#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 0.05 -0.10 1.61 1.04 -1.26 -5.04 113.70 110.00 1gfd s SER 2 Ca 0.00 -0.16 0.13 0.00 0.48 0.00 0.00 55.95 56.41 1gfd s SER 2 Cb 0.00 0.17 0.25 0.00 0.10 0.00 0.00 66.02 66.54 1gfd s SER 2 CO 0.00 -0.24 1.13 0.35 0.98 0.00 0.00 173.24 175.46 1gfd n THR 3 N 2.02 1.25 -2.97 2.02 -2.24 -1.26 -5.07 114.28 108.03 1gfd n THR 3 Ca -0.20 -1.72 -0.30 0.00 -2.27 0.00 0.00 64.05 59.57 1gfd n THR 3 Cb 0.57 0.09 -0.03 0.00 -2.10 0.00 0.00 70.33 68.85 1gfd n THR 3 CO 0.00 0.00 0.00 -0.31 -0.57 0.00 0.00 175.07 174.19 1gfd s TYR 4 N -1.88 3.48 0.00 4.78 1.51 -1.26 -1.76 117.35 122.22 1gfd s TYR 4 Ca 0.25 0.91 0.00 0.00 -1.01 0.00 0.00 57.07 57.22 1gfd s TYR 4 Cb 0.23 -2.34 0.00 0.00 -0.11 0.00 0.00 41.96 39.75 1gfd s TYR 4 CO -0.02 -0.04 0.00 1.33 -1.11 0.00 0.00 175.55 175.71 1gfd n VAL 5 N -1.28 0.00 -3.43 0.71 0.24 -0.91 -3.51 118.33 110.15 1gfd n VAL 5 Ca 0.01 0.00 -0.22 0.00 -2.04 0.00 0.00 64.34 62.09 1gfd n VAL 5 Cb 0.54 0.00 -0.11 0.00 -1.47 0.00 0.00 33.84 32.80 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 -0.84 0.42 -0.04 7.34 -0.21 0.28 -3.64 119.66 122.97 1gfd s GLN 6 Ca 0.00 -0.65 -0.03 0.00 0.02 0.00 0.00 55.36 54.69 1gfd s GLN 6 Cb 0.00 -0.91 -0.01 0.00 1.00 0.00 0.00 33.01 33.09 1gfd s GLN 6 CO 0.00 -1.11 0.16 0.00 -2.12 0.00 0.00 175.29 172.22 1gfd n ALA 7 N 4.76 0.00 -0.12 6.09 0.00 -0.41 -3.18 120.51 127.64 1gfd n ALA 7 Ca 0.03 0.02 -0.09 0.00 0.00 0.00 0.00 53.44 53.40 1gfd n ALA 7 Cb 0.43 -0.16 -0.01 0.00 0.00 0.00 0.00 19.45 19.72 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 0.66 0.48 0.00 0.00 5.85 0.10 -2.40 115.31 120.01 1gfd h LEU 8 Ca -0.01 -0.11 -0.22 0.00 0.84 0.00 0.00 57.88 58.38 1gfd h LEU 8 Cb 0.11 -0.12 -0.06 0.00 0.37 0.00 0.00 40.66 40.96 1gfd h LEU 8 CO 0.08 0.45 -0.21 0.49 -0.34 0.00 0.00 178.44 178.91 1gfd n PHE 9 N -4.73 -0.32 -2.85 1.25 3.01 -1.19 -4.85 117.46 107.77 1gfd n PHE 9 Ca -0.00 -1.27 -0.34 0.00 1.01 0.00 0.00 57.45 56.84 1gfd n PHE 9 Cb 0.09 0.12 -0.07 0.00 -0.01 0.00 0.00 39.48 39.62 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 -2.07 7.03 -0.05 4.37 1.01 -1.26 -2.86 116.67 122.84 1gfd s ASP 10 Ca 0.17 1.67 -0.02 0.00 0.71 0.00 0.00 52.55 55.09 1gfd s ASP 10 Cb 0.01 -2.53 0.03 0.00 1.01 0.00 0.00 42.92 41.44 1gfd s ASP 10 CO 0.12 -0.25 0.05 0.12 0.21 0.00 0.00 175.17 175.42 1gfd s PHE 11 N -1.99 0.18 -0.18 4.23 5.36 -0.97 -4.89 117.98 119.72 1gfd s PHE 11 Ca 0.57 0.15 -0.08 0.00 -0.96 0.00 0.00 56.93 56.61 1gfd s PHE 11 Cb -0.12 -0.55 -0.05 0.00 -0.34 0.00 0.00 43.02 41.97 1gfd s PHE 11 CO 0.17 -0.23 0.11 -0.51 -1.46 0.00 0.00 175.22 173.29 1gfd s ASP 12 N 2.13 6.08 -0.36 6.13 1.01 -1.26 -2.48 116.67 127.92 1gfd s ASP 12 Ca 0.05 0.24 -0.42 0.00 0.71 0.00 0.00 52.55 53.13 1gfd s ASP 12 Cb -0.12 -2.03 -0.17 0.00 1.01 0.00 0.00 42.92 41.60 1gfd s ASP 12 CO -0.04 0.23 1.73 -2.65 0.21 0.00 0.00 175.17 174.66 1gfd n PRO 13 N 3.15 0.76 -0.06 8.23 -0.02 -1.25 -4.80 135.00 141.02 1gfd n PRO 13 Ca -0.17 0.28 0.02 0.00 -2.02 0.00 0.00 63.50 61.61 1gfd n PRO 13 Cb 0.53 -1.91 0.05 0.00 -0.02 0.00 0.00 33.50 32.14 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 5.16 2.52 -4.40 -0.52 6.02 -1.26 -5.01 117.38 119.88 1gfd n GLN 14 Ca 0.29 -1.58 -0.20 0.00 -0.01 0.00 0.00 57.00 55.51 1gfd n GLN 14 Cb 0.07 -1.10 -0.10 0.00 1.02 0.00 0.00 30.24 30.13 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 -0.91 1.57 -0.03 -1.09 0.41 -1.26 -5.10 118.70 112.28 1gfd s GLU 15 Ca 0.08 -1.87 -0.30 0.00 -0.41 0.00 0.00 54.97 52.48 1gfd s GLU 15 Cb 0.04 -0.65 -0.03 0.00 -1.78 0.00 0.00 34.13 31.71 1gfd s GLU 15 CO 0.06 -0.23 1.12 0.34 -0.49 0.00 0.00 175.26 176.05 1gfd s ASP 16 N -3.43 7.16 -1.52 -0.19 2.15 -1.26 -3.51 116.67 116.07 1gfd s ASP 16 Ca 0.37 1.76 -0.12 0.00 0.43 0.00 0.00 52.55 54.99 1gfd s ASP 16 Cb 0.08 -2.56 0.08 0.00 -0.30 0.00 0.00 42.92 40.22 1gfd s ASP 16 CO 0.15 -0.47 0.89 0.61 -0.17 0.00 0.00 175.17 176.18 1gfd n GLY 17 N 3.19 -0.45 4.02 2.66 0.00 -1.26 -4.96 105.19 108.39 1gfd n GLY 17 Ca 0.09 0.18 -0.19 0.00 0.00 0.00 0.00 46.02 46.10 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 -6.58 2.43 0.73 1.61 2.12 -1.23 -4.66 118.70 113.12 1gfd s GLU 18 Ca 0.56 -1.45 -0.11 0.00 0.36 0.00 0.00 54.97 54.32 1gfd s GLU 18 Cb -0.28 -2.65 0.03 0.00 0.26 0.00 0.00 34.13 31.48 1gfd s GLU 18 CO 0.84 -0.72 1.07 -1.17 -0.54 0.00 0.00 175.26 174.75 1gfd s LEU 19 N -4.61 2.95 -0.21 2.70 2.96 -0.82 -4.78 118.68 116.87 1gfd s LEU 19 Ca 0.60 1.52 -0.08 0.00 -0.22 0.00 0.00 54.13 55.95 1gfd s LEU 19 Cb -0.07 -4.30 0.09 0.00 0.50 0.00 0.00 46.19 42.41 1gfd s LEU 19 CO 0.38 -1.64 0.45 -0.83 -1.32 0.00 0.00 176.35 173.39 1gfd s GLY 20 N -3.82 -0.41 0.00 7.98 0.00 -1.26 -3.80 107.32 106.01 1gfd s GLY 20 Ca 0.59 1.62 0.00 0.00 0.00 