#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2omj n SER 2 N 0.00 2.46 -4.00 1.61 7.64 -1.26 -4.98 113.62 115.10 2omj n SER 2 Ca 0.00 -3.86 -0.29 0.00 1.01 0.00 0.00 58.87 55.73 2omj n SER 2 Cb 0.00 -0.54 -0.17 0.00 -1.01 0.00 0.00 64.21 62.49 2omj n SER 2 CO 0.00 0.00 0.00 -2.28 -3.01 0.00 0.00 175.04 169.75 2omj s HIS 3 N -3.31 1.96 -0.74 1.43 5.04 -1.26 -5.08 115.29 113.33 2omj s HIS 3 Ca 0.42 -1.04 -0.20 0.00 -1.54 0.00 0.00 55.06 52.70 2omj s HIS 3 Cb 0.39 -1.47 0.11 0.00 0.04 0.00 0.00 32.58 31.65 2omj s HIS 3 CO -0.04 -0.59 0.93 -1.64 -2.34 0.00 0.00 174.74 171.07 2omj s MET 4 N 1.43 3.29 -0.24 2.88 1.00 -1.26 -4.84 119.30 121.55 2omj s MET 4 Ca 0.02 -1.39 0.12 0.00 0.00 0.00 0.00 55.69 54.44 2omj s MET 4 Cb -0.13 -4.49 0.51 0.00 0.00 0.00 0.00 34.83 30.72 2omj s MET 4 CO -0.08 -1.69 1.44 0.41 0.00 0.00 0.00 175.02 175.09 2omj n GLY 5 N 5.28 4.59 5.08 -0.03 0.00 -1.26 -5.01 105.19 113.85 2omj n GLY 5 Ca 0.05 -1.15 0.00 0.00 0.00 0.00 0.00 46.02 44.92 2omj n GLY 5 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2omj n LEU 6 N -0.93 0.00 -4.27 0.99 4.77 -1.26 -4.55 117.00 111.76 2omj n LEU 6 Ca 0.28 0.00 -0.36 0.00 -0.03 0.00 0.00 56.01 55.90 2omj n LEU 6 Cb 0.97 0.00 -0.13 0.00 -2.33 0.00 0.00 43.42 41.93 2omj n LEU 6 CO 0.17 0.00 -0.31 -0.69 -1.33 0.00 0.00 177.39 175.24 2omj s VAL 7 N 0.00 3.55 -0.06 4.08 1.01 -1.26 -5.09 120.40 122.63 2omj s VAL 7 Ca 0.00 -1.00 0.05 0.00 0.00 0.00 0.00 61.98 61.03 2omj s VAL 7 Cb 0.00 -2.91 -0.00 0.00 0.00 0.00 0.00 36.38 33.47 2omj s VAL 7 CO 0.00 -0.00 -0.21 -1.58 0.00 0.00 0.00 175.10 173.30 2omj s GLN 8 N 1.40 2.36 -0.12 2.72 2.00 -1.26 -3.02 119.66 123.74 2omj s GLN 8 Ca -0.00 -0.76 -0.09 0.00 -2.00 0.00 0.00 55.36 52.50 2omj s GLN 8 Cb -0.18 -1.94 0.04 0.00 0.80 0.00 0.00 33.01 31.73 2omj s GLN 8 CO 0.01 0.25 0.31 0.50 -0.50 0.00 0.00 175.29 175.86 2omj s ARG 9 N 0.11 0.33 -0.02 1.67 6.06 -1.06 -5.04 118.95 121.00 2omj s ARG 9 Ca -0.09 0.50 0.02 0.00 -2.50 0.00 0.00 55.73 53.66 2omj s ARG 9 Cb -0.14 0.08 -0.03 0.00 0.06 0.00 0.00 34.95 34.92 2omj s ARG 9 CO 0.05 -0.08 -0.06 0.00 -2.50 0.00 0.00 175.30 172.70 2omj s VAL 11 N -0.95 -0.03 -0.31 0.00 -7.23 -1.23 -4.99 120.40 105.67 2omj s VAL 11 Ca 0.16 0.10 -0.15 0.00 -1.81 0.00 0.00 61.98 60.27 2omj s VAL 11 Cb -0.11 -0.18 -0.02 0.00 0.56 0.00 0.00 36.38 36.62 2omj s VAL 11 CO 0.06 0.04 0.38 -0.63 -0.31 0.00 0.00 175.10 174.64 2omj s ILE 12 N 0.62 5.15 -0.10 -0.62 1.01 -1.26 -3.06 121.20 122.93 2omj s ILE 12 Ca -0.05 0.31 -0.24 0.00 0.00 0.00 0.00 60.65 60.68 2omj s ILE 12 Cb -0.06 -3.78 -0.03 0.00 0.01 0.00 0.00 42.46 38.59 2omj s ILE 12 CO -0.03 0.00 0.73 -0.63 0.00 0.00 0.00 174.94 175.01 2omj s ILE 13 N 2.09 5.00 -0.19 2.92 1.01 0.50 -4.78 121.20 127.75 2omj s ILE 13 Ca 0.14 1.46 -0.09 0.00 0.00 0.00 0.00 60.65 62.17 2omj s ILE 13 Cb -0.16 -4.05 -0.05 0.00 0.01 0.00 0.00 42.46 38.21 2omj s ILE 13 CO 0.11 0.18 0.10 -1.10 0.00 0.00 0.00 174.94 174.23 2omj s GLN 14 N 1.24 4.06 0.52 2.79 -0.21 -1.26 -2.29 119.66 124.51 2omj s GLN 14 Ca 0.37 -0.28 -0.20 0.00 0.02 0.00 0.00 55.36 55.27 2omj s GLN 14 Cb -0.17 -3.31 -0.07 0.00 1.00 0.00 0.00 33.01 30.46 2omj s GLN 14 CO 0.16 0.30 1.09 0.21 -2.12 0.00 0.00 175.29 174.94 2omj s LYS 15 N 0.32 3.52 0.00 2.91 2.20 -0.84 -4.87 119.74 122.98 2omj s LYS 15 Ca 0.06 1.51 0.00 0.00 -0.36 0.00 0.00 55.97 57.18 2omj s LYS 15 Cb -0.12 -2.04 0.00 0.00 -1.51 0.00 0.00 37.83 34.16 2omj s LYS 15 CO -0.01 -0.69 0.00 -0.25 -0.36 0.00 0.00 175.35 174.04 2omj n ASP 16 N -1.18 1.77 0.16 1.43 9.92 -1.16 -4.92 116.55 122.57 2omj n ASP 16 Ca 0.11 -0.81 0.13 0.00 -0.53 0.00 0.00 54.79 53.68 2omj n ASP 16 Cb 0.52 0.00 0.66 0.00 -0.64 0.00 0.00 41.12 41.65 2omj n ASP 16 CO 0.00 0.00 0.00 -0.78 0.13 0.00 0.00 177.20 176.55 2omj h ASP 17 N 0.00 0.00 0.00 -2.24 3.58 -2.06 -2.78 116.42 112.93 2omj h ASP 17 Ca 0.00 0.00 -0.37 0.00 0.42 0.00 0.00 57.03 57.08 2omj h ASP 17 Cb 0.00 -0.00 -0.07 0.00 1.72 0.00 0.00 39.33 40.98 2omj h ASP 17 CO 0.00 0.00 -2.40 0.59 -2.88 0.00 0.00 179.24 174.55 2omj n ASN 18 N -4.48 1.23 0.00 2.28 3.02 -1.26 -5.12 115.26 110.94 2omj n ASN 18 Ca 0.02 -0.08 0.00 0.00 -0.03 0.00 0.00 54.58 54.49 2omj n ASN 18 Cb 0.29 0.19 0.00 0.00 -0.61 0.00 0.00 39.78 39.66 2omj n ASN 18 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2omj n GLY 19 N 2.08 0.26 3.37 7.41 0.00 -1.05 -4.97 105.19 112.28 2omj n GLY 19 Ca -0.39 -1.49 -0.45 0.00 0.00 0.00 0.00 46.02 43.69 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 -1.43 3.15 0.55 1.61 0.08 -1.26 -2.96 117.98 117.72 2omj s PHE 20 Ca 0.00 -1.20 0.23 0.00 0.12 0.00 0.00 56.93 56.07 2omj s PHE 20 Cb 0.00 -4.00 1.52 0.00 -0.57 0.00 0.00 43.02 39.97 2omj s PHE 20 CO 0.00 -1.25 2.18 0.78 -0.10 0.00 0.00 175.22 176.83 2omj h GLY 21 N 9.59 0.00 -4.35 4.36 0.00 -1.94 -3.42 103.07 107.30 2omj h GLY 21 Ca -0.18 0.00 -0.53 0.00 0.00 0.00 0.00 47.33 46.62 2omj h GLY 21 CO 1.04 0.00 0.82 0.48 0.00 0.00 0.00 176.54 178.89 2omj s LEU 22 N -8.41 4.37 -0.12 3.11 0.05 -1.26 -4.49 118.68 111.93 2omj s LEU 22 Ca -0.05 2.72 -0.05 0.00 0.05 0.00 0.00 54.13 56.80 2omj s LEU 22 Cb 0.16 -3.62 -0.04 0.00 -2.05 0.00 0.00 46.19 40.65 2omj s LEU 22 CO 0.62 -0.78 0.07 -0.89 -0.55 0.00 0.00 176.35 174.81 2omj s THR 23 N 0.30 4.91 0.01 5.48 2.01 0.10 -4.93 115.64 123.54 2omj s THR 23 Ca 0.63 -0.01 0.03 0.00 0.31 0.00 0.00 61.69 62.65 2omj s THR 23 Cb -0.44 -3.13 -0.01 0.00 0.01 0.00 0.00 72.50 68.92 2omj s THR 23 CO 0.41 0.58 -0.10 0.68 -0.69 0.00 0.00 174.62 175.49 2omj s VAL 24 N -0.64 0.81 -0.14 3.82 -7.23 -1.26 -1.59 120.40 114.17 2omj s VAL 24 Ca 0.12 -0.65 -0.09 0.00 -1.81 0.00 0.00 61.98 59.55 2omj s VAL 24 Cb -0.12 -0.72 0.05 0.00 0.56 0.00 