#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 -0.26 0.13 1.12 2.07 -1.26 -5.16 121.20 117.84 2osg s ILE 2 Ca 0.00 0.26 0.05 0.00 -1.41 0.00 0.00 60.65 59.55 2osg s ILE 2 Cb 0.00 -0.38 -0.04 0.00 0.13 0.00 0.00 42.46 42.17 2osg s ILE 2 CO 0.00 0.11 -0.12 -0.83 -1.91 0.00 0.00 174.94 172.19 2osg s GLY 3 N 2.02 1.04 -0.03 1.50 0.00 -1.26 -5.15 107.32 105.44 2osg s GLY 3 Ca -0.02 -1.35 0.02 0.00 0.00 0.00 0.00 44.72 43.37 2osg s GLY 3 CO -0.08 -1.43 -0.08 0.14 0.00 0.00 0.00 173.10 171.65 2osg s VAL 4 N -2.65 0.73 -0.43 1.40 1.01 -1.26 -5.12 120.40 114.08 2osg s VAL 4 Ca 0.11 -0.31 -0.14 0.00 0.00 0.00 0.00 61.98 61.65 2osg s VAL 4 Cb -0.02 -0.67 0.05 0.00 0.00 0.00 0.00 36.38 35.74 2osg s VAL 4 CO 0.02 0.24 0.32 -1.48 0.00 0.00 0.00 175.10 174.20 2osg s LEU 5 N 0.38 5.28 -0.06 3.92 2.34 -1.26 -5.07 118.68 124.21 2osg s LEU 5 Ca -0.06 -1.21 -0.17 0.00 0.06 0.00 0.00 54.13 52.75 2osg s LEU 5 Cb -0.10 -2.12 -0.05 0.00 -0.56 0.00 0.00 46.19 43.36 2osg s LEU 5 CO 0.01 -0.54 0.47 -0.22 -1.06 0.00 0.00 176.35 175.01 2osg s LEU 6 N 1.60 4.36 0.29 1.48 2.96 -1.26 -5.08 118.68 123.03 2osg s LEU 6 Ca 0.04 0.92 0.09 0.00 -0.22 0.00 0.00 54.13 54.95 2osg s LEU 6 Cb -0.22 -2.69 -0.06 0.00 0.50 0.00 0.00 46.19 43.72 2osg s LEU 6 CO 0.07 0.12 -0.11 -0.32 -1.32 0.00 0.00 176.35 174.79 2osg s MET 7 N -0.06 1.62 -0.33 1.98 -2.45 -1.26 -5.12 119.30 113.67 2osg s MET 7 Ca 0.26 -1.80 -0.13 0.00 -1.25 0.00 0.00 55.69 52.77 2osg s MET 7 Cb -0.16 -1.43 -0.02 0.00 1.25 0.00 0.00 34.83 34.47 2osg s MET 7 CO 0.12 0.15 0.26 0.21 1.05 0.00 0.00 175.02 176.81 2osg s LYS 8 N -3.64 3.57 -0.18 4.11 2.36 -1.26 -4.92 119.74 119.77 2osg s LYS 8 Ca 0.29 -0.56 0.23 0.00 -2.55 0.00 0.00 55.97 53.39 2osg s LYS 8 Cb 0.01 -3.79 0.48 0.00 -1.05 0.00 0.00 37.83 33.48 2osg s LYS 8 CO 0.13 -0.42 1.14 0.43 1.55 0.00 0.00 175.35 178.17 2osg n SER 9 N 5.15 1.31 -3.15 1.43 7.64 -1.26 -5.03 113.62 119.71 2osg n SER 9 Ca -0.12 -2.02 0.05 0.00 1.01 0.00 0.00 58.87 57.79 2osg n SER 9 Cb 0.50 -0.39 -0.01 0.00 -1.01 0.00 0.00 64.21 63.29 2osg n SER 9 CO 0.00 0.00 0.00 -0.60 -3.01 0.00 0.00 175.04 171.43 2osg s ARG 10 N -2.56 0.17 0.18 1.43 3.00 -1.26 -5.12 118.95 114.79 2osg s ARG 10 Ca 0.28 0.26 0.00 0.00 -1.00 0.00 0.00 55.73 55.28 2osg s ARG 10 Cb 0.34 0.14 0.00 0.00 0.00 0.00 0.00 34.95 35.43 2osg s ARG 10 CO -0.08 -0.22 0.00 0.00 0.00 0.00 0.00 175.30 175.00 2osg n ALA 11 N 5.37 -2.27 -2.06 6.12 0.00 -1.26 -4.68 120.51 121.74 2osg n ALA 11 Ca -0.02 0.37 -0.27 0.00 0.00 0.00 0.00 53.44 53.51 2osg n ALA 11 Cb 0.55 -1.23 -0.06 0.00 0.00 0.00 0.00 19.45 18.71 2osg n ALA 11 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 2osg s ASN 