -5.08 113.62 121.20 2omj n SER 63 Ca -0.19 0.47 0.05 0.00 -0.26 0.00 0.00 58.87 58.93 2omj n SER 63 Cb 0.52 0.70 -0.01 0.00 -0.26 0.00 0.00 64.21 65.15 2omj n SER 63 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 2omj n ASN 64 N -3.33 -2.55 -0.16 4.04 5.15 -1.26 -2.86 115.26 114.28 2omj n ASN 64 Ca 0.00 0.41 -0.10 0.00 -0.60 0.00 0.00 54.58 54.29 2omj n ASN 64 Cb 0.00 -1.15 -0.00 0.00 -0.53 0.00 0.00 39.78 38.09 2omj n ASN 64 CO 0.00 0.00 0.00 -0.74 1.40 0.00 0.00 177.26 177.92 2omj h HIS 65 N -0.35 0.89 -0.73 1.20 2.76 -1.89 -2.56 115.15 114.46 2omj h HIS 65 Ca 0.01 -0.15 0.08 0.00 -2.20 0.00 0.00 60.37 58.11 2omj h HIS 65 Cb 0.35 -0.23 -0.07 0.00 1.55 0.00 0.00 27.41 29.01 2omj h HIS 65 CO 0.00 0.84 0.39 1.37 -1.30 0.00 0.00 177.93 179.23 2omj h LEU 66 N 0.67 0.54 -0.71 0.26 8.10 -1.99 0.36 115.31 122.54 2omj h LEU 66 Ca 0.14 0.05 -0.08 0.00 0.11 0.00 0.00 57.88 58.09 2omj h LEU 66 Cb 0.48 -0.05 -0.02 0.00 -0.44 0.00 0.00 40.66 40.63 2omj h LEU 66 CO 0.02 0.32 0.05 -0.08 -4.11 0.00 0.00 178.44 174.64 2omj h GLU 67 N 0.67 1.04 -0.21 0.17 4.57 -1.43 0.21 114.58 119.62 2omj h GLU 67 Ca 0.35 -0.30 -0.03 0.00 -1.18 0.00 0.00 59.36 58.20 2omj h GLU 67 Cb 0.31 -0.11 -0.01 0.00 -0.16 0.00 0.00 28.75 28.78 2omj h GLU 67 CO -0.24 0.99 0.02 0.28 -1.18 0.00 0.00 179.01 178.88 2omj h VAL 68 N 0.97 1.24 -0.57 0.32 2.07 -0.79 0.35 116.25 119.83 2omj h VAL 68 Ca 0.18 -0.80 -0.07 0.00 0.82 0.00 0.00 66.70 66.83 2omj h VAL 68 Cb 0.48 1.36 -0.02 0.00 -1.52 0.00 0.00 31.29 31.60 2omj h VAL 68 CO 0.02 0.25 0.08 1.62 0.02 0.00 0.00 177.57 179.55 2omj h VAL 69 N 0.13 1.26 -0.60 2.57 3.04 -0.19 0.26 116.25 122.72 2omj h VAL 69 Ca 0.06 -1.01 -0.09 0.00 -1.01 0.00 0.00 66.70 64.65 2omj h VAL 69 Cb 0.35 0.80 -0.02 0.00 -2.01 0.00 0.00 31.29 30.40 2omj h VAL 69 CO 0.01 0.37 0.01 0.11 -1.01 0.00 0.00 177.57 177.06 2omj h LYS 70 N 0.85 1.04 -0.13 4.17 6.56 -0.46 0.47 116.57 129.08 2omj h LYS 70 Ca 0.17 -0.33 -0.03 0.00 -1.06 0.00 0.00 60.65 59.41 2omj h LYS 70 Cb 0.44 -0.10 -0.00 0.00 -0.57 0.00 0.00 32.23 32.00 2omj h LYS 70 CO 0.01 1.02 -0.04 -0.07 -2.06 0.00 0.00 179.45 178.31 2omj h LEU 71 N 0.94 0.26 -0.76 2.94 -0.00 -0.02 0.11 115.31 118.78 2omj h LEU 71 Ca 0.17 -0.38 -0.12 0.00 -0.00 0.00 0.00 57.88 57.55 2omj h LEU 