#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 4.92 -0.03 1.61 0.15 -1.26 -5.07 113.70 114.03 2omj s SER 2 Ca 0.00 -0.80 0.00 0.00 0.70 0.00 0.00 55.95 55.85 2omj s SER 2 Cb 0.00 0.32 -0.02 0.00 -1.71 0.00 0.00 66.02 64.62 2omj s SER 2 CO 0.00 -1.48 -0.02 1.41 1.20 0.00 0.00 173.24 174.35 2omj n HIS 3 N -2.38 0.00 -2.76 3.44 8.25 -1.26 -5.10 115.22 115.41 2omj n HIS 3 Ca 0.16 0.00 -0.06 0.00 -0.26 0.00 0.00 57.72 57.56 2omj n HIS 3 Cb 0.62 -0.10 0.01 0.00 1.12 0.00 0.00 29.99 31.63 2omj n HIS 3 CO 0.00 0.00 0.00 -1.33 0.64 0.00 0.00 176.34 175.65 2omj n MET 4 N -2.62 -2.55 0.00 -0.41 0.00 -1.26 -5.05 117.12 105.24 2omj n MET 4 Ca -0.05 2.21 0.00 0.00 0.00 0.00 0.00 57.70 59.87 2omj n MET 4 Cb 0.55 -5.45 0.00 0.00 0.00 0.00 0.00 33.22 28.32 2omj n MET 4 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 2omj n GLY 5 N -0.08 -0.00 3.11 3.03 0.00 -1.26 -5.09 105.19 104.90 2omj n GLY 5 Ca 0.09 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.13 2omj n GLY 5 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2omj s LEU 6 N -0.47 -1.20 -0.11 0.99 2.96 -1.26 -5.14 118.68 114.46 2omj s LEU 6 Ca 0.00 -0.28 -0.01 0.00 -0.22 0.00 0.00 54.13 53.61 2omj s LEU 6 Cb 0.00 1.62 0.03 0.00 0.50 0.00 0.00 46.19 48.34 2omj s LEU 6 CO 0.00 -0.17 -0.02 0.68 -1.32 0.00 0.00 176.35 175.52 2omj s VAL 7 N 2.30 0.63 0.20 1.68 -7.23 -1.26 -5.14 120.40 111.58 2omj s VAL 7 Ca 0.16 -0.15 0.11 0.00 -1.81 0.00 0.00 61.98 60.28 2omj s VAL 7 Cb -0.04 -0.81 -0.04 0.00 0.56 0.00 0.00 36.38 36.04 2omj s VAL 7 CO -0.16 0.21 -0.22 0.00 -0.31 0.00 0.00 175.10 174.62 2omj s GLN 8 N 1.86 1.60 -0.01 4.82 -2.07 -1.26 -2.91 119.66 121.68 2omj s GLN 8 Ca 0.04 -1.51 0.00 0.00 -1.82 0.00 0.00 55.36 52.07 2omj s GLN 8 Cb -0.13 -1.88 0.01 0.00 -1.09 0.00 0.00 33.01 29.92 2omj s GLN 8 CO -0.07 0.40 0.00 -0.98 -1.32 0.00 0.00 175.29 173.33 2omj s ARG 9 N -2.76 0.09 0.04 9.60 1.70 -0.78 -5.01 118.95 121.84 2omj s ARG 9 Ca 0.22 0.05 -0.23 0.00 -0.47 0.00 0.00 55.73 55.30 2omj s ARG 9 Cb -0.08 -0.22 -0.06 0.00 -0.57 0.00 0.00 34.95 34.03 2omj s ARG 9 CO 0.11 -0.07 0.70 0.00 -1.08 0.00 0.00 175.30 174.96 2omj s VAL 11 N -0.22 0.69 -0.24 0.00 -7.23 -1.21 -5.02 120.40 107.17 2omj s VAL 11 Ca 0.35 -0.53 0.01 0.00 -1.81 0.00 0.00 61.98 60.00 2omj s VAL 11 Cb -0.20 -0.61 0.04 0.00 0.56 0.00 0.00 36.38 36.17 2omj s VAL 11 CO 0.21 0.08 -0.11 -0.63 -0.31 0.00 0.00 175.10 174.34 2omj s ILE 12 N -0.44 2.42 -0.03 -0.62 1.01 -1.26 -2.59 121.20 119.69 2omj s ILE 12 Ca 0.01 -1.27 -0.01 0.00 0.00 0.00 0.00 60.65 59.38 2omj s ILE 12 Cb -0.05 -2.27 -0.04 0.00 0.01 0.00 0.00 42.46 40.12 2omj s ILE 12 CO 0.00 0.17 0.06 0.27 0.00 0.00 0.00 174.94 175.44 2omj s ILE 13 N 1.22 4.67 -0.04 2.92 -4.36 -1.03 -4.63 121.20 119.95 2omj s ILE 13 Ca -0.03 -0.34 -0.01 0.00 -0.26 0.00 0.00 60.65 60.02 2omj s ILE 13 Cb -0.17 -3.09 -0.04 0.00 1.25 0.00 0.00 42.46 40.41 2omj s ILE 13 CO -0.06 0.42 0.03 -1.10 0.24 0.00 0.00 174.94 174.47 2omj s GLN 14 N -1.50 2.96 0.15 0.37 -0.21 -1.26 -2.29 119.66 117.88 2omj s GLN 14 Ca 0.20 -0.48 -0.27 0.00 0.02 0.00 0.00 55.36 54.83 2omj s GLN 14 Cb -0.12 -2.79 -0.07 0.00 1.00 0.00 0.00 33.01 31.03 2omj s GLN 14 CO 0.11 0.66 0.83 0.21 -2.12 0.00 0.00 175.29 174.98 2omj s LYS 15 N -1.36 4.63 0.00 2.91 2.20 -0.77 -4.83 119.74 122.52 2omj s LYS 15 Ca 0.18 1.25 0.00 0.00 -0.36 0.00 0.00 55.97 57.04 2omj s LYS 15 Cb -0.12 -3.30 0.00 0.00 -1.51 0.00 0.00 37.83 32.91 2omj s LYS 15 CO 0.08 0.46 0.00 -0.25 -0.36 0.00 0.00 175.35 175.29 2omj n ASP 16 N 1.94 0.28 -0.06 1.43 8.00 0.31 -4.91 116.55 123.54 2omj n ASP 16 Ca -0.03 -0.89 0.07 0.00 0.71 0.00 0.00 54.79 54.64 2omj n ASP 16 Cb 0.49 0.00 0.43 0.00 -0.02 0.00 0.00 41.12 42.01 2omj n ASP 16 CO 0.00 0.00 0.00 0.44 -0.39 0.00 0.00 177.20 177.25 2omj h ASP 17 N 0.00 0.49 0.16 -2.24 3.32 -2.04 -2.83 116.42 113.27 2omj h ASP 17 Ca 0.00 -0.00 -0.35 0.00 0.02 0.00 0.00 57.03 56.69 2omj h ASP 17 Cb 0.00 -0.11 -0.05 0.00 0.22 0.00 0.00 39.33 39.39 2omj h ASP 17 CO 0.00 0.33 -2.13 0.59 -1.72 0.00 0.00 179.24 176.31 2omj n ASN 18 N -4.47 1.34 0.00 6.45 4.13 -1.26 -5.09 115.26 116.35 2omj n ASN 18 Ca 0.07 0.13 0.00 0.00 1.68 0.00 0.00 54.58 56.45 2omj n ASN 18 Cb 0.18 -0.16 0.00 0.00 -1.54 0.00 0.00 39.78 38.26 2omj n ASN 18 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2omj n GLY 19 N 1.90 0.65 3.12 7.41 0.00 -1.07 -5.08 105.19 112.13 2omj n GLY 19 Ca -0.32 -0.40 -0.27 0.00 0.00 0.00 0.00 46.02 45.03 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 1.79 0.09 1.61 0.08 -1.26 -0.53 117.98 119.75 2omj s PHE 20 Ca 0.00 -0.59 -0.13 0.00 0.12 0.00 0.00 56.93 56.32 2omj s PHE 20 Cb 0.00 -1.23 -0.20 0.00 -0.57 0.00 0.00 43.02 41.02 2omj s PHE 20 CO 0.00 -0.24 1.24 0.78 -0.10 0.00 0.00 175.22 176.90 2omj h GLY 21 N 6.52 0.82 -3.96 4.36 0.00 -1.97 -3.45 103.07 105.38 2omj h GLY 21 Ca -0.30 -1.32 -0.54 0.00 0.00 0.00 0.00 47.33 45.17 2omj h GLY 21 CO 0.48 1.17 0.77 0.48 0.00 0.00 0.00 176.54 179.43 2omj s LEU 22 N -8.22 4.34 -0.18 3.11 0.05 -1.26 -4.47 118.68 112.05 2omj s LEU 22 Ca -0.10 2.99 -0.08 0.00 0.05 0.00 0.00 54.13 56.99 2omj s LEU 22 Cb 0.08 -3.66 -0.04 0.00 -2.05 0.00 0.00 46.19 40.51 2omj s LEU 22 CO 0.92 -0.83 0.07 -0.89 -0.55 0.00 0.00 176.35 175.07 2omj s THR 23 N -1.03 4.88 -0.01 5.48 2.01 0.34 -4.94 115.64 122.37 2omj s THR 23 Ca 0.53 -0.00 0.08 0.00 0.31 0.00 0.00 61.69 62.60 2omj s THR 23 Cb -0.46 -3.19 -0.02 0.00 0.01 0.00 0.00 72.50 68.84 2omj s THR 23 CO 0.60 0.47 -0.24 0.68 -0.69 0.00 0.00 174.62 175.44 2omj s VAL 24 N 0.26 2.22 -0.14 3.82 -7.23 -1.26 -1.43 120.40 116.64 2omj s VAL 24 Ca 0.04 -1.09 -0.08 0.00 -1.81 0.00 0.00 61.98 59.04 2omj s VAL 24 Cb -0.12 -1.80 0.05 0.00 0.56 