#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 -6.05 0.00 1.61 7.64 -1.26 -4.85 113.62 110.71 2omj n SER 2 Ca 0.00 -0.21 0.00 0.00 1.01 0.00 0.00 58.87 59.67 2omj n SER 2 Cb 0.00 -4.92 0.00 0.00 -1.01 0.00 0.00 64.21 58.28 2omj n SER 2 CO 0.00 0.00 0.00 1.57 -3.01 0.00 0.00 175.04 173.60 2omj n HIS 3 N -4.37 0.00 -0.06 1.43 -0.00 -1.26 -4.92 115.22 106.04 2omj n HIS 3 Ca -0.15 0.00 -0.04 0.00 -0.00 0.00 0.00 57.72 57.53 2omj n HIS 3 Cb 0.64 0.01 -0.01 0.00 -0.00 0.00 0.00 29.99 30.63 2omj n HIS 3 CO 0.00 0.00 0.00 -1.33 -0.00 0.00 0.00 176.34 175.01 2omj n MET 4 N -2.57 0.38 0.00 1.57 2.00 -1.26 -5.06 117.12 112.17 2omj n MET 4 Ca 0.00 0.45 0.00 0.00 0.00 0.00 0.00 57.70 58.15 2omj n MET 4 Cb 0.45 -1.50 0.00 0.00 0.00 0.00 0.00 33.22 32.17 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 1.63 -0.45 2.67 3.03 0.00 -1.26 -5.09 105.19 105.72 2omj n GLY 5 Ca -0.06 -0.02 -0.09 0.00 0.00 0.00 0.00 46.02 45.84 2omj n GLY 5 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2omj n LEU 6 N 0.00 1.90 -4.35 0.99 7.94 -1.26 -5.03 117.00 117.19 2omj n LEU 6 Ca 0.00 -3.71 -0.37 0.00 -1.11 0.00 0.00 56.01 50.82 2omj n LEU 6 Cb 0.00 0.33 -0.13 0.00 0.53 0.00 0.00 43.42 44.16 2omj n LEU 6 CO 0.00 1.51 -0.28 -0.69 -1.11 0.00 0.00 177.39 176.82 2omj s VAL 7 N -3.57 3.98 -0.10 1.96 1.01 -1.26 -4.97 120.40 117.45 2omj s VAL 7 Ca 0.30 -0.65 0.04 0.00 0.00 0.00 0.00 61.98 61.66 2omj s VAL 7 Cb 0.42 -3.03 0.00 0.00 0.00 0.00 0.00 36.38 33.77 2omj s VAL 7 CO -0.00 0.11 -0.21 -1.10 0.00 0.00 0.00 175.10 173.89 2omj s GLN 8 N 1.51 2.77 -0.04 2.72 1.11 -1.26 -3.75 119.66 122.72 2omj s GLN 8 Ca 0.03 -0.78 0.07 0.00 0.01 0.00 0.00 55.36 54.69 2omj s GLN 8 Cb -0.17 -2.13 -0.01 0.00 -1.01 0.00 0.00 33.01 29.69 2omj s GLN 8 CO 0.02 0.14 -0.24 0.50 0.01 0.00 0.00 175.29 175.72 2omj s ARG 9 N 0.44 2.22 -0.15 2.91 6.06 -0.53 -4.96 118.95 124.94 2omj s ARG 9 Ca -0.17 -0.87 -0.27 0.00 -2.50 0.00 0.00 55.73 51.92 2omj s ARG 9 Cb -0.17 -2.01 -0.01 0.00 0.06 0.00 0.00 34.95 32.82 2omj s ARG 9 CO 0.07 0.45 0.90 0.00 -2.50 0.00 0.00 175.30 174.22 2omj s VAL 11 N 2.18 3.39 -0.50 0.00 -7.23 -1.13 -4.97 120.40 112.14 2omj s VAL 11 Ca 0.42 -0.52 -0.17 0.00 -1.81 0.00 0.00 61.98 59.90 2omj s VAL 11 Cb -0.17 -2.48 0.08 0.00 0.56 0.00 0.00 36.38 34.37 2omj s VAL 11 CO 0.13 0.48 0.49 -0.63 -0.31 0.00 0.00 175.10 175.27 2omj s ILE 12 N 0.70 5.11 -0.33 -0.62 1.01 -1.25 -2.98 121.20 122.84 2omj s ILE 12 Ca -0.04 -0.96 -0.23 0.00 0.00 0.00 0.00 60.65 59.42 2omj s ILE 12 Cb -0.15 -4.22 0.00 0.00 0.01 0.00 0.00 42.46 38.10 2omj s ILE 12 CO 0.02 -0.71 0.79 -0.63 0.00 0.00 0.00 174.94 174.41 2omj s ILE 13 N 1.97 4.77 0.05 2.92 1.01 -0.90 -4.36 121.20 126.66 2omj s ILE 13 Ca 0.07 1.07 -0.23 0.00 0.00 0.00 0.00 60.65 61.56 2omj s ILE 13 Cb -0.24 -4.17 -0.06 0.00 0.01 