71 Cb 0.54 -0.07 -0.01 0.00 -0.00 0.00 0.00 40.66 41.11 2omj h LEU 71 CO 0.03 0.58 -0.32 -0.29 -0.00 0.00 0.00 178.44 178.44 2omj h ILE 72 N -0.06 1.28 0.00 1.22 2.10 -0.42 -2.87 117.51 118.76 2omj h ILE 72 Ca 0.03 -1.43 -0.12 0.00 1.08 0.00 0.00 64.86 64.42 2omj h ILE 72 Cb 0.47 1.43 -0.02 0.00 -1.09 0.00 0.00 36.82 37.61 2omj h ILE 72 CO 0.01 0.46 -0.58 0.50 -1.08 0.00 0.00 178.15 177.46 2omj h LYS 73 N 0.49 0.00 -4.75 2.19 3.64 0.02 -3.38 116.57 114.77 2omj h LYS 73 Ca 0.06 0.00 -0.57 0.00 -1.27 0.00 0.00 60.65 58.87 2omj h LYS 73 Cb 0.80 0.00 0.04 0.00 -0.41 0.00 0.00 32.23 32.66 2omj h LYS 73 CO 0.07 0.58 1.88 -1.13 -2.27 0.00 0.00 179.45 178.58 2omj n SER 74 N -3.67 2.41 0.00 4.20 3.41 0.37 -4.62 113.62 115.73 2omj n SER 74 Ca -0.01 -2.66 0.00 0.00 -0.26 0.00 0.00 58.87 55.95 2omj n SER 74 Cb 0.62 -1.18 0.00 0.00 -0.26 0.00 0.00 64.21 63.39 2omj n SER 74 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2omj n GLY 75 N 4.88 3.29 0.17 5.00 0.00 -1.26 -4.90 105.19 112.37 2omj n GLY 75 Ca 0.48 -1.62 -0.01 0.00 0.00 0.00 0.00 46.02 44.87 2omj n GLY 75 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2omj h SER 76 N 0.00 0.09 -3.69 1.61 4.64 -1.86 -3.41 113.55 110.94 2omj h SER 76 Ca 0.00 -0.04 -0.64 0.00 -0.47 0.00 0.00 61.79 60.63 2omj h SER 76 Cb 0.00 -0.03 -0.16 0.00 -0.31 0.00 0.00 62.40 61.91 2omj h SER 76 CO 0.00 0.58 -0.23 -0.47 -0.87 0.00 0.00 176.83 175.84 2omj s TYR 77 N -3.91 3.22 -0.05 4.77 5.04 -1.26 -0.78 117.35 124.37 2omj s TYR 77 Ca -0.03 0.20 0.03 0.00 -2.44 0.00 0.00 57.07 54.84 2omj s TYR 77 Cb 0.13 -2.66 0.00 0.00 0.35 0.00 0.00 41.96 39.78 2omj s TYR 77 CO 0.76 -0.36 -0.15 0.54 -1.34 0.00 0.00 175.55 175.00 2omj s VAL 78 N 2.10 1.33 -0.15 3.14 0.11 -0.71 -5.03 120.40 121.19 2omj s VAL 78 Ca 0.14 -0.64 -0.03 0.00 -2.93 0.00 0.00 61.98 58.53 2omj s VAL 78 Cb -0.16 -1.17 0.05 0.00 -1.53 0.00 0.00 36.38 33.57 2omj s VAL 78 CO 0.11 0.39 0.03 0.00 -3.33 0.00 0.00 175.10 172.31 2omj s ALA 79 N 0.27 0.81 -0.05 1.54 0.00 -1.26 -0.21 121.76 122.85 2omj s ALA 79 Ca -0.08 -0.45 0.04 0.00 0.00 0.00 0.00 51.96 51.46 2omj s ALA 79 Cb -0.13 -1.02 0.00 0.00 0.00 0.00 0.00 23.12 21.97 2omj s ALA 79 CO 0.03 -0.95 -0.16 -0.48 0.00 0.00 0.00 175.76 174.19 2omj s LEU 80 N 1.94 1.86 -0.04 0.00 