0.00 0.00 44.72 46.93 1gfd s GLY 20 CO 0.55 2.44 0.00 1.97 0.00 0.00 0.00 173.10 178.05 1gfd n PHE 21 N 5.30 -0.20 -3.78 1.90 -1.74 -1.04 -4.72 117.46 113.17 1gfd n PHE 21 Ca -0.10 0.00 -0.18 0.00 -0.56 0.00 0.00 57.45 56.60 1gfd n PHE 21 Cb 0.50 0.00 -0.17 0.00 1.52 0.00 0.00 39.48 41.33 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 -1.88 0.14 0.00 3.97 1.81 -1.26 -2.30 118.95 119.42 1gfd s ARG 22 Ca 0.00 0.21 0.00 0.00 -1.72 0.00 0.00 55.73 54.22 1gfd s ARG 22 Cb 0.00 -0.51 0.00 0.00 -0.45 0.00 0.00 34.95 33.99 1gfd s ARG 22 CO 0.00 -0.23 0.00 -2.13 -0.68 0.00 0.00 175.30 172.26 1gfd n ARG 23 N 4.70 0.00 0.00 3.54 0.00 -1.13 -1.35 116.66 122.41 1gfd n ARG 23 Ca -0.16 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.69 1gfd n ARG 23 Cb 0.50 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.96 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 3.32 3.66 5.14 0.00 -0.90 -4.93 105.19 111.48 1gfd n GLY 24 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 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 -1.05 6.87 -0.44 1.61 1.01 -0.46 -4.58 116.67 119.63 1gfd s ASP 25 Ca 0.00 1.87 -0.29 0.00 0.71 0.00 0.00 52.55 54.84 1gfd s ASP 25 Cb 0.00 -2.54 0.01 0.00 1.01 0.00 0.00 42.92 41.40 1gfd s ASP 25 CO 0.00 -0.79 1.37 -0.36 0.21 0.00 0.00 175.17 175.60 1gfd s PHE 26 N 3.47 2.46 0.34 4.23 0.40 -1.26 -1.29 117.98 126.32 1gfd s PHE 26 Ca 0.60 0.66 -0.27 0.00 -0.60 0.00 0.00 56.93 57.32 1gfd s PHE 26 Cb -0.25 -4.35 -0.09 0.00 0.51 0.00 0.00 43.02 38.83 1gfd s PHE 26 CO 0.20 -1.86 1.08 -1.50 0.70 0.00 0.00 175.22 173.84 1gfd s ILE 27 N 5.35 3.57 -0.59 0.64 1.10 -1.24 -4.73 121.20 125.31 1gfd s ILE 27 Ca 0.58 1.40 -0.15 0.00 -0.51 0.00 0.00 60.65 61.97 1gfd s ILE 27 Cb -0.12 -3.82 0.15 0.00 0.15 0.00 0.00 42.46 38.82 1gfd s ILE 27 CO 0.32 0.20 0.54 -2.28 -2.11 0.00 0.00 174.94 171.60 1gfd s HIS 28 N -1.39 3.37 -0.73 3.50 5.65 0.18 -2.15 115.29 123.72 1gfd s HIS 28 Ca 0.51 -1.49 -0.26 0.00 0.25 0.00 0.00 55.06 54.07 1gfd s HIS 28 Cb -0.27 -3.77 -0.05 0.00 -1.18 0.00 0.00 32.58 27.30 1gfd s HIS 28 CO 0.35 -1.01 2.05 0.08 -0.65 0.00 0.00 174.74 175.55 1gfd s VAL 29 N 1.28 3.29 -0.05 0.89 1.01 -0.72 -1.39 120.40 124.71 1gfd s VAL 29 Ca 0.06 -0.07 0.12 0.00 0.00 0.00 0.00 61.98 62.10 1gfd s VAL 29 Cb -0.26 -3.71 -0.08 0.00 0.00 0.00 0.00 36.38 32.33 1gfd s VAL 29 CO 0.00 -0.68 1.24 -0.03 0.00 0.00 0.00 