0.00 0.00 42.46 38.00 2omj s ILE 13 CO 0.08 -0.32 0.69 -1.58 0.00 0.00 0.00 174.94 173.81 2omj s GLN 14 N 3.02 4.42 0.50 2.79 0.74 -1.26 -2.29 119.66 127.58 2omj s GLN 14 Ca 0.32 0.94 -0.22 0.00 0.05 0.00 0.00 55.36 56.45 2omj s GLN 14 Cb -0.14 -3.33 -0.06 0.00 1.10 0.00 0.00 33.01 30.58 2omj s GLN 14 CO 0.14 0.38 1.26 0.21 -0.55 0.00 0.00 175.29 176.73 2omj s LYS 15 N -0.34 3.45 0.23 1.67 2.20 0.19 -4.67 119.74 122.49 2omj s LYS 15 Ca 0.35 2.00 0.02 0.00 -0.36 0.00 0.00 55.97 57.97 2omj s LYS 15 Cb -0.20 -2.33 0.02 0.00 -1.51 0.00 0.00 37.83 33.80 2omj s LYS 15 CO 0.21 -0.86 0.13 -0.25 -0.36 0.00 0.00 175.35 174.22 2omj n ASP 16 N -0.76 1.98 0.22 1.43 8.00 -1.26 -4.88 116.55 121.28 2omj n ASP 16 Ca 0.09 -1.86 0.07 0.00 0.71 0.00 0.00 54.79 53.80 2omj n ASP 16 Cb 0.47 0.03 0.60 0.00 -0.02 0.00 0.00 41.12 42.20 2omj n ASP 16 CO 0.00 0.00 0.00 -2.24 -0.39 0.00 0.00 177.20 174.57 2omj h ASP 17 N 0.35 0.08 0.06 -2.24 2.03 -1.99 -2.98 116.42 111.72 2omj h ASP 17 Ca -0.16 -0.00 -0.36 0.00 -0.73 0.00 0.00 57.03 55.78 2omj h ASP 17 Cb 0.55 -0.02 -0.04 0.00 -0.83 0.00 0.00 39.33 38.99 2omj h ASP 17 CO 0.25 0.06 -2.07 0.59 -1.03 0.00 0.00 179.24 177.04 2omj n ASN 18 N -4.53 2.03 0.00 4.15 3.02 -1.26 -5.05 115.26 113.62 2omj n ASN 18 Ca -0.02 0.16 0.00 0.00 -0.03 0.00 0.00 54.58 54.69 2omj n ASN 18 Cb 0.09 -0.76 0.00 0.00 -0.61 0.00 0.00 39.78 38.50 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 1.91 0.65 1.42 7.41 0.00 -1.13 -5.09 105.19 110.36 2omj n GLY 19 Ca -0.38 -0.62 0.00 0.00 0.00 0.00 0.00 46.02 45.02 2omj n GLY 19 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2omj n PHE 20 N 0.00 -3.92 -0.02 1.61 3.72 -1.26 -4.86 117.46 112.73 2omj n PHE 20 Ca 0.00 2.10 -0.01 0.00 -0.05 0.00 0.00 57.45 59.49 2omj n PHE 20 Cb 0.00 -3.27 -0.05 0.00 -0.94 0.00 0.00 39.48 35.22 2omj n PHE 20 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2omj n GLY 21 N -1.57 -0.31 3.76 1.37 0.00 -1.26 -4.96 105.19 102.22 2omj n GLY 21 Ca 0.00 -0.12 -0.41 0.00 0.00 0.00 0.00 46.02 45.48 2omj n GLY 21 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 2omj n LEU 22 N -2.09 4.53 -4.61 0.99 -0.00 -1.26 -4.48 117.00 110.08 2omj n LEU 22 Ca -0.08 1.20 -0.36 0.00 -0.00 0.00 0.00 56.01 56.78 2omj n LEU 22 Cb 0.55 -1.60 -0.10 0.00 -0.00 0.00 0.00 43.42 42.27 2omj n LEU 22 CO 0.14 0.09 -0.23 -0.89 -0.00 0.00 0.00 177.39 176.50 2omj s THR 23 N -0.76 4.89 -0.03 1.47 2.01 0.49 -4.93 115.64 118.78 2omj s THR 23 Ca 0.57 0.01 0.05 0.00 0.31 0.00 0.00 61.69 62.63 2omj s THR 23 Cb -0.49 -3.25 -0.01 0.00 0.01 0.00 0.00 72.50 68.76 2omj s THR 23 CO 0.59 0.40 -0.18 0.54 -0.69 0.00 0.00 174.62 175.27 2omj s VAL 24 N 0.84 1.49 -0.14 3.82 0.11 -1.26 -0.49 120.40 124.76 2omj s VAL 24 Ca 0.05 -0.77 -0.08 0.00 -2.93 0.00 0.00 61.98 58.24 2omj s VAL 24 Cb -0.13 -1.26 