#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2osg s ILE 2 N 0.00 -0.42 0.20 1.12 2.07 -1.26 -5.16 121.20 117.75 2osg s ILE 2 Ca 0.00 0.27 0.08 0.00 -1.41 0.00 0.00 60.65 59.59 2osg s ILE 2 Cb 0.00 -0.45 -0.04 0.00 0.13 0.00 0.00 42.46 42.09 2osg s ILE 2 CO 0.00 0.11 0.01 -0.83 -1.91 0.00 0.00 174.94 172.32 2osg s GLY 3 N 2.43 1.69 -0.04 1.50 0.00 -1.26 -5.13 107.32 106.51 2osg s GLY 3 Ca 0.01 -1.44 0.02 0.00 0.00 0.00 0.00 44.72 43.32 2osg s GLY 3 CO -0.09 -1.46 -0.08 0.14 0.00 0.00 0.00 173.10 171.61 2osg s VAL 4 N -1.88 0.75 -0.34 1.40 1.01 -1.26 -5.12 120.40 114.96 2osg s VAL 4 Ca 0.28 -0.30 -0.12 0.00 0.00 0.00 0.00 61.98 61.85 2osg s VAL 4 Cb -0.09 -0.70 -0.01 0.00 0.00 0.00 0.00 36.38 35.59 2osg s VAL 4 CO 0.19 0.25 0.22 -0.22 0.00 0.00 0.00 175.10 175.54 2osg s LEU 5 N 0.49 4.47 -0.01 3.92 0.20 -1.26 -5.08 118.68 121.41 2osg s LEU 5 Ca -0.08 -0.51 -0.06 0.00 0.69 0.00 0.00 54.13 54.18 2osg s LEU 5 Cb -0.12 -2.10 -0.04 0.00 -0.43 0.00 0.00 46.19 43.50 2osg s LEU 5 CO 0.01 -0.25 0.23 -0.76 -0.29 0.00 0.00 176.35 175.30 2osg s LEU 6 N 1.68 4.37 0.33 -0.68 1.02 -1.26 -5.11 118.68 119.03 2osg s LEU 6 Ca 0.05 0.49 0.09 0.00 0.02 0.00 0.00 54.13 54.79 2osg s LEU 6 Cb -0.17 -2.60 -0.05 0.00 0.02 0.00 0.00 46.19 43.39 2osg s LEU 6 CO 0.09 0.27 0.07 -0.32 0.02 0.00 0.00 176.35 176.49 2osg s MET 7 N -1.73 2.27 0.14 1.70 -2.45 -1.26 -5.13 119.30 112.84 2osg s MET 7 Ca 0.26 -1.59 -0.18 0.00 -1.25 0.00 0.00 55.69 52.93 2osg s MET 7 Cb -0.13 -2.10 -0.07 0.00 1.25 0.00 0.00 34.83 33.78 2osg s MET 7 CO 0.16 0.17 0.62 0.21 1.05 0.00 0.00 175.02 177.22 2osg s LYS 8 N -3.77 4.17 -0.30 4.11 2.47 -1.26 -5.06 119.74 120.10 2osg s LYS 8 Ca 0.36 0.72 -0.04 0.00 -1.56 0.00 0.00 55.97 55.45 2osg s LYS 8 Cb -0.02 -3.05 0.19 0.00 -1.46 0.00 0.00 37.83 33.48 2osg s LYS 8 CO 0.21 0.52 0.77 0.45 0.16 0.00 0.00 175.35 177.46 2osg s SER 9 N -1.44 -1.08 -1.58 1.43 0.15 -1.26 -4.94 113.70 104.98 2osg s SER 9 Ca 0.36 0.49 -0.04 0.00 0.70 0.00 0.00 55.95 57.46 2osg s SER 9 Cb -0.18 1.83 0.00 0.00 -1.71 0.00 0.00 66.02 65.97 2osg s SER 9 CO 0.20 -0.20 0.57 -1.14 1.20 0.00 0.00 173.24 173.87 2osg n ARG 10 N 5.41 -4.69 -3.70 5.44 0.00 -1.26 -4.98 116.66 112.88 2osg n ARG 10 Ca -0.00 0.92 -0.28 0.00 -0.00 0.00 0.00 57.85 58.49 2osg n ARG 10 Cb 0.53 -5.77 -0.16 0.00 0.00 0.00 0.00 32.46 27.06 2osg n ARG 10 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2osg s ALA 11 N -3.17 0.98 -0.14 5.13 0.00 -1.26 -4.99 121.76 118.31 2osg s ALA 11 Ca 0.28 -0.85 0.07 0.00 0.00 0.00 0.00 51.96 51.46 2osg s ALA 11 Cb -0.12 -1.26 -0.23 0.00 0.00 0.00 0.00 23.12 21.51 2osg s ALA 11 CO 0.35 -1.30 0.29 -1.71 0.00 0.00 0.00 175.76 173.39 2osg n ASN 12 N 5.06 1.22 -2.76 0.00 4.05 -1.26 -4.41 115.26 117.17 2osg n ASN 12 Ca -0.07 0.17 -0.29 0.00 0.45 0.00 0.00 54.58 54.83 2osg n ASN 12 Cb 0.46 -0.11 -0.06 0.00 1.23 0.00 0.00 39.78 41.30 2osg n ASN 12 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 177.26 173.59 2osg n GLU 13 N -3.14 3.07 -0.80 1.20 4.71 -1.26 -4.97 120.64 119.45 2osg n GLU 13 Ca -0.30 -2.39 0.11 0.00 -0.01 0.00 0.00 57.16 54.57 2osg n GLU 13 Cb 1.06 -2.32 -0.03 0.00 -1.01 0.00 0.00 31.44 29.15 2osg n GLU 13 CO 0.00 0.00 0.00 -1.91 0.09 0.00 0.00 177.13 175.31 2osg n GLU 14 N 1.68 -1.60 0.24 3.49 2.13 -1.26 -4.06 120.64 121.25 2osg n GLU 14 Ca 0.55 1.06 0.13 0.00 0.66 0.00 0.00 57.16 59.55 2osg n GLU 14 Cb 0.50 -1.96 0.51 0.00 0.27 0.00 0.00 31.44 30.77 2osg n GLU 14 CO 0.00 0.00 0.00 1.88 -0.41 0.00 0.00 177.13 178.60 2osg h TYR 15 N -0.74 0.00 0.00 4.31 -1.99 -1.93 -3.46 116.97 113.16 2osg h TYR 15 Ca 0.02 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.75 2osg h TYR 15 Cb 0.73 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.46 2osg h TYR 15 CO 0.00 0.13 0.00 0.41 -0.00 0.00 0.00 178.16 178.70 2osg n GLY 16 N 0.20 0.76 3.48 3.88 0.00 -1.26 -5.06 105.19 107.19 2osg n GLY 16 Ca 0.01 -0.47 -0.39 0.00 0.00 0.00 0.00 46.02 45.17 2osg n GLY 16 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2osg s LEU 17 N 0.00 4.24 -0.36 0.99 1.02 -1.26 -5.06 118.68 118.25 2osg s LEU 17 Ca 0.00 -0.44 -0.23 0.00 0.02 0.00 0.00 54.13 53.48 2osg s LEU 17 Cb 0.00 -2.06 0.01 0.00 0.02 0.00 0.00 46.19 44.16 2osg s LEU 17 CO 0.00 -0.20 0.76 -0.13 0.02 0.00 0.00 176.35 176.80 2osg s ARG 18 N 1.66 3.75 -0.23 1.70 3.00 -1.26 -5.03 118.95 122.54 2osg s ARG 18 Ca 0.05 0.28 -0.13 0.00 0.00 0.00 0.00 55.73 55.94 2osg s ARG 18 Cb -0.17 -3.81 -0.05 0.00 0.00 0.00 0.00 34.95 30.93 2osg s ARG 18 CO 0.08 -0.82 0.25 -0.51 0.00 0.00 0.00 175.30 174.30 2osg s LEU 19 N 3.02 4.12 0.48 2.53 1.02 -1.26 -5.08 118.68 123.51 2osg s LEU 19 Ca 0.30 0.25 0.05 0.00 0.02 0.00 0.00 54.13 54.75 2osg s LEU 19 Cb -0.13 -2.26 -0.02 0.00 0.02 0.00 0.00 46.19 43.80 2osg s LEU 19 CO 0.16 0.00 0.19 -0.83 0.02 0.00 0.00 176.35 175.89 2osg s GLY 20 N 1.09 2.55 0.08 -3.19 0.00 -1.26 -5.16 107.32 101.44 2osg s GLY 20 Ca 0.12 -1.38 0.05 0.00 0.00 0.00 0.00 44.72 43.52 2osg s GLY 20 CO 0.06 -2.01 -0.14 -1.35 0.00 0.00 0.00 173.10 169.65 2osg s SER 21 N -4.00 1.78 -0.02 1.64 1.04 -1.26 -5.02 113.70 107.86 2osg s SER 21 Ca 0.29 -0.66 0.01 0.00 0.48 0.00 0.00 55.95 56.06 2osg s SER 21 Cb 0.02 -0.06 0.01 0.00 0.10 0.00 0.00 66.02 66.09 2osg s SER 21 CO 0.16 -0.09 -0.03 0.00 0.98 0.00 0.00 173.24 174.27 2osg s GLN 22 N -1.96 0.39 -0.23 4.02 -2.07 -1.26 0.59 119.66 119.14 2osg s GLN 22 Ca 0.01 -0.08 -0.22 0.00 -1.82 0.00 