#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fv1 s HIS 5 N 0.00 -0.01 -0.05 4.31 3.76 -1.26 -5.08 115.29 116.96 1fv1 s HIS 5 Ca 0.00 0.03 0.01 0.00 -0.15 0.00 0.00 55.06 54.95 1fv1 s HIS 5 Cb 0.00 -0.02 0.02 0.00 1.11 0.00 0.00 32.58 33.68 1fv1 s HIS 5 CO 0.00 -0.16 -0.07 0.08 -0.85 0.00 0.00 174.74 173.73 1fv1 s VAL 6 N -0.70 0.76 -0.15 -0.90 1.01 -1.26 -5.03 120.40 114.14 1fv1 s VAL 6 Ca -0.08 -0.25 0.00 0.00 0.00 0.00 0.00 61.98 61.66 1fv1 s VAL 6 Cb -0.05 -0.75 -0.00 0.00 0.00 0.00 0.00 36.38 35.58 1fv1 s VAL 6 CO 0.01 0.28 -0.15 -0.63 0.00 0.00 0.00 175.10 174.60 1fv1 s ILE 7 N 0.89 2.74 -0.07 2.22 1.01 -1.26 -1.38 121.20 125.35 1fv1 s ILE 7 Ca -0.11 -0.75 0.03 0.00 0.00 0.00 0.00 60.65 59.82 1fv1 s ILE 7 Cb -0.15 -2.15 0.00 0.00 0.01 0.00 0.00 42.46 40.17 1fv1 s ILE 7 CO 0.01 0.51 -0.17 -0.63 0.00 0.00 0.00 174.94 174.67 1fv1 s ILE 8 N 0.75 1.47 -0.50 2.92 1.01 0.96 -4.95 121.20 122.86 1fv1 s ILE 8 Ca -0.06 -0.69 -0.17 0.00 0.00 0.00 0.00 60.65 59.72 1fv1 s ILE 8 Cb -0.15 -1.29 0.07 0.00 0.01 0.00 0.00 42.46 41.09 1fv1 s ILE 8 CO 0.01 0.43 0.52 -1.58 0.00 0.00 0.00 174.94 174.31 1fv1 s GLN 9 N 0.39 3.04 -0.17 2.79 0.74 -1.26 0.98 119.66 126.17 1fv1 s GLN 9 Ca -0.12 -1.18 -0.03 0.00 0.05 0.00 0.00 55.36 54.08 1fv1 s GLN 9 Cb -0.15 -4.14 -0.02 0.00 1.10 0.00 0.00 33.01 29.80 1fv1 s GLN 9 CO 0.05 -1.16 -0.06 0.00 -0.55 0.00 0.00 175.29 173.57 1fv1 s ALA 10 N 2.12 2.88 0.06 1.58 0.00 0.01 -4.99 121.76 123.42 1fv1 s ALA 10 Ca 0.09 -0.92 0.01 0.00 0.00 0.00 0.00 51.96 51.14 1fv1 s ALA 10 Cb -0.22 -1.52 -0.03 0.00 0.00 0.00 0.00 23.12 21.34 1fv1 s ALA 10 CO 0.09 0.07 -0.06 -1.83 0.00 0.00 0.00 175.76 174.03 1fv1 s GLU 11 N 0.63 0.63 0.12 0.00 -1.05 -1.26 -1.02 118.70 116.75 1fv1 s GLU 11 Ca -0.03 -1.05 -0.19 0.00 -0.15 0.00 0.00 54.97 53.54 1fv1 s GLU 11 Cb -0.15 -0.10 0.05 0.00 -0.44 0.00 0.00 34.13 33.49 1fv1 s GLU 11 CO 0.03 -0.02 0.49 -0.59 0.95 0.00 0.00 175.26 176.11 1fv1 s PHE 12 N -2.76 -0.35 -0.02 4.83 -0.12 -0.24 -4.96 117.98 114.36 1fv1 s PHE 12 Ca 0.01 0.14 0.01 0.00 -0.05 0.00 0.00 56.93 57.04 1fv1 s PHE 12 Cb -0.01 0.37 0.01 0.00 -0.63 0.00 0.00 43.02 42.76 1fv1 s PHE 12 CO -0.04 -0.73 -0.02 -0.47 -0.05 0.00 0.00 175.22 173.90 1fv1 s TYR 13 N -3.50 0.37 -0.14 3.49 6.14 -1.26 -0.78 117.35 121.67 1fv1 s TYR 13 Ca 0.01 -0.05 0.01 0.00 0.64 0.00 0.00 57.07 57.68 1fv1 s TYR 13 Cb 0.00 -0.34 0.02 0.00 0.42 0.00 0.00 41.96 42.06 1fv1 s TYR 13 CO -0.10 -0.07 -0.17 -1.17 0.64 0.00 0.00 175.55 174.67 1fv1 s LEU 14 N 0.46 1.87 0.07 6.97 2.96 0.17 -4.97 118.68 126.21 1fv1 s LEU 14 Ca -0.05 -0.52 0.03 0.00 -0.22 0.00 0.00 54.13 53.37 1fv1 s LEU 14 Cb -0.08 -1.27 -0.04 0.00 0.50 0.00 0.00 46.19 45.31 1fv1 s LEU 14 CO -0.01 0.01 0.05 0.20 -1.32 0.00 0.00 176.35 175.28 1fv1 s ASN 15 N 1.13 5.34 0.00 3.68 0.01 -1.26 0.58 114.94 124.43 1fv1 s ASN 15 Ca -0.02 -0.05 0.24 0.00 -0.71 0.00 0.00 52.86 52.32 1fv1 s ASN 15 Cb -0.14 -1.39 1.04 0.00 0.41 0.00 0.00 41.25 41.17 1fv1 s ASN 15 CO -0.06 0.19 1.71 -0.81 -1.51 0.00 0.00 177.10 176.62 1fv1 n PRO 16 N 0.63 1.49 0.31 -0.60 -0.04 -1.26 -4.88 135.00 130.66 1fv1 n PRO 16 Ca -0.10 -0.73 0.19 0.00 -0.04 0.00 0.00 63.50 62.82 1fv1 n PRO 16 Cb 0.52 -1.41 1.03 0.00 -0.04 0.00 0.00 33.50 33.60 1fv1 n PRO 16 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 1fv1 h ASP 17 N 1.58 0.00 -5.67 3.54 5.19 -2.00 -3.46 116.42 115.60 1fv1 h ASP 17 Ca 0.00 0.00 -0.36 0.00 -0.62 0.00 0.00 57.03 56.05 1fv1 h ASP 17 Cb 0.34 0.00 0.15 0.00 0.18 0.00 0.00 39.33 40.00 1fv1 h ASP 17 CO 0.00 0.01 -0.71 0.00 -3.12 0.00 0.00 179.24 175.42 1fv1 n GLN 18 N -3.43 -7.17 -4.69 3.56 6.02 0.20 -5.00 117.38 106.86 1fv1 n GLN 18 Ca -0.03 0.83 -0.33 0.00 -0.01 0.00 0.00 57.00 57.46 1fv1 n GLN 18 Cb 0.10 -5.82 -0.12 0.00 1.02 0.00 0.00 30.24 25.42 1fv1 n GLN 18 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 177.06 174.93 1fv1 s SER 19 N -3.85 4.39 0.11 1.08 0.01 -0.98 -4.92 113.70 109.55 1fv1 s SER 19 Ca 0.28 -0.14 0.04 0.00 1.31 0.00 0.00 55.95 57.44 1fv1 s SER 19 Cb -0.12 -1.26 -0.04 0.00 0.21 0.00 0.00 66.02 64.81 1fv1 s SER 19 CO 0.72 0.29 -0.10 -0.83 0.41 0.00 0.00 173.24 173.73 1fv1 s GLY 20 N -0.40 0.92 -0.02 3.44 0.00 -1.26 0.45 107.32 110.45 1fv1 s GLY 20 Ca 0.05 -1.29 -0.09 0.00 0.00 0.00 0.00 44.72 43.40 1fv1 s GLY 20 CO 0.02 -1.37 0.18 1.85 0.00 0.00 0.00 173.10 173.79 1fv1 s GLU 21 N -3.10 0.47 -0.11 2.90 2.12 0.04 -4.90 118.70 116.12 1fv1 s GLU 21 Ca 0.09 -0.22 -0.04 0.00 0.36 0.00 0.00 54.97 55.16 1fv1 s GLU 21 Cb -0.01 0.20 0.06 0.00 0.26 0.00 0.00 34.13 34.64 1fv1 s GLU 21 CO 0.00 -0.11 0.16 0.12 -0.54 0.00 0.00 175.26 174.89 1fv1 s PHE 22 N -1.07 -0.14 0.15 5.30 2.19 -1.26 -1.08 117.98 122.06 1fv1 s PHE 22 Ca -0.12 0.43 -0.07 0.00 0.33 0.00 0.00 56.93 57.51 1fv1 s PHE 22 Cb -0.06 -0.34 -0.02 0.00 -1.31 0.00 0.00 43.02 41.30 1fv1 s PHE 22 CO 0.02 -0.35 0.21 0.00 1.83 0.00 0.00 175.22 176.93 1fv1 s MET 23 N 2.28 1.06 -0.07 10.12 0.23 -0.19 -1.23 119.30 131.49 1fv1 s MET 23 Ca 0.04 -1.22 0.05 0.00 -1.03 0.00 0.00 55.69 53.53 1fv1 s MET 23 Cb -0.13 0.34 -0.01 0.00 -1.53 0.00 0.00 34.83 33.50 1fv1 s MET 23 CO -0.07 -0.36 -0.23 -0.06 -2.03 0.00 0.00 175.02 172.27 1fv1 s PHE 24 N -3.98 2.51 -0.00 3.16 0.40 0.02 -0.81 117.98 119.29 1fv1 s PHE 24 Ca 0.17 -0.77 0.07 0.00 -0.60 0.00 0.00 56.93 55.80 1fv1 s PHE 24 Cb 0.05 -1.65 -0.03 0.00 0.51 0.00 0.00 43.02 41.90 1fv1 s PHE 24 CO -0.01 -0.25 -0.21 0.34 0.70 0.00 0.00 175.22 175.79 1fv1 s ASP 25 N -0.02 3.50 -0.21 1.36 -1.08 0.28 -0.69 116.67 119.81 1fv1 s ASP 25 Ca -0.07 -0.40 -0.01 0.00 -0.52 0.00 0.00 52.55 51.55 1fv1 s ASP 25 Cb -0.15 -0.53 0.06 0.00 -1.46 0.00 0.00 42.92 40.84 1fv1 s ASP 25 CO 0.05 0.30 -0.02 0.12 0.52 0.00 