0.05 0.00 -1.53 0.00 0.00 36.38 33.50 2omj s VAL 24 CO 0.02 0.43 0.34 -0.94 -3.33 0.00 0.00 175.10 171.62 2omj s SER 25 N -0.17 -0.40 -0.30 3.54 1.04 -1.17 -4.96 113.70 111.28 2omj s SER 25 Ca 0.01 0.73 -0.17 0.00 0.48 0.00 0.00 55.95 57.00 2omj s SER 25 Cb -0.10 0.64 0.19 0.00 0.10 0.00 0.00 66.02 66.85 2omj s SER 25 CO 0.01 -0.17 1.20 -0.83 0.98 0.00 0.00 173.24 174.43 2omj s GLY 26 N 1.09 0.39 0.00 7.32 0.00 -1.26 -4.28 107.32 110.59 2omj s GLY 26 Ca -0.07 3.63 0.00 0.00 0.00 0.00 0.00 44.72 48.28 2omj s GLY 26 CO -0.09 2.92 0.60 1.22 0.00 0.00 0.00 173.10 177.76 2omj n ASP 27 N 3.66 0.00 -0.09 1.64 8.00 -1.26 -4.53 116.55 123.97 2omj n ASP 27 Ca -0.14 0.60 -0.17 0.00 0.71 0.00 0.00 54.79 55.79 2omj n ASP 27 Cb 0.56 -0.10 -0.09 0.00 -0.02 0.00 0.00 41.12 41.47 2omj n ASP 27 CO 0.00 0.00 0.00 -1.13 -0.39 0.00 0.00 177.20 175.68 2omj h ASN 28 N 0.00 0.00 -1.12 -2.24 -0.00 -1.86 -3.40 115.58 106.95 2omj h ASN 28 Ca 0.00 -0.45 0.00 0.00 -0.00 0.00 0.00 56.30 55.85 2omj h ASN 28 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 38.32 2omj h ASN 28 CO 0.00 1.25 0.00 -2.65 -0.00 0.00 0.00 177.43 176.03 2omj n PRO 29 N -4.51 -0.13 -3.27 6.67 -0.02 -1.26 -4.61 135.00 127.86 2omj n PRO 29 Ca -0.23 0.00 -0.06 0.00 -2.02 0.00 0.00 63.50 61.18 2omj n PRO 29 Cb 0.55 0.00 -0.04 0.00 -0.02 0.00 0.00 33.50 33.99 2omj n PRO 29 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2omj s VAL 30 N -0.68 -0.71 0.08 -1.45 1.01 -1.26 -4.51 120.40 112.88 2omj s VAL 30 Ca 0.00 -0.34 0.10 0.00 0.00 0.00 0.00 61.98 61.74 2omj s VAL 30 Cb 0.00 -0.68 -0.03 0.00 0.00 0.00 0.00 36.38 35.67 2omj s VAL 30 CO 0.00 -0.24 -0.27 0.72 0.00 0.00 0.00 175.10 175.31 2omj s PHE 31 N 2.16 2.32 -0.25 5.22 -0.71 -1.26 -0.85 117.98 124.61 2omj s PHE 31 Ca 0.13 -0.40 -0.20 0.00 -1.04 0.00 0.00 56.93 55.43 2omj s PHE 31 Cb -0.11 -1.33 -0.02 0.00 -1.21 0.00 0.00 43.02 40.35 2omj s PHE 31 CO -0.18 0.22 0.59 0.08 -1.34 0.00 0.00 175.22 174.59 2omj s VAL 32 N -0.92 5.02 -0.11 -2.49 1.01 -0.97 -3.04 120.40 118.90 2omj s VAL 32 Ca 0.13 1.06 -0.15 0.00 0.00 0.00 0.00 61.98 63.02 2omj s VAL 32 Cb -0.10 -3.90 -0.13 0.00 0.00 0.00 0.00 36.38 32.25 2omj s VAL 32 CO 0.04 0.06 0.41 -0.61 0.00 0.00 0.00 175.10 175.00 2omj h GLN 33 N 7.85 -0.02 -5.64 2.72 4.15 -1.13 0.76 115.11 123.80 2omj h GLN 33 Ca -0.28 0.00 -0.46 0.00 0.77 0.00 0.00 58.65 58.68 2omj h GLN 33 Cb 1.13 0.00 -0.16 0.00 0.21 0.00 0.00 27.48 28.67 2omj h GLN 33 CO 0.75 0.46 -0.75 -1.12 -1.93 0.00 0.00 178.83 176.24 2omj s SER 34 N -5.83 2.51 -0.00 -0.69 0.01 -0.96 -3.12 113.70 105.61 2omj s SER 34 Ca -0.09 -0.95 0.01 0.00 1.31 0.00 0.00 55.95 56.23 2omj s SER 34 Cb -0.01 -0.13 -0.00 0.00 0.21 0.00 0.00 66.02 66.08 2omj s SER 34 CO 0.34 -0.13 -0.05 0.68 0.41 0.00 0.00 173.24 174.50 2omj s VAL 35 N -2.60 0.38 -0.23 