0.00 36.38 36.15 2omj s VAL 24 CO 0.02 0.07 0.34 -0.55 -0.31 0.00 0.00 175.10 174.68 2omj s SER 25 N -0.65 -0.40 -0.30 4.85 0.15 -1.16 -4.94 113.70 111.24 2omj s SER 25 Ca 0.01 0.73 -0.13 0.00 0.70 0.00 0.00 55.95 57.27 2omj s SER 25 Cb -0.06 0.64 0.18 0.00 -1.71 0.00 0.00 66.02 65.07 2omj s SER 25 CO 0.00 -0.17 1.00 -0.83 1.20 0.00 0.00 173.24 174.45 2omj s GLY 26 N 1.10 -0.34 0.08 9.45 0.00 -1.26 -4.36 107.32 111.99 2omj s GLY 26 Ca -0.07 2.80 -0.30 0.00 0.00 0.00 0.00 44.72 47.15 2omj s GLY 26 CO -0.09 3.61 1.65 1.29 0.00 0.00 0.00 173.10 179.56 2omj h ASP 27 N 7.83 -0.61 0.00 1.64 2.03 -2.00 -3.40 116.42 121.92 2omj h ASP 27 Ca -0.15 0.04 0.00 0.00 -0.73 0.00 0.00 57.03 56.19 2omj h ASP 27 Cb 1.16 0.18 0.00 0.00 -0.83 0.00 0.00 39.33 39.84 2omj h ASP 27 CO -0.01 -0.39 -0.56 0.59 -1.03 0.00 0.00 179.24 177.84 2omj n ASN 28 N -5.38 1.17 -2.36 4.15 3.02 -1.26 -4.80 115.26 109.81 2omj n ASN 28 Ca -0.11 0.25 0.00 0.00 -0.03 0.00 0.00 54.58 54.69 2omj n ASN 28 Cb 0.28 -0.66 0.00 0.00 -0.61 0.00 0.00 39.78 38.79 2omj n ASN 28 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 2omj n PRO 29 N -3.70 0.36 -3.54 3.52 -0.04 -1.26 -4.81 135.00 125.53 2omj n PRO 29 Ca -0.08 0.00 -0.20 0.00 -0.04 0.00 0.00 63.50 63.18 2omj n PRO 29 Cb 0.29 0.00 -0.14 0.00 -0.04 0.00 0.00 33.50 33.61 2omj n PRO 29 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2omj s VAL 30 N -0.64 -0.25 0.04 0.52 1.01 -1.26 -4.36 120.40 115.46 2omj s VAL 30 Ca 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 61.98 61.88 2omj s VAL 30 Cb 0.00 -0.63 -0.03 0.00 0.00 0.00 0.00 36.38 35.72 2omj s VAL 30 CO 0.00 -0.21 -0.04 0.72 0.00 0.00 0.00 175.10 175.57 2omj s PHE 31 N 2.27 0.48 -0.26 5.22 -0.71 -1.26 0.10 117.98 123.83 2omj s PHE 31 Ca 0.05 -0.78 -0.18 0.00 -1.04 0.00 0.00 56.93 54.99 2omj s PHE 31 Cb -0.16 -0.33 -0.03 0.00 -1.21 0.00 0.00 43.02 41.30 2omj s PHE 31 CO -0.11 -0.25 0.50 0.08 -1.34 0.00 0.00 175.22 174.11 2omj s VAL 32 N -2.65 5.08 -0.04 -2.49 1.01 0.14 -2.98 120.40 118.47 2omj s VAL 32 Ca -0.03 0.86 0.10 0.00 0.00 0.00 0.00 61.98 62.91 2omj s VAL 32 Cb -0.01 -3.82 -0.23 0.00 0.00 0.00 0.00 36.38 32.32 2omj s VAL 32 CO -0.05 0.10 0.68 -0.61 0.00 0.00 0.00 175.10 175.22 2omj h GLN 33 N 7.99 0.03 -3.80 2.72 -0.00 -1.60 0.51 115.11 120.96 2omj h GLN 33 Ca -0.29 -0.05 -0.17 0.00 -0.00 0.00 0.00 58.65 58.13 2omj h GLN 33 Cb 1.14 0.02 -0.22 0.00 0.00 0.00 0.00 27.48 28.42 2omj h GLN 33 CO 0.71 0.61 -0.64 0.45 0.00 0.00 0.00 178.83 179.96 2omj s SER 34 N -6.24 0.14 0.03 -0.69 0.15 -0.71 -3.97 113.70 102.42 2omj s SER 34 Ca -0.06 -0.33 0.02 0.00 0.70 0.00 0.00 55.95 56.28 2omj s SER 34 Cb 0.08 0.13 -0.02 0.00 -1.71 0.00 0.00 66.02 64.50 2omj s SER 34 CO 0.82 -0.28 -0.07 0.68 1.20 0.00 0.00 173.24 175.60 2omj s VAL 35 N -1.21 0.47 -0.36 4.45 -7.23 -1.26 0.03 120.40 115.28 2omj s VAL 