0.00 55.36 53.25 2osg s GLN 22 Cb -0.09 -0.44 -0.02 0.00 -1.09 0.00 0.00 33.01 31.38 2osg s GLN 22 CO 0.02 0.01 0.69 0.42 -1.32 0.00 0.00 175.29 175.11 2osg s ILE 23 N 0.34 4.96 0.39 3.63 1.01 -0.61 -4.94 121.20 125.98 2osg s ILE 23 Ca -0.03 1.28 0.04 0.00 0.00 0.00 0.00 60.65 61.93 2osg s ILE 23 Cb -0.07 -3.99 -0.05 0.00 0.01 0.00 0.00 42.46 38.36 2osg s ILE 23 CO -0.01 0.04 0.05 0.72 0.00 0.00 0.00 174.94 175.74 2osg s PHE 24 N 2.34 2.04 -0.79 3.97 -0.71 -1.26 -0.23 117.98 123.34 2osg s PHE 24 Ca 0.30 -0.96 -0.25 0.00 -1.04 0.00 0.00 56.93 54.98 2osg s PHE 24 Cb -0.16 -1.42 0.05 0.00 -1.21 0.00 0.00 43.02 40.28 2osg s PHE 24 CO 0.09 0.08 1.24 0.08 -1.34 0.00 0.00 175.22 175.37 2osg s VAL 25 N -3.08 3.95 -0.00 -2.49 1.01 -1.08 -4.89 120.40 113.82 2osg s VAL 25 Ca 0.29 -0.09 -0.24 0.00 0.00 0.00 0.00 61.98 61.94 2osg s VAL 25 Cb 0.07 -4.89 -0.15 0.00 0.00 0.00 0.00 36.38 31.41 2osg s VAL 25 CO 0.14 -1.77 1.09 0.11 0.00 0.00 0.00 175.10 174.67 2osg h LYS 26 N 9.82 -0.57 -2.32 2.72 1.79 -1.92 0.77 116.57 126.85 2osg h LYS 26 Ca -0.17 0.04 -0.07 0.00 -2.18 0.00 0.00 60.65 58.27 2osg h LYS 26 Cb 1.05 0.13 -0.22 0.00 -1.58 0.00 0.00 32.23 31.61 2osg h LYS 26 CO 1.28 -0.27 -0.02 -2.00 -1.08 0.00 0.00 179.45 177.36 2osg s GLU 27 N -4.40 0.72 0.03 3.15 2.56 -1.26 -4.64 118.70 114.86 2osg s GLU 27 Ca -0.13 0.72 0.06 0.00 0.00 0.00 0.00 54.97 55.62 2osg s GLU 27 Cb 0.02 0.35 -0.02 0.00 2.00 0.00 0.00 34.13 36.47 2osg s GLU 27 CO 0.46 -0.11 -0.18 0.00 -0.56 0.00 0.00 175.26 174.87 2osg s MET 28 N 0.11 1.25 0.02 4.30 0.23 -1.26 -5.12 119.30 118.83 2osg s MET 28 Ca -0.02 -0.83 -0.30 0.00 -1.03 0.00 0.00 55.69 53.51 2osg s MET 28 Cb -0.04 -1.30 -0.05 0.00 -1.53 0.00 0.00 34.83 31.91 2osg s MET 28 CO 0.02 0.33 1.24 0.99 -2.03 0.00 0.00 175.02 175.57 2osg s THR 29 N -0.75 4.01 1.10 3.16 2.01 -1.26 -5.01 115.64 118.90 2osg s THR 29 Ca 0.06 1.41 -0.12 0.00 0.31 0.00 0.00 61.69 63.34 2osg s THR 29 Cb -0.08 -3.90 0.25 0.00 0.01 0.00 0.00 72.50 68.77 2osg s THR 29 CO 0.01 0.06 1.05 -0.60 -0.69 0.00 0.00 174.62 174.46 2osg s ARG 30 N 1.61 -0.38 -1.48 4.92 6.06 -1.26 -3.69 118.95 124.73 2osg s ARG 30 Ca 0.59 0.84 0.00 0.00 -2.50 0.00 0.00 55.73 54.66 2osg s ARG 30 Cb -0.29 -1.62 0.00 0.00 0.06 0.00 0.00 34.95 33.11 2osg s ARG 30 CO 0.27 -3.36 0.00 2.41 -2.50 0.00 0.00 175.30 172.11 2osg n THR 31 N -4.66 -0.80 -4.05 4.11 -1.04 -1.26 -5.00 114.28 101.57 2osg n THR 31 Ca 0.04 0.00 -0.13 0.00 -2.04 0.00 0.00 64.05 61.93 2osg n THR 31 Cb 0.55 -2.53 -0.02 0.00 -1.82 0.00 0.00 70.33 66.51 2osg n THR 31 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2osg n GLY 32 N -1.01 3.52 0.15 3.41 0.00 -1.24 -5.00 105.19 105.02 2osg n GLY 32 Ca -0.20 -2.26 0.01 