0.00 175.17 176.14 1fv1 s PHE 26 N -0.74 1.82 -1.63 -5.34 5.36 0.14 -0.03 117.98 117.56 1fv1 s PHE 26 Ca 0.12 -1.33 -0.14 0.00 -0.96 0.00 0.00 56.93 54.61 1fv1 s PHE 26 Cb -0.10 -1.35 0.12 0.00 -0.34 0.00 0.00 43.02 41.35 1fv1 s PHE 26 CO 0.01 -0.69 0.71 -0.25 -1.46 0.00 0.00 175.22 173.54 1fv1 n ASP 27 N 4.83 -2.69 0.00 6.13 8.00 -0.48 -0.86 116.55 131.49 1fv1 n ASP 27 Ca -0.11 -1.00 0.00 0.00 0.71 0.00 0.00 54.79 54.39 1fv1 n ASP 27 Cb 0.46 -2.87 0.00 0.00 -0.02 0.00 0.00 41.12 38.69 1fv1 n ASP 27 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1fv1 n GLY 28 N -1.57 1.26 3.66 0.44 0.00 -1.26 -5.05 105.19 102.67 1fv1 n GLY 28 Ca -0.02 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.72 1fv1 n GLY 28 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1fv1 s ASP 29 N -2.89 4.80 -0.14 1.61 1.01 -0.04 -5.05 116.67 115.98 1fv1 s ASP 29 Ca 0.00 -0.31 -0.25 0.00 0.71 0.00 0.00 52.55 52.71 1fv1 s ASP 29 Cb 0.00 -1.05 -0.02 0.00 1.01 0.00 0.00 42.92 42.85 1fv1 s ASP 29 CO 0.00 0.14 0.79 -0.70 0.21 0.00 0.00 175.17 175.60 1fv1 s GLU 30 N -2.57 4.33 -0.12 8.23 2.12 -1.26 0.27 118.70 129.70 1fv1 s GLU 30 Ca 0.26 0.96 -0.24 0.00 0.36 0.00 0.00 54.97 56.31 1fv1 s GLU 30 Cb -0.11 -3.54 -0.26 0.00 0.26 0.00 0.00 34.13 30.48 1fv1 s GLU 30 CO 0.18 -0.21 0.66 0.82 -0.54 0.00 0.00 175.26 176.17 1fv1 h ILE 31 N 5.07 1.44 -1.98 -3.70 2.04 -1.25 -3.40 117.51 115.72 1fv1 h ILE 31 Ca -0.33 -2.37 0.24 0.00 1.00 0.00 0.00 64.86 63.40 1fv1 h ILE 31 Cb 1.15 3.02 -0.10 0.00 -0.74 0.00 0.00 36.82 40.15 1fv1 h ILE 31 CO 0.81 0.60 0.62 0.72 0.00 0.00 0.00 178.15 180.90 1fv1 s PHE 32 N -2.34 -0.10 0.15 1.37 -0.71 -1.23 -1.19 117.98 113.93 1fv1 s PHE 32 Ca -0.20 -0.12 -0.06 0.00 -1.04 0.00 0.00 56.93 55.51 1fv1 s PHE 32 Cb 0.01 0.60 -0.02 0.00 -1.21 0.00 0.00 43.02 42.40 1fv1 s PHE 32 CO 0.72 -0.60 0.20 -3.38 -1.34 0.00 0.00 175.22 170.82 1fv1 s HIS 33 N -2.94 0.54 -0.18 3.49 -3.43 -0.80 -0.80 115.29 111.18 1fv1 s HIS 33 Ca 0.13 -0.91 -0.05 0.00 -0.80 0.00 0.00 55.06 53.42 1fv1 s HIS 33 Cb 0.01 -0.20 -0.03 0.00 -1.43 0.00 0.00 32.58 30.93 1fv1 s HIS 33 CO -0.00 -0.65 0.00 0.08 -2.00 0.00 0.00 174.74 172.17 1fv1 s VAL 34 N -3.99 4.16 -0.49 -5.38 1.01 -0.37 -0.58 120.40 114.77 1fv1 s VAL 34 Ca 0.19 -0.25 -0.28 0.00 0.00 0.00 0.00 61.98 61.63 1fv1 s VAL 34 Cb 0.05 -2.86 0.01 0.00 0.00 0.00 0.00 36.38 33.57 1fv1 s VAL 34 CO 0.00 0.46 1.48 -0.62 0.00 0.00 0.00 175.10 176.42 1fv1 s ASP 35 N 0.58 6.12 0.31 3.32 -1.08 0.57 -4.60 116.67 121.89 1fv1 s ASP 35 Ca -0.00 0.57 -0.00 0.00 -0.52 0.00 0.00 52.55 52.59 1fv1 s ASP 35 Cb -0.14 -2.54 0.51 0.00 -1.46 0.00 0.00 42.92 39.29 1fv1 s ASP 35 CO 0.02 -1.66 1.97 0.24 0.52 0.00 0.00 175.17 176.26 1fv1 h MET 36 N 11.37 1.01 0.49 4.34 2.86 -1.90 0.30 114.93 133.40 1fv1 h MET 36 Ca -0.28 -0.06 -0.02 0.00 -2.06 0.00 0.00 59.70 57.28 1fv1 h MET 36 Cb 1.11 -0.23 0.00 0.00 0.06 0.00 0.00 31.60 32.55 1fv1 h MET 36 CO 1.14 0.67 -0.24 0.00 1.06 0.00 0.00 176.91 179.54 1fv1 h ALA 37 N 1.52 -0.66 -0.00 6.32 0.00 -1.97 -3.22 119.26 121.25 1fv1 h ALA 37 Ca 0.30 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1fv1 h ALA 37 Cb -0.06 0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.99 1fv1 h ALA 37 CO -0.08 -0.71 -0.01 1.63 0.00 0.00 0.00 179.25 180.08 1fv1 n LYS 38 N -5.26 0.64 -3.85 0.00 5.02 -1.18 -4.93 118.16 108.60 1fv1 n LYS 38 Ca -0.11 -0.04 -0.26 0.00 -2.02 0.00 0.00 58.31 55.89 1fv1 n LYS 38 Cb 0.31 -1.50 0.02 0.00 -0.02 0.00 0.00 35.03 33.84 1fv1 n LYS 38 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1fv1 n LYS 39 N -1.15 -4.66 -4.02 1.97 5.02 0.10 -4.98 118.16 110.45 1fv1 n LYS 39 Ca 0.17 0.55 -0.10 0.00 -2.02 0.00 0.00 58.31 56.92 1fv1 n LYS 39 Cb 0.21 -5.14 -0.11 0.00 -0.02 0.00 0.00 35.03 29.98 1fv1 n LYS 39 CO 0.00 0.00 0.00 -1.83 -0.52 0.00 0.00 177.40 175.05 1fv1 s GLU 40 N -6.35 0.43 0.08 1.97 -1.05 -1.12 -4.79 118.70 107.86 1fv1 s GLU 40 Ca 0.25 -0.77 -0.30 0.00 -0.15 0.00 0.00 54.97 54.00 1fv1 s GLU 40 Cb -0.13 0.02 -0.05 0.00 -0.44 0.00 0.00 34.13 33.53 1fv1 s GLU 40 CO 0.84 -0.03 1.05 0.99 0.95 0.00 0.00 175.26 179.06 1fv1 s THR 41 N -1.92 4.39 -0.23 1.83 2.01 -1.26 -0.32 115.64 120.13 1fv1 s THR 41 Ca -0.10 1.84 0.02 0.00 0.31 0.00 0.00 61.69 63.76 1fv1 s THR 41 Cb -0.07 -4.18 0.05 0.00 0.01 0.00 0.00 72.50 68.32 1fv1 s THR 41 CO -0.02 0.21 -0.12 -0.69 -0.69 0.00 0.00 174.62 173.31 1fv1 s VAL 42 N 0.52 1.99 0.22 3.82 1.01 0.25 -4.92 120.40 123.30 1fv1 s VAL 42 Ca 0.52 -1.37 -0.30 0.00 0.00 0.00 0.00 61.98 60.83 1fv1 s VAL 42 Cb -0.25 -2.06 -0.09 0.00 0.00 0.00 0.00 36.38 33.98 1fv1 s VAL 42 CO 0.30 0.09 0.95 0.26 0.00 0.00 0.00 175.10 176.70 1fv1 s TRP 43 N 1.21 3.94 0.23 5.22 0.52 -1.26 -1.90 118.94 126.91 1fv1 s TRP 43 Ca -0.05 1.89 -0.07 0.00 0.02 0.00 0.00 56.10 57.89 1fv1 s TRP 43 Cb -0.18 -3.01 0.21 0.00 -1.15 0.00 0.00 33.47 29.34 1fv1 s TRP 43 CO -0.07 0.37 1.86 -0.09 0.02 0.00 0.00 176.95 179.04 1fv1 h ARG 44 N 4.37 1.24 -5.54 4.98 9.65 -1.37 -3.40 114.38 124.31 1fv1 h ARG 44 Ca -0.45 -0.13 -0.64 0.00 -1.10 0.00 0.00 59.98 57.66 1fv1 h ARG 44 Cb 1.20 -0.25 -0.32 0.00 -1.39 0.00 0.00 29.97 29.21 1fv1 h ARG 44 CO 0.69 0.89 -0.87 -0.51 2.80 0.00 0.00 179.97 182.97 1fv1 s LEU 45 N -9.96 2.00 0.32 3.80 1.43 -1.26 -5.04 118.68 109.97 1fv1 s LEU 45 Ca -0.13 -0.46 0.08 0.00 -1.03 0.00 0.00 54.13 52.59 1fv1 s LEU 45 Cb 0.17 -1.23 0.82 0.00 0.03 0.00 0.00 46.19 45.98 1fv1 s LEU 45 CO 0.82 0.18 1.77 -0.08 0.23 0.00 0.00 176.35 179.28 1fv1 h GLU 46 N 6.35 0.66 -0.69 1.70 4.81 -1.99 -0.79 114.58 124.63 1fv1 h GLU 46 Ca -0.29 -0.04 0.13 0.00 -0.13 0.00 0.00 59.36 59.03 1fv1 h GLU 46 Cb 1.19 -0.15 -0.04 0.00 0.63 0.00 0.00 28.75 30.38 1fv1 h GLU 46 CO 0.47 0.44 0.46 0.93 -0.73 