#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fqh s SER 2 N 0.00 0.04 -0.10 7.83 0.01 -1.26 -4.94 113.70 115.28 2fqh s SER 2 Ca 0.00 0.02 -0.04 0.00 1.31 0.00 0.00 55.95 57.24 2fqh s SER 2 Cb 0.00 -0.04 0.05 0.00 0.21 0.00 0.00 66.02 66.24 2fqh s SER 2 CO 0.00 -0.07 0.20 -1.83 0.41 0.00 0.00 173.24 171.96 2fqh s GLU 3 N 0.57 0.11 -0.29 12.44 -1.05 -1.25 -3.66 118.70 125.56 2fqh s GLU 3 Ca -0.05 0.58 -0.01 0.00 -0.15 0.00 0.00 54.97 55.34 2fqh s GLU 3 Cb -0.07 -0.16 0.05 0.00 -0.44 0.00 0.00 34.13 33.51 2fqh s GLU 3 CO -0.02 -0.25 -0.01 0.54 0.95 0.00 0.00 175.26 176.47 2fqh s VAL 4 N 1.97 2.93 -0.05 1.83 0.11 -1.20 -2.86 120.40 123.13 2fqh s VAL 4 Ca -0.02 -1.35 0.02 0.00 -2.93 0.00 0.00 61.98 57.70 2fqh s VAL 4 Cb -0.12 -2.66 0.01 0.00 -1.53 0.00 0.00 36.38 32.08 2fqh s VAL 4 CO -0.07 -0.06 -0.11 0.54 -3.33 0.00 0.00 175.10 172.06 2fqh s ASN 5 N 1.25 1.54 -0.06 3.54 4.22 -0.24 -3.56 114.94 121.64 2fqh s ASN 5 Ca -0.05 -0.25 -0.02 0.00 -2.14 0.00 0.00 52.86 50.40 2fqh s ASN 5 Cb -0.19 -0.58 0.04 0.00 1.28 0.00 0.00 41.25 41.79 2fqh s ASN 5 CO -0.02 0.05 0.11 -0.63 -2.04 0.00 0.00 177.10 174.58 2fqh s ILE 6 N 0.44 -0.09 -0.11 0.54 1.09 -1.26 -2.89 121.20 118.92 2fqh s ILE 6 Ca -0.09 0.24 0.01 0.00 -1.10 0.00 0.00 60.65 59.71 2fqh s ILE 6 Cb -0.13 -0.21 0.02 0.00 -1.06 0.00 0.00 42.46 41.09 2fqh s ILE 6 CO 0.02 0.10 -0.13 0.54 -0.10 0.00 0.00 174.94 175.36 2fqh s VAL 7 N 1.41 1.40 -0.11 2.92 0.11 -1.10 -4.57 120.40 120.46 2fqh s VAL 7 Ca -0.06 -0.56 0.03 0.00 -2.93 0.00 0.00 61.98 58.46 2fqh s VAL 7 Cb -0.12 -1.30 -0.01 0.00 -1.53 0.00 0.00 36.38 33.42 2fqh s VAL 7 CO -0.05 0.42 -0.20 -0.69 -3.33 0.00 0.00 175.10 171.25 2fqh s VAL 8 N 1.20 2.40 -0.23 2.04 1.01 -1.26 -3.25 120.40 122.32 2fqh s VAL 8 Ca -0.03 -0.90 0.01 0.00 0.00 0.00 0.00 61.98 61.07 2fqh s VAL 8 Cb -0.14 -1.95 0.04 0.00 0.00 0.00 0.00 36.38 34.33 2fqh s VAL 8 CO -0.04 0.55 -0.14 0.21 0.00 0.00 0.00 175.10 175.68 2fqh s ASN 9 N 0.28 3.92 -1.51 3.32 2.47 -1.26 -4.62 114.94 117.55 2fqh s ASN 9 Ca -0.15 -1.03 0.00 0.00 0.42 0.00 0.00 52.86 52.11 2fqh s ASN 9 Cb -0.17 -1.54 0.00 0.00 -1.45 0.00 0.00 41.25 38.09 2fqh s ASN 9 CO 0.07 -0.11 0.00 0.61 -3.72 0.00 0.00 177.10 173.96 2fqh n GLY 10 N 4.54 0.20 2.85 1.21 0.00 -1.26 -2.93 105.19 109.80 2fqh n GLY 10 Ca -0.17 -0.20 -0.12 0.00 0.00 0.00 0.00 46.02 45.53 2fqh n GLY 10 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2fqh n ARG 11 N -2.57 -1.89 -4.06 1.61 1.74 -1.26 -5.02 116.66 105.21 2fqh n ARG 11 Ca -0.19 0.67 -0.32 0.00 -0.77 0.00 0.00 57.85 57.24 2fqh n ARG 11 Cb 0.62 -4.86 -0.06 0.00 -1.02 0.00 0.00 32.46 27.14 2fqh n ARG 11 CO 0.00 0.00 0.00 -2.00 -1.52 0.00 0.00 177.63 174.11 2fqh s GLU 12 N -4.12 3.05 -0.02 5.56 2.56 -1.15 -5.03 118.70 119.55 2fqh s GLU 12 Ca 0.34 -0.55 -0.05 0.00 0.00 0.00 0.00 54.97 54.70 2fqh s GLU 12 Cb -0.04 -2.83 0.00 0.00 2.00 0.00 0.00 34.13 33.25 2fqh s GLU 12 CO 0.57 0.61 0.11 0.00 -0.56 0.00 0.00 175.26 176.00 2fqh s ALA 13 N -1.30 -0.27 -0.07 6.30 0.00 -1.26 -4.66 121.76 120.51 2fqh s ALA 13 Ca 0.27 0.02 0.11 0.00 0.00 0.00 0.00 51.96 52.35 2fqh s ALA 13 Cb -0.12 -0.02 -0.16 0.00 0.00 0.00 0.00 23.12 22.82 2fqh s ALA 13 CO 0.18 -0.14 0.14 0.41 0.00 0.00 0.00 175.76 176.35 2fqh n GLY 14 N 2.12 -0.54 3.90 0.00 0.00 -1.26 -5.03 105.19 104.39 2fqh n GLY 14 Ca -0.19 -0.23 -0.24 0.00 0.00 0.00 0.00 46.02 45.37 2fqh n GLY 14 