#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 0.13 -4.56 1.61 7.64 -1.26 -5.06 113.62 112.12 1gfd n SER 2 Ca 0.00 -2.05 -0.27 0.00 1.01 0.00 0.00 58.87 57.56 1gfd n SER 2 Cb 0.00 0.01 -0.05 0.00 -1.01 0.00 0.00 64.21 63.16 1gfd n SER 2 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 1gfd s THR 3 N -0.92 3.19 -0.29 0.44 -4.23 -1.26 -4.85 115.64 107.72 1gfd s THR 3 Ca 0.19 -0.06 -0.24 0.00 -1.18 0.00 0.00 61.69 60.40 1gfd s THR 3 Cb 0.29 -3.45 0.16 0.00 1.34 0.00 0.00 72.50 70.83 1gfd s THR 3 CO -0.09 -0.43 1.22 -0.31 -0.54 0.00 0.00 174.62 174.47 1gfd s TYR 4 N 11.89 -0.28 0.00 3.99 2.02 -1.26 -4.01 117.35 129.69 1gfd s TYR 4 Ca 0.83 0.66 0.00 0.00 -0.37 0.00 0.00 57.07 58.19 1gfd s TYR 4 Cb -0.12 0.40 0.00 0.00 -0.40 0.00 0.00 41.96 41.83 1gfd s TYR 4 CO 0.12 -0.13 0.00 1.33 -1.57 0.00 0.00 175.55 175.30 1gfd n VAL 5 N 2.10 0.00 -3.56 0.71 0.24 -1.01 -3.30 118.33 113.50 1gfd n VAL 5 Ca -0.12 0.00 -0.23 0.00 -2.04 0.00 0.00 64.34 61.94 1gfd n VAL 5 Cb 0.56 0.00 -0.15 0.00 -1.47 0.00 0.00 33.84 32.78 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 -1.38 0.11 -0.37 7.34 -0.21 -0.64 -3.43 119.66 121.08 1gfd s GLN 6 Ca 0.00 -0.01 -0.34 0.00 0.02 0.00 0.00 55.36 55.03 1gfd s GLN 6 Cb 0.00 -1.57 -0.14 0.00 1.00 0.00 0.00 33.01 32.29 1gfd s GLN 6 CO 0.00 -0.69 1.35 0.00 -2.12 0.00 0.00 175.29 173.83 1gfd n ALA 7 N 5.29 -0.51 -0.01 6.09 0.00 0.98 -2.48 120.51 129.87 1gfd n ALA 7 Ca -0.06 0.27 -0.17 0.00 0.00 0.00 0.00 53.44 53.47 1gfd n ALA 7 Cb 0.49 -1.47 -0.07 0.00 0.00 0.00 0.00 19.45 18.40 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 4.96 0.94 0.00 0.00 6.46 -0.16 0.11 115.31 127.61 1gfd h LEU 8 Ca -0.22 -0.63 -0.51 0.00 -0.12 0.00 0.00 57.88 56.40 1gfd h LEU 8 Cb 1.03 -0.28 -0.13 0.00 -0.73 0.00 0.00 40.66 40.55 1gfd h LEU 8 CO 0.76 1.43 -0.48 0.49 -0.62 0.00 0.00 178.44 180.02 1gfd n PHE 9 N -3.92 -0.51 -2.76 1.25 3.72 -1.11 -4.83 117.46 109.30 1gfd n PHE 9 Ca -0.08 -2.81 -0.41 0.00 -0.05 0.00 0.00 57.45 54.11 1gfd n PHE 9 Cb 0.76 0.20 -0.05 0.00 -0.94 0.00 0.00 39.48 39.46 1gfd n PHE 9 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 1gfd s ASP 10 N -3.44 7.49 -0.19 4.37 1.01 -1.26 -2.87 116.67 121.78 1gfd s ASP 10 Ca 0.34 1.77 -0.01 0.00 0.71 0.00 0.00 52.55 55.37 1gfd s ASP 10 Cb 0.02 -2.58 0.05 0.00 1.01 0.00 0.00 42.92 41.42 1gfd s ASP 10 CO 0.24 -0.02 -0.01 0.12 0.21 0.00 0.00 175.17 175.71 1gfd s PHE 11 N -0.19 