#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 1.03 0.18 2.02 -5.25 -1.26 -5.17 121.20 112.75 2osg s ILE 2 Ca 0.00 -1.90 0.07 0.00 -0.99 0.00 0.00 60.65 57.83 2osg s ILE 2 Cb 0.00 -1.66 -0.04 0.00 2.95 0.00 0.00 42.46 43.70 2osg s ILE 2 CO 0.00 -0.70 -0.15 -0.83 -1.79 0.00 0.00 174.94 171.47 2osg s GLY 3 N -2.90 1.33 -0.04 6.27 0.00 -1.26 -5.15 107.32 105.57 2osg s GLY 3 Ca 0.12 -1.55 0.03 0.00 0.00 0.00 0.00 44.72 43.33 2osg s GLY 3 CO -0.00 -1.63 -0.11 0.14 0.00 0.00 0.00 173.10 171.50 2osg s VAL 4 N -2.66 1.00 -0.41 1.40 1.01 -1.26 -5.12 120.40 114.36 2osg s VAL 4 Ca 0.18 -0.46 -0.12 0.00 0.00 0.00 0.00 61.98 61.58 2osg s VAL 4 Cb -0.02 -0.89 0.05 0.00 0.00 0.00 0.00 36.38 35.52 2osg s VAL 4 CO 0.06 0.31 0.27 -0.22 0.00 0.00 0.00 175.10 175.51 2osg s LEU 5 N 0.27 5.08 -0.21 3.92 0.20 -1.26 -5.06 118.68 121.62 2osg s LEU 5 Ca -0.06 -1.23 -0.05 0.00 0.69 0.00 0.00 54.13 53.48 2osg s LEU 5 Cb -0.11 -2.05 -0.02 0.00 -0.43 0.00 0.00 46.19 43.57 2osg s LEU 5 CO 0.01 -0.50 0.01 -0.22 -0.29 0.00 0.00 176.35 175.37 2osg s LEU 6 N 1.54 3.28 0.09 -0.68 2.96 -1.26 -5.11 118.68 119.51 2osg s LEU 6 Ca 0.03 -0.20 0.03 0.00 -0.22 0.00 0.00 54.13 53.76 2osg s LEU 6 Cb -0.21 -1.84 -0.04 0.00 0.50 0.00 0.00 46.19 44.60 2osg s LEU 6 CO 0.05 0.05 0.13 0.00 -1.32 0.00 0.00 176.35 175.26 2osg s MET 7 N 1.09 3.04 -0.14 1.98 0.00 -1.26 -5.11 119.30 118.89 2osg s MET 7 Ca 0.03 -0.66 -0.09 0.00 0.00 0.00 0.00 55.69 54.97 2osg s MET 7 Cb -0.14 -2.80 -0.04 0.00 0.00 0.00 0.00 34.83 31.84 2osg s MET 7 CO 0.02 0.56 0.16 0.21 0.00 0.00 0.00 175.02 175.97 2osg s LYS 8 N -2.56 3.75 -0.46 3.16 2.20 -1.26 -5.02 119.74 119.55 2osg s LYS 8 Ca 0.31 -0.11 0.06 0.00 -0.36 0.00 0.00 55.97 55.87 2osg s LYS 8 Cb -0.12 -3.28 0.30 0.00 -1.51 0.00 0.00 37.83 33.22 2osg s LYS 8 CO 0.24 0.59 1.07 0.43 -0.36 0.00 0.00 175.35 177.32 2osg n SER 9 N 2.54 -2.46 -0.96 1.43 7.64 -1.26 -4.97 113.62 115.58 2osg n SER 9 Ca -0.18 -3.54 -0.04 0.00 1.01 0.00 0.00 58.87 56.12 2osg n SER 9 Cb 0.54 1.88 -0.04 0.00 -1.01 0.00 0.00 64.21 65.58 2osg n SER 9 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 2osg n ARG 10 N 0.72 0.00 -3.43 1.43 3.00 -1.26 -5.06 116.66 112.06 2osg n ARG 10 Ca 0.06 -0.96 -0.16 0.00 -0.01 0.00 0.00 57.85 56.79 2osg n ARG 10 Cb 0.68 0.30 0.00 0.00 0.00 0.00 0.00 32.46 33.44 2osg n ARG 10 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2osg n ALA 11 N 0.07 -2.66 -2.49 7.54 0.00 -1.26 -5.02 120.51 116.69 2osg n ALA 11 Ca -0.17 0.01 -0.09 0.00 0.00 0.00 0.00 53.44 53.19 2osg n ALA 11 Cb 0.73 -1.40 -0.08 0.00 0.00 0.00 0.00 19.45 18.70 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 -2.80 0.17 -0.43 