0.00 0.00 36.38 35.07 2omj s VAL 24 CO 0.00 0.55 0.35 -0.44 -0.31 0.00 0.00 175.10 175.24 2omj s SER 25 N -0.73 -0.41 -0.30 4.85 0.01 -1.12 -4.92 113.70 111.08 2omj s SER 25 Ca 0.11 0.74 -0.19 0.00 1.31 0.00 0.00 55.95 57.92 2omj s SER 25 Cb -0.10 0.64 0.18 0.00 0.21 0.00 0.00 66.02 66.95 2omj s SER 25 CO -0.00 -0.17 1.28 -0.83 0.41 0.00 0.00 173.24 173.92 2omj s GLY 26 N 1.13 0.06 0.00 3.44 0.00 -1.26 -4.15 107.32 106.54 2omj s GLY 26 Ca -0.08 3.34 0.00 0.00 0.00 0.00 0.00 44.72 47.99 2omj s GLY 26 CO -0.09 3.86 0.78 1.22 0.00 0.00 0.00 173.10 178.87 2omj n ASP 27 N 5.25 0.00 -0.05 1.64 8.00 -1.26 -4.47 116.55 125.67 2omj n ASP 27 Ca -0.09 0.78 -0.00 0.00 0.71 0.00 0.00 54.79 56.19 2omj n ASP 27 Cb 0.55 -0.28 -0.00 0.00 -0.02 0.00 0.00 41.12 41.37 2omj n ASP 27 CO 0.00 0.00 0.00 0.78 -0.39 0.00 0.00 177.20 177.59 2omj h ASN 28 N 0.00 0.00 -1.80 -2.24 -0.26 -1.99 -3.36 115.58 105.94 2omj h ASN 28 Ca 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.74 2omj h ASN 28 Cb 0.00 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.26 2omj h ASN 28 CO 0.00 0.46 0.00 -0.81 -1.06 0.00 0.00 177.43 176.02 2omj n PRO 29 N -4.52 -0.13 -3.48 0.81 -0.04 -1.26 -4.57 135.00 121.81 2omj n PRO 29 Ca -0.00 0.00 -0.21 0.00 -0.04 0.00 0.00 63.50 63.24 2omj n PRO 29 Cb 0.00 0.00 -0.13 0.00 -0.04 0.00 0.00 33.50 33.34 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 -0.95 -0.26 0.02 0.52 1.01 -1.26 -4.46 120.40 115.02 2omj s VAL 30 Ca 0.00 -0.42 0.01 0.00 0.00 0.00 0.00 61.98 61.56 2omj s VAL 30 Cb 0.00 -0.86 -0.02 0.00 0.00 0.00 0.00 36.38 35.50 2omj s VAL 30 CO 0.00 -0.45 -0.05 0.72 0.00 0.00 0.00 175.10 175.33 2omj s PHE 31 N 2.26 0.39 0.01 5.22 -0.12 -1.26 0.91 117.98 125.39 2omj s PHE 31 Ca 0.08 -0.45 -0.25 0.00 -0.05 0.00 0.00 56.93 56.26 2omj s PHE 31 Cb -0.15 -0.25 -0.05 0.00 -0.63 0.00 0.00 43.02 41.94 2omj s PHE 31 CO -0.26 -0.13 0.77 0.08 -0.05 0.00 0.00 175.22 175.63 2omj s VAL 32 N -1.24 4.84 -0.13 -2.49 1.01 0.20 -2.78 120.40 119.81 2omj s VAL 32 Ca -0.12 1.62 0.06 0.00 0.00 0.00 0.00 61.98 63.54 2omj s VAL 32 Cb -0.09 -4.11 -0.23 0.00 0.00 0.00 0.00 36.38 31.95 2omj s VAL 32 CO -0.00 0.31 0.31 0.00 0.00 0.00 0.00 175.10 175.72 2omj n GLN 33 N 3.21 0.69 -3.91 2.72 10.64 -0.51 0.13 117.38 130.34 2omj n GLN 33 Ca -0.01 0.21 -0.10 0.00 -1.83 0.00 0.00 57.00 55.26 2omj n GLN 33 Cb 0.51 -1.67 -0.10 0.00 -0.86 0.00 0.00 30.24 28.12 2omj n GLN 33 CO 0.00 0.00 0.00 0.45 -1.83 0.00 0.00 177.06 175.68 2omj s SER 34 N -6.35 0.12 -0.02 2.61 0.15 -0.90 -3.64 113.70 105.67 2omj s SER 34 Ca -0.16 -0.39 0.01 0.00 0.70 0.00 0.00 55.95 56.11 2omj s SER 34 Cb 0.07 0.21 0.01 0.00 -1.71 0.00 0.00 66.02 64.60 2omj s SER 34 CO 0.77 -0.43 -0.04 0.68 1.20 0.00 0.00 173.24 175.42 2omj s VAL 35 N -1.97 0.39 -0.12 4.45 -7.23 -1.26 -0.50 120.40 114.15 2omj s VAL 35 Ca -0.10 -0.13 -0.29 0.00 -1.81 0.00 0.00 61.98 59.64 2omj s VAL 35 Cb -0.05 -0.38 -0.07 0.00 0.56 0.00 0.00 36.38 36.44 2omj s VAL 35 CO -0.02 0.15 2.13 1.17 -0.31 0.00 0.00 175.10 178.22 2omj n LYS 36 N 3.46 2.30 -1.25 4.82 3.00 -1.26 -4.85 118.16 124.38 2omj n LYS 36 Ca -0.19 0.73 -0.25 0.00 -0.00 0.00 0.00 58.31 58.60 2omj n LYS 36 Cb 0.55 -3.14 0.01 0.00 0.00 0.00 0.00 35.03 32.45 2omj n LYS 36 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.40 177.79 2omj n GLU 37 N 8.28 2.22 -1.19 1.64 1.02 -1.26 -0.09 120.64 131.27 2omj n GLU 37 Ca 0.26 -2.26 -0.01 0.00 -0.02 0.00 0.00 57.16 55.13 2omj n GLU 37 Cb 0.43 -1.95 0.01 0.00 -0.02 0.00 0.00 31.44 29.90 2omj n GLU 37 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 2omj n ASP 38 N 0.25 -0.18 0.00 1.62 2.03 -1.26 -4.96 116.55 114.04 2omj n ASP 38 Ca 0.44 -0.79 0.00 0.00 0.52 0.00 0.00 54.79 54.96 2omj n ASP 38 Cb 0.55 0.07 0.00 0.00 -0.72 0.00 0.00 41.12 41.03 2omj n ASP 38 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2omj n GLY 39 N -0.13 2.81 0.33 0.27 0.00 -1.25 -5.00 105.19 102.22 2omj n GLY 39 Ca -0.03 -0.36 0.00 0.00 0.00 0.00 0.00 46.02 45.63 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 2.00 1.45 -0.27 4.61 0.00 -1.88 -0.68 119.26 124.49 2omj h ALA 40 Ca 0.00 -0.09 0.01 0.00 0.00 0.00 0.00 54.91 54.83 2omj h ALA 40 Cb 0.00 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.52 2omj h ALA 40 CO 0.00 0.46 0.17 0.00 0.00 0.00 0.00 179.25 179.88 2omj h ALA 41 N 1.53 0.34 0.04 0.00 0.00 -1.91 0.58 119.26 119.84 2omj h ALA 41 Ca 0.22 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.12 2omj h ALA 41 Cb 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.70 2omj h ALA 41 CO -0.04 -0.20 -0.02 1.98 0.00 0.00 0.00 179.25 180.97 2omj h MET 42 N 0.35 -0.05 -0.04 0.00 -1.53 -0.17 -2.00 114.93 111.47 2omj h MET 42 Ca 0.10 0.00 -0.01 0.00 -3.44 0.00 0.00 59.70 56.35 2omj h MET 42 Cb -0.02 0.01 -0.00 0.00 -0.55 0.00 0.00 31.60 31.03 2omj h MET 42 CO -0.03 0.42 -0.04 -0.09 0.14 0.00 0.00 176.91 177.30 2omj h ARG 43 N -0.55 0.06 0.00 0.39 2.43 -1.07 -0.67 114.38 114.97 2omj h ARG 43 Ca -0.01 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.16 2omj h ARG 43 Cb 0.50 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.04 2omj h ARG 43 CO 0.01 0.11 0.00 0.00 -1.51 0.00 0.00 179.97 178.58 2omj h ALA 44 N 1.90 1.00 0.00 2.80 0.00 0.23 -3.46 119.26 121.72 2omj h ALA 44 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.92 2omj h ALA 44 Cb 0.12 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.91 2omj h ALA 44 CO 0.01 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.67 2omj n GLY 45 N 0.17 0.68 3.85 0.00 0.00 -0.26 -4.31 105.19 105.33 2omj n GLY 45 Ca 0.02 -0.73 -0.32 0.00 0.00 0.00 0.00 46.02 45.00 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 -2.00 4.66 0.04 1.61 1.01 -0.76 -5.02 120.40 119.94 2omj s VAL 46 Ca 0.00 0.96 0.06 0.00 0.00 0.00 0.00 61.98 63.00 2omj s VAL 46 Cb 0.00 -3.64 -0.02 0.00 0.00 0.00 0.00 36.38 32.72 2omj s VAL 46 CO 0.00 -0.31 -0.17 0.00 0.00 0.00 0.00 175.10 174.62 2omj s GLN 47 N -3.27 1.13 0.14 2.72 -2.07 -1.26 -4.77 119.66 112.28 2omj s GLN 47 Ca 0.55 -0.83 -0.31 0.00 -1.82 0.00 0.00 55.36 52.95 2omj s GLN 47 Cb -0.10 -1.19 -0.08 0.00 -1.09 0.00 0.00 33.01 30.55 2omj s GLN 47 CO 0.21 0.30 1.36 -0.08 -1.32 0.00 0.00 175.29 175.76 2omj s THR 48 N -0.81 3.27 0.00 3.63 -1.32 -1.26 -2.99 115.64 116.17 2omj s THR 48 Ca 0.04 0.95 0.00 0.00 -1.21 0.00 0.00 61.69 61.48 2omj s THR 48 Cb -0.08 -3.61 0.00 0.00 -1.51 0.00 0.00 72.50 67.30 2omj s THR 48 CO 0.01 0.10 0.00 0.61 -2.21 0.00 0.00 174.62 173.13 2omj n GLY 49 N 3.12 0.53 3.89 6.08 0.00 0.34 -4.96 105.19 114.19 2omj n GLY 49 Ca 0.10 -0.80 -0.32 0.00 0.00 0.00 0.00 46.02 44.99 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 -2.91 6.55 -0.01 1.61 2.15 -0.82 -4.84 116.67 118.40 2omj s ASP 50 Ca 0.00 0.72 -0.09 0.00 0.43 0.00 0.00 52.55 53.61 2omj s ASP 50 Cb 0.00 -2.15 -0.05 0.00 -0.30 0.00 0.00 42.92 40.42 2omj s ASP 50 CO 0.00 0.03 0.30 -0.13 -0.17 0.00 0.00 175.17 175.19 2omj s ARG 51 N -2.61 3.67 -0.20 4.34 0.52 -0.97 0.61 118.95 124.31 2omj s ARG 51 Ca 0.42 0.08 -0.06 0.00 -0.52 0.00 0.00 55.73 55.65 2omj s ARG 51 Cb -0.12 -3.13 -0.03 0.00 0.52 0.00 0.00 34.95 32.19 2omj s ARG 51 CO 0.23 0.67 0.03 0.42 0.02 0.00 0.00 175.30 176.67 2omj s ILE 52 N -1.20 4.25 -0.22 1.52 1.01 0.26 0.12 121.20 126.94 2omj s ILE 52 Ca 0.25 -0.21 -0.18 0.00 0.00 0.00 0.00 60.65 60.50 2omj s ILE 52 Cb -0.14 -2.93 -0.18 0.00 0.01 0.00 0.00 42.46 39.22 2omj s ILE 52 CO 0.13 0.42 0.08 -0.38 0.00 0.00 0.00 174.94 175.20 2omj n ILE 53 N 4.14 1.55 -3.72 2.92 5.41 0.30 -4.55 119.36 125.40 2omj n ILE 53 Ca -0.17 -0.16 -0.11 0.00 1.00 0.00 0.00 62.75 63.31 2omj n ILE 53 Cb 0.52 -1.97 -0.06 0.00 -0.71 0.00 0.00 39.64 37.41 2omj n ILE 53 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 176.55 174.96 2omj s LYS 54 N -2.41 0.91 -0.18 0.38 -2.85 -0.97 -4.70 119.74 109.92 2omj s LYS 54 Ca -0.31 -0.61 -0.00 0.00 -1.00 0.00 0.00 55.97 54.05 2omj s LYS 54 Cb 0.08 0.39 0.04 0.00 -2.06 0.00 0.00 37.83 36.29 2omj s LYS 54 CO 0.58 -0.31 -0.05 0.08 0.10 0.00 0.00 175.35 175.74 2omj s VAL 55 N -3.09 1.19 -1.17 1.79 1.01 0.18 0.70 120.40 121.01 2omj s VAL 55 Ca -0.01 -0.73 -0.02 0.00 0.00 0.00 0.00 61.98 61.21 2omj s VAL 55 Cb 0.01 -1.38 -0.02 0.00 0.00 0.00 0.00 36.38 34.99 2omj s VAL 55 CO -0.07 0.09 0.93 0.59 0.00 0.00 0.00 175.10 176.64 2omj n ASN 56 N 4.84 -3.33 -2.20 3.32 3.02 -0.12 -1.96 115.26 118.83 2omj n ASN 56 Ca -0.12 -0.68 -0.19 0.00 -0.03 0.00 0.00 54.58 53.55 2omj n ASN 56 Cb 0.47 -4.96 -0.03 0.00 -0.61 0.00 0.00 39.78 34.66 2omj n ASN 56 