#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gfd s SER 2 N 0.00 6.24 -0.22 1.61 1.04 -1.26 -4.84 113.70 116.27 1gfd s SER 2 Ca 0.00 -0.87 0.19 0.00 0.48 0.00 0.00 55.95 55.75 1gfd s SER 2 Cb 0.00 -2.36 0.48 0.00 0.10 0.00 0.00 66.02 64.24 1gfd s SER 2 CO 0.00 -1.13 1.15 1.07 0.98 0.00 0.00 173.24 175.31 1gfd n THR 3 N 5.82 1.43 -4.47 2.02 5.66 -1.26 -5.01 114.28 118.47 1gfd n THR 3 Ca -0.04 -2.94 -0.27 0.00 -3.05 0.00 0.00 64.05 57.75 1gfd n THR 3 Cb 0.45 0.57 -0.17 0.00 -1.55 0.00 0.00 70.33 69.63 1gfd n THR 3 CO 0.00 0.00 0.00 -0.31 -3.05 0.00 0.00 175.07 171.71 1gfd s TYR 4 N -3.09 1.82 0.00 1.09 2.02 -1.26 0.19 117.35 118.12 1gfd s TYR 4 Ca 0.35 -0.81 0.00 0.00 -0.37 0.00 0.00 57.07 56.23 1gfd s TYR 4 Cb 0.36 -1.33 0.00 0.00 -0.40 0.00 0.00 41.96 40.59 1gfd s TYR 4 CO -0.04 -0.43 0.00 1.33 -1.57 0.00 0.00 175.55 174.84 1gfd n VAL 5 N 4.14 0.00 -3.41 0.71 0.24 -0.94 -3.06 118.33 116.02 1gfd n VAL 5 Ca -0.19 0.00 -0.20 0.00 -2.04 0.00 0.00 64.34 61.90 1gfd n VAL 5 Cb 0.51 -0.12 -0.10 0.00 -1.47 0.00 0.00 33.84 32.66 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 -0.46 0.47 -0.04 7.34 -0.21 -0.57 -3.53 119.66 122.66 1gfd s GLN 6 Ca 0.00 -0.67 -0.03 0.00 0.02 0.00 0.00 55.36 54.68 1gfd s GLN 6 Cb 0.00 -0.85 -0.01 0.00 1.00 0.00 0.00 33.01 33.15 1gfd s GLN 6 CO 0.00 -1.12 0.15 0.00 -2.12 0.00 0.00 175.29 172.20 1gfd n ALA 7 N 4.67 0.00 -0.08 6.09 0.00 -0.12 -3.33 120.51 127.74 1gfd n ALA 7 Ca 0.05 0.02 -0.11 0.00 0.00 0.00 0.00 53.44 53.40 1gfd n ALA 7 Cb 0.44 -0.15 -0.04 0.00 0.00 0.00 0.00 19.45 19.70 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 0.63 0.41 0.00 0.00 6.46 0.54 -1.29 115.31 122.06 1gfd h LEU 8 Ca -0.01 -0.28 -0.52 0.00 -0.12 0.00 0.00 57.88 56.95 1gfd h LEU 8 Cb 0.10 -0.11 -0.12 0.00 -0.73 0.00 0.00 40.66 39.80 1gfd h LEU 8 CO 0.08 0.59 -0.45 0.49 -0.62 0.00 0.00 178.44 178.52 1gfd n PHE 9 N -4.67 -0.12 -2.72 1.25 3.01 -1.18 -4.82 117.46 108.21 1gfd n PHE 9 Ca -0.03 -2.60 -0.41 0.00 1.01 0.00 0.00 57.45 55.42 1gfd n PHE 9 Cb 0.22 0.08 -0.05 0.00 -0.01 0.00 0.00 39.48 39.71 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 -3.39 7.53 -0.23 4.37 1.11 -1.26 -3.21 116.67 121.58 1gfd s ASP 10 Ca 0.25 1.86 0.00 0.00 0.18 0.00 0.00 52.55 54.84 1gfd s ASP 10 Cb 0.01 -2.60 0.06 0.00 1.07 0.00 0.00 42.92 41.47 1gfd s ASP 10 CO 0.18 -0.01 -0.03 0.12 1.18 0.00 0.00 175.17 176.61 1gfd