0.00 0.02 -1.26 -5.13 114.94 105.51 2osg s ASN 12 Ca 0.06 -0.77 -0.19 0.00 -1.02 0.00 0.00 52.86 50.94 2osg s ASN 12 Cb -0.01 0.33 0.02 0.00 0.02 0.00 0.00 41.25 41.61 2osg s ASN 12 CO 0.83 -0.74 0.52 -0.70 0.02 0.00 0.00 177.10 177.04 2osg s GLU 13 N -3.90 3.17 0.39 -0.60 -6.30 -1.26 -4.93 118.70 105.28 2osg s GLU 13 Ca 0.08 -0.60 0.00 0.00 -2.50 0.00 0.00 54.97 51.95 2osg s GLU 13 Cb 0.05 -3.96 0.00 0.00 0.00 0.00 0.00 34.13 30.22 2osg s GLU 13 CO -0.08 -0.92 0.00 -1.91 0.02 0.00 0.00 175.26 172.37 2osg n GLU 14 N 5.88 -2.14 0.16 4.30 2.13 -1.26 -4.48 120.64 125.23 2osg n GLU 14 Ca -0.05 1.74 0.13 0.00 0.66 0.00 0.00 57.16 59.64 2osg n GLU 14 Cb 0.48 -2.50 0.50 0.00 0.27 0.00 0.00 31.44 30.18 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 -0.91 0.00 0.00 4.31 -1.99 -2.01 -3.46 116.97 112.90 2osg h TYR 15 Ca -0.12 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.61 2osg h TYR 15 Cb 0.89 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.62 2osg h TYR 15 CO 0.03 0.00 0.00 0.41 -0.00 0.00 0.00 178.16 178.60 2osg n GLY 16 N 0.29 0.54 3.42 3.88 0.00 -1.26 -5.04 105.19 107.02 2osg n GLY 16 Ca 0.03 -0.84 -0.37 0.00 0.00 0.00 0.00 46.02 44.83 2osg n GLY 16 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2osg s LEU 17 N 0.00 3.72 -0.37 0.99 2.96 -1.26 -5.07 118.68 119.64 2osg s LEU 17 Ca 0.00 -0.40 -0.16 0.00 -0.22 0.00 0.00 54.13 53.35 2osg s LEU 17 Cb 0.00 -1.94 0.00 0.00 0.50 0.00 0.00 46.19 44.75 2osg s LEU 17 CO 0.00 -0.11 0.39 -0.13 -1.32 0.00 0.00 176.35 175.18 2osg s ARG 18 N 1.59 3.39 -0.23 1.98 0.52 -1.26 -5.05 118.95 119.88 2osg s ARG 18 Ca 0.05 -0.55 -0.09 0.00 -0.52 0.00 0.00 55.73 54.62 2osg s ARG 18 Cb -0.16 -3.87 -0.04 0.00 0.52 0.00 0.00 34.95 31.40 2osg s ARG 18 CO 0.04 -0.65 0.12 -0.51 0.02 0.00 0.00 175.30 174.33 2osg s LEU 19 N 2.06 3.91 0.00 2.53 1.02 -1.26 -5.09 118.68 121.84 2osg s LEU 19 Ca 0.12 0.03 0.00 0.00 0.02 0.00 0.00 54.13 54.30 2osg s LEU 19 Cb -0.17 -2.04 0.00 0.00 0.02 0.00 0.00 46.19 44.01 2osg s LEU 19 CO 0.12 0.07 0.00 0.61 0.02 0.00 0.00 176.35 177.17 2osg n GLY 20 N 4.28 2.64 3.16 -3.19 0.00 -1.26 -5.15 105.19 105.67 2osg n GLY 20 Ca -0.16 -2.09 -0.12 0.00 0.00 0.00 0.00 46.02 43.65 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 -0.82 -0.11 -0.02 1.61 1.04 -1.26 -5.03 113.70 109.11 2osg s SER 21 Ca 0.00 0.05 0.03 0.00 0.48 0.00 0.00 55.95 56.50 2osg s SER 21 Cb 0.00 0.31 -0.00 0.00 0.10 0.00 0.00 66.02 66.43 2osg s SER 21 CO 0.00 -0.34 -0.10 0.00 0.98 0.00 0.00 173.24 173.78 2osg s GLN 22 N -1.06 0.96 -0.24 4.02 -2.07 -1.26 0.89 119.66 120.89 2osg s GLN 22 Ca -0.11 -0.35 -0.22 0.00 -1.82 0.00 0.00 55.36 52.86 2osg s GLN 