#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3fmz s ARG 2 N 0.00 0.42 -0.04 3.44 3.52 -1.26 -5.11 118.95 119.92 3fmz s ARG 2 Ca 0.00 0.69 -0.30 0.00 -0.13 0.00 0.00 55.73 56.00 3fmz s ARG 2 Cb 0.00 0.07 -0.06 0.00 -1.56 0.00 0.00 34.95 33.40 3fmz s ARG 2 CO 0.00 -0.12 1.71 0.34 -0.81 0.00 0.00 175.30 176.43 3fmz s ASP 3 N 0.93 6.62 -0.25 -2.12 -1.08 -1.26 -4.84 116.67 114.68 3fmz s ASP 3 Ca -0.06 2.31 0.11 0.00 -0.52 0.00 0.00 52.55 54.40 3fmz s ASP 3 Cb -0.06 -2.53 0.45 0.00 -1.46 0.00 0.00 42.92 39.32 3fmz s ASP 3 CO -0.07 -0.95 1.19 0.00 0.52 0.00 0.00 175.17 175.85 3fmz s ARG 5 N -3.30 4.34 0.27 0.00 0.52 -1.26 -4.22 118.95 115.30 3fmz s ARG 5 Ca 0.43 0.65 -0.02 0.00 -0.52 0.00 0.00 55.73 56.28 3fmz s ARG 5 Cb 0.39 -3.39 0.38 0.00 0.52 0.00 0.00 34.95 32.84 3fmz s ARG 5 CO -0.01 0.24 1.81 0.28 0.02 0.00 0.00 175.30 177.64 3fmz h VAL 6 N 4.46 1.23 0.00 3.52 2.07 -1.77 -1.99 116.25 123.78 3fmz h VAL 6 Ca -0.43 -0.84 0.00 0.00 0.82 0.00 0.00 66.70 66.25 3fmz h VAL 6 Cb 1.19 0.69 0.00 0.00 -1.52 0.00 0.00 31.29 31.65 3fmz h VAL 6 CO 0.73 0.31 0.00 -1.54 0.02 0.00 0.00 177.57 177.09 3fmz n SER 7 N -4.27 0.00 -1.51 0.57 3.41 -1.26 -2.36 113.62 108.20 3fmz n SER 7 Ca 0.04 0.46 0.02 0.00 -0.26 0.00 0.00 58.87 59.12 3fmz n SER 7 Cb 0.24 -0.46 0.08 0.00 -0.26 0.00 0.00 64.21 63.80 3fmz n SER 7 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 3fmz n SER 8 N -1.46 1.62 -4.83 4.04 3.41 -0.75 -5.06 113.62 110.58 3fmz n SER 8 Ca 0.01 -2.67 -0.37 0.00 -0.26 0.00 0.00 58.87 55.58 3fmz n SER 8 Cb 0.02 -0.39 -0.06 0.00 -0.26 0.00 0.00 64.21 63.52 3fmz n SER 8 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 3fmz s PHE 9 N -1.77 3.69 0.09 7.33 2.99 -0.99 -4.93 117.98 124.38 3fmz s PHE 9 Ca 0.35 1.14 -0.29 0.00 0.00 0.00 0.00 56.93 58.14 3fmz s PHE 9 Cb 0.38 -2.42 -0.05 0.00 0.00 0.00 0.00 43.02 40.93 3fmz s PHE 9 CO -0.10 0.50 0.92 1.03 -0.00 0.00 0.00 175.22 177.57 3fmz s ARG 10 N -1.60 4.64 0.45 0.44 0.52 -1.26 -5.07 118.95 117.08 3fmz s ARG 10 Ca 0.34 1.37 0.05 0.00 -0.52 0.00 0.00 55.73 56.97 3fmz s ARG 10 Cb -0.17 -3.38 -0.05 0.00 0.52 0.00 0.00 34.95 31.87 3fmz s ARG 10 CO 0.19 0.20 0.07 0.14 0.02 0.00 0.00 175.30 175.92 3fmz s VAL 11 N 0.09 1.80 0.22 3.52 -7.23 -1.26 -4.79 120.40 112.75 3fmz s VAL 11 Ca 0.46 -1.90 -0.32 0.00 -1.81 0.00 0.00 61.98 58.41 3fmz s VAL 11 Cb -0.22 -2.70 -0.13 0.00 0.56 0.00 0.00 36.38 33.88 3fmz s VAL 11 CO 0.28 0.00 1.44 1.17 -0.31 0.00 0.00 175.10 177.68 3fmz n LYS 12 N -1.17 2.05 -3.28 4.82 3.00 -0.24 -4.94 118.16 118.41 3fmz n LYS 12 Ca -0.08 0.73 -0.38 0.00 -0.00 0.00 0.00 58.31 58.58 3fmz n LYS 12 Cb 0.66 -2.41 -0.06 0.00 0.00 0.00 0.00 35.03 33.22 3fmz n LYS 12 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.40 175.40 3fmz s GLU 13 N -0.15 4.26 -1.21 1.64 2.12 -1.26 -4.21 118.70 119.88 3fmz s GLU 13 Ca 0.70 0.62 -0.06 0.00 0.36 0.00 0.00 54.97 56.60 3fmz s GLU 13 Cb -0.66 -3.34 -0.02 0.00 0.26 0.00 0.00 34.13 30.38 3fmz s GLU 13 CO 0.47 0.38 0.78 0.09 -0.54 0.00 0.00 175.26 176.45 3fmz n ASN 14 N 2.75 -3.19 -4.70 -1.70 3.02 -1.26 -4.88 115.26 105.30 3fmz n ASN 14 Ca -0.08 -0.83 -0.42 0.00 -0.03 0.00 0.00 54.58 53.22 3fmz n ASN 14 Cb 0.51 -4.21 -0.03 0.00 -0.61 0.00 0.00 39.78 35.44 3fmz n ASN 14 CO 0.00 0.00 0.00 0.33 -2.62 0.00 0.00 177.26 174.97 3fmz n PHE 15 N -4.04 2.69 -3.46 3.10 -0.00 -1.26 -4.94 117.46 109.55 3fmz n PHE 15 Ca -0.21 -0.08 -0.43 0.00 -0.00 0.00 0.00 57.45 56.73 3fmz n PHE 15 Cb 0.65 -2.71 -0.07 0.00 -0.00 0.00 0.00 39.48 37.35 3fmz n PHE 15 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 176.76 177.10 3fmz s ASP 16 N 2.09 5.96 0.15 -2.13 3.68 -1.26 -4.91 116.67 120.26 3fmz s ASP 16 Ca 0.79 -2.04 -0.27 0.00 2.13 0.00 0.00 52.55 53.15 3fmz s ASP 16 Cb -0.49 -2.09 -0.00 0.00 -1.45 0.00 0.00 42.92 38.89 3fmz s ASP 16 CO 0.35 -0.71 1.57 0.11 0.13 0.00 0.00 175.17 176.62 3fmz h LYS 17 N 8.40 -0.30 -0.55 4.34 1.57 -1.93 -2.63 116.57 125.48 3fmz h LYS 17 Ca -0.18 0.02 0.11 0.00 -1.87 0.00 0.00 60.65 58.72 3fmz h LYS 17 Cb 1.07 0.07 -0.11 0.00 0.08 0.00 0.00 32.23 33.34 3fmz h LYS 17 CO 0.89 -0.20 -0.24 0.00 -0.57 0.00 0.00 179.45 179.33 3fmz h ALA 18 N 0.42 0.15 0.00 3.86 0.00 -1.98 0.61 119.26 122.32 3fmz h ALA 18 Ca 0.14 0.19 0.00 0.00 0.00 0.00 0.00 54.91 55.24 3fmz h ALA 18 Cb 0.58 0.60 0.00 0.00 0.00 0.00 0.00 17.79 18.97 3fmz h ALA 18 CO -0.61 -0.56 0.00 0.00 0.00 0.00 0.00 179.25 178.08 3fmz h ARG 19 N -0.11 0.00 0.00 0.00 3.08 -1.91 -1.57 114.38 113.87 3fmz h ARG 19 Ca 0.25 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.30 3fmz h ARG 19 Cb 0.50 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.55 3fmz h ARG 19 CO -0.62 0.00 -0.27 0.34 -1.07 0.00 0.00 179.97 178.35 3fmz n PHE 20 N -2.32 0.10 -0.86 3.04 -0.00 0.21 -4.79 117.46 112.84 3fmz n PHE 20 Ca 0.01 0.03 -0.34 0.00 -0.00 0.00 0.00 57.45 57.15 3fmz n PHE 20 Cb 0.18 -0.43 0.10 0.00 -0.00 0.00 0.00 39.48 39.32 3fmz n PHE 20 CO 0.00 0.00 0.00 0.43 -0.00 0.00 0.00 176.76 177.19 3fmz n SER 21 N -1.59 -3.35 0.00 -2.13 7.64 -0.59 -4.70 113.62 108.89 3fmz n SER 21 Ca 0.06 0.24 0.00 0.00 1.01 0.00 0.00 58.87 60.18 3fmz n SER 21 Cb 0.35 -1.03 0.00 0.00 -1.01 0.00 0.00 64.21 62.52 3fmz n SER 21 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3fmz n GLY 22 N 2.21 -1.33 3.79 0.23 0.00 0.97 -4.86 105.19 106.20 3fmz n GLY 22 Ca 0.03 -1.70 -0.38 0.00 0.00 0.00 0.00 46.02 43.97 3fmz n GLY 22 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3fmz s THR 23 N 0.00 4.91 -0.04 2.61 2.01 -1.26 -1.42 115.64 122.45 3fmz s THR 23 Ca 0.00 1.09 0.02 0.00 0.31 0.00 0.00 61.69 63.12 3fmz s THR 23 Cb 0.00 -3.85 0.01 0.00 0.01 0.00 0.00 72.50 68.67 3fmz s THR 