s PHE 11 N -0.37 2.12 0.08 4.23 5.36 -0.85 -4.92 117.98 123.64 1gfd s PHE 11 Ca 0.45 -1.60 -0.14 0.00 -0.96 0.00 0.00 56.93 54.68 1gfd s PHE 11 Cb -0.24 -1.50 -0.06 0.00 -0.34 0.00 0.00 43.02 40.87 1gfd s PHE 11 CO 0.31 -0.75 0.48 -0.51 -1.46 0.00 0.00 175.22 173.29 1gfd s ASP 12 N 1.49 6.80 1.01 6.13 1.01 -1.26 -1.62 116.67 130.22 1gfd s ASP 12 Ca -0.04 0.99 -0.15 0.00 0.71 0.00 0.00 52.55 54.07 1gfd s ASP 12 Cb -0.18 -2.26 0.06 0.00 1.01 0.00 0.00 42.92 41.54 1gfd s ASP 12 CO -0.07 0.20 0.26 -2.65 0.21 0.00 0.00 175.17 173.11 1gfd n PRO 13 N 1.19 -0.71 0.00 8.23 -0.02 -1.24 -4.91 135.00 137.53 1gfd n PRO 13 Ca -0.09 -0.17 0.00 0.00 -2.02 0.00 0.00 63.50 61.22 1gfd n PRO 13 Cb 0.52 -1.79 0.00 0.00 -0.02 0.00 0.00 33.50 32.21 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 -1.75 0.27 -4.04 -0.52 6.02 -1.26 -5.08 117.38 111.01 1gfd n GLN 14 Ca 0.05 0.00 -0.26 0.00 -0.01 0.00 0.00 57.00 56.78 1gfd n GLN 14 Cb 0.56 -0.02 -0.04 0.00 1.02 0.00 0.00 30.24 31.76 1gfd n GLN 14 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 177.06 174.84 1gfd s GLU 15 N 0.00 2.27 -0.22 -1.09 2.02 -1.26 -5.04 118.70 115.38 1gfd s GLU 15 Ca 0.00 -1.94 -0.29 0.00 0.02 0.00 0.00 54.97 52.76 1gfd s GLU 15 Cb 0.00 -2.02 -0.04 0.00 0.10 0.00 0.00 34.13 32.17 1gfd s GLU 15 CO 0.00 -0.34 1.83 0.34 0.02 0.00 0.00 175.26 177.10 1gfd s ASP 16 N -4.07 6.07 -1.19 -0.19 2.15 -1.26 -2.60 116.67 115.58 1gfd s ASP 16 Ca 0.35 1.71 -0.04 0.00 0.43 0.00 0.00 52.55 54.99 1gfd s ASP 16 Cb 0.00 -2.53 0.03 0.00 -0.30 0.00 0.00 42.92 40.13 1gfd s ASP 16 CO 0.20 -1.50 0.27 0.61 -0.17 0.00 0.00 175.17 174.59 1gfd n GLY 17 N 5.08 -0.50 3.76 2.66 0.00 -1.26 -4.92 105.19 110.01 1gfd n GLY 17 Ca 0.22 0.05 -0.29 0.00 0.00 0.00 0.00 46.02 46.00 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 -5.52 0.37 0.87 1.61 2.12 -1.07 -4.78 118.70 112.30 1gfd s GLU 18 Ca 0.20 0.07 -0.11 0.00 0.36 0.00 0.00 54.97 55.49 1gfd s GLU 18 Cb -0.10 -1.77 0.12 0.00 0.26 0.00 0.00 34.13 32.63 1gfd s GLU 18 CO 0.25 -2.68 1.09 -1.17 -0.54 0.00 0.00 175.26 172.21 1gfd s LEU 19 N -6.27 2.41 -0.27 2.70 2.96 -0.83 -4.82 118.68 114.56 1gfd s LEU 19 Ca 0.68 1.56 -0.10 0.00 -0.22 0.00 0.00 54.13 56.04 1gfd s LEU 19 Cb -0.12 -4.03 0.11 0.00 0.50 0.00 0.00 46.19 42.66 1gfd s LEU 19 CO 0.54 -2.53 0.59 -0.83 -1.32 0.00 0.00 176.35 172.81 1gfd s GLY 20 N -3.41 -0.62 0.02 7.98 0.00 -1.26 -3.69 