1.51 -0.12 4.23 5.36 -0.87 -4.93 117.98 122.96 1gfd s PHE 11 Ca 0.45 -1.09 -0.15 0.00 -0.96 0.00 0.00 56.93 55.17 1gfd s PHE 11 Cb -0.23 -1.22 -0.05 0.00 -0.34 0.00 0.00 43.02 41.18 1gfd s PHE 11 CO 0.29 -0.64 0.37 0.16 -1.46 0.00 0.00 175.22 173.95 1gfd s ASP 12 N 1.70 6.58 -0.46 6.13 1.47 -1.26 -1.94 116.67 128.88 1gfd s ASP 12 Ca -0.01 0.68 -0.42 0.00 1.18 0.00 0.00 52.55 53.97 1gfd s ASP 12 Cb -0.17 -2.23 -0.17 0.00 -0.34 0.00 0.00 42.92 40.01 1gfd s ASP 12 CO -0.07 0.10 2.10 -2.65 0.68 0.00 0.00 175.17 175.33 1gfd n PRO 13 N 3.35 0.26 -0.30 2.11 -0.02 -1.25 -4.76 135.00 134.38 1gfd n PRO 13 Ca -0.11 0.07 0.07 0.00 -2.02 0.00 0.00 63.50 61.52 1gfd n PRO 13 Cb 0.52 -1.72 0.20 0.00 -0.02 0.00 0.00 33.50 32.48 1gfd n PRO 13 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 1gfd n GLN 14 N 7.35 2.83 -3.89 -0.52 1.13 -1.26 -5.00 117.38 118.01 1gfd n GLN 14 Ca 0.50 -2.47 -0.17 0.00 -1.94 0.00 0.00 57.00 52.92 1gfd n GLN 14 Cb 0.02 -1.57 -0.06 0.00 0.11 0.00 0.00 30.24 28.73 1gfd n GLN 14 CO 0.00 0.00 0.00 0.39 -1.44 0.00 0.00 177.06 176.01 1gfd n GLU 15 N -0.17 0.38 -2.37 -1.09 -0.58 -1.26 -5.09 120.64 110.45 1gfd n GLU 15 Ca 0.16 -2.81 -0.42 0.00 -0.42 0.00 0.00 57.16 53.67 1gfd n GLU 15 Cb 0.67 2.20 -0.03 0.00 -0.57 0.00 0.00 31.44 33.71 1gfd n GLU 15 CO 0.00 0.00 0.00 0.16 -0.48 0.00 0.00 177.13 176.81 1gfd s ASP 16 N -2.98 7.02 -1.14 1.62 1.47 -1.26 -3.59 116.67 117.81 1gfd s ASP 16 Ca 0.31 2.05 -0.14 0.00 1.18 0.00 0.00 52.55 55.95 1gfd s ASP 16 Cb 0.02 -2.58 0.14 0.00 -0.34 0.00 0.00 42.92 40.16 1gfd s ASP 16 CO 0.22 -0.53 0.36 0.61 0.68 0.00 0.00 175.17 176.52 1gfd n GLY 17 N 3.31 -0.30 3.95 2.12 0.00 -1.26 -4.85 105.19 108.16 1gfd n GLY 17 Ca 0.10 0.04 -0.27 0.00 0.00 0.00 0.00 46.02 45.89 1gfd n GLY 17 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1gfd s GLU 18 N -5.20 1.10 0.88 1.61 2.12 -1.24 -4.68 118.70 113.30 1gfd s GLU 18 Ca 0.51 -0.64 -0.12 0.00 0.36 0.00 0.00 54.97 55.08 1gfd s GLU 18 Cb -0.30 -2.03 0.12 0.00 0.26 0.00 0.00 34.13 32.18 1gfd s GLU 18 CO 0.62 -2.01 1.11 -1.17 -0.54 0.00 0.00 175.26 173.27 1gfd s LEU 19 N -5.59 2.22 -0.22 2.70 2.96 -0.81 -4.79 118.68 115.14 1gfd s LEU 19 Ca 0.70 1.18 -0.13 0.00 -0.22 0.00 0.00 54.13 55.67 1gfd s LEU 19 Cb -0.05 -3.61 0.07 0.00 0.50 0.00 0.00 46.19 43.10 1gfd s LEU 19 CO 0.49 -2.41 0.55 -0.83 -1.32 0.00 0.00 176.35 172.83 1gfd s GLY 20 N -3.84 -0.48 0.08 7.98 0.00 -1.26 -3.82 107.32 