22 Cb -0.06 -0.90 -0.02 0.00 -1.09 0.00 0.00 33.01 30.95 2osg s GLN 22 CO 0.02 0.16 0.70 0.42 -1.32 0.00 0.00 175.29 175.28 2osg s ILE 23 N 0.02 4.94 0.38 3.63 1.01 -0.50 -4.93 121.20 125.75 2osg s ILE 23 Ca -0.00 1.30 0.04 0.00 0.00 0.00 0.00 60.65 61.99 2osg s ILE 23 Cb -0.07 -4.00 -0.06 0.00 0.01 0.00 0.00 42.46 38.34 2osg s ILE 23 CO 0.00 0.01 0.05 0.72 0.00 0.00 0.00 174.94 175.72 2osg s PHE 24 N 2.50 2.10 -0.71 3.97 -0.71 -1.26 0.18 117.98 124.05 2osg s PHE 24 Ca 0.30 -0.91 -0.25 0.00 -1.04 0.00 0.00 56.93 55.02 2osg s PHE 24 Cb -0.16 -1.46 0.04 0.00 -1.21 0.00 0.00 43.02 40.24 2osg s PHE 24 CO 0.09 0.13 1.16 0.08 -1.34 0.00 0.00 175.22 175.33 2osg s VAL 25 N -3.06 3.95 -0.00 -2.49 1.01 -1.10 -4.88 120.40 113.83 2osg s VAL 25 Ca 0.31 0.14 -0.23 0.00 0.00 0.00 0.00 61.98 62.19 2osg s VAL 25 Cb 0.07 -4.83 -0.14 0.00 0.00 0.00 0.00 36.38 31.48 2osg s VAL 25 CO 0.15 -1.70 1.04 0.50 0.00 0.00 0.00 175.10 175.09 2osg h LYS 26 N 9.84 -0.59 -2.03 2.72 1.63 -1.93 0.97 116.57 127.19 2osg h LYS 26 Ca -0.28 0.04 -0.01 0.00 -0.85 0.00 0.00 60.65 59.55 2osg h LYS 26 Cb 1.06 0.13 -0.21 0.00 -0.60 0.00 0.00 32.23 32.61 2osg h LYS 26 CO 1.24 -0.29 0.05 -2.00 -3.45 0.00 0.00 179.45 175.00 2osg s GLU 27 N -4.30 0.75 0.22 1.90 2.12 -1.26 -4.60 118.70 113.52 2osg s GLU 27 Ca -0.13 1.11 0.09 0.00 0.36 0.00 0.00 54.97 56.40 2osg s GLU 27 Cb 0.01 0.25 -0.04 0.00 0.26 0.00 0.00 34.13 34.61 2osg s GLU 27 CO 0.44 -0.13 -0.07 0.00 -0.54 0.00 0.00 175.26 174.96 2osg s MET 28 N 1.08 2.13 0.31 4.30 0.23 -1.26 -5.10 119.30 120.98 2osg s MET 28 Ca -0.06 -1.35 -0.29 0.00 -1.03 0.00 0.00 55.69 52.97 2osg s MET 28 Cb -0.05 -2.14 -0.10 0.00 -1.53 0.00 0.00 34.83 31.00 2osg s MET 28 CO -0.11 0.40 1.38 -0.08 -2.03 0.00 0.00 175.02 174.58 2osg s THR 29 N -1.98 2.61 0.50 3.16 -1.32 -1.26 -4.98 115.64 112.38 2osg s THR 29 Ca 0.28 0.58 -0.21 0.00 -1.21 0.00 0.00 61.69 61.13 2osg s THR 29 Cb -0.08 -3.37 -0.07 0.00 -1.51 0.00 0.00 72.50 67.48 2osg s THR 29 CO 0.17 0.12 1.13 -0.60 -2.21 0.00 0.00 174.62 173.23 2osg s ARG 30 N -1.33 3.57 -1.57 7.08 6.06 -1.26 -3.26 118.95 128.25 2osg s ARG 30 Ca 0.53 1.63 -0.02 0.00 -2.50 0.00 0.00 55.73 55.37 2osg s ARG 30 Cb -0.41 -2.17 0.01 0.00 0.06 0.00 0.00 34.95 32.43 2osg s ARG 30 CO 0.51 -0.67 0.20 2.41 -2.50 0.00 0.00 175.30 175.25 2osg n THR 31 N -0.94 -1.22 -1.27 4.11 -1.04 -1.26 -4.98 114.28 107.69 2osg n THR 31 Ca 0.10 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.11 2osg n THR 31 Cb 0.50 -2.85 0.00 0.00 -1.82 0.00 0.00 70.33 66.16 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 -1.14 1.65 0.08 3.41 0.00 -1.20 -4.91 105.19 103.08 2osg n GLY 32 Ca -0.18 -1.91 -0.10 