12 N -0.62 5.05 0.16 0.00 -0.87 -1.26 -4.86 114.94 112.54 2osg s ASN 12 Ca 0.00 -1.33 -0.07 0.00 -1.57 0.00 0.00 52.86 49.89 2osg s ASN 12 Cb 0.00 -2.58 -0.02 0.00 -0.02 0.00 0.00 41.25 38.63 2osg s ASN 12 CO 0.00 -2.99 0.23 -1.61 -2.57 0.00 0.00 177.10 170.16 2osg s GLU 13 N 6.67 1.11 1.08 -0.60 2.02 -1.26 -5.17 118.70 122.55 2osg s GLU 13 Ca 0.69 -1.24 -0.13 0.00 0.02 0.00 0.00 54.97 54.32 2osg s GLU 13 Cb -0.03 0.35 0.23 0.00 0.10 0.00 0.00 34.13 34.78 2osg s GLU 13 CO 0.09 -0.39 1.07 -1.83 0.02 0.00 0.00 175.26 174.22 2osg s GLU 14 N -3.99 -0.21 0.30 1.61 -1.05 -1.26 -4.95 118.70 109.15 2osg s GLU 14 Ca 0.19 0.60 0.14 0.00 -0.15 0.00 0.00 54.97 55.75 2osg s GLU 14 Cb 0.04 -1.66 0.40 0.00 -0.44 0.00 0.00 34.13 32.48 2osg s GLU 14 CO 0.01 -3.18 1.61 1.88 0.95 0.00 0.00 175.26 176.52 2osg h TYR 15 N -2.22 0.00 -0.26 4.83 -1.99 -2.01 -3.47 116.97 111.85 2osg h TYR 15 Ca -0.58 0.00 -0.04 0.00 2.00 0.00 0.00 58.73 60.11 2osg h TYR 15 Cb 1.34 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 40.06 2osg h TYR 15 CO 0.27 0.55 -0.05 0.41 -0.00 0.00 0.00 178.16 179.33 2osg n GLY 16 N 0.44 0.34 3.41 3.88 0.00 -1.26 -5.04 105.19 106.98 2osg n GLY 16 Ca -0.00 -0.85 -0.36 0.00 0.00 0.00 0.00 46.02 44.81 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 -0.58 3.27 -0.35 0.99 1.02 -1.26 -5.08 118.68 116.70 2osg s LEU 17 Ca 0.00 -0.25 -0.12 0.00 0.02 0.00 0.00 54.13 53.79 2osg s LEU 17 Cb 0.00 -1.86 0.00 0.00 0.02 0.00 0.00 46.19 44.35 2osg s LEU 17 CO 0.00 -0.01 0.21 -0.13 0.02 0.00 0.00 176.35 176.44 2osg s ARG 18 N 1.44 3.24 -0.21 1.70 3.00 -1.26 -5.07 118.95 121.78 2osg s ARG 18 Ca 0.05 -0.81 -0.07 0.00 0.00 0.00 0.00 55.73 54.91 2osg s ARG 18 Cb -0.15 -3.73 -0.03 0.00 0.00 0.00 0.00 34.95 31.04 2osg s ARG 18 CO 0.01 -0.53 0.06 -0.48 0.00 0.00 0.00 175.30 174.36 2osg s LEU 19 N 1.64 3.57 0.00 2.53 2.34 -1.26 -5.10 118.68 122.40 2osg s LEU 19 Ca 0.05 -0.08 0.05 0.00 0.06 0.00 0.00 54.13 54.20 2osg s LEU 19 Cb -0.18 -1.92 0.05 0.00 -0.56 0.00 0.00 46.19 43.58 2osg s LEU 19 CO 0.08 0.07 0.41 0.61 -1.06 0.00 0.00 176.35 176.47 2osg n GLY 20 N 4.20 2.66 3.12 -3.48 0.00 -1.26 -5.13 105.19 105.30 2osg n GLY 20 Ca -0.16 -2.27 -0.17 0.00 0.00 0.00 0.00 46.02 43.41 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 -3.88 1.38 0.02 1.61 1.04 -1.26 -4.99 113.70 107.62 2osg s SER 21 Ca 0.31 -0.54 0.02 0.00 0.48 0.00 0.00 55.95 56.23 2osg s SER 21 Cb -0.02 -0.04 -0.02 0.00 0.10 0.00 0.00 66.02 66.04 2osg s SER 21 CO 0.20 -0.08 -0.07 0.00 0.98 0.00 0.00 173.24 174.26 2osg s GLN 22 N -1.48 0.53 -0.23 4.02 -2.07 -1.26 -0.96 119.66 118.20 2osg s GLN 22 Ca -0.03 -0.54 -0.21 0.00 -1.82 0.00 0.00 55.36 