0.00 0.00 0.00 0.00 46.02 43.57 2osg n GLY 32 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2osg h LEU 33 N 0.00 0.00 -0.26 0.99 4.07 -1.94 -1.62 115.31 116.55 2osg h LEU 33 Ca -0.17 0.00 -0.21 0.00 0.08 0.00 0.00 57.88 57.58 2osg h LEU 33 Cb 0.54 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.28 2osg h LEU 33 CO 0.27 0.55 -0.83 0.00 -1.08 0.00 0.00 178.44 177.35 2osg h ALA 34 N 1.45 0.44 0.08 1.53 0.00 -1.96 -2.98 119.26 117.81 2osg h ALA 34 Ca -0.01 -0.64 -0.25 0.00 0.00 0.00 0.00 54.91 54.01 2osg h ALA 34 Cb 1.09 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.85 2osg h ALA 34 CO 0.07 0.76 -1.12 1.15 0.00 0.00 0.00 179.25 180.11 2osg h THR 35 N 0.32 1.52 -0.60 0.00 2.02 -1.85 0.47 112.91 114.80 2osg h THR 35 Ca -0.06 -2.97 -0.04 0.00 0.77 0.00 0.00 66.41 64.12 2osg h THR 35 Cb 1.43 2.80 -0.03 0.00 -1.74 0.00 0.00 68.15 70.61 2osg h THR 35 CO 0.15 0.87 0.22 0.11 0.37 0.00 0.00 175.52 177.24 2osg h LYS 36 N 0.09 0.87 0.00 6.66 1.57 -1.33 -3.24 116.57 121.20 2osg h LYS 36 Ca -0.10 -0.14 -0.37 0.00 -1.87 0.00 0.00 60.65 58.18 2osg h LYS 36 Cb 1.83 -0.15 -0.07 0.00 0.08 0.00 0.00 32.23 33.92 2osg h LYS 36 CO 0.18 0.72 -2.38 -3.47 -0.57 0.00 0.00 179.45 173.94 2osg n ASP 37 N -4.31 0.80 -1.64 0.86 2.03 -1.13 -5.03 116.55 108.12 2osg n ASP 37 Ca 0.05 -0.05 -0.07 0.00 0.52 0.00 0.00 54.79 55.25 2osg n ASP 37 Cb 0.18 0.51 0.03 0.00 -0.72 0.00 0.00 41.12 41.12 2osg n ASP 37 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2osg n GLY 38 N 1.96 0.33 0.08 0.27 0.00 0.17 -4.99 105.19 103.01 2osg n GLY 38 Ca -0.36 -0.33 -0.16 0.00 0.00 0.00 0.00 46.02 45.16 2osg n GLY 38 CO 0.00 0.00 0.00 3.45 0.00 0.00 0.00 173.32 176.77 2osg h ASN 39 N -0.76 0.08 -3.60 1.61 -1.07 -1.88 -3.44 115.58 106.52 2osg h ASN 39 Ca -0.19 -0.92 -0.67 0.00 0.07 0.00 0.00 56.30 54.60 2osg h ASN 39 Cb 1.12 -0.02 -0.17 0.00 -2.07 0.00 0.00 38.32 37.17 2osg h ASN 39 CO 0.17 1.15 -0.17 -0.76 0.07 0.00 0.00 177.43 177.89 2osg s LEU 40 N -8.10 4.55 -0.05 6.14 1.43 -1.26 -5.05 118.68 116.34 2osg s LEU 40 Ca -0.20 -0.32 -0.25 0.00 -1.03 0.00 0.00 54.13 52.34 2osg s LEU 40 Cb -0.01 -2.45 -0.04 0.00 0.03 0.00 0.00 46.19 43.72 2osg s LEU 40 CO 0.70 -0.49 0.75 -1.00 0.23 0.00 0.00 176.35 176.54 2osg s HIS 41 N 2.22 3.60 -0.27 0.29 3.76 -1.26 -4.97 115.29 118.66 2osg s HIS 41 Ca 0.15 1.33 -0.33 0.00 -0.15 0.00 0.00 55.06 56.06 2osg s HIS 41 Cb -0.16 -2.85 -0.09 0.00 1.11 0.00 0.00 32.58 30.58 2osg s HIS 41 CO 0.13 0.09 2.15 0.39 -0.85 0.00 0.00 174.74 176.65 2osg n GLU 42 N 3.73 1.52 0.00 1.40 1.02 -1.26 0.05 120.64 127.10 2osg n GLU 42 Ca -0.00 0.44 0.00 0.00 -0.02 0.00 0.00 57.16 57.58 2osg n GLU 42 Cb 0.51 -2.73 0.00 0.00 -0.02 0.00 0.00 31.44 