#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 1.55 -0.09 3.17 1.04 -1.26 -4.90 113.70 113.20 2fqh s SER 2 Ca 0.00 -0.11 -0.04 0.00 0.48 0.00 0.00 55.95 56.28 2fqh s SER 2 Cb 0.00 -0.48 0.05 0.00 0.10 0.00 0.00 66.02 65.68 2fqh s SER 2 CO 0.00 -0.16 0.20 -1.83 0.98 0.00 0.00 173.24 172.43 2fqh s GLU 3 N 1.78 0.13 -0.24 4.02 -1.05 -1.24 -4.01 118.70 118.09 2fqh s GLU 3 Ca 0.03 0.52 -0.02 0.00 -0.15 0.00 0.00 54.97 55.35 2fqh s GLU 3 Cb -0.13 -0.16 0.02 0.00 -0.44 0.00 0.00 34.13 33.43 2fqh s GLU 3 CO -0.05 -0.21 -0.07 0.08 0.95 0.00 0.00 175.26 175.96 2fqh s VAL 4 N 1.63 2.86 -0.07 1.83 1.01 -1.23 -2.75 120.40 123.69 2fqh s VAL 4 Ca -0.05 -0.93 -0.00 0.00 0.00 0.00 0.00 61.98 61.00 2fqh s VAL 4 Cb -0.11 -2.40 0.02 0.00 0.00 0.00 0.00 36.38 33.89 2fqh s VAL 4 CO -0.07 0.27 -0.03 0.54 0.00 0.00 0.00 175.10 175.81 2fqh s ASN 5 N 1.35 1.46 -0.01 3.32 2.20 -0.46 -3.10 114.94 119.70 2fqh s ASN 5 Ca 0.02 -0.14 -0.00 0.00 -0.94 0.00 0.00 52.86 51.79 2fqh s ASN 5 Cb -0.16 -0.52 0.00 0.00 -2.00 0.00 0.00 41.25 38.57 2fqh s ASN 5 CO -0.05 -0.12 0.01 -0.51 -2.94 0.00 0.00 177.10 173.49 2fqh s ILE 6 N 1.50 -0.00 -0.02 0.54 -1.16 -1.26 -2.39 121.20 118.41 2fqh s ILE 6 Ca -0.01 0.02 -0.02 0.00 -0.51 0.00 0.00 60.65 60.12 2fqh s ILE 6 Cb -0.13 -0.03 0.00 0.00 0.61 0.00 0.00 42.46 42.92 2fqh s ILE 6 CO -0.03 0.01 0.05 0.54 -2.81 0.00 0.00 174.94 172.69 2fqh s VAL 7 N 0.08 -0.00 -0.12 4.00 0.11 -1.25 -4.28 120.40 118.95 2fqh s VAL 7 Ca -0.01 0.00 -0.01 0.00 -2.93 0.00 0.00 61.98 59.04 2fqh s VAL 7 Cb -0.01 -0.08 0.03 0.00 -1.53 0.00 0.00 36.38 34.79 2fqh s VAL 7 CO -0.00 0.00 -0.06 0.68 -3.33 0.00 0.00 175.10 172.39 2fqh s VAL 8 N 0.03 0.91 -0.26 2.04 -7.23 -1.26 -4.14 120.40 110.49 2fqh s VAL 8 Ca -0.00 -0.28 0.03 0.00 -1.81 0.00 0.00 61.98 59.92 2fqh s VAL 8 Cb -0.00 -0.99 0.06 0.00 0.56 0.00 0.00 36.38 36.00 2fqh s VAL 8 CO 0.00 0.30 -0.10 0.20 -0.31 0.00 0.00 175.10 175.19 2fqh s ASN 9 N 1.75 4.48 -1.13 4.85 -0.87 -1.26 -4.73 114.94 118.02 2fqh s ASN 9 Ca 0.04 -1.39 -0.03 0.00 -1.57 0.00 0.00 52.86 49.91 2fqh s ASN 9 Cb -0.13 -1.56 -0.03 0.00 -0.02 0.00 0.00 41.25 39.51 2fqh s ASN 9 CO -0.08 -0.19 0.94 0.61 -2.57 0.00 0.00 177.10 175.81 2fqh n GLY 10 N 4.44 -0.75 4.07 0.66 0.00 -1.26 -3.00 105.19 109.35 2fqh n GLY 10 Ca -0.14 0.34 -0.44 0.00 0.00 0.00 0.00 46.02 45.78 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 -3.72 -0.26 -3.40 1.61 1.74 -1.26 -4.87 116.66 106.50 2fqh n ARG 11 Ca -0.18 0.00 -0.38 0.00 -0.77 0.00 0.00 57.85 56.51 2fqh n ARG 11 Cb 0.64 -2.13 -0.08 0.00 -1.02 0.00 0.00 32.46 29.87 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 -7.30 4.11 0.16 5.56 -6.30 -1.16 -4.98 118.70 108.79 2fqh s GLU 12 Ca 0.45 0.12 0.04 0.00 -2.50 0.00 0.00 54.97 53.09 2fqh s GLU 12 Cb -0.25 -3.59 -0.05 0.00 0.00 0.00 0.00 34.13 30.24 2fqh s GLU 12 CO 0.89 -0.13 -0.08 0.00 0.02 0.00 0.00 175.26 175.96 2fqh s ALA 13 N 1.62 1.50 0.00 6.30 0.00 -1.26 -4.75 121.76 125.17 2fqh s ALA 13 Ca 0.17 -1.54 0.00 0.00 0.00 0.00 0.00 51.96 50.59 2fqh s ALA 13 Cb -0.15 0.14 0.00 0.00 0.00 0.00 0.00 23.12 23.11 2fqh s ALA 13 CO 0.08 -0.13 0.00 0.41 0.00 0.00 0.00 175.76 176.12 2fqh n GLY 14 N -0.23 0.00 3.70 0.00 0.00 -1.26 -5.11 105.19 102.29 2fqh n GLY 14 Ca -0.09 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.82 2fqh n GLY 14 