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2omj n GLY 57 N -1.23 0.06 3.44 7.41 0.00 -1.26 -4.95 105.19 108.65 2omj n GLY 57 Ca -0.22 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.71 2omj n GLY 57 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2omj s THR 58 N -2.87 -0.10 0.07 2.61 -4.23 -0.83 -5.16 115.64 105.13 2omj s THR 58 Ca 0.00 0.06 -0.01 0.00 -1.18 0.00 0.00 61.69 60.56 2omj s THR 58 Cb 0.00 -0.79 0.02 0.00 1.34 0.00 0.00 72.50 73.07 2omj s THR 58 CO 0.00 0.02 0.04 0.18 -0.54 0.00 0.00 174.62 174.32 2omj n LEU 59 N 4.42 0.00 -2.19 4.79 4.32 -1.26 0.51 117.00 127.58 2omj n LEU 59 Ca -0.20 -0.04 -0.27 0.00 -0.02 0.00 0.00 56.01 55.48 2omj n LEU 59 Cb 0.56 -0.05 0.12 0.00 -1.62 0.00 0.00 43.42 42.44 2omj n LEU 59 CO 0.03 -1.55 1.32 1.33 -1.22 0.00 0.00 177.39 177.30 2omj n VAL 60 N -3.10 3.25 0.00 4.08 0.24 -1.26 -4.49 118.33 117.05 2omj n VAL 60 Ca 0.01 -2.21 0.00 0.00 -2.04 0.00 0.00 64.34 60.10 2omj n VAL 60 Cb 0.03 -0.81 0.00 0.00 -1.47 0.00 0.00 33.84 31.58 2omj n VAL 60 CO 0.00 0.00 0.00 0.41 -2.14 0.00 0.00 176.83 175.10 2omj n THR 61 N -0.89 0.00 0.02 3.34 -1.04 -1.26 -4.05 114.28 110.39 2omj n THR 61 Ca 0.57 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.58 2omj n THR 61 Cb 1.17 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.68 2omj n THR 61 CO 0.00 0.00 0.00 1.57 -0.64 0.00 0.00 175.07 176.00 2omj n HIS 62 N 0.00 -1.49 -3.21 -1.42 -0.00 -1.26 -5.17 115.22 102.67 2omj n HIS 62 Ca 0.00 0.12 0.00 0.00 0.46 0.00 0.00 57.72 58.30 2omj n HIS 62 Cb 0.00 0.53 0.00 0.00 -0.12 0.00 0.00 29.99 30.40 2omj n HIS 62 CO 0.00 0.00 0.00 0.43 0.46 0.00 0.00 176.34 177.23 2omj n SER 63 N -2.29 0.00 -1.62 0.26 7.64 -1.26 -4.70 113.62 111.65 2omj n SER 63 Ca 0.00 -0.32 0.00 0.00 1.01 0.00 0.00 58.87 59.56 2omj n SER 63 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 2omj n SER 63 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 2omj n ASN 64 N -0.88 -5.84 -0.06 6.43 3.02 -1.26 -4.68 115.26 112.00 2omj n ASN 64 Ca 0.00 0.91 -0.04 0.00 -0.03 0.00 0.00 54.58 55.42 2omj n ASN 64 Cb 0.00 -3.15 0.19 0.00 -0.61 0.00 0.00 39.78 36.20 2omj n ASN 64 CO 0.00 0.00 0.00 -0.74 -2.62 0.00 0.00 177.26 173.90 2omj h HIS 65 N 2.19 0.73 -0.91 3.10 2.76 -1.87 -2.78 115.15 118.37 2omj h HIS 65 Ca 0.00 -0.11 0.11 0.00 -2.20 0.00 0.00 60.37 58.17 2omj h HIS 65 Cb 0.00 -0.20 -0.08 0.00 1.55 0.00 0.00 27.41 28.68 2omj h HIS 65 CO 0.00 0.73 0.55 -0.07 -1.30 0.00 0.00 177.93 177.84 2omj h LEU 66 N 0.63 0.79 -0.57 0.26 4.07 -1.98 0.38 115.31 118.89 2omj h LEU 66 Ca 0.12 0.05 -0.04 0.00 0.08 0.00 0.00 57.88 58.08 2omj h LEU 66 Cb 0.49 -0.11 -0.02 0.00 1.08 0.00 0.00 40.66 42.10 2omj h LEU 66 CO 0.03 0.43 0.18 -0.08 -1.08 0.00 0.00 178.44 177.93 2omj h GLU 67 N 0.89 0.89 -0.26 1.13 4.81 -1.77 0.36 114.58 120.63 2omj h GLU 67 Ca 0.45 -0.19 -0.02 0.00 -0.13 0.00 0.00 