29.20 2osg n GLU 42 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2osg n GLY 43 N 5.96 1.58 3.77 0.62 0.00 0.27 -4.96 105.19 112.42 2osg n GLY 43 Ca 0.35 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.96 2osg n GLY 43 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2osg s ASP 44 N -1.75 6.53 -0.24 1.61 -1.08 0.11 -4.65 116.67 117.19 2osg s ASP 44 Ca 0.00 2.86 -0.29 0.00 -0.52 0.00 0.00 52.55 54.60 2osg s ASP 44 Cb 0.00 -2.65 0.01 0.00 -1.46 0.00 0.00 42.92 38.82 2osg s ASP 44 CO 0.00 -0.74 1.05 0.27 0.52 0.00 0.00 175.17 176.26 2osg s ILE 45 N -0.82 4.65 0.26 4.11 -4.36 -1.26 -2.63 121.20 121.15 2osg s ILE 45 Ca 0.54 1.99 -0.23 0.00 -0.26 0.00 0.00 60.65 62.69 2osg s ILE 45 Cb -0.44 -4.32 -0.09 0.00 1.25 0.00 0.00 42.46 38.86 2osg s ILE 45 CO 0.55 -0.22 0.82 -0.63 0.24 0.00 0.00 174.94 175.69 2osg s ILE 46 N 3.27 4.41 -0.20 8.37 1.01 0.68 -3.41 121.20 135.33 2osg s ILE 46 Ca 0.44 1.53 -0.02 0.00 0.00 0.00 0.00 60.65 62.61 2osg s ILE 46 Cb -0.15 -3.94 -0.12 0.00 0.01 0.00 0.00 42.46 38.27 2osg s ILE 46 CO 0.07 0.21 -0.19 -0.11 0.00 0.00 0.00 174.94 174.92 2osg n LEU 47 N 0.73 2.59 -3.70 2.97 0.00 0.17 -4.50 117.00 115.25 2osg n LEU 47 Ca -0.01 -0.01 -0.14 0.00 0.00 0.00 0.00 56.01 55.85 2osg n LEU 47 Cb 0.50 -0.66 -0.08 0.00 0.00 0.00 0.00 43.42 43.19 2osg n LEU 47 CO 0.44 0.72 0.13 -0.54 0.00 0.00 0.00 177.39 178.14 2osg s LYS 48 N -2.38 0.72 -0.07 1.96 1.02 -1.21 -2.26 119.74 117.52 2osg s LYS 48 Ca -0.27 0.07 -0.02 0.00 0.02 0.00 0.00 55.97 55.77 2osg s LYS 48 Cb 0.08 0.33 0.03 0.00 -0.52 0.00 0.00 37.83 37.75 2osg s LYS 48 CO 0.42 -0.19 0.03 0.42 -0.92 0.00 0.00 175.35 175.11 2osg s ILE 49 N -0.98 0.17 -1.49 2.17 -1.09 0.18 0.70 121.20 120.86 2osg s ILE 49 Ca -0.10 0.19 -0.13 0.00 -2.23 0.00 0.00 60.65 58.39 2osg s ILE 49 Cb -0.04 -0.41 0.07 0.00 -1.58 0.00 0.00 42.46 40.50 2osg s ILE 49 CO 0.05 0.18 1.04 -3.20 -1.23 0.00 0.00 174.94 171.77 2osg n ASN 50 N 5.21 -5.19 -0.21 3.58 2.85 0.16 -0.75 115.26 120.91 2osg n ASN 50 Ca -0.06 -0.72 -0.03 0.00 -0.11 0.00 0.00 54.58 53.67 2osg n ASN 50 Cb 0.50 -4.16 -0.01 0.00 1.24 0.00 0.00 39.78 37.34 2osg n ASN 50 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2osg n GLY 51 N -1.77 0.58 3.30 8.20 0.00 -1.26 -5.00 105.19 109.24 2osg n GLY 51 Ca 0.03 -0.36 -0.31 0.00 0.00 0.00 0.00 46.02 45.39 2osg n GLY 51 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2osg s THR 52 N -1.95 2.03 0.53 2.61 2.01 0.07 -5.11 115.64 115.82 2osg s THR 52 Ca 0.00 -1.09 -0.22 0.00 0.31 0.00 0.00 61.69 60.68 2osg s THR 52 Cb 0.00 -1.68 -0.06 0.00 0.01 0.00 0.00 72.50 70.77 2osg s THR 52 CO 0.00 0.57 1.37 0.52 -0.69 0.00 0.00 174.62 176.39 2osg n VAL 53 N 2.49 3.65 -1.27 3.82 0.31 -1.26 0.50 118.33 126.56 2osg n VAL 53 Ca -0.16 -0.50 0.08 0.00 -0.01 0.00 0.00 64.34 63.75 2osg n VAL 53 Cb 0.51 -1.69 0.11 0.00 -0.91 0.00 0.00 33.84 31.86 2osg n VAL 53 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 2osg n THR 54 N -0.89 1.50 -5.00 2.52 -1.04 -0.96 -4.72 114.28 105.69 2osg n THR 54 Ca 0.09 -1.81 -0.32 0.00 -2.04 0.00 0.00 64.05 59.97 2osg n THR 54 Cb 0.44 -0.08 -0.15 0.00 -1.82 0.00 0.00 70.33 68.71 2osg n THR 54 CO 0.00 0.00 0.00 -0.70 -0.64 0.00 0.00 175.07 173.73 2osg s GLU 55 N -2.28 3.04 0.00 -2.82 2.12 -1.26 -1.58 118.70 115.92 2osg s GLU 55 Ca 0.25 -0.78 0.00 0.00 0.36 0.00 0.00 54.97 54.80 2osg s GLU 55 Cb 0.22 -2.43 0.00 0.00 0.26 0.00 0.00 34.13 32.19 2osg s GLU 55 CO 0.02 0.28 0.00 0.09 -0.54 0.00 0.00 175.26 175.12 2osg n ASN 56 N 3.27 0.00 -4.40 -1.70 3.02 0.20 -4.98 115.26 110.68 2osg n ASN 56 Ca -0.18 0.00 -0.29 0.00 -0.03 0.00 0.00 54.58 54.08 2osg n ASN 56 Cb 0.53 -0.78 0.21 0.00 -0.61 0.00 0.00 39.78 39.13 2osg n ASN 56 CO 0.00 0.00 0.00 -0.32 -2.62 0.00 0.00 177.26 174.32 2osg s MET 57 N -0.11 -0.35 0.16 3.52 1.75 -1.26 -4.88 119.30 118.13 2osg s MET 57 Ca 0.00 0.38 -0.13 0.00 -1.25 0.00 0.00 55.69 54.69 2osg s MET 57 Cb 0.00 -1.66 -0.07 0.00 2.84 0.00 0.00 34.83 35.94 2osg s MET 57 CO 0.00 -3.23 0.53 -1.12 -0.65 0.00 0.00 175.02 170.56 2osg s SER 58 N -3.43 6.76 0.28 1.11 0.01 -1.26 -4.92 113.70 112.24 2osg s SER 58 Ca 0.67 1.01 -0.03 0.00 1.31 0.00 0.00 55.95 58.91 2osg s SER 58 Cb -0.17 -2.26 0.37 0.00 0.21 0.00 0.00 66.02 64.16 2osg s SER 58 CO 0.58 0.07 1.92 0.25 0.41 0.00 0.00 173.24 176.47 2osg h LEU 59 N 3.33 0.99 -0.25 2.44 6.46 -1.99 -0.49 115.31 125.81 2osg h LEU 59 Ca -0.48 -0.06 -0.01 0.00 -0.12 0.00 0.00 57.88 57.20 2osg h LEU 59 Cb 1.19 -0.25 -0.01 0.00 -0.73 0.00 0.00 40.66 40.86 2osg h LEU 59 CO 0.67 0.76 0.10 0.71 -0.62 0.00 0.00 178.44 180.06 2osg h THR 60 N 1.13 1.17 -0.45 1.05 1.35 -1.99 -0.73 112.91 114.45 2osg h THR 60 Ca 0.29 -0.52 -0.03 0.00 -0.55 0.00 0.00 66.41 65.60 2osg h THR 60 Cb -0.04 1.06 -0.02 0.00 -1.73 0.00 0.00 68.15 67.42 2osg h THR 60 CO -0.05 0.17 0.15 -0.78 -0.25 0.00 0.00 175.52 174.76 2osg h ASP 61 N 0.24 0.64 -0.81 5.36 3.58 -1.89 -0.87 116.42 122.68 2osg h ASP 61 Ca 0.08 -0.20 0.01 0.00 0.42 0.00 0.00 57.03 57.34 2osg h ASP 61 Cb 0.18 -0.17 -0.04 0.00 1.72 0.00 0.00 39.33 41.02 2osg h ASP 61 CO -0.01 0.67 0.53 0.00 -2.88 0.00 0.00 179.24 177.55 2osg h ALA 62 N 1.00 1.02 -0.57 -0.78 0.00 -0.97 0.98 119.26 119.93 2osg h ALA 62 Ca 0.14 -0.06 -0.10 0.00 0.00 0.00 0.00 54.91 54.89 2osg h ALA 62 Cb 0.25 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 2osg h ALA 62 CO -0.01 0.44 -0.05 -0.09 0.00 0.00 0.00 179.25 179.54 2osg h ARG 63 N 