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2fqh s SER 15 N 0.00 0.37 -0.00 1.61 1.04 -1.26 -5.00 113.70 110.45 2fqh s SER 15 Ca 0.00 -1.32 0.02 0.00 0.48 0.00 0.00 55.95 55.13 2fqh s SER 15 Cb 0.00 0.81 0.05 0.00 0.10 0.00 0.00 66.02 66.98 2fqh s SER 15 CO 0.00 -1.60 1.04 0.29 0.98 0.00 0.00 173.24 173.94 2fqh n LYS 16 N -0.56 1.13 -0.17 4.02 4.76 -1.26 -3.39 118.16 122.69 2fqh n LYS 16 Ca -0.06 -0.19 0.03 0.00 -2.87 0.00 0.00 58.31 55.22 2fqh n LYS 16 Cb 0.60 -1.04 0.10 0.00 -1.84 0.00 0.00 35.03 32.85 2fqh n LYS 16 CO 0.00 0.00 0.00 -1.13 -1.37 0.00 0.00 177.40 174.90 2fqh n SER 17 N -0.34 1.61 0.08 4.39 3.41 -1.26 -3.27 113.62 118.24 2fqh n SER 17 Ca 0.02 -2.10 0.09 0.00 -0.26 0.00 0.00 58.87 56.62 2fqh n SER 17 Cb 0.05 -0.30 -0.03 0.00 -0.26 0.00 0.00 64.21 63.67 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 0.15 0.61 0.00 4.33 4.76 -1.22 -3.94 118.16 122.85 2fqh n LYS 18 Ca 0.07 0.12 0.00 0.00 -2.87 0.00 0.00 58.31 55.64 2fqh n LYS 18 Cb 0.31 -1.81 0.00 0.00 -1.84 0.00 0.00 35.03 31.70 2fqh n LYS 18 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2fqh n GLY 19 N 1.23 0.94 4.00 0.72 0.00 -1.17 -4.12 105.19 106.79 2fqh n GLY 19 Ca -0.02 -0.56 -0.18 0.00 0.00 0.00 0.00 46.02 45.26 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 0.70 0.47 0.98 0.00 0.00 -1.88 -3.24 119.26 116.29 2fqh h ALA 21 Ca -0.42 -0.32 -0.05 0.00 0.00 0.00 0.00 54.91 54.12 2fqh h ALA 21 Cb 1.27 -0.12 0.01 0.00 0.00 0.00 0.00 17.79 18.95 2fqh h ALA 21 CO 0.48 0.35 -0.47 1.25 0.00 0.00 0.00 179.25 180.86 2fqh h LEU 22 N 0.46 -1.12 -8.83 0.00 6.46 -1.96 -3.47 115.31 106.86 2fqh h LEU 22 Ca 0.08 0.04 -0.40 0.00 -0.12 0.00 0.00 57.88 57.48 2fqh h LEU 22 Cb 0.63 0.29 -0.14 0.00 -0.73 0.00 0.00 40.66 40.71 2fqh h LEU 22 CO 0.04 -0.79 -0.54 0.00 -0.62 0.00 0.00 178.44 176.54 2fqh s GLY 24 N -3.31 2.27 -0.13 0.00 0.00 -1.26 -0.06 107.32 104.83 2fqh s GLY 24 Ca 0.39 -3.02 0.00 0.00 0.00 0.00 0.00 44.72 42.10 2fqh s GLY 24 CO 0.22 0.99 -0.12 0.00 0.00 0.00 0.00 173.10 174.19 2fqh n ALA 25 N 3.53 1.74 -1.97 3.20 0.00 -1.26 -4.91 120.51 120.85 2fqh n ALA 25 Ca 0.05 -0.56 -0.24 0.00 0.00 0.00 0.00 53.44 52.68 2fqh n ALA 25 Cb 0.36 0.21 0.10 0.00 0.00 0.00 0.00 19.45 20.11 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 -2.26 2.22 0.10 0.00 -4.23 -1.26 -5.00 115.64 105.20 2fqh s THR 26 Ca -0.18 -0.50 -0.26 0.00 -1.18 0.00 0.00 61.69 59.57 2fqh s THR 26 Cb 0.05 -2.72 0.08 0.00 1.34 0.00 0.00 72.50 71.24 2fqh s THR 26 CO 0.30 0.00 0.87 -1.66 -0.54 0.00 0.00 174.62 173.59 2fqh s TRP 27 N -3.18 -0.27 0.00 3.99 1.48 -1.26 -3.03 118.94 116.68 2fqh s TRP 27 Ca 0.65 0.03 0.00 0.00 -1.06 0.00 0.00 56.10 55.72 2fqh s TRP 27 Cb -0.07 0.59 0.00 0.00 -1.16 0.00 0.00 33.47 32.84 2fqh s TRP 27 CO 0.44 -0.74 0.00 0.41 -4.06 0.00 0.00 176.95 173.00 2fqh n GLY 28 N -0.37 4.16 0.17 3.67 0.00 -1.26 -4.97 105.19 106.59 2fqh n GLY 28 Ca -0.08 -0.60 0.14 0.00 0.00 0.00 0.00 46.02 45.48 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 0.68 -0.12 1.61 8.00 -1.26 -3.37 116.55 122.10 2fqh n ASP 29 Ca 0.00 -0.73 0.15 0.00 0.71 0.00 0.00 54.79 54.92 2fqh n ASP 29 Cb 0.00 -0.01 0.84 0.00 -0.02 0.00 0.00 41.12 41.93 2fqh n ASP 29 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 2fqh n TYR 30 N -0.80 0.00 -2.92 1.24 4.02 -1.26 -4.83 117.16 112.61 2fqh n TYR 30 Ca 0.14 0.00 -0.21 0.00 -0.01 0.00 0.00 57.90 57.82 2fqh n TYR 30 Cb 0.30 -0.01 0.08 0.00 -0.02 0.00 0.00 39.34 39.69 2fqh n TYR 30 CO 0.00 0.00 0.00 -1.01 -1.01 0.00 0.00 176.86 174.84 2fqh s HIS 31 N -2.03 1.25 -0.17 -0.72 3.76 -1.22 -5.10 115.29 111.07 2fqh s HIS 31 Ca 0.45 -0.65 -0.02 0.00 -0.15 0.00 0.00 55.06 54.69 2fqh s HIS 31 Cb 0.22 -2.42 -0.01 0.00 1.11 0.00 0.00 32.58 31.48 2fqh s HIS 31 CO 0.37 -1.42 -0.10 0.00 -0.85 0.00 0.00 174.74 172.74 2fqh s ALA 32 N -2.84 2.68 0.44 -1.40 0.00 -1.26 -5.11 121.76 114.27 2fqh s ALA 32 Ca 0.64 -1.02 -0.03 0.00 0.00 0.00 0.00 51.96 51.55 2fqh s ALA 32 Cb -0.05 -1.40 -0.03 0.00 0.00 0.00 0.00 23.12 21.63 2fqh s ALA 32 CO 0.41 -0.05 0.71 0.34 0.00 0.00 0.00 175.76 177.17 2fqh s ASP 33 N 0.84 6.24 0.42 0.00 -1.08 -1.26 -4.41 116.67 117.43 2fqh s ASP 33 Ca -0.03 0.76 0.05 0.00 -0.52 0.00 0.00 52.55 52.80 2fqh s ASP 33 Cb -0.15 -2.15 -0.06 0.00 -1.46 0.00 0.00 42.92 39.11 2fqh s ASP 33 CO 0.01 -0.51 0.02 0.12 0.52 0.00 0.00 175.17 175.33 2fqh s PHE 34 N -2.61 2.23 0.47 -5.34 5.36 -1.05 -4.54 117.98 112.50 2fqh s PHE 34 Ca 0.45 -0.82 0.18 0.00 -0.96 0.00 0.00 56.93 55.79 2fqh s PHE 34 Cb -0.10 -1.63 1.20 0.00 -0.34 0.00 0.00 43.02 42.15 2fqh s PHE 34 CO 0.42 0.29 2.05 -0.07 -1.46 0.00 0.00 175.22 176.46 2fqh h LEU 35 N 1.71 0.00 -0.13 6.12 4.07 -1.92 0.17 115.31 125.34 2fqh h LEU 35 Ca -0.43 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.53 2fqh h LEU 35 Cb 1.26 0.00 0.00 0.00 1.08 0.00 0.00 40.66 43.00 2fqh h LEU 35 CO 0.76 0.13 0.00 0.61 -1.08 0.00 0.00 178.44 178.86 2fqh n GLY 36 N -1.06 -0.89 2.21 0.83 0.00 -1.26 -4.86 105.19 100.16 2fqh n GLY 36 Ca -0.02 -0.01 -0.08 0.00 0.00 0.00 0.00 46.02 45.90 2fqh n GLY 36 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2fqh n GLU 37 N -1.60 -2.90 -4.04 1.61 2.13 0.05 -5.02 120.64 110.87 2fqh n GLU 37 Ca 0.02 0.41 -0.13 0.00 0.66 0.00 0.00 57.16 58.13 2fqh n GLU 37 Cb 0.13 -4.06 -0.04 0.00 0.27 0.00 0.00 31.44 27.74 2fqh n GLU 37 CO 0.00 0.00 0.00 0.16 -0.41 0.00 0.00 177.13 176.88 2fqh s ASP 38 N -3.59 0.61 -0.12 4.31 1.47 -1.25 -4.56 116.67 113.53 2fqh s ASP 38 Ca 0.03 -1.34 -0.00 0.00 1.18 0.00 0.00 52.55 52.42 2fqh s ASP 38 Cb -0.00 0.67 0.03 0.00 -0.34 0.00 0.00 42.92 43.27 2fqh s ASP 38 CO 0.36 -1.31 -0.07 -0.22 0.68 0.00 0.00 175.17 174.60 2fqh s LEU 39 N -3.18 1.23 -0.04 2.11 1.98 0.25 -2.52 118.68 118.51 2fqh s LEU 39 Ca 0.27 -0.34 0.16 0.00 -2.89 0.00 0.00 54.13 51.33 2fqh s LEU 39 Cb -0.01 -0.85 -0.24 0.00 0.66 0.00 0.00 46.19 45.75 2fqh s LEU 39 CO 0.17 -0.13 0.32 2.22 -1.89 0.00 0.00 176.35 177.04 2fqh n PHE 40 N 4.94 0.00 0.47 5.38 1.16 -1.26 -3.87 117.46 124.27 2fqh n PHE 40 Ca -0.12 0.00 0.04 0.00 -1.87 0.00 0.00 57.45 55.49 2fqh n PHE 40 Cb 0.50 -0.43 0.22 0.00 -1.61 0.00 0.00 39.48 38.16 2fqh n PHE 40 CO 0.00 0.00 0.00 0.34 -1.87 0.00 0.00 176.76 175.23 2fqh n PHE 41 N -2.14 0.00 -0.12 2.97 7.35 -1.26 0.26 117.46 124.52 2fqh n PHE 41 Ca -0.06 0.00 -0.22 0.00 -0.76 0.00 0.00 57.45 56.41 2fqh n PHE 41 Cb 0.51 0.00 -0.07 0.00 0.35 0.00 0.00 39.48 40.26 2fqh n PHE 41 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2fqh n ASP 44 N -3.57 -4.25 -0.04 0.00 2.03 0.72 -4.74 116.55 106.69 2fqh n ASP 44 Ca -0.27 0.30 -0.05 0.00 0.52 0.00 0.00 54.79 55.29 2fqh n ASP 44 Cb 0.70 -3.55 -0.02 0.00 -0.72 0.00 0.00 41.12 37.53 2fqh n ASP 44 