#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 1.42 -0.04 7.83 1.04 -1.26 -4.85 113.70 117.84 2fqh s SER 2 Ca 0.00 -0.24 -0.03 0.00 0.48 0.00 0.00 55.95 56.16 2fqh s SER 2 Cb 0.00 0.36 0.01 0.00 0.10 0.00 0.00 66.02 66.49 2fqh s SER 2 CO 0.00 -0.33 0.09 -1.61 0.98 0.00 0.00 173.24 172.37 2fqh s GLU 3 N 2.32 0.09 -0.26 4.02 0.41 -1.25 -3.69 118.70 120.34 2fqh s GLU 3 Ca 0.07 0.15 0.01 0.00 -0.41 0.00 0.00 54.97 54.79 2fqh s GLU 3 Cb -0.16 0.02 0.05 0.00 -1.78 0.00 0.00 34.13 32.26 2fqh s GLU 3 CO -0.12 -0.03 -0.09 0.54 -0.49 0.00 0.00 175.26 175.07 2fqh s VAL 4 N 0.20 2.40 -0.12 2.63 0.11 -1.14 -3.34 120.40 121.13 2fqh s VAL 4 Ca -0.01 -1.50 0.03 0.00 -2.93 0.00 0.00 61.98 57.56 2fqh s VAL 4 Cb -0.02 -2.37 0.01 0.00 -1.53 0.00 0.00 36.38 32.46 2fqh s VAL 4 CO -0.01 -0.00 -0.23 0.21 -3.33 0.00 0.00 175.10 171.75 2fqh s ASN 5 N 1.16 3.07 -0.10 3.54 2.47 -0.76 -3.56 114.94 120.77 2fqh s ASN 5 Ca -0.07 -0.58 -0.04 0.00 0.42 0.00 0.00 52.86 52.59 2fqh s ASN 5 Cb -0.19 -1.42 0.05 0.00 -1.45 0.00 0.00 41.25 38.24 2fqh s ASN 5 CO -0.04 0.11 0.19 -0.51 -3.72 0.00 0.00 177.10 173.12 2fqh s ILE 6 N 0.64 -0.29 -0.14 -5.21 1.10 -1.26 -3.26 121.20 112.78 2fqh s ILE 6 Ca -0.12 0.32 -0.04 0.00 -0.51 0.00 0.00 60.65 60.31 2fqh s ILE 6 Cb -0.16 -0.34 0.05 0.00 0.15 0.00 0.00 42.46 42.16 2fqh s ILE 6 CO 0.02 0.13 0.07 0.54 -2.11 0.00 0.00 174.94 173.60 2fqh s VAL 7 N 2.26 0.03 -0.12 4.00 0.11 -1.22 -4.52 120.40 120.93 2fqh s VAL 7 Ca 0.02 -0.05 -0.01 0.00 -2.93 0.00 0.00 61.98 59.00 2fqh s VAL 7 Cb -0.12 -0.53 0.03 0.00 -1.53 0.00 0.00 36.38 34.23 2fqh s VAL 7 CO -0.07 -0.12 -0.03 -0.69 -3.33 0.00 0.00 175.10 170.86 2fqh s VAL 8 N 2.10 0.76 -0.15 2.04 1.01 -1.26 -3.15 120.40 121.75 2fqh s VAL 8 Ca 0.03 -0.26 -0.00 0.00 0.00 0.00 0.00 61.98 61.75 2fqh s VAL 8 Cb -0.15 -0.92 -0.01 0.00 0.00 0.00 0.00 36.38 35.30 2fqh s VAL 8 CO -0.07 0.21 -0.14 0.21 0.00 0.00 0.00 175.10 175.31 2fqh s ASN 9 N 1.80 3.84 -1.06 3.32 3.84 -1.26 -4.64 114.94 120.78 2fqh s ASN 9 Ca 0.03 -0.41 -0.00 0.00 0.21 0.00 0.00 52.86 52.69 2fqh s ASN 9 Cb -0.14 -1.60 0.00 0.00 -0.55 0.00 0.00 41.25 38.97 2fqh s ASN 9 CO -0.07 0.10 0.88 0.61 -2.79 0.00 0.00 177.10 175.84 2fqh n GLY 10 N 3.93 -0.27 3.99 1.21 0.00 -1.26 -3.16 105.19 109.64 2fqh n GLY 10 Ca -0.19 0.03 -0.34 0.00 0.00 0.00 0.00 46.02 45.53 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 -3.76 -0.44 -3.87 1.61 1.85 -1.26 -4.87 116.66 105.91 2fqh n ARG 11 Ca -0.25 -0.12 -0.35 0.00 -1.00 0.00 0.00 57.85 56.13 2fqh n ARG 11 Cb 0.65 -1.43 -0.10 0.00 -1.05 0.00 0.00 32.46 30.53 2fqh n ARG 11 CO 0.00 0.00 0.00 -2.00 -0.01 0.00 0.00 177.63 175.62 2fqh s GLU 12 N -6.78 4.01 0.02 2.89 -6.30 -1.19 -5.08 118.70 106.27 2fqh s GLU 12 Ca 0.35 -0.32 -0.14 0.00 -2.50 0.00 0.00 54.97 52.37 2fqh s GLU 12 Cb -0.20 -3.32 0.02 0.00 0.00 0.00 0.00 34.13 30.63 2fqh s GLU 12 CO 0.69 0.21 0.30 0.00 0.02 0.00 0.00 175.26 176.47 2fqh s ALA 13 N 0.58 -0.69 -0.37 6.30 0.00 -1.26 -4.72 121.76 121.59 2fqh s ALA 13 Ca 0.05 0.10 0.11 0.00 0.00 0.00 0.00 51.96 52.22 2fqh s ALA 13 Cb -0.12 0.23 0.40 0.00 0.00 0.00 0.00 23.12 23.62 2fqh s ALA 13 CO 0.01 -0.35 1.45 0.41 0.00 0.00 0.00 175.76 177.28 2fqh n GLY 14 N 0.85 1.70 3.39 0.00 0.00 -1.26 -5.14 105.19 104.73 2fqh n GLY 14 Ca -0.20 -0.16 -0.18 0.00 0.00 0.00 0.00 46.02 45.48 