0.05 -1.07 0.03 118.68 121.45 2omj s LEU 80 Ca 0.01 -0.35 -0.30 0.00 0.05 0.00 0.00 54.13 53.54 2omj s LEU 80 Cb -0.15 -0.96 -0.03 0.00 -2.05 0.00 0.00 46.19 42.99 2omj s LEU 80 CO -0.07 0.12 1.17 -0.89 -0.55 0.00 0.00 176.35 176.13 2omj s THR 81 N 0.22 4.32 0.41 5.48 2.01 0.15 -3.49 115.64 124.74 2omj s THR 81 Ca -0.08 1.64 0.03 0.00 0.31 0.00 0.00 61.69 63.60 2omj s THR 81 Cb -0.13 -4.05 -0.03 0.00 0.01 0.00 0.00 72.50 68.29 2omj s THR 81 CO 0.03 0.02 0.08 0.68 -0.69 0.00 0.00 174.62 174.74 2omj s VAL 82 N 1.99 0.92 -0.03 3.82 -7.23 -1.17 0.66 120.40 119.35 2omj s VAL 82 Ca 0.55 -2.00 0.01 0.00 -1.81 0.00 0.00 61.98 58.74 2omj s VAL 82 Cb -0.24 -2.45 0.01 0.00 0.56 0.00 0.00 36.38 34.26 2omj s VAL 82 CO 0.23 0.00 -0.06 -1.58 -0.31 0.00 0.00 175.10 173.38 2omj s GLN 83 N -3.79 0.80 -0.24 4.82 0.74 0.27 -1.75 119.66 120.51 2omj s GLN 83 Ca 0.24 -0.16 -0.02 0.00 0.05 0.00 0.00 55.36 55.47 2omj s GLN 83 Cb 0.04 -0.78 0.08 0.00 1.10 0.00 0.00 33.01 33.45 2omj s GLN 83 CO 0.13 -0.01 0.07 0.20 -0.55 0.00 0.00 175.29 175.12 2omj s GLY 84 N 0.60 0.80 -0.31 2.59 0.00 -0.48 -2.24 107.32 108.28 2omj s GLY 84 Ca -0.08 -1.07 -0.12 0.00 0.00 0.00 0.00 44.72 43.45 2omj s GLY 84 CO 0.00 1.57 1.08 -1.60 0.00 0.00 0.00 173.10 174.15 2omj s ARG 85 N 1.81 0.12 1.11 2.90 6.06 -1.26 -4.30 118.95 125.39 2omj s ARG 85 Ca 0.04 0.05 -0.14 0.00 -2.50 0.00 0.00 55.73 53.18 2omj s ARG 85 Cb -0.17 0.04 0.25 0.00 0.06 0.00 0.00 34.95 35.12 2omj s ARG 85 CO -0.17 -0.20 1.07 -1.25 -2.50 0.00 0.00 175.30 172.24 2omj s PRO 86 N 2.63 -0.47 1.17 5.12 0.04 -1.26 -4.59 135.00 137.64 2omj s PRO 86 Ca 0.24 0.47 -0.16 0.00 0.04 0.00 0.00 61.00 61.60 2omj s PRO 86 Cb 0.00 -1.64 0.27 0.00 0.04 0.00 0.00 34.50 33.18 2omj s PRO 86 CO -0.20 -3.33 1.04 -1.25 0.04 0.00 0.00 177.00 173.30 2omj s PRO 87 N -4.89 -0.99 -0.23 0.56 0.04 -1.26 -4.76 135.00 123.47 2omj s PRO 87 Ca 0.67 0.43 0.14 0.00 0.04 0.00 0.00 61.00 62.28 2omj s PRO 87 Cb -0.19 -1.58 0.82 0.00 0.04 0.00 0.00 34.50 33.59 2omj s PRO 87 CO 0.59 -3.66 1.75 0.41 0.04 0.00 0.00 177.00 176.13 2omj n GLY 88 N -0.00 2.99 3.63 0.56 0.00 -1.26 -5.07 105.19 106.04 2omj n GLY 88 Ca 0.07 -0.93 0.00 0.00 0.00 0.00 0.00 46.02 45.16 2omj n GLY 88 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76