52.75 2osg s GLN 22 Cb -0.09 -0.41 -0.02 0.00 -1.09 0.00 0.00 33.01 31.41 2osg s GLN 22 CO 0.01 0.09 0.67 0.42 -1.32 0.00 0.00 175.29 175.17 2osg s ILE 23 N -0.84 4.97 0.41 3.63 1.01 -1.13 -4.97 121.20 124.28 2osg s ILE 23 Ca -0.04 1.25 0.05 0.00 0.00 0.00 0.00 60.65 61.91 2osg s ILE 23 Cb -0.07 -3.98 -0.06 0.00 0.01 0.00 0.00 42.46 38.37 2osg s ILE 23 CO 0.00 0.04 0.03 0.72 0.00 0.00 0.00 174.94 175.73 2osg s PHE 24 N 2.34 2.22 -0.77 3.97 -0.71 -1.26 -1.68 117.98 122.10 2osg s PHE 24 Ca 0.29 -0.83 -0.24 0.00 -1.04 0.00 0.00 56.93 55.11 2osg s PHE 24 Cb -0.16 -1.60 0.06 0.00 -1.21 0.00 0.00 43.02 40.11 2osg s PHE 24 CO 0.09 0.27 1.17 0.08 -1.34 0.00 0.00 175.22 175.49 2osg s VAL 25 N -2.90 4.08 -0.00 -2.49 1.01 -1.11 -4.89 120.40 114.10 2osg s VAL 25 Ca 0.28 -0.26 -0.24 0.00 0.00 0.00 0.00 61.98 61.77 2osg s VAL 25 Cb 0.07 -4.84 -0.14 0.00 0.00 0.00 0.00 36.38 31.48 2osg s VAL 25 CO 0.14 -1.69 1.02 0.50 0.00 0.00 0.00 175.10 175.08 2osg h LYS 26 N 9.70 -0.69 -2.89 2.72 3.11 -1.93 0.84 116.57 127.43 2osg h LYS 26 Ca -0.17 0.05 -0.15 0.00 -2.81 0.00 0.00 60.65 57.57 2osg h LYS 26 Cb 1.05 0.16 -0.26 0.00 -1.00 0.00 0.00 32.23 32.18 2osg h LYS 26 CO 1.25 -0.40 -0.35 -2.00 -2.81 0.00 0.00 179.45 175.14 2osg s GLU 27 N -4.32 0.36 -0.02 1.90 2.12 -1.26 -4.64 118.70 112.83 2osg s GLU 27 Ca -0.13 0.53 0.01 0.00 0.36 0.00 0.00 54.97 55.74 2osg s GLU 27 Cb 0.01 0.10 0.01 0.00 0.26 0.00 0.00 34.13 34.51 2osg s GLU 27 CO 0.41 -0.09 -0.02 0.00 -0.54 0.00 0.00 175.26 175.03 2osg s MET 28 N 0.59 0.33 0.02 4.30 0.23 -1.26 -5.13 119.30 118.38 2osg s MET 28 Ca -0.03 -0.03 -0.30 0.00 -1.03 0.00 0.00 55.69 54.29 2osg s MET 28 Cb -0.05 -0.41 -0.05 0.00 -1.53 0.00 0.00 34.83 32.79 2osg s MET 28 CO -0.04 -0.03 1.26 0.95 -2.03 0.00 0.00 175.02 175.14 2osg s THR 29 N 0.49 3.95 -0.99 3.16 -4.23 -1.26 -4.90 115.64 111.86 2osg s THR 29 Ca -0.05 1.36 -0.14 0.00 -1.18 0.00 0.00 61.69 61.68 2osg s THR 29 Cb -0.08 -3.87 -0.09 0.00 1.34 0.00 0.00 72.50 69.80 2osg s THR 29 CO -0.01 0.05 2.12 -2.11 -0.54 0.00 0.00 174.62 174.13 2osg n ARG 30 N 4.59 2.08 -0.66 3.99 1.85 -1.26 -3.39 116.66 123.87 2osg n ARG 30 Ca 0.11 -1.84 -0.03 0.00 -1.00 0.00 0.00 57.85 55.08 2osg n ARG 30 Cb 0.45 -2.80 -0.03 0.00 -1.05 0.00 0.00 32.46 29.04 2osg n ARG 30 CO 0.00 0.00 0.00 0.25 -0.01 0.00 0.00 177.63 177.87 2osg n THR 31 N 5.04 0.00 -4.17 8.89 -2.24 -1.26 -5.02 114.28 115.53 2osg n THR 31 Ca 0.51 0.00 -0.08 0.00 -2.27 0.00 0.00 64.05 62.21 2osg n THR 31 Cb 0.29 0.21 -0.02 0.00 -2.10 0.00 0.00 70.33 68.71 2osg n THR 31 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2osg n GLY 32 N 0.00 3.93 0.17 3.38 0.00 -1.22 -5.01 105.19 106.45 2osg