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 -1.08 -1.05 0.00 1.61 3.41 -1.26 -5.00 113.62 110.24 2fqh n SER 15 Ca -0.10 -3.12 0.07 0.00 -0.26 0.00 0.00 58.87 55.46 2fqh n SER 15 Cb 0.86 2.15 0.37 0.00 -0.26 0.00 0.00 64.21 67.34 2fqh n SER 15 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 2fqh n LYS 16 N -0.63 0.16 -0.51 4.33 4.81 -1.26 -3.32 118.16 121.74 2fqh n LYS 16 Ca 0.05 0.17 0.44 0.00 -0.87 0.00 0.00 58.31 58.09 2fqh n LYS 16 Cb 0.61 -1.50 0.69 0.00 0.02 0.00 0.00 35.03 34.86 2fqh n LYS 16 CO 0.00 0.00 0.00 0.77 1.17 0.00 0.00 177.40 179.34 2fqh h SER 17 N 0.00 0.00 -0.32 3.14 0.02 -1.95 1.81 113.55 116.25 2fqh h SER 17 Ca 0.00 0.00 0.09 0.00 -0.84 0.00 0.00 61.79 61.04 2fqh h SER 17 Cb 0.17 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.70 2fqh h SER 17 CO 0.00 0.00 0.54 0.11 -1.14 0.00 0.00 176.83 176.34 2fqh h LYS 18 N 0.00 0.00 0.00 3.45 1.57 -1.79 -3.07 116.57 116.73 2fqh h LYS 18 Ca 0.76 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.54 2fqh h LYS 18 Cb 3.38 0.00 0.00 0.00 0.08 0.00 0.00 32.23 35.69 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 -1.43 -1.17 3.99 3.86 0.00 0.62 -4.29 105.19 106.77 2fqh n GLY 19 Ca 0.06 -1.64 -0.19 0.00 0.00 0.00 0.00 46.02 44.24 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 0.30 1.51 0.00 0.00 0.00 -1.86 -3.18 119.26 116.04 2fqh h ALA 21 Ca -0.40 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 54.36 2fqh h ALA 21 Cb 1.29 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.95 2fqh h ALA 21 CO 0.48 0.36 -0.09 -0.07 0.00 0.00 0.00 179.25 179.93 2fqh h LEU 22 N 0.43 0.00 -8.42 0.00 3.38 -1.94 -3.50 115.31 105.26 2fqh h LEU 22 Ca 0.10 -0.02 -0.20 0.00 0.09 0.00 0.00 57.88 57.85 2fqh h LEU 22 Cb 0.23 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 40.89 2fqh h LEU 22 CO 0.00 0.56 -0.18 0.00 0.09 0.00 0.00 178.44 178.91 2fqh s GLY 24 N -3.16 1.92 -0.04 0.00 0.00 -1.26 0.20 107.32 104.98 2fqh s GLY 24 Ca 0.28 -1.09 -0.09 0.00 0.00 0.00 0.00 44.72 43.82 2fqh s GLY 24 CO 0.16 0.76 -0.18 0.00 0.00 0.00 0.00 173.10 173.84 2fqh n ALA 25 N 5.14 1.92 -2.54 3.20 0.00 -1.26 -4.87 120.51 122.10 2fqh n ALA 25 Ca -0.12 -0.42 -0.24 0.00 0.00 0.00 0.00 53.44 52.66 2fqh n ALA 25 Cb 0.51 0.14 -0.09 0.00 0.00 0.00 0.00 19.45 20.01 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 -2.46 2.69 -0.03 0.00 2.01 -1.26 -5.08 115.64 111.51 2fqh s THR 26 Ca -0.15 -2.09 -0.01 0.00 0.31 0.00 0.00 61.69 59.75 2fqh s THR 26 Cb 0.02 -2.67 0.03 0.00 0.01 0.00 0.00 72.50 69.89 2fqh s THR 26 CO 0.22 -0.28 0.03 -1.66 -0.69 0.00 0.00 174.62 172.24 2fqh s TRP 27 N -2.49 0.14 -0.21 4.92 -2.14 -1.26 -3.90 118.94 114.00 2fqh s TRP 27 Ca 0.33 0.12 -0.27 0.00 2.66 0.00 0.00 56.10 58.93 2fqh s TRP 27 Cb -0.02 -0.38 0.10 0.00 -3.10 0.00 0.00 33.47 30.07 2fqh s TRP 27 CO 0.18 -0.14 0.87 0.20 -2.66 0.00 0.00 176.95 175.40 2fqh s GLY 28 N 1.41 -0.36 0.11 3.67 0.00 -1.26 -5.02 107.32 105.86 2fqh s GLY 28 Ca -0.05 2.13 0.24 0.00 0.00 0.00 0.00 44.72 47.04 2fqh s GLY 28 CO -0.03 1.51 1.24 1.22 0.00 0.00 0.00 173.10 177.04 2fqh n ASP 29 N 1.84 0.68 0.00 1.64 9.92 -1.26 -3.59 116.55 125.79 2fqh n ASP 29 Ca -0.14 0.05 0.16 0.00 -0.53 0.00 0.00 54.79 54.34 2fqh n ASP 29 Cb 0.56 0.32 0.94 0.00 -0.64 0.00 0.00 41.12 42.30 2fqh n ASP 29 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2fqh n TYR 30 N -2.09 0.00 -2.59 