23 CO 0.00 0.50 -0.10 0.26 -0.69 0.00 0.00 174.62 174.59 3fmz s TRP 24 N -0.66 1.15 -0.29 4.92 0.52 -0.86 -4.66 118.94 119.06 3fmz s TRP 24 Ca 0.28 -0.34 -0.09 0.00 0.02 0.00 0.00 56.10 55.96 3fmz s TRP 24 Cb -0.18 -0.84 -0.02 0.00 -1.15 0.00 0.00 33.47 31.28 3fmz s TRP 24 CO 0.16 -0.17 0.14 0.71 0.02 0.00 0.00 176.95 177.81 3fmz s TYR 25 N 0.42 3.16 -0.01 -1.98 1.51 0.14 -1.83 117.35 118.76 3fmz s TYR 25 Ca -0.08 -0.41 -0.30 0.00 -1.01 0.00 0.00 57.07 55.27 3fmz s TYR 25 Cb -0.12 -2.34 -0.07 0.00 -0.11 0.00 0.00 41.96 39.32 3fmz s TYR 25 CO 0.02 -0.38 1.78 0.00 -1.11 0.00 0.00 175.55 175.86 3fmz s ALA 26 N 1.64 3.61 -0.01 3.71 0.00 -0.99 -0.79 121.76 128.93 3fmz s ALA 26 Ca 0.05 1.12 0.07 0.00 0.00 0.00 0.00 51.96 53.20 3fmz s ALA 26 Cb -0.16 -3.78 -0.10 0.00 0.00 0.00 0.00 23.12 19.07 3fmz s ALA 26 CO 0.07 -1.45 0.14 -1.33 0.00 0.00 0.00 175.76 173.19 3fmz n MET 27 N 7.18 0.26 -4.10 0.00 2.81 0.12 -4.67 117.12 118.71 3fmz n MET 27 Ca 0.18 -0.06 -0.10 0.00 -1.81 0.00 0.00 57.70 55.91 3fmz n MET 27 Cb 0.42 -1.16 -0.08 0.00 -0.71 0.00 0.00 33.22 31.69 3fmz n MET 27 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 3fmz s ALA 28 N -2.45 0.60 -0.02 3.04 0.00 -1.20 -1.59 121.76 120.14 3fmz s ALA 28 Ca -0.02 -1.33 -0.18 0.00 0.00 0.00 0.00 51.96 50.42 3fmz s ALA 28 Cb 0.04 1.12 0.03 0.00 0.00 0.00 0.00 23.12 24.31 3fmz s ALA 28 CO 0.27 -0.63 0.38 0.21 0.00 0.00 0.00 175.76 175.99 3fmz s LYS 29 N -4.07 0.74 -0.31 0.00 2.20 -0.63 -2.64 119.74 115.02 3fmz s LYS 29 Ca 0.29 -0.10 0.01 0.00 -0.36 0.00 0.00 55.97 55.81 3fmz s LYS 29 Cb 0.05 0.33 0.10 0.00 -1.51 0.00 0.00 37.83 36.80 3fmz s LYS 29 CO 0.07 -0.21 0.06 0.21 -0.36 0.00 0.00 175.35 175.12 3fmz s LYS 30 N -1.29 1.15 0.52 4.03 2.36 -0.30 -1.18 119.74 125.03 3fmz s LYS 30 Ca -0.13 -1.41 -0.19 0.00 -2.55 0.00 0.00 55.97 51.68 3fmz s LYS 30 Cb -0.04 -2.59 -0.07 0.00 -1.05 0.00 0.00 37.83 34.08 3fmz s LYS 30 CO 0.05 -0.92 1.07 -0.51 1.55 0.00 0.00 175.35 176.59 3fmz s ASP 31 N 1.28 6.06 0.13 1.43 1.11 -1.26 -2.74 116.67 122.67 3fmz s ASP 31 Ca 0.08 2.01 0.00 0.00 0.18 0.00 0.00 52.55 54.82 3fmz s ASP 31 Cb -0.18 -2.56 0.00 0.00 1.07 0.00 0.00 42.92 41.24 3fmz s ASP 31 CO -0.15 -0.98 0.00 -0.81 1.18 0.00 0.00 175.17 174.40 3fmz n PRO 32 N -1.20 1.59 -1.46 8.23 -0.04 -1.21 -4.80 135.00 136.10 3fmz n PRO 32 Ca 0.10 0.00 -0.30 0.00 -0.04 0.00 0.00 63.50 63.26 3fmz n PRO 32 Cb 0.52 0.00 0.08 0.00 -0.04 0.00 0.00 33.50 34.06 3fmz n PRO 32 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 3fmz s GLU 33 N -0.13 2.32 1.49 0.54 8.01 -1.26 -4.88 118.70 124.80 3fmz s GLU 33 Ca 0.00 0.87 0.00 0.00 0.01 0.00 0.00 54.97 55.85 3fmz s GLU 33 Cb 0.00 -1.93 0.00 0.00 -4.31 0.00 0.00 34.13 27.89 3fmz s GLU 33 CO 0.00 -1.51 0.00 0.41 0.01 0.00 0.00 175.26 174.17 3fmz n GLY 34 N -1.78 -1.65 3.81 -1.39 0.00 -1.26 -4.89 105.19 98.03 3fmz n GLY 34 Ca 0.08 -1.32 -0.32 0.00 0.00 0.00 0.00 46.02 44.46 3fmz n GLY 34 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3fmz s LEU 35 N 0.00 3.28 0.33 0.99 1.02 -1.26 -5.06 118.68 117.98 3fmz s LEU 35 Ca 0.00 1.70 -0.18 0.00 0.02 0.00 0.00 54.13 55.67 3fmz s LEU 35 Cb 0.00 -4.51 0.05 0.00 0.02 0.00 0.00 46.19 41.75 3fmz s LEU 35 CO 0.00 -1.32 0.80 0.12 0.02 0.00 0.00 176.35 175.97 3fmz s PHE 36 N -2.80 0.02 0.50 0.29 5.36 -1.26 -4.97 117.98 115.12 3fmz s PHE 36 Ca 0.60 -0.61 -0.21 0.00 -0.96 0.00 0.00 56.93 55.76 3fmz s PHE 36 Cb -0.15 0.79 -0.07 0.00 -0.34 0.00 0.00 43.02 43.25 3fmz s PHE 36 CO 0.47 -1.40 1.11 -0.51 -1.46 0.00 0.00 175.22 173.44 3fmz s LEU 37 N -3.05 3.85 -0.14 6.12 1.43 -1.26 -4.78 118.68 120.85 3fmz s LEU 37 Ca 0.15 2.15 -0.02 0.00 -1.03 0.00 0.00 54.13 55.38 3fmz s LEU 37 Cb -0.05 -4.47 -0.08 0.00 0.03 0.00 0.00 46.19 41.62 3fmz s LEU 37 CO 0.09 -1.01 -0.14 1.67 0.23 0.00 0.00 176.35 177.19 3fmz n GLN 38 N -0.96 0.32 -2.68 1.70 7.27 -0.36 -5.02 117.38 117.64 3fmz n GLN 38 Ca 0.10 0.10 -0.00 0.00 0.07 0.00 0.00 57.00 57.26 3fmz n GLN 38 Cb 0.50 -1.17 0.01 0.00 2.41 0.00 0.00 30.24 31.99 3fmz n GLN 38 CO 0.00 0.00 0.00 -0.40 0.07 0.00 0.00 177.06 176.73 3fmz n ASP 39 N -3.15 -0.74 -3.77 1.69 5.68 -1.19 -4.66 116.55 110.41 3fmz n ASP 39 Ca -0.25 -1.33 -0.28 0.00 -0.50 0.00 0.00 54.79 52.43 3fmz n ASP 39 Cb 0.73 1.19 0.04 0.00 -1.14 0.00 0.00 41.12 41.94 3fmz n ASP 39 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.20 176.46 3fmz n ASN 40 N -0.81 -5.24 -4.71 -1.12 3.02 0.52 -0.69 115.26 106.23 3fmz n ASN 40 Ca 0.00 -0.68 -0.40 0.00 -0.03 0.00 0.00 54.58 53.47 3fmz n ASN 40 Cb 0.28 -4.17 -0.05 0.00 -0.61 0.00 0.00 39.78 35.23 3fmz n ASN 40 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3fmz s ILE 41 N -3.28 5.05 -0.17 2.41 1.01 -1.26 -3.92 121.20 121.04 3fmz s ILE 41 Ca 0.62 1.39 -0.09 0.00 0.00 0.00 0.00 60.65 62.57 3fmz s ILE 41 Cb -0.30 -4.02 0.06 0.00 0.01 0.00 0.00 42.46 38.21 3fmz s ILE 41 CO 0.77 0.23 0.41 -0.69 0.00 0.00 0.00 174.94 175.66 3fmz s VAL 42 N 0.95 -0.08 0.13 2.92 1.01 -0.40 -2.35 120.40 122.58 3fmz s VAL 42 Ca 0.36 0.10 0.06 0.00 0.00 0.00 0.00 61.98 62.50 3fmz s VAL 42 Cb -0.17 -0.61 -0.04 0.00 0.00 0.00 0.00 36.38 35.56 3fmz s VAL 42 CO 0.16 0.04 -0.01 0.00 0.00 0.00 0.00 175.10 175.29 3fmz s ALA 43 N 1.50 3.20 -0.23 5.51 0.00 -0.76 -1.33 121.76 129.65 3fmz s ALA 43 Ca -0.09 -1.26 -0.01 0.00 0.00 0.00 0.00 51.96 50.60 3fmz s ALA 43 Cb -0.09 -1.05 0.06 0.00 0.00 0.00 0.00 23.12 22.05 3fmz s ALA 43 CO -0.13 0.58 -0.00 -2.00 0.00 0.00 0.00 175.76 174.21 3fmz s GLU 44 N -2.61 1.14 -0.03 0.00 2.56 -0.12 -2.02 118.70 117.61 3fmz s GLU 44 Ca 0.26 -0.78 -0.13 0.00 0.00 0.00 0.00 54.97 54.32 3fmz s GLU 44 Cb -0.10 -2.35 -0.05 0.00 2.00 0.00 0.00 34.13 33.62 3fmz s GLU 