n GLY 32 Ca -0.12 -2.09 -0.00 0.00 0.00 0.00 0.00 46.02 43.81 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 0.05 -0.40 0.99 4.07 -1.98 0.01 115.31 118.05 2osg h LEU 33 Ca -0.10 -0.02 -0.12 0.00 0.08 0.00 0.00 57.88 57.71 2osg h LEU 33 Cb 0.34 -0.01 -0.01 0.00 1.08 0.00 0.00 40.66 42.06 2osg h LEU 33 CO 0.16 0.54 -0.23 0.00 -1.08 0.00 0.00 178.44 177.83 2osg h ALA 34 N 1.46 0.57 0.06 1.53 0.00 -1.96 -1.87 119.26 119.05 2osg h ALA 34 Ca -0.00 -0.39 -0.24 0.00 0.00 0.00 0.00 54.91 54.28 2osg h ALA 34 Cb 0.89 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.54 2osg h ALA 34 CO 0.07 0.55 -1.08 1.15 0.00 0.00 0.00 179.25 179.94 2osg h THR 35 N 0.68 1.54 -0.42 0.00 2.02 -1.83 0.42 112.91 115.32 2osg h THR 35 Ca 0.09 -3.00 -0.08 0.00 0.77 0.00 0.00 66.41 64.19 2osg h THR 35 Cb 0.79 2.78 -0.02 0.00 -1.74 0.00 0.00 68.15 69.96 2osg h THR 35 CO 0.07 0.87 -0.05 0.11 0.37 0.00 0.00 175.52 176.89 2osg h LYS 36 N 0.08 0.72 0.01 6.66 1.79 -0.95 -3.24 116.57 121.64 2osg h LYS 36 Ca -0.08 -0.20 -0.36 0.00 -2.18 0.00 0.00 60.65 57.83 2osg h LYS 36 Cb 1.79 -0.08 -0.06 0.00 -1.58 0.00 0.00 32.23 32.30 2osg h LYS 36 CO 0.17 0.76 -2.25 -0.25 -1.08 0.00 0.00 179.45 176.80 2osg n ASP 37 N -4.20 0.64 -1.74 0.86 9.92 -0.71 -5.02 116.55 116.29 2osg n ASP 37 Ca 0.02 0.07 -0.10 0.00 -0.53 0.00 0.00 54.79 54.25 2osg n ASP 37 Cb 0.32 0.44 0.03 0.00 -0.64 0.00 0.00 41.12 41.27 2osg n ASP 37 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2osg n GLY 38 N 1.82 0.35 0.07 0.44 0.00 0.15 -4.96 105.19 103.06 2osg n GLY 38 Ca -0.32 -0.30 -0.09 0.00 0.00 0.00 0.00 46.02 45.30 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 -1.08 0.08 -3.28 1.61 7.08 -1.86 -3.44 115.58 114.68 2osg h ASN 39 Ca -0.23 -0.10 -0.66 0.00 -3.08 0.00 0.00 56.30 52.23 2osg h ASN 39 Cb 1.15 -0.03 -0.30 0.00 -2.08 0.00 0.00 38.32 37.06 2osg h ASN 39 CO 0.22 1.08 -0.78 -0.76 -2.08 0.00 0.00 177.43 175.11 2osg s LEU 40 N -6.62 2.58 0.05 6.14 1.43 -1.26 -5.01 118.68 115.99 2osg s LEU 40 Ca -0.02 -0.45 -0.18 0.00 -1.03 0.00 0.00 54.13 52.44 2osg s LEU 40 Cb 0.09 -1.61 -0.06 0.00 0.03 0.00 0.00 46.19 44.64 2osg s LEU 40 CO 0.83 0.05 0.54 -1.00 0.23 0.00 0.00 176.35 177.00 2osg s HIS 41 N 1.01 3.79 -0.26 0.29 3.76 -1.26 -4.91 115.29 117.71 2osg s HIS 41 Ca -0.01 1.21 -0.31 0.00 -0.15 0.00 0.00 55.06 55.81 2osg s HIS 41 Cb -0.15 -2.46 -0.07 0.00 1.11 0.00 0.00 32.58 31.01 2osg s HIS 41 CO -0.02 0.59 2.21 0.39 -0.85 0.00 0.00 174.74 177.05 2osg n GLU 42 N 1.79 1.67 0.00 1.40 1.02 -1.26 0.11 120.64 125.38 2osg n GLU 42 Ca -0.11 0.46 0.00 0.00 -0.02 0.00 0.00 57.16 57.49 2osg n GLU 42 Cb 0.51 -2.97 0.00 0.00 -0.02 0.00 0.00 31.44 28.96 