1.24 9.36 -1.26 -4.81 117.16 117.00 2fqh n TYR 30 Ca 0.03 0.00 -0.23 0.00 3.32 0.00 0.00 57.90 61.02 2fqh n TYR 30 Cb 0.44 -0.01 0.09 0.00 -0.63 0.00 0.00 39.34 39.24 2fqh n TYR 30 CO 0.00 0.00 0.00 -1.01 0.22 0.00 0.00 176.86 176.07 2fqh s HIS 31 N -2.01 1.84 -0.15 2.98 3.76 -1.24 -5.09 115.29 115.38 2fqh s HIS 31 Ca 0.47 -0.22 -0.05 0.00 -0.15 0.00 0.00 55.06 55.12 2fqh s HIS 31 Cb 0.22 -2.94 -0.03 0.00 1.11 0.00 0.00 32.58 30.94 2fqh s HIS 31 CO 0.37 -1.55 0.01 0.00 -0.85 0.00 0.00 174.74 172.72 2fqh s ALA 32 N -3.07 3.22 0.09 -1.40 0.00 -1.26 -5.09 121.76 114.24 2fqh s ALA 32 Ca 0.64 -0.79 0.03 0.00 0.00 0.00 0.00 51.96 51.84 2fqh s ALA 32 Cb -0.06 -1.67 -0.04 0.00 0.00 0.00 0.00 23.12 21.34 2fqh s ALA 32 CO 0.43 0.29 0.12 -0.51 0.00 0.00 0.00 175.76 176.09 2fqh s ASP 33 N 0.09 5.75 0.41 0.00 1.01 -1.26 -3.85 116.67 118.82 2fqh s ASP 33 Ca 0.02 0.05 0.05 0.00 0.71 0.00 0.00 52.55 53.38 2fqh s ASP 33 Cb -0.13 -1.60 -0.06 0.00 1.01 0.00 0.00 42.92 42.14 2fqh s ASP 33 CO 0.02 0.15 0.03 -0.36 0.21 0.00 0.00 175.17 175.22 2fqh s PHE 34 N -1.47 2.24 0.64 4.23 0.08 -1.16 -4.31 117.98 118.23 2fqh s PHE 34 Ca 0.31 -0.82 0.27 0.00 0.12 0.00 0.00 56.93 56.81 2fqh s PHE 34 Cb -0.12 -1.61 1.41 0.00 -0.57 0.00 0.00 43.02 42.13 2fqh s PHE 34 CO 0.24 0.27 1.81 1.37 -0.10 0.00 0.00 175.22 178.81 2fqh h LEU 35 N 1.77 0.00 -0.62 -0.37 -0.00 -1.94 1.39 115.31 115.54 2fqh h LEU 35 Ca -0.43 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.45 2fqh h LEU 35 Cb 1.26 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.92 2fqh h LEU 35 CO 0.76 0.00 0.00 0.61 -0.00 0.00 0.00 178.44 179.81 2fqh n GLY 36 N -1.36 0.10 4.25 0.17 0.00 -1.26 -4.88 105.19 102.21 2fqh n GLY 36 Ca 0.02 -0.10 -0.33 0.00 0.00 0.00 0.00 46.02 45.62 2fqh n GLY 36 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2fqh n GLU 37 N -0.15 -0.83 -4.22 1.61 0.28 0.48 -4.84 120.64 112.97 2fqh n GLU 37 Ca 0.03 0.08 -0.13 0.00 -0.16 0.00 0.00 57.16 56.98 2fqh n GLU 37 Cb 0.16 -3.32 -0.10 0.00 1.43 0.00 0.00 31.44 29.62 2fqh n GLU 37 CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 177.13 176.46 2fqh s ASP 38 N -4.24 0.32 -0.22 -1.84 -0.00 -1.24 -4.04 116.67 105.42 2fqh s ASP 38 Ca 0.07 -1.41 -0.02 0.00 -0.00 0.00 0.00 52.55 51.20 2fqh s ASP 38 Cb -0.04 0.37 0.01 0.00 -0.00 0.00 0.00 42.92 43.26 2fqh s ASP 38 CO 0.97 -0.84 -0.09 -0.76 -0.00 0.00 0.00 175.17 174.45 2fqh s LEU 39 N -3.19 2.82 -0.22 1.23 1.02 0.97 -2.97 118.68 118.34 2fqh s LEU 39 Ca 0.39 -0.67 0.15 0.00 0.02 0.00 0.00 54.13 54.02 2fqh s LEU 39 Cb 0.07 -1.64 0.69 0.00 0.02 0.00 0.00 46.19 45.33 2fqh s LEU 39 CO 0.13 -0.06 1.62 2.22 0.02 0.00 0.00 176.35 180.27 2fqh n PHE 40 N 4.69 1.63 0.52 0.29 -1.74 -1.25 -4.20 117.46 117.40 2fqh n PHE 40 Ca -0.18 -0.86 0.06 0.00 -0.56 0.00 0.00 57.45 55.91 2fqh n PHE 40 Cb 0.49 -0.45 0.05 0.00 1.52 0.00 0.00 39.48 41.09 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 0.02 0.00 -0.10 2.97 -0.00 -1.26 -3.56 117.46 115.52 2fqh n PHE 41 Ca 0.27 0.00 -0.16 0.00 -0.00 0.00 0.00 57.45 57.55 2fqh n PHE 41 Cb 1.09 0.00 -0.06 0.00 -0.00 0.00 0.00 39.48 40.51 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 -3.69 -5.09 -0.05 0.00 5.68 -1.23 -4.75 116.55 107.41 2fqh n ASP 44 Ca -0.23 0.27 -0.06 0.00 -0.50 0.00 0.00 54.79 54.27 2fqh n ASP 44 Cb 0.61 -3.89 -0.02 0.00 -1.14 0.00 0.00 41.12 36.68 