44 CO 0.18 -0.66 0.35 -0.06 -0.56 0.00 0.00 175.26 174.51 3fmz s PHE 45 N 1.60 3.69 0.23 5.30 0.08 -0.51 -1.32 117.98 127.05 3fmz s PHE 45 Ca -0.02 0.88 -0.14 0.00 0.12 0.00 0.00 56.93 57.77 3fmz s PHE 45 Cb -0.18 -2.22 0.00 0.00 -0.57 0.00 0.00 43.02 40.05 3fmz s PHE 45 CO -0.09 0.64 0.48 -1.54 -0.10 0.00 0.00 175.22 174.62 3fmz s SER 46 N -0.98 -0.12 -0.02 1.36 1.04 -0.89 -0.02 113.70 114.07 3fmz s SER 46 Ca 0.22 -0.83 -0.07 0.00 0.48 0.00 0.00 55.95 55.75 3fmz s SER 46 Cb -0.16 0.58 0.01 0.00 0.10 0.00 0.00 66.02 66.55 3fmz s SER 46 CO 0.11 -1.11 0.16 0.54 0.98 0.00 0.00 173.24 173.92 3fmz s VAL 47 N -3.98 0.05 0.00 5.02 0.11 -1.26 -1.77 120.40 118.57 3fmz s VAL 47 Ca 0.19 -0.44 0.00 0.00 -2.93 0.00 0.00 61.98 58.80 3fmz s VAL 47 Cb -0.01 -0.37 0.00 0.00 -1.53 0.00 0.00 36.38 34.47 3fmz s VAL 47 CO 0.06 -0.24 0.00 -0.90 -3.33 0.00 0.00 175.10 170.69 3fmz n ASP 48 N 1.99 0.00 -0.15 3.54 3.85 -1.16 -4.97 116.55 119.65 3fmz n ASP 48 Ca -0.19 -0.43 -0.11 0.00 -0.71 0.00 0.00 54.79 53.35 3fmz n ASP 48 Cb 0.57 0.00 0.01 0.00 -1.35 0.00 0.00 41.12 40.34 3fmz n ASP 48 CO 0.00 0.00 0.00 -0.33 -1.01 0.00 0.00 177.20 175.86 3fmz h GLU 49 N 0.00 0.97 -0.81 0.11 4.39 -2.03 -3.01 114.58 114.20 3fmz h GLU 49 Ca 0.00 -0.43 -0.02 0.00 0.34 0.00 0.00 59.36 59.25 3fmz h GLU 49 Cb 0.00 -0.03 -0.04 0.00 -0.10 0.00 0.00 28.75 28.58 3fmz h GLU 49 CO 0.00 1.10 0.42 1.79 -1.16 0.00 0.00 179.01 181.16 3fmz h THR 50 N 0.83 1.24 0.00 1.13 1.35 -2.06 -3.47 112.91 111.94 3fmz h THR 50 Ca 0.10 -0.64 0.00 0.00 -0.55 0.00 0.00 66.41 65.33 3fmz h THR 50 Cb 0.82 0.17 0.00 0.00 -1.73 0.00 0.00 68.15 67.40 3fmz h THR 50 CO 0.07 0.28 0.00 0.61 -0.25 0.00 0.00 175.52 176.23 3fmz n GLY 51 N -1.12 1.41 3.72 5.82 0.00 -1.14 -5.10 105.19 108.79 3fmz n GLY 51 Ca 0.08 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.69 3fmz n GLY 51 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3fmz s GLN 52 N -0.25 4.52 0.07 1.61 -1.52 -1.26 -4.85 119.66 117.97 3fmz s GLN 52 Ca 0.00 1.67 -0.08 0.00 -1.95 0.00 0.00 55.36 55.00 3fmz s GLN 52 Cb 0.00 -3.35 -0.05 0.00 -0.22 0.00 0.00 33.01 29.39 3fmz s GLN 52 CO 0.00 -0.09 0.35 1.41 -0.25 0.00 0.00 175.29 176.71 3fmz s MET 53 N 0.56 3.68 0.24 2.91 -2.45 -1.26 -3.01 119.30 119.97 3fmz s MET 53 Ca 0.54 0.05 -0.05 0.00 -1.25 0.00 0.00 55.69 54.97 3fmz s MET 53 Cb -0.27 -3.00 -0.02 0.00 1.25 0.00 0.00 34.83 32.78 3fmz s MET 53 CO 0.31 0.57 0.32 -1.54 1.05 0.00 0.00 175.02 175.73 3fmz s SER 54 N -1.85 0.23 -0.05 1.11 1.04 -0.73 -2.23 113.70 111.21 3fmz s SER 54 Ca 0.32 -1.24 -0.30 0.00 0.48 0.00 0.00 55.95 55.21 3fmz s SER 54 Cb -0.13 0.51 0.08 0.00 0.10 0.00 0.00 66.02 66.57 3fmz s SER 54 CO 0.19 -1.03 0.73 0.00 0.98 0.00 0.00 173.24 174.10 3fmz s ALA 55 N -3.93 -1.78 -0.21 5.32 0.00 0.36 -2.09 121.76 119.43 3fmz s ALA 55 Ca 0.31 1.29 -0.03 0.00 0.00 0.00 0.00 51.96 53.54 3fmz s ALA 55 Cb 0.03 -0.03 -0.01 0.00 0.00 0.00 0.00 23.12 23.11 3fmz s ALA 55 CO 0.13 -0.40 -0.06 0.95 0.00 0.00 0.00 175.76 176.38 3fmz s THR 56 N -1.41 3.24 -0.05 0.00 -4.23 -0.44 -0.23 115.64 112.52 3fmz s THR 56 Ca -0.08 -0.54 -0.10 0.00 -1.18 0.00 0.00 61.69 59.79 3fmz s THR 56 Cb -0.00 -2.46 -0.05 0.00 1.34 0.00 0.00 72.50 71.33 3fmz s THR 56 CO 0.07 0.44 0.27 0.00 -0.54 0.00 0.00 174.62 174.85 3fmz s ALA 57 N 1.36 3.80 -0.05 3.99 0.00 -0.05 -0.95 121.76 129.87 3fmz s ALA 57 Ca 0.04 -0.46 -0.04 0.00 0.00 0.00 0.00 51.96 51.50 3fmz s ALA 57 Cb -0.14 -2.15 0.01 0.00 0.00 0.00 0.00 23.12 20.84 3fmz s ALA 57 CO -0.04 0.57 0.12 0.15 0.00 0.00 0.00 175.76 176.57 3fmz s LYS 58 N -1.18 0.13 0.04 0.00 1.02 -0.44 -0.52 119.74 118.80 3fmz s LYS 58 Ca 0.21 0.19 -0.27 0.00 0.02 0.00 0.00 55.97 56.12 3fmz s LYS 58 Cb -0.14 0.04 0.09 0.00 -0.52 0.00 0.00 37.83 37.30 3fmz s LYS 58 CO 0.10 -0.04 1.21 0.20 -0.92 0.00 0.00 175.35 175.90 3fmz s GLY 59 N 0.20 -0.06 -0.02 -3.33 0.00 0.17 -1.28 107.32 103.01 3fmz s GLY 59 Ca -0.01 -0.06 0.02 0.00 0.00 0.00 0.00 44.72 44.66 3fmz s GLY 59 CO -0.01 4.53 -0.03 -1.60 0.00 0.00 0.00 173.10 176.00 3fmz s ARG 60 N -2.07 2.74 -0.05 2.90 3.52 0.14 0.19 118.95 126.31 3fmz s ARG 60 Ca 0.27 -0.61 -0.01 0.00 -0.13 0.00 0.00 55.73 55.25 3fmz s ARG 60 Cb -0.01 -2.63 0.03 0.00 -1.56 0.00 0.00 34.95 30.78 3fmz s ARG 60 CO 0.01 0.63 0.00 0.08 -0.81 0.00 0.00 175.30 175.22 3fmz s VAL 61 N -1.01 0.27 -0.31 7.11 1.01 0.30 -1.23 120.40 126.55 3fmz s VAL 61 Ca 0.17 0.13 -0.26 0.00 0.00 0.00 0.00 61.98 62.02 3fmz s VAL 61 Cb -0.11 -0.41 0.01 0.00 0.00 0.00 0.00 36.38 35.86 3fmz s VAL 61 CO 0.08 0.21 0.91 -0.60 0.00 0.00 0.00 175.10 175.70 3fmz s ARG 62 N 1.60 4.01 0.00 2.72 6.06 -1.26 -2.21 118.95 129.87 3fmz s ARG 62 Ca -0.01 0.79 0.00 0.00 -2.50 0.00 0.00 55.73 54.01 3fmz s ARG 62 Cb -0.13 -3.73 0.00 0.00 0.06 0.00 0.00 34.95 31.15 3fmz s ARG 62 CO -0.03 -0.77 0.00 1.28 -2.50 0.00 0.00 175.30 173.28 3fmz n LEU 63 N 6.47 1.06 -0.92 -0.88 4.32 -0.86 -4.67 117.00 121.52 3fmz n LEU 63 Ca 0.07 0.14 0.10 0.00 -0.02 0.00 0.00 56.01 56.30 3fmz n LEU 63 Cb 0.48 -0.22 0.14 0.00 -1.62 0.00 0.00 43.42 42.20 3fmz n LEU 63 CO 0.54 -0.22 0.62 0.18 -1.22 0.00 0.00 177.39 177.29 3fmz n LEU 64 N -1.45 3.00 0.00 2.23 4.77 -1.26 -4.91 117.00 119.38 3fmz n LEU 64 Ca 0.00 -1.30 0.00 0.00 -0.03 0.00 0.00 56.01 54.68 3fmz n LEU 64 Cb 0.00 -0.13 0.00 0.00 -2.33 0.00 0.00 43.42 40.96 3fmz n LEU 64 CO 0.00 0.60 0.00 0.59 -1.33 0.00 0.00 177.39 177.25 3fmz n ASN 65 N 1.21 0.00 -0.45 -1.43 3.02 -1.26 -4.86 115.26 111.50 3fmz n ASN 65 Ca 0.15 0.00 0.04 0.00 -0.03 0.00 0.00 54.58 54.74 3fmz n ASN 65 Cb 0.53 0.00 0.10 0.00 -0.61 0.00 0.00 39.78 39.80 3fmz n ASN 65 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 3fmz n ASN 66 