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 6.01 0.77 3.75 0.62 0.00 0.29 -4.96 105.19 111.67 2osg n GLY 43 Ca 0.34 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.94 2osg n GLY 43 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2osg n ASP 44 N 0.00 3.61 -4.50 1.61 -0.08 0.12 -4.59 116.55 112.72 2osg n ASP 44 Ca 0.00 1.19 -0.42 0.00 -1.51 0.00 0.00 54.79 54.05 2osg n ASP 44 Cb 0.00 -1.58 -0.03 0.00 2.34 0.00 0.00 41.12 41.84 2osg n ASP 44 CO 0.00 0.00 0.00 0.27 0.12 0.00 0.00 177.20 177.59 2osg s ILE 45 N -0.70 4.05 0.33 5.18 -4.36 -1.26 -2.74 121.20 121.70 2osg s ILE 45 Ca 0.58 -0.08 -0.29 0.00 -0.26 0.00 0.00 60.65 60.60 2osg s ILE 45 Cb -0.51 -4.81 -0.10 0.00 1.25 0.00 0.00 42.46 38.29 2osg s ILE 45 CO 0.58 -1.66 1.38 -0.63 0.24 0.00 0.00 174.94 174.84 2osg s ILE 46 N 4.81 2.51 -0.15 8.37 1.01 -0.67 -3.94 121.20 133.14 2osg s ILE 46 Ca 0.29 0.50 -0.03 0.00 0.00 0.00 0.00 60.65 61.42 2osg s ILE 46 Cb -0.12 -3.32 -0.24 0.00 0.01 0.00 0.00 42.46 38.79 2osg s ILE 46 CO 0.11 0.11 0.25 -0.11 0.00 0.00 0.00 174.94 175.30 2osg n LEU 47 N 0.90 2.51 -3.75 2.97 7.94 0.23 -4.49 117.00 123.31 2osg n LEU 47 Ca 0.01 0.14 -0.13 0.00 -1.11 0.00 0.00 56.01 54.92 2osg n LEU 47 Cb 0.41 -0.94 -0.08 0.00 0.53 0.00 0.00 43.42 43.34 2osg n LEU 47 CO 0.61 0.83 0.04 -0.54 -1.11 0.00 0.00 177.39 177.21 2osg s LYS 48 N -2.55 0.70 -0.08 1.96 1.02 -1.20 -1.27 119.74 118.31 2osg s LYS 48 Ca -0.23 -0.22 -0.02 0.00 0.02 0.00 0.00 55.97 55.51 2osg s LYS 48 Cb 0.07 0.31 0.03 0.00 -0.52 0.00 0.00 37.83 37.73 2osg s LYS 48 CO 0.74 -0.20 0.04 0.42 -0.92 0.00 0.00 175.35 175.43 2osg s ILE 49 N -1.50 0.10 -1.50 2.17 1.01 0.14 -0.10 121.20 121.52 2osg s ILE 49 Ca -0.12 0.19 -0.11 0.00 0.00 0.00 0.00 60.65 60.60 2osg s ILE 49 Cb -0.04 -0.39 0.07 0.00 0.01 0.00 0.00 42.46 42.11 2osg s ILE 49 CO 0.03 0.12 0.92 0.59 0.00 0.00 0.00 174.94 176.61 2osg n ASN 50 N 5.23 -4.09 0.00 3.58 4.13 0.51 -0.02 115.26 124.60 2osg n ASN 50 Ca -0.05 -0.80 0.00 0.00 1.68 0.00 0.00 54.58 55.41 2osg n ASN 50 Cb 0.50 -3.87 0.00 0.00 -1.54 0.00 0.00 39.78 34.87 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 -1.68 0.51 3.62 7.41 0.00 -1.26 -4.95 105.19 108.84 2osg n GLY 51 Ca -0.02 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.65 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 -2.31 4.59 0.51 2.61 2.01 0.96 -5.08 115.64 118.94 2osg s THR 52 Ca 0.00 -0.11 -0.23 0.00 0.31 0.00 0.00 61.69 61.66 2osg s THR 52 Cb 0.00 -3.04 -0.06 0.00 0.01 0.00 0.00 72.50 69.41 2osg s THR 52 CO 0.00 0.49 1.40 -0.69 -0.69 0.00 0.00 174.62 175.13 2osg s VAL 53 N 0.15 2.02 -0.23 3.82 1.01 -1.26 0.25 120.40 126.16 2osg s VAL 53 Ca 0.03 0.02 