107.32 106.34 1gfd s GLY 20 Ca 0.63 2.14 -0.00 0.00 0.00 0.00 0.00 44.72 47.49 1gfd s GLY 20 CO 0.57 2.78 0.02 1.97 0.00 0.00 0.00 173.10 178.44 1gfd n PHE 21 N 5.23 -0.40 -4.03 1.90 -1.74 -0.64 -4.67 117.46 113.11 1gfd n PHE 21 Ca -0.13 -0.12 -0.18 0.00 -0.56 0.00 0.00 57.45 56.46 1gfd n PHE 21 Cb 0.51 0.03 -0.16 0.00 1.52 0.00 0.00 39.48 41.37 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 -2.05 0.49 0.00 3.97 1.81 -1.26 -2.01 118.95 119.91 1gfd s ARG 22 Ca 0.02 -0.01 0.00 0.00 -1.72 0.00 0.00 55.73 54.02 1gfd s ARG 22 Cb -0.00 -0.59 0.00 0.00 -0.45 0.00 0.00 34.95 33.91 1gfd s ARG 22 CO 0.01 -0.09 0.00 -2.13 -0.68 0.00 0.00 175.30 172.41 1gfd n ARG 23 N 3.99 0.00 0.00 3.54 0.63 -1.20 -0.98 116.66 122.64 1gfd n ARG 23 Ca -0.25 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.68 1gfd n ARG 23 Cb 0.51 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.42 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 3.04 3.67 5.14 0.00 -0.49 -4.89 105.19 111.66 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 -0.69 6.53 -0.53 1.61 1.01 -0.16 -4.46 116.67 119.99 1gfd s ASP 25 Ca 0.00 2.53 -0.28 0.00 0.71 0.00 0.00 52.55 55.51 1gfd s ASP 25 Cb 0.00 -2.54 0.02 0.00 1.01 0.00 0.00 42.92 41.41 1gfd s ASP 25 CO 0.00 -0.99 1.33 -0.36 0.21 0.00 0.00 175.17 175.37 1gfd s PHE 26 N 3.82 2.44 0.37 4.23 0.40 -1.26 -0.94 117.98 127.03 1gfd s PHE 26 Ca 0.81 0.52 -0.26 0.00 -0.60 0.00 0.00 56.93 57.40 1gfd s PHE 26 Cb -0.40 -4.41 -0.09 0.00 0.51 0.00 0.00 43.02 38.62 1gfd s PHE 26 CO 0.36 -1.81 1.09 -1.50 0.70 0.00 0.00 175.22 174.07 1gfd s ILE 27 N 5.50 3.51 -0.67 0.64 1.10 -1.23 -4.71 121.20 125.34 1gfd s ILE 27 Ca 0.51 1.28 -0.11 0.00 -0.51 0.00 0.00 60.65 61.82 1gfd s ILE 27 Cb -0.10 -3.72 0.17 0.00 0.15 0.00 0.00 42.46 38.96 1gfd s ILE 27 CO 0.27 0.13 0.58 -2.28 -2.11 0.00 0.00 174.94 171.53 1gfd s HIS 28 N -1.46 3.54 -0.89 3.50 2.46 0.96 -2.20 115.29 121.21 1gfd s HIS 28 Ca 0.54 -1.96 -0.26 0.00 0.47 0.00 0.00 55.06 53.85 1gfd s HIS 28 Cb -0.27 -3.64 -0.18 0.00 -0.13 0.00 0.00 32.58 28.36 1gfd s HIS 28 CO 0.34 -0.97 2.29 0.28 -2.47 0.00 0.00 174.74 174.21 1gfd n VAL 29 N 4.31 0.00 0.12 0.89 0.31 0.50 -1.87 118.33 122.60 1gfd n VAL 29 Ca 0.03 -0.33 -0.02 0.00 -0.01 0.00 0.00 64.34 64.01 1gfd n VAL 29 Cb 0.43 -1.92 0.15 0.00 -0.91 0.00 0.00 33.84 31.58 1gfd n VAL 29 CO 0.00 0.00 0.00 0.24 -1.32 0.00 0.00 176.83 175.75 