N 0.00 2.54 -3.68 6.41 3.02 -1.26 -5.00 115.26 117.29 3fmz n ASN 66 Ca 0.00 -1.91 -0.13 0.00 -0.03 0.00 0.00 54.58 52.52 3fmz n ASN 66 Cb 0.00 -0.15 -0.13 0.00 -0.61 0.00 0.00 39.78 38.90 3fmz n ASN 66 CO 0.00 0.00 0.00 0.26 -2.62 0.00 0.00 177.26 174.90 3fmz s TRP 67 N -0.95 -0.42 -0.28 3.10 0.52 -1.26 -5.04 118.94 114.60 3fmz s TRP 67 Ca 0.16 0.95 -0.10 0.00 0.02 0.00 0.00 56.10 57.13 3fmz s TRP 67 Cb 0.09 0.02 -0.04 0.00 -1.15 0.00 0.00 33.47 32.38 3fmz s TRP 67 CO 0.11 -0.32 0.17 -0.51 0.02 0.00 0.00 176.95 176.42 3fmz s ASP 68 N 2.01 5.84 -0.02 2.95 1.01 -1.26 -2.02 116.67 125.18 3fmz s ASP 68 Ca -0.03 -0.12 0.02 0.00 0.71 0.00 0.00 52.55 53.14 3fmz s ASP 68 Cb -0.11 -2.08 0.00 0.00 1.01 0.00 0.00 42.92 41.74 3fmz s ASP 68 CO -0.09 -0.08 -0.08 0.54 0.21 0.00 0.00 175.17 175.68 3fmz s VAL 69 N 1.72 0.67 0.12 -1.27 0.11 -0.94 -4.96 120.40 115.85 3fmz s VAL 69 Ca 0.07 -0.31 -0.30 0.00 -2.93 0.00 0.00 61.98 58.50 3fmz s VAL 69 Cb -0.16 -0.60 -0.06 0.00 -1.53 0.00 0.00 36.38 34.03 3fmz s VAL 69 CO 0.09 0.21 1.03 0.00 -3.33 0.00 0.00 175.10 173.11 3fmz s ALA 71 N 0.11 3.01 0.08 0.00 0.00 0.51 -4.86 121.76 120.61 3fmz s ALA 71 Ca 0.49 -0.89 0.07 0.00 0.00 0.00 0.00 51.96 51.64 3fmz s ALA 71 Cb -0.26 -1.25 -0.03 0.00 0.00 0.00 0.00 23.12 21.58 3fmz s ALA 71 CO 0.31 0.58 -0.18 -0.51 0.00 0.00 0.00 175.76 175.96 3fmz s ASP 72 N -0.83 2.20 0.10 0.00 1.01 -1.26 -0.66 116.67 117.23 3fmz s ASP 72 Ca 0.13 -0.62 -0.25 0.00 0.71 0.00 0.00 52.55 52.51 3fmz s ASP 72 Cb -0.11 -0.12 0.07 0.00 1.01 0.00 0.00 42.92 43.77 3fmz s ASP 72 CO 0.02 0.03 0.62 0.00 0.21 0.00 0.00 175.17 176.05 3fmz s MET 73 N -1.70 1.21 0.22 8.23 0.23 0.33 -2.85 119.30 124.97 3fmz s MET 73 Ca 0.04 -0.25 0.11 0.00 -1.03 0.00 0.00 55.69 54.55 3fmz s MET 73 Cb -0.10 0.56 -0.05 0.00 -1.53 0.00 0.00 34.83 33.72 3fmz s MET 73 CO 0.03 -0.49 -0.20 0.08 -2.03 0.00 0.00 175.02 172.41 3fmz s VAL 74 N -2.99 2.53 -0.10 5.16 1.01 -0.45 -0.87 120.40 124.70 3fmz s VAL 74 Ca -0.03 -2.07 -0.11 0.00 0.00 0.00 0.00 61.98 59.77 3fmz s VAL 74 Cb -0.01 -2.25 0.03 0.00 0.00 0.00 0.00 36.38 34.15 3fmz s VAL 74 CO -0.06 -0.19 0.29 -0.83 0.00 0.00 0.00 175.10 174.31 3fmz s GLY 75 N -2.93 -0.20 0.25 4.51 0.00 0.68 -1.92 107.32 107.70 3fmz s GLY 75 Ca 0.24 0.74 0.10 0.00 0.00 0.00 0.00 44.72 45.80 3fmz s GLY 75 CO 0.12 0.62 -0.05 -0.51 0.00 0.00 0.00 173.10 173.28 3fmz s THR 76 N -0.07 3.26 -0.15 0.90 -4.23 0.13 -0.49 115.64 114.99 3fmz s THR 76 Ca -0.02 -1.93 -0.01 0.00 -1.18 0.00 0.00 61.69 58.55 3fmz s THR 76 Cb -0.03 -2.71 0.04 0.00 1.34 0.00 0.00 72.50 71.14 3fmz s THR 76 CO 0.01 -0.32 -0.04 -0.36 -0.54 0.00 0.00 174.62 173.37 3fmz s PHE 77 N -2.22 1.46 0.25 3.99 0.40 -0.95 -0.30 117.98 120.61 3fmz s PHE 77 Ca 0.30 -0.90 -0.30 0.00 -0.60 0.00 0.00 56.93 55.43 3fmz s PHE 77 Cb -0.07 -1.20 -0.09 0.00 0.51 0.00 0.00 43.02 42.17 3fmz s PHE 77 CO 0.18 -0.57 1.05 0.99 0.70 0.00 0.00 175.22 177.58 3fmz s THR 78 N 1.71 3.73 0.55 0.64 2.01 0.12 -4.42 115.64 119.99 3fmz s THR 78 Ca 0.02 1.69 -0.15 0.00 0.31 0.00 0.00 61.69 63.56 3fmz s THR 78 Cb -0.15 -4.08 -0.06 0.00 0.01 0.00 0.00 72.50 68.22 3fmz s THR 78 CO -0.07 0.38 1.00 -1.81 -0.69 0.00 0.00 174.62 173.43 3fmz s ASP 79 N -0.81 6.43 0.53 3.53 -0.00 -1.26 -1.23 116.67 123.86 3fmz s ASP 79 Ca 0.44 1.54 0.02 0.00 -0.00 0.00 0.00 52.55 54.56 3fmz s ASP 79 Cb -0.30 -2.50 0.01 0.00 -0.00 0.00 0.00 42.92 40.14 3fmz s ASP 79 CO 0.37 -0.72 0.14 0.42 -0.00 0.00 0.00 175.17 175.38 3fmz s THR 80 N -2.78 1.23 0.60 -1.27 -4.23 -1.18 -4.83 115.64 103.17 3fmz s THR 80 Ca 0.58 -1.82 0.33 0.00 -1.18 0.00 0.00 61.69 59.60 3fmz s THR 80 Cb -0.11 -2.06 0.37 0.00 1.34 0.00 0.00 72.50 72.05 3fmz s THR 80 CO 0.39 0.00 2.28 -0.33 -0.54 0.00 0.00 174.62 176.41 3fmz h GLU 81 N 1.09 0.00 -4.82 3.99 4.39 -1.98 -3.38 114.58 113.88 3fmz h GLU 81 Ca -0.41 0.00 -0.66 0.00 0.34 0.00 0.00 59.36 58.62 3fmz h GLU 81 Cb 1.32 0.00 -0.18 0.00 -0.10 0.00 0.00 28.75 29.79 3fmz h GLU 81 CO 0.68 0.01 -0.45 0.34 -1.16 0.00 0.00 179.01 178.42 3fmz s ASP 82 N -5.93 6.08 0.00 1.42 3.68 -1.26 -4.97 116.67 115.68 3fmz s ASP 82 Ca -0.05 -0.26 0.07 0.00 2.13 0.00 0.00 52.55 54.44 3fmz s ASP 82 Cb 0.15 -2.15 0.41 0.00 -1.45 0.00 0.00 42.92 39.88 3fmz s ASP 82 CO 0.52 -0.20 0.99 -0.81 0.13 0.00 0.00 175.17 175.79 3fmz n PRO 83 N 5.15 0.17 -0.00 4.34 -0.04 -1.26 -1.51 135.00 141.85 3fmz n PRO 83 Ca -0.12 0.10 0.08 0.00 -0.04 0.00 0.00 63.50 63.52 3fmz n PRO 83 Cb 0.50 -1.50 -0.11 0.00 -0.04 0.00 0.00 33.50 32.35 3fmz n PRO 83 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3fmz n ALA 84 N -1.13 3.15 -2.74 0.55 0.00 -1.26 -4.36 120.51 114.71 3fmz n ALA 84 Ca 0.05 -0.40 -0.35 0.00 0.00 0.00 0.00 53.44 52.74 3fmz n ALA 84 Cb 0.04 -0.55 -0.10 0.00 0.00 0.00 0.00 19.45 18.84 3fmz n ALA 84 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 3fmz s LYS 85 N -2.85 3.21 0.05 0.00 1.02 -0.57 -2.07 119.74 118.53 3fmz s LYS 85 Ca -0.01 -0.40 0.03 0.00 0.02 0.00 0.00 55.97 55.60 3fmz s LYS 85 Cb 0.11 -2.87 -0.03 0.00 -0.52 0.00 0.00 37.83 34.52 3fmz s LYS 85 CO 0.65 0.59 -0.10 -0.06 -0.92 0.00 0.00 175.35 175.52 3fmz s PHE 86 N -0.57 0.84 -0.33 3.18 0.08 -0.32 -3.13 117.98 117.72 3fmz s PHE 86 Ca 0.10 -0.49 -0.12 0.00 0.12 0.00 0.00 56.93 56.53 3fmz s PHE 86 Cb -0.12 -0.49 -0.02 0.00 -0.57 0.00 0.00 43.02 41.82 3fmz s PHE 86 CO 0.02 -0.04 0.23 0.15 -0.10 0.00 0.00 175.22 175.48 3fmz s LYS 87 N -1.66 3.55 -0.16 0.44 -0.14 -0.37 -0.53 119.74 120.88 3fmz s LYS 87 Ca -0.07 -0.60 -0.05 0.00 -1.36 0.00 0.00 55.97 53.89 3fmz s LYS 87 Cb -0.10 -3.77 -0.03 0.00 -1.68 0.00 0.00 37.83 32.25 3fmz s LYS 87 CO 0.01 -0.40 -0.00 1.41 -0.76 0.00 0.00 175.35 175.61 3fmz s