0.14 0.00 0.00 0.00 0.00 61.98 62.17 2osg s VAL 53 Cb -0.13 -3.01 0.56 0.00 0.00 0.00 0.00 36.38 33.80 2osg s VAL 53 CO 0.01 0.00 1.49 0.41 0.00 0.00 0.00 175.10 177.01 2osg n THR 54 N -0.70 2.46 -4.78 3.92 -1.04 -0.40 -4.69 114.28 109.05 2osg n THR 54 Ca 0.08 -2.07 -0.27 0.00 -2.04 0.00 0.00 64.05 59.76 2osg n THR 54 Cb 0.43 -0.29 -0.17 0.00 -1.82 0.00 0.00 70.33 68.49 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 -2.97 2.05 -0.21 -2.82 2.12 -1.26 -2.82 118.70 112.79 2osg s GLU 55 Ca 0.45 -0.55 0.00 0.00 0.36 0.00 0.00 54.97 55.22 2osg s GLU 55 Cb 0.37 -1.65 0.00 0.00 0.26 0.00 0.00 34.13 33.11 2osg s GLU 55 CO 0.07 0.09 0.00 0.27 -0.54 0.00 0.00 175.26 175.15 2osg n ASN 56 N 3.66 -3.41 -3.02 -1.70 0.23 -0.14 -4.92 115.26 105.96 2osg n ASN 56 Ca -0.21 0.05 -0.15 0.00 -0.53 0.00 0.00 54.58 53.74 2osg n ASN 56 Cb 0.52 -2.36 0.12 0.00 -2.08 0.00 0.00 39.78 35.99 2osg n ASN 56 CO 0.00 0.00 0.00 1.15 -0.93 0.00 0.00 177.26 177.48 2osg n MET 57 N 0.19 -2.14 -3.21 -3.83 0.00 -1.26 -4.98 117.12 101.89 2osg n MET 57 Ca -0.02 -0.84 -0.39 0.00 0.00 0.00 0.00 57.70 56.44 2osg n MET 57 Cb 0.31 -0.80 -0.06 0.00 0.00 0.00 0.00 33.22 32.66 2osg n MET 57 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 175.97 174.43 2osg s SER 58 N -2.92 6.62 0.20 3.17 1.04 -1.26 -4.97 113.70 115.58 2osg s SER 58 Ca 0.34 0.75 -0.11 0.00 0.48 0.00 0.00 55.95 57.41 2osg s SER 58 Cb -0.04 -2.31 0.16 0.00 0.10 0.00 0.00 66.02 63.93 2osg s SER 58 CO 0.27 -0.19 1.83 0.25 0.98 0.00 0.00 173.24 176.37 2osg h LEU 59 N 7.88 0.60 -1.02 2.42 6.46 -1.98 0.25 115.31 129.92 2osg h LEU 59 Ca -0.34 0.01 -0.05 0.00 -0.12 0.00 0.00 57.88 57.38 2osg h LEU 59 Cb 1.15 -0.12 -0.03 0.00 -0.73 0.00 0.00 40.66 40.94 2osg h LEU 59 CO 0.75 0.42 0.17 0.00 -0.62 0.00 0.00 178.44 179.16 2osg h THR 60 N 0.73 1.23 -0.04 1.05 1.03 -1.99 -1.31 112.91 113.61 2osg h THR 60 Ca 0.25 -0.79 -0.20 0.00 -0.01 0.00 0.00 66.41 65.67 2osg h THR 60 Cb 0.04 0.61 -0.00 0.00 -1.07 0.00 0.00 68.15 67.73 2osg h THR 60 CO -0.11 0.30 -0.82 0.44 -0.01 0.00 0.00 175.52 175.32 2osg h ASP 61 N 0.85 0.44 -0.45 0.00 5.19 -1.80 -1.85 116.42 118.80 2osg h ASP 61 Ca 0.19 -0.32 -0.06 0.00 -0.62 0.00 0.00 57.03 56.22 2osg h ASP 61 Cb 0.27 -0.13 -0.02 0.00 0.18 0.00 0.00 39.33 39.62 2osg h ASP 61 CO -0.01 1.09 0.06 0.00 -3.12 0.00 0.00 179.24 177.26 2osg h ALA 62 N 0.90 0.59 -0.17 3.45 0.00 -0.14 0.31 119.26 124.19 2osg h ALA 62 Ca -0.05 -0.23 -0.18 0.00 0.00 0.00 0.00 54.91 54.45 2osg h ALA 62 Cb 1.42 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 19.04 2osg h ALA 62 CO 0.14 0.33 -0.62 0.07 0.00 0.00 0.00 179.25 179.17 2osg h ARG 63 N 0.60 0.59 -0.42 0.00 0.11 -1.28 -2.86 114.38 111.13 2osg h ARG 63 Ca 0.13 -0.41 -0.11 0.00 0.10 0.00 0.00 59.98 59.70 2osg h ARG 63 Cb 0.40 0.06 -0.02 0.00 1.11 0.00 0.00 29.97 31.53 2osg h ARG 63 CO 0.01 1.02 -0.19 -0.22 0.10 0.00 0.00 179.97 180.69 2osg h LYS 64 N 0.44 0.81 -0.50 0.08 1.63 -1.17 -1.73 116.57 116.14 2osg h LYS 64 Ca -0.01 -0.32 0.01 0.00 -0.85 0.00 0.00 60.65 59.49 2osg h LYS 64 Cb 1.18 -0.04 -0.03 0.00 -0.60 0.00 0.00 32.23 32.74 2osg h LYS 64 CO 0.12 0.94 0.31 1.25 -3.45 0.00 0.00 179.45 178.62 2osg h LEU 65 N 0.72 0.52 -0.62 5.20 7.12 -0.29 0.47 115.31 128.43 2osg h LEU 65 Ca 0.10 -0.01 -0.13 0.00 0.13 0.00 0.00 57.88 57.98 2osg h LEU 65 Cb 0.71 -0.12 -0.01 0.00 -0.53 0.00 0.00 40.66 40.71 2osg h LEU 65 CO 0.05 0.38 -0.32 0.40 -0.13 0.00 0.00 178.44 178.82 2osg h ILE 66 N 0.63 1.28 -0.03 4.05 2.04 -1.38 -1.49 117.51 122.61 2osg h ILE 66 Ca 0.19 -1.46 -0.01 0.00 1.00 0.00 0.00 64.86 64.58 2osg h ILE 66 Cb -0.03 1.35 -0.00 0.00 -0.74 0.00 0.00 36.82 37.40 2osg h ILE 66 CO -0.06 0.48 -0.02 -0.33 0.00 0.00 0.00 178.15 178.21 2osg h GLU 67 N 0.63 0.06 0.00 2.37 3.07 -0.87 -3.06 114.58 116.80 2osg h GLU 67 Ca 0.07 -0.03 -0.02 0.00 -0.50 0.00 0.00 59.36 58.88 2osg h GLU 67 Cb 0.84 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 28.75 2osg h GLU 67 CO 0.07 0.51 -0.08 0.87 -1.40 0.00 0.00 179.01 178.98 2osg h LYS 68 N -0.38 0.00 -3.98 2.33 1.79 -0.08 -3.33 116.57 112.91 2osg h LYS 68 Ca 0.01 0.00 -0.65 0.00 -2.18 0.00 0.00 60.65 57.82 2osg h LYS 68 Cb 0.50 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.15 2osg h LYS 68 CO 0.01 0.08 2.90 0.43 -1.08 0.00 0.00 179.45 181.79 2osg n SER 69 N -3.48 4.12 -2.81 0.86 7.64 -0.56 -4.75 113.62 114.64 2osg n SER 69 Ca -0.02 -2.70 -0.31 0.00 1.01 0.00 0.00 58.87 56.85 2osg n SER 69 Cb 0.22 -1.41 -0.04 0.00 -1.01 0.00 0.00 64.21 61.97 2osg n SER 69 CO 0.00 0.00 0.00 -2.11 -3.01 0.00 0.00 175.04 169.92 2osg n ARG 70 N 5.90 3.12 0.00 1.43 1.85 -1.25 -4.55 116.66 123.16 2osg n ARG 70 Ca 0.54 -2.74 0.00 0.00 -1.00 0.00 0.00 57.85 54.65 2osg n ARG 70 Cb 0.35 -2.30 0.00 0.00 -1.05 0.00 0.00 32.46 29.46 2osg n ARG 70 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2osg n GLY 71 N 1.09 -2.14 2.94 2.89 0.00 -1.26 -5.13 105.19 103.57 2osg n GLY 71 Ca 0.53 0.71 -0.24 0.00 0.00 0.00 0.00 46.02 47.02 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 1.36 -0.04 1.61 2.20 -1.26 -5.14 119.74 118.47 2osg s LYS 72 Ca 0.00 -0.25 0.03 0.00 -0.36 0.00 0.00 55.97 55.38 2osg s LYS 72 Cb 0.00 -1.29 0.00 0.00 -1.51 0.00 0.00 37.83 35.04 2osg s LYS 72 CO 0.00 -0.11 -0.12 -0.48 -0.36 0.00 0.00 175.35 174.29 2osg s LEU 73 N 1.11 1.79 0.04 5.43 0.05 -1.26 -4.98 118.68 120.85 