CO 0.00 0.00 0.00 -0.38 -1.92 0.00 0.00 177.20 174.90 2fqh n ILE 45 N -1.92 1.02 0.81 5.18 -0.00 -1.26 -4.66 119.36 118.53 2fqh n ILE 45 Ca -0.12 0.26 0.11 0.00 -0.00 0.00 0.00 62.75 63.00 2fqh n ILE 45 Cb 0.49 -1.96 0.09 0.00 -0.00 0.00 0.00 39.64 38.25 2fqh n ILE 45 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 2fqh s ALA 47 N -3.08 4.48 -0.02 0.00 0.00 -1.26 -4.68 121.76 117.20 2fqh s ALA 47 Ca 0.07 -1.69 -0.00 0.00 0.00 0.00 0.00 51.96 50.34 2fqh s ALA 47 Cb 0.16 -1.57 -0.00 0.00 0.00 0.00 0.00 23.12 21.71 2fqh s ALA 47 CO 0.77 -0.27 0.02 0.00 0.00 0.00 0.00 175.76 176.28 2fqh n ALA 48 N -1.82 -1.03 -2.02 0.00 0.00 -1.26 -4.56 120.51 109.83 2fqh n ALA 48 Ca 0.08 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 53.17 2fqh n ALA 48 Cb 0.59 -0.32 -0.06 0.00 0.00 0.00 0.00 19.45 19.66 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 -3.01 4.24 0.00 0.00 1.03 -1.26 -4.96 118.70 114.73 2fqh s GLU 49 Ca 0.00 0.93 0.24 0.00 0.03 0.00 0.00 54.97 56.17 2fqh s GLU 49 Cb -0.00 -2.64 0.67 0.00 -0.80 0.00 0.00 34.13 31.36 2fqh s GLU 49 CO 0.02 0.25 1.52 1.19 -1.33 0.00 0.00 175.26 176.91 2fqh n PHE 50 N 0.19 0.15 0.65 4.83 3.01 -1.26 -4.05 117.46 120.97 2fqh n PHE 50 Ca 0.01 -0.07 0.06 0.00 1.01 0.00 0.00 57.45 58.46 2fqh n PHE 50 Cb 0.52 0.00 0.33 0.00 -0.01 0.00 0.00 39.48 40.32 2fqh n PHE 50 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2fqh n MET 51 N 0.69 0.24 -2.68 -1.08 0.00 -1.26 -4.69 117.12 108.36 2fqh n MET 51 Ca 0.17 0.12 -0.16 0.00 0.00 0.00 0.00 57.70 57.83 2fqh n MET 51 Cb 0.44 -1.50 0.04 0.00 0.00 0.00 0.00 33.22 32.20 2fqh n MET 51 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 175.97 176.06 2fqh n ASN 52 N -1.20 1.77 -4.90 3.17 4.13 -1.26 -4.93 115.26 112.04 2fqh n ASN 52 Ca 0.07 -2.23 -0.28 0.00 1.68 0.00 0.00 54.58 53.82 2fqh n ASN 52 Cb 0.08 -0.25 0.02 0.00 -1.54 0.00 0.00 39.78 38.08 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 -3.93 3.28 0.28 3.52 0.23 -1.26 -4.98 119.30 116.44 2fqh s MET 53 Ca 0.41 0.25 -0.01 0.00 -1.03 0.00 0.00 55.69 55.31 2fqh s MET 53 Cb -0.03 -2.26 0.39 0.00 -1.53 0.00 0.00 34.83 31.40 2fqh s MET 53 CO 0.26 -0.51 1.79 0.52 -2.03 0.00 0.00 175.02 175.05 2fqh h MET 54 N -0.08 0.75 -1.24 3.16 2.86 -2.00 -2.43 114.93 115.95 2fqh h MET 54 Ca -0.46 -0.19 0.37 0.00 -2.06 0.00 0.00 59.70 57.37 2fqh h MET 54 Cb 1.22 -0.09 -0.10 0.00 0.06 0.00 0.00 31.60 32.69 2fqh h MET 54 CO 0.62 0.75 0.82 -0.44 1.06 0.00 0.00 176.91 179.72 2fqh h ASP 55 N 0.71 0.27 -0.74 1.22 3.32 -1.99 0.35 116.42 119.56 2fqh h ASP 55 Ca 0.14 0.09 0.15 0.00 0.02 0.00 0.00 57.03 57.43 2fqh h ASP 55 Cb 0.41 0.06 -0.14 0.00 0.22 0.00 0.00 39.33 39.88 2fqh h ASP 55 CO 0.01 -0.05 -0.21 -0.33 -1.72 0.00 0.00 179.24 176.95 2fqh h GLU 56 N 0.18 -0.02 -0.15 3.56 5.08 -1.83 0.44 114.58 121.85 2fqh h GLU 56 Ca 0.71 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 59.06 2fqh h GLU 56 Cb 2.22 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 31.47 2fqh h GLU 56 CO -0.29 -0.01 0.03 0.00 -1.00 0.00 0.00 179.01 177.73 2fqh h ALA 57 N 1.66 0.19 -0.96 3.43 0.00 -0.50 -2.63 119.26 120.46 2fqh h ALA 57 Ca 0.35 -0.15 0.22 0.00 0.00 0.00 0.00 54.91 55.33 2fqh h ALA 57 Cb 0.55 -0.06 -0.08 0.00 0.00 0.00 0.00 17.79 18.21 2fqh h ALA 57 CO -0.77 -0.16 0.63 0.35 0.00 0.00 0.00 179.25 179.30 2fqh h PHE 58 N 0.03 