1gfd h MET 30 N 12.26 0.06 -1.07 5.55 2.86 -1.32 -3.42 114.93 129.85 1gfd h MET 30 Ca 0.00 -0.04 -0.05 0.00 -2.06 0.00 0.00 59.70 57.55 1gfd h MET 30 Cb 1.00 0.01 -0.20 0.00 0.06 0.00 0.00 31.60 32.47 1gfd h MET 30 CO 1.02 0.67 -0.44 0.34 1.06 0.00 0.00 176.91 179.55 1gfd s ASP 31 N -6.86 -1.39 -0.77 1.22 -1.08 -0.36 -5.00 116.67 102.44 1gfd s ASP 31 Ca -0.02 -0.49 -0.25 0.00 -0.52 0.00 0.00 52.55 51.27 1gfd s ASP 31 Cb 0.12 1.90 -0.04 0.00 -1.46 0.00 0.00 42.92 43.44 1gfd s ASP 31 CO 0.77 -0.22 1.97 0.54 0.52 0.00 0.00 175.17 178.75 1gfd s ASN 32 N 2.17 5.07 0.00 -0.34 2.20 -1.26 -2.56 114.94 120.22 1gfd s ASN 32 Ca 0.14 -0.18 0.00 0.00 -0.94 0.00 0.00 52.86 51.88 1gfd s ASN 32 Cb -0.07 -2.55 0.00 0.00 -2.00 0.00 0.00 41.25 36.64 1gfd s ASN 32 CO -0.14 -2.69 0.00 -0.24 -2.94 0.00 0.00 177.10 171.09 1gfd n SER 33 N 13.93 0.00 -4.76 3.54 2.88 -1.26 -4.99 113.62 122.96 1gfd n SER 33 Ca 0.33 0.03 -0.32 0.00 -1.33 0.00 0.00 58.87 57.58 1gfd n SER 33 Cb 0.49 -0.28 0.07 0.00 -0.75 0.00 0.00 64.21 63.74 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 -2.65 4.75 0.01 -3.46 1.11 -0.93 -4.99 116.67 110.51 1gfd s ASP 34 Ca 0.00 1.94 -0.12 0.00 0.18 0.00 0.00 52.55 54.55 1gfd s ASP 34 Cb 0.00 -2.54 -0.07 0.00 1.07 0.00 0.00 42.92 41.38 1gfd s ASP 34 CO 0.00 -1.87 0.90 1.55 1.18 0.00 0.00 175.17 176.93 1gfd h PRO 35 N -0.53 -0.42 -0.17 8.23 0.13 -2.02 -3.26 132.00 133.96 1gfd h PRO 35 Ca -0.45 0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.71 1gfd h PRO 35 Cb 1.24 0.09 0.00 0.00 0.13 0.00 0.00 31.00 32.47 1gfd h PRO 35 CO 0.52 -0.28 0.00 -1.71 -0.23 0.00 0.00 178.00 176.31 1gfd n ASN 36 N -3.49 1.35 -3.96 1.44 5.15 -1.26 -4.69 115.26 109.80 1gfd n ASN 36 Ca -0.05 -1.74 -0.10 0.00 -0.60 0.00 0.00 54.58 52.09 1gfd n ASN 36 Cb 0.17 -0.11 -0.12 0.00 -0.53 0.00 0.00 39.78 39.19 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 -1.78 0.23 0.26 1.20 0.52 -1.23 0.76 118.94 118.89 1gfd s TRP 37 Ca 0.28 -0.40 -0.07 0.00 0.02 0.00 0.00 56.10 55.93 1gfd s TRP 37 Cb 0.15 -0.16 -0.01 0.00 -1.15 0.00 0.00 33.47 32.29 1gfd s TRP 37 CO 0.22 -0.14 0.37 -1.58 0.02 0.00 0.00 176.95 175.84 1gfd s TRP 38 N -1.11 0.78 -0.14 -1.98 0.51 -0.77 -2.19 118.94 114.04 1gfd s TRP 38 Ca -0.12 -1.06 -0.01 0.00 -2.12 0.00 0.00 56.10 52.79 1gfd s TRP 38 Cb -0.08 -0.11 -0.02 0.00 -0.81 0.00 0.00 33.47 32.46 1gfd s TRP 38 CO -0.01 -0.92 -0.10 