0.00 0.00 179.01 180.58 1fv1 h GLU 47 N 0.68 0.39 -0.12 1.92 3.07 -1.96 -2.57 114.58 115.99 1fv1 h GLU 47 Ca 0.58 -0.02 0.04 0.00 -0.50 0.00 0.00 59.36 59.46 1fv1 h GLU 47 Cb 1.02 -0.09 -0.04 0.00 -0.84 0.00 0.00 28.75 28.80 1fv1 h GLU 47 CO -0.38 0.26 -0.12 0.74 -1.40 0.00 0.00 179.01 178.11 1fv1 h PHE 48 N 0.40 -0.29 0.00 4.33 0.04 -1.53 -1.03 116.94 118.86 1fv1 h PHE 48 Ca 0.33 0.02 0.00 0.00 2.80 0.00 0.00 57.97 61.12 1fv1 h PHE 48 Cb 0.75 0.15 0.00 0.00 2.20 0.00 0.00 35.95 39.05 1fv1 h PHE 48 CO -0.00 -0.18 0.00 0.41 -0.60 0.00 0.00 178.31 177.94 1fv1 n GLY 49 N -1.26 -0.32 0.53 -1.45 0.00 -0.97 -1.04 105.19 100.68 1fv1 n GLY 49 Ca -0.03 -0.01 0.12 0.00 0.00 0.00 0.00 46.02 46.10 1fv1 n GLY 49 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1fv1 n ARG 50 N -1.25 1.44 0.00 1.61 1.74 -0.39 -4.30 116.66 115.51 1fv1 n ARG 50 Ca 0.01 -1.06 0.00 0.00 -0.77 0.00 0.00 57.85 56.03 1fv1 n ARG 50 Cb 0.02 -1.48 0.00 0.00 -1.02 0.00 0.00 32.46 29.98 1fv1 n ARG 50 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 1fv1 n PHE 51 N 0.14 0.00 -4.17 -1.55 3.01 -0.20 -5.09 117.46 109.60 1fv1 n PHE 51 Ca 0.13 0.00 -0.11 0.00 1.01 0.00 0.00 57.45 58.48 1fv1 n PHE 51 Cb 0.44 0.00 -0.10 0.00 -0.01 0.00 0.00 39.48 39.81 1fv1 n PHE 51 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1fv1 s ALA 52 N -1.61 1.00 0.20 4.37 0.00 -0.73 -5.15 121.76 119.83 1fv1 s ALA 52 Ca 0.00 -1.37 0.03 0.00 0.00 0.00 0.00 51.96 50.61 1fv1 s ALA 52 Cb 0.00 0.22 -0.05 0.00 0.00 0.00 0.00 23.12 23.30 1fv1 s ALA 52 CO 0.00 -0.26 -0.00 -1.12 0.00 0.00 0.00 175.76 174.38 1fv1 s SER 53 N -3.05 1.49 -0.25 0.00 0.01 -1.26 -4.39 113.70 106.24 1fv1 s SER 53 Ca 0.13 -1.19 -0.11 0.00 1.31 0.00 0.00 55.95 56.09 1fv1 s SER 53 Cb 0.06 0.07 0.10 0.00 0.21 0.00 0.00 66.02 66.45 1fv1 s SER 53 CO -0.04 -0.54 0.57 0.12 0.41 0.00 0.00 173.24 173.76 1fv1 s PHE 54 N -3.55 -1.03 -0.59 2.43 5.36 -1.26 -5.11 117.98 114.24 1fv1 s PHE 54 Ca 0.26 1.94 -0.28 0.00 -0.96 0.00 0.00 56.93 57.89 1fv1 s PHE 54 Cb 0.06 0.56 0.02 0.00 -0.34 0.00 0.00 43.02 43.32 1fv1 s PHE 54 CO 0.06 -0.54 1.39 -2.00 -1.46 0.00 0.00 175.22 172.68 1fv1 s GLU 55 N 2.24 3.28 0.46 10.12 2.56 -1.26 -4.71 118.70 131.40 1fv1 s GLU 55 Ca -0.07 0.36 0.22 0.00 0.00 0.00 0.00 54.97 55.48 1fv1 s GLU 55 Cb -0.09 -4.13 1.22 0.00 2.00 0.00 0.00 34.13 33.13 1fv1 s GLU 55 CO -0.17 -1.97 1.87 0.00 -0.56 0.00 0.00 175.26 174.44 1fv1 h ALA 56 N 10.94 2.41 -0.95 6.30 0.00 -1.94 -1.23 119.26 134.80 1fv1 h ALA 56 Ca -0.27 0.00 0.21 0.00 0.00 0.00 0.00 54.91 54.86 1fv1 h ALA 56 Cb 1.09 0.01 -0.08 0.00 0.00 0.00 0.00 17.79 18.81 1fv1 h ALA 56 CO 1.19 -0.68 0.62 0.37 0.00 0.00 0.00 179.25 180.75 1fv1 h GLN 57 N 0.26 0.45 -0.51 0.00 5.75 -1.89 0.14 115.11 119.31 1fv1 h GLN 57 Ca 0.44 -0.03 -0.05 0.00 -0.15 0.00 0.00 58.65 58.86 1fv1 h GLN 57 Cb 1.32 -0.10 -0.02 0.00 1.07 0.00 0.00 27.48 29.74 1fv1 h GLN 57 CO -0.12 0.30 0.10 0.78 -2.65 0.00 0.00 178.83 177.24 1fv1 h GLY 58 N 0.47 0.85 0.81 2.39 0.00 -1.63 -1.90 103.07 104.05 1fv1 h GLY 58 Ca 0.51 -0.50 -0.05 0.00 0.00 0.00 0.00 47.33 47.29 1fv1 h GLY 58 CO -0.23 0.47 -0.06 0.00 0.00 0.00 0.00 176.54 176.72 1fv1 h ALA 59 N 1.35 0.28 -0.97 3.60 0.00 -0.87 -2.61 119.26 120.03 1fv1 h ALA 59 Ca 0.16 -0.26 0.05 0.00 0.00 0.00 0.00 54.91 54.87 1fv1 h ALA 59 Cb 0.32 -0.07 -0.06 0.00 0.00 0.00 0.00 17.79 17.98 1fv1 h ALA 59 CO 0.00 0.07 0.63 -0.07 0.00 0.00 0.00 179.25 179.88 1fv1 h LEU 60 N 0.11 1.02 -0.42 0.00 3.38 -1.19 -0.19 115.31 118.02 1fv1 h LEU 60 Ca 0.05 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.00 1fv1 h LEU 60 Cb 0.52 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 41.03 1fv1 h LEU 60 CO 0.02 0.67 0.19 0.00 0.09 0.00 0.00 178.44 179.41 1fv1 h ALA 61 N 1.43 0.55 -0.55 1.53 0.00 -1.27 -1.63 119.26 119.31 1fv1 h ALA 61 Ca 0.41 -0.13 -0.05 0.00 0.00 0.00 0.00 54.91 55.15 1fv1 h ALA 61 Cb 0.11 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.71 1fv1 h ALA 61 CO -0.16 0.13 0.15 -0.91 0.00 0.00 0.00 179.25 178.47 1fv1 h ASN 62 N 0.54 0.78 -0.45 0.00 4.21 -0.93 -1.88 115.58 117.86 1fv1 h ASN 62 Ca 0.14 -0.13 -0.13 0.00 1.21 0.00 0.00 56.30 57.39 1fv1 h ASN 62 Cb 0.15 -0.20 -0.01 0.00 -1.12 0.00 0.00 38.32 37.13 1fv1 h ASN 62 CO -0.02 0.76 -0.21 0.40 -1.29 0.00 0.00 177.43 177.07 1fv1 h ILE 63 N 0.81 1.27 -0.61 2.81 1.08 -0.73 0.24 117.51 122.38 1fv1 h ILE 63 Ca 0.18 -1.37 -0.08 0.00 -0.39 0.00 0.00 64.86 63.20 1fv1 h ILE 63 Cb 0.27 1.13 -0.02 0.00 -3.07 0.00 0.00 36.82 35.13 1fv1 h ILE 63 CO -0.00 0.47 0.06 0.00 -0.69 0.00 0.00 178.15 177.98 1fv1 h ALA 64 N 0.92 0.95 -0.54 1.87 0.00 -1.08 -1.21 119.26 120.16 1fv1 h ALA 64 Ca 0.11 -0.28 -0.11 0.00 0.00 0.00 0.00 54.91 54.63 1fv1 h ALA 64 Cb 0.78 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.32 1fv1 h ALA 64 CO 0.06 0.64 -0.09 0.28 0.00 0.00 0.00 179.25 180.15 1fv1 h VAL 65 N 0.95 1.27 -0.89 0.00 2.07 -0.99 -2.23 116.25 116.42 1fv1 h VAL 65 Ca 0.18 -1.24 0.00 0.00 0.82 0.00 0.00 66.70 66.46 1fv1 h VAL 65 Cb 0.47 0.94 -0.04 0.00 -1.52 0.00 0.00 31.29 31.14 1fv1 h VAL 65 CO 0.02 0.44 0.57 0.44 0.02 0.00 0.00 177.57 179.06 1fv1 h ASP 66 N 0.90 1.04 -0.34 0.57 3.32 0.02 0.11 116.42 122.04 1fv1 h ASP 66 Ca 0.14 -0.04 -0.00 0.00 0.02 0.00 0.00 57.03 57.15 1fv1 h ASP 66 Cb 0.65 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.93 1fv1 h ASP 66 CO 0.05 0.77 0.20 0.50 -1.72 0.00 0.00 179.24 179.04 1fv1 h LYS 67 N 1.22 0.47 -0.56 3.56 3.64 -1.03 0.23 116.57 124.09 1fv1 h LYS 67 Ca 0.32 -0.04 -0.02 0.00 -1.27 0.00 0.00 60.65 59.64 1fv1 h LYS 67 Cb -0.11 -0.10 -0.03 0.00 -0.41 0.00 0.00 32.23 31.59 1fv1 h LYS 67 CO -0.07 0.36 0.27 0.00 -2.27 0.00 0.00 179.45 177.74 1fv1 h ALA 68 N 1.08 0.72 -0.34 5.00 