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 -2.05 1.13 0.92 2.12 -0.00 -1.26 -4.63 119.36 115.60 2fqh n ILE 45 Ca -0.11 0.24 0.12 0.00 -0.00 0.00 0.00 62.75 62.99 2fqh n ILE 45 Cb 0.54 -2.04 0.18 0.00 -0.00 0.00 0.00 39.64 38.32 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 -3.03 4.22 -0.05 0.00 0.00 -1.26 -4.59 121.76 117.05 2fqh s ALA 47 Ca 0.10 -1.44 -0.00 0.00 0.00 0.00 0.00 51.96 50.61 2fqh s ALA 47 Cb 0.17 -1.68 -0.00 0.00 0.00 0.00 0.00 23.12 21.60 2fqh s ALA 47 CO 0.73 -0.01 0.05 0.00 0.00 0.00 0.00 175.76 176.53 2fqh n ALA 48 N -1.62 -1.09 -2.41 0.00 0.00 -1.26 -4.59 120.51 109.53 2fqh n ALA 48 Ca -0.01 0.00 -0.40 0.00 0.00 0.00 0.00 53.44 53.04 2fqh n ALA 48 Cb 0.58 -0.46 -0.05 0.00 0.00 0.00 0.00 19.45 19.52 2fqh n ALA 48 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 2fqh s GLU 49 N -3.04 4.51 0.00 0.00 2.56 -1.26 -4.93 118.70 116.54 2fqh s GLU 49 Ca 0.01 1.09 0.25 0.00 0.00 0.00 0.00 54.97 56.32 2fqh s GLU 49 Cb -0.00 -3.37 1.48 0.00 2.00 0.00 0.00 34.13 34.24 2fqh s GLU 49 CO 0.05 0.26 1.88 1.19 -0.56 0.00 0.00 175.26 178.08 2fqh n PHE 50 N 2.88 0.00 0.20 5.30 3.72 -1.26 -3.58 117.46 124.72 2fqh n PHE 50 Ca -0.02 0.00 0.18 0.00 -0.05 0.00 0.00 57.45 57.56 2fqh n PHE 50 Cb 0.50 0.00 0.81 0.00 -0.94 0.00 0.00 39.48 39.85 2fqh n PHE 50 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2fqh h MET 51 N 0.00 0.00 0.00 -1.08 -0.00 -1.96 -3.41 114.93 108.48 2fqh h MET 51 Ca 0.00 0.00 -0.32 0.00 -0.00 0.00 0.00 59.70 59.38 2fqh h MET 51 Cb 0.00 0.00 0.06 0.00 -0.00 0.00 0.00 31.60 31.66 2fqh h MET 51 CO 0.00 0.00 0.08 0.09 -0.00 0.00 0.00 176.91 177.08 2fqh n ASN 52 N -3.46 0.92 -4.92 -0.10 3.02 -1.24 -4.85 115.26 104.63 2fqh n ASN 52 Ca 0.03 -1.77 -0.27 0.00 -0.03 0.00 0.00 54.58 52.54 2fqh n ASN 52 Cb 0.45 -0.44 0.05 0.00 -0.61 0.00 0.00 39.78 39.23 2fqh n ASN 52 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 2fqh s MET 53 N -4.24 2.66 0.05 3.52 -1.94 -1.26 -5.00 119.30 113.09 2fqh s MET 53 Ca 0.45 -0.04 -0.22 0.00 -1.71 0.00 0.00 55.69 54.17 2fqh s MET 53 Cb -0.03 -2.21 -0.14 0.00 2.01 0.00 0.00 34.83 34.47 2fqh s MET 53 CO 0.30 -0.92 1.53 1.98 -0.01 0.00 0.00 175.02 177.89 2fqh h MET 54 N -0.37 0.16 -1.04 2.03 4.05 -1.99 -2.70 114.93 115.07 2fqh h MET 54 Ca -0.45 -0.04 0.27 0.00 -0.28 0.00 0.00 59.70 59.20 2fqh h MET 54 Cb 1.28 -0.02 -0.11 0.00 -0.80 0.00 0.00 31.60 31.95 2fqh h MET 54 CO 0.61 0.36 0.64 -0.44 0.23 0.00 0.00 176.91 178.31 2fqh h ASP 55 N -0.07 0.54 -0.64 1.39 3.45 -1.98 0.94 116.42 120.05 2fqh h ASP 55 Ca 0.03 0.12 0.11 0.00 0.43 0.00 0.00 57.03 57.72 2fqh h ASP 55 Cb 0.27 0.03 -0.12 0.00 -0.56 0.00 0.00 39.33 38.96 2fqh h ASP 55 CO 0.00 0.07 -0.33 -0.33 -1.57 0.00 0.00 179.24 177.08 2fqh h GLU 56 N 0.46 -0.13 -0.35 3.56 4.39 -1.87 0.78 114.58 121.41 2fqh h GLU 56 Ca 0.64 0.01 -0.06 0.00 0.34 0.00 0.00 59.36 60.28 2fqh h GLU 56 Cb 1.45 0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 30.11 2fqh h GLU 56 CO -0.40 -0.09 -0.05 0.00 -1.16 0.00 0.00 179.01 177.31 2fqh h ALA 57 N 1.07 1.25 -0.49 3.43 0.00 -0.93 -2.26 119.26 121.33 2fqh h ALA 57 Ca 0.25 -0.25 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 2fqh h ALA 57 Cb 0.55 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.17 2fqh h ALA 57 CO -0.72 0.49 0.20 0.35 0.00 0.00 0.00 179.25 179.57 2fqh h PHE 58 N 0.54 0.70 -1.06 0.00 3.04 0.83 -2.16 116.94 118.83 2fqh h PHE 58 Ca 0.11 -0.03 0.31 0.00 3.98 0.00 0.00 57.97 62.34 2fqh h PHE 58 Cb 0.43 -0.22 -0.13 0.00 2.56 0.00 0.00 35.95 38.59 2fqh h PHE 58 CO 0.02 0.55 0.64 -0.22 -2.02 0.00 0.00 178.31 177.28 2fqh h LYS 59 N 0.70 0.34 0.36 1.11 1.63 0.76 0.51 116.57 121.99 2fqh h LYS 59 Ca 0.17 -0.02 -0.01 0.00 -0.85 0.00 0.00 60.65 59.94 2fqh h LYS 59 Cb 0.14 -0.08 -0.00 0.00 -0.60 0.00 0.00 32.23 31.69 2fqh h LYS 59 CO -0.02 0.22 -0.21 1.25 -3.45 0.00 0.00 179.45 177.24 2fqh h HIS 60 N 0.35 -0.56 -0.44 1.91 2.76 -1.50 0.32 115.15 117.99 2fqh h HIS 60 Ca 0.70 -0.01 -0.02 0.00 -2.20 0.00 0.00 60.37 58.84 2fqh h HIS 60 Cb 1.70 0.20 -0.02 0.00 1.55 0.00 0.00 27.41 30.84 2fqh h HIS 60 CO -0.01 -0.33 0.18 1.15 -1.30 0.00 0.00 177.93 177.63 2fqh h THR 61 N -0.54 1.16 0.43 6.26 2.02 -0.35 0.81 112.91 122.70 2fqh h THR 61 Ca -0.04 -0.50 -0.02 0.00 0.77 0.00 0.00 66.41 66.62 2fqh h THR 61 Cb 0.44 0.63 0.00 0.00 -1.74 0.00 0.00 68.15 67.49 2fqh h THR 61 CO 0.04 0.20 -0.21 0.00 0.37 0.00 0.00 175.52 175.93 2fqh h ALA 62 N 1.58 -0.58 0.00 6.16 0.00 0.35 -2.00 119.26 124.77 2fqh h ALA 62 Ca 0.15 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2fqh h ALA 62 Cb 0.11 0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.13 2fqh h ALA 62 CO -0.02 -0.74 0.00 2.89 0.00 0.00 0.00 179.25 181.38 2fqh n ARG 63 N -5.27 0.88 -0.03 0.00 -4.01 0.11 -1.99 116.66 106.34 2fqh n ARG 63 Ca -0.11 0.00 -0.07 0.00 -1.04 0.00 0.00 57.85 56.63 2fqh n ARG 63 Cb 0.28 -1.03 -0.06 0.00 -3.04 0.00 0.00 32.46 28.61 2fqh n ARG 63 CO 0.00 0.00 0.00 1.25 -3.04 0.00 0.00 177.63 175.84 2fqh h HIS 64 N 0.00 -0.05 0.00 2.89 2.76 -0.05 -3.39 115.15 117.31 2fqh h HIS 64 Ca 0.00 -0.00 -0.07 0.00 -2.20 0.00 0.00 60.37 58.10 2fqh h HIS 64 Cb 0.00 0.02 -0.01 0.00 1.55 0.00 0.00 27.41 28.96 2fqh h HIS 64 CO 0.00 0.41 -0.94 0.27 -1.30 0.00 0.00 177.93 176.37 2fqh n ASN 65 N -4.75 0.86 -0.82 3.26 0.23 -1.22 -4.97 115.26 107.85 2fqh n ASN 65 Ca -0.05 0.13 0.00 0.00 -0.53 0.00 0.00 54.58 54.13 2fqh n ASN 65 Cb 0.23 -0.31 0.00 0.00 -2.08 0.00 0.00 39.78 37.62 2fqh n ASN 65 CO 0.00 0.00 0.00 1.33 -0.93 0.00 0.00 177.26 177.66 2fqh n VAL 66 N -3.51 0.00 -4.13 3.53 0.24 -0.84 -5.07 118.33 108.55 2fqh n VAL 66 Ca -0.10 0.00 -0.19 0.00 -2.04 0.00 0.00 64.34 62.01 2fqh n VAL 66 Cb 0.41 -1.25 -0.16 0.00 -1.47 0.00 0.00 33.84 31.36 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 0.81 -0.07 -1.34 -4.77 -1.18 -3.66 116.67 105.47 2fqh s ASP 67 Ca 0.00 -0.11 -0.06 0.00 -3.30 0.00 0.00 52.55 49.08 2fqh s ASP 67 Cb 0.00 -0.40 0.02 0.00 -1.09 0.00 0.00 42.92 41.45 2fqh s ASP 67 CO 0.00 -0.06 0.18 -0.70 0.70 0.00 0.00 175.17 175.29 2fqh s GLU 68 N 0.89 0.21 -0.04 2.11 -6.30 -1.26 -4.96 118.70 109.36 2fqh s GLU 68 Ca -0.11 0.25 0.01 0.00 -2.50 0.00 0.00 54.97 52.61 2fqh s GLU 68 Cb -0.14 0.10 0.02 0.00 0.00 0.00 0.00 34.13 34.11 2fqh s GLU 68 CO -0.00 -0.03 -0.04 -0.48 0.02 0.00 0.00 175.26 174.74 2fqh s LEU 69 N 0.09 1.33 -0.07 2.70 -0.00 -1.26 -4.77 118.68 116.70 2fqh s LEU 69 Ca -0.00 -0.11 -0.06 0.00 -0.00 0.00 0.00 54.13 53.96 2fqh s LEU 69 Cb -0.01 -0.40 0.02 0.00 -0.00 0.00 0.00 46.19 45.79 2fqh s LEU 69 CO 0.00 -0.06 0.18 -2.28 -0.00 0.00 0.00 176.35 174.19 2fqh s HIS 70 N 0.89 -0.20 -0.04 3.48 2.46 -1.26 -4.92 115.29 115.71 2fqh s HIS 70 Ca -0.11 0.48 0.01 0.00 0.47 