#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 -0.18 0.15 3.17 2.07 -1.26 -5.16 121.20 120.00 2osg s ILE 2 Ca 0.00 0.31 0.06 0.00 -1.41 0.00 0.00 60.65 59.61 2osg s ILE 2 Cb 0.00 -0.25 -0.04 0.00 0.13 0.00 0.00 42.46 42.30 2osg s ILE 2 CO 0.00 0.13 -0.14 -0.83 -1.91 0.00 0.00 174.94 172.20 2osg s GLY 3 N 1.92 1.19 -0.04 1.50 0.00 -1.26 -5.15 107.32 105.48 2osg s GLY 3 Ca -0.01 -1.45 0.02 0.00 0.00 0.00 0.00 44.72 43.29 2osg s GLY 3 CO -0.05 -1.52 -0.09 0.14 0.00 0.00 0.00 173.10 171.58 2osg s VAL 4 N -2.62 0.79 -0.39 1.40 1.01 -1.26 -5.12 120.40 114.21 2osg s VAL 4 Ca 0.15 -0.33 -0.16 0.00 0.00 0.00 0.00 61.98 61.64 2osg s VAL 4 Cb -0.02 -0.72 0.01 0.00 0.00 0.00 0.00 36.38 35.65 2osg s VAL 4 CO 0.04 0.26 0.36 -0.76 0.00 0.00 0.00 175.10 174.99 2osg s LEU 5 N 0.41 4.82 -0.16 3.92 1.43 -1.26 -5.06 118.68 122.78 2osg s LEU 5 Ca -0.07 -0.63 -0.07 0.00 -1.03 0.00 0.00 54.13 52.33 2osg s LEU 5 Cb -0.11 -2.28 -0.04 0.00 0.03 0.00 0.00 46.19 43.79 2osg s LEU 5 CO 0.01 -0.45 0.09 -0.22 0.23 0.00 0.00 176.35 176.01 2osg s LEU 6 N 1.93 4.05 0.32 1.79 2.96 -1.26 -5.10 118.68 123.36 2osg s LEU 6 Ca 0.09 0.24 0.08 0.00 -0.22 0.00 0.00 54.13 54.32 2osg s LEU 6 Cb -0.18 -2.01 -0.04 0.00 0.50 0.00 0.00 46.19 44.47 2osg s LEU 6 CO 0.12 0.27 0.19 -0.32 -1.32 0.00 0.00 176.35 175.29 2osg s MET 7 N -0.19 2.55 -0.33 1.98 -2.45 -1.26 -5.10 119.30 114.50 2osg s MET 7 Ca 0.09 -1.39 -0.14 0.00 -1.25 0.00 0.00 55.69 53.00 2osg s MET 7 Cb -0.12 -2.33 -0.02 0.00 1.25 0.00 0.00 34.83 33.62 2osg s MET 7 CO 0.01 0.15 0.31 0.21 1.05 0.00 0.00 175.02 176.76 2osg s LYS 8 N -3.89 3.64 -0.42 4.11 2.20 -1.26 -4.95 119.74 119.17 2osg s LYS 8 Ca 0.38 -0.41 0.05 0.00 -0.36 0.00 0.00 55.97 55.62 2osg s LYS 8 Cb -0.05 -3.77 0.60 0.00 -1.51 0.00 0.00 37.83 33.10 2osg s LYS 8 CO 0.24 -0.44 1.78 0.45 -0.36 0.00 0.00 175.35 177.02 2osg n SER 9 N 5.27 3.67 -3.63 1.43 2.88 -1.26 -4.89 113.62 117.09 2osg n SER 9 Ca -0.10 -3.68 -0.04 0.00 -1.33 0.00 0.00 58.87 53.71 2osg n SER 9 Cb 0.50 -0.78 -0.06 0.00 -0.75 0.00 0.00 64.21 63.12 2osg n SER 9 CO 0.00 0.00 0.00 -0.13 -1.23 0.00 0.00 175.04 173.68 2osg s ARG 10 N -3.33 0.61 -1.02 -1.46 0.52 -1.26 -5.05 118.95 107.96 2osg s ARG 10 Ca 0.54 1.27 -0.08 0.00 -0.52 0.00 0.00 55.73 56.94 2osg s ARG 10 Cb 0.46 0.46 -0.11 0.00 0.52 0.00 0.00 34.95 36.29 2osg s ARG 10 CO 0.07 -0.16 3.08 0.00 0.02 0.00 0.00 175.30 178.30 2osg n ALA 11 N 4.79 7.05 0.00 2.13 0.00 -1.26 -4.74 120.51 128.48 2osg n ALA 11 Ca -0.16 -3.06 0.00 0.00 0.00 0.00 0.00 53.44 50.22 2osg n ALA 11 Cb 0.54 -2.90 0.00 0.00 0.00 0.00 0.00 19.45 17.10 2osg n ALA 11 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 