MET 88 N 1.72 3.70 -0.16 1.68 -2.45 0.90 0.14 119.30 124.83 3fmz s MET 88 Ca 0.06 -0.45 -0.05 0.00 -1.25 0.00 0.00 55.69 54.00 3fmz s MET 88 Cb -0.17 -3.00 -0.03 0.00 1.25 0.00 0.00 34.83 32.88 3fmz s MET 88 CO 0.10 0.31 0.00 0.21 1.05 0.00 0.00 175.02 176.69 3fmz s LYS 89 N 0.22 3.78 0.09 4.11 2.20 0.59 -1.28 119.74 129.45 3fmz s LYS 89 Ca 0.00 -0.45 -0.02 0.00 -0.36 0.00 0.00 55.97 55.15 3fmz s LYS 89 Cb -0.13 -3.03 -0.04 0.00 -1.51 0.00 0.00 37.83 33.12 3fmz s LYS 89 CO 0.02 0.27 0.03 1.52 -0.36 0.00 0.00 175.35 176.83 3fmz s TYR 90 N 0.33 0.61 0.01 4.03 1.13 -1.01 -0.69 117.35 121.75 3fmz s TYR 90 Ca -0.01 -1.08 -0.28 0.00 -1.41 0.00 0.00 57.07 54.29 3fmz s TYR 90 Cb -0.13 -0.38 0.09 0.00 -1.10 0.00 0.00 41.96 40.44 3fmz s TYR 90 CO 0.02 -0.46 0.81 1.67 -2.51 0.00 0.00 175.55 175.08 3fmz s TRP 91 N -3.96 -0.43 0.51 -3.49 -2.14 -0.81 -1.81 118.94 106.80 3fmz s TRP 91 Ca 0.13 0.40 0.08 0.00 2.66 0.00 0.00 56.10 59.38 3fmz s TRP 91 Cb 0.07 0.52 0.05 0.00 -3.10 0.00 0.00 33.47 31.01 3fmz s TRP 91 CO -0.05 -0.60 0.70 0.20 -2.66 0.00 0.00 176.95 174.54 3fmz s GLY 92 N -2.21 1.83 0.13 3.67 0.00 -1.22 -1.34 107.32 108.18 3fmz s GLY 92 Ca 0.01 -1.87 0.00 0.00 0.00 0.00 0.00 44.72 42.86 3fmz s GLY 92 CO -0.06 -1.54 0.00 3.33 0.00 0.00 0.00 173.10 174.83 3fmz n VAL 93 N -2.10 0.47 0.13 1.40 0.24 -1.13 -4.77 118.33 112.57 3fmz n VAL 93 Ca 0.12 0.15 0.01 0.00 -2.04 0.00 0.00 64.34 62.58 3fmz n VAL 93 Cb 0.60 -1.09 0.09 0.00 -1.47 0.00 0.00 33.84 31.97 3fmz n VAL 93 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3fmz h ALA 94 N 0.00 0.71 0.00 2.33 0.00 -1.93 -3.42 119.26 116.94 3fmz h ALA 94 Ca 0.00 -0.54 0.00 0.00 0.00 0.00 0.00 54.91 54.37 3fmz h ALA 94 Cb 0.18 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.88 3fmz h ALA 94 CO 0.00 0.74 0.00 0.43 0.00 0.00 0.00 179.25 180.42 3fmz n SER 95 N -3.38 0.00 -4.72 0.00 7.64 -1.26 -5.10 113.62 106.80 3fmz n SER 95 Ca 0.01 0.00 -0.42 0.00 1.01 0.00 0.00 58.87 59.47 3fmz n SER 95 Cb 0.71 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.88 3fmz n SER 95 CO 0.00 0.00 0.00 0.12 -3.01 0.00 0.00 175.04 172.15 3fmz s PHE 96 N -0.97 2.97 0.00 1.43 5.99 -1.26 -4.92 117.98 121.22 3fmz s PHE 96 Ca 0.00 0.52 0.00 0.00 0.00 0.00 0.00 56.93 57.45 3fmz s PHE 96 Cb 0.00 -3.99 0.00 0.00 0.00 0.00 0.00 43.02 39.03 3fmz s PHE 96 CO 0.00 -3.72 0.27 1.28 -0.00 0.00 0.00 175.22 173.05 3fmz n LEU 97 N 4.09 0.55 -4.85 6.12 4.77 -1.26 -3.33 117.00 123.08 3fmz n LEU 97 Ca 0.15 -0.77 -0.35 0.00 -0.03 0.00 0.00 56.01 55.01 3fmz n LEU 97 Cb 0.38 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.41 3fmz n LEU 97 CO 0.62 0.14 0.20 0.00 -1.33 0.00 0.00 177.39 177.02 3fmz s GLN 98 N -0.45 3.91 0.16 3.23 -2.07 -1.26 -4.83 119.66 118.35 3fmz s GLN 98 Ca 0.00 0.39 0.06 0.00 -1.82 0.00 0.00 55.36 53.99 3fmz s GLN 98 Cb 0.00 -2.90 -0.04 0.00 -1.09 0.00 0.00 33.01 28.98 3fmz s GLN 98 CO 0.00 0.47 0.07 0.15 -1.32 0.00 0.00 175.29 174.66 3fmz s LYS 99 N -2.09 2.67 0.31 9.60 1.02 -1.26 -3.39 119.74 126.60 3fmz s LYS 99 Ca 0.38 -0.96 -0.12 0.00 0.02 0.00 0.00 55.97 55.30 3fmz s LYS 99 Cb -0.14 -2.52 0.02 0.00 -0.52 0.00 0.00 37.83 34.66 3fmz s LYS 99 CO 0.19 0.48 0.59 0.20 -0.92 0.00 0.00 175.35 175.89 3fmz s GLY 100 N -2.95 0.65 -0.12 -3.33 0.00 -0.75 -5.00 107.32 95.81 3fmz s GLY 100 Ca 0.29 -0.93 -0.02 0.00 0.00 0.00 0.00 44.72 44.06 3fmz s GLY 100 CO 0.21 -0.57 0.01 -1.31 0.00 0.00 0.00 173.10 171.45 3fmz s ASN 101 N -3.07 2.15 0.09 1.64 0.01 -1.26 -2.41 114.94 112.09 3fmz s ASN 101 Ca 0.21 -0.40 0.06 0.00 -0.71 0.00 0.00 52.86 52.02 3fmz s ASN 101 Cb -0.02 -0.51 -0.03 0.00 0.41 0.00 0.00 41.25 41.09 3fmz s ASN 101 CO 0.12 -0.24 -0.15 -1.81 -1.51 0.00 0.00 177.10 173.51 3fmz s ASP 102 N 1.92 1.86 0.33 -1.22 1.01 -0.40 -4.97 116.67 115.20 3fmz s ASP 102 Ca 0.03 -0.68 -0.28 0.00 0.71 0.00 0.00 52.55 52.32 3fmz s ASP 102 Cb -0.14 -0.06 -0.09 0.00 1.01 0.00 0.00 42.92 43.63 3fmz s ASP 102 CO -0.07 -0.08 1.15 -1.81 0.21 0.00 0.00 175.17 174.57 3fmz s ASP 103 N -1.97 6.97 -0.29 0.27 -0.00 -1.26 -0.07 116.67 120.32 3fmz s ASP 103 Ca 0.02 2.34 -0.01 0.00 -0.00 0.00 0.00 52.55 54.90 3fmz s ASP 103 Cb -0.08 -2.62 0.09 0.00 -0.00 0.00 0.00 42.92 40.30 3fmz s ASP 103 CO 0.03 -0.36 0.09 -2.28 -0.00 0.00 0.00 175.17 172.64 3fmz s HIS 104 N -1.26 1.46 -0.12 4.23 2.46 0.31 -4.46 115.29 117.90 3fmz s HIS 104 Ca 0.49 -1.49 -0.04 0.00 0.47 0.00 0.00 55.06 54.49 3fmz s HIS 104 Cb -0.32 -1.50 -0.03 0.00 -0.13 0.00 0.00 32.58 30.59 3fmz s HIS 104 CO 0.41 -0.83 0.02 -1.58 -2.47 0.00 0.00 174.74 170.30 3fmz s TRP 105 N 1.70 3.19 -0.57 3.88 0.52 0.45 -1.18 118.94 126.93 3fmz s TRP 105 Ca 0.07 0.11 -0.17 0.00 0.02 0.00 0.00 56.10 56.13 3fmz s TRP 105 Cb -0.17 -1.89 0.13 0.00 -1.15 0.00 0.00 33.47 30.39 3fmz s TRP 105 CO -0.23 0.34 0.58 0.42 0.02 0.00 0.00 176.95 178.07 3fmz s ILE 106 N -0.42 5.11 0.09 2.03 -1.09 -0.88 -0.51 121.20 125.54 3fmz s ILE 106 Ca 0.08 -1.41 -0.17 0.00 -2.23 0.00 0.00 60.65 56.92 3fmz s ILE 106 Cb -0.12 -4.40 -0.07 0.00 -1.58 0.00 0.00 42.46 36.29 3fmz s ILE 106 CO 0.02 -0.96 1.50 0.58 -1.23 0.00 0.00 174.94 174.85 3fmz h VAL 107 N 5.84 1.27 -2.96 2.92 2.07 -1.45 -0.61 116.25 123.33 3fmz h VAL 107 Ca -0.27 -1.04 0.05 0.00 0.82 0.00 0.00 66.70 66.26 3fmz h VAL 107 Cb 1.09 1.38 -0.08 0.00 -1.52 0.00 0.00 31.29 32.17 3fmz h VAL 107 CO 1.04 0.33 0.24 -0.62 0.02 0.00 0.00 177.57 178.58 3fmz s ASP 108 N -6.09 -0.36 -0.30 0.57 3.68 -1.14 -1.42 116.67 111.61 3fmz s ASP 108 Ca -0.13 -0.39 -0.32 0.00 2.13 0.00 0.00 52.55 53.83 3fmz s ASP 108 Cb 0.08 0.67 0.19 0.00 -1.45 0.00 0.00 42.92 42.41 3fmz s ASP 108 CO 0.77 -1.19 1.40 0.28 0.13 0.00 0.00 175.17 176.55 3fmz s THR 109 