0.60 -0.13 0.00 3.04 -0.51 0.66 116.94 120.63 2fqh h PHE 58 Ca 0.04 0.02 0.03 0.00 3.98 0.00 0.00 57.97 62.04 2fqh h PHE 58 Cb 0.28 -0.18 -0.03 0.00 2.56 0.00 0.00 35.95 38.58 2fqh h PHE 58 CO 0.01 0.12 -0.06 -0.22 -2.02 0.00 0.00 178.31 176.15 2fqh h LYS 59 N 0.42 -0.05 -1.05 1.11 3.11 0.11 -0.67 116.57 119.54 2fqh h LYS 59 Ca 0.52 0.00 0.32 0.00 -2.81 0.00 0.00 60.65 58.68 2fqh h LYS 59 Cb 1.28 0.01 -0.13 0.00 -1.00 0.00 0.00 32.23 32.39 2fqh h LYS 59 CO -0.22 -0.03 0.63 1.25 -2.81 0.00 0.00 179.45 178.27 2fqh h HIS 60 N -0.05 0.84 -0.38 1.91 2.76 -0.84 1.64 115.15 121.04 2fqh h HIS 60 Ca 0.07 0.03 -0.07 0.00 -2.20 0.00 0.00 60.37 58.21 2fqh h HIS 60 Cb 0.16 -0.23 -0.02 0.00 1.55 0.00 0.00 27.41 28.87 2fqh h HIS 60 CO -0.19 -0.11 -0.05 1.15 -1.30 0.00 0.00 177.93 177.43 2fqh h THR 61 N 0.33 1.23 0.71 6.26 2.02 -1.07 -2.18 112.91 120.21 2fqh h THR 61 Ca 0.71 -0.95 -0.03 0.00 0.77 0.00 0.00 66.41 66.91 2fqh h THR 61 Cb 1.72 0.99 0.01 0.00 -1.74 0.00 0.00 68.15 69.13 2fqh h THR 61 CO -0.51 0.32 -0.35 0.00 0.37 0.00 0.00 175.52 175.35 2fqh h ALA 62 N 1.38 -0.96 0.00 6.16 0.00 0.28 -0.78 119.26 125.34 2fqh h ALA 62 Ca 0.11 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.82 2fqh h ALA 62 Cb 0.44 0.38 0.00 0.00 0.00 0.00 0.00 17.79 18.61 2fqh h ALA 62 CO 0.02 -1.04 0.00 -2.13 0.00 0.00 0.00 179.25 176.10 2fqh n ARG 63 N -5.51 0.61 0.08 0.00 0.63 -0.83 -2.74 116.66 108.90 2fqh n ARG 63 Ca -0.14 0.00 -0.04 0.00 -0.92 0.00 0.00 57.85 56.75 2fqh n ARG 63 Cb 0.39 -1.00 -0.02 0.00 0.45 0.00 0.00 32.46 32.28 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 0.01 -0.24 0.00 -0.14 2.76 -0.47 -3.45 115.15 113.61 2fqh h HIS 64 Ca 0.00 -0.01 -0.01 0.00 -2.20 0.00 0.00 60.37 58.15 2fqh h HIS 64 Cb 0.00 0.08 -0.00 0.00 1.55 0.00 0.00 27.41 29.04 2fqh h HIS 64 CO 0.00 -0.15 -0.37 0.27 -1.30 0.00 0.00 177.93 176.38 2fqh n ASN 65 N -4.27 1.23 -0.77 3.26 0.23 -1.22 -5.08 115.26 108.65 2fqh n ASN 65 Ca -0.03 0.18 0.00 0.00 -0.53 0.00 0.00 54.58 54.19 2fqh n ASN 65 Cb 0.10 -0.41 0.00 0.00 -2.08 0.00 0.00 39.78 37.39 2fqh n ASN 65 CO 0.00 0.00 0.00 0.52 -0.93 0.00 0.00 177.26 176.85 2fqh n VAL 66 N -3.69 0.00 -4.12 3.53 0.31 -1.11 -5.12 118.33 108.13 2fqh n VAL 66 Ca -0.05 0.00 -0.19 0.00 -0.01 0.00 0.00 64.34 64.09 2fqh n VAL 66 Cb 0.18 -0.37 -0.16 0.00 -0.91 0.00 0.00 33.84 32.58 2fqh n VAL 66 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2fqh s ASP 67 N -1.00 0.81 -0.07 4.52 -1.08 -1.20 -3.76 116.67 114.90 2fqh s ASP 67 Ca 0.00 -0.11 -0.06 0.00 -0.52 0.00 0.00 52.55 51.86 2fqh s ASP 67 Cb 0.00 -0.40 0.02 0.00 -1.46 0.00 0.00 42.92 41.08 2fqh s ASP 67 CO 0.00 -0.06 0.18 -0.70 0.52 0.00 0.00 175.17 175.11 2fqh s GLU 68 N 0.90 0.21 -0.01 4.34 -6.30 -1.26 -4.97 118.70 111.61 2fqh s GLU 68 Ca -0.11 0.25 0.02 0.00 -2.50 0.00 0.00 54.97 52.62 2fqh s GLU 68 Cb -0.14 0.10 -0.01 0.00 0.00 0.00 0.00 34.13 34.08 2fqh s GLU 68 CO -0.00 -0.02 -0.07 -0.48 0.02 0.00 0.00 175.26 174.71 2fqh s LEU 69 N 0.10 2.01 -0.00 2.70 -0.00 -1.26 -4.71 118.68 117.52 2fqh s LEU 69 Ca -0.00 -0.12 -0.00 0.00 -0.00 0.00 0.00 54.13 54.01 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 0.01 -1.00 -0.00 0.00 0.00 176.35 175.44 2fqh s HIS 70 N -0.15 -0.01 -0.04 3.48 3.76 -1.26 -4.98 115.29 116.09 2fqh s HIS 70 Ca 0.03 0.03 0.01 0.00 -0.15 0.00 0.00 55.06 54.97 2fqh