#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 2.17 -0.07 6.12 1.04 -1.26 -5.01 113.70 116.68 2fqh s SER 2 Ca 0.00 -0.37 -0.03 0.00 0.48 0.00 0.00 55.95 56.03 2fqh s SER 2 Cb 0.00 -0.98 0.04 0.00 0.10 0.00 0.00 66.02 65.18 2fqh s SER 2 CO 0.00 0.03 0.15 -1.61 0.98 0.00 0.00 173.24 172.78 2fqh s GLU 3 N 0.82 0.08 -0.12 4.02 2.02 -1.23 -2.55 118.70 121.74 2fqh s GLU 3 Ca -0.11 0.40 0.02 0.00 0.02 0.00 0.00 54.97 55.31 2fqh s GLU 3 Cb -0.15 -0.20 0.01 0.00 0.10 0.00 0.00 34.13 33.89 2fqh s GLU 3 CO 0.02 -0.19 -0.18 0.54 0.02 0.00 0.00 175.26 175.46 2fqh s VAL 4 N 1.40 1.72 -0.06 2.63 0.11 -1.22 -3.09 120.40 121.89 2fqh s VAL 4 Ca -0.07 -0.78 -0.03 0.00 -2.93 0.00 0.00 61.98 58.17 2fqh s VAL 4 Cb -0.12 -1.55 0.04 0.00 -1.53 0.00 0.00 36.38 33.22 2fqh s VAL 4 CO -0.06 0.49 0.12 0.54 -3.33 0.00 0.00 175.10 172.85 2fqh s ASN 5 N 0.88 0.80 -0.16 3.54 4.22 -0.49 -3.68 114.94 120.05 2fqh s ASN 5 Ca -0.08 0.22 0.00 0.00 -2.14 0.00 0.00 52.86 50.87 2fqh s ASN 5 Cb -0.15 0.10 0.03 0.00 1.28 0.00 0.00 41.25 42.50 2fqh s ASN 5 CO -0.01 -0.23 -0.13 -0.63 -2.04 0.00 0.00 177.10 174.05 2fqh s ILE 6 N 2.11 1.58 -0.04 0.54 1.01 -1.26 -2.85 121.20 122.29 2fqh s ILE 6 Ca 0.02 -0.71 0.06 0.00 0.00 0.00 0.00 60.65 60.02 2fqh s ILE 6 Cb -0.12 -1.53 -0.02 0.00 0.01 0.00 0.00 42.46 40.80 2fqh s ILE 6 CO -0.05 0.40 -0.21 0.54 0.00 0.00 0.00 174.94 175.62 2fqh s VAL 7 N 1.47 2.49 -0.18 2.92 0.11 -1.26 -4.66 120.40 121.29 2fqh s VAL 7 Ca 0.04 -0.94 -0.04 0.00 -2.93 0.00 0.00 61.98 58.10 2fqh s VAL 7 Cb -0.13 -1.92 0.06 0.00 -1.53 0.00 0.00 36.38 32.86 2fqh s VAL 7 CO -0.10 0.58 0.08 -0.69 -3.33 0.00 0.00 175.10 171.64 2fqh s VAL 8 N -0.62 0.07 -0.24 2.04 1.01 -1.26 -4.38 120.40 117.01 2fqh s VAL 8 Ca 0.10 -0.26 0.02 0.00 0.00 0.00 0.00 61.98 61.83 2fqh s VAL 8 Cb -0.11 -0.69 0.06 0.00 0.00 0.00 0.00 36.38 35.64 2fqh s VAL 8 CO -0.00 -0.26 -0.08 0.54 0.00 0.00 0.00 175.10 175.30 2fqh s ASN 9 N 2.07 4.02 0.00 3.32 2.20 -1.26 -4.66 114.94 120.63 2fqh s ASN 9 Ca 0.01 -1.22 0.00 0.00 -0.94 0.00 0.00 52.86 50.71 2fqh s ASN 9 Cb -0.16 -1.32 0.00 0.00 -2.00 0.00 0.00 41.25 37.77 2fqh s ASN 9 CO -0.09 -0.21 0.00 0.61 -2.94 0.00 0.00 177.10 174.47 2fqh n GLY 10 N 4.59 1.77 3.84 0.45 0.00 -1.26 -4.63 105.19 109.94 2fqh n GLY 10 Ca -0.13 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.66 2fqh n GLY 10 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2fqh n ARG 11 N -0.54 -0.68 -4.19 1.61 1.85 -1.26 -4.87 116.66 108.58 2fqh n ARG 11 Ca 0.00 -0.20 -0.34 0.00 -1.00 0.00 0.00 57.85 56.31 2fqh n ARG 11 Cb 0.00 -0.90 -0.14 0.00 -1.05 0.00 0.00 32.46 30.37 2fqh n ARG 11 CO 0.00 0.00 0.00 -1.83 -0.01 0.00 0.00 177.63 175.79 2fqh s GLU 12 N -6.10 3.36 -0.04 2.89 4.04 -1.26 -5.09 118.70 116.50 2fqh s GLU 12 Ca 0.21 -0.65 -0.12 0.00 0.04 0.00 0.00 54.97 54.45 2fqh s GLU 12 Cb -0.12 -2.86 0.02 0.00 0.02 0.00 0.00 34.13 31.19 2fqh s GLU 12 CO 0.49 -0.06 0.28 0.00 -1.84 0.00 0.00 175.26 174.13 2fqh s ALA 13 N 1.08 -0.69 -0.40 -0.84 0.00 -1.26 -4.90 121.76 114.75 2fqh s ALA 13 Ca 0.01 0.41 0.02 0.00 0.00 0.00 0.00 51.96 52.40 2fqh s ALA 13 Cb -0.15 -0.10 0.27 0.00 0.00 0.00 0.00 23.12 23.14 2fqh s ALA 13 CO -0.01 -0.21 1.11 0.41 0.00 0.00 0.00 175.76 177.05 2fqh n GLY 14 N 1.85 -0.84 3.57 0.00 0.00 -1.26 -5.16 105.19 103.35 2fqh n GLY 14 Ca -0.19 0.58 -0.13 0.00 0.00 0.00 0.00 46.02 46.28 2fqh n GLY 14 