0.00 -0.79 -1.81 119.26 123.11 1fv1 h ALA 68 Ca 0.12 -0.13 -0.11 0.00 0.00 0.00 0.00 54.91 54.80 1fv1 h ALA 68 Cb 0.02 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 1fv1 h ALA 68 CO -0.02 0.29 -0.22 -0.91 0.00 0.00 0.00 179.25 178.38 1fv1 h ASN 69 N 0.75 0.68 -0.77 0.00 2.35 -0.53 -2.88 115.58 115.18 1fv1 h ASN 69 Ca 0.19 -0.23 -0.01 0.00 -0.55 0.00 0.00 56.30 55.69 1fv1 h ASN 69 Cb 0.12 -0.18 -0.04 0.00 0.05 0.00 0.00 38.32 38.27 1fv1 h ASN 69 CO -0.02 0.89 0.42 0.25 -1.65 0.00 0.00 177.43 177.31 1fv1 h LEU 70 N 0.59 0.96 -0.67 1.61 5.85 -0.13 -0.41 115.31 123.10 1fv1 h LEU 70 Ca 0.09 -0.10 0.08 0.00 0.84 0.00 0.00 57.88 58.79 1fv1 h LEU 70 Cb 0.70 -0.24 -0.07 0.00 0.37 0.00 0.00 40.66 41.42 1fv1 h LEU 70 CO 0.05 0.78 0.34 -0.33 -0.34 0.00 0.00 178.44 178.94 1fv1 h GLU 71 N 1.06 0.57 -0.08 1.25 3.07 -1.13 0.19 114.58 119.52 1fv1 h GLU 71 Ca 0.27 -0.03 -0.03 0.00 -0.50 0.00 0.00 59.36 59.06 1fv1 h GLU 71 Cb 0.03 -0.13 -0.00 0.00 -0.84 0.00 0.00 28.75 27.81 1fv1 h GLU 71 CO -0.04 0.38 -0.08 0.82 -1.40 0.00 0.00 179.01 178.69 1fv1 h ILE 72 N 0.59 1.36 -0.92 3.13 2.04 -1.32 -2.99 117.51 119.40 1fv1 h ILE 72 Ca 0.32 -1.22 0.04 0.00 1.00 0.00 0.00 64.86 65.00 1fv1 h ILE 72 Cb 0.31 1.99 -0.06 0.00 -0.74 0.00 0.00 36.82 38.32 1fv1 h ILE 72 CO -0.24 0.34 0.59 0.24 0.00 0.00 0.00 178.15 179.08 1fv1 h MET 73 N -0.21 1.11 -0.13 2.37 2.86 -0.71 0.25 114.93 120.46 1fv1 h MET 73 Ca 0.01 -0.07 0.02 0.00 -2.06 0.00 0.00 59.70 57.61 1fv1 h MET 73 Cb 0.59 -0.25 -0.02 0.00 0.06 0.00 0.00 31.60 31.97 1fv1 h MET 73 CO 0.02 0.73 -0.02 1.15 1.06 0.00 0.00 176.91 179.86 1fv1 h THR 74 N 1.14 0.89 -0.38 2.22 2.02 -0.62 -0.71 112.91 117.46 1fv1 h THR 74 Ca 0.37 -0.01 -0.03 0.00 0.77 0.00 0.00 66.41 67.51 1fv1 h THR 74 Cb 0.02 0.86 -0.02 0.00 -1.74 0.00 0.00 68.15 67.28 1fv1 h THR 74 CO -0.13 0.00 0.13 0.50 0.37 0.00 0.00 175.52 176.40 1fv1 h LYS 75 N 0.02 0.59 -0.28 6.66 3.64 -1.32 -0.95 116.57 124.93 1fv1 h LYS 75 Ca 0.06 -0.12 0.08 0.00 -1.27 0.00 0.00 60.65 59.40 1fv1 h LYS 75 Cb 0.09 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 31.81 1fv1 h LYS 75 CO -0.12 0.58 0.22 -0.09 -2.27 0.00 0.00 179.45 177.78 1fv1 h ARG 76 N 0.47 0.00 -0.12 1.90 2.43 -0.53 0.90 114.38 119.42 1fv1 h ARG 76 Ca 0.12 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.29 1fv1 h ARG 76 Cb 0.23 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.78 1fv1 h ARG 76 CO -0.01 0.00 0.00 -1.13 -1.51 0.00 0.00 179.97 177.32 1fv1 n SER 77 N -4.22 1.29 -2.37 -3.80 3.41 -0.31 -4.88 113.62 102.74 1fv1 n SER 77 Ca 0.04 -1.63 -0.15 0.00 -0.26 0.00 0.00 58.87 56.87 1fv1 n SER 77 Cb 0.38 -0.08 0.04 0.00 -0.26 0.00 0.00 64.21 64.30 1fv1 n SER 77 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1fv1 n ASN 78 N 0.07 -4.77 -3.54 4.04 5.15 0.31 -3.40 115.26 113.11 1fv1 n ASN 78 Ca 0.16 -0.30 -0.19 0.00 -0.60 0.00 0.00 54.58 53.65 1fv1 n ASN 78 Cb 0.27 -3.44 0.07 0.00 -0.53 0.00 0.00 39.78 36.15 1fv1 n ASN 78 CO 0.00 0.00 0.00 -1.22 1.40 0.00 0.00 177.26 177.44 1fv1 n TYR 79 N -4.12 -2.07 -2.87 1.20 4.01 -0.41 -4.96 117.16 107.95 1fv1 n TYR 79 Ca -0.02 0.90 -0.42 0.00 -0.16 0.00 0.00 57.90 58.20 1fv1 n TYR 79 Cb 0.55 -4.79 -0.04 0.00 -0.31 0.00 0.00 39.34 34.75 1fv1 n TYR 79 CO 0.00 0.00 0.00 0.99 -0.46 0.00 0.00 176.86 177.39 1fv1 s THR 80 N -3.49 4.76 0.60 -0.72 2.01 -1.22 -5.04 115.64 112.54 1fv1 s THR 80 Ca 0.01 1.41 -0.08 0.00 0.31 0.00 0.00 61.69 63.34 1fv1 s THR 80 Cb -0.00 -4.19 -0.01 0.00 0.01 0.00 0.00 72.50 68.31 1fv1 s THR 80 CO 0.76 -0.23 0.95 -2.16 -0.69 0.00 0.00 174.62 173.25 1fv1 s PRO 81 N 3.04 3.14 0.39 4.92 0.04 -1.26 -5.03 135.00 140.24 1fv1 s PRO 81 Ca 0.36 0.28 -0.24 0.00 0.04 0.00 0.00 61.00 61.44 1fv1 s PRO 81 Cb -0.14 -2.19 -0.09 0.00 0.04 0.00 0.00 34.50 32.11 1fv1 s PRO 81 CO 0.11 -0.67 1.06 -1.50 0.04 0.00 0.00 177.00 176.05 1fv1 s ILE 82 N -3.07 3.65 -0.08 0.56 2.07 -1.26 -5.01 121.20 118.06 1fv1 s ILE 82 Ca 0.54 1.29 -0.22 0.00 -1.41 0.00 0.00 60.65 60.86 1fv1 s ILE 82 Cb -0.11 -3.68 -0.04 0.00 0.13 0.00 0.00 42.46 38.76 1fv1 s ILE 82 CO 0.48 0.04 0.63 0.28 -1.91 0.00 0.00 174.94 174.46 1fv1 s THR 83 N -1.60 5.08 0.20 4.00 -1.32 -1.26 -4.99 115.64 115.74 1fv1 s THR 83 Ca 0.57 1.29 -0.30 0.00 -1.21 0.00 0.00 61.69 62.03 1fv1 s THR 83 Cb -0.23 -3.97 -0.09 0.00 -1.51 0.00 0.00 72.50 66.70 1fv1 s THR 83 CO 0.29 0.29 1.38 0.20 -2.21 0.00 0.00 174.62 174.58 1fv1 s ASN 84 N 0.66 6.78 -0.26 8.08 0.01 -1.26 -4.65 114.94 124.30 1fv1 s ASN 84 Ca 0.34 2.49 0.03 0.00 -0.71 0.00 0.00 52.86 55.01 1fv1 s ASN 84 Cb -0.17 -2.61 0.06 0.00 0.41 0.00 0.00 41.25 38.94 1fv1 s ASN 84 CO 0.16 -0.63 -0.10 -0.69 -1.51 0.00 0.00 177.10 174.33 1fv1 s VAL 85 N 0.30 2.09 0.50 1.60 1.01 0.98 -4.84 120.40 122.05 1fv1 s VAL 85 Ca 0.60 -1.59 -0.23 0.00 0.00 0.00 0.00 61.98 60.76 1fv1 s VAL 85 Cb -0.39 -2.22 -0.06 0.00 0.00 0.00 0.00 36.38 33.71 1fv1 s VAL 85 CO 0.38 -0.04 1.28 -2.16 0.00 0.00 0.00 175.10 174.56 1fv1 s PRO 86 N 1.14 3.44 0.63 2.72 0.04 -1.26 -1.89 135.00 139.81 1fv1 s PRO 86 Ca -0.09 2.06 -0.12 0.00 0.04 0.00 0.00 61.00 62.89 1fv1 s PRO 86 Cb -0.20 -2.35 -0.03 0.00 0.04 0.00 0.00 34.50 31.96 1fv1 s PRO 86 CO -0.05 -0.89 1.03 -1.25 0.04 0.00 0.00 177.00 175.88 1fv1 s PRO 87 N -2.78 3.43 -0.16 0.56 0.04 -1.26 -4.57 135.00 130.25 1fv1 s PRO 87 Ca 0.67 0.88 -0.08 0.00 0.04 0.00 0.00 61.00 62.52 1fv1 s PRO 87 Cb -0.36 -2.06 -0.04 0.00 0.04 0.00 0.00 34.50 32.08 1fv1 s PRO 87 CO 0.43 -0.71 0.10 -1.21 0.04 0.00 0.00 177.00 175.65 1fv1 s GLU 88 N -4.88 3.83 -0.07 4.56 2.02 -0.09 -4.91 118.70 119.16 1fv1 s GLU 88 Ca 0.57 -0.25 0.04 0.00 0.02 0.00 0.00 54.97 55.35 1fv1 s GLU 88 Cb -0.12 -3.24 -0.00 0.00 0.10 0.00 0.00 34.13 30.86 1fv1 s GLU 88 CO 0.50 0.45 -0.22 0.08 0.02 0.00 0.00 175.26 176.09 1fv1 s VAL 89 N -0.10 1.83 -0.01 2.63 1.01 -1.26 -0.82 120.40 123.68 1fv1 s VAL 89 Ca 0.09 -0.91 0.01 0.00 0.00 0.00 0.00 61.98 61.16 1fv1 s VAL 89 Cb -0.12 -1.58 0.01 0.00 0.00 0.00 0.00 36.38 34.69 1fv1 s VAL 89 CO 0.01 0.51 -0.02 0.42 0.00 0.00 0.00 175.10 176.02 1fv1 s THR 90 N 0.17 0.21 -0.12 3.92 -4.23 -0.81 -4.99 115.64 109.78 1fv1 s THR 90 Ca -0.11 -0.06 -0.00 0.00 -1.18 0.00 0.00 61.69 60.34 1fv1 s THR 90 Cb -0.15 -0.22 -0.02 0.00 1.34 0.00 0.00 72.50 73.45 1fv1 s THR 90 CO 0.06 0.09 -0.12 -0.69 -0.54 0.00 0.00 174.62 173.42 1fv1 s VAL 91 N 0.28 3.21 0.19 2.29 1.01 -1.26 -0.48 120.40 125.64 1fv1 s VAL 91 Ca -0.03 -0.61 -0.07 0.00 0.00 0.00 0.00 61.98 61.27 1fv1 s VAL 91 Cb -0.05 -2.35 -0.02 0.00 0.00 0.00 0.00 36.38 33.96 1fv1 s VAL 91 CO -0.01 0.53 0.27 -1.48 0.00 0.00 0.00 175.10 174.42 1fv1 s LEU 92 N 0.19 0.91 0.12 3.92 0.05 -0.04 -4.97 118.68 118.86 1fv1 s LEU 92 Ca -0.07 -1.06 0.02 0.00 0.05 0.00 0.00 54.13 53.07 1fv1 s LEU 92 Cb -0.15 1.05 -0.04 0.00 -2.05 0.00 0.00 46.19 45.00 1fv1 s LEU 92 CO 0.05 -0.93 0.25 -0.89 -0.55 0.00 0.00 176.35 174.28 1fv1 s THR 93 N -4.04 5.32 0.39 5.48 2.01 -1.26 0.12 115.64 123.66 1fv1 s THR 93 Ca 0.25 -0.58 0.10 0.00 0.31 0.00 0.00 61.69 61.77 1fv1 s THR 93 Cb 0.04 -3.69 0.15 0.00 0.01 0.00 0.00 72.50 69.01 1fv1 s THR 93 CO 0.06 -0.00 1.91 -1.13 -0.69 0.00 0.00 174.62 174.77 1fv1 h ASN 94 N 2.51 0.19 -5.05 3.53 -1.24 -1.22 -3.46 115.58 110.84 1fv1 h ASN 94 Ca -0.47 -0.04 0.01 0.00 0.71 0.00 0.00 56.30 56.51 1fv1 h ASN 94 Cb 1.18 -0.05 -0.09 0.00 0.73 0.00 0.00 38.32 40.09 1fv1 h ASN 94 CO 0.71 0.37 0.13 -0.94 -1.29 0.00 0.00 177.43 176.41 1fv1 s SER 95 N -6.90 -0.32 0.12 1.15 1.04 -1.26 -5.04 113.70 102.49 1fv1 s SER 95 Ca -0.05 -0.43 -0.35 0.00 0.48 0.00 0.00 55.95 55.59 1fv1 s SER 95 Cb 0.15 0.63 -0.16 0.00 0.10 0.00 0.00 66.02 66.75 1fv1 s SER 95 CO 0.73 -1.14 1.39 -2.65 0.98 0.00 0.00 173.24 172.55 1fv1 n PRO 96 N -0.39 1.44 -2.62 4.02 -0.02 -1.26 -4.89 135.00 131.28 1fv1 n PRO 96 Ca -0.09 0.52 -0.35 0.00 -2.02 0.00 0.00 63.50 61.56 1fv1 n PRO 96 Cb 0.62 -2.19 -0.05 0.00 -0.02 0.00 0.00 33.50 31.87 1fv1 n PRO 96 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1fv1 s VAL 97 N 0.52 3.92 -0.12 -1.45 1.01 -1.26 -5.06 120.40 117.97 1fv1 s VAL 97 Ca 0.82 1.31 -0.05 0.00 0.00 0.00 0.00 61.98 64.05 1fv1 s VAL 97 Cb -0.86 -3.59 0.05 0.00 0.00 0.00 0.00 36.38 31.98 1fv1 s VAL 97 CO 0.45 -0.16 0.27 -1.61 0.00 0.00 0.00 175.10 174.05 1fv1 s GLU 98 N -2.92 0.20 0.36 2.72 2.02 -1.26 -5.11 118.70 114.71 1fv1 s GLU 98 Ca 0.62 0.64 -0.26 0.00 0.02 0.00 0.00 54.97 55.99 1fv1 s GLU 98 Cb -0.17 -0.07 -0.13 0.00 0.10 0.00 0.00 34.13 33.86 1fv1 s GLU 98 CO 0.21 -0.21 0.91 1.28 0.02 0.00 0.00 175.26 177.47 1fv1 n LEU 99 N 4.68 1.68 0.00 1.80 4.77 -1.26 -1.17 117.00 127.51 1fv1 n LEU 99 Ca -0.18 1.08 0.00 0.00 -0.03 0.00 0.00 56.01 56.88 1fv1 n LEU 99 Cb 0.52 -1.27 0.00 0.00 -2.33 0.00 0.00 43.42 40.34 1fv1 n LEU 99 CO 0.09 -1.74 0.00 0.54 -1.33 0.00 0.00 177.39 174.95 1fv1 n ARG 100 N 0.49 0.00 -3.30 3.23 1.74 -1.19 -4.95 116.66 112.68 1fv1 n ARG 100 Ca 0.10 0.00 -0.41 0.00 -0.77 0.00 0.00 57.85 56.77 1fv1 n ARG 100 Cb 0.36 -2.53 -0.08 0.00 -1.02 0.00 0.00 32.46 29.19 1fv1 n ARG 100 CO 0.00 0.00 0.00 -2.00 -1.52 0.00 0.00 177.63 174.11 1fv1 s GLU 101 N 0.00 3.69 0.17 5.56 2.56 -0.32 -4.91 118.70 125.46 1fv1 s GLU 101 Ca 0.00 -0.16 -0.33 0.00 0.00 0.00 0.00 54.97 54.48 1fv1 s GLU 101 Cb 0.00 -3.78 -0.16 0.00 2.00 0.00 0.00 34.13 32.19 1fv1 s GLU 101 CO 0.00 -0.55 1.11 -2.30 -0.56 0.00 0.00 175.26 172.97 1fv1 n PRO 102 N 5.59 1.06 -4.12 4.30 -0.02 -1.26 -4.36 135.00 136.19 1fv1 n PRO 102 Ca -0.06 0.38 -0.15 0.00 -2.02 0.00 0.00 63.50 61.65 1fv1 n PRO 102 Cb 0.49 -1.84 -0.05 0.00 -0.02 0.00 0.00 33.50 32.08 1fv1 n PRO 102 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 1fv1 s ASN 103 N -0.09 0.94 -0.03 2.55 3.84 -0.53 -5.01 114.94 116.60 1fv1 s ASN 103 Ca 0.73 -1.49 0.02 0.00 0.21 0.00 0.00 52.86 52.32 1fv1 s ASN 103 Cb -0.87 0.63 0.01 0.00 -0.55 0.00 0.00 41.25 40.47 1fv1 s ASN 103 CO 0.53 -1.23 -0.07 -0.69 -2.79 0.00 0.00 177.10 172.85 1fv1 s VAL 104 N -3.22 0.63 -0.04 -5.21 1.01 -1.26 -0.50 120.40 111.81 1fv1 s VAL 104 Ca 0.32 -0.25 -0.18 0.00 0.00 0.00 0.00 61.98 61.87 1fv1 s VAL 104 Cb 0.00 -0.59 -0.05 0.00 0.00 0.00 0.00 36.38 35.74 1fv1 s VAL 104 CO 0.20 0.22 0.50 -0.76 0.00 0.00 0.00 175.10 175.26 1fv1 s LEU 105 N 0.40 4.39 -0.17 3.92 1.43 0.41 -0.60 118.68 128.47 1fv1 s LEU 105 Ca -0.06 0.99 0.01 0.00 -1.03 0.00 0.00 54.13 54.04 1fv1 s LEU 105 Cb -0.10 -2.74 0.01 0.00 0.03 0.00 0.00 46.19 43.39 1fv1 s LEU 105 CO 0.00 0.14 -0.18 -0.63 0.23 0.00 0.00 176.35 175.92 1fv1 s ILE 106 N -0.21 2.36 -0.32 -0.59 1.01 0.33 -1.02 121.20 122.77 1fv1 s ILE 106 Ca 0.27 -0.86 -0.09 0.00 0.00 0.00 0.00 60.65 59.97 1fv1 s ILE 106 Cb -0.17 -1.99 0.01 0.00 0.01 0.00 0.00 42.46 40.32 1fv1 s ILE 106 CO 0.14 0.52 0.14 0.00 0.00 0.00 0.00 174.94 175.74 1fv1 s PHE 108 N 1.55 3.19 -0.29 0.00 5.36 0.37 -1.39 117.98 126.77 1fv1 s PHE 108 Ca 0.03 -0.62 -0.10 0.00 -0.96 0.00 0.00 56.93 55.28 1fv1 s PHE 108 Cb -0.18 -2.36 -0.03 0.00 -0.34 0.00 0.00 43.02 40.11 1fv1 s PHE 108 CO 0.05 -0.48 0.15 0.42 -1.46 0.00 0.00 175.22 173.90 1fv1 s ILE 109 N 1.60 4.82 0.23 3.12 1.09 -0.20 -1.93 121.20 129.93 1fv1 s ILE 109 Ca 0.04 -0.14 0.06 0.00 -1.10 0.00 0.00 60.65 59.52 1fv1 s ILE 109 Cb -0.17 -3.35 -0.05 0.00 -1.06 0.00 0.00 42.46 37.83 1fv1 s ILE 109 CO 0.06 0.20 -0.08 -0.62 -0.10 0.00 0.00 174.94 174.40 1fv1 s ASP 110 N 1.67 2.42 -1.21 3.58 2.15 -0.00 -0.67 116.67 124.61 1fv1 s ASP 110 Ca 0.06 -1.13 -0.19 0.00 0.43 0.00 0.00 52.55 51.72 1fv1 s ASP 110 Cb -0.16 -0.11 0.00 0.00 -0.30 0.00 0.00 42.92 42.36 1fv1 s ASP 110 CO 0.07 -0.32 0.69 0.29 -0.17 0.00 0.00 175.17 175.73 1fv1 n LYS 111 N -0.45 -1.44 -4.13 4.34 5.02 -0.74 -0.91 118.16 119.86 1fv1 n LYS 111 Ca -0.07 0.37 -0.09 0.00 -2.02 0.00 0.00 58.31 56.51 1fv1 n LYS 111 Cb 0.62 -3.89 -0.10 0.00 -0.02 0.00 0.00 35.03 31.64 1fv1 n LYS 111 CO 0.00 0.00 0.00 -0.59 -0.52 0.00 0.00 177.40 176.29 1fv1 s PHE 112 N -3.59 0.70 -0.14 2.13 -0.71 -1.08 -4.39 117.98 110.90 1fv1 s PHE 112 Ca 0.38 -1.10 -0.30 0.00 -1.04 0.00 0.00 56.93 54.87 1fv1 s PHE 112 Cb -0.15 -0.45 0.12 0.00 -1.21 0.00 0.00 43.02 41.33 1fv1 s PHE 112 CO 0.89 -0.39 0.95 -0.08 -1.34 0.00 0.00 175.22 175.25 1fv1 s THR 113 N -3.91 0.00 0.96 -4.49 -1.32 -0.79 -0.00 115.64 106.08 1fv1 s THR 113 Ca 0.14 0.00 -0.12 0.00 -1.21 0.00 0.00 61.69 60.50 1fv1 s THR 113 Cb 0.07 -1.00 0.17 0.00 -1.51 0.00 0.00 72.50 70.23 1fv1 s THR 113 CO -0.05 0.00 1.09 -2.16 -2.21 0.00 0.00 174.62 171.29 1fv1 s PRO 114 N -1.10 0.74 -1.12 7.08 0.04 -1.26 -0.01 135.00 139.36 1fv1 s PRO 114 Ca -0.03 0.62 -0.15 0.00 0.04 0.00 0.00 61.00 61.48 1fv1 s PRO 114 Cb -0.00 -1.77 -0.07 0.00 0.04 0.00 0.00 34.50 32.70 1fv1 s PRO 114 CO 0.03 -2.54 2.20 -0.35 0.04 0.00 0.00 177.00 176.37 1fv1 n PRO 115 N -4.06 2.32 -3.69 0.56 -0.04 -1.26 -4.78 135.00 124.05 1fv1 n PRO 115 Ca 0.06 -2.04 -0.15 0.00 -0.04 0.00 0.00 63.50 61.33 1fv1 n PRO 115 Cb 0.57 -2.92 -0.15 0.00 -0.04 0.00 0.00 33.50 30.96 1fv1 n PRO 115 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1fv1 s VAL 116 N 3.76 -0.20 -0.12 0.52 1.01 -1.26 -5.04 120.40 119.06 1fv1 s VAL 116 Ca 0.52 0.28 -0.19 0.00 0.00 0.00 0.00 61.98 62.59 1fv1 s VAL 116 Cb 0.14 -0.31 0.05 0.00 0.00 0.00 0.00 36.38 36.26 1fv1 s VAL 116 CO 0.00 0.12 0.48 0.54 0.00 0.00 0.00 175.10 176.24 1fv1 s VAL 117 N 1.90 0.01 -0.30 2.92 0.11 -1.26 -4.72 120.40 119.05 1fv1 s VAL 117 Ca -0.02 -0.11 -0.05 0.00 -2.93 0.00 0.00 61.98 58.87 1fv1 s VAL 117 Cb -0.12 -0.73 0.03 0.00 -1.53 0.00 0.00 36.38 34.03 1fv1 s VAL 117 CO -0.06 -0.06 0.04 0.21 -3.33 0.00 0.00 175.10 171.90 1fv1 s ASN 118 N -0.37 4.98 -0.11 3.54 3.04 -0.77 -4.97 114.94 120.28 1fv1 s ASN 118 Ca -0.05 -1.00 0.01 0.00 0.04 0.00 0.00 52.86 51.86 1fv1 s ASN 118 Cb -0.03 -1.80 -0.02 0.00 -1.54 0.00 0.00 41.25 37.86 1fv1 s ASN 118 CO 0.03 -0.24 -0.14 -0.69 -3.04 0.00 0.00 177.10 173.02 1fv1 s VAL 119 N 1.38 2.98 0.07 -5.21 1.01 -1.26 -0.64 120.40 118.74 1fv1 s VAL 119 Ca -0.01 -0.70 0.06 0.00 0.00 0.00 0.00 61.98 61.33 1fv1 s VAL 119 Cb -0.18 -2.22 -0.03 0.00 0.00 0.00 0.00 36.38 33.94 1fv1 s VAL 119 CO 0.00 0.54 -0.17 -0.89 0.00 0.00 0.00 175.10 174.59 1fv1 s THR 120 N 0.09 1.33 -0.08 3.92 2.01 0.12 -4.97 115.64 118.07 1fv1 s THR 120 Ca -0.06 -1.32 0.00 0.00 0.31 0.00 0.00 61.69 60.63 1fv1 s THR 120 Cb -0.15 -1.23 -0.03 0.00 0.01 0.00 0.00 72.50 71.10 1fv1 s THR 120 CO 0.05 -0.11 -0.07 0.26 -0.69 0.00 0.00 174.62 174.05 1fv1 s TRP 121 N -1.14 2.92 -0.01 4.92 0.52 -1.26 0.30 118.94 125.20 1fv1 s TRP 121 Ca 0.02 -0.07 0.05 0.00 0.02 0.00 0.00 56.10 56.12 1fv1 s TRP 121 Cb -0.10 -1.74 -0.01 0.00 -1.15 0.00 0.00 33.47 30.47 1fv1 s TRP 121 CO 0.03 0.25 -0.16 -0.51 0.02 0.00 0.00 176.95 176.58 1fv1 s LEU 122 N -0.60 2.03 -0.19 2.99 1.02 0.06 -1.22 118.68 122.78 1fv1 s LEU 122 Ca 0.09 -0.28 0.00 0.00 0.02 0.00 0.00 54.13 53.96 1fv1 s LEU 122 Cb -0.12 -0.81 0.02 0.00 0.02 0.00 0.00 46.19 45.31 1fv1 s LEU 122 CO 0.02 0.19 -0.18 -0.60 0.02 0.00 0.00 176.35 175.80 1fv1 s ARG 123 N -0.37 3.01 -1.64 1.70 3.52 0.11 -1.08 118.95 124.21 1fv1 s ARG 123 Ca 0.06 -0.83 -0.16 0.00 -0.13 0.00 0.00 55.73 54.67 1fv1 s ARG 123 Cb -0.06 -2.64 0.13 0.00 -1.56 0.00 0.00 34.95 30.82 1fv1 s ARG 123 CO -0.01 -0.22 0.85 0.09 -0.81 0.00 0.00 175.30 175.20 1fv1 n ASN 124 N 4.64 -3.76 0.00 -2.12 3.02 0.11 -0.98 115.26 116.16 1fv1 n ASN 124 Ca -0.20 -0.93 0.00 0.00 -0.03 0.00 0.00 54.58 53.42 1fv1 n ASN 124 Cb 0.50 -3.17 0.00 0.00 -0.61 0.00 0.00 39.78 36.50 1fv1 n ASN 124 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1fv1 n GLY 125 N -1.52 1.47 3.45 7.41 0.00 -1.26 -5.04 105.19 109.71 1fv1 n GLY 125 Ca 0.05 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.74 1fv1 n GLY 125 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1fv1 s LYS 126 N -0.33 3.04 0.57 1.61 1.02 -0.15 -5.04 119.74 120.45 1fv1 s LYS 126 Ca 0.00 -0.65 -0.20 0.00 0.02 0.00 0.00 55.97 55.13 1fv1 s LYS 126 Cb 0.00 -2.57 -0.04 0.00 -0.52 0.00 0.00 37.83 34.69 1fv1 s LYS 126 CO 0.00 0.42 1.24 -2.30 -0.92 0.00 0.00 175.35 173.79 1fv1 n PRO 127 N 2.94 1.39 -4.10 -1.68 -0.02 -1.26 0.09 135.00 132.36 1fv1 n PRO 127 Ca -0.18 0.52 -0.16 0.00 -2.02 0.00 0.00 63.50 61.66 1fv1 n PRO 127 Cb 0.53 -2.45 -0.15 0.00 -0.02 0.00 0.00 33.50 31.41 1fv1 n PRO 127 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 1fv1 s VAL 128 N -1.35 0.35 0.00 -1.45 -7.23 -0.35 -4.76 120.40 105.61 1fv1 s VAL 128 Ca 0.74 -0.14 0.00 0.00 -1.81 0.00 0.00 61.98 60.77 1fv1 s VAL 128 Cb -0.42 -0.33 0.00 0.00 0.56 0.00 0.00 36.38 36.19 1fv1 s VAL 128 CO 0.47 0.12 0.05 0.35 -0.31 0.00 0.00 175.10 175.79 1fv1 n THR 129 N 3.28 0.00 -1.81 5.32 -2.24 -1.26 -4.38 114.28 113.19 1fv1 n THR 129 Ca -0.17 -0.23 -0.42 0.00 -2.27 0.00 0.00 64.05 60.96 1fv1 n THR 129 Cb 0.56 1.11 -0.03 0.00 -2.10 0.00 0.00 70.33 69.88 1fv1 n THR 129 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1fv1 s THR 130 N -0.37 3.25 0.00 4.28 -4.23 -1.26 -2.39 115.64 114.93 1fv1 s THR 130 Ca 0.00 0.30 0.00 0.00 -1.18 0.00 0.00 61.69 60.81 1fv1 s THR 130 Cb 0.00 -3.22 0.00 0.00 1.34 0.00 0.00 72.50 70.62 1fv1 s THR 130 CO 0.00 -0.05 0.00 0.61 -0.54 0.00 0.00 174.62 174.64 1fv1 n GLY 131 N 4.58 1.61 3.77 3.99 0.00 -1.26 -4.75 105.19 113.12 1fv1 n GLY 131 