s HIS 70 Cb -0.03 0.00 0.02 0.00 1.11 0.00 0.00 32.58 33.69 2fqh s HIS 70 CO -0.00 -0.01 -0.04 -1.50 -0.85 0.00 0.00 174.74 172.34 2fqh s ILE 71 N 0.00 0.47 -0.07 0.60 -1.16 -1.26 -4.36 121.20 115.43 2fqh s ILE 71 Ca -0.00 -0.09 -0.06 0.00 -0.51 0.00 0.00 60.65 59.98 2fqh s ILE 71 Cb -0.00 -0.51 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 -0.62 -2.81 0.00 0.00 174.94 171.90 2fqh s ASP 72 N 0.88 -0.19 -0.04 4.50 2.15 -1.18 -5.00 116.67 117.79 2fqh s ASP 72 Ca -0.11 0.37 0.01 0.00 0.43 0.00 0.00 52.55 53.24 2fqh s ASP 72 Cb -0.14 0.37 0.02 0.00 -0.30 0.00 0.00 42.92 42.87 2fqh s ASP 72 CO 0.00 -0.06 -0.04 -0.83 -0.17 0.00 0.00 175.17 174.07 2fqh s GLY 73 N 0.10 0.41 -0.08 2.66 0.00 -1.26 -3.53 107.32 105.61 2fqh s GLY 73 Ca -0.00 -0.01 -0.05 0.00 0.00 0.00 0.00 44.72 44.66 2fqh s GLY 73 CO 0.00 0.45 0.19 0.21 0.00 0.00 0.00 173.10 173.95 2fqh s ASN 74 N 0.90 -0.19 0.33 1.64 3.84 -1.26 -5.00 114.94 115.21 2fqh s ASN 74 Ca -0.11 0.39 0.19 0.00 0.21 0.00 0.00 52.86 53.54 2fqh s ASN 74 Cb -0.14 0.33 1.04 0.00 -0.55 0.00 0.00 41.25 41.93 2fqh s ASN 74 CO -0.00 -0.12 1.55 -1.22 -2.79 0.00 0.00 177.10 174.52 2fqh n TYR 75 N 3.72 0.65 0.57 0.43 4.01 -1.26 0.78 117.16 126.06 2fqh n TYR 75 Ca -0.21 0.34 0.09 0.00 -0.16 0.00 0.00 57.90 57.96 2fqh n TYR 75 Cb 0.55 -0.97 -0.12 0.00 -0.31 0.00 0.00 39.34 38.49 2fqh n TYR 75 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2fqh n GLN 76 N -2.21 0.83 -0.08 -0.72 -0.00 -1.26 -4.57 117.38 109.37 2fqh n GLN 76 Ca -0.01 -0.06 -0.07 0.00 -0.00 0.00 0.00 57.00 56.86 2fqh n GLN 76 Cb 0.14 -1.39 -0.05 0.00 -0.00 0.00 0.00 30.24 28.94 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 -0.95 0.00 2.61 5.85 -0.03 -3.45 115.31 119.35 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 0.58 0.39 0.00 0.00 0.37 0.00 0.00 40.66 42.00 2fqh h LEU 77 CO 0.00 -0.20 0.00 0.61 -0.34 0.00 0.00 178.44 178.51 2fqh n GLY 78 N -1.19 0.00 3.90 3.75 0.00 -1.26 -4.95 105.19 105.45 2fqh n GLY 78 Ca -0.02 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.72 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 -2.54 -3.99 1.61 1.74 -1.26 -4.94 116.66 107.27 2fqh n ARG 79 Ca 0.00 0.39 -0.34 0.00 -0.77 0.00 0.00 57.85 57.13 2fqh n ARG 79 Cb 0.00 -4.28 -0.15 0.00 -1.02 0.00 0.00 32.46 27.01 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 -4.11 3.86 -0.26 0.55 0.01 -1.26 -5.03 114.94 108.71 2fqh s ASN 80 Ca 0.15 -0.50 0.03 0.00 -0.71 0.00 0.00 52.86 51.82 2fqh s ASN 80 Cb -0.06 -1.64 0.06 0.00 0.41 0.00 0.00 41.25 40.02 2fqh s ASN 80 CO 0.89 -0.02 -0.11 0.68 -1.51 0.00 0.00 177.10 177.03 2fqh s VAL 81 N 1.40 2.16 -0.14 1.60 -7.23 -1.26 -3.66 120.40 113.26 2fqh s VAL 81 Ca 0.05 -1.63 0.00 0.00 -1.81 0.00 0.00 61.98 58.60 2fqh s VAL 81 Cb -0.14 -2.27 0.02 0.00 0.56 0.00 0.00 36.38 34.56 2fqh s VAL 81 CO -0.07 -0.03 -0.13 -0.76 -0.31 0.00 0.00 175.10 173.80 2fqh s LEU 82 N 1.11 1.63 -0.30 1.32 1.43 -1.11 -4.99 118.68 117.76 2fqh s LEU 82 Ca -0.09 -0.47 -0.01 0.00 -1.03 0.00 0.00 54.13 52.53 2fqh s LEU 82 Cb -0.20 -1.14 0.05 0.00 0.03 0.00 0.00 46.19 44.93 2fqh s LEU 82 CO -0.05 -0.06 -0.01 -0.22 0.23 0.00 0.00 176.35 176.24 2fqh s LEU 83 N 1.51 3.87 -0.15 1.79 0.20 -1.26 -1.36 118.68 123.28 2fqh s LEU 83 Ca 0.05 -1.28 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 -0.26 -0.14 -0.75 -0.29 0.00 0.00 