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2fqh n SER 15 N 1.37 -1.68 -0.79 1.61 3.41 -1.26 -5.01 113.62 111.27 2fqh n SER 15 Ca 0.04 -2.86 0.03 0.00 -0.26 0.00 0.00 58.87 55.83 2fqh n SER 15 Cb 0.68 3.00 0.14 0.00 -0.26 0.00 0.00 64.21 67.77 2fqh n SER 15 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2fqh n LYS 16 N -0.58 2.09 -0.04 4.33 4.01 -1.26 -3.77 118.16 122.94 2fqh n LYS 16 Ca -0.02 -1.09 0.05 0.00 -0.51 0.00 0.00 58.31 56.74 2fqh n LYS 16 Cb 0.60 -1.53 0.26 0.00 -0.51 0.00 0.00 35.03 33.85 2fqh n LYS 16 CO 0.00 0.00 0.00 -1.13 -1.11 0.00 0.00 177.40 175.16 2fqh n SER 17 N 0.26 0.54 -0.25 4.39 3.41 -1.26 -2.91 113.62 117.79 2fqh n SER 17 Ca 0.10 -1.77 0.13 0.00 -0.26 0.00 0.00 58.87 57.06 2fqh n SER 17 Cb 0.44 -0.05 0.31 0.00 -0.26 0.00 0.00 64.21 64.64 2fqh n SER 17 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2fqh n LYS 18 N -0.31 0.79 0.00 4.33 5.02 -1.25 -2.90 118.16 123.84 2fqh n LYS 18 Ca 0.09 -0.50 0.00 0.00 -2.02 0.00 0.00 58.31 55.87 2fqh n LYS 18 Cb 0.11 -1.49 0.00 0.00 -0.02 0.00 0.00 35.03 33.63 2fqh n LYS 18 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2fqh n GLY 19 N 1.37 0.79 3.60 0.72 0.00 -0.65 -3.01 105.19 108.00 2fqh n GLY 19 Ca 0.11 0.00 -0.27 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 1.85 0.32 0.71 0.00 0.00 -1.88 -3.24 119.26 117.02 2fqh h ALA 21 Ca -0.43 -0.22 -0.03 0.00 0.00 0.00 0.00 54.91 54.22 2fqh h ALA 21 Cb 1.24 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 18.96 2fqh h ALA 21 CO 0.76 0.05 -0.34 1.25 0.00 0.00 0.00 179.25 180.97 2fqh h LEU 22 N 0.18 -0.81 -8.28 0.00 7.12 -1.97 -3.44 115.31 108.12 2fqh h LEU 22 Ca 0.07 0.02 -0.59 0.00 0.13 0.00 0.00 57.88 57.50 2fqh h LEU 22 Cb 0.42 0.21 -0.31 0.00 -0.53 0.00 0.00 40.66 40.45 2fqh h LEU 22 CO 0.01 -0.43 -0.85 0.00 -0.13 0.00 0.00 178.44 177.04 2fqh n GLY 24 N 3.13 5.73 0.00 0.00 0.00 -1.22 0.35 105.19 113.18 2fqh n GLY 24 Ca -0.18 -2.74 0.07 0.00 0.00 0.00 0.00 46.02 43.16 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 -0.21 2.98 -2.28 4.61 0.00 -1.26 -4.72 120.51 119.63 2fqh n ALA 25 Ca 0.34 -0.36 -0.22 0.00 0.00 0.00 0.00 53.44 53.21 2fqh n ALA 25 Cb 0.36 -0.49 0.01 0.00 0.00 0.00 0.00 19.45 19.33 2fqh n ALA 25 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2fqh s THR 26 N -2.75 3.79 0.03 0.00 -4.23 -1.26 -4.99 115.64 106.23 2fqh s THR 26 Ca -0.02 -0.58 0.02 0.00 -1.18 0.00 0.00 61.69 59.93 2fqh s THR 26 Cb 0.10 -3.39 -0.02 0.00 1.34 0.00 0.00 72.50 70.53 2fqh s THR 26 CO 0.59 -0.26 -0.08 -1.66 -0.54 0.00 0.00 174.62 172.67 2fqh s TRP 27 N -2.54 0.66 -0.36 3.99 -2.14 -1.26 -1.63 118.94 115.66 2fqh s TRP 27 Ca 0.49 -0.41 0.02 0.00 2.66 0.00 0.00 56.10 58.87 2fqh s TRP 27 Cb -0.10 -0.40 0.15 0.00 -3.10 0.00 0.00 33.47 30.02 2fqh s TRP 27 CO 0.37 -0.06 0.36 0.20 -2.66 0.00 0.00 176.95 175.16 2fqh s GLY 28 N -1.28 0.01 0.00 3.67 0.00 -1.17 -4.94 107.32 103.62 2fqh s GLY 28 Ca -0.07 -0.94 -0.25 0.00 0.00 0.00 0.00 44.72 43.46 2fqh s GLY 28 CO 0.00 2.69 1.23 1.29 0.00 0.00 0.00 173.10 178.31 2fqh h ASP 29 N 7.22 -0.24 -0.00 1.64 3.04 -2.00 -2.77 116.42 123.31 2fqh h ASP 29 Ca 0.03 -0.25 0.00 0.00 -3.24 0.00 0.00 57.03 53.57 2fqh h ASP 29 Cb 1.05 0.06 -0.00 0.00 -1.04 0.00 0.00 39.33 39.40 2fqh h ASP 29 CO 0.22 0.15 0.03 1.88 -2.04 0.00 0.00 179.24 179.48 2fqh h TYR 30 N -0.67 0.00 -2.90 4.15 0.05 -2.02 -3.42 116.97 112.17 2fqh h TYR 