N -3.82 0.00 -0.25 1.71 -1.32 -1.26 -0.04 115.64 110.65 3fmz s THR 109 Ca 0.08 0.00 0.04 0.00 -1.21 0.00 0.00 61.69 60.60 3fmz s THR 109 Cb -0.04 -1.00 0.11 0.00 -1.51 0.00 0.00 72.50 70.06 3fmz s THR 109 CO -0.00 0.00 1.08 -0.90 -2.21 0.00 0.00 174.62 172.59 3fmz n ASP 110 N 0.33 2.30 0.00 8.08 5.68 -0.90 -5.00 116.55 127.05 3fmz n ASP 110 Ca 0.03 -2.09 0.00 0.00 -0.50 0.00 0.00 54.79 52.23 3fmz n ASP 110 Cb 0.58 -0.10 0.00 0.00 -1.14 0.00 0.00 41.12 40.46 3fmz n ASP 110 CO 0.00 0.00 0.00 -1.22 -1.33 0.00 0.00 177.20 174.65 3fmz n TYR 111 N -0.30 0.00 -0.65 2.11 4.01 -1.26 -4.41 117.16 116.67 3fmz n TYR 111 Ca 0.04 0.00 0.07 0.00 -0.16 0.00 0.00 57.90 57.85 3fmz n TYR 111 Cb 0.33 0.00 0.19 0.00 -0.31 0.00 0.00 39.34 39.55 3fmz n TYR 111 CO 0.00 0.00 0.00 -0.40 -0.46 0.00 0.00 176.86 176.00 3fmz n ASP 112 N 1.85 3.20 0.00 7.72 3.85 -1.26 -4.76 116.55 127.15 3fmz n ASP 112 Ca 0.00 -2.60 0.00 0.00 -0.71 0.00 0.00 54.79 51.48 3fmz n ASP 112 Cb 0.00 -0.38 0.00 0.00 -1.35 0.00 0.00 41.12 39.39 3fmz n ASP 112 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.20 176.60 3fmz n THR 113 N -0.30 0.00 -3.54 2.12 -1.04 -1.26 -4.81 114.28 105.44 3fmz n THR 113 Ca 0.15 0.00 -0.07 0.00 -2.04 0.00 0.00 64.05 62.10 3fmz n THR 113 Cb 0.65 0.00 -0.02 0.00 -1.82 0.00 0.00 70.33 69.14 3fmz n THR 113 CO 0.00 0.00 0.00 -0.72 -0.64 0.00 0.00 175.07 173.71 3fmz s TYR 114 N -1.00 -0.27 -0.02 -1.42 -0.85 -1.26 -3.30 117.35 109.22 3fmz s TYR 114 Ca 0.00 0.15 -0.11 0.00 -0.52 0.00 0.00 57.07 56.58 3fmz s TYR 114 Cb 0.00 0.54 0.02 0.00 0.38 0.00 0.00 41.96 42.90 3fmz s TYR 114 CO 0.00 -0.48 0.25 0.00 -1.52 0.00 0.00 175.55 173.79 3fmz s ALA 115 N -2.96 -0.61 -0.16 9.51 0.00 -0.97 -2.12 121.76 124.45 3fmz s ALA 115 Ca 0.07 0.25 -0.01 0.00 0.00 0.00 0.00 51.96 52.27 3fmz s ALA 115 Cb -0.01 -0.00 -0.01 0.00 0.00 0.00 0.00 23.12 23.11 3fmz s ALA 115 CO -0.07 -0.22 -0.13 0.08 0.00 0.00 0.00 175.76 175.42 3fmz s VAL 116 N -1.10 2.86 0.31 0.00 1.01 0.94 -0.31 120.40 124.11 3fmz s VAL 116 Ca -0.12 -0.70 0.09 0.00 0.00 0.00 0.00 61.98 61.25 3fmz s VAL 116 Cb -0.05 -2.22 -0.04 0.00 0.00 0.00 0.00 36.38 34.06 3fmz s VAL 116 CO 0.03 0.50 0.10 -1.58 0.00 0.00 0.00 175.10 174.15 3fmz s GLN 117 N 0.83 2.40 0.02 2.72 -0.44 -0.77 -1.16 119.66 123.26 3fmz s GLN 117 Ca -0.04 -1.46 -0.28 0.00 -2.50 0.00 0.00 55.36 51.08 3fmz s GLN 117 Cb -0.15 -2.21 0.07 0.00 -1.64 0.00 0.00 33.01 29.08 3fmz s GLN 117 CO 0.00 0.22 0.66 -0.47 0.50 0.00 0.00 175.29 176.21 3fmz s TYR 118 N -2.37 -0.60 -0.30 1.67 6.14 0.33 -3.20 117.35 119.03 3fmz s TYR 118 Ca 0.35 0.80 0.00 0.00 0.64 0.00 0.00 57.07 58.87 3fmz s TYR 118 Cb -0.04 0.47 0.19 0.00 0.42 0.00 0.00 41.96 43.00 3fmz s TYR 118 CO 0.22 -0.69 0.63 0.45 0.64 0.00 0.00 175.55 176.80 3fmz s SER 119 N -1.79 -1.40 0.10 4.32 0.15 -0.47 -0.41 113.70 114.20 3fmz s SER 119 Ca -0.06 0.60 -0.26 0.00 0.70 0.00 0.00 55.95 56.94 3fmz s SER 119 Cb -0.00 2.06 -0.06 0.00 -1.71 0.00 0.00 66.02 66.31 3fmz s SER 119 CO 0.01 -0.26 0.79 0.00 1.20 0.00 0.00 173.24 174.98 3fmz n ARG 121 N 2.34 3.20 -3.58 0.00 1.74 0.21 -4.43 116.66 116.15 3fmz n ARG 121 Ca -0.03 -0.02 -0.01 0.00 -0.77 0.00 0.00 57.85 57.02 3fmz n ARG 121 Cb 0.49 -0.98 -0.05 0.00 -1.02 0.00 0.00 32.46 30.90 3fmz n ARG 121 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 3fmz s LEU 122 N -2.70 -0.93 0.02 0.55 2.96 -1.11 -4.91 118.68 112.57 3fmz s LEU 122 Ca 0.02 1.31 -0.18 0.00 -0.22 0.00 0.00 54.13 55.06 3fmz s LEU 122 Cb 0.06 2.11 -0.06 0.00 0.50 0.00 0.00 46.19 48.80 3fmz s LEU 122 CO 0.36 -0.19 0.51 -0.76 -1.32 0.00 0.00 176.35 174.96 3fmz s LEU 123 N 2.52 4.48 0.82 -0.68 1.43 -1.26 0.16 118.68 126.14 3fmz s LEU 123 Ca -0.06 1.12 -0.11 0.00 -1.03 0.00 0.00 54.13 54.05 3fmz s LEU 123 Cb -0.09 -2.79 0.08 0.00 0.03 0.00 0.00 46.19 43.43 3fmz s LEU 123 CO -0.18 0.24 1.10 0.20 0.23 0.00 0.00 176.35 177.94 3fmz s ASN 124 N -0.83 4.07 0.53 2.29 0.01 0.23 -4.66 114.94 116.59 3fmz s ASN 124 Ca 0.27 1.77 0.21 0.00 -0.71 0.00 0.00 52.86 54.41 3fmz s ASN 124 Cb -0.18 -2.44 1.38 0.00 0.41 0.00 0.00 41.25 40.42 3fmz s ASN 124 CO 0.16 -2.30 2.10 -0.07 -1.51 0.00 0.00 177.10 175.48 3fmz h LEU 125 N -1.31 0.00 -0.99 0.60 3.38 -1.98 -2.13 115.31 112.87 3fmz h LEU 125 Ca -0.45 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.52 3fmz h LEU 125 Cb 1.25 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.00 3fmz h LEU 125 CO 0.51 0.00 0.00 -0.90 0.09 0.00 0.00 178.44 178.14 3fmz n ASP 126 N -4.37 1.50 0.00 -0.43 5.75 -1.26 -4.92 116.55 112.82 3fmz n ASP 126 Ca 0.02 -1.66 0.00 0.00 -0.01 0.00 0.00 54.79 53.14 3fmz n ASP 126 Cb 0.29 -0.09 0.00 0.00 -1.03 0.00 0.00 41.12 40.29 3fmz n ASP 126 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3fmz n GLY 127 N 1.10 2.89 3.79 6.12 0.00 -0.80 -4.95 105.19 113.34 3fmz n GLY 127 Ca 0.16 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.86 3fmz n GLY 127 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3fmz s THR 128 N -2.82 3.56 0.06 2.61 -4.23 -1.26 -2.16 115.64 111.40 3fmz s THR 128 Ca 0.00 0.63 -0.31 0.00 -1.18 0.00 0.00 61.69 60.83 3fmz s THR 128 Cb 0.00 -3.18 -0.06 0.00 1.34 0.00 0.00 72.50 70.60 3fmz s THR 128 CO 0.00 -0.54 1.21 0.00 -0.54 0.00 0.00 174.62 174.74 3fmz h ALA 130 N 6.83 0.29 -3.35 0.00 0.00 0.13 -3.43 119.26 119.72 3fmz h ALA 130 Ca -0.41 -1.25 -0.43 0.00 0.00 0.00 0.00 54.91 52.81 3fmz h ALA 130 Cb 1.21 0.58 -0.36 0.00 0.00 0.00 0.00 17.79 19.23 3fmz h ALA 130 CO 0.82 1.11 -0.77 0.34 0.00 0.00 0.00 179.25 180.75 3fmz s ASP 131 N -7.14 1.32 0.12 0.00 3.68 -0.99 -4.97 116.67 108.69 3fmz s ASP 131 Ca -0.20 -0.13 -0.03 0.00 2.13 0.00 0.00 52.55 54.33 3fmz s ASP 131 Cb 0.06 -0.49 -0.03 