175.10 175.63 1gfd h MET 30 N 13.88 0.00 -0.98 2.72 4.05 -1.62 -3.43 114.93 129.55 1gfd h MET 30 Ca -0.09 0.00 -0.11 0.00 -0.28 0.00 0.00 59.70 59.22 1gfd h MET 30 Cb 1.09 0.00 -0.17 0.00 -0.80 0.00 0.00 31.60 31.72 1gfd h MET 30 CO 1.18 0.64 -0.47 0.34 0.23 0.00 0.00 176.91 178.83 1gfd s ASP 31 N -6.42 -1.45 -0.68 1.39 2.15 -1.01 -5.03 116.67 105.63 1gfd s ASP 31 Ca 0.01 -1.38 -0.27 0.00 0.43 0.00 0.00 52.55 51.34 1gfd s ASP 31 Cb 0.09 1.88 -0.13 0.00 -0.30 0.00 0.00 42.92 44.46 1gfd s ASP 31 CO 0.79 -0.09 2.51 -0.46 -0.17 0.00 0.00 175.17 177.75 1gfd n ASN 32 N 3.44 1.55 0.00 -0.34 6.94 -1.26 -3.56 115.26 122.02 1gfd n ASN 32 Ca 0.15 -0.32 0.00 0.00 -0.02 0.00 0.00 54.58 54.39 1gfd n ASN 32 Cb 0.57 -1.35 0.00 0.00 -2.36 0.00 0.00 39.78 36.64 1gfd n ASN 32 CO 0.00 0.00 0.00 -0.24 -1.03 0.00 0.00 177.26 175.99 1gfd n SER 33 N 14.06 0.00 -4.79 0.53 2.88 -1.26 -4.97 113.62 120.07 1gfd n SER 33 Ca 0.48 0.02 -0.32 0.00 -1.33 0.00 0.00 58.87 57.72 1gfd n SER 33 Cb 0.36 -0.10 0.06 0.00 -0.75 0.00 0.00 64.21 63.78 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 -1.54 5.15 0.01 -3.46 1.11 -0.75 -4.99 116.67 112.19 1gfd s ASP 34 Ca 0.00 1.76 -0.15 0.00 0.18 0.00 0.00 52.55 54.34 1gfd s ASP 34 Cb 0.00 -2.52 -0.08 0.00 1.07 0.00 0.00 42.92 41.39 1gfd s ASP 34 CO 0.00 -1.60 0.99 1.55 1.18 0.00 0.00 175.17 177.29 1gfd h PRO 35 N -0.56 -0.51 -0.21 8.23 0.13 -2.02 -3.24 132.00 133.83 1gfd h PRO 35 Ca -0.45 0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.72 1gfd h PRO 35 Cb 1.22 0.12 0.00 0.00 0.13 0.00 0.00 31.00 32.47 1gfd h PRO 35 CO 0.55 -0.34 0.00 -1.71 -0.23 0.00 0.00 178.00 176.27 1gfd n ASN 36 N -3.73 1.49 -3.96 1.44 5.15 -1.26 -4.71 115.26 109.68 1gfd n ASN 36 Ca -0.07 -1.80 -0.10 0.00 -0.60 0.00 0.00 54.58 52.01 1gfd n ASN 36 Cb 0.21 -0.14 -0.12 0.00 -0.53 0.00 0.00 39.78 39.20 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 -1.73 0.23 0.29 1.20 0.52 -1.22 0.29 118.94 118.52 1gfd s TRP 37 Ca 0.27 -0.40 -0.03 0.00 0.02 0.00 0.00 56.10 55.96 1gfd s TRP 37 Cb 0.14 -0.16 -0.01 0.00 -1.15 0.00 0.00 33.47 32.28 1gfd s TRP 37 CO 0.21 -0.14 0.37 -1.58 0.02 0.00 0.00 176.95 175.83 1gfd s TRP 38 N -1.10 1.04 -0.07 -1.98 0.51 -0.68 -1.82 118.94 114.85 1gfd s TRP 38 Ca -0.12 -1.25 0.04 0.00 -2.12 0.00 0.00 56.10 52.65 1gfd s TRP 38 Cb -0.08 -0.23 -0.02 0.00 -0.81 0.00 0.00 33.47 32.34 1gfd s TRP 38 CO -0.01 -0.95 -0.18 0.21 -0.51 0.00 0.00 176.95 175.51 1gfd s LYS 39 N -3.57 2.72 0.00 4.98 2.47 -1.23 -1.86 119.74 123.25 1gfd s LYS 39 Ca 0.32 -0.77 0.00 0.00 -1.56 0.00 0.00 55.97 53.96 1gfd s LYS 39 Cb 0.02 -2.36 0.00 0.00 -1.46 0.00 0.00 37.83 34.03 1gfd s LYS 39 CO 0.17 0.44 0.00 0.41 0.16 0.00 0.00 175.35 176.53 1gfd n GLY 40 N 2.83 3.25 3.52 5.54 0.00 -0.62 -1.68 105.19 118.03 1gfd n GLY 40 Ca -0.17 -0.28 -0.11 0.00 0.00 0.00 0.00 46.02 45.46 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 -1.83 0.00 4.61 0.00 -0.49 -2.43 121.76 120.62 1gfd s ALA 41 Ca 0.00 1.19 0.00 0.00 0.00 0.00 0.00 51.96 53.15 1gfd s ALA 41 Cb 0.00 0.05 0.00 0.00 0.00 0.00 0.00 23.12 23.17 1gfd s ALA 41 CO 0.00 -0.54 0.00 0.00 0.00 0.00 0.00 175.76 175.22 1gfd n HIS 43 N 0.00 0.70 -1.89 0.00 -0.00 -1.26 -3.64 115.22 109.12 1gfd n HIS 43 Ca 0.00 -0.12 0.00 0.00 -0.00 0.00 0.00 57.72 57.60 1gfd n HIS 43 Cb 0.00 -2.14 0.00 0.00 -0.00 0.00 0.00 29.99 27.85 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 5.78 -0.31 3.37 -1.39 0.00 -1.26 -4.81 105.19 106.56 1gfd n GLY 44 Ca 0.32 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.20 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 -3.74 0.94 0.27 1.61 0.74 -1.24 -5.17 119.66 113.07 1gfd s GLN 45 Ca 0.00 -0.18 0.03 0.00 0.05 0.00 0.00 55.36 55.26 1gfd s GLN 45 Cb 0.00 0.43 0.05 0.00 1.10 0.00 0.00 33.01 34.58 1gfd s GLN 45 CO 0.00 -0.31 0.37 0.25 -0.55 0.00 0.00 175.29 175.05 1gfd n THR 46 N 0.69 0.00 -1.09 -0.34 -2.24 -1.26 -1.22 114.28 108.81 1gfd n THR 46 Ca -0.19 -0.81 0.00 0.00 -2.27 0.00 0.00 64.05 60.78 1gfd n THR 46 Cb 0.59 -0.88 0.00 0.00 -2.10 0.00 0.00 70.33 67.94 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 1.83 0.36 3.66 3.38 0.00 -1.02 -4.44 105.19 108.95 1gfd n GLY 47 Ca 0.07 -1.72 -0.29 0.00 0.00 0.00 0.00 46.02 44.08 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 2.42 -0.05 1.61 -1.94 -1.26 -1.58 119.30 116.49 1gfd s MET 48 Ca 0.00 -0.96 -0.19 0.00 -1.71 0.00 0.00 55.69 52.84 1gfd s MET 48 Cb 0.00 -2.44 0.04 0.00 2.01 0.00 0.00 34.83 34.44 1gfd s MET 48 CO 0.00 0.51 0.42 -0.59 -0.01 0.00 0.00 175.02 175.35 1gfd s PHE 49 N -1.42 -0.35 0.18 -0.03 -0.71 -0.78 -1.94 117.98 112.93 1gfd s PHE 49 Ca 0.25 0.65 -0.32 0.00 -1.04 0.00 0.00 56.93 56.48 1gfd s PHE 49 Cb -0.11 0.18 -0.12 0.00 -1.21 0.00 0.00 43.02 41.77 1gfd s PHE 49 CO 0.17 -0.41 1.76 -2.30 -1.34 