30 Ca -0.03 0.00 -0.45 0.00 0.05 0.00 0.00 58.73 58.30 2fqh h TYR 30 Cb 0.47 0.00 0.05 0.00 1.01 0.00 0.00 36.73 38.26 2fqh h TYR 30 CO 0.04 0.00 0.02 -1.01 -1.05 0.00 0.00 178.16 176.16 2fqh s HIS 31 N -4.23 2.98 0.22 4.88 3.76 -1.05 -5.11 115.29 116.74 2fqh s HIS 31 Ca -0.05 0.18 0.11 0.00 -0.15 0.00 0.00 55.06 55.16 2fqh s HIS 31 Cb 0.13 -2.74 -0.05 0.00 1.11 0.00 0.00 32.58 31.03 2fqh s HIS 31 CO 0.43 -0.86 -0.22 0.00 -0.85 0.00 0.00 174.74 173.23 2fqh s ALA 32 N -2.83 2.56 -0.03 -1.40 0.00 -1.26 -4.92 121.76 113.88 2fqh s ALA 32 Ca 0.56 -1.71 0.04 0.00 0.00 0.00 0.00 51.96 50.84 2fqh s ALA 32 Cb -0.10 -0.29 -0.00 0.00 0.00 0.00 0.00 23.12 22.72 2fqh s ALA 32 CO 0.40 0.36 -0.15 0.16 0.00 0.00 0.00 175.76 176.53 2fqh s ASP 33 N -2.96 1.90 0.78 0.00 1.47 -1.26 -4.53 116.67 112.07 2fqh s ASP 33 Ca 0.24 -0.30 -0.02 0.00 1.18 0.00 0.00 52.55 53.64 2fqh s ASP 33 Cb -0.07 -0.46 0.16 0.00 -0.34 0.00 0.00 42.92 42.21 2fqh s ASP 33 CO 0.11 0.14 1.07 -0.36 0.68 0.00 0.00 175.17 176.82 2fqh s PHE 34 N -0.01 1.22 0.63 2.11 0.08 -1.24 -4.64 117.98 116.13 2fqh s PHE 34 Ca -0.02 -0.33 0.26 0.00 0.12 0.00 0.00 56.93 56.97 2fqh s PHE 34 Cb -0.10 -3.14 1.30 0.00 -0.57 0.00 0.00 43.02 40.51 2fqh s PHE 34 CO 0.01 -2.01 1.73 -0.07 -0.10 0.00 0.00 175.22 174.79 2fqh h LEU 35 N -0.76 0.00 -1.72 -0.37 3.38 -1.93 0.29 115.31 114.19 2fqh h LEU 35 Ca -0.35 0.00 0.08 0.00 0.09 0.00 0.00 57.88 57.70 2fqh h LEU 35 Cb 1.25 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.99 2fqh h LEU 35 CO 0.36 0.00 0.53 1.23 0.09 0.00 0.00 178.44 180.65 2fqh h GLY 36 N 0.00 0.00 -1.63 0.83 0.00 -1.91 -3.44 103.07 96.92 2fqh h GLY 36 Ca 0.15 0.00 -0.16 0.00 0.00 0.00 0.00 47.33 47.32 2fqh h GLY 36 CO -0.00 0.00 -0.22 -2.21 0.00 0.00 0.00 176.54 174.11 2fqh n GLU 37 N -3.26 -1.34 -4.03 4.80 4.07 0.10 -5.00 120.64 115.98 2fqh n GLU 37 Ca 0.05 0.36 -0.11 0.00 -0.06 0.00 0.00 57.16 57.40 2fqh n GLU 37 Cb 0.66 -4.17 -0.05 0.00 -0.06 0.00 0.00 31.44 27.82 2fqh n GLU 37 CO 0.00 0.00 0.00 0.16 -0.06 0.00 0.00 177.13 177.23 2fqh s ASP 38 N -2.78 0.23 -0.16 4.31 1.47 -1.14 -4.37 116.67 114.23 2fqh s ASP 38 Ca 0.07 -1.15 0.00 0.00 1.18 0.00 0.00 52.55 52.65 2fqh s ASP 38 Cb -0.03 0.60 0.03 0.00 -0.34 0.00 0.00 42.92 43.19 2fqh s ASP 38 CO 0.08 -1.19 -0.11 -0.22 0.68 0.00 0.00 175.17 174.41 2fqh s LEU 39 N -3.10 1.76 -0.05 2.11 0.20 0.50 -3.60 118.68 116.52 2fqh s LEU 39 Ca 0.26 -0.59 0.16 0.00 0.69 0.00 0.00 54.13 54.65 2fqh s LEU 39 Cb -0.00 -1.11 -0.24 0.00 -0.43 0.00 0.00 46.19 44.41 2fqh s LEU 39 CO 0.13 -0.10 0.30 2.22 -0.29 0.00 0.00 176.35 178.60 2fqh n PHE 40 N 4.79 0.00 0.10 5.38 1.16 -1.26 -3.73 117.46 123.90 2fqh n PHE 40 Ca -0.15 0.00 0.01 0.00 -1.87 0.00 0.00 57.45 55.44 2fqh n PHE 40 Cb 0.49 -0.44 0.06 0.00 -1.61 0.00 0.00 39.48 37.98 2fqh n PHE 40 CO 0.00 0.00 0.00 1.19 -1.87 0.00 0.00 176.76 176.08 2fqh n PHE 41 N -2.16 0.00 -0.09 2.97 3.01 -1.26 0.23 117.46 120.16 2fqh n PHE 41 Ca -0.07 0.00 -0.17 0.00 1.01 0.00 0.00 57.45 58.22 2fqh n PHE 41 Cb 0.53 -0.40 -0.10 0.00 -0.01 0.00 0.00 39.48 39.50 2fqh n PHE 41 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2fqh n ASP 44 N -3.98 -4.72 -0.07 0.00 2.03 0.64 -4.85 116.55 105.60 2fqh n ASP 44 Ca -0.07 0.35 -0.10 0.00 0.52 0.00 0.00 54.79 55.50 2fqh n ASP 44 Cb 0.26 -3.48 -0.03 0.00 -0.72 0.00 0.00 41.12 37.15 2fqh n ASP 44 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2fqh