0.00 -1.45 0.00 0.00 42.92 41.01 3fmz s ASP 131 CO 0.79 -0.11 0.08 -0.94 0.13 0.00 0.00 175.17 175.12 3fmz s SER 132 N 1.40 0.29 0.07 -0.34 1.04 -1.26 0.68 113.70 115.56 3fmz s SER 132 Ca -0.03 -1.10 -0.08 0.00 0.48 0.00 0.00 55.95 55.21 3fmz s SER 132 Cb -0.13 0.30 -0.00 0.00 0.10 0.00 0.00 66.02 66.29 3fmz s SER 132 CO -0.03 -0.73 0.17 -0.72 0.98 0.00 0.00 173.24 172.91 3fmz s TYR 133 N -4.01 0.14 -0.19 5.02 -0.85 -0.55 -3.34 117.35 113.57 3fmz s TYR 133 Ca 0.20 -0.49 -0.19 0.00 -0.52 0.00 0.00 57.07 56.06 3fmz s TYR 133 Cb 0.07 -0.07 0.05 0.00 0.38 0.00 0.00 41.96 42.39 3fmz s TYR 133 CO -0.01 -0.48 0.53 0.45 -1.52 0.00 0.00 175.55 174.52 3fmz s SER 134 N -2.54 -0.55 0.11 -0.18 0.15 -1.11 -1.37 113.70 108.21 3fmz s SER 134 Ca 0.01 1.02 0.07 0.00 0.70 0.00 0.00 55.95 57.74 3fmz s SER 134 Cb 0.03 1.03 -0.04 0.00 -1.71 0.00 0.00 66.02 65.33 3fmz s SER 134 CO -0.08 -0.22 -0.09 -0.36 1.20 0.00 0.00 173.24 173.69 3fmz s PHE 135 N 0.13 2.77 -0.34 3.44 0.08 -1.19 -1.15 117.98 121.71 3fmz s PHE 135 Ca -0.01 -0.14 -0.08 0.00 0.12 0.00 0.00 56.93 56.81 3fmz s PHE 135 Cb -0.04 -1.44 0.03 0.00 -0.57 0.00 0.00 43.02 41.00 3fmz s PHE 135 CO 0.01 0.44 0.14 0.08 -0.10 0.00 0.00 175.22 175.79 3fmz s VAL 136 N -1.24 4.17 0.11 -0.44 1.01 -1.08 -1.86 120.40 121.07 3fmz s VAL 136 Ca 0.22 -0.89 -0.00 0.00 0.00 0.00 0.00 61.98 61.30 3fmz s VAL 136 Cb -0.11 -3.29 -0.04 0.00 0.00 0.00 0.00 36.38 32.94 3fmz s VAL 136 CO 0.14 -0.13 0.27 -0.36 0.00 0.00 0.00 175.10 175.03 3fmz s PHE 137 N 1.49 3.50 -0.01 5.22 0.08 0.58 -0.70 117.98 128.14 3fmz s PHE 137 Ca 0.01 0.28 -0.00 0.00 0.12 0.00 0.00 56.93 57.33 3fmz s PHE 137 Cb -0.19 -1.79 0.00 0.00 -0.57 0.00 0.00 43.02 40.48 3fmz s PHE 137 CO 0.04 0.52 0.02 0.45 -0.10 0.00 0.00 175.22 176.15 3fmz s SER 138 N -2.74 -0.01 0.50 1.36 0.15 0.03 -2.28 113.70 110.71 3fmz s SER 138 Ca 0.36 0.03 0.29 0.00 0.70 0.00 0.00 55.95 57.33 3fmz s SER 138 Cb -0.12 0.02 0.96 0.00 -1.71 0.00 0.00 66.02 65.17 3fmz s SER 138 CO 0.28 -0.02 1.83 0.03 1.20 0.00 0.00 173.24 176.56 3fmz h ARG 139 N 6.25 0.00 -4.88 5.44 2.47 -1.82 0.39 114.38 122.23 3fmz h ARG 139 Ca -0.26 0.00 -0.67 0.00 -1.26 0.00 0.00 59.98 57.78 3fmz h ARG 139 Cb 1.20 0.00 -0.36 0.00 -1.65 0.00 0.00 29.97 29.16 3fmz h ARG 139 CO 0.50 0.02 -0.79 0.34 0.56 0.00 0.00 179.97 180.60 3fmz s ASP 140 N -5.92 4.36 0.00 7.04 -1.08 -1.26 -4.81 116.67 115.00 3fmz s ASP 140 Ca 0.03 -1.26 0.16 0.00 -0.52 0.00 0.00 52.55 50.96 3fmz s ASP 140 Cb 0.08 -1.58 0.90 0.00 -1.46 0.00 0.00 42.92 40.86 3fmz s ASP 140 CO 0.60 -0.18 1.36 -0.81 0.52 0.00 0.00 175.17 176.66 3fmz n PRO 141 N 4.50 0.44 0.00 4.34 -0.04 -1.26 -1.47 135.00 141.51 3fmz n PRO 141 Ca -0.15 0.02 0.13 0.00 -0.04 0.00 0.00 63.50 63.47 3fmz n PRO 141 Cb 0.43 -1.50 0.38 0.00 -0.04 0.00 0.00 33.50 32.77 3fmz n PRO 141 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 3fmz n ASN 142 N -1.05 1.28 0.00 3.54 3.02 -1.26 -5.04 115.26 115.75 3fmz n ASN 142 Ca 0.11 -1.12 0.00 0.00 -0.03 0.00 0.00 54.58 53.54 3fmz n ASN 142 Cb 0.06 0.12 0.00 0.00 -0.61 0.00 0.00 39.78 39.35 3fmz n ASN 142 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3fmz n GLY 143 N 1.30 0.77 3.63 7.41 0.00 -0.54 -5.11 105.19 112.65 3fmz n GLY 143 Ca 0.14 -2.19 -0.27 0.00 0.00 0.00 0.00 46.02 43.71 3fmz n GLY 143 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3fmz s LEU 144 N 0.00 3.18 0.79 0.99 1.43 -1.26 -4.60 118.68 119.21 3fmz s LEU 144 Ca 0.00 -0.47 -0.12 0.00 -1.03 0.00 0.00 54.13 52.51 3fmz s LEU 144 Cb 0.00 -1.84 0.07 0.00 0.03 0.00 0.00 46.19 44.45 3fmz s LEU 144 CO 0.00 0.09 1.12 -2.84 0.23 0.00 0.00 176.35 174.95 3fmz s PRO 145 N -2.91 2.12 0.14 1.29 0.02 -1.26 -4.79 135.00 129.60 3fmz s PRO 145 Ca 0.26 0.45 -0.18 0.00 0.02 0.00 0.00 61.00 61.56 3fmz s PRO 145 Cb -0.09 -1.94 -0.01 0.00 0.02 0.00 0.00 34.50 32.49 3fmz s PRO 145 CO 0.17 -1.56 1.74 -1.35 -0.33 0.00 0.00 177.00 175.68 3fmz h PRO 146 N -1.04 0.18 -0.90 5.54 0.11 -2.00 0.55 132.00 134.44 3fmz h PRO 146 Ca -0.47 -0.01 0.18 0.00 0.11 0.00 0.00 66.00 65.81 3fmz h PRO 146 Cb 1.28 -0.04 -0.17 0.00 0.11 0.00 0.00 31.00 32.18 3fmz h PRO 146 CO 0.62 0.12 -0.24 1.49 -0.21 0.00 0.00 178.00 179.78 3fmz h GLU 147 N 0.18 -0.00 0.00 1.05 4.57 -2.00 -1.45 114.58 116.93 3fmz h GLU 147 Ca 0.11 0.00 -0.15 0.00 -1.18 0.00 0.00 59.36 58.15 3fmz h GLU 147 Cb 0.09 0.00 0.01 0.00 -0.16 0.00 0.00 28.75 28.70 3fmz h GLU 147 CO -0.13 -0.00 -0.57 0.00 -1.18 0.00 0.00 179.01 177.13 3fmz h ALA 148 N 1.84 0.07 -0.89 2.92 0.00 -1.58 -2.98 119.26 118.64 3fmz h ALA 148 Ca 0.42 -0.56 0.19 0.00 0.00 0.00 0.00 54.91 54.96 3fmz h ALA 148 Cb 0.65 0.03 -0.07 0.00 0.00 0.00 0.00 17.79 18.41 3fmz h ALA 148 CO -0.93 0.33 0.59 1.96 0.00 0.00 0.00 179.25 181.19 3fmz h GLN 149 N -0.15 0.45 -0.16 0.00 4.20 -0.46 -1.27 115.11 117.71 3fmz h GLN 149 Ca -0.07 -0.03 -0.06 0.00 0.06 0.00 0.00 58.65 58.55 3fmz h GLN 149 Cb 1.29 -0.10 -0.00 0.00 0.30 0.00 0.00 27.48 28.97 3fmz h GLN 149 CO 0.11 0.29 -0.15 -0.22 -0.67 0.00 0.00 178.83 178.20 3fmz h LYS 150 N 0.46 0.39 -0.20 1.46 3.11 -1.18 -1.43 116.57 119.18 3fmz h LYS 150 Ca 0.47 -0.20 -0.15 0.00 -2.81 0.00 0.00 60.65 57.95 3fmz h LYS 150 Cb 1.08 0.00 -0.01 0.00 -1.00 0.00 0.00 32.23 32.30 3fmz h LYS 150 CO -0.19 0.76 -0.50 0.82 -2.81 0.00 0.00 179.45 177.53 3fmz h ILE 151 N 0.04 1.32 0.32 2.00 2.04 -1.24 -2.72 117.51 119.27 3fmz h ILE 151 Ca 0.03 -1.72 -0.02 0.00 1.00 0.00 0.00 64.86 64.15 3fmz h ILE 151 Cb 0.68 1.71 0.00 0.00 -0.74 0.00 0.00 36.82 38.47 3fmz h ILE 151 CO 0.04 0.53 -0.15 0.58 0.00 0.00 0.00 178.15 179.15 3fmz h VAL 152 N 0.42 0.70 -0.85 1.67 2.07 -1.24 -2.35 116.25 116.67 3fmz h VAL 152 Ca 0.02 -0.09 0.18 0.00 