1.10 1.04 -0.48 0.00 2.43 -0.91 -2.63 114.38 114.92 2osg h ARG 63 Ca 0.30 -0.35 -0.11 0.00 -0.81 0.00 0.00 59.98 59.01 2osg h ARG 63 Cb -0.12 -0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 29.33 2osg h ARG 63 CO -0.06 1.04 -0.12 -0.22 -1.51 0.00 0.00 179.97 179.09 2osg h LYS 64 N 0.94 0.89 -0.66 0.20 1.63 -0.63 -2.17 116.57 116.77 2osg h LYS 64 Ca 0.16 -0.32 0.00 0.00 -0.85 0.00 0.00 60.65 59.64 2osg h LYS 64 Cb 0.61 -0.06 -0.03 0.00 -0.60 0.00 0.00 32.23 32.14 2osg h LYS 64 CO 0.04 0.96 0.42 1.25 -3.45 0.00 0.00 179.45 178.67 2osg h LEU 65 N 0.79 0.77 -0.65 5.20 5.85 -0.63 0.22 115.31 126.85 2osg h LEU 65 Ca 0.13 -0.03 -0.12 0.00 0.84 0.00 0.00 57.88 58.69 2osg h LEU 65 Cb 0.65 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.47 2osg h LEU 65 CO 0.05 0.57 -0.28 0.40 -0.34 0.00 0.00 178.44 178.84 2osg h ILE 66 N 0.89 1.28 -0.02 4.05 2.04 -1.34 -0.80 117.51 123.60 2osg h ILE 66 Ca 0.24 -1.41 -0.01 0.00 1.00 0.00 0.00 64.86 64.68 2osg h ILE 66 Cb -0.08 1.30 -0.00 0.00 -0.74 0.00 0.00 36.82 37.30 2osg h ILE 66 CO -0.05 0.46 -0.02 -0.33 0.00 0.00 0.00 178.15 178.22 2osg h GLU 67 N 0.64 0.05 -0.04 2.37 3.07 -0.95 -3.14 114.58 116.59 2osg h GLU 67 Ca 0.08 -0.03 -0.05 0.00 -0.50 0.00 0.00 59.36 58.86 2osg h GLU 67 Cb 0.80 -0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.70 2osg h GLU 67 CO 0.07 0.49 -0.23 1.57 -1.40 0.00 0.00 179.01 179.51 2osg h LYS 68 N -0.38 0.06 -3.12 2.33 2.10 -0.59 -3.26 116.57 113.71 2osg h LYS 68 Ca 0.00 -0.01 -0.69 0.00 -2.00 0.00 0.00 60.65 57.95 2osg h LYS 68 Cb 0.48 -0.01 -0.01 0.00 -0.90 0.00 0.00 32.23 31.79 2osg h LYS 68 CO 0.00 0.28 3.46 0.43 -2.00 0.00 0.00 179.45 181.63 2osg n SER 69 N -4.25 7.74 -4.79 7.07 7.64 -0.31 -4.95 113.62 121.78 2osg n SER 69 Ca -0.02 -2.72 -0.36 0.00 1.01 0.00 0.00 58.87 56.78 2osg n SER 69 Cb 0.30 -1.54 -0.04 0.00 -1.01 0.00 0.00 64.21 61.92 2osg n SER 69 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2osg s ARG 70 N 1.75 4.02 0.00 1.43 1.04 -1.23 -4.37 118.95 121.59 2osg s ARG 70 Ca 0.63 1.49 0.00 0.00 -1.04 0.00 0.00 55.73 56.80 2osg s ARG 70 Cb 0.17 -2.39 0.00 0.00 -2.04 0.00 0.00 34.95 30.69 2osg s ARG 70 CO -0.07 -0.26 0.00 0.41 -0.04 0.00 0.00 175.30 175.34 2osg n GLY 71 N 0.17 1.09 2.85 3.88 0.00 -1.26 -4.89 105.19 107.03 2osg n GLY 71 Ca 0.06 -0.67 -0.21 0.00 0.00 0.00 0.00 46.02 45.21 2osg n GLY 71 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2osg s LYS 72 N 0.00 0.73 0.03 1.61 1.02 -1.26 -5.15 119.74 116.72 2osg s LYS 72 Ca 0.00 -0.03 0.06 0.00 0.02 0.00 0.00 55.97 56.02 2osg s LYS 72 Cb 0.00 -0.85 -0.02 0.00 -0.52 0.00 0.00 37.83 36.44 2osg s LYS 72 CO 0.00 -0.15 -0.19 -0.48 -0.92 0.00 0.00 175.35 173.61 2osg s LEU 73 N 1.22 