35 Ca -0.13 -0.93 -0.27 0.00 -1.81 0.00 0.00 61.98 58.84 2omj s VAL 35 Cb -0.08 -0.53 -0.05 0.00 0.56 0.00 0.00 36.38 36.28 2omj s VAL 35 CO -0.00 -0.32 2.26 -0.75 -0.31 0.00 0.00 175.10 175.97 2omj s LYS 36 N -1.35 2.67 0.17 4.82 2.36 -1.26 -4.82 119.74 122.33 2omj s LYS 36 Ca -0.09 1.65 -0.30 0.00 -2.55 0.00 0.00 55.97 54.68 2omj s LYS 36 Cb -0.09 -4.46 -0.07 0.00 -1.05 0.00 0.00 37.83 32.16 2omj s LYS 36 CO 0.00 -2.64 1.11 -1.21 1.55 0.00 0.00 175.35 174.17 2omj s GLU 37 N 7.18 4.58 -1.79 4.03 8.01 -1.26 -1.56 118.70 137.88 2omj s GLU 37 Ca 0.96 1.72 0.00 0.00 0.01 0.00 0.00 54.97 57.67 2omj s GLU 37 Cb -0.24 -3.28 0.00 0.00 -4.31 0.00 0.00 34.13 26.29 2omj s GLU 37 CO 0.30 0.04 0.00 -3.47 0.01 0.00 0.00 175.26 172.14 2omj n ASP 38 N 2.50 -5.37 0.00 -0.19 -0.08 -1.26 -4.92 116.55 107.24 2omj n ASP 38 Ca 0.03 0.21 0.00 0.00 -1.51 0.00 0.00 54.79 53.52 2omj n ASP 38 Cb 0.46 -4.47 0.00 0.00 2.34 0.00 0.00 41.12 39.45 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 -0.85 5.31 0.33 0.27 0.00 -1.17 -4.96 105.19 104.11 2omj n GLY 39 Ca -0.21 -1.38 -0.04 0.00 0.00 0.00 0.00 46.02 44.39 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 1.06 -0.29 4.61 0.00 -1.90 0.23 119.26 123.97 2omj h ALA 40 Ca 0.00 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 2omj h ALA 40 Cb 0.00 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.44 2omj h ALA 40 CO 0.00 0.52 0.16 0.00 0.00 0.00 0.00 179.25 179.93 2omj h ALA 41 N 1.27 0.37 -0.32 0.00 0.00 -1.90 0.07 119.26 118.75 2omj h ALA 41 Ca 0.30 -0.07 -0.05 0.00 0.00 0.00 0.00 54.91 55.09 2omj h ALA 41 Cb -0.04 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 2omj h ALA 41 CO -0.06 -0.10 0.02 1.98 0.00 0.00 0.00 179.25 181.10 2omj h MET 42 N 0.36 0.55 -0.30 0.00 -1.53 -1.01 -2.35 114.93 110.65 2omj h MET 42 Ca 0.10 -0.16 -0.02 0.00 -3.44 0.00 0.00 59.70 56.18 2omj h MET 42 Cb 0.06 -0.06 -0.02 0.00 -0.55 0.00 0.00 31.60 31.03 2omj h MET 42 CO -0.02 0.66 0.09 -0.09 0.14 0.00 0.00 176.91 177.69 2omj h ARG 43 N 0.36 0.42 0.00 0.39 2.43 -0.81 -1.11 114.38 116.07 2omj h ARG 43 Ca 0.09 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.21 2omj h ARG 43 Cb 0.40 -0.08 0.00 0.00 -0.42 0.00 0.00 29.97 29.87 2omj h ARG 43 CO 0.01 0.39 0.00 0.00 -1.51 0.00 0.00 179.97 178.86 2omj h ALA 44 N 1.68 1.00 -0.12 2.80 0.00 -0.74 -3.46 119.26 120.41 2omj h ALA 44 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.01 2omj h ALA 44 Cb 0.15 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.94 2omj h ALA 44 CO -0.01 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.65 2omj n GLY 45 N 0.18 0.87 3.87 0.00 0.00 -0.42 -4.60 105.19 105.09 2omj n GLY 45 Ca 0.02 -0.60 -0.31 0.00 0.00 0.00 0.00 46.02 45.13 2omj n GLY 45 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2omj s VAL 46 N -2.12 4.70 0.06 1.61 1.01 -0.91 -4.98 