2osg n ASN 12 N 2.82 0.00 -1.11 0.00 6.94 -1.26 -5.15 115.26 117.50 2osg n ASN 12 Ca 0.64 0.00 0.00 0.00 -0.02 0.00 0.00 54.58 55.20 2osg n ASN 12 Cb 0.46 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.88 2osg n ASN 12 CO 0.00 0.00 0.00 1.21 -1.03 0.00 0.00 177.26 177.44 2osg n GLU 13 N -0.04 -3.15 -0.90 -3.83 4.07 -1.26 -4.98 120.64 110.54 2osg n GLU 13 Ca 0.00 2.32 -0.30 0.00 -0.06 0.00 0.00 57.16 59.12 2osg n GLU 13 Cb 0.00 -2.58 0.25 0.00 -0.06 0.00 0.00 31.44 29.05 2osg n GLU 13 CO 0.00 0.00 0.00 -1.21 -0.06 0.00 0.00 177.13 175.86 2osg s GLU 14 N -3.81 -1.66 0.57 5.31 8.01 -1.26 -4.86 118.70 121.00 2osg s GLU 14 Ca 0.00 -0.00 0.29 0.00 0.01 0.00 0.00 54.97 55.27 2osg s GLU 14 Cb 0.00 -1.54 1.47 0.00 -4.31 0.00 0.00 34.13 29.75 2osg s GLU 14 CO 0.00 -4.01 1.90 1.88 0.01 0.00 0.00 175.26 175.04 2osg h TYR 15 N -2.80 0.00 0.00 1.61 -1.99 -1.98 -3.45 116.97 108.36 2osg h TYR 15 Ca -0.45 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.28 2osg h TYR 15 Cb 1.31 0.00 0.00 0.00 2.00 0.00 0.00 36.73 40.04 2osg h TYR 15 CO -2.38 0.00 0.00 0.41 -0.00 0.00 0.00 178.16 176.19 2osg n GLY 16 N -1.58 0.54 3.54 3.88 0.00 -1.26 -5.03 105.19 105.28 2osg n GLY 16 Ca 0.11 -0.69 -0.41 0.00 0.00 0.00 0.00 46.02 45.04 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 4.47 -0.37 0.99 1.43 -1.26 -5.05 118.68 118.89 2osg s LEU 17 Ca 0.00 -0.29 -0.19 0.00 -1.03 0.00 0.00 54.13 52.62 2osg s LEU 17 Cb 0.00 -2.30 0.00 0.00 0.03 0.00 0.00 46.19 43.93 2osg s LEU 17 CO 0.00 -0.32 0.54 -0.60 0.23 0.00 0.00 176.35 176.20 2osg s ARG 18 N 1.96 3.51 -0.21 1.70 6.06 -1.26 -5.05 118.95 125.66 2osg s ARG 18 Ca 0.11 -0.24 -0.07 0.00 -2.50 0.00 0.00 55.73 53.03 2osg s ARG 18 Cb -0.17 -3.85 -0.03 0.00 0.06 0.00 0.00 34.95 30.96 2osg s ARG 18 CO 0.11 -0.74 0.05 -0.48 -2.50 0.00 0.00 175.30 171.74 2osg s LEU 19 N 2.48 3.52 0.00 -0.88 2.34 -1.26 -5.10 118.68 119.78 2osg s LEU 19 Ca 0.19 -0.11 0.04 0.00 0.06 0.00 0.00 54.13 54.31 2osg s LEU 19 Cb -0.15 -1.91 0.04 0.00 -0.56 0.00 0.00 46.19 43.61 2osg s LEU 19 CO 0.15 0.07 0.30 0.61 -1.06 0.00 0.00 176.35 176.41 2osg n GLY 20 N 4.24 2.80 3.01 -3.48 0.00 -1.26 -5.15 105.19 105.34 2osg n GLY 20 Ca -0.16 -2.26 -0.11 0.00 0.00 0.00 0.00 46.02 43.49 2osg n GLY 20 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2osg s SER 21 N -3.27 0.06 -0.04 1.61 1.04 -1.26 -5.03 113.70 106.80 2osg s SER 21 Ca 0.23 -0.17 0.04 0.00 0.48 0.00 0.00 55.95 56.53 2osg s SER 21 Cb -0.02 0.16 -0.00 0.00 0.10 0.00 0.00 66.02 66.26 2osg s SER 21 CO 0.14 -0.23 -0.15 0.00 0.98 0.00 0.00 173.24 173.98 2osg s GLN 22 N -0.91 1.60 -0.24 4.02 -2.07 -1.26 0.10 119.66 120.91 2osg s GLN 22 Ca -0.10 -0.55 -0.22 0.00 -1.82 0.00 0.00 55.36 52.67 2osg s GLN 22 Cb -0.06 -1.41 -0.02 0.00 -1.09 0.00 0.00 33.01 30.43 2osg s GLN 22 CO 0.00 0.22 0.70 0.42 -1.32 0.00 0.00 175.29 175.31 2osg s ILE 23 N 0.06 4.94 0.40 3.63 1.01 -0.65 -4.95 121.20 125.64 2osg s ILE 23 Ca -0.03 1.30 0.04 0.00 0.00 0.00 0.00 60.65 61.96 2osg s ILE 23 Cb -0.11 -4.00 -0.06 0.00 0.01 0.00 0.00 42.46 38.31 2osg s ILE 23 CO 0.02 0.01 0.04 0.72 0.00 0.00 0.00 174.94 175.72 2osg s PHE 24 N 2.53 2.14 -0.71 3.97 -0.71 -1.26 0.04 117.98 123.97 2osg s PHE 24 Ca 0.30 -0.89 -0.26 0.00 -1.04 0.00 0.00 56.93 55.04 2osg s PHE 24 Cb -0.15 -1.52 0.04 0.00 -1.21 0.00 0.00 43.02 40.18 2osg s PHE 24 CO 0.08 0.18 1.19 0.08 -1.34 0.00 0.00 175.22 175.41 2osg s VAL 25 N -2.98 3.90 -0.03 -2.49 1.01 -0.92 -4.88 120.40 114.01 2osg s VAL 25 Ca 0.29 0.20 -0.18 0.00 0.00 0.00 0.00 61.98 62.28 2osg s VAL 25 Cb 0.07 -4.85 -0.10 0.00 0.00 0.00 0.00 36.38 31.50 2osg s VAL 25 CO 0.14 -1.73 0.75 0.50 0.00 0.00 0.00 175.10 174.76 2osg h LYS 26 N 9.88 -0.60 -2.93 2.72 3.64 -1.92 1.01 116.57 128.38 2osg h LYS 26 Ca -0.28 0.04 -0.15 0.00 -1.27 0.00 0.00 60.65 58.99 2osg h LYS 26 Cb 1.06 0.14 -0.26 0.00 -0.41 0.00 0.00 32.23 32.75 2osg h LYS 26 CO 1.25 -0.38 -0.37 -2.00 -2.27 0.00 0.00 179.45 175.68 2osg s GLU 27 N -3.64 0.33 0.14 1.90 2.56 -1.26 -4.62 118.70 114.11 2osg s GLU 27 Ca -0.10 0.52 0.10 0.00 0.00 0.00 0.00 54.97 55.49 2osg s GLU 27 Cb 0.01 0.08 -0.04 0.00 2.00 0.00 0.00 34.13 36.18 2osg s GLU 27 CO 0.29 -0.09 -0.24 0.00 -0.56 0.00 0.00 175.26 174.67 2osg s MET 28 N 0.62 1.33 0.23 4.30 0.23 -1.26 -5.11 119.30 119.64 2osg s MET 28 Ca -0.04 -1.33 -0.30 0.00 -1.03 0.00 0.00 55.69 52.99 2osg s MET 28 Cb -0.05 -1.67 -0.10 0.00 -1.53 0.00 0.00 34.83 31.48 2osg s MET 28 CO -0.04 0.38 1.45 -0.08 -2.03 0.00 0.00 175.02 174.70 2osg s THR 29 N -1.32 2.70 0.45 3.16 -1.32 -1.26 -4.98 115.64 113.07 2osg s THR 29 Ca 0.13 0.57 -0.23 0.00 -1.21 0.00 0.00 61.69 60.96 2osg s THR 29 Cb -0.09 -3.37 -0.08 0.00 -1.51 0.00 0.00 72.50 67.45 2osg s THR 29 CO 0.06 0.09 1.12 0.00 -2.21 0.00 0.00 174.62 173.67 2osg s ARG 30 N -0.17 3.85 -1.37 7.08 1.70 -1.26 -3.34 118.95 125.44 2osg s ARG 30 Ca 0.60 1.64 -0.03 0.00 -0.47 0.00 0.00 55.73 57.48 2osg s ARG 30 Cb -0.42 -2.38 0.00 0.00 -0.57 0.00 0.00 34.95 31.59 2osg s ARG 30 CO 0.41 -0.45 0.36 2.41 -1.08 0.00 0.00 175.30 176.95 2osg n THR 31 N -0.48 -1.43 -3.16 4.99 -1.04 -1.26 -5.01 114.28 106.88 2osg n THR 31 Ca 0.07 0.00 -0.04 0.00 -2.04 0.00 0.00 64.05 62.04 2osg n THR 31 Cb 0.49 -2.95 0.01 0.00 -1.82 0.00 0.00 70.33 66.06 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 -1.29 2.23 0.17 3.41 0.00 -1.21 -4.91 105.19 103.59 2osg n GLY 32 Ca -0.13 -2.16 -0.02 0.00 0.00 0.00 0.00 46.02 43.71 2osg n GLY 32 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2osg h LEU 33 N 0.00 0.16 -0.32 0.99 6.46 -1.95 -0.66 115.31 120.00 2osg h LEU 33 Ca -0.05 -0.08 -0.20 0.00 -0.12 0.00 0.00 57.88 57.43 2osg h LEU 33 Cb 0.23 -0.05 -0.01 0.00 -0.73 0.00 0.00 40.66 40.11 2osg h LEU 33 CO 0.08 0.65 -0.83 0.00 -0.62 0.00 0.00 178.44 177.71 2osg h ALA 34 N 1.36 0.53 0.08 1.25 0.00 -1.95 -3.02 119.26 117.51 2osg h ALA 34 Ca 0.00 -0.67 -0.25 0.00 0.00 0.00 0.00 54.91 53.99 2osg h ALA 34 Cb 0.95 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.68 2osg h ALA 34 CO 0.07 0.83 -1.13 1.15 0.00 0.00 0.00 179.25 180.17 2osg h THR 35 N 0.20 1.52 -0.50 0.00 2.02 -1.81 0.49 112.91 114.83 2osg h THR 35 Ca -0.05 -3.00 -0.05 0.00 0.77 0.00 0.00 66.41 64.08 2osg h THR 35 Cb 1.43 2.82 -0.02 0.00 -1.74 0.00 0.00 68.15 70.64 2osg h THR 35 CO 0.14 0.87 0.09 0.50 0.37 0.00 0.00 175.52 177.49 2osg h LYS 36 N 0.08 0.78 0.00 6.66 3.64 -1.15 -3.23 116.57 123.35 2osg h LYS 36 Ca -0.10 -0.17 -0.36 0.00 -1.27 0.00 0.00 60.65 58.75 2osg h LYS 36 Cb 1.84 -0.11 -0.07 0.00 -0.41 0.00 0.00 32.23 33.48 2osg h LYS 36 CO 0.18 0.73 -2.36 -3.47 -2.27 0.00 0.00 179.45 172.26 2osg n ASP 37 N -4.26 0.22 -2.22 4.20 2.03 -1.14 -5.03 116.55 110.34 2osg n ASP 37 Ca 0.03 -0.01 -0.11 0.00 0.52 0.00 0.00 54.79 55.23 2osg n ASP 37 Cb 0.24 0.92 0.05 0.00 -0.72 0.00 0.00 41.12 41.61 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 1.81 0.08 0.20 0.27 0.00 0.17 -4.96 105.19 102.76 2osg n GLY 38 Ca -0.33 -0.18 -0.16 0.00 0.00 0.00 0.00 46.02 45.35 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 -1.22 0.80 -3.73 1.61 -1.07 -1.88 -3.45 115.58 106.65 2osg h ASN 39 Ca -0.31 -0.58 -0.51 0.00 0.07 0.00 0.00 56.30 54.97 2osg h ASN 39 Cb 1.19 -0.24 -0.32 0.00 -2.07 0.00 0.00 38.32 36.88 2osg h ASN 39 CO 0.28 1.37 -0.82 -0.76 0.07 0.00 0.00 177.43 177.58 2osg s LEU 40 N -8.14 1.80 0.03 6.14 1.43 -1.26 -5.04 118.68 113.64 2osg s LEU 40 Ca -0.09 -0.29 -0.01 0.00 -1.03 0.00 0.00 54.13 52.71 2osg s LEU 40 Cb 0.08 -0.82 -0.04 0.00 0.03 0.00 0.00 46.19 45.45 2osg s LEU 40 CO 0.90 0.09 0.20 -1.00 0.23 0.00 0.00 176.35 176.77 2osg s HIS 41 N 0.26 3.53 -0.17 0.29 3.76 -1.26 -4.92 115.29 116.78 2osg s HIS 41 Ca -0.07 0.31 -0.29 0.00 -0.15 0.00 0.00 55.06 54.86 2osg s HIS 41 Cb -0.12 -1.80 -0.06 0.00 1.11 0.00 0.00 32.58 31.71 2osg s HIS 41 CO 0.02 0.61 2.17 0.39 -0.85 0.00 0.00 174.74 177.08 2osg n GLU 42 N 0.57 2.09 0.00 1.40 1.02 -1.26 -1.15 120.64 123.31 2osg n GLU 42 Ca -0.07 0.63 0.00 0.00 -0.02 0.00 0.00 57.16 57.69 2osg n GLU 42 Cb 0.52 -3.14 0.00 