0.00 0.00 0.00 0.00 46.02 43.83 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 0.11 -0.26 0.99 3.38 -1.94 -2.80 115.31 114.79 2osg h LEU 33 Ca 0.00 -0.16 -0.21 0.00 0.09 0.00 0.00 57.88 57.60 2osg h LEU 33 Cb 0.00 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 40.71 2osg h LEU 33 CO 0.00 1.14 -0.87 0.00 0.09 0.00 0.00 178.44 178.80 2osg h ALA 34 N 0.84 0.47 0.07 1.53 0.00 -1.96 -3.16 119.26 117.06 2osg h ALA 34 Ca -0.19 -0.68 -0.25 0.00 0.00 0.00 0.00 54.91 53.79 2osg h ALA 34 Cb 1.94 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 19.68 2osg h ALA 34 CO 0.12 0.82 -1.11 1.15 0.00 0.00 0.00 179.25 180.22 2osg h THR 35 N 0.22 1.53 -0.86 0.00 2.02 -1.84 0.53 112.91 114.51 2osg h THR 35 Ca -0.06 -3.00 0.00 0.00 0.77 0.00 0.00 66.41 64.12 2osg h THR 35 Cb 1.48 2.81 -0.04 0.00 -1.74 0.00 0.00 68.15 70.65 2osg h THR 35 CO 0.15 0.87 0.55 0.50 0.37 0.00 0.00 175.52 177.96 2osg h LYS 36 N 0.08 1.14 0.00 6.66 3.64 -1.53 -3.23 116.57 123.32 2osg h LYS 36 Ca -0.09 -0.08 -0.32 0.00 -1.27 0.00 0.00 60.65 58.89 2osg h LYS 36 Cb 1.83 -0.25 -0.06 0.00 -0.41 0.00 0.00 32.23 33.34 2osg h LYS 36 CO 0.18 0.76 -2.19 -0.25 -2.27 0.00 0.00 179.45 175.68 2osg n ASP 37 N -4.39 1.20 -1.78 4.20 8.00 -1.19 -5.04 116.55 117.54 2osg n ASP 37 Ca 0.10 -0.03 -0.05 0.00 0.71 0.00 0.00 54.79 55.51 2osg n ASP 37 Cb 0.03 0.58 0.03 0.00 -0.02 0.00 0.00 41.12 41.74 2osg n ASP 37 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2osg n GLY 38 N 2.09 0.19 0.10 0.44 0.00 0.18 -5.00 105.19 103.18 2osg n GLY 38 Ca -0.31 -0.29 -0.18 0.00 0.00 0.00 0.00 46.02 45.24 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 -0.61 0.17 -3.35 1.61 -1.07 -1.89 -3.45 115.58 106.99 2osg h ASN 39 Ca -0.19 -0.88 -0.63 0.00 0.07 0.00 0.00 56.30 54.68 2osg h ASN 39 Cb 1.11 -0.06 -0.19 0.00 -2.07 0.00 0.00 38.32 37.11 2osg h ASN 39 CO 0.16 1.28 -0.61 -0.76 0.07 0.00 0.00 177.43 177.58 2osg s LEU 40 N -7.96 3.56 -0.10 6.14 1.43 -1.26 -5.09 118.68 115.39 2osg s LEU 40 Ca -0.20 -0.04 -0.15 0.00 -1.03 0.00 0.00 54.13 52.72 2osg s LEU 40 Cb 0.01 -1.89 -0.05 0.00 0.03 0.00 0.00 46.19 44.29 2osg s LEU 40 CO 0.72 0.14 0.37 -2.28 0.23 0.00 0.00 176.35 175.53 2osg s HIS 41 N 0.55 3.56 -0.28 0.29 2.46 -1.26 -4.95 115.29 115.65 2osg s HIS 41 Ca 0.01 0.78 -0.32 0.00 0.47 0.00 0.00 55.06 56.00 2osg s HIS 41 Cb -0.13 -2.36 -0.09 0.00 -0.13 0.00 0.00 32.58 29.87 2osg s HIS 41 CO 0.02 0.36 2.19 0.39 -2.47 0.00 0.00 174.74 175.23 2osg n GLU 42 N 3.03 1.50 0.00 2.88 1.02 -1.26 -0.20 120.64 127.60 2osg n GLU 42 Ca -0.12 0.41 0.00 0.00 -0.02 0.00 0.00 57.16 57.44 2osg n GLU 42 Cb 0.52 -2.80 0.00 0.00 -0.02 0.00 0.00 31.44 29.14 