0.82 0.00 0.00 66.70 67.63 3fmz h VAL 152 Cb 1.02 0.75 -0.11 0.00 -1.52 0.00 0.00 31.29 31.43 3fmz h VAL 152 CO 0.09 0.02 0.40 -0.09 0.02 0.00 0.00 177.57 178.01 3fmz h ARG 153 N -0.48 0.49 -0.05 1.57 2.43 -1.13 -0.53 114.38 116.68 3fmz h ARG 153 Ca -0.04 -0.03 -0.19 0.00 -0.81 0.00 0.00 59.98 58.91 3fmz h ARG 153 Cb 0.36 -0.11 -0.00 0.00 -0.42 0.00 0.00 29.97 29.80 3fmz h ARG 153 CO 0.07 0.32 -0.78 0.37 -1.51 0.00 0.00 179.97 178.44 3fmz h GLN 154 N 0.50 0.36 -0.26 0.20 5.75 -1.35 -2.97 115.11 117.34 3fmz h GLN 154 Ca 0.50 -0.32 -0.05 0.00 -0.15 0.00 0.00 58.65 58.62 3fmz h GLN 154 Cb 0.82 0.08 -0.01 0.00 1.07 0.00 0.00 27.48 29.43 3fmz h GLN 154 CO -0.44 0.98 -0.02 0.00 -2.65 0.00 0.00 178.83 176.70 3fmz h ARG 155 N 0.24 0.48 -0.03 1.69 2.47 -0.81 -2.19 114.38 116.23 3fmz h ARG 155 Ca -0.04 -0.16 0.02 0.00 -1.26 0.00 0.00 59.98 58.54 3fmz h ARG 155 Cb 1.37 -0.04 -0.05 0.00 -1.65 0.00 0.00 29.97 29.61 3fmz h ARG 155 CO 0.13 0.66 -0.43 1.96 0.56 0.00 0.00 179.97 182.85 3fmz h GLN 156 N 0.25 -0.50 -0.90 0.04 4.20 -1.08 0.41 115.11 117.53 3fmz h GLN 156 Ca 0.07 0.03 0.24 0.00 0.06 0.00 0.00 58.65 59.05 3fmz h GLN 156 Cb 0.46 0.11 -0.17 0.00 0.30 0.00 0.00 27.48 28.18 3fmz h GLN 156 CO 0.02 -0.33 -0.03 -1.91 -0.67 0.00 0.00 178.83 175.91 3fmz n GLU 157 N -4.84 -0.07 0.01 1.46 4.07 -1.13 0.24 120.64 120.38 3fmz n GLU 157 Ca -0.06 1.36 0.02 0.00 -0.06 0.00 0.00 57.16 58.43 3fmz n GLU 157 Cb 0.31 -2.14 0.36 0.00 -0.06 0.00 0.00 31.44 29.91 3fmz n GLU 157 CO 0.00 0.00 0.00 0.93 -0.06 0.00 0.00 177.13 178.00 3fmz h GLU 158 N 0.00 0.52 -0.00 5.31 3.07 0.40 -1.15 114.58 122.73 3fmz h GLU 158 Ca 0.53 -0.07 0.00 0.00 -0.50 0.00 0.00 59.36 59.32 3fmz h GLU 158 Cb 1.04 -0.10 0.00 0.00 -0.84 0.00 0.00 28.75 28.86 3fmz h GLU 158 CO -0.87 0.45 -0.06 1.28 -1.40 0.00 0.00 179.01 178.41 3fmz n LEU 159 N -4.38 0.22 -2.98 1.33 4.77 0.14 -4.91 117.00 111.18 3fmz n LEU 159 Ca 0.02 0.17 -0.15 0.00 -0.03 0.00 0.00 56.01 56.02 3fmz n LEU 159 Cb 0.15 -0.25 0.07 0.00 -2.33 0.00 0.00 43.42 41.07 3fmz n LEU 159 CO 0.37 0.04 0.11 0.00 -1.33 0.00 0.00 177.39 176.58 3fmz n LEU 161 N -3.67 0.85 -4.76 0.00 4.77 -1.18 -5.02 117.00 108.00 3fmz n LEU 161 Ca -0.18 -0.85 -0.41 0.00 -0.03 0.00 0.00 56.01 54.53 3fmz n LEU 161 Cb 0.62 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.70 3fmz n LEU 161 CO 0.50 0.21 1.17 0.00 -1.33 0.00 0.00 177.39 177.94 3fmz s ALA 162 N -0.39 3.65 0.00 -1.18 0.00 -1.26 -1.03 121.76 121.56 3fmz s ALA 162 Ca 0.00 1.50 0.00 0.00 0.00 0.00 0.00 51.96 53.46 3fmz s ALA 162 Cb 0.00 -3.61 0.00 0.00 0.00 0.00 0.00 23.12 19.51 3fmz s ALA 162 CO 0.00 -0.93 0.00 0.54 0.00 0.00 0.00 175.76 175.37 3fmz n ARG 163 N 1.57 0.00 0.01 0.00 1.74 -1.26 -4.84 116.66 113.88 3fmz n ARG 163 Ca 0.05 0.00 0.11 0.00 -0.77 0.00 0.00 57.85 57.24 3fmz n ARG 163 Cb 0.39 -0.89 0.07 0.00 -1.02 0.00 0.00 32.46 31.01 3fmz n ARG 163 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 3fmz n GLN 164 N -2.00 0.07 -1.75 5.56 6.02 -0.20 -4.92 117.38 120.17 3fmz n GLN 164 Ca 0.00 -0.00 -0.29 0.00 -0.01 0.00 0.00 57.00 56.70 3fmz n GLN 164 Cb 0.00 -1.52 0.10 0.00 1.02 0.00 0.00 30.24 29.84 3fmz n GLN 164 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 177.06 176.76 3fmz s TYR 165 N -3.05 2.83 -0.03 1.08 2.02 -1.24 -4.70 117.35 114.25 3fmz s TYR 165 Ca 0.08 0.85 -0.20 0.00 -0.37 0.00 0.00 57.07 57.43 3fmz s TYR 165 Cb 0.16 -3.39 0.04 0.00 -0.40 0.00 0.00 41.96 38.37 3fmz s TYR 165 CO 0.78 -1.92 0.43 -0.98 -1.57 0.00 0.00 175.55 172.29 3fmz s ARG 166 N -5.42 0.78 0.44 -0.62 1.70 -0.32 -4.91 118.95 110.60 3fmz s ARG 166 Ca 0.62 -0.00 -0.23 0.00 -0.47 0.00 0.00 55.73 55.65 3fmz s ARG 166 Cb -0.13 0.36 -0.08 0.00 -0.57 0.00 0.00 34.95 34.53 3fmz s ARG 166 CO 0.51 -0.22 1.11 -0.51 -1.08 0.00 0.00 175.30 175.11 3fmz s LEU 167 N -1.19 4.04 -0.23 -1.89 1.43 -1.26 -1.61 118.68 117.97 3fmz s LEU 167 Ca -0.12 2.18 -0.10 0.00 -1.03 0.00 0.00 54.13 55.06 3fmz s LEU 167 Cb -0.04 -4.25 -0.05 0.00 0.03 0.00 0.00 46.19 41.89 3fmz s LEU 167 CO 0.06 -0.75 0.14 -0.63 0.23 0.00 0.00 176.35 175.40 3fmz s ILE 168 N -1.62 5.22 0.30 -0.59 1.01 -0.62 -4.91 121.20 119.98 3fmz s ILE 168 Ca 0.62 0.13 -0.29 0.00 0.00 0.00 0.00 60.65 61.11 3fmz s ILE 168 Cb -0.25 -3.42 -0.10 0.00 0.01 0.00 0.00 42.46 38.70 3fmz s ILE 168 CO 0.31 0.36 1.32 -0.69 0.00 0.00 0.00 174.94 176.24 3fmz s VAL 169 N 1.00 2.78 -0.47 2.92 1.01 -1.26 -4.85 120.40 121.54 3fmz s VAL 169 Ca 0.07 0.75 0.09 0.00 0.00 0.00 0.00 61.98 62.88 3fmz s VAL 169 Cb -0.13 -3.48 0.36 0.00 0.00 0.00 0.00 36.38 33.13 3fmz s VAL 169 CO 0.04 0.16 0.87 1.41 0.00 0.00 0.00 175.10 177.58 3fmz n HIS 170 N 1.25 2.29 -0.64 5.22 8.25 -1.26 -0.35 115.22 129.98 3fmz n HIS 170 Ca 0.02 -3.79 -0.08 0.00 -0.26 0.00 0.00 57.72 53.60 3fmz n HIS 170 Cb 0.42 -0.43 0.02 0.00 1.12 0.00 0.00 29.99 31.12 3fmz n HIS 170 CO 0.00 0.00 0.00 0.27 0.64 0.00 0.00 176.34 177.25 3fmz n ASN 171 N -0.04 5.79 -2.59 0.41 0.23 -1.26 -4.83 115.26 112.96 3fmz n ASN 171 Ca 0.28 -2.72 -0.14 0.00 -0.53 0.00 0.00 54.58 51.48 3fmz n ASN 171 Cb 0.54 -1.07 -0.03 0.00 -2.08 0.00 0.00 39.78 37.15 3fmz n ASN 171 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3fmz n GLY 172 N 0.90 -0.28 0.30 4.83 0.00 -1.26 -4.79 105.19 104.89 3fmz n GLY 172 Ca 0.15 0.02 -0.16 0.00 0.00 0.00 0.00 46.02 46.03 3fmz n GLY 172 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 3fmz h TYR 173 N -0.27 -0.68 0.00 1.61 3.20 -1.97 -3.54 116.97 115.31 3fmz h TYR 173 Ca -0.19 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.67 3fmz h TYR 173 Cb 0.75 0.23 0.00 0.00 1.54 0.00 0.00 36.73 39.26 3fmz h TYR 173 CO 0.51 -0.41 0.00 0.00 -1.64 0.00 0.00 178.16 176.62