#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gfd n SER 2 N 0.00 -1.15 -4.18 1.61 2.88 -1.26 -5.14 113.62 106.39 1gfd n SER 2 Ca 0.00 -1.95 -0.36 0.00 -1.33 0.00 0.00 58.87 55.23 1gfd n SER 2 Cb 0.00 0.49 0.06 0.00 -0.75 0.00 0.00 64.21 64.01 1gfd n SER 2 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 1gfd n THR 3 N -0.93 0.20 0.00 2.46 -2.24 -1.26 -4.99 114.28 107.52 1gfd n THR 3 Ca -0.18 -0.42 0.00 0.00 -2.27 0.00 0.00 64.05 61.18 1gfd n THR 3 Cb 0.77 -0.22 0.00 0.00 -2.10 0.00 0.00 70.33 68.78 1gfd n THR 3 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 1gfd n TYR 4 N -2.61 0.00 -3.73 4.78 4.01 -1.26 -4.44 117.16 113.92 1gfd n TYR 4 Ca 0.03 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.77 1gfd n TYR 4 Cb 0.54 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.57 1gfd n TYR 4 CO 0.00 0.00 0.00 1.33 -0.46 0.00 0.00 176.86 177.73 1gfd n VAL 5 N -0.04 0.00 -3.50 -0.72 0.24 -0.94 -1.17 118.33 112.20 1gfd n VAL 5 Ca 0.00 0.00 -0.22 0.00 -2.04 0.00 0.00 64.34 62.08 1gfd n VAL 5 Cb 0.00 0.00 -0.13 0.00 -1.47 0.00 0.00 33.84 32.24 1gfd n VAL 5 CO 0.00 0.00 0.00 -1.10 -2.14 0.00 0.00 176.83 173.59 1gfd s GLN 6 N -1.75 0.20 -0.35 7.34 -0.21 -0.24 -3.58 119.66 121.08 1gfd s GLN 6 Ca 0.00 -0.10 -0.31 0.00 0.02 0.00 0.00 55.36 54.98 1gfd s GLN 6 Cb 0.00 -1.17 -0.13 0.00 1.00 0.00 0.00 33.01 32.70 1gfd s GLN 6 CO 0.00 -0.83 1.42 0.00 -2.12 0.00 0.00 175.29 173.76 1gfd n ALA 7 N 5.29 -0.03 -0.14 6.09 0.00 0.75 -2.57 120.51 129.91 1gfd n ALA 7 Ca -0.05 0.17 -0.03 0.00 0.00 0.00 0.00 53.44 53.52 1gfd n ALA 7 Cb 0.47 -1.42 0.18 0.00 0.00 0.00 0.00 19.45 18.67 1gfd n ALA 7 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1gfd h LEU 8 N 5.76 0.79 0.00 0.00 6.46 -0.29 0.20 115.31 128.23 1gfd h LEU 8 Ca -0.11 -0.15 -0.11 0.00 -0.12 0.00 0.00 57.88 57.39 1gfd h LEU 8 Cb 0.98 -0.21 -0.03 0.00 -0.73 0.00 0.00 40.66 40.67 1gfd h LEU 8 CO 0.74 0.79 -0.07 0.49 -0.62 0.00 0.00 178.44 179.77 1gfd n PHE 9 N -4.26 -0.73 -2.69 1.25 3.01 -1.21 -4.79 117.46 108.05 1gfd n PHE 9 Ca 0.04 -0.89 -0.42 0.00 1.01 0.00 0.00 57.45 57.18 1gfd n PHE 9 Cb 0.24 0.19 -0.03 0.00 -0.01 0.00 0.00 39.48 39.87 1gfd n PHE 9 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 1gfd s ASP 10 N -1.81 7.33 -0.28 4.37 1.01 -1.26 -2.65 116.67 123.37 1gfd s ASP 10 Ca 0.11 1.66 0.01 0.00 0.71 0.00 0.00 52.55 55.04 1gfd s ASP 10 Cb -0.00 -2.57 0.06 0.00 1.01 0.00 0.00 42.92 41.42 1gfd s ASP 10 CO 0.08 -0.31 -0.05 0.12 0.21 0.00 0.00 175.17 