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 6.13 0.84 3.74 0.62 0.00 0.34 -4.96 105.19 111.91 2osg n GLY 43 Ca 0.36 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.97 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 -1.85 7.13 -0.29 1.61 2.15 0.72 -4.72 116.67 121.42 2osg s ASP 44 Ca 0.00 2.21 -0.29 0.00 0.43 0.00 0.00 52.55 54.90 2osg s ASP 44 Cb 0.00 -2.61 -0.00 0.00 -0.30 0.00 0.00 42.92 40.01 2osg s ASP 44 CO 0.00 -0.32 1.38 0.27 -0.17 0.00 0.00 175.17 176.33 2osg s ILE 45 N -0.20 4.02 0.20 4.11 -4.36 -1.26 -2.72 121.20 121.00 2osg s ILE 45 Ca 0.51 1.14 -0.29 0.00 -0.26 0.00 0.00 60.65 61.75 2osg s ILE 45 Cb -0.32 -4.06 -0.08 0.00 1.25 0.00 0.00 42.46 39.25 2osg s ILE 45 CO 0.37 -0.46 0.92 -0.63 0.24 0.00 0.00 174.94 175.38 2osg s ILE 46 N 4.65 4.20 -0.23 8.37 1.01 0.13 -2.96 121.20 136.36 2osg s ILE 46 Ca 0.60 2.03 -0.13 0.00 0.00 0.00 0.00 60.65 63.15 2osg s ILE 46 Cb -0.18 -4.30 -0.17 0.00 0.01 0.00 0.00 42.46 37.82 2osg s ILE 46 CO 0.25 0.46 -0.08 -0.11 0.00 0.00 0.00 174.94 175.47 2osg n LEU 47 N 1.78 2.19 -3.74 2.97 0.00 0.25 -4.45 117.00 116.00 2osg n LEU 47 Ca -0.02 0.26 -0.14 0.00 0.00 0.00 0.00 56.01 56.12 2osg n LEU 47 Cb 0.48 -0.92 -0.09 0.00 0.00 0.00 0.00 43.42 42.89 2osg n LEU 47 CO 0.50 0.59 0.06 -0.54 0.00 0.00 0.00 177.39 177.99 2osg s LYS 48 N -2.48 0.66 -0.08 1.96 1.02 -1.15 -1.71 119.74 117.95 2osg s LYS 48 Ca -0.33 -0.03 -0.02 0.00 0.02 0.00 0.00 55.97 55.61 2osg s LYS 48 Cb 0.10 0.30 0.03 0.00 -0.52 0.00 0.00 37.83 37.74 2osg s LYS 48 CO 0.57 -0.17 0.03 0.42 -0.92 0.00 0.00 175.35 175.28 2osg s ILE 49 N -1.04 0.22 -1.37 2.17 1.01 0.16 0.40 121.20 122.75 2osg s ILE 49 Ca -0.11 0.13 -0.06 0.00 0.00 0.00 0.00 60.65 60.61 2osg s ILE 49 Cb -0.04 -0.47 0.03 0.00 0.01 0.00 0.00 42.46 41.98 2osg s ILE 49 CO 0.04 0.15 0.93 -3.20 0.00 0.00 0.00 174.94 172.87 2osg n ASN 50 N 5.19 -3.43 -0.45 3.58 4.05 0.02 -1.18 115.26 123.04 2osg n ASN 50 Ca -0.06 -0.72 -0.06 0.00 0.45 0.00 0.00 54.58 54.19 2osg n ASN 50 Cb 0.50 -4.38 -0.03 0.00 1.23 0.00 0.00 39.78 37.10 2osg n ASN 50 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 2osg n GLY 51 N -1.62 0.76 3.27 8.20 0.00 -1.26 -4.99 105.19 109.54 2osg n GLY 51 Ca -0.13 -0.27 -0.31 0.00 0.00 0.00 0.00 46.02 45.31 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 -1.97 1.97 0.57 2.61 2.01 -0.32 -5.12 115.64 115.39 2osg s THR 52 Ca 0.00 -1.04 -0.21 0.00 0.31 0.00 0.00 61.69 60.75 2osg s THR 52 Cb 0.00 -1.65 -0.04 0.00 0.01 0.00 0.00 72.50 70.82 2osg s THR 52 CO 0.00 0.55 1.35 -0.69 -0.69 0.00 0.00 174.62 175.14 2osg s VAL 53 N -0.31 2.05 -0.11 3.82 1.01 -1.26 0.40 120.40 126.00 2osg s VAL 53 Ca 0.01 0.04 0.14 0.00 