0.00 0.00 55.06 55.90 2fqh s HIS 70 Cb -0.14 0.07 0.02 0.00 -0.13 0.00 0.00 32.58 32.40 2fqh s HIS 70 CO -0.00 -0.09 -0.04 0.42 -2.47 0.00 0.00 174.74 172.56 2fqh s ILE 71 N 0.09 0.46 -0.07 0.89 1.01 -1.26 -4.44 121.20 117.89 2fqh s ILE 71 Ca -0.00 -0.08 -0.06 0.00 0.00 0.00 0.00 60.65 60.50 2fqh s ILE 71 Cb -0.01 -0.50 0.02 0.00 0.01 0.00 0.00 42.46 41.98 2fqh s ILE 71 CO 0.00 0.21 0.18 -1.81 0.00 0.00 0.00 174.94 173.52 2fqh s ASP 72 N 0.90 -0.19 -0.04 3.58 1.11 -1.23 -5.00 116.67 115.80 2fqh s ASP 72 Ca -0.11 0.36 0.01 0.00 0.18 0.00 0.00 52.55 52.99 2fqh s ASP 72 Cb -0.14 0.37 0.02 0.00 1.07 0.00 0.00 42.92 44.24 2fqh s ASP 72 CO -0.00 -0.06 -0.04 -0.83 1.18 0.00 0.00 175.17 175.42 2fqh s GLY 73 N 0.12 0.41 -0.07 0.21 0.00 -1.26 -2.88 107.32 103.84 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 0.45 0.18 -1.31 0.00 0.00 0.00 173.10 172.42 2fqh s ASN 74 N 0.90 -0.18 0.28 1.64 -0.87 -1.24 -4.97 114.94 110.49 2fqh s ASN 74 Ca -0.11 0.36 0.20 0.00 -1.57 0.00 0.00 52.86 51.73 2fqh s ASN 74 Cb -0.14 0.36 1.03 0.00 -0.02 0.00 0.00 41.25 42.48 2fqh s ASN 74 CO -0.00 -0.06 1.61 -1.22 -2.57 0.00 0.00 177.10 174.85 2fqh n TYR 75 N 2.98 0.67 0.55 2.20 4.02 -1.26 -0.13 117.16 126.19 2fqh n TYR 75 Ca -0.13 0.33 0.11 0.00 -0.01 0.00 0.00 57.90 58.21 2fqh n TYR 75 Cb 0.59 -1.03 -0.06 0.00 -0.02 0.00 0.00 39.34 38.81 2fqh n TYR 75 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 176.86 176.89 2fqh n GLN 76 N -2.17 0.30 -0.28 -0.72 1.13 -1.26 -4.30 117.38 110.08 2fqh n GLN 76 Ca -0.01 -0.05 0.09 0.00 -1.94 0.00 0.00 57.00 55.10 2fqh n GLN 76 Cb 0.06 -1.55 0.23 0.00 0.11 0.00 0.00 30.24 29.09 2fqh n GLN 76 CO 0.00 0.00 0.00 1.25 -1.44 0.00 0.00 177.06 176.87 2fqh h LEU 77 N 0.00 -0.14 0.00 1.08 6.46 -0.92 -3.44 115.31 118.34 2fqh h LEU 77 Ca 0.00 0.19 0.00 0.00 -0.12 0.00 0.00 57.88 57.95 2fqh h LEU 77 Cb 0.73 0.29 0.00 0.00 -0.73 0.00 0.00 40.66 40.95 2fqh h LEU 77 CO 0.00 -0.15 0.00 0.61 -0.62 0.00 0.00 178.44 178.28 2fqh n GLY 78 N -1.39 0.55 1.06 3.75 0.00 -1.26 -4.85 105.19 103.04 2fqh n GLY 78 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.20 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 0.00 -3.99 1.61 5.12 -1.26 -5.06 116.66 113.08 2fqh n ARG 79 Ca 0.00 0.00 -0.34 0.00 -1.93 0.00 0.00 57.85 55.58 2fqh n ARG 79 Cb 0.00 -2.08 -0.15 0.00 -1.16 0.00 0.00 32.46 29.08 2fqh n ARG 79 CO 0.00 0.00 0.00 1.21 -1.93 0.00 0.00 177.63 176.91 2fqh s ASN 80 N -2.88 3.85 -0.30 0.55 2.47 -1.26 -5.04 114.94 112.33 2fqh s ASN 80 Ca 0.00 -0.49 -0.01 0.00 0.42 0.00 0.00 52.86 52.78 2fqh s ASN 80 Cb 0.00 -1.64 0.05 0.00 -1.45 0.00 0.00 41.25 38.21 2fqh s ASN 80 CO 0.00 -0.01 -0.01 -0.69 -3.72 0.00 0.00 177.10 172.67 2fqh s VAL 81 N 1.41 2.93 -0.14 -5.21 1.01 -1.26 -3.90 120.40 115.23 2fqh s VAL 81 Ca 0.05 -1.40 0.00 0.00 0.00 0.00 0.00 61.98 60.64 2fqh s VAL 81 Cb -0.14 -2.69 0.02 0.00 0.00 0.00 0.00 36.38 33.58 2fqh s VAL 81 CO -0.07 -0.10 -0.13 -0.76 0.00 0.00 0.00 175.10 174.03 2fqh s LEU 82 N 1.24 1.63 -0.30 3.92 1.43 -1.21 -5.05 118.68 120.34 2fqh s LEU 82 Ca -0.05 -0.47 -0.02 0.00 -1.03 0.00 0.00 54.13 52.56 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 -0.01 -0.06 -0.01 -0.22 0.23 0.00 0.00 176.35 176.27 2fqh s LEU 83 N 1.51 3.84 -0.15 1.79 0.20 -1.26 -1.82 118.68 122.80 2fqh s LEU 83 Ca 0.05 -1.26 0.00 0.00 0.69 0.00 0.00 54.13 