n ILE 45 N -2.58 1.42 0.97 5.18 3.06 -1.26 -4.67 119.36 121.47 2fqh n ILE 45 Ca -0.14 0.12 0.10 0.00 -2.50 0.00 0.00 62.75 60.33 2fqh n ILE 45 Cb 0.47 -2.14 -0.12 0.00 0.54 0.00 0.00 39.64 38.39 2fqh n ILE 45 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 2fqh s ALA 47 N -3.01 4.53 -0.00 0.00 0.00 -1.26 -4.59 121.76 117.42 2fqh s ALA 47 Ca 0.08 -1.67 -0.00 0.00 0.00 0.00 0.00 51.96 50.37 2fqh s ALA 47 Cb 0.16 -1.63 -0.00 0.00 0.00 0.00 0.00 23.12 21.65 2fqh s ALA 47 CO 0.87 -0.28 0.00 0.00 0.00 0.00 0.00 175.76 176.35 2fqh n ALA 48 N -1.85 -0.91 -2.10 0.00 0.00 -1.26 -4.59 120.51 109.81 2fqh n ALA 48 Ca 0.08 0.00 -0.39 0.00 0.00 0.00 0.00 53.44 53.13 2fqh n ALA 48 Cb 0.59 -0.31 -0.06 0.00 0.00 0.00 0.00 19.45 19.67 2fqh n ALA 48 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.50 175.67 2fqh s GLU 49 N -3.00 4.42 0.00 0.00 -1.05 -1.26 -4.94 118.70 112.87 2fqh s GLU 49 Ca 0.00 0.99 0.23 0.00 -0.15 0.00 0.00 54.97 56.04 2fqh s GLU 49 Cb -0.00 -3.24 1.36 0.00 -0.44 0.00 0.00 34.13 31.81 2fqh s GLU 49 CO 0.00 0.59 1.82 1.19 0.95 0.00 0.00 175.26 179.81 2fqh n PHE 50 N 1.61 0.00 0.07 4.83 3.72 -1.26 -3.44 117.46 123.00 2fqh n PHE 50 Ca -0.07 0.00 0.03 0.00 -0.05 0.00 0.00 57.45 57.36 2fqh n PHE 50 Cb 0.49 0.00 0.41 0.00 -0.94 0.00 0.00 39.48 39.44 2fqh n PHE 50 CO 0.00 0.00 0.00 0.52 -0.05 0.00 0.00 176.76 177.23 2fqh h MET 51 N 0.00 0.37 0.00 -1.08 2.86 -1.97 -3.43 114.93 111.68 2fqh h MET 51 Ca 0.00 -0.06 -0.29 0.00 -2.06 0.00 0.00 59.70 57.29 2fqh h MET 51 Cb 0.00 -0.06 0.07 0.00 0.06 0.00 0.00 31.60 31.67 2fqh h MET 51 CO 0.00 0.37 0.14 0.09 1.06 0.00 0.00 176.91 178.57 2fqh n ASN 52 N -4.36 0.63 -4.85 1.22 4.13 -1.22 -4.85 115.26 105.96 2fqh n ASN 52 Ca 0.01 -1.61 -0.35 0.00 1.68 0.00 0.00 54.58 54.31 2fqh n ASN 52 Cb 0.18 -0.49 -0.06 0.00 -1.54 0.00 0.00 39.78 37.87 2fqh n ASN 52 CO 0.00 0.00 0.00 -0.04 0.28 0.00 0.00 177.26 177.50 2fqh s MET 53 N -4.37 3.97 0.24 3.52 -1.94 -1.26 -4.99 119.30 114.47 2fqh s MET 53 Ca 0.45 0.48 -0.05 0.00 -1.71 0.00 0.00 55.69 54.86 2fqh s MET 53 Cb -0.02 -2.92 0.26 0.00 2.01 0.00 0.00 34.83 34.16 2fqh s MET 53 CO 0.30 0.47 1.80 1.98 -0.01 0.00 0.00 175.02 179.56 2fqh h MET 54 N 3.52 1.04 -1.17 2.03 4.05 -1.96 -2.20 114.93 120.24 2fqh h MET 54 Ca -0.49 -0.20 0.34 0.00 -0.28 0.00 0.00 59.70 59.07 2fqh h MET 54 Cb 1.19 -0.16 -0.10 0.00 -0.80 0.00 0.00 31.60 31.73 2fqh h MET 54 CO 0.66 0.88 0.77 -0.44 0.23 0.00 0.00 176.91 179.01 2fqh h ASP 55 N 1.01 0.30 -1.17 1.39 5.19 -2.01 0.83 116.42 121.96 2fqh h ASP 55 Ca 0.23 0.08 0.33 0.00 -0.62 0.00 0.00 57.03 57.06 2fqh h ASP 55 Cb 0.25 0.05 -0.09 0.00 0.18 0.00 0.00 39.33 39.71 2fqh h ASP 55 CO -0.01 -0.01 0.77 1.05 -3.12 0.00 0.00 179.24 177.91 2fqh h GLU 56 N 0.23 0.22 -0.15 3.56 4.11 -1.80 0.61 114.58 121.36 2fqh h GLU 56 Ca 0.67 -0.01 -0.02 0.00 0.07 0.00 0.00 59.36 60.07 2fqh h GLU 56 Cb 2.02 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 31.21 2fqh h GLU 56 CO -0.28 0.15 0.03 0.00 0.07 0.00 0.00 179.01 178.97 2fqh h ALA 57 N 1.56 0.20 -0.97 1.06 0.00 0.50 -2.81 119.26 118.80 2fqh h ALA 57 Ca 0.66 -0.16 0.29 0.00 0.00 0.00 0.00 54.91 55.71 2fqh h ALA 57 Cb 1.99 -0.06 -0.15 0.00 0.00 0.00 0.00 17.79 19.58 2fqh h ALA 57 CO -0.27 -0.15 0.48 0.35 0.00 0.00 0.00 179.25 179.66 2fqh h PHE 58 N 0.03 0.78 -0.61 0.00 3.04 0.17 0.21 116.94 120.55 2fqh h PHE 58 Ca 