176.35 174.81 2fqh s LYS 84 N 1.24 2.23 -0.27 1.98 2.36 -1.01 -5.07 119.74 121.22 2fqh s LYS 84 Ca -0.05 -0.53 -0.02 0.00 -2.55 0.00 0.00 55.97 52.82 2fqh s LYS 84 Cb -0.20 -2.06 0.03 0.00 -1.05 0.00 0.00 37.83 34.55 2fqh s LYS 84 CO -0.01 -0.24 -0.04 1.21 1.55 0.00 0.00 175.35 177.82 2fqh s ASN 85 N 1.50 4.51 -0.22 1.43 3.84 -1.26 -3.82 114.94 120.92 2fqh s ASN 85 Ca 0.05 -1.01 0.00 0.00 0.21 0.00 0.00 52.86 52.11 2fqh s ASN 85 Cb -0.13 -1.68 0.03 0.00 -0.55 0.00 0.00 41.25 38.92 2fqh s ASN 85 CO -0.10 -0.17 -0.12 -0.83 -2.79 0.00 0.00 177.10 173.08 2fqh s GLY 86 N 1.30 1.55 -0.14 1.21 0.00 -1.26 -5.04 107.32 104.93 2fqh s GLY 86 Ca -0.02 -1.43 0.00 0.00 0.00 0.00 0.00 44.72 43.28 2fqh s GLY 86 CO -0.03 0.45 -0.13 1.85 0.00 0.00 0.00 173.10 175.23 2fqh s GLU 87 N 1.27 2.21 0.00 2.90 -6.30 -1.26 -4.52 118.70 113.01 2fqh s GLU 87 Ca 0.00 -0.52 -0.10 0.00 -2.50 0.00 0.00 54.97 51.84 2fqh s GLU 87 Cb -0.16 -2.05 0.01 0.00 0.00 0.00 0.00 34.13 31.93 2fqh s GLU 87 CO -0.08 -0.24 0.21 0.34 0.02 0.00 0.00 175.26 175.51 2fqh s ASP 88 N 1.51 -0.06 -0.23 -1.70 2.15 -1.26 -5.08 116.67 112.00 2fqh s ASP 88 Ca 0.05 -0.11 -0.01 0.00 0.43 0.00 0.00 52.55 52.91 2fqh s ASP 88 Cb -0.13 0.25 0.02 0.00 -0.30 0.00 0.00 42.92 42.77 2fqh s ASP 88 CO -0.10 -0.42 -0.09 -0.13 -0.17 0.00 0.00 175.17 174.25 2fqh s ARG 89 N -1.50 2.88 0.19 4.34 0.52 -1.26 -4.93 118.95 119.20 2fqh s ARG 89 Ca -0.13 -0.94 0.09 0.00 -0.52 0.00 0.00 55.73 54.23 2fqh s ARG 89 Cb -0.06 -2.89 -0.04 0.00 0.52 0.00 0.00 34.95 32.48 2fqh s ARG 89 CO 0.02 -0.35 -0.19 -0.51 0.02 0.00 0.00 175.30 174.29 2fqh s LEU 90 N 1.31 2.48 0.00 2.53 1.43 -1.26 -5.01 118.68 120.16 2fqh s LEU 90 Ca 0.01 -0.91 0.29 0.00 -1.03 0.00 0.00 54.13 52.49 2fqh s LEU 90 Cb -0.16 -0.91 1.45 0.00 0.03 0.00 0.00 46.19 46.60 2fqh s LEU 90 CO -0.06 -0.01 2.01 0.54 0.23 0.00 0.00 176.35 179.05 2fqh n ARG 91 N 0.05 0.35 0.07 1.70 3.00 -1.26 -3.18 116.66 117.39 2fqh n ARG 91 Ca -0.11 0.01 -0.09 0.00 -0.01 0.00 0.00 57.85 57.64 2fqh n ARG 91 Cb 0.58 -1.50 0.01 0.00 0.00 0.00 0.00 32.46 31.55 2fqh n ARG 91 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.63 178.37 2fqh h PHE 92 N 0.00 0.41 -3.71 -1.55 0.04 -2.03 -3.45 116.94 106.65 2fqh h PHE 92 Ca 0.00 -0.21 -0.49 0.00 2.80 0.00 0.00 57.97 60.07 2fqh h PHE 92 Cb 0.32 -0.05 0.04 0.00 2.20 0.00 0.00 35.95 38.45 2fqh h PHE 92 CO 0.00 0.99 0.16 0.71 -0.60 0.00 0.00 178.31 179.57 2fqh s TYR 93 N -3.38 3.56 -0.11 -0.55 1.51 -1.19 -5.01 117.35 112.18 2fqh s TYR 93 Ca -0.04 0.92 0.04 0.00 -1.01 0.00 0.00 57.07 56.98 2fqh s TYR 93 Cb 0.10 -2.38 -0.10 0.00 -0.11 0.00 0.00 41.96 39.47 2fqh s TYR 93 CO 0.83 -0.33 -0.05 1.33 -1.11 0.00 0.00 175.55 176.23 2fqh n VAL 94 N -2.24 0.70 0.00 0.71 0.24 -1.26 -4.62 118.33 111.86 2fqh n VAL 94 Ca 0.02 -0.34 -0.13 0.00 -2.04 0.00 0.00 64.34 61.85 2fqh n VAL 94 Cb 0.55 -0.86 -0.14 0.00 -1.47 0.00 0.00 33.84 31.92 2fqh n VAL 94 CO 0.00 0.00 0.00 0.50 -2.14 0.00 0.00 176.83 175.19 2fqh h LYS 95 N 0.00 0.11 -6.76 7.34 3.64 -1.96 -3.48 116.57 115.46 2fqh h LYS 95 Ca -0.27 -0.19 -0.51 0.00 -1.27 0.00 0.00 60.65 58.41 2fqh h LYS 95 Cb 1.51 0.07 -0.15 0.00 -0.41 0.00 0.00 32.23 33.24 2fqh h LYS 95 CO -0.02 0.80 -0.80 1.97 -2.27 0.00 0.00 179.45 179.13 2fqh n PHE 96 N -3.24 -1.05 -2.47 1.91 -1.74 -1.26 -4.84 117.46 104.77 2fqh n PHE 96 Ca -0.20 