0.00 0.00 0.00 61.98 62.17 2osg s VAL 53 Cb -0.12 -3.02 0.25 0.00 0.00 0.00 0.00 36.38 33.49 2osg s VAL 53 CO 0.02 -0.00 1.13 0.41 0.00 0.00 0.00 175.10 176.65 2osg n THR 54 N -1.23 1.44 -5.00 3.92 -1.04 -0.70 -4.72 114.28 106.95 2osg n THR 54 Ca 0.12 -1.85 -0.32 0.00 -2.04 0.00 0.00 64.05 59.95 2osg n THR 54 Cb 0.46 -0.02 -0.16 0.00 -1.82 0.00 0.00 70.33 68.78 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 -2.18 3.19 0.00 -2.82 2.12 -1.26 -1.41 118.70 116.34 2osg s GLU 55 Ca 0.26 -0.80 0.00 0.00 0.36 0.00 0.00 54.97 54.80 2osg s GLU 55 Cb 0.24 -2.45 0.00 0.00 0.26 0.00 0.00 34.13 32.18 2osg s GLU 55 CO 0.00 0.18 0.00 0.09 -0.54 0.00 0.00 175.26 175.00 2osg n ASN 56 N 3.55 0.00 -4.30 -1.70 3.02 0.26 -4.98 115.26 111.12 2osg n ASN 56 Ca -0.19 0.00 -0.29 0.00 -0.03 0.00 0.00 54.58 54.07 2osg n ASN 56 Cb 0.53 -1.00 0.21 0.00 -0.61 0.00 0.00 39.78 38.91 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 -0.29 -0.50 0.10 3.52 1.75 -1.26 -4.90 119.30 117.71 2osg s MET 57 Ca 0.00 0.30 -0.21 0.00 -1.25 0.00 0.00 55.69 54.52 2osg s MET 57 Cb 0.00 -1.65 -0.07 0.00 2.84 0.00 0.00 34.83 35.95 2osg s MET 57 CO 0.00 -3.31 0.63 -1.12 -0.65 0.00 0.00 175.02 170.57 2osg s SER 58 N -3.52 7.16 0.24 1.11 0.01 -1.26 -4.93 113.70 112.51 2osg s SER 58 Ca 0.68 1.37 -0.05 0.00 1.31 0.00 0.00 55.95 59.25 2osg s SER 58 Cb -0.16 -2.40 0.35 0.00 0.21 0.00 0.00 66.02 64.02 2osg s SER 58 CO 0.58 0.25 1.83 0.25 0.41 0.00 0.00 173.24 176.55 2osg h LEU 59 N 4.54 0.74 -0.91 2.44 6.46 -2.00 -0.66 115.31 125.93 2osg h LEU 59 Ca -0.49 0.03 -0.07 0.00 -0.12 0.00 0.00 57.88 57.23 2osg h LEU 59 Cb 1.21 -0.12 -0.02 0.00 -0.73 0.00 0.00 40.66 41.00 2osg h LEU 59 CO 0.64 0.46 0.01 0.74 -0.62 0.00 0.00 178.44 179.67 2osg h THR 60 N 0.87 1.24 -0.29 1.05 2.02 -1.99 -2.37 112.91 113.45 2osg h THR 60 Ca 0.37 -1.00 -0.06 0.00 0.77 0.00 0.00 66.41 66.50 2osg h THR 60 Cb 0.25 0.85 -0.01 0.00 -1.74 0.00 0.00 68.15 67.50 2osg h THR 60 CO -0.20 0.35 -0.06 0.44 0.37 0.00 0.00 175.52 176.43 2osg h ASP 61 N 0.76 0.55 -0.83 4.18 3.32 -1.67 -0.78 116.42 121.95 2osg h ASP 61 Ca 0.15 -0.36 0.01 0.00 0.02 0.00 0.00 57.03 56.86 2osg h ASP 61 Cb 0.45 -0.15 -0.04 0.00 0.22 0.00 0.00 39.33 39.80 2osg h ASP 61 CO 0.02 0.77 0.55 0.00 -1.72 0.00 0.00 179.24 178.86 2osg h ALA 62 N 0.79 1.06 -0.16 3.45 0.00 -1.03 0.18 119.26 123.56 2osg h ALA 62 Ca 0.07 -0.05 -0.16 0.00 0.00 0.00 0.00 54.91 54.77 2osg h ALA 62 Cb 0.53 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 2osg h ALA 62 CO 0.03 0.44 -0.59 0.07 0.00 0.00 0.00 179.25 179.20 2osg h ARG 63 N 1.11 0.51 -0.42 0.00 0.11 -1.36 -2.93 114.38 111.39 2osg h ARG 63 Ca 0.31 -0.34 -0.13 0.00 