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2fqh n SER 15 N -2.19 2.54 -0.86 1.61 7.64 -1.26 -4.99 113.62 116.11 2fqh n SER 15 Ca -0.11 -2.78 0.04 0.00 1.01 0.00 0.00 58.87 57.02 2fqh n SER 15 Cb 0.61 -0.19 0.15 0.00 -1.01 0.00 0.00 64.21 63.78 2fqh n SER 15 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 2fqh n LYS 16 N -1.99 2.23 -0.37 1.43 4.01 -1.26 -4.31 118.16 117.91 2fqh n LYS 16 Ca 0.05 -1.22 0.37 0.00 -0.51 0.00 0.00 58.31 57.00 2fqh n LYS 16 Cb 0.63 -1.57 0.66 0.00 -0.51 0.00 0.00 35.03 34.23 2fqh n LYS 16 CO 0.00 0.00 0.00 0.66 -1.11 0.00 0.00 177.40 176.95 2fqh h SER 17 N 1.72 0.00 -0.23 4.39 4.64 -1.85 1.42 113.55 123.63 2fqh h SER 17 Ca 0.00 0.00 0.07 0.00 -0.47 0.00 0.00 61.79 61.39 2fqh h SER 17 Cb 0.81 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.89 2fqh h SER 17 CO 0.12 0.00 0.52 0.11 -0.87 0.00 0.00 176.83 176.71 2fqh h LYS 18 N 0.00 0.00 0.00 4.77 1.57 -1.83 -2.41 116.57 118.67 2fqh h LYS 18 Ca 0.62 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.40 2fqh h LYS 18 Cb 2.90 0.00 0.00 0.00 0.08 0.00 0.00 32.23 35.21 2fqh h LYS 18 CO -0.01 0.00 0.00 0.41 -0.57 0.00 0.00 179.45 179.28 2fqh n GLY 19 N -1.39 1.63 3.38 3.86 0.00 0.49 -4.40 105.19 108.75 2fqh n GLY 19 Ca 0.04 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.86 2fqh n GLY 19 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fqh h ALA 21 N 2.41 1.36 0.00 0.00 0.00 -1.84 -3.29 119.26 117.90 2fqh h ALA 21 Ca -0.39 -0.05 -0.29 0.00 0.00 0.00 0.00 54.91 54.19 2fqh h ALA 21 Cb 1.23 -0.35 -0.05 0.00 0.00 0.00 0.00 17.79 18.62 2fqh h ALA 21 CO 0.65 0.54 -2.02 -0.11 0.00 0.00 0.00 179.25 178.31 2fqh n LEU 22 N -4.44 2.30 -4.92 0.00 7.94 -1.26 -4.98 117.00 111.64 2fqh n LEU 22 Ca 0.13 0.04 -0.26 0.00 -1.11 0.00 0.00 56.01 54.82 2fqh n LEU 22 Cb 0.10 -0.59 -0.00 0.00 0.53 0.00 0.00 43.42 43.46 2fqh n LEU 22 CO 0.35 0.63 0.33 0.00 -1.11 0.00 0.00 177.39 177.58 2fqh n GLY 24 N -2.07 -0.17 0.12 0.00 0.00 -1.26 0.18 105.19 102.00 2fqh n GLY 24 Ca -0.02 0.23 -0.10 0.00 0.00 0.00 0.00 46.02 46.13 2fqh n GLY 24 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fqh n ALA 25 N 2.55 1.75 -2.45 4.61 0.00 -1.26 -4.94 120.51 120.77 2fqh n ALA 25 Ca 0.16 -0.57 -0.29 0.00 0.00 0.00 0.00 53.44 52.74 2fqh n ALA 25 Cb 0.57 0.20 -0.03 0.00 0.00 0.00 0.00 19.45 20.20 2fqh n ALA 25 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2fqh s THR 26 N -2.27 4.98 -0.17 0.00 2.01 -1.26 -5.02 115.64 113.90 2fqh s THR 26 Ca -0.18 0.16 -0.19 0.00 0.31 0.00 0.00 61.69 61.78 2fqh s THR 26 Cb 0.05 -3.74 0.05 0.00 0.01 0.00 0.00 72.50 68.87 2fqh s THR 26 CO 0.30 -0.37 0.53 -1.66 -0.69 0.00 0.00 174.62 172.73 2fqh s TRP 27 N -2.15 -0.56 0.00 4.92 1.48 -1.26 -2.37 118.94 118.99 2fqh s TRP 27 Ca 0.45 1.31 0.00 0.00 -1.06 0.00 0.00 56.10 56.81 2fqh s TRP 27 Cb -0.11 0.21 0.00 0.00 -1.16 0.00 0.00 33.47 32.41 2fqh s TRP 27 CO 0.30 -0.31 0.00 0.41 -4.06 0.00 0.00 176.95 173.29 2fqh n GLY 28 N 2.54 0.88 0.02 3.67 0.00 -1.26 -5.02 105.19 106.01 2fqh n GLY 28 Ca -0.15 -0.87 0.04 0.00 0.00 0.00 0.00 46.02 45.05 2fqh n GLY 28 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2fqh n ASP 29 N 0.00 1.67 -0.09 1.61 9.92 -1.26 -4.42 116.55 123.98 2fqh n ASP 29 Ca 0.00 0.00 0.26 0.00 -0.53 0.00 0.00 54.79 54.52 2fqh n ASP 29 Cb 0.00 1.48 0.71 0.00 -0.64 0.00 0.00 41.12 42.67 2fqh n ASP 29 CO 0.00 0.00 0.00 0.22 0.13 0.00 0.00 177.20 177.55 2fqh h TYR 30 N 0.00 0.00 -2.04 1.24 3.20 -2.01 -3.40 116.97 113.96 2fqh h TYR 30 Ca -0.08 0.00 -0.44 0.00 3.14 0.00 0.00 58.73 61.35 2fqh h TYR 30 Cb 0.92 0.00 0.02 0.00 1.54 0.00 0.00 36.73 39.21 2fqh h TYR 30 CO 0.00 0.00 -0.22 -3.38 -1.64 0.00 0.00 178.16 172.92 2fqh s HIS 31 N -4.76 3.02 0.24 -3.82 -3.43 -1.26 -5.12 115.29 100.17 2fqh s HIS 31 Ca -0.04 -0.13 0.06 0.00 -0.80 0.00 0.00 55.06 54.14 2fqh s HIS 31 Cb 0.18 -2.28 -0.03 0.00 -1.43 0.00 0.00 32.58 29.02 2fqh s HIS 31 CO 0.65 -0.33 0.27 0.00 -2.00 0.00 0.00 174.74 173.33 2fqh s ALA 32 N -2.40 3.76 0.49 -1.38 0.00 -1.26 -5.04 121.76 115.93 2fqh s ALA 32 Ca 0.50 -1.31 0.06 0.00 0.00 0.00 0.00 51.96 51.21 2fqh s ALA 32 Cb -0.10 -1.52 0.00 0.00 0.00 0.00 0.00 23.12 21.51 2fqh s ALA 32 CO 0.34 0.27 0.31 -0.51 0.00 0.00 0.00 175.76 176.18 2fqh s ASP 33 N -3.84 4.60 0.11 0.00 -0.00 -1.26 -4.56 116.67 111.71 2fqh s ASP 33 Ca 0.33 -1.17 0.03 0.00 -0.00 0.00 0.00 52.55 51.74 2fqh s ASP 33 Cb -0.09 0.07 -0.04 0.00 -0.00 0.00 0.00 42.92 42.86 2fqh s ASP 33 CO 0.27 -0.88 -0.08 -0.36 -0.00 0.00 0.00 175.17 174.12 2fqh s PHE 34 N -2.70 0.99 0.55 4.23 0.08 -1.12 -4.71 117.98 115.31 2fqh s PHE 34 Ca 0.35 -0.84 0.30 0.00 0.12 0.00 0.00 56.93 56.86 2fqh s PHE 34 Cb -0.01 -0.55 1.46 0.00 -0.57 0.00 0.00 43.02 43.36 2fqh s PHE 34 CO 0.21 -0.07 1.91 -0.07 -0.10 0.00 0.00 175.22 177.09 2fqh h LEU 35 N 3.03 0.00 0.00 -0.37 3.38 -1.91 1.58 115.31 121.01 2fqh h LEU 35 Ca -0.36 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.61 2fqh h LEU 35 Cb 1.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.93 2fqh h LEU 35 CO 0.62 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.76 2fqh n GLY 36 N -1.65 -0.71 3.38 0.83 0.00 -1.26 -4.87 105.19 100.90 2fqh n GLY 36 Ca 0.15 -0.12 -0.18 0.00 0.00 0.00 0.00 46.02 45.87 2fqh n GLY 36 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2fqh n GLU 37 N -1.06 -3.63 -3.75 1.61 1.02 0.54 -4.92 120.64 110.45 2fqh n GLU 37 Ca 0.14 0.81 -0.11 0.00 -0.02 0.00 0.00 57.16 57.98 2fqh n GLU 37 Cb 0.09 -5.64 -0.07 0.00 -0.02 0.00 0.00 31.44 25.80 2fqh n GLU 37 CO 0.00 0.00 0.00 0.16 1.18 0.00 0.00 177.13 178.47 2fqh s ASP 38 N -3.76 -0.12 -0.21 1.62 1.47 -1.25 -4.50 116.67 109.93 2fqh s ASP 38 Ca 0.29 -0.24 -0.00 0.00 1.18 0.00 0.00 52.55 53.78 2fqh s ASP 38 Cb -0.05 0.37 0.02 0.00 -0.34 0.00 0.00 42.92 42.92 2fqh s ASP 38 CO 0.75 -0.65 -0.13 -0.22 0.68 0.00 0.00 175.17 175.60 2fqh s LEU 39 N -2.20 2.64 -0.36 2.11 0.20 -0.91 -2.78 118.68 117.39 2fqh s LEU 39 Ca -0.03 -0.74 0.07 0.00 0.69 0.00 0.00 54.13 54.12 2fqh s LEU 39 Cb -0.00 -1.57 0.64 0.00 -0.43 0.00 0.00 46.19 44.82 2fqh s LEU 39 CO -0.05 -0.05 1.74 2.22 -0.29 0.00 0.00 176.35 179.92 2fqh n PHE 40 N 4.64 2.26 0.67 5.38 -1.74 -1.26 -4.22 117.46 123.19 2fqh n PHE 40 Ca -0.19 -1.57 0.07 0.00 -0.56 0.00 0.00 57.45 55.21 2fqh n PHE 40 Cb 0.49 -0.73 -0.02 0.00 1.52 0.00 0.00 39.48 40.74 2fqh n PHE 40 CO 0.00 0.00 0.00 0.34 -0.56 0.00 0.00 176.76 176.54 2fqh n PHE 41 N -0.87 0.00 -0.08 2.97 -0.00 -1.26 -3.72 117.46 114.50 2fqh n PHE 41 Ca 0.46 0.00 -0.17 0.00 -0.00 0.00 0.00 57.45 57.74 2fqh n PHE 41 Cb 1.39 0.00 -0.06 0.00 -0.00 0.00 0.00 39.48 40.81 2fqh n PHE 41 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 2fqh n ASP 44 N -3.97 -5.50 -0.05 0.00 5.68 -1.24 -4.76 116.55 106.71 2fqh n ASP 44 Ca -0.07 0.26 -0.05 0.00 -0.50 0.00 0.00 54.79 54.43 2fqh n ASP 44 Cb 0.27 -4.07 -0.02 0.00 -1.14 0.00 