0.05 0.04 0.11 0.00 3.98 0.00 0.00 57.97 62.14 2fqh h PHE 58 Cb 0.29 -0.18 -0.12 0.00 2.56 0.00 0.00 35.95 38.50 2fqh h PHE 58 CO 0.02 -0.17 -0.33 -0.22 -2.02 0.00 0.00 178.31 175.58 2fqh h LYS 59 N 0.31 -0.14 -0.32 1.11 1.63 -1.25 1.05 116.57 118.96 2fqh h LYS 59 Ca 0.68 0.01 0.07 0.00 -0.85 0.00 0.00 60.65 60.56 2fqh h LYS 59 Cb 1.50 0.03 -0.08 0.00 -0.60 0.00 0.00 32.23 33.08 2fqh h LYS 59 CO -0.61 -0.10 -0.29 1.25 -3.45 0.00 0.00 179.45 176.25 2fqh h HIS 60 N -0.15 -0.79 -0.49 1.91 2.76 -0.68 0.24 115.15 117.95 2fqh h HIS 60 Ca 0.24 0.05 -0.00 0.00 -2.20 0.00 0.00 60.37 58.46 2fqh h HIS 60 Cb 0.55 0.40 -0.02 0.00 1.55 0.00 0.00 27.41 29.88 2fqh h HIS 60 CO -0.64 -0.36 0.30 1.15 -1.30 0.00 0.00 177.93 177.08 2fqh h THR 61 N -0.26 1.14 0.56 6.26 2.02 -0.68 -2.32 112.91 119.62 2fqh h THR 61 Ca 0.16 -0.29 -0.02 0.00 0.77 0.00 0.00 66.41 67.03 2fqh h THR 61 Cb 0.51 0.44 -0.00 0.00 -1.74 0.00 0.00 68.15 67.36 2fqh h THR 61 CO -0.47 0.14 -0.32 0.00 0.37 0.00 0.00 175.52 175.24 2fqh h ALA 62 N 1.67 -0.83 0.00 6.16 0.00 0.41 -0.12 119.26 126.55 2fqh h ALA 62 Ca 0.18 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.92 2fqh h ALA 62 Cb -0.04 0.38 0.00 0.00 0.00 0.00 0.00 17.79 18.13 2fqh h ALA 62 CO -0.04 -0.98 0.00 -2.13 0.00 0.00 0.00 179.25 176.11 2fqh n ARG 63 N -5.46 0.53 0.07 0.00 0.63 0.22 -2.76 116.66 109.88 2fqh n ARG 63 Ca -0.12 0.00 -0.04 0.00 -0.92 0.00 0.00 57.85 56.77 2fqh n ARG 63 Cb 0.35 -1.00 -0.02 0.00 0.45 0.00 0.00 32.46 32.25 2fqh n ARG 63 CO 0.00 0.00 0.00 1.25 -2.51 0.00 0.00 177.63 176.37 2fqh h HIS 64 N 0.00 -0.22 0.00 -0.14 2.76 -0.47 -3.46 115.15 113.62 2fqh h HIS 64 Ca 0.00 -0.01 -0.00 0.00 -2.20 0.00 0.00 60.37 58.16 2fqh h HIS 64 Cb 0.00 0.07 -0.00 0.00 1.55 0.00 0.00 27.41 29.03 2fqh h HIS 64 CO 0.00 -0.14 -0.28 0.27 -1.30 0.00 0.00 177.93 176.49 2fqh n ASN 65 N -4.14 1.31 -0.77 3.26 6.94 -1.21 -5.08 115.26 115.57 2fqh n ASN 65 Ca -0.03 0.19 0.00 0.00 -0.02 0.00 0.00 54.58 54.72 2fqh n ASN 65 Cb 0.09 -0.44 0.00 0.00 -2.36 0.00 0.00 39.78 37.08 2fqh n ASN 65 CO 0.00 0.00 0.00 1.33 -1.03 0.00 0.00 177.26 177.56 2fqh n VAL 66 N -3.73 0.00 -3.99 3.53 0.24 -1.11 -5.12 118.33 108.14 2fqh n VAL 66 Ca -0.04 0.00 -0.17 0.00 -2.04 0.00 0.00 64.34 62.09 2fqh n VAL 66 Cb 0.14 -0.36 -0.16 0.00 -1.47 0.00 0.00 33.84 31.99 2fqh n VAL 66 CO 0.00 0.00 0.00 1.51 -2.14 0.00 0.00 176.83 176.20 2fqh s ASP 67 N -1.00 0.51 -0.04 -1.34 -4.77 -1.21 -3.75 116.67 105.07 2fqh s ASP 67 Ca 0.00 -0.05 -0.04 0.00 -3.30 0.00 0.00 52.55 49.16 2fqh s ASP 67 Cb 0.00 -0.25 0.01 0.00 -1.09 0.00 0.00 42.92 41.59 2fqh s ASP 67 CO 0.00 -0.08 0.11 -0.70 0.70 0.00 0.00 175.17 175.20 2fqh s GLU 68 N 0.89 0.13 -0.01 2.11 2.56 -1.26 -4.98 118.70 118.14 2fqh s GLU 68 Ca -0.10 0.16 0.02 0.00 0.00 0.00 0.00 54.97 55.05 2fqh s GLU 68 Cb -0.13 0.06 -0.00 0.00 2.00 0.00 0.00 34.13 36.06 2fqh s GLU 68 CO -0.01 -0.02 -0.07 -0.48 -0.56 0.00 0.00 175.26 174.13 2fqh s LEU 69 N 0.06 2.01 -0.00 2.70 -0.00 -1.26 -4.77 118.68 117.42 2fqh s LEU 69 Ca -0.00 -0.12 0.01 0.00 -0.00 0.00 0.00 54.13 54.02 2fqh s LEU 69 Cb -0.01 -0.34 -0.00 0.00 -0.00 0.00 0.00 46.19 45.84 2fqh s LEU 69 CO 0.00 0.08 -0.02 -1.00 -0.00 0.00 0.00 176.35 175.41 2fqh s HIS 70 N -0.15 0.17 -0.04 3.48 3.76 -1.26 -4.86 115.29 116.38 2fqh s HIS 70 Ca 0.02 -0.03 0.01 0.00 -0.15 0.00 0.00 55.06 54.91 2fqh s HIS 70 Cb -0.03 -0.11 0.02 0.00 