53.61 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 -0.75 -0.29 0.00 0.00 176.35 174.82 2fqh s LYS 84 N 1.25 2.23 -0.21 1.98 2.47 -1.20 -5.08 119.74 121.18 2fqh s LYS 84 Ca -0.05 -0.54 -0.02 0.00 -1.56 0.00 0.00 55.97 53.80 2fqh s LYS 84 Cb -0.20 -2.07 0.01 0.00 -1.46 0.00 0.00 37.83 34.11 2fqh s LYS 84 CO -0.01 -0.24 -0.10 0.54 0.16 0.00 0.00 175.35 175.70 2fqh s ASN 85 N 1.51 3.90 -0.21 1.43 2.20 -1.26 -3.41 114.94 119.10 2fqh s ASN 85 Ca 0.05 -0.54 -0.02 0.00 -0.94 0.00 0.00 52.86 51.41 2fqh s ASN 85 Cb -0.13 -1.64 0.00 0.00 -2.00 0.00 0.00 41.25 37.49 2fqh s ASN 85 CO -0.10 -0.03 -0.10 -0.83 -2.94 0.00 0.00 177.10 173.10 2fqh s GLY 86 N 1.39 1.53 -0.23 0.45 0.00 -1.19 -5.04 107.32 104.24 2fqh s GLY 86 Ca 0.05 -1.21 0.02 0.00 0.00 0.00 0.00 44.72 43.58 2fqh s GLY 86 CO -0.07 0.38 -0.13 -0.54 0.00 0.00 0.00 173.10 172.75 2fqh s GLU 87 N 1.40 2.35 -0.13 2.90 2.02 -1.26 -4.67 118.70 121.32 2fqh s GLU 87 Ca 0.05 -1.09 -0.11 0.00 0.02 0.00 0.00 54.97 53.84 2fqh s GLU 87 Cb -0.14 -2.69 0.03 0.00 0.10 0.00 0.00 34.13 31.43 2fqh s GLU 87 CO -0.07 -0.45 0.33 0.16 0.02 0.00 0.00 175.26 175.26 2fqh s ASP 88 N 1.23 -0.35 -0.05 -0.19 -4.77 -1.26 -5.12 116.67 106.16 2fqh s ASP 88 Ca -0.04 0.67 -0.02 0.00 -3.30 0.00 0.00 52.55 49.87 2fqh s ASP 88 Cb -0.17 0.68 0.03 0.00 -1.09 0.00 0.00 42.92 42.36 2fqh s ASP 88 CO -0.08 -0.12 0.05 0.00 0.70 0.00 0.00 175.17 175.72 2fqh s ARG 89 N 0.23 0.07 0.28 2.11 1.04 -1.26 -3.92 118.95 117.49 2fqh s ARG 89 Ca -0.00 0.32 0.02 0.00 -1.04 0.00 0.00 55.73 55.02 2fqh s ARG 89 Cb -0.03 -0.60 -0.06 0.00 -2.04 0.00 0.00 34.95 32.23 2fqh s ARG 89 CO -0.00 -0.32 0.07 -0.51 -0.04 0.00 0.00 175.30 174.51 2fqh s LEU 90 N 2.09 1.88 0.45 -1.89 2.01 -1.26 -5.03 118.68 116.93 2fqh s LEU 90 Ca 0.04 -1.37 0.24 0.00 0.01 0.00 0.00 54.13 53.06 2fqh s LEU 90 Cb -0.12 -0.15 1.03 0.00 0.01 0.00 0.00 46.19 46.96 2fqh s LEU 90 CO -0.03 -0.67 1.88 0.03 1.01 0.00 0.00 176.35 178.57 2fqh h ARG 91 N 2.30 0.00 0.00 1.70 3.08 -2.02 -2.23 114.38 117.21 2fqh h ARG 91 Ca -0.39 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.66 2fqh h ARG 91 Cb 1.24 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.29 2fqh h ARG 91 CO 0.64 0.22 0.00 0.35 -1.07 0.00 0.00 179.97 180.11 2fqh h PHE 92 N 0.00 0.00 -3.90 3.04 3.04 -2.04 -3.43 116.94 113.65 2fqh h PHE 92 Ca -0.00 0.00 -0.68 0.00 3.98 0.00 0.00 57.97 61.26 2fqh h PHE 92 Cb 0.65 0.00 -0.21 0.00 2.56 0.00 0.00 35.95 38.95 2fqh h PHE 92 CO 0.00 0.00 -0.78 0.71 -2.02 0.00 0.00 178.31 176.22 2fqh s TYR 93 N -3.53 2.66 -0.19 0.41 1.51 -0.84 -5.02 117.35 112.35 2fqh s TYR 93 Ca 0.03 -0.19 0.10 0.00 -1.01 0.00 0.00 57.07 55.99 2fqh s TYR 93 Cb 0.08 -1.52 -0.18 0.00 -0.11 0.00 0.00 41.96 40.22 2fqh s TYR 93 CO 0.57 0.27 -0.05 1.33 -1.11 0.00 0.00 175.55 176.56 2fqh n VAL 94 N 1.67 1.20 0.05 0.71 0.24 -1.26 -4.43 118.33 116.50 2fqh n VAL 94 Ca -0.16 -0.62 -0.00 0.00 -2.04 0.00 0.00 64.34 61.51 2fqh n VAL 94 Cb 0.52 -0.85 -0.07 0.00 -1.47 0.00 0.00 33.84 31.98 2fqh n VAL 94 CO 0.00 0.00 0.00 0.11 -2.14 0.00 0.00 176.83 174.80 2fqh h LYS 95 N 0.00 0.00 -6.91 7.34 6.56 -1.95 -3.49 116.57 118.13 2fqh h LYS 95 Ca -0.47 0.00 -0.58 0.00 -1.06 0.00 0.00 60.65 58.54 2fqh h LYS 95 Cb 1.93 0.00 -0.01 0.00 -0.57 0.00 0.00 32.23 33.58 2fqh h LYS 95 CO -0.02 0.36 -1.03 1.97 -2.06 0.00 0.00 179.45 178.67 2fqh n PHE 