175.22 1gfd s PHE 11 N 1.21 3.28 0.07 4.23 5.36 -1.11 -4.93 117.98 126.10 1gfd s PHE 11 Ca 0.52 -2.12 -0.28 0.00 -0.96 0.00 0.00 56.93 54.08 1gfd s PHE 11 Cb -0.21 -2.06 -0.05 0.00 -0.34 0.00 0.00 43.02 40.35 1gfd s PHE 11 CO 0.26 -0.85 0.90 -0.51 -1.46 0.00 0.00 175.22 173.56 1gfd s ASP 12 N 1.18 7.38 0.23 6.13 1.11 -1.26 -2.72 116.67 128.72 1gfd s ASP 12 Ca -0.06 1.65 0.03 0.00 0.18 0.00 0.00 52.55 54.35 1gfd s ASP 12 Cb -0.20 -2.54 0.61 0.00 1.07 0.00 0.00 42.92 41.85 1gfd s ASP 12 CO -0.03 -0.07 1.13 -2.65 1.18 0.00 0.00 175.17 174.73 1gfd n PRO 13 N 2.99 -0.06 -0.60 8.23 -0.02 -1.25 -4.64 135.00 139.66 1gfd n PRO 13 Ca 0.01 1.07 0.00 0.00 -2.02 0.00 0.00 63.50 62.57 1gfd n PRO 13 Cb 0.50 -1.73 0.00 0.00 -0.02 0.00 0.00 33.50 32.25 1gfd n PRO 13 CO 0.00 0.00 0.00 0.94 1.98 0.00 0.00 175.50 178.42 1gfd n GLN 14 N -4.95 -0.55 -3.73 -0.52 7.27 -1.26 -4.80 117.38 108.84 1gfd n GLN 14 Ca 0.18 0.13 -0.13 0.00 0.07 0.00 0.00 57.00 57.26 1gfd n GLN 14 Cb 0.61 -4.44 -0.10 0.00 2.41 0.00 0.00 30.24 28.71 1gfd n GLN 14 CO 0.00 0.00 0.00 -1.21 0.07 0.00 0.00 177.06 175.92 1gfd s GLU 15 N -1.20 0.44 -0.16 3.69 0.41 -1.26 -5.02 118.70 115.60 1gfd s GLU 15 Ca 0.00 0.59 0.01 0.00 -0.41 0.00 0.00 54.97 55.16 1gfd s GLU 15 Cb 0.00 0.16 0.22 0.00 -1.78 0.00 0.00 34.13 32.74 1gfd s GLU 15 CO 0.00 -0.08 1.38 -0.25 -0.49 0.00 0.00 175.26 175.82 1gfd n ASP 16 N 3.18 3.50 -0.02 -0.19 9.92 -1.26 -3.29 116.55 128.40 1gfd n ASP 16 Ca -0.15 -2.58 0.00 0.00 -0.53 0.00 0.00 54.79 51.52 1gfd n ASP 16 Cb 0.57 -0.66 0.00 0.00 -0.64 0.00 0.00 41.12 40.39 1gfd n ASP 16 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1gfd n GLY 17 N -0.01 0.17 2.75 0.44 0.00 -1.26 -5.13 105.19 102.15 1gfd n GLY 17 Ca 0.21 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.98 1gfd n GLY 17 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1gfd n GLU 18 N 0.00 1.07 -1.71 1.61 0.28 -1.21 -4.71 120.64 115.97 1gfd n GLU 18 Ca 0.00 -2.80 -0.31 0.00 -0.16 0.00 0.00 57.16 53.89 1gfd n GLU 18 Cb 0.50 0.75 0.04 0.00 1.43 0.00 0.00 31.44 34.17 1gfd n GLU 18 CO 0.00 0.00 0.00 -1.17 -0.16 0.00 0.00 177.13 175.80 1gfd s LEU 19 N 0.00 3.02 -0.16 -1.84 2.96 -0.70 -4.80 118.68 117.16 1gfd s LEU 19 Ca 0.00 1.42 -0.09 0.00 -0.22 0.00 0.00 54.13 55.24 1gfd s LEU 19 Cb 0.00 -4.29 0.05 0.00 0.50 0.00 0.00 46.19 42.46 1gfd s LEU 19 CO 0.00 -1.35 0.38 -0.83 -1.32 0.00 0.00 176.35 173.23 1gfd s GLY 20 N -4.03 -0.29 0.00 7.98 0.00 -1.26 -3.75 107.32 105.97 1gfd s GLY 20 Ca 0.58 1.37 