#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 -0.20 -0.17 1.61 0.15 -1.26 -5.06 113.70 108.78 1gfd s SER 2 Ca 0.00 -0.39 0.22 0.00 0.70 0.00 0.00 55.95 56.47 1gfd s SER 2 Cb 0.00 0.50 0.44 0.00 -1.71 0.00 0.00 66.02 65.25 1gfd s SER 2 CO 0.00 -0.92 1.16 0.35 1.20 0.00 0.00 173.24 175.04 1gfd n THR 3 N -0.46 0.65 -4.06 6.45 -2.24 -1.26 -5.07 114.28 108.29 1gfd n THR 3 Ca -0.06 -1.92 -0.27 0.00 -2.27 0.00 0.00 64.05 59.53 1gfd n THR 3 Cb 0.61 1.13 -0.05 0.00 -2.10 0.00 0.00 70.33 69.91 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 -1.94 3.20 0.08 4.78 2.02 -1.26 0.12 117.35 124.34 1gfd s TYR 4 Ca 0.26 0.02 0.02 0.00 -0.37 0.00 0.00 57.07 57.00 1gfd s TYR 4 Cb 0.34 -1.55 -0.01 0.00 -0.40 0.00 0.00 41.96 40.34 1gfd s TYR 4 CO -0.09 0.52 0.07 1.33 -1.57 0.00 0.00 175.55 175.81 1gfd n VAL 5 N -0.21 0.00 -3.49 0.71 0.24 -1.07 -3.84 118.33 110.67 1gfd n VAL 5 Ca -0.08 -0.56 -0.26 0.00 -2.04 0.00 0.00 64.34 61.40 1gfd n VAL 5 Cb 0.54 0.28 -0.13 0.00 -1.47 0.00 0.00 33.84 33.06 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 -2.31 0.29 -0.02 7.34 -0.21 0.46 -3.46 119.66 121.74 1gfd s GLN 6 Ca 0.09 -0.56 -0.02 0.00 0.02 0.00 0.00 55.36 54.89 1gfd s GLN 6 Cb 0.00 -1.04 -0.01 0.00 1.00 0.00 0.00 33.01 32.97 1gfd s GLN 6 CO 0.07 -1.06 0.09 0.00 -2.12 0.00 0.00 175.29 172.27 1gfd n ALA 7 N 5.05 -0.00 -0.05 6.09 0.00 -0.15 -3.02 120.51 128.43 1gfd n ALA 7 Ca -0.02 0.01 -0.06 0.00 0.00 0.00 0.00 53.44 53.38 1gfd n ALA 7 Cb 0.42 -0.10 0.14 0.00 0.00 0.00 0.00 19.45 19.91 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 0.38 0.67 0.00 0.00 6.46 0.09 -1.87 115.31 121.04 1gfd h LEU 8 Ca -0.01 -0.23 -0.19 0.00 -0.12 0.00 0.00 57.88 57.34 1gfd h LEU 8 Cb 0.07 -0.18 -0.05 0.00 -0.73 0.00 0.00 40.66 39.76 1gfd h LEU 8 CO 0.05 0.88 -0.15 0.49 -0.62 0.00 0.00 178.44 179.09 1gfd n PHE 9 N -4.12 -0.65 -2.97 1.25 3.01 -1.18 -4.86 117.46 107.94 1gfd n PHE 9 Ca 0.00 -1.26 -0.40 0.00 1.01 0.00 0.00 57.45 56.80 1gfd n PHE 9 Cb 0.41 0.20 -0.04 0.00 -0.01 0.00 0.00 39.48 40.04 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 -2.10 7.12 -0.26 4.37 1.01 -1.26 -2.62 116.67 122.93 1gfd s ASP 10 Ca 0.17 1.35 0.03 0.00 0.71 0.00 0.00 52.55 54.81 1gfd s ASP 10 Cb 0.00 -2.46 0.06 0.00 1.01 0.00 0.00 42.92 41.54 1gfd s ASP 10 CO 0.12 -0.10 -0.09 0.12 0.21 0.00 0.00 175.17 175.43 1gfd s PHE 11 N 0.56 3.19 -0.11 4.23 5.36 -0.80 -4.93 117.98 125.49 1gfd s PHE 11 Ca 0.40 -2.29 -0.13 0.00 -0.96 0.00 0.00 56.93 53.95 1gfd s PHE 11 Cb -0.19 -1.94 -0.05 0.00 -0.34 0.00 0.00 43.02 40.50 1gfd s PHE 11 CO 0.21 -0.87 0.31 -0.51 -1.46 0.00 0.00 175.22 172.90 1gfd s ASP 12 N 1.13 6.54 0.76 6.13 1.01 -1.26 -2.20 116.67 128.77 1gfd s ASP 12 Ca -0.08 0.64 -0.17 0.00 0.71 0.00 0.00 52.55 53.65 1gfd s ASP 12 Cb -0.20 -2.19 -0.12 0.00 1.01 0.00 0.00 42.92 41.42 1gfd s ASP 12 CO -0.05 0.20 -0.27 -2.65 0.21 0.00 0.00 175.17 172.60 1gfd n PRO 13 N 2.90 0.04 0.00 8.23 -0.02 -1.23 -4.89 135.00 140.03 1gfd n PRO 13 Ca -0.13 0.02 0.00 0.00 -2.02 0.00 0.00 63.50 61.37 1gfd n PRO 13 Cb 0.52 -1.17 0.00 0.00 -0.02 0.00 0.00 33.50 32.84 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 1.41 0.00 -4.40 -0.52 6.02 -1.26 -5.08 117.38 113.54 1gfd n GLN 14 Ca 0.04 -0.08 -0.27 0.00 -0.01 0.00 0.00 57.00 56.68 1gfd n GLN 14 Cb 0.51 -0.26 -0.07 0.00 1.02 0.00 0.00 30.24 31.45 1gfd n GLN 14 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 177.06 176.44 1gfd n GLU 15 N 0.00 0.71 -3.04 -1.09 -0.58 -1.26 -5.05 120.64 110.33 1gfd n GLU 15 Ca 0.00 -3.39 -0.44 0.00 -0.42 0.00 0.00 57.16 52.91 1gfd n GLU 15 Cb 0.32 1.40 -0.00 0.00 -0.57 0.00 0.00 31.44 32.59 1gfd n GLU 15 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 1gfd s ASP 16 N -3.51 7.10 0.00 1.62 1.11 -1.26 -3.76 116.67 117.97 1gfd s ASP 16 Ca 0.11 -3.08 0.00 0.00 0.18 0.00 0.00 52.55 49.76 1gfd s ASP 16 Cb 0.01 -2.35 0.00 0.00 1.07 0.00 0.00 42.92 41.64 1gfd s ASP 16 CO 0.08 -0.65 0.00 0.61 1.18 0.00 0.00 175.17 176.38 1gfd n GLY 17 N 3.85 1.22 2.85 0.21 0.00 -1.26 -5.12 105.19 106.95 1gfd n GLY 17 Ca 0.33 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.23 1gfd n GLY 17 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1gfd n GLU 18 N 0.00 -0.30 -3.75 1.61 2.13 -1.25 -4.69 120.64 114.39 1gfd n GLU 18 Ca 0.00 -0.09 -0.25 0.00 0.66 0.00 0.00 57.16 57.48 1gfd n GLU 18 Cb 0.00 -1.07 -0.02 0.00 0.27 0.00 0.00 31.44 30.62 1gfd n GLU 18 CO 0.00 0.00 0.00 -1.17 -0.41 0.00 0.00 177.13 175.55 1gfd s LEU 19 N 6.90 4.23 -0.16 4.31 2.96 -1.16 -4.78 118.68 130.98 1gfd s LEU 19 Ca 0.14 0.29 -0.04 0.00 -0.22 0.00 0.00 54.13 54.30 1gfd s LEU 19 Cb 0.02 -3.07 0.07 0.00 0.50 0.00 0.00 46.19 43.71 1gfd s LEU 19 CO 0.21 -0.08 0.18 -0.83 -1.32 0.00 0.00 176.35 174.51 1gfd s GLY 20 N -3.55 0.08 0.35 7.98 0.00 -1.26 -3.48 107.32 107.44 1gfd s GLY 20 Ca 0.37 0.24 0.06 0.00 0.00 0.00 0.00 44.72 45.39 1gfd s GLY 20 CO 0.30 1.94 0.21 1.97 0.00 0.00 0.00 173.10 177.52 1gfd n PHE 21 N 5.31 -0.33 -3.83 1.90 -1.74 -0.94 -4.66 117.46 113.18 1gfd n PHE 21 Ca -0.06 -2.61 -0.20 0.00 -0.56 0.00 0.00 57.45 54.03 1gfd n PHE 21 Cb 0.49 0.14 -0.17 0.00 1.52 0.00 0.00 39.48 41.47 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 -3.39 0.35 0.00 3.97 1.81 -1.26 -1.90 118.95 118.53 1gfd s ARG 22 Ca 0.29 0.14 0.00 0.00 -1.72 0.00 0.00 55.73 54.45 1gfd s ARG 22 Cb 0.01 -0.68 0.00 0.00 -0.45 0.00 0.00 34.95 33.84 1gfd s ARG 22 CO 0.21 -0.23 0.00 -2.13 -0.68 0.00 0.00 175.30 172.47 1gfd n ARG 23 N 4.73 0.00 0.00 3.54 0.00 -1.08 -1.13 116.66 122.72 1gfd n ARG 23 Ca -0.15 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.70 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 3.36 3.69 5.14 0.00 -0.70 -4.92 105.19 111.76 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 -0.99 6.87 -0.50 1.61 1.01 -0.28 -4.57 116.67 119.82 1gfd s ASP 25 Ca 0.00 2.11 -0.29 0.00 0.71 0.00 0.00 52.55 55.09 1gfd s ASP 25 Cb 0.00 -2.56 0.02 0.00 1.01 0.00 0.00 42.92 41.39 1gfd s ASP 25 CO 0.00 -0.69 1.25 -0.36 0.21 0.00 0.00 175.17 175.58 1gfd s PHE 26 N 2.16 2.60 0.33 4.23 0.40 -1.26 -0.97 117.98 125.47 1gfd s PHE 26 Ca 0.63 0.60 -0.27 0.00 -0.60 0.00 0.00 56.93 57.29 1gfd s PHE 26 Cb -0.31 -4.43 -0.09 0.00 0.51 0.00 0.00 43.02 38.69 1gfd s PHE 26 CO 0.27 -1.60 1.12 -1.50 0.70 0.00 0.00 175.22 174.20 1gfd s ILE 27 N 5.02 3.40 -0.59 0.64 1.10 -1.22 -4.68 121.20 124.88 1gfd s ILE 27 Ca 0.50 1.29 -0.14 0.00 -0.51 0.00 0.00 60.65 61.79 1gfd s ILE 27 Cb -0.09 -3.77 0.15 0.00 0.15 0.00 0.00 42.46 38.90 1gfd s ILE 27 CO 0.30 0.21 0.52 -2.28 -2.11 0.00 0.00 174.94 171.58 1gfd s HIS 28 N -1.32 3.39 -0.98 3.50 2.46 0.18 -2.59 115.29 119.92 1gfd s HIS 28 Ca 0.50 -1.57 -0.25 0.00 0.47 0.00 0.00 55.06 54.21 1gfd s HIS 28 Cb -0.30 -3.73 -0.15 0.00 -0.13 0.00 0.00 32.58 28.27 1gfd s HIS 28 CO 0.39 -1.00 2.15 0.08 -2.47 0.00 0.00 174.74 173.88 1gfd s VAL 29 N 1.23 3.18 0.32 0.89 1.01 0.33 -1.88 120.40 125.48 1gfd s VAL 29 Ca 0.07 -0.24 0.10 0.00 0.00 0.00 0.00 61.98 61.91 1gfd s VAL 29 Cb -0.25 -3.81 0.04 0.00 0.00 0.00 0.00 36.38 32.37 1gfd s VAL 29 CO -0.00 -0.35 1.73 -0.03 0.00 0.00 0.00 175.10 176.45 1gfd h MET 30 N 11.55 