105.98 1gfd s GLY 20 Ca 0.63 1.98 -0.02 0.00 0.00 0.00 0.00 44.72 47.30 1gfd s GLY 20 CO 0.55 2.04 0.15 1.97 0.00 0.00 0.00 173.10 177.80 1gfd n PHE 21 N 4.27 -1.10 -3.84 1.90 -1.74 -0.82 -4.80 117.46 111.34 1gfd n PHE 21 Ca -0.22 -0.42 -0.17 0.00 -0.56 0.00 0.00 57.45 56.09 1gfd n PHE 21 Cb 0.57 0.17 -0.16 0.00 1.52 0.00 0.00 39.48 41.58 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 -2.06 0.14 0.00 3.97 1.81 -1.26 -2.05 118.95 119.50 1gfd s ARG 22 Ca 0.04 0.15 0.00 0.00 -1.72 0.00 0.00 55.73 54.20 1gfd s ARG 22 Cb -0.01 -0.41 0.00 0.00 -0.45 0.00 0.00 34.95 34.08 1gfd s ARG 22 CO 0.03 -0.17 0.00 -2.13 -0.68 0.00 0.00 175.30 172.35 1gfd n ARG 23 N 4.31 0.00 0.00 3.54 0.63 -1.14 -1.09 116.66 122.91 1gfd n ARG 23 Ca -0.24 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.69 1gfd n ARG 23 Cb 0.50 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.41 1gfd n ARG 23 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1gfd n GLY 24 N 0.00 3.12 3.65 5.14 0.00 0.37 -4.87 105.19 112.60 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 -1.11 6.52 -0.47 1.61 1.01 -0.25 -4.39 116.67 119.59 1gfd s ASP 25 Ca 0.00 2.24 -0.28 0.00 0.71 0.00 0.00 52.55 55.21 1gfd s ASP 25 Cb 0.00 -2.53 0.01 0.00 1.01 0.00 0.00 42.92 41.41 1gfd s ASP 25 CO 0.00 -1.05 1.46 -0.36 0.21 0.00 0.00 175.17 175.42 1gfd s PHE 26 N 4.52 2.28 0.32 4.23 0.40 -1.26 -0.02 117.98 128.46 1gfd s PHE 26 Ca 0.78 0.60 -0.27 0.00 -0.60 0.00 0.00 56.93 57.45 1gfd s PHE 26 Cb -0.34 -4.32 -0.09 0.00 0.51 0.00 0.00 43.02 38.77 1gfd s PHE 26 CO 0.33 -2.05 0.99 -1.50 0.70 0.00 0.00 175.22 173.68 1gfd s ILE 27 N 5.93 3.95 -0.67 0.64 1.10 -1.22 -4.77 121.20 126.16 1gfd s ILE 27 Ca 0.60 1.69 -0.14 0.00 -0.51 0.00 0.00 60.65 62.28 1gfd s ILE 27 Cb -0.13 -3.97 0.17 0.00 0.15 0.00 0.00 42.46 38.68 1gfd s ILE 27 CO 0.29 0.20 0.61 -2.28 -2.11 0.00 0.00 174.94 171.65 1gfd s HIS 28 N -1.49 3.50 -0.38 3.50 5.65 0.09 -2.41 115.29 123.75 1gfd s HIS 28 Ca 0.50 -1.69 -0.28 0.00 0.25 0.00 0.00 55.06 53.84 1gfd s HIS 28 Cb -0.23 -3.77 -0.04 0.00 -1.18 0.00 0.00 32.58 27.37 1gfd s HIS 28 CO 0.29 -1.00 2.03 0.08 -0.65 0.00 0.00 174.74 175.49 1gfd s VAL 29 N 0.89 3.25 -0.11 0.89 1.01 -1.26 -1.98 120.40 123.09 1gfd s VAL 29 Ca 0.10 0.23 0.16 0.00 0.00 0.00 0.00 61.98 62.47 1gfd s VAL 29 Cb -0.21 -3.42 -0.13 0.00 0.00 0.00 0.00 36.38 32.63 1gfd s VAL 29 CO -0.03 -0.32 0.88 -0.03 0.00 0.00 0.00 175.10 175.61 1gfd