0.10 0.00 0.00 59.98 59.92 2osg h ARG 63 Cb -0.10 0.05 -0.01 0.00 1.11 0.00 0.00 29.97 31.01 2osg h ARG 63 CO -0.08 0.95 -0.24 -0.22 0.10 0.00 0.00 179.97 180.48 2osg h LYS 64 N 0.39 0.87 -0.52 0.08 3.64 -0.62 -1.96 116.57 118.45 2osg h LYS 64 Ca -0.00 -0.37 0.01 0.00 -1.27 0.00 0.00 60.65 59.02 2osg h LYS 64 Cb 1.13 -0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 32.90 2osg h LYS 64 CO 0.11 1.02 0.33 1.25 -2.27 0.00 0.00 179.45 179.89 2osg h LEU 65 N 0.75 0.57 -0.70 5.20 5.85 -0.59 0.24 115.31 126.63 2osg h LEU 65 Ca 0.10 -0.01 -0.12 0.00 0.84 0.00 0.00 57.88 58.68 2osg h LEU 65 Cb 0.79 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.67 2osg h LEU 65 CO 0.07 0.41 -0.29 0.40 -0.34 0.00 0.00 178.44 178.69 2osg h ILE 66 N 0.68 1.28 -0.06 4.05 2.04 -1.43 -1.50 117.51 122.57 2osg h ILE 66 Ca 0.19 -1.41 -0.02 0.00 1.00 0.00 0.00 64.86 64.63 2osg h ILE 66 Cb -0.06 1.34 -0.00 0.00 -0.74 0.00 0.00 36.82 37.36 2osg h ILE 66 CO -0.05 0.46 -0.03 -0.33 0.00 0.00 0.00 178.15 178.20 2osg h GLU 67 N 0.59 0.12 0.00 2.37 3.07 -0.90 -3.07 114.58 116.76 2osg h GLU 67 Ca 0.07 -0.05 -0.04 0.00 -0.50 0.00 0.00 59.36 58.84 2osg h GLU 67 Cb 0.79 -0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.69 2osg h GLU 67 CO 0.06 0.50 -0.19 -0.22 -1.40 0.00 0.00 179.01 177.77 2osg h LYS 68 N -0.26 0.00 -5.50 2.33 3.11 -0.53 -3.36 116.57 112.35 2osg h LYS 68 Ca 0.01 0.00 -0.67 0.00 -2.81 0.00 0.00 60.65 57.18 2osg h LYS 68 Cb 0.47 0.00 -0.13 0.00 -1.00 0.00 0.00 32.23 31.57 2osg h LYS 68 CO 0.01 0.19 1.49 -1.12 -2.81 0.00 0.00 179.45 177.21 2osg s SER 69 N -6.86 6.74 -0.38 4.20 0.01 -0.57 -4.97 113.70 111.87 2osg s SER 69 Ca -0.04 -2.17 -0.18 0.00 1.31 0.00 0.00 55.95 54.87 2osg s SER 69 Cb 0.15 -2.50 0.01 0.00 0.21 0.00 0.00 66.02 63.89 2osg s SER 69 CO 0.68 -1.16 0.53 0.00 0.41 0.00 0.00 173.24 173.70 2osg s ARG 70 N 3.52 3.47 0.00 12.44 1.70 -1.26 -4.65 118.95 134.17 2osg s ARG 70 Ca 0.44 -0.30 0.00 0.00 -0.47 0.00 0.00 55.73 55.40 2osg s ARG 70 Cb -0.01 -3.86 0.00 0.00 -0.57 0.00 0.00 34.95 30.51 2osg s ARG 70 CO -0.03 -0.75 0.00 0.41 -1.08 0.00 0.00 175.30 173.85 2osg n GLY 71 N 4.90 1.35 3.15 3.88 0.00 -1.26 -5.06 105.19 112.15 2osg n GLY 71 Ca -0.05 -0.43 -0.28 0.00 0.00 0.00 0.00 46.02 45.26 2osg n GLY 71 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2osg s LYS 72 N 0.00 2.32 -0.02 1.61 -2.85 -1.26 -5.13 119.74 114.40 2osg s LYS 72 Ca 0.00 -0.69 0.04 0.00 -1.00 0.00 0.00 55.97 54.32 2osg s LYS 72 Cb 0.00 -1.86 -0.01 0.00 -2.06 0.00 0.00 37.83 33.91 2osg s LYS 72 CO 0.00 0.18 -0.13 -0.48 0.10 0.00 0.00 175.35 175.01 2osg s LEU 73 N 0.30 1.96 -0.12 2.77 2.34 -1.26 -5.02 118.68 119.65 