2.14 -0.09 3.17 0.05 -1.26 -5.02 118.68 118.89 2osg s LEU 73 Ca -0.06 -0.46 -0.05 0.00 0.05 0.00 0.00 54.13 53.60 2osg s LEU 73 Cb -0.14 -0.90 -0.04 0.00 -2.05 0.00 0.00 46.19 43.06 2osg s LEU 73 CO -0.02 0.15 0.12 -1.58 -0.55 0.00 0.00 176.35 174.48 2osg s GLN 74 N -0.99 3.34 -0.05 1.48 2.00 -1.26 -4.94 119.66 119.23 2osg s GLN 74 Ca 0.06 -0.23 0.01 0.00 -2.00 0.00 0.00 55.36 53.20 2osg s GLN 74 Cb -0.08 -3.09 0.02 0.00 0.80 0.00 0.00 33.01 30.66 2osg s GLN 74 CO 0.01 0.74 -0.05 -0.51 -0.50 0.00 0.00 175.29 174.98 2osg s LEU 75 N -1.21 1.29 -0.12 3.68 1.02 -1.26 -0.67 118.68 121.40 2osg s LEU 75 Ca 0.17 -0.16 -0.03 0.00 0.02 0.00 0.00 54.13 54.14 2osg s LEU 75 Cb -0.12 -0.53 -0.03 0.00 0.02 0.00 0.00 46.19 45.53 2osg s LEU 75 CO 0.07 -0.06 -0.02 -0.69 0.02 0.00 0.00 176.35 175.67 2osg s VAL 76 N 1.04 4.10 0.14 -1.59 1.01 0.22 -4.97 120.40 120.34 2osg s VAL 76 Ca -0.09 -0.30 0.00 0.00 0.00 0.00 0.00 61.98 61.59 2osg s VAL 76 Cb -0.14 -2.76 -0.04 0.00 0.00 0.00 0.00 36.38 33.43 2osg s VAL 76 CO -0.00 0.54 0.03 0.68 0.00 0.00 0.00 175.10 176.35 2osg s VAL 77 N -0.21 0.34 0.00 2.92 -7.23 -1.26 0.43 120.40 115.39 2osg s VAL 77 Ca 0.05 -1.93 -0.20 0.00 -1.81 0.00 0.00 61.98 58.09 2osg s VAL 77 Cb -0.13 -2.03 -0.06 0.00 0.56 0.00 0.00 36.38 34.72 2osg s VAL 77 CO 0.02 -0.51 0.56 -0.22 -0.31 0.00 0.00 175.10 174.65 2osg s LEU 78 N -3.09 4.43 -0.43 1.32 2.96 -1.22 -4.89 118.68 117.76 2osg s LEU 78 Ca 0.23 1.13 -0.02 0.00 -0.22 0.00 0.00 54.13 55.25 2osg s LEU 78 Cb 0.07 -2.87 0.22 0.00 0.50 0.00 0.00 46.19 44.11 2osg s LEU 78 CO 0.02 0.14 2.20 -2.11 -1.32 0.00 0.00 176.35 175.28 2osg n ARG 79 N 2.54 2.12 -1.51 1.98 1.85 -1.26 -4.92 116.66 117.46 2osg n ARG 79 Ca -0.08 -2.10 -0.49 0.00 -1.00 0.00 0.00 57.85 54.18 2osg n ARG 79 Cb 0.51 -1.87 -0.06 0.00 -1.05 0.00 0.00 32.46 29.99 2osg n ARG 79 CO 0.00 0.00 0.00 -3.47 -0.01 0.00 0.00 177.63 174.15 2osg n ASP 80 N 0.23 2.49 -4.55 2.89 2.03 -1.26 -4.81 116.55 113.56 2osg n ASP 80 Ca 0.41 0.43 -0.28 0.00 0.52 0.00 0.00 54.79 55.87 2osg n ASP 80 Cb 0.57 -1.33 -0.05 0.00 -0.72 0.00 0.00 41.12 39.60 2osg n ASP 80 CO 0.00 0.00 0.00 -0.94 -1.92 0.00 0.00 177.20 174.34 2osg s SER 81 N 7.15 4.50 0.13 1.67 1.04 -1.26 -4.88 113.70 122.04 2osg s SER 81 Ca 1.06 0.36 -0.12 0.00 0.48 0.00 0.00 55.95 57.73 2osg s SER 81 Cb -0.74 -2.53 0.01 0.00 0.10 0.00 0.00 66.02 62.86 2osg s SER 81 CO 0.47 -3.11 0.30 -0.76 0.98 0.00 0.00 173.24 171.12 2osg s LEU 82 N 12.23 0.89 0.00 2.42 1.43 -1.26 -5.34 118.68 129.06 2osg s LEU 82 Ca 0.87 -0.59 0.00 0.00 -1.03 0.00 0.00 54.13 53.38 2osg s LEU 82 Cb -0.13 1.41 0.00 0.00 0.03 0.00 0.00 46.19 47.50 2osg s LEU 82 CO 0.15 -0.83 0.43 -0.62 0.23 0.00 0.00 176.35 175.71