0.00 0.00 0.00 0.00 0.00 44.72 46.67 1gfd s GLY 20 CO 0.54 1.50 0.00 1.97 0.00 0.00 0.00 173.10 177.11 1gfd n PHE 21 N 4.04 -0.53 -3.78 1.90 -1.74 -1.10 -4.86 117.46 111.39 1gfd n PHE 21 Ca -0.22 0.00 -0.14 0.00 -0.56 0.00 0.00 57.45 56.52 1gfd n PHE 21 Cb 0.55 0.00 -0.16 0.00 1.52 0.00 0.00 39.48 41.40 1gfd n PHE 21 CO 0.00 0.00 0.00 1.03 -0.56 0.00 0.00 176.76 177.23 1gfd s ARG 22 N -1.53 -0.02 0.00 3.97 1.81 -1.26 -2.74 118.95 119.18 1gfd s ARG 22 Ca 0.00 0.19 0.00 0.00 -1.72 0.00 0.00 55.73 54.20 1gfd s ARG 22 Cb 0.00 -0.21 0.00 0.00 -0.45 0.00 0.00 34.95 34.29 1gfd s ARG 22 CO 0.00 -0.15 0.00 -2.13 -0.68 0.00 0.00 175.30 172.34 1gfd n ARG 23 N 4.05 0.00 0.00 3.54 0.00 -1.09 -0.72 116.66 122.44 1gfd n ARG 23 Ca -0.26 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.59 1gfd n ARG 23 Cb 0.51 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.97 1gfd n ARG 23 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1gfd n GLY 24 N 0.00 3.05 3.66 5.14 0.00 0.71 -4.86 105.19 112.88 1gfd n GLY 24 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1gfd n GLY 24 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1gfd s ASP 25 N -0.72 6.37 -0.56 1.61 1.11 0.10 -4.30 116.67 120.27 1gfd s ASP 25 Ca 0.00 2.61 -0.28 0.00 0.18 0.00 0.00 52.55 55.06 1gfd s ASP 25 Cb 0.00 -2.53 0.02 0.00 1.07 0.00 0.00 42.92 41.48 1gfd s ASP 25 CO 0.00 -1.13 1.37 -0.36 1.18 0.00 0.00 175.17 176.23 1gfd s PHE 26 N 4.76 2.35 0.36 4.23 0.40 -1.26 -0.18 117.98 128.64 1gfd s PHE 26 Ca 0.89 0.46 -0.26 0.00 -0.60 0.00 0.00 56.93 57.42 1gfd s PHE 26 Cb -0.42 -4.42 -0.09 0.00 0.51 0.00 0.00 43.02 38.60 1gfd s PHE 26 CO 0.41 -1.90 1.05 -1.50 0.70 0.00 0.00 175.22 173.98 1gfd s ILE 27 N 5.81 3.72 -0.53 0.64 1.10 -1.23 -4.72 121.20 125.98 1gfd s ILE 27 Ca 0.50 1.42 -0.12 0.00 -0.51 0.00 0.00 60.65 61.95 1gfd s ILE 27 Cb -0.10 -3.78 0.13 0.00 0.15 0.00 0.00 42.46 38.86 1gfd s ILE 27 CO 0.25 0.11 0.44 -2.28 -2.11 0.00 0.00 174.94 171.35 1gfd s HIS 28 N -1.53 3.39 -0.76 3.50 5.65 0.65 -2.20 115.29 123.98 1gfd s HIS 28 Ca 0.54 -1.71 -0.26 0.00 0.25 0.00 0.00 55.06 53.88 1gfd s HIS 28 Cb -0.24 -3.62 -0.09 0.00 -1.18 0.00 0.00 32.58 27.45 1gfd s HIS 28 CO 0.30 -1.00 2.21 0.08 -0.65 0.00 0.00 174.74 175.68 1gfd s VAL 29 N 1.30 3.18 0.23 0.89 1.01 -1.26 -1.83 120.40 123.92 1gfd s VAL 29 Ca 0.06 -0.10 -0.02 0.00 0.00 0.00 0.00 61.98 61.93 1gfd s VAL 29 Cb -0.26 -3.42 0.02 0.00 0.00 0.00 0.00 36.38 32.72 1gfd s VAL 29 CO -0.00 -0.40 1.63 0.24 0.00 0.00 0.00 