#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 6.23 -0.23 1.61 0.01 -1.26 -4.76 113.70 115.30 1gfd s SER 2 Ca 0.00 -0.79 0.20 0.00 1.31 0.00 0.00 55.95 56.67 1gfd s SER 2 Cb 0.00 -2.52 0.48 0.00 0.21 0.00 0.00 66.02 64.20 1gfd s SER 2 CO 0.00 -1.66 1.14 1.07 0.41 0.00 0.00 173.24 174.20 1gfd n THR 3 N 6.29 1.39 -4.73 1.44 5.66 -1.26 -5.02 114.28 118.05 1gfd n THR 3 Ca 0.06 -2.93 -0.26 0.00 -3.05 0.00 0.00 64.05 57.87 1gfd n THR 3 Cb 0.48 0.71 -0.17 0.00 -1.55 0.00 0.00 70.33 69.81 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 -3.22 1.68 0.00 1.09 2.02 -1.26 0.18 117.35 117.84 1gfd s TYR 4 Ca 0.33 -0.62 0.00 0.00 -0.37 0.00 0.00 57.07 56.41 1gfd s TYR 4 Cb 0.35 -1.19 0.00 0.00 -0.40 0.00 0.00 41.96 40.72 1gfd s TYR 4 CO -0.04 -0.29 0.00 1.33 -1.57 0.00 0.00 175.55 174.98 1gfd n VAL 5 N 3.68 0.00 -3.46 0.71 0.24 -0.93 -3.39 118.33 115.17 1gfd n VAL 5 Ca -0.22 0.00 -0.23 0.00 -2.04 0.00 0.00 64.34 61.86 1gfd n VAL 5 Cb 0.52 0.00 -0.12 0.00 -1.47 0.00 0.00 33.84 32.77 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 -0.69 0.26 -0.14 7.34 -0.21 0.16 -3.53 119.66 122.85 1gfd s GLN 6 Ca 0.00 -0.31 -0.12 0.00 0.02 0.00 0.00 55.36 54.94 1gfd s GLN 6 Cb 0.00 -0.89 -0.05 0.00 1.00 0.00 0.00 33.01 33.07 1gfd s GLN 6 CO 0.00 -1.02 0.56 0.00 -2.12 0.00 0.00 175.29 172.71 1gfd n ALA 7 N 5.28 -0.02 -0.04 6.09 0.00 0.24 -2.93 120.51 129.14 1gfd n ALA 7 Ca -0.04 0.07 -0.12 0.00 0.00 0.00 0.00 53.44 53.35 1gfd n ALA 7 Cb 0.44 -0.56 -0.06 0.00 0.00 0.00 0.00 19.45 19.27 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 2.28 0.24 0.00 0.00 5.85 0.89 -1.53 115.31 123.04 1gfd h LEU 8 Ca -0.04 -0.32 -0.54 0.00 0.84 0.00 0.00 57.88 57.81 1gfd h LEU 8 Cb 0.39 -0.06 -0.12 0.00 0.37 0.00 0.00 40.66 41.23 1gfd h LEU 8 CO 0.29 0.51 -0.45 0.49 -0.34 0.00 0.00 178.44 178.94 1gfd n PHE 9 N -4.76 0.09 -2.79 1.25 3.72 -1.18 -4.82 117.46 108.97 1gfd n PHE 9 Ca -0.06 -2.56 -0.41 0.00 -0.05 0.00 0.00 57.45 54.38 1gfd n PHE 9 Cb 0.22 0.01 -0.05 0.00 -0.94 0.00 0.00 39.48 38.72 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 -3.43 7.46 -0.23 4.37 1.01 -1.26 -3.17 116.67 121.42 1gfd s ASP 10 Ca 0.21 1.74 0.02 0.00 0.71 0.00 0.00 52.55 55.23 1gfd s ASP 10 Cb 0.01 -2.57 0.05 0.00 1.01 0.00 0.00 42.92 41.42 1gfd s ASP 10 CO 0.15 -0.01 -0.11 0.12 0.21 0.00 0.00 175.17 175.53 1gfd s PHE 11 N -0.22 2.77 