h MET 30 N 14.99 0.00 -0.40 2.72 4.05 -1.47 -3.43 114.93 131.39 1gfd h MET 30 Ca -0.33 0.00 0.22 0.00 -0.28 0.00 0.00 59.70 59.31 1gfd h MET 30 Cb 1.20 0.00 -0.21 0.00 -0.80 0.00 0.00 31.60 31.80 1gfd h MET 30 CO 1.07 0.36 0.07 0.34 0.23 0.00 0.00 176.91 178.97 1gfd s ASP 31 N -5.92 -0.57 -0.52 1.39 2.15 -1.07 -5.04 116.67 107.09 1gfd s ASP 31 Ca -0.02 0.31 -0.26 0.00 0.43 0.00 0.00 52.55 53.00 1gfd s ASP 31 Cb 0.09 1.46 -0.06 0.00 -0.30 0.00 0.00 42.92 44.10 1gfd s ASP 31 CO 0.81 -0.11 2.29 0.54 -0.17 0.00 0.00 175.17 178.53 1gfd s ASN 32 N 2.94 4.61 -0.05 -0.34 2.20 -1.26 -3.39 114.94 119.65 1gfd s ASN 32 Ca 0.05 0.91 -0.03 0.00 -0.94 0.00 0.00 52.86 52.84 1gfd s ASN 32 Cb -0.10 -2.51 -0.01 0.00 -2.00 0.00 0.00 41.25 36.63 1gfd s ASN 32 CO -0.14 -2.78 -0.07 -0.24 -2.94 0.00 0.00 177.10 170.94 1gfd n SER 33 N 15.24 0.63 -4.92 3.54 2.88 -1.26 -4.97 113.62 124.75 1gfd n SER 33 Ca 0.33 0.35 -0.26 0.00 -1.33 0.00 0.00 58.87 57.96 1gfd n SER 33 Cb 0.54 -0.62 -0.01 0.00 -0.75 0.00 0.00 64.21 63.37 1gfd n SER 33 CO 0.00 0.00 0.00 -1.81 -1.23 0.00 0.00 175.04 172.00 1gfd s ASP 34 N -4.32 6.28 0.01 -3.46 1.01 -0.74 -5.01 116.67 110.44 1gfd s ASP 34 Ca -0.06 0.73 -0.14 0.00 0.71 0.00 0.00 52.55 53.80 1gfd s ASP 34 Cb 0.01 -2.16 -0.07 0.00 1.01 0.00 0.00 42.92 41.70 1gfd s ASP 34 CO 0.08 -0.46 0.98 1.55 0.21 0.00 0.00 175.17 177.53 1gfd h PRO 35 N 0.46 -0.47 -0.00 8.23 0.13 -2.02 -3.28 132.00 135.05 1gfd h PRO 35 Ca -0.48 0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 1gfd h PRO 35 Cb 1.21 0.11 0.00 0.00 0.13 0.00 0.00 31.00 32.45 1gfd h PRO 35 CO 0.62 -0.31 -0.14 -1.71 -0.23 0.00 0.00 178.00 176.22 1gfd n ASN 36 N -3.60 0.19 -4.31 1.44 4.05 -1.26 -4.77 115.26 107.00 1gfd n ASN 36 Ca -0.06 0.11 -0.20 0.00 0.45 0.00 0.00 54.58 54.88 1gfd n ASN 36 Cb 0.19 -0.24 -0.11 0.00 1.23 0.00 0.00 39.78 40.86 1gfd n ASN 36 CO 0.00 0.00 0.00 0.26 -3.05 0.00 0.00 177.26 174.47 1gfd s TRP 37 N -2.89 1.68 0.34 1.20 0.52 -1.23 0.35 118.94 118.90 1gfd s TRP 37 Ca 0.16 -0.51 -0.03 0.00 0.02 0.00 0.00 56.10 55.74 1gfd s TRP 37 Cb 0.19 -0.84 0.01 0.00 -1.15 0.00 0.00 33.47 31.68 1gfd s TRP 37 CO 0.56 0.28 0.50 0.91 0.02 0.00 0.00 176.95 179.22 1gfd n TRP 38 N 0.24 -1.52 -4.86 -1.98 8.01 -0.82 -1.80 117.44 114.71 1gfd n TRP 38 Ca -0.13 -2.22 -0.30 0.00 -1.31 0.00 0.00 57.50 53.54 1gfd n TRP 38 Cb 0.58 0.57 -0.17 0.00 -2.01 0.00 0.00 31.31 30.28 1gfd n TRP 38 CO 0.00 0.00 0.00 