0.45 -0.38 0.00 -0.56 0.00 0.00 57.45 56.75 2fqh n PHE 96 Cb 1.05 -2.30 -0.04 0.00 1.52 0.00 0.00 39.48 39.70 2fqh n PHE 96 CO 0.00 0.00 0.00 0.20 -0.56 0.00 0.00 176.76 176.40 2fqh s GLY 97 N -4.10 2.87 -1.19 4.97 0.00 -1.26 -4.92 107.32 103.68 2fqh s GLY 97 Ca 0.05 0.81 -0.19 0.00 0.00 0.00 0.00 44.72 45.39 2fqh s GLY 97 CO 0.82 1.31 1.93 -1.55 0.00 0.00 0.00 173.10 175.61 2fqh n PRO 98 N 0.35 2.31 -1.43 2.90 -0.04 -1.26 -4.90 135.00 132.94 2fqh n PRO 98 Ca 0.03 -2.62 -0.46 0.00 -0.04 0.00 0.00 63.50 60.40 2fqh n PRO 98 Cb 0.47 -3.41 -0.13 0.00 -0.04 0.00 0.00 33.50 30.40 2fqh n PRO 98 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2fqh n GLY 99 N 5.09 -0.29 3.80 0.55 0.00 -1.26 -4.88 105.19 108.20 2fqh n GLY 99 Ca 0.48 1.10 -0.23 0.00 0.00 0.00 0.00 46.02 47.38 2fqh n GLY 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fqh s ALA 100 N 8.30 3.80 0.13 4.61 0.00 -1.26 -4.40 121.76 132.94 2fqh s ALA 100 Ca 1.27 -2.00 -0.16 0.00 0.00 0.00 0.00 51.96 51.08 2fqh s ALA 100 Cb -1.22 -0.68 -0.01 0.00 0.00 0.00 0.00 23.12 21.20 2fqh s ALA 100 CO 0.52 -0.18 1.69 0.28 0.00 0.00 0.00 175.76 178.07 2fqh h VAL 101 N 1.25 1.19 -0.85 0.00 2.07 -1.92 -0.64 116.25 117.35 2fqh h VAL 101 Ca -0.42 -0.56 0.04 0.00 0.82 0.00 0.00 66.70 66.58 2fqh h VAL 101 Cb 1.26 0.83 -0.05 0.00 -1.52 0.00 0.00 31.29 31.81 2fqh h VAL 101 CO 0.64 0.21 0.56 0.40 0.02 0.00 0.00 177.57 179.39 2fqh h ILE 102 N 0.49 1.12 -0.18 4.57 1.08 -1.98 -1.68 117.51 120.93 2fqh h ILE 102 Ca 0.13 -0.35 -0.01 0.00 -0.39 0.00 0.00 64.86 64.24 2fqh h ILE 102 Cb 0.17 0.00 -0.01 0.00 -3.07 0.00 0.00 36.82 33.91 2fqh h ILE 102 CO -0.01 0.19 0.06 0.11 -0.69 0.00 0.00 178.15 177.80 2fqh h LYS 103 N 1.02 0.28 -0.85 2.37 1.79 -1.77 -2.79 116.57 116.62 2fqh h LYS 103 Ca 0.34 -0.06 0.22 0.00 -2.18 0.00 0.00 60.65 58.97 2fqh h LYS 103 Cb 0.08 -0.04 -0.14 0.00 -1.58 0.00 0.00 32.23 30.55 2fqh h LYS 103 CO -0.11 0.39 0.12 0.93 -1.08 0.00 0.00 179.45 179.70 2fqh h GLU 104 N 0.12 0.14 -1.01 3.15 4.39 -0.19 0.75 114.58 121.94 2fqh h GLU 104 Ca 0.06 -0.01 0.23 0.00 0.34 0.00 0.00 59.36 59.98 2fqh h GLU 104 Cb 0.22 -0.03 -0.11 0.00 -0.10 0.00 0.00 28.75 28.73 2fqh h GLU 104 CO -0.00 0.09 0.62 0.74 -1.16 0.00 0.00 179.01 179.30 2fqh h PHE 105 N 0.14 0.92 -1.78 4.33 0.04 -1.20 0.21 116.94 119.60 2fqh h PHE 105 Ca 0.51 0.03 0.54 0.00 2.80 0.00 0.00 57.97 61.86 2fqh h PHE 105 Cb 1.00 -0.27 -0.10 0.00 2.20 0.00 0.00 35.95 38.77 2fqh h PHE 105 CO -0.35 0.13 1.24 1.17 -0.60 0.00 0.00 178.31 179.90 2fqh n LYS 106 N -4.76 -0.01 -0.55 1.51 0.00 0.26 0.15 118.16 114.75 2fqh n LYS 106 Ca 0.25 1.15 0.44 0.00 0.00 0.00 0.00 58.31 60.15 2fqh n LYS 106 Cb 0.71 -2.51 0.74 0.00 0.00 0.00 0.00 35.03 33.97 2fqh n LYS 106 CO 0.00 0.00 0.00 0.97 0.00 0.00 0.00 177.40 178.37 2fqh h ILE 107 N 0.00 0.06 0.00 3.15 6.09 -0.70 -3.28 117.51 122.83 2fqh h ILE 107 Ca 0.93 -0.01 0.00 0.00 -1.37 0.00 0.00 64.86 64.41 2fqh h ILE 107 Cb 3.48 0.03 0.00 0.00 0.47 0.00 0.00 36.82 40.80 2fqh h ILE 107 CO -0.17 0.00 -0.17 0.41 -3.07 0.00 0.00 178.15 175.15 2fqh n THR 108 N -4.37 0.01 0.00 2.19 -1.04 0.39 -5.10 114.28 106.36 2fqh n THR 108 Ca 0.40 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.42 2fqh n THR 108 Cb 1.70 -0.68 0.00 0.00 -1.82 0.00 0.00 70.33 69.52 2fqh n THR 108 CO 0.00 0.00 0.00 -0.67 -0.64 0.00 0.00 175.07 173.76