0.00 41.12 36.16 2fqh n ASP 44 CO 0.00 0.00 0.00 -0.38 -1.33 0.00 0.00 177.20 175.49 2fqh n ILE 45 N -2.13 1.09 0.86 2.12 2.08 -1.26 -4.65 119.36 117.47 2fqh n ILE 45 Ca -0.11 0.24 0.12 0.00 0.56 0.00 0.00 62.75 63.56 2fqh n ILE 45 Cb 0.57 -2.00 0.13 0.00 -0.75 0.00 0.00 39.64 37.59 2fqh n ILE 45 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 2fqh s ALA 47 N -3.06 4.45 -0.07 0.00 0.00 -1.26 -4.72 121.76 117.10 2fqh s ALA 47 Ca 0.08 -1.68 -0.00 0.00 0.00 0.00 0.00 51.96 50.36 2fqh s ALA 47 Cb 0.16 -1.56 -0.00 0.00 0.00 0.00 0.00 23.12 21.72 2fqh s ALA 47 CO 0.75 -0.26 0.06 0.00 0.00 0.00 0.00 175.76 176.32 2fqh n ALA 48 N -1.80 -1.12 -1.99 0.00 0.00 -1.26 -4.57 120.51 109.77 2fqh n ALA 48 Ca 0.07 0.01 -0.36 0.00 0.00 0.00 0.00 53.44 53.16 2fqh n ALA 48 Cb 0.59 -0.52 -0.06 0.00 0.00 0.00 0.00 19.45 19.46 2fqh n ALA 48 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 2fqh s GLU 49 N -3.06 4.31 0.00 0.00 0.41 -1.26 -4.94 118.70 114.16 2fqh s GLU 49 Ca 0.02 0.99 0.21 0.00 -0.41 0.00 0.00 54.97 55.77 2fqh s GLU 49 Cb -0.00 -2.74 1.23 0.00 -1.78 0.00 0.00 34.13 30.84 2fqh s GLU 49 CO 0.06 0.30 1.68 0.34 -0.49 0.00 0.00 175.26 177.14 2fqh n PHE 50 N 0.42 0.00 0.22 1.61 7.35 -1.26 -3.57 117.46 122.22 2fqh n PHE 50 Ca 0.00 0.00 0.11 0.00 -0.76 0.00 0.00 57.45 56.81 2fqh n PHE 50 Cb 0.51 0.00 0.59 0.00 0.35 0.00 0.00 39.48 40.94 2fqh n PHE 50 CO 0.00 0.00 0.00 1.98 -0.76 0.00 0.00 176.76 177.98 2fqh h MET 51 N 0.00 0.00 0.00 -4.13 1.85 -1.92 -3.41 114.93 107.33 2fqh h MET 51 Ca 0.00 0.00 -0.29 0.00 -0.61 0.00 0.00 59.70 58.80 2fqh h MET 51 Cb 0.00 0.00 -0.01 0.00 0.43 0.00 0.00 31.60 32.02 2fqh h MET 51 CO 0.00 0.00 -0.11 0.09 -0.40 0.00 0.00 176.91 176.49 2fqh n ASN 52 N -2.38 1.69 -4.81 1.39 4.13 -1.23 -4.80 115.26 109.24 2fqh n ASN 52 Ca -0.01 -1.94 -0.22 0.00 1.68 0.00 0.00 54.58 54.09 2fqh n ASN 52 Cb 0.24 -0.08 -0.04 0.00 -1.54 0.00 0.00 39.78 38.36 2fqh n ASN 52 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2fqh s MET 53 N -3.23 2.71 0.36 3.52 0.23 -1.26 -5.02 119.30 116.61 2fqh s MET 53 Ca 0.20 -1.26 0.04 0.00 -1.03 0.00 0.00 55.69 53.65 2fqh s MET 53 Cb -0.02 -2.44 0.66 0.00 -1.53 0.00 0.00 34.83 31.50 2fqh s MET 53 CO 0.13 0.21 1.96 0.00 -2.03 0.00 0.00 175.02 175.29 2fqh h MET 54 N 1.41 0.65 -1.25 3.16 -0.00 -2.00 -1.95 114.93 114.94 2fqh h MET 54 Ca -0.46 -0.08 0.38 0.00 -0.00 0.00 0.00 59.70 59.54 2fqh h MET 54 Cb 1.25 -0.13 -0.10 0.00 -0.00 0.00 0.00 31.60 32.62 2fqh h MET 54 CO 0.60 0.52 0.83 -0.44 -0.00 0.00 0.00 176.91 178.41 2fqh h ASP 55 N 0.65 0.26 -0.64 -0.10 5.19 -2.02 0.35 116.42 120.12 2fqh h ASP 55 Ca 0.16 0.09 0.12 0.00 -0.62 0.00 0.00 57.03 56.79 2fqh h ASP 55 Cb 0.09 0.06 -0.12 0.00 0.18 0.00 0.00 39.33 39.54 2fqh h ASP 55 CO -0.02 -0.06 -0.24 -0.08 -3.12 0.00 0.00 179.24 175.72 2fqh h GLU 56 N 0.17 -0.07 -1.15 3.56 4.57 -1.76 0.82 114.58 120.72 2fqh h GLU 56 Ca 0.72 0.00 0.35 0.00 -1.18 0.00 0.00 59.36 59.26 2fqh h GLU 56 Cb 2.26 0.02 -0.12 0.00 -0.16 0.00 0.00 28.75 30.74 2fqh h GLU 56 CO -0.30 -0.05 0.72 0.00 -1.18 0.00 0.00 179.01 178.21 2fqh h ALA 57 N 1.39 2.38 -0.54 2.92 0.00 -0.49 1.71 119.26 126.63 2fqh h ALA 57 Ca 0.29 0.12 0.02 0.00 0.00 0.00 0.00 54.91 55.33 2fqh h ALA 57 Cb 0.52 0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.42 2fqh h ALA 57 CO -0.69 -0.93 0.36 0.35 0.00 0.00 0.00 179.25 178.33 2fqh h PHE 58 N 0.24 0.63 -0.59 0.00 3.57 0.59 -2.55 