120.40 119.77 2omj s VAL 46 Ca 0.00 0.83 0.08 0.00 0.00 0.00 0.00 61.98 62.89 2omj s VAL 46 Cb 0.00 -3.79 -0.03 0.00 0.00 0.00 0.00 36.38 32.56 2omj s VAL 46 CO 0.00 -0.83 -0.23 -1.10 0.00 0.00 0.00 175.10 172.94 2omj s GLN 47 N -4.50 1.50 -0.07 2.72 -0.21 -1.26 -4.82 119.66 113.02 2omj s GLN 47 Ca 0.54 -1.05 -0.30 0.00 0.02 0.00 0.00 55.36 54.58 2omj s GLN 47 Cb -0.10 -1.68 -0.03 0.00 1.00 0.00 0.00 33.01 32.19 2omj s GLN 47 CO 0.41 0.43 1.27 0.99 -2.12 0.00 0.00 175.29 176.26 2omj s THR 48 N -0.85 4.14 0.00 -0.19 2.01 -1.26 -3.22 115.64 116.26 2omj s THR 48 Ca 0.09 1.45 0.00 0.00 0.31 0.00 0.00 61.69 63.54 2omj s THR 48 Cb -0.09 -3.93 0.00 0.00 0.01 0.00 0.00 72.50 68.48 2omj s THR 48 CO 0.02 -0.04 0.00 0.61 -0.69 0.00 0.00 174.62 174.53 2omj n GLY 49 N 3.51 0.75 3.88 4.40 0.00 0.17 -5.01 105.19 112.89 2omj n GLY 49 Ca 0.12 -0.69 -0.33 0.00 0.00 0.00 0.00 46.02 45.12 2omj n GLY 49 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2omj s ASP 50 N -2.86 6.58 0.05 1.61 2.15 -0.85 -4.86 116.67 118.49 2omj s ASP 50 Ca 0.00 0.73 -0.17 0.00 0.43 0.00 0.00 52.55 53.54 2omj s ASP 50 Cb 0.00 -2.15 -0.06 0.00 -0.30 0.00 0.00 42.92 40.41 2omj s ASP 50 CO 0.00 0.10 0.50 -0.60 -0.17 0.00 0.00 175.17 175.00 2omj s ARG 51 N -2.30 4.07 -0.17 4.34 3.52 -0.84 0.23 118.95 127.79 2omj s ARG 51 Ca 0.38 0.59 -0.07 0.00 -0.13 0.00 0.00 55.73 56.50 2omj s ARG 51 Cb -0.13 -3.20 -0.04 0.00 -1.56 0.00 0.00 34.95 30.02 2omj s ARG 51 CO 0.21 0.65 0.04 0.42 -0.81 0.00 0.00 175.30 175.80 2omj s ILE 52 N -1.13 4.59 -0.24 4.11 1.01 0.29 0.97 121.20 130.79 2omj s ILE 52 Ca 0.28 -0.11 -0.11 0.00 0.00 0.00 0.00 60.65 60.71 2omj s ILE 52 Cb -0.18 -3.05 -0.11 0.00 0.01 0.00 0.00 42.46 39.13 2omj s ILE 52 CO 0.17 0.47 -0.30 -0.38 0.00 0.00 0.00 174.94 174.90 2omj n ILE 53 N 3.50 1.30 -4.81 2.92 2.08 0.21 -4.42 119.36 120.14 2omj n ILE 53 Ca -0.17 -0.35 -0.26 0.00 0.56 0.00 0.00 62.75 62.54 2omj n ILE 53 Cb 0.52 -1.78 -0.15 0.00 -0.75 0.00 0.00 39.64 37.49 2omj n ILE 53 CO 0.00 0.00 0.00 -0.54 0.56 0.00 0.00 176.55 176.57 2omj s LYS 54 N -2.44 1.48 -0.32 0.38 1.02 -0.97 -4.39 119.74 114.51 2omj s LYS 54 Ca -0.33 -0.79 -0.02 0.00 0.02 0.00 0.00 55.97 54.85 2omj s LYS 54 Cb 0.12 -1.50 0.06 0.00 -0.52 0.00 0.00 37.83 36.00 2omj s LYS 54 CO 0.43 0.40 0.04 0.14 -0.92 0.00 0.00 175.35 175.44 2omj s VAL 55 N -0.60 3.01 -1.30 3.17 -7.23 0.19 -0.14 120.40 117.50 2omj s VAL 55 Ca 0.07 -1.58 -0.06 0.00 -1.81 0.00 0.00 61.98 58.61 2omj s VAL 55 Cb -0.08 -2.83 0.01 0.00 0.56 0.00 0.00 36.38 34.04 2omj s VAL 55 CO 0.00 -0.26 1.11 -3.20 -0.31 0.00 0.00 175.10 172.45 2omj n ASN 56 N 4.60 -4.72 -1.06 4.85 5.15 0.44 -2.02 115.26 122.50 2omj n ASN 56 Ca -0.10 -0.57 -0.10 0.00 -0.60 0.00 0.00 54.58 53.21 2omj n ASN 56 Cb 0.43 -5.06 -0.01 0.00 -0.53 0.00 0.00 39.78 34.60 2omj n ASN 56 