0.00 -0.02 0.00 0.00 31.44 28.80 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 5.55 1.96 3.74 0.62 0.00 0.35 -4.96 105.19 112.45 2osg n GLY 43 Ca 0.29 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.89 2osg n GLY 43 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2osg s ASP 44 N -1.83 6.52 -0.61 1.61 1.11 -0.30 -4.62 116.67 118.55 2osg s ASP 44 Ca 0.00 2.77 -0.27 0.00 0.18 0.00 0.00 52.55 55.24 2osg s ASP 44 Cb 0.00 -2.62 0.03 0.00 1.07 0.00 0.00 42.92 41.40 2osg s ASP 44 CO 0.00 -0.82 1.14 0.27 1.18 0.00 0.00 175.17 176.94 2osg s ILE 45 N 0.31 4.06 0.56 0.77 -4.36 -1.26 -2.17 121.20 119.11 2osg s ILE 45 Ca 0.64 0.62 -0.20 0.00 -0.26 0.00 0.00 60.65 61.45 2osg s ILE 45 Cb -0.45 -4.72 -0.05 0.00 1.25 0.00 0.00 42.46 38.50 2osg s ILE 45 CO 0.42 -1.39 1.23 -0.63 0.24 0.00 0.00 174.94 174.80 2osg s ILE 46 N 4.83 2.63 -0.18 8.37 1.01 0.11 -3.00 121.20 134.96 2osg s ILE 46 Ca 0.38 0.42 -0.05 0.00 0.00 0.00 0.00 60.65 61.40 2osg s ILE 46 Cb -0.09 -3.19 -0.09 0.00 0.01 0.00 0.00 42.46 39.10 2osg s ILE 46 CO 0.21 -0.06 -0.20 -0.11 0.00 0.00 0.00 174.94 174.79 2osg n LEU 47 N -1.26 2.00 -3.77 2.97 0.00 0.29 -4.46 117.00 112.78 2osg n LEU 47 Ca 0.12 0.09 -0.13 0.00 0.00 0.00 0.00 56.01 56.09 2osg n LEU 47 Cb 0.48 -0.56 -0.09 0.00 0.00 0.00 0.00 43.42 43.25 2osg n LEU 47 CO 0.47 0.55 0.01 -0.54 0.00 0.00 0.00 177.39 177.88 2osg s LYS 48 N -2.34 0.61 -0.13 1.96 1.02 -1.21 -0.81 119.74 118.84 2osg s LYS 48 Ca -0.25 -0.08 -0.01 0.00 0.02 0.00 0.00 55.97 55.66 2osg s LYS 48 Cb 0.08 0.27 0.03 0.00 -0.52 0.00 0.00 37.83 37.70 2osg s LYS 48 CO 0.35 -0.16 -0.06 0.42 -0.92 0.00 0.00 175.35 174.99 2osg s ILE 49 N -1.06 1.02 -1.06 2.17 1.01 0.25 -0.05 121.20 123.48 2osg s ILE 49 Ca -0.11 -0.40 -0.04 0.00 0.00 0.00 0.00 60.65 60.10 2osg s ILE 49 Cb -0.05 -1.11 0.03 0.00 0.01 0.00 0.00 42.46 41.34 2osg s ILE 49 CO 0.03 0.26 0.20 0.59 0.00 0.00 0.00 174.94 176.02 2osg n ASN 50 N 4.93 -3.62 0.00 3.58 4.13 0.92 0.03 115.26 125.23 2osg n ASN 50 Ca -0.12 -0.01 0.00 0.00 1.68 0.00 0.00 54.58 56.13 2osg n ASN 50 Cb 0.49 -3.05 0.00 0.00 -1.54 0.00 0.00 39.78 35.68 2osg n ASN 50 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2osg n GLY 51 N -0.93 0.67 3.25 7.41 0.00 -1.26 -4.99 105.19 109.35 2osg n GLY 51 Ca -0.08 -0.41 -0.31 0.00 0.00 0.00 0.00 46.02 45.22 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 -2.00 1.97 0.43 2.61 2.01 0.10 -5.11 115.64 115.65 2osg s THR 52 Ca 0.00 -1.03 -0.26 0.00 0.31 0.00 0.00 61.69 60.72 2osg s THR 52 Cb 0.00 -1.67 -0.09 0.00 0.01 0.00 0.00 72.50 70.75 2osg s THR 52 CO 0.00 0.55 1.33 0.52 -0.69 0.00 0.00 174.62 176.34 2osg n VAL 53 N 2.92 2.58 -0.73 