3.43 -7.23 -1.26 -0.38 120.40 112.50 2omj s VAL 35 Ca 0.19 -0.20 -0.28 0.00 -1.81 0.00 0.00 61.98 59.87 2omj s VAL 35 Cb -0.03 -0.32 -0.05 0.00 0.56 0.00 0.00 36.38 36.54 2omj s VAL 35 CO 0.06 0.11 2.23 1.17 -0.31 0.00 0.00 175.10 178.36 2omj n LYS 36 N 2.98 1.92 -2.21 4.82 3.00 -1.26 -4.82 118.16 122.58 2omj n LYS 36 Ca -0.13 0.51 -0.42 0.00 -0.00 0.00 0.00 58.31 58.28 2omj n LYS 36 Cb 0.58 -3.23 -0.03 0.00 0.00 0.00 0.00 35.03 32.35 2omj n LYS 36 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.40 175.40 2omj s GLU 37 N 6.43 4.36 -1.73 1.64 2.12 -1.26 -1.80 118.70 128.45 2omj s GLU 37 Ca 1.01 2.04 -0.01 0.00 0.36 0.00 0.00 54.97 58.36 2omj s GLU 37 Cb -0.34 -3.24 0.00 0.00 0.26 0.00 0.00 34.13 30.81 2omj s GLU 37 CO 0.35 -0.35 0.17 -3.47 -0.54 0.00 0.00 175.26 171.43 2omj n ASP 38 N 3.43 -6.00 0.00 -1.70 -0.08 -1.26 -4.92 116.55 106.01 2omj n ASP 38 Ca 0.09 -0.09 0.00 0.00 -1.51 0.00 0.00 54.79 53.28 2omj n ASP 38 Cb 0.43 -4.96 0.00 0.00 2.34 0.00 0.00 41.12 38.93 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 -1.16 5.37 0.36 0.27 0.00 -1.08 -4.94 105.19 104.01 2omj n GLY 39 Ca -0.21 -1.36 -0.02 0.00 0.00 0.00 0.00 46.02 44.43 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 1.28 -0.15 4.61 0.00 -1.83 0.11 119.26 124.28 2omj h ALA 40 Ca 0.00 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 54.78 2omj h ALA 40 Cb 0.00 -0.34 -0.00 0.00 0.00 0.00 0.00 17.79 17.44 2omj h ALA 40 CO 0.00 0.61 -0.03 0.00 0.00 0.00 0.00 179.25 179.82 2omj h ALA 41 N 1.38 0.21 -0.07 0.00 0.00 -1.89 -1.28 119.26 117.61 2omj h ALA 41 Ca 0.30 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 2omj h ALA 41 Cb -0.03 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 17.70 2omj h ALA 41 CO -0.06 -0.04 0.02 1.98 0.00 0.00 0.00 179.25 181.15 2omj h MET 42 N -0.01 0.11 -0.16 0.00 -1.53 -1.11 -2.40 114.93 109.82 2omj h MET 42 Ca 0.04 -0.02 -0.00 0.00 -3.44 0.00 0.00 59.70 56.27 2omj h MET 42 Cb 0.45 -0.01 -0.01 0.00 -0.55 0.00 0.00 31.60 31.48 2omj h MET 42 CO 0.01 0.29 0.09 0.00 0.14 0.00 0.00 176.91 177.44 2omj h ARG 43 N -0.09 0.21 0.00 0.39 2.47 -0.82 -0.13 114.38 116.40 2omj h ARG 43 Ca 0.02 -0.01 0.00 0.00 -1.26 0.00 0.00 59.98 58.73 2omj h ARG 43 Cb 0.23 -0.05 0.00 0.00 -1.65 0.00 0.00 29.97 28.50 2omj h ARG 43 CO -0.00 0.15 0.00 0.00 0.56 0.00 0.00 179.97 180.68 2omj h ALA 44 N 1.89 1.00 0.00 0.04 0.00 -0.94 -3.47 119.26 117.78 2omj h ALA 44 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.97 2omj h ALA 44 Cb -0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 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 0.29 0.56 3.86 0.00 0.00 -0.06 -3.94 105.19 105.89 2omj n GLY 45 Ca 0.03 -0.80 -0.31 0.00 0.00 0.00 0.00 46.02 44.93 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 4.55 0.01 1.61 1.01 -0.93 -4.94 