116.94 118.84 2fqh h PHE 58 Ca 0.73 0.02 0.10 0.00 3.53 0.00 0.00 57.97 62.34 2fqh h PHE 58 Cb 2.00 -0.21 -0.11 0.00 2.79 0.00 0.00 35.95 40.42 2fqh h PHE 58 CO -0.01 0.38 -0.36 0.87 -2.23 0.00 0.00 178.31 176.96 2fqh h LYS 59 N 0.67 -0.18 -0.03 1.11 1.57 0.27 0.46 116.57 120.44 2fqh h LYS 59 Ca 0.21 0.01 0.04 0.00 -1.87 0.00 0.00 60.65 59.03 2fqh h LYS 59 Cb 0.02 0.04 -0.05 0.00 0.08 0.00 0.00 32.23 32.31 2fqh h LYS 59 CO -0.05 -0.12 -0.30 1.25 -0.57 0.00 0.00 179.45 179.66 2fqh h HIS 60 N -0.18 -0.82 -0.93 -1.35 -0.00 -1.52 2.70 115.15 113.04 2fqh h HIS 60 Ca 0.22 0.03 0.21 0.00 -0.00 0.00 0.00 60.37 60.83 2fqh h HIS 60 Cb 0.56 0.37 -0.07 0.00 -0.00 0.00 0.00 27.41 28.26 2fqh h HIS 60 CO -0.66 -0.39 0.61 1.15 -0.00 0.00 0.00 177.93 178.64 2fqh h THR 61 N -0.44 0.66 0.00 6.26 2.02 -0.94 0.76 112.91 121.23 2fqh h THR 61 Ca 0.07 -0.14 -0.01 0.00 0.77 0.00 0.00 66.41 67.10 2fqh h THR 61 Cb 0.53 0.21 -0.00 0.00 -1.74 0.00 0.00 68.15 67.15 2fqh h THR 61 CO -0.27 0.08 -0.07 0.00 0.37 0.00 0.00 175.52 175.62 2fqh h ALA 62 N 1.61 0.01 0.00 6.16 0.00 0.21 -3.24 119.26 124.01 2fqh h ALA 62 Ca 0.49 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 55.06 2fqh h ALA 62 Cb 1.22 0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.06 2fqh h ALA 62 CO -0.20 0.05 0.00 0.54 0.00 0.00 0.00 179.25 179.64 2fqh n ARG 63 N -4.67 0.28 0.06 0.00 1.74 0.88 -1.44 116.66 113.52 2fqh n ARG 63 Ca -0.07 0.00 -0.07 0.00 -0.77 0.00 0.00 57.85 56.94 2fqh n ARG 63 Cb 0.30 -1.28 -0.04 0.00 -1.02 0.00 0.00 32.46 30.41 2fqh n ARG 63 CO 0.00 0.00 0.00 1.25 -1.52 0.00 0.00 177.63 177.36 2fqh h HIS 64 N 0.00 -0.24 0.00 -1.55 2.76 0.49 -3.45 115.15 113.16 2fqh h HIS 64 Ca 0.00 -0.01 -0.07 0.00 -2.20 0.00 0.00 60.37 58.09 2fqh h HIS 64 Cb 0.00 0.08 -0.01 0.00 1.55 0.00 0.00 27.41 29.03 2fqh h HIS 64 CO 0.00 0.01 -0.91 -1.71 -1.30 0.00 0.00 177.93 174.03 2fqh n ASN 65 N -4.94 0.88 -0.68 3.26 5.15 -1.08 -5.08 115.26 112.76 2fqh n ASN 65 Ca -0.05 0.13 0.00 0.00 -0.60 0.00 0.00 54.58 54.06 2fqh n ASN 65 Cb 0.18 -0.32 0.00 0.00 -0.53 0.00 0.00 39.78 39.12 2fqh n ASN 65 CO 0.00 0.00 0.00 0.52 1.40 0.00 0.00 177.26 179.18 2fqh n VAL 66 N -3.52 0.00 -4.10 3.44 0.31 -0.52 -5.11 118.33 108.83 2fqh n VAL 66 Ca -0.10 0.00 -0.15 0.00 -0.01 0.00 0.00 64.34 64.08 2fqh n VAL 66 Cb 0.40 -1.04 -0.14 0.00 -0.91 0.00 0.00 33.84 32.15 2fqh n VAL 66 CO 0.00 0.00 0.00 -1.81 -1.32 0.00 0.00 176.83 173.70 2fqh s ASP 67 N -1.00 0.50 -0.00 4.52 1.11 -1.22 -3.50 116.67 117.07 2fqh s ASP 67 Ca 0.00 -0.08 -0.00 0.00 0.18 0.00 0.00 52.55 52.65 2fqh s ASP 67 Cb 0.00 -0.06 0.00 0.00 1.07 0.00 0.00 42.92 43.93 2fqh s ASP 67 CO 0.00 0.05 0.01 -1.61 1.18 0.00 0.00 175.17 174.80 2fqh s GLU 68 N -0.08 0.01 -0.04 8.23 2.02 -1.26 -4.93 118.70 122.65 2fqh s GLU 68 Ca 0.01 0.01 0.01 0.00 0.02 0.00 0.00 54.97 55.03 2fqh s GLU 68 Cb -0.02 0.01 0.02 0.00 0.10 0.00 0.00 34.13 34.24 2fqh s GLU 68 CO -0.00 -0.00 -0.04 -0.48 0.02 0.00 0.00 175.26 174.76 2fqh s LEU 69 N 0.00 1.33 -0.03 1.80 0.05 -1.26 -4.77 118.68 115.81 2fqh s LEU 69 Ca -0.00 -0.11 -0.02 0.00 0.05 0.00 0.00 54.13 54.04 2fqh s LEU 69 Cb -0.00 -0.41 0.01 0.00 -2.05 0.00 0.00 46.19 43.74 2fqh s LEU 69 CO 0.00 -0.06 0.07 -2.28 -0.55 0.00 0.00 176.35 173.53 2fqh s HIS 70 N 0.89 -0.08 -0.04 3.48 2.46 -1.26 -4.87 115.29 115.87 2fqh s HIS 70 Ca -0.12 0.19 0.01 0.00 0.47 0.00 0.00 55.06 55.61 2fqh s HIS 70 Cb -0.14 0.03 0.02 0.00 -0.13 0.00 0.00 32.58 32.36 2fqh s HIS 70 CO 0.00 -0.04 -0.04 -1.50 -2.47 0.00 0.00 174.74 170.70 2fqh s ILE 71 N 0.03 0.47 -0.07 0.89 1.10 -1.26 -4.37 121.20 117.99 2fqh s ILE 71 Ca -0.00 -0.09 -0.06 0.00 -0.51 0.00 0.00 60.65 59.99 2fqh s ILE 71 Cb -0.01 -0.50 0.02 0.00 0.15 0.00 0.00 42.46 42.12 2fqh s ILE 71 CO 0.00 0.21 0.18 -1.81 -2.11 0.00 0.00 174.94 171.41 2fqh s ASP 72 N 0.90 -0.18 -0.04 4.50 -0.00 -1.23 -5.02 116.67 115.59 2fqh s ASP 72 Ca -0.11 0.36 0.01 0.00 -0.00 0.00 0.00 52.55 52.80 2fqh s ASP 72 Cb -0.14 0.36 0.02 0.00 -0.00 0.00 0.00 42.92 43.16 2fqh s ASP 72 CO -0.00 -0.06 -0.04 -0.83 -0.00 0.00 0.00 175.17 174.24 2fqh s GLY 73 N 0.09 0.41 -0.07 0.21 0.00 -1.26 -3.23 107.32 103.47 2fqh s GLY 73 Ca -0.00 -0.01 -0.06 0.00 0.00 0.00 0.00 44.72 44.64 2fqh s GLY 73 CO 0.00 0.44 0.18 0.21 0.00 0.00 0.00 173.10 173.93 2fqh s ASN 74 N 0.89 -0.19 0.00 1.64 2.47 -1.24 -4.94 114.94 113.57 2fqh s ASN 74 Ca -0.11 0.36 0.06 0.00 0.42 0.00 0.00 52.86 53.58 2fqh s ASN 74 Cb -0.14 0.37 0.27 0.00 -1.45 0.00 0.00 41.25 40.29 2fqh s ASN 74 CO 0.00 -0.06 1.07 0.00 -3.72 0.00 0.00 177.10 174.38 2fqh n TYR 75 N 2.98 0.00 0.23 0.43 4.19 -1.26 -0.49 117.16 123.24 2fqh n TYR 75 Ca -0.13 0.00 0.08 0.00 3.31 0.00 0.00 57.90 61.16 2fqh n TYR 75 Cb 0.59 -0.35 -0.11 0.00 0.49 0.00 0.00 39.34 39.95 2fqh n TYR 75 CO 0.00 0.00 0.00 0.94 0.91 0.00 0.00 176.86 178.71 2fqh n GLN 76 N -1.35 0.91 -0.19 2.98 0.00 -1.26 -4.48 117.38 113.99 2fqh n GLN 76 Ca 0.02 -0.10 -0.01 0.00 -0.00 0.00 0.00 57.00 56.92 2fqh n GLN 76 Cb 0.05 -1.34 0.08 0.00 0.00 0.00 0.00 30.24 29.03 2fqh n GLN 76 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.06 178.31 2fqh h LEU 77 N 0.00 -0.29 0.00 1.69 5.85 -1.18 -3.44 115.31 117.93 2fqh h LEU 77 Ca 0.00 0.14 0.00 0.00 0.84 0.00 0.00 57.88 58.86 2fqh h LEU 77 Cb 0.62 0.26 0.00 0.00 0.37 0.00 0.00 40.66 41.92 2fqh h LEU 77 CO 0.00 -0.11 0.00 0.61 -0.34 0.00 0.00 178.44 178.60 2fqh n GLY 78 N -1.35 0.00 3.90 3.75 0.00 -1.26 -4.88 105.19 105.35 2fqh n GLY 78 Ca 0.07 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.81 2fqh n GLY 78 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2fqh n ARG 79 N 0.00 -2.60 -4.09 1.61 1.74 -1.26 -4.95 116.66 107.11 2fqh n ARG 79 Ca 0.00 0.39 -0.33 0.00 -0.77 0.00 0.00 57.85 57.14 2fqh n ARG 79 Cb 0.00 -4.31 -0.16 0.00 -1.02 0.00 0.00 32.46 26.98 2fqh n ARG 79 CO 0.00 0.00 0.00 -0.80 -1.52 0.00 0.00 177.63 175.31 2fqh s ASN 80 N -4.12 3.42 -0.29 0.55 -0.87 -1.26 -5.00 114.94 107.37 2fqh s ASN 80 Ca 0.14 -0.72 -0.00 0.00 -1.57 0.00 0.00 52.86 50.71 2fqh s ASN 80 Cb -0.06 -1.52 0.05 0.00 -0.02 0.00 0.00 41.25 39.71 2fqh s ASN 80 CO 0.89 -0.03 -0.04 0.54 -2.57 0.00 0.00 177.10 175.89 2fqh s VAL 81 N 1.29 2.73 -0.17 1.60 0.11 -1.26 -3.88 120.40 120.82 2fqh s VAL 81 Ca 0.03 -1.46 0.00 0.00 -2.93 0.00 0.00 61.98 57.63 2fqh s VAL 81 Cb -0.14 -2.58 0.03 0.00 -1.53 0.00 0.00 36.38 32.16 2fqh s VAL 81 CO -0.11 -0.08 -0.12 -0.76 -3.33 0.00 0.00 175.10 170.70 2fqh s LEU 82 N 1.21 1.86 -0.27 2.54 1.02 -1.13 -4.97 118.68 118.93 2fqh s LEU 82 Ca -0.06 -0.63 0.02 0.00 0.02 0.00 0.00 54.13 53.48 2fqh s LEU 82 Cb -0.20 -1.16 0.06 0.00 0.02 0.00 0.00 46.19 44.91 2fqh s LEU 82 CO -0.02 -0.10 -0.09 -0.22 0.02 0.00 0.00 176.35 175.94 2fqh s LEU 83 N 1.48 3.54 -0.15 1.79 0.20 -1.25 -1.08 118.68 123.21 2fqh s LEU 83 Ca 0.03 -1.37 0.00 0.00 0.69 0.00 0.00 54.13 53.48 2fqh s LEU 83 