Ca 0.20 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.89 1fv1 n GLY 131 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1fv1 s VAL 132 N -3.69 3.12 0.23 1.61 -7.23 -1.00 -4.46 120.40 108.98 1fv1 s VAL 132 Ca 0.00 0.57 -0.11 0.00 -1.81 0.00 0.00 61.98 60.62 1fv1 s VAL 132 Cb 0.00 -3.11 -0.01 0.00 0.56 0.00 0.00 36.38 33.83 1fv1 s VAL 132 CO 0.00 -0.28 0.42 -0.94 -0.31 0.00 0.00 175.10 173.98 1fv1 s SER 133 N -2.33 -0.06 0.21 4.85 1.04 -1.01 -5.00 113.70 111.40 1fv1 s SER 133 Ca 0.69 -0.95 -0.17 0.00 0.48 0.00 0.00 55.95 56.01 1fv1 s SER 133 Cb -0.22 0.54 0.02 0.00 0.10 0.00 0.00 66.02 66.46 1fv1 s SER 133 CO 0.38 -1.07 0.52 -1.83 0.98 0.00 0.00 173.24 172.23 1fv1 s GLU 134 N -4.02 1.44 0.45 4.02 -1.05 -1.26 -0.35 118.70 117.93 1fv1 s GLU 134 Ca 0.23 -0.97 0.08 0.00 -0.15 0.00 0.00 54.97 54.16 1fv1 s GLU 134 Cb 0.01 0.51 0.01 0.00 -0.44 0.00 0.00 34.13 34.22 1fv1 s GLU 134 CO 0.08 -0.61 0.48 0.95 0.95 0.00 0.00 175.26 177.11 1fv1 s THR 135 N -3.91 2.55 0.35 1.83 -4.23 -0.35 -5.01 115.64 106.87 1fv1 s THR 135 Ca 0.12 -1.23 -0.03 0.00 -1.18 0.00 0.00 61.69 59.37 1fv1 s THR 135 Cb -0.01 -2.78 0.07 0.00 1.34 0.00 0.00 72.50 71.12 1fv1 s THR 135 CO 0.01 0.00 0.48 1.33 -0.54 0.00 0.00 174.62 175.89 1fv1 n VAL 136 N -1.74 0.00 -2.37 2.29 0.24 -1.26 -4.66 118.33 110.83 1fv1 n VAL 136 Ca 0.06 -0.56 -0.43 0.00 -2.04 0.00 0.00 64.34 61.37 1fv1 n VAL 136 Cb 0.61 -1.43 -0.02 0.00 -1.47 0.00 0.00 33.84 31.54 1fv1 n VAL 136 CO 0.00 0.00 0.00 -0.36 -2.14 0.00 0.00 176.83 174.33 1fv1 s PHE 137 N -1.60 2.65 0.11 6.34 0.40 -1.26 -4.66 117.98 119.96 1fv1 s PHE 137 Ca 0.29 0.86 -0.15 0.00 -0.60 0.00 0.00 56.93 57.33 1fv1 s PHE 137 Cb -0.01 -3.75 -0.07 0.00 0.51 0.00 0.00 43.02 39.70 1fv1 s PHE 137 CO 0.20 -1.94 0.53 -0.51 0.70 0.00 0.00 175.22 174.20 1fv1 s LEU 138 N 4.11 4.40 0.50 -0.37 2.01 0.64 -4.89 118.68 125.08 1fv1 s LEU 138 Ca 0.58 1.10 -0.19 0.00 0.01 0.00 0.00 54.13 55.63 1fv1 s LEU 138 Cb -0.20 -3.09 -0.08 0.00 0.01 0.00 0.00 46.19 42.83 1fv1 s LEU 138 CO 0.21 0.17 1.01 -2.16 1.01 0.00 0.00 176.35 176.59 1fv1 s PRO 139 N -1.66 3.82 0.10 1.29 0.04 -1.26 -0.77 135.00 136.55 1fv1 s PRO 139 Ca 0.34 1.18 0.08 0.00 0.04 0.00 0.00 61.00 62.64 1fv1 s PRO 139 Cb -0.16 -2.11 -0.03 0.00 0.04 0.00 0.00 34.50 32.24 1fv1 s PRO 139 CO 0.18 -0.39 -0.21 1.03 0.04 0.00 0.00 177.00 177.65 1fv1 s ARG 140 N -3.60 1.15 0.58 4.56 0.52 -1.00 -4.81 118.95 116.36 1fv1 s ARG 140 Ca 0.63 -1.14 0.28 0.00 -0.52 0.00 0.00 55.73 54.99 1fv1 s ARG 140 Cb -0.13 -1.40 1.67 0.00 0.52 0.00 0.00 34.95 35.61 1fv1 s ARG 140 CO 0.25 0.33 2.15 0.93 0.02 0.00 0.00 175.30 178.98 1fv1 h GLU 141 N 4.16 0.00 -0.19 3.54 5.08 -1.99 0.33 114.58 125.51 1fv1 h GLU 141 Ca -0.46 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.90 1fv1 h GLU 141 Cb 1.18 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.43 1fv1 h GLU 141 CO 0.40 0.00 0.00 -0.40 -1.00 0.00 0.00 179.01 178.01 1fv1 n ASP 142 N -3.89 1.31 -0.24 1.42 5.68 -1.26 -4.89 116.55 114.67 1fv1 n ASP 142 Ca 0.00 -1.80 -0.03 0.00 -0.50 0.00 0.00 54.79 52.46 1fv1 n ASP 142 Cb 0.24 -0.12 -0.01 0.00 -1.14 0.00 0.00 41.12 40.09 1fv1 n ASP 142 CO 0.00 0.00 0.00 1.41 -1.33 0.00 0.00 177.20 177.28 1fv1 n HIS 143 N 0.14 0.00 -2.06 2.11 8.25 0.11 -5.01 115.22 118.76 1fv1 n HIS 143 Ca 0.12 0.00 -0.06 0.00 -0.26 0.00 0.00 57.72 57.52 1fv1 n HIS 143 Cb 0.24 -1.27 0.04 0.00 1.12 0.00 0.00 29.99 30.12 1fv1 n HIS 143 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 1fv1 n LEU 144 N -0.36 0.00 -4.43 2.41 4.77 -1.26 -4.85 117.00 113.29 1fv1 n LEU 144 Ca -0.03 -0.49 -0.21 0.00 -0.03 0.00 0.00 56.01 55.25 1fv1 n LEU 144 Cb 0.27 -0.19 -0.11 0.00 -2.33 0.00 0.00 43.42 41.07 1fv1 n LEU 144 CO 0.05 -0.65 -0.29 -0.36 -1.33 0.00 0.00 177.39 174.81 1fv1 s PHE 145 N -0.88 1.90 0.07 -1.77 0.40 0.99 -2.36 117.98 116.34 1fv1 s PHE 145 Ca 0.17 -0.92 0.02 0.00 -0.60 0.00 0.00 56.93 55.60 1fv1 s PHE 145 Cb -0.01 -1.20 -0.03 0.00 0.51 0.00 0.00 43.02 42.29 1fv1 s PHE 145 CO 0.12 0.04 -0.07 0.50 0.70 0.00 0.00 175.22 176.50 1fv1 s ARG 146 N -3.87 0.70 -0.05 0.44 3.52 0.05 -1.79 118.95 117.95 1fv1 s ARG 146 Ca 0.34 -1.10 -0.30 0.00 -0.13 0.00 0.00 55.73 54.54 1fv1 s ARG 146 Cb 0.08 -0.21 0.08 0.00 -1.56 0.00 0.00 34.95 33.34 1fv1 s ARG 146 CO 0.14 0.00 0.73 0.21 -0.81 0.00 0.00 175.30 175.57 1fv1 s LYS 147 N -2.95 1.00 -0.03 5.12 2.20 0.16 -0.26 119.74 124.98 1fv1 s LYS 147 Ca 0.03 0.16 0.04 0.00 -0.36 0.00 0.00 55.97 55.84 1fv1 s LYS 147 Cb -0.01 0.47 -0.00 0.00 -1.51 0.00 0.00 37.83 36.78 1fv1 s LYS 147 CO -0.03 -0.33 -0.14 -0.06 -0.36 0.00 0.00 175.35 174.43 1fv1 s PHE 148 N -1.46 1.38 0.06 4.03 0.40 -1.26 -1.04 117.98 120.09 1fv1 s PHE 148 Ca -0.08 -0.34 0.08 0.00 -0.60 0.00 0.00 56.93 55.99 1fv1 s PHE 148 Cb -0.00 -0.92 -0.03 0.00 0.51 0.00 0.00 43.02 42.58 1fv1 s PHE 148 CO 0.06 -0.10 -0.22 -1.01 0.70 0.00 0.00 175.22 174.65 1fv1 s HIS 149 N -0.06 1.96 0.05 0.36 3.76 -0.49 -1.21 115.29 119.66 1fv1 s HIS 149 Ca -0.00 -0.39 0.05 0.00 -0.15 0.00 0.00 55.06 54.57 1fv1 s HIS 149 Cb -0.09 -1.14 -0.02 0.00 1.11 0.00 0.00 32.58 32.44 1fv1 s HIS 149 CO 0.01 0.15 -0.14 0.71 -0.85 0.00 0.00 174.74 174.61 1fv1 s TYR 150 N -0.90 1.22 -0.26 1.40 2.02 0.52 -1.17 117.35 120.19 1fv1 s TYR 150 Ca 0.09 -0.39 -0.04 0.00 -0.37 0.00 0.00 57.07 56.36 1fv1 s TYR 150 Cb -0.09 -0.71 0.09 0.00 -0.40 0.00 0.00 41.96 40.85 1fv1 s TYR 150 CO 0.03 0.04 0.12 -1.17 -1.57 0.00 0.00 175.55 173.00 1fv1 s LEU 151 N -1.33 0.49 0.32 -1.29 2.96 -0.19 -2.40 118.68 117.23 1fv1 s LEU 151 Ca 0.00 -1.12 -0.29 0.00 -0.22 0.00 0.00 54.13 52.50 1fv1 s LEU 151 Cb -0.09 -0.32 -0.10 0.00 0.50 0.00 0.00 46.19 46.19 1fv1 s LEU 151 CO 0.02 -0.42 1.25 -2.16 -1.32 0.00 0.00 176.35 