120.40 119.71 2omj s VAL 46 Ca 0.00 0.90 0.06 0.00 0.00 0.00 0.00 61.98 62.95 2omj s VAL 46 Cb 0.00 -3.76 -0.02 0.00 0.00 0.00 0.00 36.38 32.60 2omj s VAL 46 CO 0.00 -1.01 -0.19 -1.10 0.00 0.00 0.00 175.10 172.79 2omj s GLN 47 N -4.94 1.46 0.13 2.72 1.11 -1.26 -4.83 119.66 114.05 2omj s GLN 47 Ca 0.56 -0.78 -0.31 0.00 0.01 0.00 0.00 55.36 54.84 2omj s GLN 47 Cb -0.11 -1.47 -0.10 0.00 -1.01 0.00 0.00 33.01 30.32 2omj s GLN 47 CO 0.50 0.39 1.62 0.99 0.01 0.00 0.00 175.29 178.80 2omj s THR 48 N -0.59 2.72 -0.76 -0.19 2.01 -1.26 -2.91 115.64 114.67 2omj s THR 48 Ca 0.07 0.42 -0.01 0.00 0.31 0.00 0.00 61.69 62.48 2omj s THR 48 Cb -0.08 -3.27 0.00 0.00 0.01 0.00 0.00 72.50 69.17 2omj s THR 48 CO 0.00 0.02 0.64 0.61 -0.69 0.00 0.00 174.62 175.20 2omj n GLY 49 N 3.87 -0.04 4.01 4.40 0.00 0.26 -5.01 105.19 112.68 2omj n GLY 49 Ca 0.15 -0.12 -0.19 0.00 0.00 0.00 0.00 46.02 45.86 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 -3.74 5.29 -0.11 1.61 1.47 -1.03 -4.89 116.67 115.27 2omj s ASP 50 Ca 0.06 -0.69 0.00 0.00 1.18 0.00 0.00 52.55 53.09 2omj s ASP 50 Cb -0.03 -0.13 -0.02 0.00 -0.34 0.00 0.00 42.92 42.41 2omj s ASP 50 CO 0.45 -1.06 -0.11 -0.13 0.68 0.00 0.00 175.17 175.01 2omj s ARG 51 N -4.49 3.19 -0.31 2.11 0.52 -0.81 -2.28 118.95 116.87 2omj s ARG 51 Ca 0.57 -0.63 -0.09 0.00 -0.52 0.00 0.00 55.73 55.06 2omj s ARG 51 Cb -0.07 -2.63 0.00 0.00 0.52 0.00 0.00 34.95 32.77 2omj s ARG 51 CO 0.35 0.36 0.13 0.42 0.02 0.00 0.00 175.30 176.59 2omj s ILE 52 N -0.02 4.38 -0.12 1.52 1.01 -0.03 0.30 121.20 128.24 2omj s ILE 52 Ca -0.02 -0.56 0.15 0.00 0.00 0.00 0.00 60.65 60.22 2omj s ILE 52 Cb -0.14 -3.27 -0.24 0.00 0.01 0.00 0.00 42.46 38.82 2omj s ILE 52 CO 0.04 0.03 0.36 -0.38 0.00 0.00 0.00 174.94 174.99 2omj n ILE 53 N 4.94 1.50 -4.14 2.92 -0.00 0.38 -4.50 119.36 120.47 2omj n ILE 53 Ca -0.14 -0.83 -0.15 0.00 -0.00 0.00 0.00 62.75 61.63 2omj n ILE 53 Cb 0.48 -0.75 -0.13 0.00 -0.00 0.00 0.00 39.64 39.24 2omj n ILE 53 CO 0.00 0.00 0.00 -0.75 -0.00 0.00 0.00 176.55 175.80 2omj s LYS 54 N -2.54 0.47 -0.26 0.38 2.20 -0.96 -3.12 119.74 115.91 2omj s LYS 54 Ca -0.08 -0.37 0.01 0.00 -0.36 0.00 0.00 55.97 55.17 2omj s LYS 54 Cb 0.07 -0.39 0.07 0.00 -1.51 0.00 0.00 37.83 36.07 2omj s LYS 54 CO 0.83 0.10 -0.01 0.14 -0.36 0.00 0.00 175.35 176.04 2omj s VAL 55 N -0.51 1.43 -1.65 4.02 -7.23 -1.24 0.87 120.40 116.09 2omj s VAL 55 Ca -0.02 -1.33 -0.02 0.00 -1.81 0.00 0.00 61.98 58.80 2omj s VAL 55 Cb -0.05 -1.82 0.00 0.00 0.56 0.00 0.00 36.38 35.08 2omj s VAL 55 CO -0.00 -0.26 0.30 -3.20 -0.31 0.00 0.00 175.10 171.62 2omj n ASN 56 N 4.68 -5.98 -1.59 4.85 5.15 0.28 -1.44 115.26 121.20 2omj n ASN 56 Ca -0.08 -0.15 -0.16 0.00 -0.60 0.00 0.00 54.58 53.59 2omj n ASN 56 Cb 0.44 -4.89 -0.03 0.00 -0.53 0.00 0.00 39.78 34.77 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 -1.27 0.42 0.35 8.20 0.00 -1.05 -4.85 105.19 107.00 2omj n GLY 57 Ca -0.18 -0.24 0.07 0.00 0.00 0.00 0.00 46.02 45.68 2omj n GLY 57 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2omj n THR 58 N -3.46 1.70 -1.18 2.61 -1.04 -0.52 -5.12 114.28 107.27 2omj n THR 58 Ca -0.18 -2.28 0.14 0.00 -2.04 0.00 0.00 64.05 59.70 2omj n THR 58 Cb 0.60 -0.10 -0.05 0.00 -1.82 0.00 0.00 70.33 68.96 2omj n THR 58 CO 0.00 0.00 0.00 -0.11 -0.64 0.00 0.00 175.07 174.32 2omj n LEU 59 N -1.10 -0.62 -3.21 -4.42 7.94 -1.26 -4.58 117.00 109.75 2omj n LEU 59 Ca 0.15 1.40 -0.29 0.00 -1.11 0.00 0.00 56.01 56.16 2omj n LEU 59 Cb 0.69 -3.76 -0.05 0.00 0.53 0.00 0.00 43.42 40.83 2omj n LEU 59 CO -0.01 -2.53 0.26 1.33 -1.11 0.00 0.00 177.39 175.32 2omj n VAL 60 N -3.60 3.14 -1.27 1.96 0.24 -1.18 -3.61 118.33 114.00 2omj n VAL 60 Ca -0.02 -5.50 -0.23 0.00 -2.04 0.00 0.00 64.34 56.55 2omj n VAL 60 Cb 0.64 -1.69 0.17 0.00 -1.47 0.00 0.00 33.84 31.48 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 0.23 3.19 -3.72 3.34 -1.04 -1.26 -4.96 114.28 110.06 2omj n THR 61 Ca 0.31 -2.12 -0.21 0.00 -2.04 0.00 0.00 64.05 59.99 2omj n THR 61 Cb 0.39 -0.53 0.01 0.00 -1.82 0.00 0.00 70.33 68.37 2omj n THR 61 CO 0.00 0.00 0.00 1.41 -0.64 0.00 0.00 175.07 175.84 2omj n HIS 62 N -1.12 -0.95 0.01 -1.42 8.25 -1.26 -5.07 115.22 113.66 2omj n HIS 62 Ca 0.58 -1.91 0.00 0.00 -0.26 0.00 0.00 57.72 56.12 2omj n HIS 62 Cb 1.51 -0.38 0.00 0.00 1.12 0.00 0.00 29.99 32.23 2omj n HIS 62 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 2omj n SER 63 N -1.93 -0.06 -4.70 0.41 3.41 -1.26 -4.77 113.62 104.72 2omj n SER 63 Ca 0.00 0.02 -0.42 0.00 -0.26 0.00 0.00 58.87 58.21 2omj n SER 63 Cb 0.52 0.23 -0.03 0.00 -0.26 0.00 0.00 64.21 64.67 2omj n SER 63 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 2omj s ASN 64 N -3.93 6.42 0.23 4.04 -0.87 -1.26 -4.72 114.94 114.85 2omj s ASN 64 Ca 0.00 2.77 -0.08 0.00 -1.57 0.00 0.00 52.86 53.98 2omj s ASN 64 Cb 0.00 -2.57 0.21 0.00 -0.02 0.00 0.00 41.25 38.86 2omj s ASN 64 CO 0.00 -1.00 1.90 -0.74 -2.57 0.00 0.00 177.10 174.70 2omj h HIS 65 N 8.29 1.10 -0.77 2.20 2.76 -1.91 -2.22 115.15 124.61 2omj h HIS 65 Ca -0.45 0.02 0.09 0.00 -2.20 0.00 0.00 60.37 57.83 2omj h HIS 65 Cb 1.21 -0.37 -0.07 0.00 1.55 0.00 0.00 27.41 29.73 2omj h HIS 65 CO 0.77 0.70 0.43 -0.07 -1.30 0.00 0.00 177.93 178.45 2omj h LEU 66 N 1.19 0.60 -0.50 0.26 4.07 -1.98 0.33 115.31 119.27 2omj h LEU 66 Ca 0.32 0.05 -0.03 0.00 0.08 0.00 0.00 57.88 58.30 2omj h LEU 66 Cb -0.13 -0.07 -0.02 0.00 1.08 0.00 0.00 40.66 41.52 2omj h LEU 66 CO -0.07 0.35 0.22 -0.08 -1.08 0.00 0.00 178.44 177.78 2omj h GLU 67 N 0.73 0.75 -0.29 1.13 4.81 -1.80 0.35 114.58 120.25 2omj h GLU 67 Ca 0.37 -0.13 -0.01 0.00 -0.13 0.00 0.00 59.36 59.46 2omj h GLU 67 Cb 0.33 