59.36 59.47 2omj h GLU 67 Cb 0.43 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.67 2omj h GLU 67 CO -0.26 0.80 0.08 0.28 -0.73 0.00 0.00 179.01 179.18 2omj h VAL 68 N 0.80 1.19 -0.47 0.32 2.07 -0.99 0.36 116.25 119.54 2omj h VAL 68 Ca 0.19 -0.61 -0.03 0.00 0.82 0.00 0.00 66.70 67.07 2omj h VAL 68 Cb 0.27 1.11 -0.02 0.00 -1.52 0.00 0.00 31.29 31.14 2omj h VAL 68 CO -0.01 0.20 0.19 0.58 0.02 0.00 0.00 177.57 178.55 2omj h VAL 69 N 0.25 1.21 -0.54 2.57 2.07 -0.10 0.31 116.25 122.02 2omj h VAL 69 Ca 0.08 -0.64 -0.09 0.00 0.82 0.00 0.00 66.70 66.88 2omj h VAL 69 Cb 0.23 0.75 -0.02 0.00 -1.52 0.00 0.00 31.29 30.72 2omj h VAL 69 CO -0.00 0.24 -0.01 0.11 0.02 0.00 0.00 177.57 177.93 2omj h LYS 70 N 0.62 0.93 -0.21 1.57 1.57 -0.13 0.41 116.57 121.34 2omj h LYS 70 Ca 0.16 -0.28 -0.07 0.00 -1.87 0.00 0.00 60.65 58.59 2omj h LYS 70 Cb 0.19 -0.09 -0.00 0.00 0.08 0.00 0.00 32.23 32.40 2omj h LYS 70 CO -0.01 0.92 -0.14 1.25 -0.57 0.00 0.00 179.45 180.90 2omj h LEU 71 N 0.85 0.49 -0.66 2.94 6.46 0.06 0.25 115.31 125.70 2omj h LEU 71 Ca 0.16 -0.44 -0.14 0.00 -0.12 0.00 0.00 57.88 57.34 2omj h LEU 71 Cb 0.52 -0.14 -0.01 0.00 -0.73 0.00 0.00 40.66 40.30 2omj h LEU 71 CO 0.03 0.82 -0.42 0.40 -0.62 0.00 0.00 178.44 178.65 2omj h ILE 72 N 0.15 1.30 0.00 4.05 2.04 -0.27 -2.94 117.51 121.85 2omj h ILE 72 Ca 0.04 -1.60 -0.13 0.00 1.00 0.00 0.00 64.86 64.18 2omj h ILE 72 Cb 0.66 1.58 -0.02 0.00 -0.74 0.00 0.00 36.82 38.30 2omj h ILE 72 CO 0.04 0.50 -0.60 0.11 0.00 0.00 0.00 178.15 178.20 2omj h LYS 73 N 0.46 0.00 -5.27 2.37 1.57 -0.12 -3.40 116.57 112.17 2omj h LYS 73 Ca 0.04 0.00 -0.16 0.00 -1.87 0.00 0.00 60.65 58.66 2omj h LYS 73 Cb 0.93 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.22 2omj h LYS 73 CO 0.08 0.60 0.51 -1.12 -0.57 0.00 0.00 179.45 178.95 2omj s SER 74 N -6.77 4.13 0.00 0.86 0.01 0.07 -4.59 113.70 107.42 2omj s SER 74 Ca -0.01 -1.29 0.00 0.00 1.31 0.00 0.00 55.95 55.96 2omj s SER 74 Cb 0.12 -2.59 0.00 0.00 0.21 0.00 0.00 66.02 63.76 2omj s SER 74 CO 0.75 -4.03 0.00 0.61 0.41 0.00 0.00 173.24 170.99 2omj n GLY 75 N 5.99 3.94 0.17 3.44 0.00 -1.26 -4.99 105.19 112.48 2omj n GLY 75 Ca 0.43 -1.44 -0.12 0.00 0.00 0.00 0.00 46.02 44.89 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 -0.28 -3.82 1.61 4.64 -1.90 -3.43 113.55 110.37 2omj h SER 76 Ca 0.00 -0.25 -0.64 0.00 -0.47 0.00 0.00 61.79 60.44 2omj h SER 76 Cb 0.00 0.07 -0.16 0.00 -0.31 0.00 0.00 62.40 62.00 2omj h SER 76 CO 0.00 0.16 -0.40 -0.31 -0.87 0.00 0.00 176.83 175.41 2omj s TYR 77 N -4.16 3.23 -0.19 4.77 1.51 -1.26 -1.85 117.35 119.40 2omj s TYR 77 Ca -0.14 0.22 0.01 0.00 -1.01 0.00 0.00 57.07 56.15 2omj s TYR 77 Cb 0.01 -2.46 0.04 0.00 -0.11 0.00 0.00 41.96 39.44 2omj s TYR 77 CO 0.52 -0.20 -0.10 0.54 -1.11 0.00 0.00 175.55 175.20 2omj s VAL 78 N 1.88 1.58 -0.42 0.71 0.11 -0.97 -5.01 