0.00 0.00 175.22 173.10 1gfd n PRO 50 N 1.50 2.75 -0.28 1.99 -0.02 -1.26 -1.69 135.00 138.00 1gfd n PRO 50 Ca -0.19 1.00 -0.03 0.00 -2.02 0.00 0.00 63.50 62.25 1gfd n PRO 50 Cb 0.56 -2.86 0.13 0.00 -0.02 0.00 0.00 33.50 31.32 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 7.33 1.14 0.00 -0.52 1.12 -0.44 -1.44 114.38 121.57 1gfd h ARG 51 Ca -0.44 -0.15 0.00 0.00 -1.11 0.00 0.00 59.98 58.28 1gfd h ARG 51 Cb 1.21 -0.22 0.00 0.00 -0.01 0.00 0.00 29.97 30.96 1gfd h ARG 51 CO 0.95 0.86 0.00 0.09 -3.11 0.00 0.00 179.97 178.76 1gfd n ASN 52 N -4.33 0.00 -1.26 -3.80 4.13 -1.25 -1.67 115.26 107.08 1gfd n ASN 52 Ca 0.08 -0.56 0.11 0.00 1.68 0.00 0.00 54.58 55.89 1gfd n ASN 52 Cb 0.12 0.00 0.29 0.00 -1.54 0.00 0.00 39.78 38.65 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 -0.88 0.86 -4.30 3.10 4.02 -0.54 -4.85 117.16 114.57 1gfd n TYR 53 Ca 0.08 -0.46 -0.19 0.00 -0.01 0.00 0.00 57.90 57.32 1gfd n TYR 53 Cb 0.04 -0.00 -0.09 0.00 -0.02 0.00 0.00 39.34 39.27 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 -1.07 0.11 -0.17 -0.72 -7.23 -0.67 0.14 120.40 110.80 1gfd s VAL 54 Ca 0.45 -2.00 -0.21 0.00 -1.81 0.00 0.00 61.98 58.41 1gfd s VAL 54 Cb 0.24 -2.48 0.05 0.00 0.56 0.00 0.00 36.38 34.75 1gfd s VAL 54 CO 0.32 0.00 0.56 0.28 -0.31 0.00 0.00 175.10 175.95 1gfd s THR 55 N -3.57 0.01 0.52 5.32 -1.32 -1.19 -4.50 115.64 110.91 1gfd s THR 55 Ca 0.38 -0.04 -0.22 0.00 -1.21 0.00 0.00 61.69 60.59 1gfd s THR 55 Cb 0.04 -0.81 -0.06 0.00 -1.51 0.00 0.00 72.50 70.16 1gfd s THR 55 CO 0.22 -0.02 1.24 -0.81 -2.21 0.00 0.00 174.62 173.04 1gfd n PRO 56 N 2.38 1.57 0.04 7.08 -0.04 -1.26 1.00 135.00 145.77 1gfd n PRO 56 Ca -0.15 0.58 0.13 0.00 -0.04 0.00 0.00 63.50 64.02 1gfd n PRO 56 Cb 0.56 -2.42 0.53 0.00 -0.04 0.00 0.00 33.50 32.13 1gfd n PRO 56 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 1gfd n VAL 57 N -0.96 0.28 -3.67 0.52 0.31 -1.23 -4.71 118.33 108.87 1gfd n VAL 57 Ca 0.10 -0.08 -0.08 0.00 -0.01 0.00 0.00 64.34 64.27 1gfd n VAL 57 Cb 0.44 -0.57 -0.09 0.00 -0.91 0.00 0.00 33.84 32.70 1gfd n VAL 57 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 1gfd s ASN 58 N -3.56 -0.59 0.00 4.52 4.22 -1.26 -5.11 114.94 113.17 1gfd s ASN 58 Ca 0.12 1.10 0.00 0.00 -2.14 0.00 0.00 52.86 51.94 1gfd s ASN 58 Cb 0.16 1.18 0.00 0.00 1.28 0.00 0.00 41.25 43.87 1gfd s ASN 58 CO 0.54 -0.22 0.00 0.54 -2.04 0.00 0.00 177.10 175.92