2osg s LEU 73 Ca -0.07 -0.25 -0.16 0.00 0.05 0.00 0.00 54.13 53.70 2osg s LEU 73 Cb -0.14 -0.71 -0.06 0.00 -2.05 0.00 0.00 46.19 43.22 2osg s LEU 73 CO -0.01 0.08 0.46 -1.10 -0.55 0.00 0.00 176.35 175.23 2osg s GLN 74 N 0.24 3.99 -0.05 1.48 -0.21 -1.26 -4.89 119.66 118.96 2osg s GLN 74 Ca -0.05 0.49 0.01 0.00 0.02 0.00 0.00 55.36 55.83 2osg s GLN 74 Cb -0.11 -3.19 0.02 0.00 1.00 0.00 0.00 33.01 30.73 2osg s GLN 74 CO 0.01 0.65 -0.04 -0.51 -2.12 0.00 0.00 175.29 173.28 2osg s LEU 75 N -1.21 1.25 0.01 2.90 1.02 -1.26 -0.36 118.68 121.03 2osg s LEU 75 Ca 0.27 -0.14 0.06 0.00 0.02 0.00 0.00 54.13 54.34 2osg s LEU 75 Cb -0.17 -0.48 -0.03 0.00 0.02 0.00 0.00 46.19 45.53 2osg s LEU 75 CO 0.16 -0.07 -0.17 -0.69 0.02 0.00 0.00 176.35 175.59 2osg s VAL 76 N 1.06 2.82 0.13 -1.59 1.01 0.86 -4.97 120.40 119.72 2osg s VAL 76 Ca -0.09 -1.02 0.06 0.00 0.00 0.00 0.00 61.98 60.93 2osg s VAL 76 Cb -0.14 -2.14 -0.04 0.00 0.00 0.00 0.00 36.38 34.06 2osg s VAL 76 CO -0.01 0.44 -0.13 0.68 0.00 0.00 0.00 175.10 176.08 2osg s VAL 77 N -0.83 1.32 -0.22 2.92 -7.23 -1.26 0.76 120.40 115.84 2osg s VAL 77 Ca 0.13 -1.77 -0.05 0.00 -1.81 0.00 0.00 61.98 58.48 2osg s VAL 77 Cb -0.10 -1.58 -0.02 0.00 0.56 0.00 0.00 36.38 35.24 2osg s VAL 77 CO 0.03 -0.46 0.00 -0.22 -0.31 0.00 0.00 175.10 174.14 2osg s LEU 78 N -2.56 3.15 -0.67 1.32 0.20 -1.25 -4.81 118.68 114.04 2osg s LEU 78 Ca 0.10 -0.29 -0.02 0.00 0.69 0.00 0.00 54.13 54.61 2osg s LEU 78 Cb -0.04 -1.82 0.42 0.00 -0.43 0.00 0.00 46.19 44.32 2osg s LEU 78 CO 0.03 -0.01 2.05 0.54 -0.29 0.00 0.00 176.35 178.67 2osg n ARG 79 N 4.72 2.65 -3.67 1.98 1.74 -1.26 -4.91 116.66 117.91 2osg n ARG 79 Ca -0.17 -3.22 -0.25 0.00 -0.77 0.00 0.00 57.85 53.44 2osg n ARG 79 Cb 0.51 -2.25 0.01 0.00 -1.02 0.00 0.00 32.46 29.72 2osg n ARG 79 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 2osg n ASP 80 N -0.78 -5.44 -2.12 0.55 8.00 -1.26 -4.38 116.55 111.12 2osg n ASP 80 Ca 0.60 -0.86 -0.02 0.00 0.71 0.00 0.00 54.79 55.22 2osg n ASP 80 Cb 0.60 -2.77 -0.02 0.00 -0.02 0.00 0.00 41.12 38.90 2osg n ASP 80 CO 0.00 0.00 0.00 -0.24 -0.39 0.00 0.00 177.20 176.57 2osg n SER 81 N -2.41 -3.63 -4.44 -2.24 2.88 -1.26 -5.05 113.62 97.47 2osg n SER 81 Ca -0.18 1.10 -0.32 0.00 -1.33 0.00 0.00 58.87 58.15 2osg n SER 81 Cb 0.61 -3.97 -0.13 0.00 -0.75 0.00 0.00 64.21 59.97 2osg n SER 81 CO 0.00 0.00 0.00 -0.22 -1.23 0.00 0.00 175.04 173.59 2osg s LEU 82 N -0.44 2.58 0.00 2.46 0.20 -1.26 -5.24 118.68 116.97 2osg s LEU 82 Ca -0.12 -0.34 0.00 0.00 0.69 0.00 0.00 54.13 54.36 2osg s LEU 82 Cb 0.01 -1.51 0.00 0.00 -0.43 0.00 0.00 46.19 44.26 2osg s LEU 82 CO 0.31 0.30 0.44 -0.62 -0.29 0.00 0.00 176.35 176.49