0.08 -0.53 2.72 4.05 -1.63 -3.43 114.93 127.74 1gfd h MET 30 Ca 0.06 -0.04 0.06 0.00 -0.28 0.00 0.00 59.70 59.50 1gfd h MET 30 Cb 0.99 -0.00 -0.18 0.00 -0.80 0.00 0.00 31.60 31.61 1gfd h MET 30 CO 1.08 0.51 -0.24 0.34 0.23 0.00 0.00 176.91 178.83 1gfd s ASP 31 N -6.90 -0.83 -0.57 1.39 2.15 -0.79 -5.03 116.67 106.10 1gfd s ASP 31 Ca -0.03 -0.37 -0.32 0.00 0.43 0.00 0.00 52.55 52.27 1gfd s ASP 31 Cb 0.14 1.10 -0.13 0.00 -0.30 0.00 0.00 42.92 43.73 1gfd s ASP 31 CO 0.75 -0.10 2.40 -0.46 -0.17 0.00 0.00 175.17 177.59 1gfd n ASN 32 N 4.11 1.63 -0.06 -0.34 0.23 -1.26 -3.47 115.26 116.11 1gfd n ASN 32 Ca 0.08 0.09 -0.17 0.00 -0.53 0.00 0.00 54.58 54.05 1gfd n ASN 32 Cb 0.60 -1.25 -0.14 0.00 -2.08 0.00 0.00 39.78 36.92 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 11.73 1.61 -4.39 0.53 7.64 -1.26 -4.93 113.62 124.56 1gfd n SER 33 Ca 0.47 0.10 -0.20 0.00 1.01 0.00 0.00 58.87 60.25 1gfd n SER 33 Cb 0.26 -0.36 -0.10 0.00 -1.01 0.00 0.00 64.21 63.00 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 -6.53 2.89 0.01 6.43 1.11 0.57 -5.01 116.67 116.14 1gfd s ASP 34 Ca -0.22 -1.04 -0.07 0.00 0.18 0.00 0.00 52.55 51.40 1gfd s ASP 34 Cb 0.07 -0.19 -0.04 0.00 1.07 0.00 0.00 42.92 43.84 1gfd s ASP 34 CO 0.73 -0.13 1.11 1.55 1.18 0.00 0.00 175.17 179.62 1gfd h PRO 35 N 2.45 -0.23 -0.52 8.23 0.13 -2.02 -3.11 132.00 136.93 1gfd h PRO 35 Ca -0.39 0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.76 1gfd h PRO 35 Cb 1.23 0.05 0.00 0.00 0.13 0.00 0.00 31.00 32.41 1gfd h PRO 35 CO 0.62 -0.15 0.00 -1.71 -0.23 0.00 0.00 178.00 176.53 1gfd n ASN 36 N -2.80 2.68 -3.83 1.44 5.15 -1.26 -4.72 115.26 111.92 1gfd n ASN 36 Ca -0.03 -2.16 -0.12 0.00 -0.60 0.00 0.00 54.58 51.68 1gfd n ASN 36 Cb 0.10 -0.38 -0.11 0.00 -0.53 0.00 0.00 39.78 38.86 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 -1.60 -0.11 0.26 1.20 0.52 -1.17 -1.23 118.94 116.81 1gfd s TRP 37 Ca 0.29 0.24 -0.03 0.00 0.02 0.00 0.00 56.10 56.62 1gfd s TRP 37 Cb 0.17 0.03 -0.02 0.00 -1.15 0.00 0.00 33.47 32.50 1gfd s TRP 37 CO 0.16 -0.20 0.31 -1.58 0.02 0.00 0.00 176.95 175.66 1gfd s TRP 38 N -0.61 1.01 -0.17 -1.98 0.51 -0.73 -0.31 118.94 116.66 1gfd s TRP 38 Ca -0.07 -1.23 -0.01 0.00 -2.12 0.00 0.00 56.10 52.67 1gfd s TRP 38 Cb -0.04 -0.29 -0.00 0.00 -0.81 0.00 0.00 33.47 32.32 1gfd s TRP 38 CO 0.01 -0.86 -0.12 0.21 -0.51 0.00 0.00 176.95 175.68 