0.04 4.23 5.36 -0.97 -4.91 117.98 124.28 1gfd s PHE 11 Ca 0.44 -1.90 -0.12 0.00 -0.96 0.00 0.00 56.93 54.39 1gfd s PHE 11 Cb -0.23 -1.77 -0.06 0.00 -0.34 0.00 0.00 43.02 40.63 1gfd s PHE 11 CO 0.29 -0.81 0.39 0.16 -1.46 0.00 0.00 175.22 173.79 1gfd s ASP 12 N 1.27 6.69 0.01 6.13 1.47 -1.26 -1.87 116.67 129.12 1gfd s ASP 12 Ca -0.04 0.84 0.00 0.00 1.18 0.00 0.00 52.55 54.53 1gfd s ASP 12 Cb -0.18 -2.20 0.00 0.00 -0.34 0.00 0.00 42.92 40.20 1gfd s ASP 12 CO -0.07 0.25 0.00 -2.65 0.68 0.00 0.00 175.17 173.37 1gfd n PRO 13 N 1.33 2.00 0.00 2.11 -0.02 -1.25 -4.93 135.00 134.24 1gfd n PRO 13 Ca -0.11 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.37 1gfd n PRO 13 Cb 0.52 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 34.00 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 -0.02 0.00 -4.11 -0.52 1.13 -1.26 -5.10 117.38 107.50 1gfd n GLN 14 Ca 0.00 0.00 -0.25 0.00 -1.94 0.00 0.00 57.00 54.81 1gfd n GLN 14 Cb 0.00 0.00 -0.06 0.00 0.11 0.00 0.00 30.24 30.29 1gfd n GLN 14 CO 0.00 0.00 0.00 -1.21 -1.44 0.00 0.00 177.06 174.41 1gfd s GLU 15 N 0.00 2.81 -0.16 -1.09 2.02 -1.26 -5.04 118.70 115.99 1gfd s GLU 15 Ca 0.00 -0.96 -0.29 0.00 0.02 0.00 0.00 54.97 53.74 1gfd s GLU 15 Cb 0.00 -2.57 -0.05 0.00 0.10 0.00 0.00 34.13 31.61 1gfd s GLU 15 CO 0.00 0.46 1.85 0.34 0.02 0.00 0.00 175.26 177.93 1gfd s ASP 16 N -3.25 6.17 -1.20 -0.19 2.15 -1.26 -2.14 116.67 116.96 1gfd s ASP 16 Ca 0.31 1.95 -0.06 0.00 0.43 0.00 0.00 52.55 55.18 1gfd s ASP 16 Cb -0.09 -2.53 0.01 0.00 -0.30 0.00 0.00 42.92 40.01 1gfd s ASP 16 CO 0.23 -1.38 0.80 0.61 -0.17 0.00 0.00 175.17 175.26 1gfd n GLY 17 N 4.89 -0.30 3.97 2.66 0.00 -1.26 -5.00 105.19 110.16 1gfd n GLY 17 Ca 0.22 0.05 -0.22 0.00 0.00 0.00 0.00 46.02 46.07 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 -5.86 2.31 0.62 1.61 2.12 -0.91 -4.61 118.70 113.98 1gfd s GLU 18 Ca 0.40 -0.81 -0.13 0.00 0.36 0.00 0.00 54.97 54.79 1gfd s GLU 18 Cb -0.17 -2.42 -0.03 0.00 0.26 0.00 0.00 34.13 31.76 1gfd s GLU 18 CO 0.49 -0.93 1.03 -1.17 -0.54 0.00 0.00 175.26 174.14 1gfd s LEU 19 N -4.90 3.31 -0.16 2.70 2.96 -0.81 -4.79 118.68 116.99 1gfd s LEU 19 Ca 0.60 1.55 -0.07 0.00 -0.22 0.00 0.00 54.13 55.99 1gfd s LEU 19 Cb -0.09 -4.49 0.07 0.00 0.50 0.00 0.00 46.19 42.18 1gfd s LEU 19 CO 0.40 -1.01 0.36 -0.83 -1.32 0.00 0.00 176.35 173.94 1gfd s GLY 20 N -3.70 -0.26 0.00 