Cb -0.14 -1.59 0.02 0.00 -0.43 0.00 0.00 46.19 44.06 2fqh s LEU 83 CO -0.10 -0.20 -0.14 -0.75 -0.29 0.00 0.00 176.35 174.87 2fqh s LYS 84 N 1.13 2.23 -0.24 1.98 2.36 -1.14 -5.06 119.74 121.00 2fqh s LYS 84 Ca -0.08 -0.53 -0.02 0.00 -2.55 0.00 0.00 55.97 52.79 2fqh s LYS 84 Cb -0.20 -2.06 0.02 0.00 -1.05 0.00 0.00 37.83 34.54 2fqh s LYS 84 CO -0.04 -0.24 -0.07 -0.80 1.55 0.00 0.00 175.35 175.75 2fqh s ASN 85 N 1.51 4.24 -0.21 1.43 0.01 -1.26 -2.72 114.94 117.93 2fqh s ASN 85 Ca 0.05 -0.79 0.01 0.00 -0.71 0.00 0.00 52.86 51.42 2fqh s ASN 85 Cb -0.13 -1.66 0.03 0.00 0.41 0.00 0.00 41.25 39.90 2fqh s ASN 85 CO -0.10 -0.10 -0.14 -0.83 -1.51 0.00 0.00 177.10 174.41 2fqh s GLY 86 N 1.35 1.51 -0.15 0.66 0.00 -1.20 -4.92 107.32 104.56 2fqh s GLY 86 Ca 0.01 -1.37 0.00 0.00 0.00 0.00 0.00 44.72 43.37 2fqh s GLY 86 CO -0.05 0.40 -0.14 -1.83 0.00 0.00 0.00 173.10 171.48 2fqh s GLU 87 N 1.27 2.31 0.16 2.90 -1.05 -1.26 -4.05 118.70 118.99 2fqh s GLU 87 Ca 0.01 -0.58 0.09 0.00 -0.15 0.00 0.00 54.97 54.35 2fqh s GLU 87 Cb -0.15 -2.14 -0.04 0.00 -0.44 0.00 0.00 34.13 31.36 2fqh s GLU 87 CO -0.09 -0.24 -0.21 0.16 0.95 0.00 0.00 175.26 175.83 2fqh s ASP 88 N 1.48 2.92 -0.14 0.83 1.47 -1.26 -4.97 116.67 116.99 2fqh s ASP 88 Ca 0.05 -0.84 -0.22 0.00 1.18 0.00 0.00 52.55 52.72 2fqh s ASP 88 Cb -0.13 -0.19 0.05 0.00 -0.34 0.00 0.00 42.92 42.32 2fqh s ASP 88 CO -0.11 0.03 0.56 0.00 0.68 0.00 0.00 175.17 176.33 2fqh s ARG 89 N -2.61 0.77 0.35 2.11 3.03 -1.26 -4.86 118.95 116.48 2fqh s ARG 89 Ca 0.16 0.48 -0.08 0.00 2.03 0.00 0.00 55.73 58.32 2fqh s ARG 89 Cb -0.07 0.37 0.02 0.00 -1.03 0.00 0.00 34.95 34.23 2fqh s ARG 89 CO 0.07 -0.16 0.58 -0.51 -1.13 0.00 0.00 175.30 174.15 2fqh s LEU 90 N -0.38 0.60 0.66 -1.89 1.43 -1.26 -5.01 118.68 112.83 2fqh s LEU 90 Ca -0.05 -1.30 0.38 0.00 -1.03 0.00 0.00 54.13 52.13 2fqh s LEU 90 Cb -0.03 1.96 2.09 0.00 0.03 0.00 0.00 46.19 50.23 2fqh s LEU 90 CO 0.04 -1.41 2.20 0.08 0.23 0.00 0.00 176.35 177.49 2fqh h ARG 91 N 2.09 0.00 0.00 1.70 0.11 -2.04 0.21 114.38 116.45 2fqh h ARG 91 Ca -0.29 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.79 2fqh h ARG 91 Cb 1.24 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.32 2fqh h ARG 91 CO 0.39 0.00 0.00 0.35 0.10 0.00 0.00 179.97 180.81 2fqh h PHE 92 N 0.00 0.00 -2.87 4.08 3.04 -2.04 -3.42 116.94 115.72 2fqh h PHE 92 Ca 0.01 0.00 -0.52 0.00 3.98 0.00 0.00 57.97 61.43 2fqh h PHE 92 Cb 0.27 0.00 -0.02 0.00 2.56 0.00 0.00 35.95 38.77 2fqh h PHE 92 CO 0.00 0.00 -0.29 0.71 -2.02 0.00 0.00 178.31 176.71 2fqh s TYR 93 N -3.50 3.48 -0.07 0.41 2.02 0.72 -5.02 117.35 115.39 2fqh s TYR 93 Ca 0.00 0.38 0.00 0.00 -0.37 0.00 0.00 57.07 57.09 2fqh s TYR 93 Cb 0.08 -1.89 -0.05 0.00 -0.40 0.00 0.00 41.96 39.71 2fqh s TYR 93 CO 0.32 0.33 -0.06 1.33 -1.57 0.00 0.00 175.55 175.89 2fqh n VAL 94 N -0.83 0.41 -0.01 0.71 0.24 -1.26 -4.68 118.33 112.90 2fqh n VAL 94 Ca -0.04 -0.15 0.00 0.00 -2.04 0.00 0.00 64.34 62.10 2fqh n VAL 94 Cb 0.54 -0.80 -0.12 0.00 -1.47 0.00 0.00 33.84 32.00 2fqh n VAL 94 CO 0.00 0.00 0.00 2.29 -2.14 0.00 0.00 176.83 176.98 2fqh n LYS 95 N -2.74 0.64 -3.64 7.34 2.85 -1.26 -5.00 118.16 116.35 2fqh n LYS 95 Ca -0.13 0.08 -0.26 0.00 -1.05 0.00 0.00 58.31 56.95 2fqh n LYS 95 Cb 0.63 -1.69 0.04 0.00 -0.65 0.00 0.00 35.03 33.37 2fqh n LYS 95 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 177.40 178.54 2fqh n PHE 96 N -2.73 -1.97 -3.25 5.58 