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2omj n GLY 57 N -1.68 0.20 2.72 8.20 0.00 -1.14 -4.88 105.19 108.61 2omj n GLY 57 Ca -0.11 -0.49 -0.25 0.00 0.00 0.00 0.00 46.02 45.17 2omj n GLY 57 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2omj s THR 58 N -2.47 0.32 -1.27 2.61 2.01 -0.86 -5.07 115.64 110.92 2omj s THR 58 Ca 0.00 -0.19 -0.19 0.00 0.31 0.00 0.00 61.69 61.62 2omj s THR 58 Cb 0.00 -0.72 0.02 0.00 0.01 0.00 0.00 72.50 71.81 2omj s THR 58 CO 0.00 -0.04 1.81 -0.11 -0.69 0.00 0.00 174.62 175.59 2omj n LEU 59 N 5.14 4.40 -3.92 4.42 0.00 -1.26 -0.63 117.00 125.14 2omj n LEU 59 Ca -0.08 -3.69 -0.14 0.00 0.00 0.00 0.00 56.01 52.10 2omj n LEU 59 Cb 0.49 -1.74 -0.14 0.00 0.00 0.00 0.00 43.42 42.02 2omj n LEU 59 CO 0.11 -0.44 -0.38 0.68 0.00 0.00 0.00 177.39 177.36 2omj s VAL 60 N 6.29 0.24 -0.06 1.96 -7.23 -1.26 -5.02 120.40 115.32 2omj s VAL 60 Ca 0.58 -0.14 0.10 0.00 -1.81 0.00 0.00 61.98 60.72 2omj s VAL 60 Cb 0.03 -0.21 -0.15 0.00 0.56 0.00 0.00 36.38 36.60 2omj s VAL 60 CO 0.09 0.06 0.14 1.07 -0.31 0.00 0.00 175.10 176.16 2omj n THR 61 N 2.99 0.36 -1.34 5.32 5.66 -1.26 -4.67 114.28 121.34 2omj n THR 61 Ca -0.13 -0.35 0.18 0.00 -3.05 0.00 0.00 64.05 60.70 2omj n THR 61 Cb 0.59 -0.24 -0.05 0.00 -1.55 0.00 0.00 70.33 69.08 2omj n THR 61 CO 0.00 0.00 0.00 1.41 -3.05 0.00 0.00 175.07 173.43 2omj n HIS 62 N -2.14 -3.37 0.00 1.09 8.25 -1.26 -4.86 115.22 112.93 2omj n HIS 62 Ca -0.10 1.69 0.00 0.00 -0.26 0.00 0.00 57.72 59.05 2omj n HIS 62 Cb 0.57 -3.06 0.00 0.00 1.12 0.00 0.00 29.99 28.62 2omj n HIS 62 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 2omj n SER 63 N -4.03 0.00 -4.78 0.41 7.64 -1.26 -4.93 113.62 106.67 2omj n SER 63 Ca 0.00 0.00 -0.36 0.00 1.01 0.00 0.00 58.87 59.52 2omj n SER 63 Cb 0.61 -0.22 -0.03 0.00 -1.01 0.00 0.00 64.21 63.55 2omj n SER 63 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 2omj s ASN 64 N -2.38 6.61 0.30 6.43 -0.87 -1.26 -4.79 114.94 118.98 2omj s ASN 64 Ca 0.00 2.08 0.00 0.00 -1.57 0.00 0.00 52.86 53.38 2omj s ASN 64 Cb 0.00 -2.59 0.46 0.00 -0.02 0.00 0.00 41.25 39.10 2omj s ASN 64 CO 0.00 -0.59 1.84 -0.74 -2.57 0.00 0.00 177.10 175.04 2omj h HIS 65 N 2.35 0.78 -0.77 2.20 -0.00 -1.90 -2.70 115.15 115.10 2omj h HIS 65 Ca -0.49 -0.07 0.09 0.00 -0.00 0.00 0.00 60.37 59.91 2omj h HIS 65 Cb 1.22 -0.23 -0.07 0.00 -0.00 0.00 0.00 27.41 28.33 2omj h HIS 65 CO 0.57 0.67 0.42 -0.07 -0.00 0.00 0.00 177.93 179.52 2omj h LEU 66 N 0.73 0.59 -0.52 0.26 3.38 -1.98 0.34 115.31 118.11 2omj h LEU 66 Ca 0.16 0.05 -0.01 0.00 0.09 0.00 0.00 57.88 58.17 2omj h LEU 66 Cb 0.29 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 40.96 2omj h LEU 66 CO -0.00 0.34 0.27 -0.33 0.09 0.00 0.00 178.44 178.81 2omj h GLU 67 N 0.71 0.74 -0.25 1.13 5.08 -1.88 0.35 114.58 120.46 2omj h GLU 67 Ca 0.37 -0.10 -0.02 0.00 -1.00 0.00 0.00 59.36 58.62 2omj h GLU 