175.10 176.56 1gfd h MET 30 N 13.48 0.61 -0.79 2.72 2.86 -1.34 -3.42 114.93 129.04 1gfd h MET 30 Ca -0.03 -0.27 0.01 0.00 -2.06 0.00 0.00 59.70 57.35 1gfd h MET 30 Cb 1.06 -0.01 -0.19 0.00 0.06 0.00 0.00 31.60 32.51 1gfd h MET 30 CO 1.11 0.85 -0.34 0.34 1.06 0.00 0.00 176.91 179.94 1gfd s ASP 31 N -6.82 -1.23 -0.54 1.22 2.15 -0.90 -5.02 116.67 105.52 1gfd s ASP 31 Ca -0.08 -0.42 -0.26 0.00 0.43 0.00 0.00 52.55 52.22 1gfd s ASP 31 Cb 0.13 1.62 -0.08 0.00 -0.30 0.00 0.00 42.92 44.28 1gfd s ASP 31 CO 0.82 -0.16 2.43 -0.46 -0.17 0.00 0.00 175.17 177.64 1gfd n ASN 32 N 4.51 2.15 0.00 -0.34 0.23 -1.26 -3.27 115.26 117.27 1gfd n ASN 32 Ca 0.09 -0.55 0.00 0.00 -0.53 0.00 0.00 54.58 53.59 1gfd n ASN 32 Cb 0.58 -1.55 0.00 0.00 -2.08 0.00 0.00 39.78 36.73 1gfd n ASN 32 CO 0.00 0.00 0.00 -1.20 -0.93 0.00 0.00 177.26 175.13 1gfd n SER 33 N 15.84 0.00 -4.72 0.53 7.64 -1.26 -4.97 113.62 126.68 1gfd n SER 33 Ca 0.40 0.00 -0.32 0.00 1.01 0.00 0.00 58.87 59.96 1gfd n SER 33 Cb 0.51 0.00 0.12 0.00 -1.01 0.00 0.00 64.21 63.83 1gfd n SER 33 CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 1gfd s ASP 34 N -1.00 3.83 0.00 6.43 1.11 -0.73 -4.98 116.67 121.34 1gfd s ASP 34 Ca 0.00 2.11 -0.05 0.00 0.18 0.00 0.00 52.55 54.79 1gfd s ASP 34 Cb 0.00 -2.56 -0.03 0.00 1.07 0.00 0.00 42.92 41.41 1gfd s ASP 34 CO 0.00 -2.49 0.87 1.55 1.18 0.00 0.00 175.17 176.27 1gfd h PRO 35 N -1.15 -0.16 -0.06 8.23 0.13 -2.02 -3.24 132.00 133.73 1gfd h PRO 35 Ca -0.45 0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 1gfd h PRO 35 Cb 1.26 0.04 0.00 0.00 0.13 0.00 0.00 31.00 32.43 1gfd h PRO 35 CO 0.47 -0.11 0.00 -1.71 -0.23 0.00 0.00 178.00 176.42 1gfd n ASN 36 N -2.54 0.70 -3.99 1.44 5.15 -1.26 -4.69 115.26 110.06 1gfd n ASN 36 Ca -0.02 -1.50 -0.14 0.00 -0.60 0.00 0.00 54.58 52.32 1gfd n ASN 36 Cb 0.07 -0.04 -0.13 0.00 -0.53 0.00 0.00 39.78 39.15 1gfd n ASN 36 CO 0.00 0.00 0.00 0.26 1.40 0.00 0.00 177.26 178.92 1gfd s TRP 37 N -1.92 0.50 0.23 1.20 0.52 -1.22 0.56 118.94 118.81 1gfd s TRP 37 Ca 0.31 -0.27 -0.03 0.00 0.02 0.00 0.00 56.10 56.14 1gfd s TRP 37 Cb 0.16 -0.31 -0.03 0.00 -1.15 0.00 0.00 33.47 32.13 1gfd s TRP 37 CO 0.25 -0.05 0.24 -1.58 0.02 0.00 0.00 176.95 175.84 1gfd s TRP 38 N -0.67 1.06 -0.15 -1.98 0.51 -0.87 -1.78 118.94 115.06 1gfd s TRP 38 Ca -0.04 -1.27 -0.03 0.00 -2.12 0.00 0.00 56.10 52.64 1gfd s TRP 38 Cb -0.05 -0.39 -0.02 0.00 -0.81 0.00 0.00 33.47 32.19 1gfd s TRP 38 CO 0.00 -0.77 -0.06 0.21 -0.51 0.00 0.00 176.95 175.82 1gfd s LYS 