2osg s LEU 73 Ca -0.12 -0.25 -0.06 0.00 0.06 0.00 0.00 54.13 53.75 2osg s LEU 73 Cb -0.15 -0.71 -0.04 0.00 -0.56 0.00 0.00 46.19 44.73 2osg s LEU 73 CO 0.05 0.15 0.11 -1.58 -1.06 0.00 0.00 176.35 174.01 2osg s GLN 74 N -0.17 3.41 -0.06 1.48 0.74 -1.26 -4.93 119.66 118.87 2osg s GLN 74 Ca 0.02 -0.20 0.00 0.00 0.05 0.00 0.00 55.36 55.23 2osg s GLN 74 Cb -0.07 -3.12 0.02 0.00 1.10 0.00 0.00 33.01 30.95 2osg s GLN 74 CO 0.00 0.71 -0.04 -0.51 -0.55 0.00 0.00 175.29 174.90 2osg s LEU 75 N -0.85 1.09 0.06 3.68 1.43 -1.26 -0.80 118.68 122.03 2osg s LEU 75 Ca 0.14 -0.15 0.08 0.00 -1.03 0.00 0.00 54.13 53.16 2osg s LEU 75 Cb -0.12 -0.53 -0.03 0.00 0.03 0.00 0.00 46.19 45.54 2osg s LEU 75 CO 0.03 -0.10 -0.19 -0.69 0.23 0.00 0.00 176.35 175.63 2osg s VAL 76 N 1.35 2.73 -0.01 -1.59 1.01 0.16 -4.98 120.40 119.08 2osg s VAL 76 Ca -0.04 -1.31 0.08 0.00 0.00 0.00 0.00 61.98 60.71 2osg s VAL 76 Cb -0.13 -2.17 -0.02 0.00 0.00 0.00 0.00 36.38 34.05 2osg s VAL 76 CO -0.03 0.27 -0.24 0.68 0.00 0.00 0.00 175.10 175.78 2osg s VAL 77 N -0.98 1.94 -0.00 2.92 -7.23 -1.26 0.84 120.40 116.62 2osg s VAL 77 Ca 0.15 -1.08 -0.26 0.00 -1.81 0.00 0.00 61.98 58.99 2osg s VAL 77 Cb -0.10 -1.61 -0.04 0.00 0.56 0.00 0.00 36.38 35.18 2osg s VAL 77 CO 0.06 0.52 0.80 -0.22 -0.31 0.00 0.00 175.10 175.95 2osg s LEU 78 N -0.65 4.39 0.00 1.32 2.96 -1.16 -4.74 118.68 120.80 2osg s LEU 78 Ca 0.10 1.42 0.00 0.00 -0.22 0.00 0.00 54.13 55.42 2osg s LEU 78 Cb -0.09 -3.27 0.00 0.00 0.50 0.00 0.00 46.19 43.33 2osg s LEU 78 CO -0.01 -0.09 0.00 0.54 -1.32 0.00 0.00 176.35 175.47 2osg n ARG 79 N 3.38 -1.06 -3.02 1.98 3.00 -1.26 -4.91 116.66 114.77 2osg n ARG 79 Ca 0.00 0.70 -0.09 0.00 -0.01 0.00 0.00 57.85 58.45 2osg n ARG 79 Cb 0.51 -1.30 0.01 0.00 0.00 0.00 0.00 32.46 31.68 2osg n ARG 79 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.63 174.16 2osg n ASP 80 N -2.98 -7.56 -3.47 0.55 -0.08 -1.26 -5.05 116.55 96.70 2osg n ASP 80 Ca 0.00 0.22 0.01 0.00 -1.51 0.00 0.00 54.79 53.51 2osg n ASP 80 Cb 0.24 -4.88 -0.04 0.00 2.34 0.00 0.00 41.12 38.77 2osg n ASP 80 CO 0.00 0.00 0.00 -0.55 0.12 0.00 0.00 177.20 176.77 2osg s SER 81 N -2.65 -0.67 0.15 1.67 0.15 -1.26 -5.08 113.70 106.00 2osg s SER 81 Ca 0.17 0.94 0.00 0.00 0.70 0.00 0.00 55.95 57.76 2osg s SER 81 Cb -0.04 1.73 0.00 0.00 -1.71 0.00 0.00 66.02 65.99 2osg s SER 81 CO 0.78 -0.13 0.00 0.18 1.20 0.00 0.00 173.24 175.27 2osg n LEU 82 N 4.94 0.09 -0.74 3.45 4.32 -1.26 -5.27 117.00 122.52 2osg n LEU 82 Ca -0.11 0.25 0.13 0.00 -0.02 0.00 0.00 56.01 56.26 2osg n LEU 82 Cb 0.52 0.14 0.29 0.00 -1.62 0.00 0.00 43.42 42.75 2osg n LEU 82 CO -0.04 -0.67 0.74 1.21 -1.22 0.00 0.00 177.39 177.41