3.82 0.31 -1.26 0.86 118.33 126.83 2osg n VAL 53 Ca -0.17 -0.50 0.07 0.00 -0.01 0.00 0.00 64.34 63.73 2osg n VAL 53 Cb 0.52 -1.68 0.10 0.00 -0.91 0.00 0.00 33.84 31.88 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 -0.15 1.62 -5.02 2.52 -1.04 0.00 -4.72 114.28 107.49 2osg n THR 54 Ca 0.06 -1.84 -0.31 0.00 -2.04 0.00 0.00 64.05 59.92 2osg n THR 54 Cb 0.40 -0.00 -0.17 0.00 -1.82 0.00 0.00 70.33 68.74 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 -2.27 2.76 0.00 -2.82 2.12 -1.26 -1.64 118.70 115.59 2osg s GLU 55 Ca 0.23 -0.78 0.00 0.00 0.36 0.00 0.00 54.97 54.78 2osg s GLU 55 Cb 0.20 -2.13 0.00 0.00 0.26 0.00 0.00 34.13 32.46 2osg s GLU 55 CO 0.03 0.12 0.00 0.09 -0.54 0.00 0.00 175.26 174.96 2osg n ASN 56 N 3.66 0.00 -4.22 -1.70 3.02 0.28 -4.98 115.26 111.33 2osg n ASN 56 Ca -0.20 0.00 -0.29 0.00 -0.03 0.00 0.00 54.58 54.06 2osg n ASN 56 Cb 0.53 -0.78 0.22 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 -0.14 -0.60 0.03 3.52 1.75 -1.26 -4.90 119.30 117.69 2osg s MET 57 Ca 0.00 0.23 -0.22 0.00 -1.25 0.00 0.00 55.69 54.45 2osg s MET 57 Cb 0.00 -1.64 -0.06 0.00 2.84 0.00 0.00 34.83 35.97 2osg s MET 57 CO 0.00 -3.36 0.64 -1.54 -0.65 0.00 0.00 175.02 170.11 2osg s SER 58 N -3.60 7.06 0.22 1.11 1.04 -1.26 -4.97 113.70 113.30 2osg s SER 58 Ca 0.68 1.26 -0.07 0.00 0.48 0.00 0.00 55.95 58.30 2osg s SER 58 Cb -0.15 -2.39 0.29 0.00 0.10 0.00 0.00 66.02 63.87 2osg s SER 58 CO 0.57 0.11 1.82 0.25 0.98 0.00 0.00 173.24 176.98 2osg h LEU 59 N 5.41 0.66 -0.79 2.42 5.85 -1.99 0.46 115.31 127.33 2osg h LEU 59 Ca -0.46 0.03 -0.07 0.00 0.84 0.00 0.00 57.88 58.22 2osg h LEU 59 Cb 1.20 -0.10 -0.03 0.00 0.37 0.00 0.00 40.66 42.10 2osg h LEU 59 CO 0.69 0.41 0.12 0.71 -0.34 0.00 0.00 178.44 180.04 2osg h THR 60 N 0.79 1.26 -0.11 1.05 1.35 -1.99 -0.39 112.91 114.87 2osg h THR 60 Ca 0.34 -0.98 -0.02 0.00 -0.55 0.00 0.00 66.41 65.19 2osg h THR 60 Cb 0.21 0.63 -0.00 0.00 -1.73 0.00 0.00 68.15 67.25 2osg h THR 60 CO -0.19 0.37 -0.02 -0.78 -0.25 0.00 0.00 175.52 174.64 2osg h ASP 61 N 0.98 0.21 -0.84 5.36 3.58 -1.74 -1.57 116.42 122.40 2osg h ASP 61 Ca 0.20 -0.36 -0.03 0.00 0.42 0.00 0.00 57.03 57.26 2osg h ASP 61 Cb 0.39 -0.06 -0.04 0.00 1.72 0.00 0.00 39.33 41.35 2osg h ASP 61 CO 0.01 0.53 0.41 0.00 -2.88 0.00 0.00 179.24 177.30 2osg h ALA 62 N 0.69 1.09 -0.82 -0.78 0.00 -0.85 -1.65 119.26 116.95 2osg h ALA 62 Ca 0.03 -0.16 -0.04 0.00 0.00 0.00 0.00 54.91 54.74 2osg h ALA 62 Cb 0.43 -0.33 -0.04 0.00 0.00 0.00 0.00 17.79 17.85 2osg h ALA 62 CO 0.01 0.65 0.36 -0.09 0.00 0.00 0.00 179.25 180.18 2osg h ARG 63 N 1.20 1.20 -0.56 0.00 2.43 -1.00 -2.48 114.38 115.16 2osg h ARG 63 Ca 0.29 -0.20 -0.08 0.00 -0.81 0.00 0.00 59.98 59.19 2osg h ARG 63 Cb 0.12 -0.21 -0.02 0.00 -0.42 0.00 0.00 29.97 29.44 2osg h ARG 63 CO -0.04 0.94 0.03 -0.22 -1.51 0.00 0.00 179.97 179.18 2osg h LYS 64 N 1.17 0.94 -0.38 0.20 3.64 -0.77 -0.80 116.57 120.56 2osg h LYS 64 Ca 0.28 -0.26 0.01 0.00 -1.27 0.00 0.00 60.65 59.40 2osg h LYS 64 Cb 0.17 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 31.86 2osg h LYS 64 CO -0.03 0.91 0.24 1.25 -2.27 0.00 0.00 179.45 179.55 2osg h LEU 65 N 0.87 0.41 -0.67 5.20 5.85 -0.88 0.43 115.31 126.52 2osg h LEU 65 Ca 0.17 -0.01 -0.13 0.00 0.84 0.00 0.00 57.88 58.75 2osg h LEU 65 Cb 0.47 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.39 2osg h LEU 65 CO 0.02 0.30 -0.36 0.40 -0.34 0.00 0.00 178.44 178.46 2osg h ILE 66 N 0.50 1.29 -0.17 4.05 5.03 -1.31 -2.27 117.51 124.63 2osg h ILE 66 Ca 0.14 -1.50 -0.05 0.00 -0.12 0.00 0.00 64.86 63.33 2osg h ILE 66 Cb -0.04 1.46 -0.00 0.00 -3.03 0.00 0.00 36.82 35.20 2osg h ILE 66 CO -0.04 0.48 -0.09 -0.33 -0.68 0.00 0.00 178.15 177.49 2osg h GLU 67 N 0.53 0.36 0.00 2.37 5.08 -0.71 -3.02 114.58 119.20 2osg h GLU 67 Ca 0.05 -0.16 -0.03 0.00 -1.00 0.00 0.00 59.36 58.21 2osg h GLU 67 Cb 0.86 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 30.10 2osg h GLU 67 CO 0.07 0.68 -0.17 -0.22 -1.00 0.00 0.00 179.01 178.38 2osg h LYS 68 N 0.03 0.00 -6.02 2.33 3.64 -0.14 -3.37 116.57 113.04 2osg h LYS 68 Ca 0.04 0.00 -0.56 0.00 -1.27 0.00 0.00 60.65 58.85 2osg h LYS 68 Cb 0.58 0.00 -0.09 0.00 -0.41 0.00 0.00 32.23 32.31 2osg h LYS 68 CO 0.03 0.17 1.47 0.45 -2.27 0.00 0.00 179.45 179.29 2osg s SER 69 N -6.71 6.34 -0.65 4.20 0.15 -0.86 -4.81 113.70 111.36 2osg s SER 69 Ca -0.04 -1.46 -0.02 0.00 0.70 0.00 0.00 55.95 55.14 2osg s SER 69 Cb 0.15 -2.57 0.43 0.00 -1.71 0.00 0.00 66.02 62.31 2osg s SER 69 CO 0.66 -1.66 2.04 0.54 1.20 0.00 0.00 173.24 176.02 2osg n ARG 70 N 8.82 2.62 0.00 5.44 1.74 -1.26 -4.71 116.66 129.31 2osg n ARG 70 Ca 0.36 -3.16 0.00 0.00 -0.77 0.00 0.00 57.85 54.27 2osg n ARG 70 Cb 0.50 -2.24 0.00 0.00 -1.02 0.00 0.00 32.46 29.70 2osg n ARG 70 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2osg n GLY 71 N -0.80 -0.53 2.93 -0.13 0.00 -1.26 -5.13 105.19 100.27 2osg n GLY 71 Ca 0.60 0.29 -0.26 0.00 0.00 0.00 0.00 46.02 46.65 2osg n GLY 71 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2osg s LYS 72 N 0.00 1.55 -0.07 1.61 2.20 -1.26 -5.13 119.74 118.63 2osg s LYS 72 Ca 0.00 -0.28 0.03 0.00 -0.36 0.00 0.00 55.97 55.36 2osg s LYS 72 Cb 0.00 -1.54 -0.02 0.00 -1.51 0.00 0.00 37.83 34.76 2osg s LYS 72 CO 0.00 -0.21 -0.15 -0.48 -0.36 0.00 0.00 175.35 174.15 2osg s LEU 73 N 1.49 2.63 -0.16 5.43 2.34 -1.26 -5.04 118.68 