39 N -3.97 3.59 0.00 4.98 2.20 -1.20 -1.81 119.74 123.52 1gfd s LYS 39 Ca 0.35 -0.55 0.00 0.00 -0.36 0.00 0.00 55.97 55.41 1gfd s LYS 39 Cb 0.04 -2.85 0.00 0.00 -1.51 0.00 0.00 37.83 33.52 1gfd s LYS 39 CO 0.14 0.25 0.00 0.41 -0.36 0.00 0.00 175.35 175.79 1gfd n GLY 40 N 3.48 3.48 3.48 5.54 0.00 -0.18 -0.94 105.19 120.04 1gfd n GLY 40 Ca -0.18 -0.68 -0.14 0.00 0.00 0.00 0.00 46.02 45.03 1gfd n GLY 40 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1gfd s ALA 41 N -1.13 -1.72 0.20 4.61 0.00 -0.76 -1.38 121.76 121.58 1gfd s ALA 41 Ca 0.00 0.96 -0.22 0.00 0.00 0.00 0.00 51.96 52.71 1gfd s ALA 41 Cb 0.00 0.36 0.07 0.00 0.00 0.00 0.00 23.12 23.55 1gfd s ALA 41 CO 0.00 -0.57 1.02 0.00 0.00 0.00 0.00 175.76 176.21 1gfd n HIS 43 N -0.69 -1.27 -2.31 0.00 -0.00 -1.26 0.16 115.22 109.85 1gfd n HIS 43 Ca -0.03 0.00 -0.01 0.00 -0.00 0.00 0.00 57.72 57.68 1gfd n HIS 43 Cb 0.59 -1.13 0.00 0.00 -0.00 0.00 0.00 29.99 29.45 1gfd n HIS 43 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 1gfd n GLY 44 N -0.18 0.65 3.58 -1.39 0.00 -1.26 -5.06 105.19 101.53 1gfd n GLY 44 Ca -0.01 -0.73 -0.16 0.00 0.00 0.00 0.00 46.02 45.12 1gfd n GLY 44 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1gfd s GLN 45 N -4.61 0.92 0.58 1.61 -0.21 0.42 -5.17 119.66 113.19 1gfd s GLN 45 Ca 0.01 0.68 0.01 0.00 0.02 0.00 0.00 55.36 56.09 1gfd s GLN 45 Cb -0.01 0.44 0.11 0.00 1.00 0.00 0.00 33.01 34.56 1gfd s GLN 45 CO 0.02 -0.19 0.79 0.25 -2.12 0.00 0.00 175.29 174.04 1gfd n THR 46 N 1.94 0.00 -1.40 -0.19 -2.24 -1.26 -0.06 114.28 111.07 1gfd n THR 46 Ca -0.16 -1.33 0.00 0.00 -2.27 0.00 0.00 64.05 60.29 1gfd n THR 46 Cb 0.56 -0.92 0.00 0.00 -2.10 0.00 0.00 70.33 67.86 1gfd n THR 46 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1gfd n GLY 47 N -1.18 0.35 3.54 3.38 0.00 -0.48 -4.60 105.19 106.20 1gfd n GLY 47 Ca 0.13 -1.64 -0.30 0.00 0.00 0.00 0.00 46.02 44.21 1gfd n GLY 47 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1gfd s MET 48 N -2.00 2.12 -0.08 1.61 -1.94 -1.26 -1.01 119.30 116.74 1gfd s MET 48 Ca 0.00 -0.99 -0.16 0.00 -1.71 0.00 0.00 55.69 52.83 1gfd s MET 48 Cb 0.00 -2.28 0.03 0.00 2.01 0.00 0.00 34.83 34.60 1gfd s MET 48 CO 0.00 0.52 0.38 -0.59 -0.01 0.00 0.00 175.02 175.33 1gfd s PHE 49 N -1.10 -0.34 0.14 -0.03 -0.71 -0.75 -1.72 117.98 113.47 1gfd s PHE 49 Ca 0.19 0.69 -0.33 0.00 -1.04 0.00 0.00 56.93 56.44 1gfd s PHE 49 Cb -0.11 0.15 -0.13 0.00 -1.21 0.00 0.00 43.02 41.72 1gfd s PHE 49 CO 0.10 -0.34 1.69 -2.30 -1.34 0.00 0.00 