1.11 0.00 0.00 32.58 33.58 2fqh s HIS 70 CO -0.00 -0.00 -0.04 -1.50 -0.85 0.00 0.00 174.74 172.35 2fqh s ILE 71 N -0.05 0.47 -0.07 0.60 -1.16 -1.26 -4.43 121.20 115.30 2fqh s ILE 71 Ca 0.01 -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 0.61 0.00 0.00 42.46 42.58 2fqh s ILE 71 CO -0.00 0.21 0.18 -1.81 -2.81 0.00 0.00 174.94 170.71 2fqh s ASP 72 N 0.89 -0.19 -0.04 4.50 1.01 -1.24 -5.05 116.67 116.56 2fqh s ASP 72 Ca -0.11 0.36 0.01 0.00 0.71 0.00 0.00 52.55 53.52 2fqh s ASP 72 Cb -0.14 0.37 0.02 0.00 1.01 0.00 0.00 42.92 44.18 2fqh s ASP 72 CO -0.00 -0.06 -0.04 -0.83 0.21 0.00 0.00 175.17 174.45 2fqh s GLY 73 N 0.09 0.40 -0.07 0.21 0.00 -1.26 -3.42 107.32 103.27 2fqh s GLY 73 Ca -0.00 -0.01 -0.06 0.00 0.00 0.00 0.00 44.72 44.65 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 0.88 -0.19 0.00 1.64 3.84 -1.05 -4.97 114.94 115.09 2fqh s ASN 74 Ca -0.11 0.36 0.09 0.00 0.21 0.00 0.00 52.86 53.41 2fqh s ASN 74 Cb -0.14 0.37 0.43 0.00 -0.55 0.00 0.00 41.25 41.36 2fqh s ASN 74 CO -0.00 -0.06 1.21 0.00 -2.79 0.00 0.00 177.10 175.46 2fqh n TYR 75 N 2.98 0.00 0.37 0.43 4.11 -1.26 -0.82 117.16 122.97 2fqh n TYR 75 Ca -0.13 0.00 0.04 0.00 -0.00 0.00 0.00 57.90 57.82 2fqh n TYR 75 Cb 0.59 -0.37 -0.00 0.00 -0.00 0.00 0.00 39.34 39.56 2fqh n TYR 75 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.86 176.86 2fqh n GLN 76 N -1.37 2.34 -0.07 -3.48 10.64 -1.26 -4.70 117.38 119.48 2fqh n GLN 76 Ca 0.03 -0.51 -0.07 0.00 -1.83 0.00 0.00 57.00 54.62 2fqh n GLN 76 Cb 0.08 -1.02 -0.05 0.00 -0.86 0.00 0.00 30.24 28.39 2fqh n GLN 76 CO 0.00 0.00 0.00 1.25 -1.83 0.00 0.00 177.06 176.48 2fqh h LEU 77 N 0.87 -0.97 0.00 2.61 5.85 -1.35 -3.45 115.31 118.87 2fqh h LEU 77 Ca 0.00 0.13 0.00 0.00 0.84 0.00 0.00 57.88 58.85 2fqh h LEU 77 Cb 0.28 0.40 0.00 0.00 0.37 0.00 0.00 40.66 41.70 2fqh h LEU 77 CO 0.00 -0.21 0.00 0.61 -0.34 0.00 0.00 178.44 178.50 2fqh n GLY 78 N -1.20 0.00 3.92 3.75 0.00 -1.26 -4.89 105.19 105.51 2fqh n GLY 78 Ca -0.02 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.73 2fqh n GLY 78 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2fqh n ARG 79 N 0.00 -2.73 -4.02 1.61 0.63 -1.26 -4.94 116.66 105.95 2fqh n ARG 79 Ca 0.00 0.39 -0.34 0.00 -0.92 0.00 0.00 57.85 56.98 2fqh n ARG 79 Cb 0.00 -4.34 -0.15 0.00 0.45 0.00 0.00 32.46 28.42 2fqh n ARG 79 CO 0.00 0.00 0.00 0.54 -2.51 0.00 0.00 177.63 175.66 2fqh s ASN 80 N -4.18 3.80 -0.28 6.15 4.22 -1.26 -5.06 114.94 118.33 2fqh s ASN 80 Ca 0.11 -0.67 0.00 0.00 -2.14 0.00 0.00 52.86 50.16 2fqh s ASN 80 Cb -0.04 -1.60 0.05 0.00 1.28 0.00 0.00 41.25 40.94 2fqh s ASN 80 CO 0.89 -0.05 -0.05 0.68 -2.04 0.00 0.00 177.10 176.53 2fqh s VAL 81 N 1.34 2.63 -0.14 3.54 -7.23 -1.26 -3.55 120.40 115.72 2fqh s VAL 81 Ca 0.03 -1.49 0.00 0.00 -1.81 0.00 0.00 61.98 58.71 2fqh s VAL 81 Cb -0.15 -2.52 0.02 0.00 0.56 0.00 0.00 36.38 34.29 2fqh s VAL 81 CO -0.08 -0.07 -0.14 -0.76 -0.31 0.00 0.00 175.10 173.75 2fqh s LEU 82 N 1.19 1.63 -0.30 1.32 1.43 -1.18 -4.98 118.68 117.79 2fqh s LEU 82 Ca -0.07 -0.47 -0.01 0.00 -1.03 0.00 0.00 54.13 52.55 2fqh s LEU 82 Cb -0.20 -1.15 0.05 0.00 0.03 0.00 0.00 46.19 44.93 2fqh s LEU 82 CO -0.03 -0.06 -0.01 -0.22 0.23 0.00 0.00 176.35 176.26 2fqh s LEU 83 N 1.51 3.86 -0.14 1.79 0.20 -1.26 -1.39 118.68 123.24 2fqh s LEU 83 Ca 0.05 -1.27 0.00 0.00 0.69 0.00 0.00 54.13 53.60 2fqh s LEU 83 Cb -0.13 -1.70 0.02 0.00 -0.43 0.00 0.00 46.19 43.95 2fqh s LEU 83 CO -0.10 -0.25 -0.14 -0.54 -0.29 0.00 0.00 176.35 175.03 2fqh s LYS 84 N 1.25 2.22 -0.24 1.98 1.02 -1.13 -5.07 119.74 119.77 2fqh s LYS 84 Ca -0.05 -0.53 -0.02 0.00 0.02 0.00 0.00 55.97 55.39 2fqh s LYS 84 Cb -0.20 -2.05 0.02 0.00 -0.52 0.00 0.00 37.83 35.08 2fqh s LYS 84 CO -0.01 -0.24 -0.07 1.21 -0.92 0.00 0.00 175.35 175.32 2fqh s ASN 85 N 1.51 4.21 -0.21 2.83 3.84 -1.26 -3.98 114.94 121.89 2fqh s ASN 85 Ca 0.05 -0.78 -0.02 0.00 0.21 0.00 0.00 52.86 52.32 2fqh s ASN 85 Cb -0.13 -1.66 0.00 0.00 -0.55 0.00 0.00 41.25 38.91 2fqh s ASN 85 CO -0.10 -0.10 -0.10 -0.83 -2.79 0.00 0.00 177.10 173.17 2fqh s GLY 86 N 1.35 1.53 -0.15 1.21 0.00 -1.25 -5.08 107.32 104.93 2fqh s GLY 86 Ca 0.02 -1.19 0.00 0.00 0.00 0.00 0.00 44.72 43.55 2fqh s GLY 86 CO -0.05 0.38 -0.14 1.85 0.00 0.00 0.00 173.10 175.14 2fqh s GLU 87 N 1.41 2.24 -0.12 2.90 2.12 -1.26 -4.00 118.70 121.99 2fqh s GLU 87 Ca 0.05 -0.54 -0.05 0.00 0.36 0.00 0.00 54.97 54.80 2fqh s GLU 87 Cb -0.14 -2.07 0.06 0.00 0.26 0.00 0.00 34.13 32.24 2fqh s GLU 87 CO -0.07 -0.24 0.24 -0.51 -0.54 0.00 0.00 175.26 174.14 2fqh s ASP 88 N 1.50 0.28 -0.04 -1.70 1.11 -1.26 -5.06 116.67 111.51 2fqh s ASP 88 Ca 0.05 0.53 0.00 0.00 0.18 0.00 0.00 52.55 53.31 2fqh s ASP 88 Cb -0.13 0.57 0.03 0.00 1.07 0.00 0.00 42.92 44.45 2fqh s ASP 88 CO -0.11 -0.22 -0.01 -0.13 1.18 0.00 0.00 175.17 175.88 2fqh s ARG 89 N 2.15 0.44 0.43 8.23 1.81 -1.26 -4.85 118.95 125.90 2fqh s ARG 89 Ca -0.01 0.06 0.03 0.00 -1.72 0.00 0.00 55.73 54.09 2fqh s ARG 89 Cb -0.12 -0.63 -0.02 0.00 -0.45 0.00 0.00 34.95 33.73 2fqh s ARG 89 CO -0.08 -0.16 0.10 -0.51 -0.68 0.00 0.00 175.30 173.98 2fqh s LEU 90 N 1.19 2.07 0.30 2.53 2.01 -1.26 -5.04 118.68 120.47 2fqh s LEU 90 Ca -0.07 -1.68 0.18 0.00 0.01 0.00 0.00 54.13 52.58 2fqh s LEU 90 Cb -0.13 -0.25 0.13 0.00 0.01 0.00 0.00 46.19 45.95 2fqh s LEU 90 CO -0.02 -0.92 1.40 0.08 1.01 0.00 0.00 176.35 177.90 2fqh h ARG 91 N 1.68 0.00 0.00 1.70 0.11 -2.06 -3.13 114.38 112.67 2fqh h ARG 91 Ca -0.37 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.71 2fqh h ARG 91 Cb 1.28 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.36 2fqh h ARG 91 CO 0.61 0.27 0.00 1.97 0.10 0.00 0.00 179.97 182.92 2fqh n PHE 92 N -3.10 0.00 -3.13 4.08 1.16 -1.26 -4.70 117.46 110.51 2fqh n PHE 92 Ca 0.01 0.00 -0.40 0.00 -1.87 0.00 0.00 57.45 55.19 2fqh n PHE 92 Cb 0.66 -0.13 -0.06 0.00 -1.61 0.00 0.00 39.48 38.34 2fqh n PHE 92 CO 0.00 0.00 0.00 0.71 -1.87 0.00 0.00 176.76 175.60 2fqh s TYR 93 N -2.25 3.31 -0.05 2.97 1.51 -1.19 -4.90 117.35 116.76 2fqh s TYR 93 Ca 0.32 0.83 0.18 0.00 -1.01 0.00 0.00 57.07 57.39 2fqh s TYR 93 Cb 0.17 -2.81 -0.28 0.00 -0.11 0.00 0.00 41.96 38.94 2fqh s TYR 93 CO 0.33 -0.26 0.41 0.28 -1.11 0.00 0.00 175.55 175.20 2fqh n VAL 94 N 5.01 0.00 0.04 0.71 0.31 -1.26 -4.31 118.33 118.83 2fqh n VAL 94 Ca -0.01 -0.40 -0.10 0.00 -0.01 0.00 0.00 64.34 63.82 2fqh n VAL 94 Cb 0.49 0.12 -0.13 0.00 -0.91 0.00 0.00 33.84 33.41 2fqh n VAL 94 CO 0.00 0.00 0.00 0.50 -1.32 0.00 0.00 176.83 176.01 2fqh h LYS 95 N 0.00 0.06 -6.30 5.55 3.64 -1.99 -3.48 116.57 114.04 2fqh h LYS 95 Ca 0.00 -0.10 -0.33 0.00 -1.27 0.00 0.00 60.65 58.95 2fqh h LYS 95 Cb 0.82 0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.68 2fqh h LYS 95 CO 0.00 0.90 -0.82 1.19 -2.27 0.00 0.00 179.45 178.45 2fqh n PHE 96 N -3.30 -2.45 -3.99 