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.57 2omj h GLU 67 CO -0.24 0.65 0.13 0.28 -0.73 0.00 0.00 179.01 179.10 2omj h VAL 68 N 0.67 1.16 -0.29 0.32 2.07 -0.76 0.36 116.25 119.79 2omj h VAL 68 Ca 0.17 -0.46 -0.00 0.00 0.82 0.00 0.00 66.70 67.22 2omj h VAL 68 Cb 0.17 0.93 -0.01 0.00 -1.52 0.00 0.00 31.29 30.86 2omj h VAL 68 CO -0.02 0.16 0.16 0.58 0.02 0.00 0.00 177.57 178.48 2omj h VAL 69 N 0.33 1.12 -0.72 2.57 2.07 -0.12 0.32 116.25 121.81 2omj h VAL 69 Ca 0.10 -0.31 -0.03 0.00 0.82 0.00 0.00 66.70 67.28 2omj h VAL 69 Cb 0.14 0.81 -0.03 0.00 -1.52 0.00 0.00 31.29 30.68 2omj h VAL 69 CO -0.01 0.12 0.34 0.11 0.02 0.00 0.00 177.57 178.15 2omj h LYS 70 N 0.35 1.03 -0.39 1.57 1.57 -0.08 0.36 116.57 120.98 2omj h LYS 70 Ca 0.10 -0.15 -0.11 0.00 -1.87 0.00 0.00 60.65 58.62 2omj h LYS 70 Cb 0.05 -0.19 -0.01 0.00 0.08 0.00 0.00 32.23 32.16 2omj h LYS 70 CO -0.02 0.80 -0.19 1.25 -0.57 0.00 0.00 179.45 180.73 2omj h LEU 71 N 1.02 0.85 -0.58 2.94 6.46 0.23 -0.86 115.31 125.38 2omj h LEU 71 Ca 0.25 -0.40 -0.15 0.00 -0.12 0.00 0.00 57.88 57.45 2omj h LEU 71 Cb 0.12 -0.23 -0.01 0.00 -0.73 0.00 0.00 40.66 39.81 2omj h LEU 71 CO -0.03 1.06 -0.50 0.40 -0.62 0.00 0.00 178.44 178.75 2omj h ILE 72 N 0.63 1.32 0.00 4.05 2.04 0.05 -2.97 117.51 122.63 2omj h ILE 72 Ca 0.09 -1.72 -0.09 0.00 1.00 0.00 0.00 64.86 64.13 2omj h ILE 72 Cb 0.74 1.70 -0.01 0.00 -0.74 0.00 0.00 36.82 38.51 2omj h ILE 72 CO 0.06 0.54 -0.45 0.50 0.00 0.00 0.00 178.15 178.79 2omj h LYS 73 N 0.43 0.00 -5.25 2.37 1.63 -0.20 -3.40 116.57 112.15 2omj h LYS 73 Ca 0.02 0.00 -0.15 0.00 -0.85 0.00 0.00 60.65 59.67 2omj h LYS 73 Cb 1.03 0.00 -0.02 0.00 -0.60 0.00 0.00 32.23 32.64 2omj h LYS 73 CO 0.09 0.45 0.48 -1.12 -3.45 0.00 0.00 179.45 175.90 2omj s SER 74 N -6.59 4.06 0.00 4.20 0.01 -0.34 -4.59 113.70 110.46 2omj s SER 74 Ca -0.01 -1.28 0.00 0.00 1.31 0.00 0.00 55.95 55.98 2omj s SER 74 Cb 0.12 -2.60 0.00 0.00 0.21 0.00 0.00 66.02 63.75 2omj s SER 74 CO 0.71 -4.11 0.00 0.61 0.41 0.00 0.00 173.24 170.86 2omj n GLY 75 N 5.99 3.72 0.46 3.44 0.00 -1.26 -4.97 105.19 112.57 2omj n GLY 75 Ca 0.43 -1.57 -0.18 0.00 0.00 0.00 0.00 46.02 44.69 2omj n GLY 75 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2omj h SER 76 N 0.00 -1.02 -3.32 1.61 0.02 -1.90 -3.43 113.55 105.51 2omj h SER 76 Ca 0.00 0.04 -0.66 0.00 -0.84 0.00 0.00 61.79 60.33 2omj h SER 76 Cb 0.00 0.27 -0.28 0.00 0.14 0.00 0.00 62.40 62.53 2omj h SER 76 CO 0.00 -0.70 -0.78 -0.72 -1.14 0.00 0.00 176.83 173.49 2omj s TYR 77 N -5.56 2.80 -0.05 3.45 1.13 -1.26 0.56 117.35 118.41 2omj s TYR 77 Ca -0.17 -0.77 0.03 0.00 -1.41 0.00 0.00 57.07 54.75 2omj s TYR 77 Cb 0.02 -1.86 -0.03 0.00 -1.10 0.00 0.00 41.96 38.99 2omj s TYR 77 CO 0.52 -0.30 -0.12 0.54 -2.51 0.00 0.00 175.55 173.68 2omj s VAL 78 N 0.51 3.25 -0.49 -3.49 0.11 -0.97 -4.93 120.40 114.40 2omj s VAL 78 Ca -0.09 -0.67 -0.13 0.00 -2.93 0.00 0.00 61.98 58.16 2omj s VAL 78 Cb -0.16 -2.29 0.11 0.00 -1.53 0.00 0.00 36.38 32.51 2omj s VAL 78 CO 0.04 0.58 0.39 0.00 -3.33 0.00 0.00 175.10 172.79 2omj s ALA 79 N -0.77 3.49 -0.16 1.54 0.00 -1.26 -2.11 121.76 122.50 2omj s ALA 79 Ca 0.12 -2.40 -0.01 0.00 0.00 0.00 0.00 51.96 49.67 2omj s ALA 79 Cb -0.11 -2.99 -0.01 0.00 0.00 0.00 0.00 23.12 20.01 2omj s ALA 79 CO 0.01 -1.87 -0.11 -0.51 0.00 0.00 0.00 175.76 173.28 2omj s LEU 80 N 1.50 2.74 -0.30 0.00 1.02 -1.16 0.99 118.68 123.47 2omj s LEU 80 Ca 0.04 -0.36 -0.29 0.00 0.02 0.00 0.00 54.13 53.55 2omj s LEU 80 Cb -0.27 -1.64 -0.01 0.00 0.02 0.00 0.00 46.19 44.29 2omj s LEU 80 CO 0.02 0.11 1.56 -0.89 0.02 0.00 0.00 176.35 177.17 2omj s THR 81 N 0.68 3.77 0.25 5.49 2.01 0.25 -2.84 115.64 125.25 2omj s THR 81 Ca -0.06 0.83 0.10 0.00 0.31 0.00 0.00 61.69 62.87 2omj s THR 81 Cb -0.15 -3.88 -0.04 0.00 0.01 0.00 0.00 72.50 68.44 2omj s THR 81 CO 0.02 -0.45 -0.03 0.54 -0.69 0.00 0.00 174.62 174.01 2omj s VAL 82 N 5.47 3.38 0.02 3.82 0.11 -1.05 -0.47 120.40 131.69 2omj s VAL 82 Ca 0.68 -1.89 0.04 0.00 -2.93 0.00 0.00 61.98 57.88 2omj s VAL 82 Cb -0.21 -2.78 -0.02 0.00 -1.53 0.00 0.00 36.38 31.84 2omj s VAL 82 CO 0.30 -0.34 -0.11 -1.58 -3.33 0.00 0.00 175.10 170.05 2omj s GLN 83 N -3.54 0.76 -0.12 1.54 0.74 0.15 -1.45 119.66 117.75 2omj s GLN 83 Ca 0.30 -0.59 -0.00 0.00 0.05 0.00 0.00 55.36 55.12 2omj s GLN 83 Cb -0.07 -0.71 0.02 0.00 1.10 0.00 0.00 33.01 33.35 2omj s GLN 83 CO 0.19 0.18 -0.08 0.20 -0.55 0.00 0.00 175.29 175.23 2omj s GLY 84 N -0.88 0.85 -0.01 2.59 0.00 -1.25 -1.93 107.32 106.69 2omj s GLY 84 Ca -0.00 -0.57 -0.01 0.00 0.00 0.00 0.00 44.72 44.14 2omj s GLY 84 CO 0.01 0.77 0.03 -1.60 0.00 0.00 0.00 173.10 172.31 2omj s ARG 85 N 1.67 0.03 -0.41 2.90 3.52 -1.26 -4.82 118.95 120.58 2omj s ARG 85 Ca 0.05 0.06 -0.29 0.00 -0.13 0.00 0.00 55.73 55.42 2omj s ARG 85 Cb -0.13 -0.01 0.01 0.00 -1.56 0.00 0.00 34.95 33.27 2omj s ARG 85 CO -0.08 -0.02 1.44 -1.25 -0.81 0.00 0.00 175.30 174.58 2omj s PRO 86 N 0.11 3.55 0.66 5.12 0.04 -1.26 -5.01 135.00 138.22 2omj s PRO 86 Ca -0.01 0.96 -0.16 0.00 0.04 0.00 0.00 61.00 61.84 2omj s PRO 86 Cb -0.01 -4.04 0.00 0.00 0.04 0.00 0.00 34.50 30.49 2omj s PRO 86 CO -0.00 -1.59 1.14 -1.25 0.04 0.00 0.00 177.00 175.33 2omj s PRO 87 N 4.99 2.69 -0.35 0.56 0.04 -1.26 -4.94 135.00 136.73 2omj s PRO 87 Ca 0.62 1.52 0.04 0.00 0.04 0.00 0.00 61.00 63.22 2omj s PRO 87 Cb -0.14 -1.93 0.56 0.00 0.04 0.00 0.00 34.50 33.03 2omj s PRO 87 CO 0.33 -1.36 1.74 0.41 0.04 0.00 0.00 177.00 178.16 2omj n GLY 88 N -0.19 3.94 3.88 0.56 0.00 -1.26 -5.36 105.19 106.76 2omj n GLY 88 Ca 0.11 -0.88 0.00 0.00 0.00 0.00 0.00 46.02 45.25 2omj n GLY 88 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18