175.22 173.03 1gfd n PRO 50 N 1.91 2.42 -0.04 1.99 -0.02 -1.26 -2.04 135.00 137.97 1gfd n PRO 50 Ca -0.18 0.88 0.01 0.00 -2.02 0.00 0.00 63.50 62.19 1gfd n PRO 50 Cb 0.57 -2.69 0.33 0.00 -0.02 0.00 0.00 33.50 31.68 1gfd n PRO 50 CO 0.00 0.00 0.00 -0.09 1.98 0.00 0.00 175.50 177.39 1gfd h ARG 51 N 6.88 0.61 -0.16 -0.52 1.12 -0.17 -2.26 114.38 119.88 1gfd h ARG 51 Ca -0.45 -0.08 0.00 0.00 -1.11 0.00 0.00 59.98 58.34 1gfd h ARG 51 Cb 1.24 -0.11 0.00 0.00 -0.01 0.00 0.00 29.97 31.08 1gfd h ARG 51 CO 0.92 0.51 0.00 0.09 -3.11 0.00 0.00 179.97 178.38 1gfd n ASN 52 N -4.37 0.16 -0.76 -3.80 4.13 -1.26 -2.43 115.26 106.94 1gfd n ASN 52 Ca 0.03 -1.51 0.07 0.00 1.68 0.00 0.00 54.58 54.86 1gfd n ASN 52 Cb 0.15 -0.08 0.16 0.00 -1.54 0.00 0.00 39.78 38.47 1gfd n ASN 52 CO 0.00 0.00 0.00 -1.22 0.28 0.00 0.00 177.26 176.32 1gfd n TYR 53 N -0.37 0.43 -4.30 3.10 4.02 -0.85 -4.92 117.16 114.27 1gfd n TYR 53 Ca 0.00 -0.35 -0.17 0.00 -0.01 0.00 0.00 57.90 57.37 1gfd n TYR 53 Cb 0.04 -0.01 -0.09 0.00 -0.02 0.00 0.00 39.34 39.25 1gfd n TYR 53 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 176.86 175.99 1gfd s VAL 54 N -1.06 0.27 -0.05 -0.72 -7.23 -1.02 0.41 120.40 111.00 1gfd s VAL 54 Ca 0.26 -2.00 -0.00 0.00 -1.81 0.00 0.00 61.98 58.43 1gfd s VAL 54 Cb 0.15 -2.53 0.03 0.00 0.56 0.00 0.00 36.38 34.58 1gfd s VAL 54 CO 0.20 0.00 -0.00 0.28 -0.31 0.00 0.00 175.10 175.26 1gfd s THR 55 N -3.75 0.31 0.37 5.32 -1.32 -1.06 -4.59 115.64 110.93 1gfd s THR 55 Ca 0.37 0.08 -0.27 0.00 -1.21 0.00 0.00 61.69 60.66 1gfd s THR 55 Cb 0.06 -0.43 -0.11 0.00 -1.51 0.00 0.00 72.50 70.50 1gfd s THR 55 CO 0.16 0.21 1.29 -2.65 -2.21 0.00 0.00 174.62 171.43 1gfd n PRO 56 N 4.61 2.09 -3.95 7.08 -0.02 -1.26 -1.07 135.00 142.47 1gfd n PRO 56 Ca -0.17 0.74 -0.16 0.00 -2.02 0.00 0.00 63.50 61.89 1gfd n PRO 56 Cb 0.50 -2.37 -0.16 0.00 -0.02 0.00 0.00 33.50 31.46 1gfd n PRO 56 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1gfd s VAL 57 N -1.14 0.19 0.00 -1.45 0.11 -0.32 -4.85 120.40 112.94 1gfd s VAL 57 Ca 0.57 0.03 0.00 0.00 -2.93 0.00 0.00 61.98 59.66 1gfd s VAL 57 Cb -0.54 -0.25 0.00 0.00 -1.53 0.00 0.00 36.38 34.06 1gfd s VAL 57 CO 0.61 0.12 0.00 -0.46 -3.33 0.00 0.00 175.10 172.04 1gfd n ASN 58 N 3.85 2.14 0.00 3.54 6.94 -1.26 -4.33 115.26 126.14 1gfd n ASN 58 Ca -0.24 0.00 0.00 0.00 -0.02 0.00 0.00 54.58 54.32 1gfd n ASN 58 Cb 0.52 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.94 1gfd n ASN 58 CO 0.00 0.00 0.00 -1.14 -1.03 0.00 0.00 177.26 175.09