124.11 2osg s LEU 73 Ca 0.01 -0.28 -0.08 0.00 0.06 0.00 0.00 54.13 53.84 2osg s LEU 73 Cb -0.13 -1.54 -0.04 0.00 -0.56 0.00 0.00 46.19 43.91 2osg s LEU 73 CO -0.06 0.28 0.12 -1.58 -1.06 0.00 0.00 176.35 174.05 2osg s GLN 74 N -0.33 3.80 -0.02 1.48 0.74 -1.26 -4.94 119.66 119.13 2osg s GLN 74 Ca 0.03 -0.21 0.05 0.00 0.05 0.00 0.00 55.36 55.27 2osg s GLN 74 Cb -0.13 -3.26 -0.01 0.00 1.10 0.00 0.00 33.01 30.71 2osg s GLN 74 CO 0.02 0.50 -0.16 -0.51 -0.55 0.00 0.00 175.29 174.60 2osg s LEU 75 N -0.24 1.97 -0.02 3.68 1.43 -1.26 -0.06 118.68 124.17 2osg s LEU 75 Ca 0.10 -0.30 0.08 0.00 -1.03 0.00 0.00 54.13 52.98 2osg s LEU 75 Cb -0.12 -0.86 -0.02 0.00 0.03 0.00 0.00 46.19 45.23 2osg s LEU 75 CO 0.01 0.17 -0.26 -0.69 0.23 0.00 0.00 176.35 175.81 2osg s VAL 76 N -0.18 2.03 -0.00 -1.59 1.01 0.93 -4.97 120.40 117.63 2osg s VAL 76 Ca 0.02 -1.10 0.05 0.00 0.00 0.00 0.00 61.98 60.96 2osg s VAL 76 Cb -0.08 -1.69 -0.03 0.00 0.00 0.00 0.00 36.38 34.58 2osg s VAL 76 CO 0.00 0.57 -0.16 -0.69 0.00 0.00 0.00 175.10 174.82 2osg s VAL 77 N -0.56 2.89 -0.19 2.92 1.01 -1.26 0.11 120.40 125.31 2osg s VAL 77 Ca 0.09 -0.96 -0.25 0.00 0.00 0.00 0.00 61.98 60.86 2osg s VAL 77 Cb -0.10 -2.17 -0.01 0.00 0.00 0.00 0.00 36.38 34.10 2osg s VAL 77 CO -0.01 0.47 0.82 -0.22 0.00 0.00 0.00 175.10 176.16 2osg s LEU 78 N -1.07 4.15 -0.29 3.92 0.20 -1.16 -4.80 118.68 119.62 2osg s LEU 78 Ca 0.13 1.11 0.04 0.00 0.69 0.00 0.00 54.13 56.10 2osg s LEU 78 Cb -0.11 -3.20 0.18 0.00 -0.43 0.00 0.00 46.19 42.64 2osg s LEU 78 CO 0.03 -0.42 0.51 -0.60 -0.29 0.00 0.00 176.35 175.58 2osg s ARG 79 N 2.32 0.50 0.00 1.98 3.52 -1.26 -4.91 118.95 121.10 2osg s ARG 79 Ca 0.37 0.42 0.00 0.00 -0.13 0.00 0.00 55.73 56.39 2osg s ARG 79 Cb -0.16 0.03 0.00 0.00 -1.56 0.00 0.00 34.95 33.26 2osg s ARG 79 CO 0.11 -1.00 0.00 -3.47 -0.81 0.00 0.00 175.30 170.13 2osg n ASP 80 N 5.39 0.00 -3.73 -2.12 -0.08 -1.26 -5.17 116.55 109.58 2osg n ASP 80 Ca 0.03 0.00 -0.14 0.00 -1.51 0.00 0.00 54.79 53.16 2osg n ASP 80 Cb 0.52 0.00 -0.15 0.00 2.34 0.00 0.00 41.12 43.83 2osg n ASP 80 CO 0.00 0.00 0.00 -0.44 0.12 0.00 0.00 177.20 176.88 2osg s SER 81 N 0.00 0.06 0.31 1.67 0.01 -1.26 -5.11 113.70 109.39 2osg s SER 81 Ca 0.00 0.32 0.00 0.00 1.31 0.00 0.00 55.95 57.58 2osg s SER 81 Cb 0.00 0.22 0.00 0.00 0.21 0.00 0.00 66.02 66.45 2osg s SER 81 CO 0.00 -0.17 0.00 -0.11 0.41 0.00 0.00 173.24 173.37 2osg n LEU 82 N 4.46 -0.84 0.00 2.44 -0.00 -1.26 -5.37 117.00 116.42 2osg n LEU 82 Ca -0.22 1.46 0.00 0.00 -0.00 0.00 0.00 56.01 57.25 2osg n LEU 82 Cb 0.51 -1.19 0.00 0.00 -0.00 0.00 0.00 43.42 42.74 2osg n LEU 82 CO 0.15 -0.49 0.00 1.21 -0.00 0.00 0.00 177.39 178.25