67 Cb 0.35 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.45 2omj h GLU 67 CO -0.25 0.59 0.09 0.28 -1.00 0.00 0.00 179.01 178.71 2omj h VAL 68 N 0.70 1.19 -0.55 3.13 2.07 -1.15 0.35 116.25 121.99 2omj h VAL 68 Ca 0.18 -0.59 0.00 0.00 0.82 0.00 0.00 66.70 67.12 2omj h VAL 68 Cb 0.08 1.11 -0.03 0.00 -1.52 0.00 0.00 31.29 30.92 2omj h VAL 68 CO -0.03 0.19 0.36 0.58 0.02 0.00 0.00 177.57 178.70 2omj h VAL 69 N 0.24 1.14 -0.54 2.57 2.07 -0.08 0.28 116.25 121.94 2omj h VAL 69 Ca 0.08 -0.27 -0.09 0.00 0.82 0.00 0.00 66.70 67.25 2omj h VAL 69 Cb 0.22 0.33 -0.02 0.00 -1.52 0.00 0.00 31.29 30.30 2omj h VAL 69 CO -0.00 0.14 -0.01 0.11 0.02 0.00 0.00 177.57 177.82 2omj h LYS 70 N 0.75 0.93 -0.16 1.57 1.57 -0.08 0.43 116.57 121.59 2omj h LYS 70 Ca 0.20 -0.28 -0.02 0.00 -1.87 0.00 0.00 60.65 58.68 2omj h LYS 70 Cb -0.08 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.13 2omj h LYS 70 CO -0.04 0.93 0.02 1.25 -0.57 0.00 0.00 179.45 181.04 2omj h LEU 71 N 0.86 0.25 -0.38 2.94 5.85 0.36 0.55 115.31 125.74 2omj h LEU 71 Ca 0.16 -0.26 -0.10 0.00 0.84 0.00 0.00 57.88 58.52 2omj h LEU 71 Cb 0.52 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.48 2omj h LEU 71 CO 0.03 0.45 -0.15 0.40 -0.34 0.00 0.00 178.44 178.82 2omj h ILE 72 N 0.04 1.28 0.00 4.05 2.04 -0.33 -2.74 117.51 121.85 2omj h ILE 72 Ca 0.05 -1.27 0.00 0.00 1.00 0.00 0.00 64.86 64.64 2omj h ILE 72 Cb 0.30 1.30 0.00 0.00 -0.74 0.00 0.00 36.82 37.68 2omj h ILE 72 CO 0.00 0.42 0.00 1.17 0.00 0.00 0.00 178.15 179.74 2omj n LYS 73 N -4.30 0.24 -0.20 2.37 4.81 0.15 -3.46 118.16 117.76 2omj n LYS 73 Ca -0.02 0.33 0.31 0.00 -0.87 0.00 0.00 58.31 58.06 2omj n LYS 73 Cb 0.39 -1.86 0.71 0.00 0.02 0.00 0.00 35.03 34.30 2omj n LYS 73 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 2omj h SER 74 N 0.00 0.00 -4.82 3.14 4.64 0.44 -3.40 113.55 113.55 2omj h SER 74 Ca 0.00 0.00 -0.25 0.00 -0.47 0.00 0.00 61.79 61.07 2omj h SER 74 Cb 0.55 0.00 -0.21 0.00 -0.31 0.00 0.00 62.40 62.42 2omj h SER 74 CO 0.00 0.00 -0.73 -0.83 -0.87 0.00 0.00 176.83 174.40 2omj s GLY 75 N -3.86 0.44 0.04 -0.77 0.00 -1.22 -5.06 107.32 96.89 2omj s GLY 75 Ca -0.04 -0.72 -0.25 0.00 0.00 0.00 0.00 44.72 43.70 2omj s GLY 75 CO 0.69 -0.78 1.50 1.48 0.00 0.00 0.00 173.10 175.99 2omj h SER 76 N 4.53 -0.11 -3.59 1.64 4.64 -1.87 -3.40 113.55 115.39 2omj h SER 76 Ca -0.35 -0.18 -0.67 0.00 -0.47 0.00 0.00 61.79 60.12 2omj h SER 76 Cb 1.20 0.03 -0.17 0.00 -0.31 0.00 0.00 62.40 63.15 2omj h SER 76 CO 0.41 0.12 -0.16 -0.31 -0.87 0.00 0.00 176.83 176.01 2omj s TYR 77 N -5.31 3.17 -0.06 4.77 2.02 -1.26 -1.98 117.35 118.70 2omj s TYR 77 Ca -0.14 -0.12 0.02 0.00 -0.37 0.00 0.00 57.07 56.45 2omj s TYR 77 Cb 0.04 -2.88 0.02 0.00 -0.40 0.00 0.00 41.96 38.73 2omj s TYR 77 CO 0.64 -0.60 -0.09 0.08 -1.57 0.00 0.00 175.55 174.01 2omj s VAL 78 N 2.23 0.87 -0.40 