0.21 -1.01 0.00 0.00 177.69 176.89 1gfd s LYS 39 N -2.70 2.66 0.00 -0.99 2.20 -1.22 -1.94 119.74 117.76 1gfd s LYS 39 Ca 0.27 -0.74 0.00 0.00 -0.36 0.00 0.00 55.97 55.14 1gfd s LYS 39 Cb -0.01 -2.10 0.00 0.00 -1.51 0.00 0.00 37.83 34.20 1gfd s LYS 39 CO 0.19 0.07 0.00 0.41 -0.36 0.00 0.00 175.35 175.66 1gfd n GLY 40 N 3.81 3.96 3.48 5.54 0.00 -0.62 -1.20 105.19 120.16 1gfd n GLY 40 Ca -0.20 -0.59 -0.10 0.00 0.00 0.00 0.00 46.02 45.13 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 -1.26 -1.76 0.07 4.61 0.00 -0.84 -1.89 121.76 120.70 1gfd s ALA 41 Ca 0.00 0.91 -0.22 0.00 0.00 0.00 0.00 51.96 52.64 1gfd s ALA 41 Cb 0.00 0.47 0.08 0.00 0.00 0.00 0.00 23.12 23.67 1gfd s ALA 41 CO 0.00 -0.68 1.03 0.00 0.00 0.00 0.00 175.76 176.12 1gfd n HIS 43 N -0.74 -1.16 -1.43 0.00 -0.00 -1.26 0.14 115.22 110.78 1gfd n HIS 43 Ca 0.01 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.73 1gfd n HIS 43 Cb 0.52 -0.98 0.00 0.00 -0.00 0.00 0.00 29.99 29.53 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 -0.09 0.86 3.53 -1.39 0.00 -1.26 -5.07 105.19 101.78 1gfd n GLY 44 Ca 0.00 -0.62 -0.14 0.00 0.00 0.00 0.00 46.02 45.26 1gfd n GLY 44 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1gfd s GLN 45 N -3.13 0.86 0.41 1.61 -0.44 0.38 -5.17 119.66 114.17 1gfd s GLN 45 Ca 0.00 0.11 0.01 0.00 -2.50 0.00 0.00 55.36 52.98 1gfd s GLN 45 Cb 0.00 0.40 0.08 0.00 -1.64 0.00 0.00 33.01 31.85 1gfd s GLN 45 CO 0.00 -0.29 0.56 0.25 0.50 0.00 0.00 175.29 176.31 1gfd n THR 46 N 0.63 0.00 -1.82 -0.34 -2.24 -1.26 0.02 114.28 109.27 1gfd n THR 46 Ca -0.14 -0.97 0.00 0.00 -2.27 0.00 0.00 64.05 60.66 1gfd n THR 46 Cb 0.58 -1.00 0.00 0.00 -2.10 0.00 0.00 70.33 67.81 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 0.59 -0.10 3.68 3.38 0.00 -0.79 -4.55 105.19 107.40 1gfd n GLY 47 Ca 0.10 -1.60 -0.33 0.00 0.00 0.00 0.00 46.02 44.19 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 2.82 -0.06 1.61 -1.94 -1.26 -1.59 119.30 116.88 1gfd s MET 48 Ca 0.00 -0.58 -0.12 0.00 -1.71 0.00 0.00 55.69 53.28 1gfd s MET 48 Cb 0.00 -2.69 0.02 0.00 2.01 0.00 0.00 34.83 34.18 1gfd s MET 48 CO 0.00 0.64 0.29 -0.59 -0.01 0.00 0.00 175.02 175.34 1gfd s PHE 49 N -1.05 -0.22 0.09 -0.03 -0.71 -0.82 -1.92 117.98 113.32 1gfd s PHE 49 Ca 0.18 0.46 -0.33 0.00 -1.04 0.00 0.00 56.93 56.21 1gfd s PHE 49 Cb -0.11 0.09 -0.12 0.00 -1.21 0.00 0.00 43.02 41.66 1gfd s PHE 49 CO 0.09 -0.28 1.77 -2.30 -1.34 0.00 