1.91 3.72 -1.26 -4.95 117.46 107.13 2fqh n PHE 96 Ca -0.08 0.99 -0.32 0.00 -0.05 0.00 0.00 57.45 57.99 2fqh n PHE 96 Cb 0.99 -3.03 -0.15 0.00 -0.94 0.00 0.00 39.48 36.36 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 -2.75 1.92 -0.61 1.37 0.00 -1.26 -5.06 107.32 100.93 2fqh s GLY 97 Ca 0.07 -2.48 -0.27 0.00 0.00 0.00 0.00 44.72 42.04 2fqh s GLY 97 CO 0.85 0.93 1.52 2.56 0.00 0.00 0.00 173.10 178.96 2fqh s PRO 98 N 0.95 3.08 -1.01 2.90 0.04 -1.26 -4.91 135.00 134.79 2fqh s PRO 98 Ca 0.09 0.36 -0.25 0.00 0.04 0.00 0.00 61.00 61.24 2fqh s PRO 98 Cb -0.20 -4.22 -0.13 0.00 0.04 0.00 0.00 34.50 30.00 2fqh s PRO 98 CO -0.07 -2.22 2.09 0.20 0.04 0.00 0.00 177.00 177.04 2fqh s GLY 99 N 5.37 -0.40 0.32 0.56 0.00 -1.26 -4.81 107.32 107.11 2fqh s GLY 99 Ca 0.53 -1.53 0.07 0.00 0.00 0.00 0.00 44.72 43.79 2fqh s GLY 99 CO 0.22 3.89 0.36 0.00 0.00 0.00 0.00 173.10 177.56 2fqh s ALA 100 N 13.28 3.98 0.26 3.20 0.00 -1.26 -3.75 121.76 137.47 2fqh s ALA 100 Ca 0.78 -1.53 -0.04 0.00 0.00 0.00 0.00 51.96 51.16 2fqh s ALA 100 Cb -0.06 -1.42 0.32 0.00 0.00 0.00 0.00 23.12 21.97 2fqh s ALA 100 CO 0.10 0.03 1.91 -0.39 0.00 0.00 0.00 175.76 177.41 2fqh h VAL 101 N 1.12 1.24 -0.55 0.00 -1.51 -1.90 0.16 116.25 114.82 2fqh h VAL 101 Ca -0.46 -0.54 -0.06 0.00 -1.23 0.00 0.00 66.70 64.41 2fqh h VAL 101 Cb 1.25 0.04 -0.02 0.00 -2.13 0.00 0.00 31.29 30.43 2fqh h VAL 101 CO 0.57 0.26 0.11 -0.29 -1.23 0.00 0.00 177.57 176.98 2fqh h ILE 102 N 1.19 1.25 -0.35 7.19 2.10 -1.96 -2.38 117.51 124.56 2fqh h ILE 102 Ca 0.31 -0.92 -0.06 0.00 1.08 0.00 0.00 64.86 65.27 2fqh h ILE 102 Cb -0.03 0.79 -0.02 0.00 -1.09 0.00 0.00 36.82 36.47 2fqh h ILE 102 CO -0.06 0.33 -0.06 0.11 -1.08 0.00 0.00 178.15 177.40 2fqh h LYS 103 N 0.79 0.57 -1.15 2.19 6.56 -1.65 -2.47 116.57 121.40 2fqh h LYS 103 Ca 0.17 -0.15 0.35 0.00 -1.06 0.00 0.00 60.65 59.96 2fqh h LYS 103 Cb 0.37 -0.07 -0.12 0.00 -0.57 0.00 0.00 32.23 31.84 2fqh h LYS 103 CO 0.01 0.63 0.72 0.93 -2.06 0.00 0.00 179.45 179.68 2fqh h GLU 104 N 0.53 0.24 -0.77 3.15 5.08 -0.15 1.22 114.58 123.88 2fqh h GLU 104 Ca 0.11 -0.01 0.01 0.00 -1.00 0.00 0.00 59.36 58.46 2fqh h GLU 104 Cb 0.43 -0.05 -0.04 0.00 0.50 0.00 0.00 28.75 29.59 2fqh h GLU 104 CO 0.02 0.16 0.50 0.74 -1.00 0.00 0.00 179.01 179.43 2fqh h PHE 105 N 0.24 0.97 -1.18 4.33 0.04 -1.48 -1.20 116.94 118.66 2fqh h PHE 105 Ca 0.72 0.02 0.34 0.00 2.80 0.00 0.00 57.97 61.85 2fqh h PHE 105 Cb 2.00 -0.33 -0.05 0.00 2.20 0.00 0.00 35.95 39.78 2fqh h PHE 105 CO -0.01 0.62 0.96 -0.22 -0.60 0.00 0.00 178.31 179.06 2fqh h LYS 106 N 1.04 0.00 -0.95 1.51 3.64 0.14 0.67 116.57 122.62 2fqh h LYS 106 Ca 0.28 0.00 0.37 0.00 -1.27 0.00 0.00 60.65 60.03 2fqh h LYS 106 Cb -0.11 0.00 -0.17 0.00 -0.41 0.00 0.00 32.23 31.54 2fqh h LYS 106 CO -0.06 0.00 0.39 0.44 -2.27 0.00 0.00 179.45 177.95 2fqh n ILE 107 N -3.87 -0.40 0.00 2.00 -6.64 -0.45 -4.04 119.36 105.95 2fqh n ILE 107 Ca 0.26 1.97 0.00 0.00 -1.77 0.00 0.00 62.75 63.21 2fqh n ILE 107 Cb 1.34 -3.12 0.00 0.00 -1.44 0.00 0.00 39.64 36.42 2fqh n ILE 107 CO 0.00 0.00 0.00 0.41 -1.77 0.00 0.00 176.55 175.19 2fqh n THR 108 N -5.21 0.00 0.00 7.28 -1.04 0.75 -5.10 114.28 110.95 2fqh n THR 108 Ca 0.33 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.34 2fqh n THR 108 Cb 1.11 -0.25 0.00 0.00 -1.82 0.00 0.00 70.33 69.37 2fqh n THR 108 CO 0.00 0.00 0.00 -0.67 -0.64 0.00 0.00 175.07 173.76