7.98 0.00 -1.26 -3.85 107.32 106.23 1gfd s GLY 20 Ca 0.58 1.30 0.00 0.00 0.00 0.00 0.00 44.72 46.60 1gfd s GLY 20 CO 0.48 1.99 0.00 1.97 0.00 0.00 0.00 173.10 177.54 1gfd n PHE 21 N 4.98 -0.33 -3.88 1.90 -1.74 -0.78 -4.75 117.46 112.87 1gfd n PHE 21 Ca -0.13 0.00 -0.15 0.00 -0.56 0.00 0.00 57.45 56.61 1gfd n PHE 21 Cb 0.51 0.00 -0.15 0.00 1.52 0.00 0.00 39.48 41.36 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 -1.52 0.10 0.00 3.97 1.81 -1.26 -2.29 118.95 119.76 1gfd s ARG 22 Ca 0.00 0.07 0.00 0.00 -1.72 0.00 0.00 55.73 54.08 1gfd s ARG 22 Cb 0.00 -0.25 0.00 0.00 -0.45 0.00 0.00 34.95 34.25 1gfd s ARG 22 CO 0.00 -0.08 0.00 -2.13 -0.68 0.00 0.00 175.30 172.41 1gfd n ARG 23 N 3.72 0.00 0.00 3.54 0.63 -1.19 -0.80 116.66 122.57 1gfd n ARG 23 Ca -0.22 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.71 1gfd n ARG 23 Cb 0.54 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.45 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 3.10 3.67 5.14 0.00 -0.58 -4.90 105.19 111.63 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 -1.14 6.67 -0.58 1.61 1.11 0.02 -4.50 116.67 119.85 1gfd s ASP 25 Ca 0.00 2.28 -0.28 0.00 0.18 0.00 0.00 52.55 54.74 1gfd s ASP 25 Cb 0.00 -2.54 0.02 0.00 1.07 0.00 0.00 42.92 41.46 1gfd s ASP 25 CO 0.00 -0.90 1.38 -0.36 1.18 0.00 0.00 175.17 176.47 1gfd s PHE 26 N 3.56 2.32 0.44 4.23 0.40 -1.26 -0.59 117.98 127.08 1gfd s PHE 26 Ca 0.73 0.42 -0.23 0.00 -0.60 0.00 0.00 56.93 57.25 1gfd s PHE 26 Cb -0.35 -4.43 -0.09 0.00 0.51 0.00 0.00 43.02 38.67 1gfd s PHE 26 CO 0.30 -1.93 1.06 -1.50 0.70 0.00 0.00 175.22 173.85 1gfd s ILE 27 N 5.92 3.65 -0.54 0.64 1.10 -1.23 -4.66 121.20 126.07 1gfd s ILE 27 Ca 0.49 1.18 -0.08 0.00 -0.51 0.00 0.00 60.65 61.73 1gfd s ILE 27 Cb -0.10 -3.56 0.14 0.00 0.15 0.00 0.00 42.46 39.09 1gfd s ILE 27 CO 0.24 -0.08 0.41 -2.28 -2.11 0.00 0.00 174.94 171.12 1gfd s HIS 28 N -1.75 3.48 -0.77 3.50 5.65 0.29 -2.19 115.29 123.50 1gfd s HIS 28 Ca 0.62 -2.12 -0.26 0.00 0.25 0.00 0.00 55.06 53.55 1gfd s HIS 28 Cb -0.21 -3.45 -0.13 0.00 -1.18 0.00 0.00 32.58 27.60 1gfd s HIS 28 CO 0.26 -0.96 2.42 0.08 -0.65 0.00 0.00 174.74 175.89 1gfd s VAL 29 N 0.89 3.00 0.39 0.89 1.01 0.47 -1.58 120.40 125.46 1gfd s VAL 29 Ca 0.10 -0.00 0.07 0.00 0.00 0.00 0.00 61.98 62.14 1gfd s VAL 29 Cb -0.23 -3.00 0.22 0.00 0.00 0.00 0.00 36.38 33.37 1gfd s VAL 29 CO -0.03 -0.00 1.99 -0.03 0.00 0.00 0.00 175.10 177.03 1gfd h MET 30 N 13.25 0.49 -0.08 2.72 4.05 -0.90 -3.43 114.93 131.02 1gfd h MET 30 Ca -0.02 -0.06 0.29 0.00 -0.28 0.00 0.00 59.70 59.63 1gfd h MET 30 Cb 1.02 -0.10 -0.22 0.00 -0.80 0.00 0.00 31.60 31.50 1gfd h MET 30 CO 1.01 0.41 0.33 0.34 0.23 0.00 0.00 176.91 179.23 1gfd s ASP 31 N -6.73 -0.10 -0.58 1.39 2.15 -1.09 -5.03 116.67 106.68 1gfd s ASP 31 Ca -0.08 0.07 -0.26 0.00 0.43 0.00 0.00 52.55 52.71 1gfd s ASP 31 Cb 0.17 1.09 -0.10 0.00 -0.30 0.00 0.00 42.92 43.77 1gfd s ASP 31 CO 0.74 -0.02 2.45 -0.46 -0.17 0.00 0.00 175.17 177.71 1gfd n ASN 32 N 5.33 1.99 -0.01 -0.34 6.94 -1.26 -3.61 115.26 124.29 1gfd n ASN 32 Ca -0.09 -0.51 -0.01 0.00 -0.02 0.00 0.00 54.58 53.95 1gfd n ASN 32 Cb 0.55 -1.50 -0.00 0.00 -2.36 0.00 0.00 39.78 36.46 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 15.42 0.34 -4.90 0.53 2.88 -1.26 -4.98 113.62 121.64 1gfd n SER 33 Ca 0.42 0.21 -0.28 0.00 -1.33 0.00 0.00 58.87 57.89 1gfd n SER 33 Cb 0.47 -0.56 0.00 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 -4.10 6.25 0.00 -3.46 1.11 -0.71 -5.01 116.67 110.75 1gfd s ASP 34 Ca -0.04 0.97 -0.03 0.00 0.18 0.00 0.00 52.55 53.63 1gfd s ASP 34 Cb 0.01 -2.26 -0.02 0.00 1.07 0.00 0.00 42.92 41.72 1gfd s ASP 34 CO 0.06 -0.61 0.80 1.55 1.18 0.00 0.00 175.17 178.14 1gfd h PRO 35 N 0.17 -0.12 -0.00 8.23 0.13 -2.02 -3.27 132.00 135.11 1gfd h PRO 35 Ca -0.47 0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 1gfd h PRO 35 Cb 1.20 0.03 0.00 0.00 0.13 0.00 0.00 31.00 32.36 1gfd h PRO 35 CO 0.62 -0.08 -0.02 -1.71 -0.23 0.00 0.00 178.00 176.57 1gfd n ASN 36 N -2.42 0.23 -4.16 1.44 4.05 -1.26 -4.70 115.26 108.44 1gfd n ASN 36 Ca -0.02 -0.71 -0.15 0.00 0.45 0.00 0.00 54.58 54.15 1gfd n ASN 36 Cb 0.05 -0.09 -0.11 0.00 1.23 0.00 0.00 39.78 40.85 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 -2.26 1.03 0.21 1.20 0.52 -1.23 0.09 118.94 118.49 1gfd s TRP 37 Ca 0.38 -0.61 -0.10 0.00 0.02 0.00 0.00 56.10 55.78 1gfd s TRP 37 Cb 0.21 -0.57 -0.01 0.00 -1.15 0.00 0.00 33.47 31.95 1gfd s TRP 37 CO 0.42 -0.00 0.37 -1.58 0.02 0.00 0.00 176.95 176.17 1gfd s TRP 38 N -2.15 0.45 -0.16 -1.98 0.51 -0.90 -1.75 118.94 112.97 1gfd s TRP 38 Ca 0.02 -0.79 -0.04 0.00 -2.12 0.00 0.00 56.10 53.17 1gfd s TRP 38 Cb -0.05 0.02 -0.03 0.00 -0.81 0.00 0.00 33.47 32.60 1gfd s TRP 38 CO 0.00 -0.85 -0.02 0.21 -0.51 0.00 0.00 176.95 175.79 1gfd s LYS 39 N -4.01 3.69 0.00 4.98 2.20 -1.24 -1.71 119.74 123.66 1gfd s LYS 39 Ca 0.22 -0.48 0.00 0.00 -0.36 0.00 0.00 55.97 55.35 1gfd s LYS 39 Cb 0.02 -2.96 0.00 0.00 -1.51 0.00 0.00 37.83 33.38 1gfd s LYS 39 CO 0.06 0.27 0.00 0.41 -0.36 0.00 0.00 175.35 175.73 1gfd n GLY 40 N 3.45 3.44 3.51 5.54 0.00 0.17 -0.27 105.19 121.02 1gfd n GLY 40 Ca -0.17 -0.57 -0.10 0.00 0.00 0.00 0.00 46.02 45.18 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 -1.06 -1.63 0.00 4.61 0.00 -0.62 -1.26 121.76 121.79 1gfd s ALA 41 Ca 0.00 0.54 0.00 0.00 0.00 0.00 0.00 51.96 52.50 1gfd s ALA 41 Cb 0.00 0.73 0.00 0.00 0.00 0.00 0.00 23.12 23.85 1gfd s ALA 41 CO 0.00 -0.79 0.00 0.00 0.00 0.00 0.00 175.76 174.97 1gfd n HIS 43 N -0.03 0.44 -0.99 0.00 -0.00 -1.26 -3.99 115.22 109.40 1gfd n HIS 43 Ca 0.00 -0.48 -0.01 0.00 -0.00 0.00 0.00 57.72 57.23 1gfd n HIS 43 Cb 0.00 -1.44 -0.01 0.00 -0.00 0.00 0.00 29.99 28.54 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 5.36 0.14 2.99 -1.39 0.00 -1.26 -4.82 105.19 106.21 1gfd n GLY 44 Ca 0.45 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.34 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 -2.01 0.14 0.44 1.61 -1.52 -1.26 -5.16 119.66 111.90 1gfd s GLN 45 Ca 0.00 0.30 -0.05 0.00 -1.95 0.00 0.00 55.36 53.66 1gfd s GLN 45 Cb 0.00 -0.04 0.10 0.00 -0.22 0.00 0.00 33.01 32.85 1gfd s GLN 45 CO 0.00 -0.09 0.60 0.25 -0.25 0.00 0.00 175.29 175.79 1gfd n THR 46 N 3.60 0.00 -1.19 -0.19 -2.24 -1.26 -2.33 114.28 110.66 1gfd n THR 46 Ca -0.19 -0.58 0.00 0.00 -2.27 0.00 0.00 64.05 61.01 1gfd n THR 46 Cb 0.55 -1.55 0.00 0.00 -2.10 0.00 0.00 70.33 67.24 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 0.91 0.35 3.64 3.38 0.00 -0.39 -4.55 105.19 108.53 1gfd n GLY 47 Ca 0.08 -1.69 -0.32 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 2.68 -0.04 1.61 -1.94 -1.26 -0.66 119.30 117.69 1gfd s MET 48 Ca 0.00 -0.66 -0.08 0.00 -1.71 0.00 0.00 55.69 53.25 1gfd s MET 48 Cb 0.00 -2.59 0.01 0.00 2.01 0.00 0.00 34.83 34.26 1gfd s MET 48 CO 0.00 0.62 0.19 -0.59 -0.01 0.00 0.00 175.02 175.22 1gfd s PHE 49 N -1.03 -0.12 0.07 -0.03 -0.71 -0.69 -1.92 117.98 113.54 1gfd s PHE 49 Ca 0.18 0.27 -0.34 0.00 -1.04 0.00 0.00 56.93 56.01 1gfd s PHE 49 Cb -0.11 0.03 -0.13 0.00 -1.21 0.00 0.00 43.02 41.60 1gfd s PHE 49 CO 0.09 -0.19 1.71 -2.30 -1.34 0.00 0.00 175.22 173.18 1gfd n PRO 50 N 2.30 2.23 0.20 1.99 -0.02 -1.26 -2.11 135.00 138.32 1gfd n PRO 50 Ca -0.17 0.81 0.06 0.00 -2.02 0.00 0.00 63.50 62.18 1gfd n PRO 50 Cb 0.57 -2.62 0.53 0.00 -0.02 0.00 0.00 33.50 31.97 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 7.29 0.10 0.00 -0.52 1.12 -0.62 -1.43 114.38 120.32 1gfd h ARG 51 Ca -0.46 -0.01 0.00 0.00 -1.11 0.00 0.00 59.98 58.40 1gfd h ARG 51 Cb 1.26 -0.02 0.00 0.00 -0.01 0.00 0.00 29.97 31.20 1gfd h ARG 51 CO 0.91 0.16 0.00 -1.71 -3.11 0.00 0.00 179.97 176.22 1gfd n ASN 52 N -4.42 0.00 -1.46 -3.80 2.85 -1.25 -2.75 115.26 104.43 1gfd n ASN 52 Ca -0.02 -1.06 0.10 0.00 -0.11 0.00 0.00 54.58 53.49 1gfd n ASN 52 Cb 0.17 0.00 0.34 0.00 1.24 0.00 0.00 39.78 41.52 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 -0.90 1.25 -4.24 1.20 4.02 -0.54 -4.85 117.16 113.09 1gfd n TYR 53 Ca 0.17 -0.57 -0.16 0.00 -0.01 0.00 0.00 57.90 57.34 1gfd n TYR 53 Cb 0.08 -0.14 -0.09 0.00 -0.02 0.00 0.00 39.34 39.17 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 -1.50 0.01 -0.18 -0.72 -7.23 -1.11 0.13 120.40 109.80 1gfd s VAL 54 Ca 0.49 -2.00 -0.16 0.00 -1.81 0.00 0.00 61.98 58.50 1gfd s VAL 54 Cb 0.29 -2.50 0.05 0.00 0.56 0.00 0.00 36.38 34.78 1gfd s VAL 54 CO 0.28 0.00 0.47 0.28 -0.31 0.00 0.00 175.10 175.82 1gfd s THR 55 N -3.79 -0.00 0.71 5.32 -1.32 -1.15 -4.53 115.64 110.88 1gfd s THR 55 Ca 0.40 0.00 -0.16 0.00 -1.21 0.00 0.00 61.69 60.72 1gfd s THR 55 Cb 0.05 -0.66 0.03 0.00 -1.51 0.00 0.00 72.50 70.40 1gfd s THR 55 CO 0.20 0.00 1.25 -0.81 -2.21 0.00 0.00 174.62 173.05 1gfd n PRO 56 N 2.87 0.75 -1.30 7.08 -0.04 -1.26 0.37 135.00 143.47 1gfd n PRO 56 Ca -0.14 0.32 -0.29 0.00 -0.04 0.00 0.00 63.50 63.35 1gfd n PRO 56 Cb 0.57 -2.49 0.04 0.00 -0.04 0.00 0.00 33.50 31.58 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 -2.46 3.32 -2.49 0.52 0.31 -1.22 -4.75 118.33 111.57 1gfd n VAL 57 Ca 0.15 -2.75 -0.43 0.00 -0.01 0.00 0.00 64.34 61.30 1gfd n VAL 57 Cb 0.49 -1.29 -0.02 0.00 -0.91 0.00 0.00 33.84 32.11 1gfd n VAL 57 CO 0.00 0.00 0.00 0.21 -1.32 0.00 0.00 176.83 175.72 1gfd s ASN 58 N -0.80 6.49 0.00 4.52 3.84 -1.26 -5.12 114.94 122.61 1gfd s ASN 58 Ca 0.52 0.59 0.00 0.00 0.21 0.00 0.00 52.86 54.18 1gfd s ASN 58 Cb 0.40 -2.55 0.00 0.00 -0.55 0.00 0.00 41.25 38.55 1gfd s ASN 58 CO -0.10 -1.35 0.00 0.54 -2.79 0.00 0.00 177.10 173.40