3.72 -1.26 -4.93 117.46 112.61 2fqh n PHE 96 Ca -0.14 0.62 -0.41 0.00 -0.05 0.00 0.00 57.45 57.47 2fqh n PHE 96 Cb 0.86 -3.77 -0.08 0.00 -0.94 0.00 0.00 39.48 35.55 2fqh n PHE 96 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 2fqh s GLY 97 N -3.72 1.83 0.94 1.37 0.00 -1.26 -5.06 107.32 101.42 2fqh s GLY 97 Ca 0.34 -0.88 -0.13 0.00 0.00 0.00 0.00 44.72 44.04 2fqh s GLY 97 CO 0.83 1.23 1.15 2.56 0.00 0.00 0.00 173.10 178.88 2fqh s PRO 98 N 2.34 0.90 -0.40 2.90 0.04 -1.26 -4.97 135.00 134.55 2fqh s PRO 98 Ca 0.19 0.19 0.02 0.00 0.04 0.00 0.00 61.00 61.44 2fqh s PRO 98 Cb -0.15 -1.82 0.12 0.00 0.04 0.00 0.00 34.50 32.69 2fqh s PRO 98 CO 0.12 -2.34 0.19 0.20 0.04 0.00 0.00 177.00 175.20 2fqh s GLY 99 N -4.10 1.56 0.76 0.56 0.00 -1.26 -5.01 107.32 99.83 2fqh s GLY 99 Ca 0.65 -2.37 -0.03 0.00 0.00 0.00 0.00 44.72 42.97 2fqh s GLY 99 CO 0.53 1.50 1.05 0.00 0.00 0.00 0.00 173.10 176.18 2fqh s ALA 100 N 0.71 3.51 0.27 3.20 0.00 -1.26 -4.29 121.76 123.89 2fqh s ALA 100 Ca 0.15 -1.69 -0.01 0.00 0.00 0.00 0.00 51.96 50.41 2fqh s ALA 100 Cb -0.22 -2.09 0.48 0.00 0.00 0.00 0.00 23.12 21.28 2fqh s ALA 100 CO -0.07 -1.63 1.84 0.28 0.00 0.00 0.00 175.76 176.18 2fqh h VAL 101 N -0.71 0.95 -0.95 0.00 2.07 -1.96 0.15 116.25 115.80 2fqh h VAL 101 Ca -0.37 -0.34 0.10 0.00 0.82 0.00 0.00 66.70 66.91 2fqh h VAL 101 Cb 1.26 -0.12 -0.07 0.00 -1.52 0.00 0.00 31.29 30.84 2fqh h VAL 101 CO 0.39 0.18 0.61 0.40 0.02 0.00 0.00 177.57 179.17 2fqh h ILE 102 N 0.98 0.98 -0.42 4.57 1.08 -2.00 0.20 117.51 122.90 2fqh h ILE 102 Ca 0.46 -0.34 -0.05 0.00 -0.39 0.00 0.00 64.86 64.54 2fqh h ILE 102 Cb 0.39 -0.09 -0.02 0.00 -3.07 0.00 0.00 36.82 34.03 2fqh h ILE 102 CO -0.24 0.18 0.05 0.50 -0.69 0.00 0.00 178.15 177.95 2fqh h LYS 103 N 0.98 0.65 -0.77 2.37 1.63 -1.08 -2.21 116.57 118.15 2fqh h LYS 103 Ca 0.44 -0.14 -0.05 0.00 -0.85 0.00 0.00 60.65 60.05 2fqh h LYS 103 Cb 0.37 -0.10 -0.03 0.00 -0.60 0.00 0.00 32.23 31.87 2fqh h LYS 103 CO -0.20 0.64 0.29 1.49 -3.45 0.00 0.00 179.45 178.22 2fqh h GLU 104 N 0.63 1.16 -0.64 1.90 4.81 -0.03 -2.30 114.58 120.11 2fqh h GLU 104 Ca 0.14 -0.22 0.05 0.00 -0.13 0.00 0.00 59.36 59.20 2fqh h GLU 104 Cb 0.32 -0.18 -0.04 0.00 0.63 0.00 0.00 28.75 29.48 2fqh h GLU 104 CO 0.01 0.95 0.42 0.74 -0.73 0.00 0.00 179.01 180.40 2fqh h PHE 105 N 1.13 0.66 -0.94 0.92 -1.00 -0.68 -0.72 116.94 116.31 2fqh h PHE 105 Ca 0.26 0.02 0.27 0.00 2.81 0.00 0.00 57.97 61.32 2fqh h PHE 105 Cb 0.24 -0.22 -0.04 0.00 3.61 0.00 0.00 35.95 39.54 2fqh h PHE 105 CO 0.02 0.36 0.97 -0.22 -1.61 0.00 0.00 178.31 177.83 2fqh h LYS 106 N 0.67 0.00 -1.62 1.51 3.64 -1.25 0.47 116.57 119.98 2fqh h LYS 106 Ca 0.27 0.00 0.49 0.00 -1.27 0.00 0.00 60.65 60.14 2fqh h LYS 106 Cb 0.22 0.00 -0.09 0.00 -0.41 0.00 0.00 32.23 31.95 2fqh h LYS 106 CO -0.08 0.00 1.13 1.51 -2.27 0.00 0.00 179.45 179.74 2fqh n ILE 107 N -3.53 -0.08 0.00 2.00 0.00 -0.28 -4.07 119.36 113.41 2fqh n ILE 107 Ca 0.20 1.44 0.00 0.00 0.00 0.00 0.00 62.75 64.40 2fqh n ILE 107 Cb 1.27 -2.39 0.00 0.00 0.00 0.00 0.00 39.64 38.52 2fqh n ILE 107 CO 0.00 0.00 0.00 1.07 0.00 0.00 0.00 176.55 177.62 2fqh n THR 108 N -3.99 0.00 0.00 9.51 5.66 0.64 -5.10 114.28 120.99 2fqh n THR 108 Ca 0.39 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.39 2fqh n THR 108 Cb 1.70 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 70.48 2fqh n THR 108 CO 0.00 0.00 0.00 -0.67 -3.05 0.00 0.00 175.07 171.35