96 N -2.97 -1.52 -0.86 -1.35 -1.74 -1.26 -4.54 117.46 103.21 2fqh n PHE 96 Ca -0.08 0.23 0.11 0.00 -0.56 0.00 0.00 57.45 57.15 2fqh n PHE 96 Cb 0.84 -2.77 -0.04 0.00 1.52 0.00 0.00 39.48 39.03 2fqh n PHE 96 CO 0.00 0.00 0.00 0.41 -0.56 0.00 0.00 176.76 176.61 2fqh n GLY 97 N -2.00 -2.19 0.19 4.97 0.00 -1.25 -4.47 105.19 100.44 2fqh n GLY 97 Ca -0.16 -1.27 -0.19 0.00 0.00 0.00 0.00 46.02 44.40 2fqh n GLY 97 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2fqh h PRO 98 N -0.82 0.68 0.00 1.61 0.13 -1.86 -3.50 132.00 128.25 2fqh h PRO 98 Ca -0.04 -0.67 0.00 0.00 -0.87 0.00 0.00 66.00 64.42 2fqh h PRO 98 Cb 0.80 0.18 0.00 0.00 0.13 0.00 0.00 31.00 32.11 2fqh h PRO 98 CO 0.02 1.27 0.00 0.41 -0.23 0.00 0.00 178.00 179.47 2fqh n GLY 99 N 0.96 1.92 3.68 1.56 0.00 -1.26 -4.93 105.19 107.12 2fqh n GLY 99 Ca -0.10 -0.58 -0.30 0.00 0.00 0.00 0.00 46.02 45.04 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 -1.64 3.55 0.09 4.61 0.00 -1.26 -4.70 121.76 122.41 2fqh s ALA 100 Ca 0.00 -1.59 -0.21 0.00 0.00 0.00 0.00 51.96 50.16 2fqh s ALA 100 Cb 0.00 0.08 -0.11 0.00 0.00 0.00 0.00 23.12 23.09 2fqh s ALA 100 CO 0.00 -0.09 1.70 0.28 0.00 0.00 0.00 175.76 177.64 2fqh h VAL 101 N 1.59 1.08 -1.20 0.00 2.07 -1.97 -1.63 116.25 116.19 2fqh h VAL 101 Ca -0.44 -0.22 0.35 0.00 0.82 0.00 0.00 66.70 67.21 2fqh h VAL 101 Cb 1.27 1.02 -0.10 0.00 -1.52 0.00 0.00 31.29 31.96 2fqh h VAL 101 CO 0.78 0.07 0.79 0.16 0.02 0.00 0.00 177.57 179.39 2fqh h ILE 102 N 0.10 0.34 0.39 4.57 3.07 -2.01 0.40 117.51 124.36 2fqh h ILE 102 Ca 0.04 -0.07 -0.02 0.00 1.55 0.00 0.00 64.86 66.36 2fqh h ILE 102 Cb 0.06 0.11 0.00 0.00 -0.27 0.00 0.00 36.82 36.73 2fqh h ILE 102 CO -0.01 0.04 -0.19 0.11 -1.05 0.00 0.00 178.15 177.06 2fqh h LYS 103 N 0.21 -0.50 -1.24 0.16 1.79 -1.66 -2.71 116.57 112.61 2fqh h LYS 103 Ca 0.69 0.03 0.37 0.00 -2.18 0.00 0.00 60.65 59.56 2fqh h LYS 103 Cb 2.09 0.11 -0.10 0.00 -1.58 0.00 0.00 32.23 32.75 2fqh h LYS 103 CO -0.29 -0.21 0.82 0.93 -1.08 0.00 0.00 179.45 179.62 2fqh h GLU 104 N -0.76 0.17 -1.04 3.15 3.07 0.03 0.62 114.58 119.81 2fqh h GLU 104 Ca -0.05 -0.01 0.29 0.00 -0.50 0.00 0.00 59.36 59.08 2fqh h GLU 104 Cb 0.52 -0.04 -0.12 0.00 -0.84 0.00 0.00 28.75 28.27 2fqh h GLU 104 CO 0.09 0.11 0.64 0.35 -1.40 0.00 0.00 179.01 178.80 2fqh h PHE 105 N 0.18 0.84 -1.85 4.33 3.04 -1.04 0.36 116.94 122.80 2fqh h PHE 105 Ca 0.72 0.03 0.55 0.00 3.98 0.00 0.00 57.97 63.26 2fqh h PHE 105 Cb 2.24 -0.23 -0.09 0.00 2.56 0.00 0.00 35.95 40.42 2fqh h PHE 105 CO -0.00 -0.01 1.31 0.36 -2.02 0.00 0.00 178.31 177.95 2fqh n LYS 106 N -4.82 -0.01 -0.45 1.11 0.00 0.22 0.17 118.16 114.38 2fqh n LYS 106 Ca 0.28 1.11 0.41 0.00 -0.00 0.00 0.00 58.31 60.12 2fqh n LYS 106 Cb 0.90 -2.49 0.71 0.00 -0.00 0.00 0.00 35.03 34.15 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 0.11 0.00 0.58 -0.00 -0.47 -3.28 117.51 114.45 2fqh h ILE 107 Ca 0.93 0.00 0.00 0.00 -0.00 0.00 0.00 64.86 65.79 2fqh h ILE 107 Cb 3.58 0.13 0.00 0.00 -0.00 0.00 0.00 36.82 40.53 2fqh h ILE 107 CO -0.11 0.00 -0.05 0.41 -0.00 0.00 0.00 178.15 178.41 2fqh n THR 108 N -3.79 0.16 0.00 2.19 -1.04 0.44 -5.05 114.28 107.19 2fqh n THR 108 Ca 0.33 0.05 0.00 0.00 -2.04 0.00 0.00 64.05 62.39 2fqh n THR 108 Cb 1.64 -0.69 0.00 0.00 -1.82 0.00 0.00 70.33 69.47 2fqh n THR 108 CO 0.00 0.00 0.00 -0.67 -0.64 0.00 0.00 175.07 173.76