0.21 -0.51 0.00 0.00 176.95 175.62 1gfd s LYS 39 N -3.83 3.46 0.00 4.98 2.20 -1.06 -1.62 119.74 123.87 1gfd s LYS 39 Ca 0.29 -0.64 0.00 0.00 -0.36 0.00 0.00 55.97 55.26 1gfd s LYS 39 Cb 0.02 -2.72 0.00 0.00 -1.51 0.00 0.00 37.83 33.62 1gfd s LYS 39 CO 0.13 0.20 0.00 0.41 -0.36 0.00 0.00 175.35 175.73 1gfd n GLY 40 N 3.60 3.51 3.82 5.54 0.00 -0.26 -0.98 105.19 120.42 1gfd n GLY 40 Ca -0.18 -0.29 -0.05 0.00 0.00 0.00 0.00 46.02 45.50 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 -1.00 -1.39 0.00 4.61 0.00 -0.78 -1.39 121.76 121.80 1gfd s ALA 41 Ca 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 51.96 51.69 1gfd s ALA 41 Cb 0.00 0.71 0.00 0.00 0.00 0.00 0.00 23.12 23.83 1gfd s ALA 41 CO 0.00 -1.04 0.00 0.00 0.00 0.00 0.00 175.76 174.72 1gfd n HIS 43 N 0.00 0.74 -1.86 0.00 -0.00 -1.26 -3.77 115.22 109.07 1gfd n HIS 43 Ca 0.00 -0.19 -0.02 0.00 -0.00 0.00 0.00 57.72 57.52 1gfd n HIS 43 Cb 0.00 -2.27 -0.00 0.00 -0.00 0.00 0.00 29.99 27.72 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 5.90 -0.21 3.40 -1.39 0.00 -1.26 -4.83 105.19 106.80 1gfd n GLY 44 Ca 0.39 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 46.25 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 -3.76 0.87 0.39 1.61 -1.52 -1.25 -5.17 119.66 110.84 1gfd s GLN 45 Ca 0.00 0.12 0.02 0.00 -1.95 0.00 0.00 55.36 53.55 1gfd s GLN 45 Cb 0.00 0.40 0.07 0.00 -0.22 0.00 0.00 33.01 33.27 1gfd s GLN 45 CO 0.00 -0.25 0.54 0.25 -0.25 0.00 0.00 175.29 175.58 1gfd n THR 46 N 1.20 0.00 -1.70 -0.19 -2.24 -1.26 -1.44 114.28 108.64 1gfd n THR 46 Ca -0.20 -1.03 0.00 0.00 -2.27 0.00 0.00 64.05 60.56 1gfd n THR 46 Cb 0.57 -0.93 0.00 0.00 -2.10 0.00 0.00 70.33 67.87 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 0.60 0.18 3.65 3.38 0.00 -0.49 -4.52 105.19 107.99 1gfd n GLY 47 Ca 0.10 -1.59 -0.32 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 2.63 -0.09 1.61 -1.94 -1.26 -1.10 119.30 117.14 1gfd s MET 48 Ca 0.00 -0.71 -0.12 0.00 -1.71 0.00 0.00 55.69 53.15 1gfd s MET 48 Cb 0.00 -2.57 0.03 0.00 2.01 0.00 0.00 34.83 34.30 1gfd s MET 48 CO 0.00 0.60 0.31 -0.59 -0.01 0.00 0.00 175.02 175.33 1gfd s PHE 49 N -1.10 -0.30 0.03 -0.03 -0.71 -0.64 -1.96 117.98 113.28 1gfd s PHE 49 Ca 0.20 0.69 -0.33 0.00 -1.04 0.00 0.00 56.93 56.45 1gfd s PHE 49 Cb -0.11 0.11 -0.12 0.00 -1.21 0.00 0.00 43.02 41.69 1gfd s PHE 49 CO 0.11 -0.22 1.80 -2.30 -1.34 0.00 0.00 