0.00 175.22 173.16 1gfd n PRO 50 N 2.01 2.47 0.26 1.99 -0.02 -1.26 -1.95 135.00 138.50 1gfd n PRO 50 Ca -0.18 0.90 0.12 0.00 -2.02 0.00 0.00 63.50 62.32 1gfd n PRO 50 Cb 0.57 -2.75 0.68 0.00 -0.02 0.00 0.00 33.50 31.98 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 7.88 0.00 -0.09 -0.52 1.12 -0.39 -1.98 114.38 120.40 1gfd h ARG 51 Ca -0.46 0.00 0.00 0.00 -1.11 0.00 0.00 59.98 58.41 1gfd h ARG 51 Cb 1.24 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 31.20 1gfd h ARG 51 CO 0.93 0.14 0.00 -1.71 -3.11 0.00 0.00 179.97 176.22 1gfd n ASN 52 N -3.68 0.61 -1.08 -3.80 2.85 -1.25 -3.05 115.26 105.86 1gfd n ASN 52 Ca -0.02 -1.79 0.10 0.00 -0.11 0.00 0.00 54.58 52.77 1gfd n ASN 52 Cb 0.26 -0.06 0.23 0.00 1.24 0.00 0.00 39.78 41.45 1gfd n ASN 52 CO 0.00 0.00 0.00 -1.22 -2.11 0.00 0.00 177.26 173.93 1gfd n TYR 53 N -0.27 0.63 -4.40 1.20 4.02 -0.74 -4.91 117.16 112.69 1gfd n TYR 53 Ca 0.09 -0.37 -0.23 0.00 -0.01 0.00 0.00 57.90 57.38 1gfd n TYR 53 Cb 0.12 -0.01 -0.08 0.00 -0.02 0.00 0.00 39.34 39.36 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 -1.19 0.26 -0.16 -0.72 -7.23 -1.17 0.53 120.40 110.71 1gfd s VAL 54 Ca 0.38 -2.00 -0.06 0.00 -1.81 0.00 0.00 61.98 58.48 1gfd s VAL 54 Cb 0.21 -2.39 0.07 0.00 0.56 0.00 0.00 36.38 34.83 1gfd s VAL 54 CO 0.28 0.00 0.35 0.28 -0.31 0.00 0.00 175.10 175.70 1gfd s THR 55 N -3.31 -0.46 0.63 5.32 -1.32 -1.03 -4.54 115.64 110.94 1gfd s THR 55 Ca 0.32 0.20 -0.18 0.00 -1.21 0.00 0.00 61.69 60.82 1gfd s THR 55 Cb 0.02 -0.56 -0.02 0.00 -1.51 0.00 0.00 72.50 70.43 1gfd s THR 55 CO 0.21 0.08 1.25 -2.65 -2.21 0.00 0.00 174.62 171.31 1gfd n PRO 56 N 5.19 1.12 -3.53 7.08 -0.02 -1.26 -1.62 135.00 141.96 1gfd n PRO 56 Ca -0.10 0.44 -0.37 0.00 -2.02 0.00 0.00 63.50 61.44 1gfd n PRO 56 Cb 0.50 -2.48 -0.09 0.00 -0.02 0.00 0.00 33.50 31.42 1gfd n PRO 56 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1gfd s VAL 57 N -1.40 5.28 0.00 -1.45 1.01 -1.21 -4.87 120.40 117.77 1gfd s VAL 57 Ca 0.81 0.43 0.00 0.00 0.00 0.00 0.00 61.98 63.22 1gfd s VAL 57 Cb -0.39 -3.61 0.00 0.00 0.00 0.00 0.00 36.38 32.38 1gfd s VAL 57 CO 0.42 0.30 0.00 0.59 0.00 0.00 0.00 175.10 176.41 1gfd n ASN 58 N 4.41 0.12 0.00 3.32 5.03 -1.26 -5.05 115.26 121.83 1gfd n ASN 58 Ca -0.12 -0.03 0.00 0.00 0.87 0.00 0.00 54.58 55.31 1gfd n ASN 58 Cb 0.52 0.08 0.00 0.00 -1.02 0.00 0.00 39.78 39.35 1gfd n ASN 58 CO 0.00 0.00 0.00 -1.14 -1.83 0.00 0.00 177.26 174.29