1gfd s LYS 39 N -3.81 3.27 0.00 4.98 2.20 -1.23 -1.53 119.74 123.62 1gfd s LYS 39 Ca 0.33 -0.71 0.00 0.00 -0.36 0.00 0.00 55.97 55.23 1gfd s LYS 39 Cb 0.03 -2.74 0.00 0.00 -1.51 0.00 0.00 37.83 33.61 1gfd s LYS 39 CO 0.15 -0.05 0.00 0.41 -0.36 0.00 0.00 175.35 175.50 1gfd n GLY 40 N 4.27 4.48 3.65 5.54 0.00 -0.65 -1.88 105.19 120.59 1gfd n GLY 40 Ca -0.19 -0.75 -0.07 0.00 0.00 0.00 0.00 46.02 45.01 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 -1.50 -1.63 0.00 4.61 0.00 -0.79 -2.03 121.76 120.42 1gfd s ALA 41 Ca 0.00 0.37 0.00 0.00 0.00 0.00 0.00 51.96 52.33 1gfd s ALA 41 Cb 0.00 0.64 0.00 0.00 0.00 0.00 0.00 23.12 23.76 1gfd s ALA 41 CO 0.00 -0.90 0.00 0.00 0.00 0.00 0.00 175.76 174.86 1gfd n HIS 43 N 0.00 0.31 0.00 0.00 -0.00 -1.26 -3.97 115.22 110.30 1gfd n HIS 43 Ca 0.00 0.32 0.00 0.00 -0.00 0.00 0.00 57.72 58.04 1gfd n HIS 43 Cb 0.00 -0.72 0.00 0.00 -0.00 0.00 0.00 29.99 29.27 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 -1.14 0.00 3.49 -1.39 0.00 -1.26 -5.16 105.19 99.73 1gfd n GLY 44 Ca 0.14 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.05 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 0.00 1.34 0.08 1.61 0.74 -1.25 -5.17 119.66 117.00 1gfd s GLN 45 Ca 0.00 -0.64 0.00 0.00 0.05 0.00 0.00 55.36 54.78 1gfd s GLN 45 Cb 0.00 0.57 0.02 0.00 1.10 0.00 0.00 33.01 34.69 1gfd s GLN 45 CO 0.00 -0.58 0.11 0.25 -0.55 0.00 0.00 175.29 174.52 1gfd n THR 46 N -0.37 0.00 -1.53 -0.34 -2.24 -1.26 -1.91 114.28 106.63 1gfd n THR 46 Ca -0.14 -0.21 0.00 0.00 -2.27 0.00 0.00 64.05 61.43 1gfd n THR 46 Cb 0.64 -1.16 0.00 0.00 -2.10 0.00 0.00 70.33 67.71 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 4.10 -0.06 3.75 3.38 0.00 -0.86 -4.62 105.19 110.88 1gfd n GLY 47 Ca 0.02 -1.63 -0.34 0.00 0.00 0.00 0.00 46.02 44.07 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 -1.95 3.03 -0.05 1.61 -1.94 -1.26 -1.64 119.30 117.11 1gfd s MET 48 Ca 0.00 -0.45 -0.11 0.00 -1.71 0.00 0.00 55.69 53.42 1gfd s MET 48 Cb 0.00 -2.84 0.02 0.00 2.01 0.00 0.00 34.83 34.02 1gfd s MET 48 CO 0.00 0.67 0.25 -0.59 -0.01 0.00 0.00 175.02 175.35 1gfd s PHE 49 N -1.08 -0.18 0.13 -0.03 -0.71 -0.58 -2.98 117.98 112.55 1gfd s PHE 49 Ca 0.19 0.36 -0.32 0.00 -1.04 0.00 0.00 56.93 56.11 1gfd s PHE 49 Cb -0.12 0.06 -0.12 0.00 -1.21 0.00 0.00 43.02 41.64 1gfd s PHE 49 CO 0.09 -0.27 1.75 -2.30 -1.34 0.00 0.00 175.22 