0.71 1.01 -0.97 -5.01 120.40 118.84 2omj s VAL 78 Ca 0.14 -0.31 -0.05 0.00 0.00 0.00 0.00 61.98 61.76 2omj s VAL 78 Cb -0.16 -0.83 0.09 0.00 0.00 0.00 0.00 36.38 35.48 2omj s VAL 78 CO 0.13 0.30 0.19 0.00 0.00 0.00 0.00 175.10 175.73 2omj s ALA 79 N 0.81 3.15 -0.16 5.51 0.00 -1.26 -0.37 121.76 129.44 2omj s ALA 79 Ca -0.12 -2.27 -0.03 0.00 0.00 0.00 0.00 51.96 49.54 2omj s ALA 79 Cb -0.15 -2.43 -0.02 0.00 0.00 0.00 0.00 23.12 20.52 2omj s ALA 79 CO 0.02 -1.66 -0.05 -0.51 0.00 0.00 0.00 175.76 173.56 2omj s LEU 80 N 1.27 3.14 -0.18 0.00 1.02 -1.17 -0.42 118.68 122.33 2omj s LEU 80 Ca 0.04 -0.19 -0.29 0.00 0.02 0.00 0.00 54.13 53.71 2omj s LEU 80 Cb -0.22 -1.75 0.00 0.00 0.02 0.00 0.00 46.19 44.23 2omj s LEU 80 CO -0.01 0.15 1.04 -0.89 0.02 0.00 0.00 176.35 176.65 2omj s THR 81 N 0.50 4.69 0.44 5.49 2.01 0.80 -3.50 115.64 126.06 2omj s THR 81 Ca -0.04 2.01 0.07 0.00 0.31 0.00 0.00 61.69 64.03 2omj s THR 81 Cb -0.15 -4.29 -0.03 0.00 0.01 0.00 0.00 72.50 68.04 2omj s THR 81 CO 0.03 -0.12 0.24 0.68 -0.69 0.00 0.00 174.62 174.76 2omj s VAL 82 N 2.81 2.16 -0.03 3.82 -7.23 -0.75 0.65 120.40 121.83 2omj s VAL 82 Ca 0.46 -1.63 -0.02 0.00 -1.81 0.00 0.00 61.98 58.98 2omj s VAL 82 Cb -0.16 -2.79 0.01 0.00 0.56 0.00 0.00 36.38 34.00 2omj s VAL 82 CO 0.10 0.00 0.07 -1.58 -0.31 0.00 0.00 175.10 173.39 2omj s GLN 83 N -4.00 0.07 -0.42 4.82 0.74 0.27 -2.56 119.66 118.58 2omj s GLN 83 Ca 0.38 0.14 -0.09 0.00 0.05 0.00 0.00 55.36 55.84 2omj s GLN 83 Cb 0.02 -0.01 0.08 0.00 1.10 0.00 0.00 33.01 34.20 2omj s GLN 83 CO 0.22 -0.04 0.26 0.20 -0.55 0.00 0.00 175.29 175.37 2omj s GLY 84 N 0.27 1.97 -0.36 2.59 0.00 -1.17 -1.99 107.32 108.64 2omj s GLY 84 Ca -0.02 -2.20 0.03 0.00 0.00 0.00 0.00 44.72 42.53 2omj s GLY 84 CO -0.01 0.98 0.40 -1.60 0.00 0.00 0.00 173.10 172.88 2omj s ARG 85 N 1.40 0.62 0.22 2.90 6.06 -1.26 -4.55 118.95 124.34 2omj s ARG 85 Ca 0.03 -0.67 -0.07 0.00 -2.50 0.00 0.00 55.73 52.52 2omj s ARG 85 Cb -0.23 -0.59 0.35 0.00 0.06 0.00 0.00 34.95 34.53 2omj s ARG 85 CO 0.01 -1.17 1.74 -1.35 -2.50 0.00 0.00 175.30 172.04 2omj h PRO 86 N 7.22 0.43 0.00 5.12 0.11 -1.95 -3.43 132.00 139.50 2omj h PRO 86 Ca 0.03 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.11 2omj h PRO 86 Cb 1.08 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.09 2omj h PRO 86 CO 0.20 0.29 0.00 -2.30 -0.21 0.00 0.00 178.00 175.98 2omj n PRO 87 N -4.98 0.93 -2.35 1.05 -0.02 -1.26 -4.97 135.00 123.40 2omj n PRO 87 Ca 0.11 0.00 -0.26 0.00 -2.02 0.00 0.00 63.50 61.33 2omj n PRO 87 Cb 0.32 0.00 0.01 0.00 -0.02 0.00 0.00 33.50 33.81 2omj n PRO 87 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2omj n GLY 88 N 0.96 6.01 3.98 -1.23 0.00 -1.26 -5.22 105.19 108.42 2omj n GLY 88 Ca 0.00 -2.70 0.00 0.00 0.00 0.00 0.00 46.02 43.32 2omj n GLY 88 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18