175.22 173.27 1gfd n PRO 50 N 2.51 2.35 0.24 1.99 -0.02 -1.26 -1.84 135.00 138.96 1gfd n PRO 50 Ca -0.15 0.86 0.07 0.00 -2.02 0.00 0.00 63.50 62.25 1gfd n PRO 50 Cb 0.57 -2.70 0.58 0.00 -0.02 0.00 0.00 33.50 31.93 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 8.30 0.00 0.00 -0.52 1.12 0.08 -0.98 114.38 122.38 1gfd h ARG 51 Ca -0.47 0.00 0.00 0.00 -1.11 0.00 0.00 59.98 58.40 1gfd h ARG 51 Cb 1.25 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 31.21 1gfd h ARG 51 CO 0.93 0.09 0.00 -1.71 -3.11 0.00 0.00 179.97 176.17 1gfd n ASN 52 N -4.41 0.00 -1.04 -3.80 5.15 -1.24 -2.23 115.26 107.69 1gfd n ASN 52 Ca -0.03 -0.08 0.09 0.00 -0.60 0.00 0.00 54.58 53.96 1gfd n ASN 52 Cb 0.17 -0.25 0.25 0.00 -0.53 0.00 0.00 39.78 39.41 1gfd n ASN 52 CO 0.00 0.00 0.00 -1.22 1.40 0.00 0.00 177.26 177.44 1gfd n TYR 53 N -1.25 0.77 -4.29 1.20 4.02 -0.37 -4.85 117.16 112.40 1gfd n TYR 53 Ca 0.10 -0.38 -0.16 0.00 -0.01 0.00 0.00 57.90 57.45 1gfd n TYR 53 Cb 0.15 -0.02 -0.10 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 -1.30 0.28 -0.07 -0.72 -7.23 -0.95 0.11 120.40 110.52 1gfd s VAL 54 Ca 0.37 -2.00 -0.03 0.00 -1.81 0.00 0.00 61.98 58.51 1gfd s VAL 54 Cb 0.20 -2.54 0.04 0.00 0.56 0.00 0.00 36.38 34.64 1gfd s VAL 54 CO 0.25 0.00 0.13 0.28 -0.31 0.00 0.00 175.10 175.45 1gfd s THR 55 N -3.79 -0.18 0.51 5.32 -1.32 -1.21 -4.55 115.64 110.43 1gfd s THR 55 Ca 0.37 0.32 -0.23 0.00 -1.21 0.00 0.00 61.69 60.95 1gfd s THR 55 Cb 0.06 -0.24 -0.06 0.00 -1.51 0.00 0.00 72.50 70.74 1gfd s THR 55 CO 0.16 0.13 1.34 -2.65 -2.21 0.00 0.00 174.62 171.39 1gfd n PRO 56 N 4.99 1.80 -2.41 7.08 -0.01 -1.26 -1.51 135.00 143.67 1gfd n PRO 56 Ca -0.11 0.65 -0.42 0.00 -0.01 0.00 0.00 63.50 63.61 1gfd n PRO 56 Cb 0.50 -2.54 -0.00 0.00 -0.01 0.00 0.00 33.50 31.45 1gfd n PRO 56 CO 0.00 0.00 0.00 0.28 -0.01 0.00 0.00 175.50 175.77 1gfd n VAL 57 N -0.79 3.79 -3.89 -1.45 0.31 -1.17 -4.88 118.33 110.24 1gfd n VAL 57 Ca 0.09 -3.84 -0.09 0.00 -0.01 0.00 0.00 64.34 60.48 1gfd n VAL 57 Cb 0.43 -2.39 -0.06 0.00 -0.91 0.00 0.00 33.84 30.92 1gfd n VAL 57 CO 0.00 0.00 0.00 0.20 -1.32 0.00 0.00 176.83 175.71 1gfd s ASN 58 N 4.14 -0.03 0.00 4.52 0.01 -1.26 -5.10 114.94 117.22 1gfd s ASN 58 Ca 0.53 -0.75 0.00 0.00 -0.71 0.00 0.00 52.86 51.94 1gfd s ASN 58 Cb 0.06 0.46 0.00 0.00 0.41 0.00 0.00 41.25 42.18 1gfd s ASN 58 CO 0.05 -0.92 0.00 -1.14 -1.51 0.00 0.00 177.10 173.59