120.40 118.29 2omj s VAL 78 Ca 0.10 -0.92 -0.10 0.00 -2.93 0.00 0.00 61.98 58.13 2omj s VAL 78 Cb -0.16 -1.64 0.07 0.00 -1.53 0.00 0.00 36.38 33.12 2omj s VAL 78 CO 0.11 0.20 0.27 0.00 -3.33 0.00 0.00 175.10 172.35 2omj s ALA 79 N 1.43 3.31 -0.06 1.54 0.00 -1.26 -2.47 121.76 124.25 2omj s ALA 79 Ca -0.00 -2.11 0.02 0.00 0.00 0.00 0.00 51.96 49.87 2omj s ALA 79 Cb -0.16 -2.69 -0.03 0.00 0.00 0.00 0.00 23.12 20.25 2omj s ALA 79 CO -0.08 -1.63 -0.10 -0.48 0.00 0.00 0.00 175.76 173.46 2omj s LEU 80 N 1.46 2.98 -0.22 0.00 2.34 -1.07 -0.95 118.68 123.22 2omj s LEU 80 Ca 0.03 -0.10 -0.25 0.00 0.06 0.00 0.00 54.13 53.88 2omj s LEU 80 Cb -0.23 -1.63 -0.01 0.00 -0.56 0.00 0.00 46.19 43.76 2omj s LEU 80 CO 0.03 0.35 0.82 -0.89 -1.06 0.00 0.00 176.35 175.61 2omj s THR 81 N -0.77 4.85 0.48 5.48 2.01 0.22 -3.31 115.64 124.61 2omj s THR 81 Ca 0.12 1.57 0.05 0.00 0.31 0.00 0.00 61.69 63.74 2omj s THR 81 Cb -0.11 -4.12 -0.01 0.00 0.01 0.00 0.00 72.50 68.27 2omj s THR 81 CO 0.01 -0.04 0.20 0.68 -0.69 0.00 0.00 174.62 174.78 2omj s VAL 82 N 2.62 1.75 0.03 3.82 -7.23 -1.09 0.11 120.40 120.40 2omj s VAL 82 Ca 0.35 -1.73 0.01 0.00 -1.81 0.00 0.00 61.98 58.81 2omj s VAL 82 Cb -0.16 -2.47 -0.02 0.00 0.56 0.00 0.00 36.38 34.29 2omj s VAL 82 CO 0.09 0.00 -0.05 -1.58 -0.31 0.00 0.00 175.10 173.25 2omj s GLN 83 N -4.01 0.41 0.00 4.82 0.74 0.12 -1.87 119.66 119.87 2omj s GLN 83 Ca 0.28 -0.69 0.00 0.00 0.05 0.00 0.00 55.36 55.00 2omj s GLN 83 Cb 0.01 -0.05 0.00 0.00 1.10 0.00 0.00 33.01 34.08 2omj s GLN 83 CO 0.16 -0.01 0.00 0.41 -0.55 0.00 0.00 175.29 175.30 2omj n GLY 84 N 1.49 2.06 3.30 2.59 0.00 -1.15 -2.28 105.19 111.19 2omj n GLY 84 Ca -0.23 0.08 -0.33 0.00 0.00 0.00 0.00 46.02 45.54 2omj n GLY 84 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2omj s ARG 85 N -0.63 3.27 -0.43 1.61 6.06 -1.26 -4.84 118.95 122.73 2omj s ARG 85 Ca 0.00 -0.74 -0.32 0.00 -2.50 0.00 0.00 55.73 52.17 2omj s ARG 85 Cb 0.00 -2.59 -0.11 0.00 0.06 0.00 0.00 34.95 32.31 2omj s ARG 85 CO 0.00 0.12 2.29 -2.30 -2.50 0.00 0.00 175.30 172.91 2omj n PRO 86 N 3.76 1.06 0.05 5.12 -0.02 -1.26 -4.87 135.00 138.85 2omj n PRO 86 Ca -0.19 0.24 -0.14 0.00 -2.02 0.00 0.00 63.50 61.39 2omj n PRO 86 Cb 0.52 -2.63 -0.09 0.00 -0.02 0.00 0.00 33.50 31.29 2omj n PRO 86 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 2omj h PRO 87 N 13.98 -0.57 -0.42 0.52 0.11 -2.03 -3.47 132.00 140.11 2omj h PRO 87 Ca -0.26 0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.89 2omj h PRO 87 Cb 1.30 0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.54 2omj h PRO 87 CO 1.08 -0.38 0.00 0.41 -0.21 0.00 0.00 178.00 178.90 2omj n GLY 88 N -1.40 0.67 3.95 -0.55 0.00 -1.26 -4.57 105.19 102.03 2omj n GLY 88 Ca -0.06 -0.76 0.00 0.00 0.00 0.00 0.00 46.02 45.19 2omj n GLY 88 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76