173.15 1gfd n PRO 50 N 1.97 2.54 -0.12 1.99 -0.02 -1.26 -1.76 135.00 138.33 1gfd n PRO 50 Ca -0.18 0.92 0.01 0.00 -2.02 0.00 0.00 63.50 62.23 1gfd n PRO 50 Cb 0.57 -2.77 0.30 0.00 -0.02 0.00 0.00 33.50 31.57 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 7.55 0.80 0.00 -0.52 9.65 -1.45 -1.27 114.38 129.14 1gfd h ARG 51 Ca -0.46 -0.07 0.00 0.00 -1.10 0.00 0.00 59.98 58.35 1gfd h ARG 51 Cb 1.23 -0.17 0.00 0.00 -1.39 0.00 0.00 29.97 29.64 1gfd h ARG 51 CO 0.93 0.57 0.00 -1.71 2.80 0.00 0.00 179.97 182.56 1gfd n ASN 52 N -4.41 0.00 -0.83 -3.80 2.85 -1.26 -2.46 115.26 105.36 1gfd n ASN 52 Ca 0.06 -0.62 0.10 0.00 -0.11 0.00 0.00 54.58 54.00 1gfd n ASN 52 Cb 0.08 -0.04 0.28 0.00 1.24 0.00 0.00 39.78 41.34 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 -1.04 0.43 -4.34 1.20 4.02 -0.48 -4.87 117.16 112.09 1gfd n TYR 53 Ca 0.16 -0.21 -0.18 0.00 -0.01 0.00 0.00 57.90 57.66 1gfd n TYR 53 Cb 0.09 0.00 -0.10 0.00 -0.02 0.00 0.00 39.34 39.31 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 -1.57 0.53 -0.01 -0.72 -7.23 -1.03 0.75 120.40 111.13 1gfd s VAL 54 Ca 0.34 -2.00 -0.10 0.00 -1.81 0.00 0.00 61.98 58.41 1gfd s VAL 54 Cb 0.19 -2.60 0.01 0.00 0.56 0.00 0.00 36.38 34.53 1gfd s VAL 54 CO 0.26 0.00 0.20 0.28 -0.31 0.00 0.00 175.10 175.53 1gfd s THR 55 N -3.68 0.07 0.77 5.32 -1.32 -1.17 -4.58 115.64 111.05 1gfd s THR 55 Ca 0.37 -0.57 -0.15 0.00 -1.21 0.00 0.00 61.69 60.13 1gfd s THR 55 Cb 0.07 -0.48 0.03 0.00 -1.51 0.00 0.00 72.50 70.61 1gfd s THR 55 CO 0.15 -0.31 0.98 -0.81 -2.21 0.00 0.00 174.62 172.41 1gfd n PRO 56 N 1.51 0.33 -2.44 7.08 -0.04 -1.26 0.17 135.00 140.36 1gfd n PRO 56 Ca -0.22 0.17 -0.32 0.00 -0.04 0.00 0.00 63.50 63.10 1gfd n PRO 56 Cb 0.56 -2.24 -0.04 0.00 -0.04 0.00 0.00 33.50 31.74 1gfd n PRO 56 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1gfd s VAL 57 N -1.97 4.51 0.66 0.52 1.01 -1.25 -4.56 120.40 119.32 1gfd s VAL 57 Ca 0.72 1.24 -0.11 0.00 0.00 0.00 0.00 61.98 63.83 1gfd s VAL 57 Cb -0.32 -3.70 -0.02 0.00 0.00 0.00 0.00 36.38 32.34 1gfd s VAL 57 CO 0.52 -0.65 1.05 0.20 0.00 0.00 0.00 175.10 176.23 1gfd s ASN 58 N -2.97 5.87 0.00 3.32 0.01 -1.26 -5.09 114.94 114.82 1gfd s ASN 58 Ca 0.59 1.36 0.19 0.00 -0.71 0.00 0.00 52.86 54.30 1gfd s ASN 58 Cb -0.10 -2.32 1.12 0.00 0.41 0.00 0.00 41.25 40.36 1gfd s ASN 58 CO 0.29 -1.09 1.52 0.54 -1.51 0.00 0.00 177.10 176.84