173.72 1fv1 s PRO 152 N 2.11 4.43 0.16 0.98 0.04 -1.26 -0.44 135.00 141.02 1fv1 s PRO 152 Ca 0.07 2.10 -0.15 0.00 0.04 0.00 0.00 61.00 63.06 1fv1 s PRO 152 Cb -0.16 -3.10 0.02 0.00 0.04 0.00 0.00 34.50 31.30 1fv1 s PRO 152 CO -0.30 -0.08 0.42 -0.59 0.04 0.00 0.00 177.00 176.49 1fv1 s PHE 153 N -1.15 -0.03 -0.40 0.56 -0.71 0.34 -4.91 117.98 111.69 1fv1 s PHE 153 Ca 0.48 -0.31 -0.06 0.00 -1.04 0.00 0.00 56.93 56.00 1fv1 s PHE 153 Cb -0.38 0.24 0.08 0.00 -1.21 0.00 0.00 43.02 41.76 1fv1 s PHE 153 CO 0.50 -0.79 0.20 -1.17 -1.34 0.00 0.00 175.22 172.61 1fv1 s LEU 154 N -2.87 4.99 0.04 -1.99 2.96 -1.26 -1.46 118.68 119.09 1fv1 s LEU 154 Ca 0.09 -1.64 -0.38 0.00 -0.22 0.00 0.00 54.13 51.98 1fv1 s LEU 154 Cb 0.01 -1.89 -0.19 0.00 0.50 0.00 0.00 46.19 44.61 1fv1 s LEU 154 CO -0.06 -0.50 0.97 -2.65 -1.32 0.00 0.00 176.35 172.80 1fv1 n PRO 155 N 4.77 0.03 -3.73 0.98 -0.02 -1.26 -4.84 135.00 130.93 1fv1 n PRO 155 Ca -0.08 0.01 -0.12 0.00 -2.02 0.00 0.00 63.50 61.29 1fv1 n PRO 155 Cb 0.42 -1.42 -0.12 0.00 -0.02 0.00 0.00 33.50 32.36 1fv1 n PRO 155 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1fv1 s SER 156 N -0.18 -0.32 0.00 2.55 0.15 -1.26 -3.19 113.70 111.45 1fv1 s SER 156 Ca 0.86 0.61 0.20 0.00 0.70 0.00 0.00 55.95 58.32 1fv1 s SER 156 Cb -1.20 0.53 1.14 0.00 -1.71 0.00 0.00 66.02 64.79 1fv1 s SER 156 CO 0.57 -0.15 1.59 0.35 1.20 0.00 0.00 173.24 176.80 1fv1 n THR 157 N 3.86 0.11 0.79 6.45 -2.24 -1.26 -2.51 114.28 119.47 1fv1 n THR 157 Ca -0.21 0.03 0.08 0.00 -2.27 0.00 0.00 64.05 61.67 1fv1 n THR 157 Cb 0.55 -0.71 -0.08 0.00 -2.10 0.00 0.00 70.33 67.98 1fv1 n THR 157 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1fv1 n GLU 158 N -1.07 1.50 -3.75 -0.78 4.71 -1.26 -4.91 120.64 115.08 1fv1 n GLU 158 Ca 0.14 -0.11 -0.37 0.00 -0.01 0.00 0.00 57.16 56.80 1fv1 n GLU 158 Cb 0.09 -1.29 -0.06 0.00 -1.01 0.00 0.00 31.44 29.17 1fv1 n GLU 158 CO 0.00 0.00 0.00 -0.51 0.09 0.00 0.00 177.13 176.71 1fv1 s ASP 159 N -2.51 6.52 -0.13 1.62 1.01 -1.05 -4.99 116.67 117.15 1fv1 s ASP 159 Ca 0.07 0.63 0.01 0.00 0.71 0.00 0.00 52.55 53.97 1fv1 s ASP 159 Cb 0.13 -2.13 0.02 0.00 1.01 0.00 0.00 42.92 41.95 1fv1 s ASP 159 CO 0.65 0.37 -0.15 -0.69 0.21 0.00 0.00 175.17 175.57 1fv1 s VAL 160 N -0.99 1.54 0.10 -1.27 1.01 -1.26 -4.32 120.40 115.19 1fv1 s VAL 160 Ca 0.18 -0.64 0.06 0.00 0.00 0.00 0.00 61.98 61.58 1fv1 s VAL 160 Cb -0.14 -1.42 -0.04 0.00 0.00 0.00 0.00 36.38 34.78 1fv1 s VAL 160 CO 0.07 0.45 -0.07 -0.31 0.00 0.00 0.00 175.10 175.24 1fv1 s TYR 161 N 1.20 2.82 0.03 5.22 1.51 0.01 0.04 117.35 128.18 1fv1 s TYR 161 Ca -0.02 -0.11 0.05 0.00 -1.01 0.00 0.00 57.07 55.98 1fv1 s TYR 161 Cb -0.14 -1.47 -0.02 0.00 -0.11 0.00 0.00 41.96 40.22 1fv1 s TYR 161 CO -0.05 0.44 -0.14 -0.51 -1.11 0.00 0.00 175.55 174.18 1fv1 s ASP 162 N -2.20 1.65 -0.23 2.29 1.01 -0.24 -1.24 116.67 117.71 1fv1 s ASP 162 Ca 0.22 -0.41 -0.05 0.00 0.71 0.00 0.00 52.55 53.02 1fv1 s ASP 162 Cb -0.11 -0.12 -0.02 0.00 1.01 0.00 0.00 42.92 43.68 1fv1 s ASP 162 CO 0.15 0.06 0.01 0.00 0.21 0.00 0.00 175.17 175.60 1fv1 s ARG 164 N 1.49 3.83 -0.10 0.00 3.52 0.15 -1.55 118.95 126.29 1fv1 s ARG 164 Ca 0.06 -0.40 0.03 0.00 -0.13 0.00 0.00 55.73 55.28 1fv1 s ARG 164 Cb -0.15 -3.30 0.01 0.00 -1.56 0.00 0.00 34.95 29.95 1fv1 s ARG 164 CO 0.00 0.03 -0.19 0.08 -0.81 0.00 0.00 175.30 174.41 1fv1 s VAL 165 N 1.04 1.70 -0.02 7.11 1.01 0.44 -0.70 120.40 130.98 1fv1 s VAL 165 Ca 0.04 -0.80 0.05 0.00 0.00 0.00 0.00 61.98 61.28 1fv1 s VAL 165 Cb -0.14 -1.51 -0.03 0.00 0.00 0.00 0.00 36.38 34.71 1fv1 s VAL 165 CO 0.03 0.48 -0.16 -1.61 0.00 0.00 0.00 175.10 173.84 1fv1 s GLU 166 N 0.62 2.34 -0.24 2.72 2.02 0.19 -0.71 118.70 125.64 1fv1 s GLU 166 Ca -0.14 -0.80 -0.26 0.00 0.02 0.00 0.00 54.97 53.79 1fv1 s GLU 166 Cb -0.16 -2.29 0.10 0.00 0.10 0.00 0.00 34.13 31.88 1fv1 s GLU 166 CO 0.04 0.59 0.91 -1.58 0.02 0.00 0.00 175.26 175.24 1fv1 s HIS 167 N -0.77 -0.57 0.60 1.61 2.46 -1.26 -1.85 115.29 115.50 1fv1 s HIS 167 Ca 0.12 1.31 0.30 0.00 0.47 0.00 0.00 55.06 57.26 1fv1 s HIS 167 Cb -0.11 0.35 1.67 0.00 -0.13 0.00 0.00 32.58 34.37 1fv1 s HIS 167 CO 0.02 -0.32 2.07 -1.49 -2.47 0.00 0.00 174.74 172.55 1fv1 h TRP 168 N 4.11 0.00 0.00 3.88 6.55 -1.96 -0.65 115.95 127.89 1fv1 h TRP 168 Ca -0.27 0.00 0.00 0.00 0.95 0.00 0.00 58.89 59.57 1fv1 h TRP 168 Cb 1.17 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 29.47 1fv1 h TRP 168 CO 0.34 0.00 0.00 0.41 -1.05 0.00 0.00 178.44 178.14 1fv1 n GLY 169 N -1.38 -1.37 3.82 1.49 0.00 -1.26 -4.83 105.19 101.65 1fv1 n GLY 169 Ca 0.02 -0.12 -0.38 0.00 0.00 0.00 0.00 46.02 45.54 1fv1 n GLY 169 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1fv1 s LEU 170 N -2.79 4.48 0.26 0.99 1.02 -0.25 -4.46 118.68 117.92 1fv1 s LEU 170 Ca 0.21 1.05 0.03 0.00 0.02 0.00 0.00 54.13 55.44 1fv1 s LEU 170 Cb 0.19 -2.70 0.33 0.00 0.02 0.00 0.00 46.19 44.03 1fv1 s LEU 170 CO 0.49 0.28 1.64 0.44 0.02 0.00 0.00 176.35 179.21 1fv1 h ASP 171 N 4.85 0.40 -5.18 2.29 3.32 -1.88 -3.46 116.42 116.76 1fv1 h ASP 171 Ca -0.50 -0.18 -0.10 0.00 0.02 0.00 0.00 57.03 56.28 1fv1 h ASP 171 Cb 1.21 -0.11 -0.14 0.00 0.22 0.00 0.00 39.33 40.51 1fv1 h ASP 171 CO 0.63 0.78 -0.44 -1.61 -1.72 0.00 0.00 179.24 176.88 1fv1 s GLU 172 N -4.16 0.81 0.69 3.56 0.41 -1.26 -5.14 118.70 113.60 1fv1 s GLU 172 Ca -0.06 -1.04 -0.16 0.00 -0.41 0.00 0.00 54.97 53.31 1fv1 s GLU 172 Cb 0.13 0.31 0.01 0.00 -1.78 0.00 0.00 34.13 32.80 1fv1 s GLU 172 CO 0.80 -0.24 1.21 -2.14 -0.49 0.00 0.00 175.26 174.40 1fv1 s PRO 173 N -3.88 2.42 0.06 0.39 0.02 -1.26 -4.91 135.00 127.83 1fv1 s PRO 173 Ca 0.06 1.79 0.03 0.00 0.02 0.00 0.00 61.00 62.90 1fv1 s PRO 173 Cb 0.06 -1.86 -0.04 0.00 0.02 0.00 0.00 34.50 32.67 1fv1 s PRO 173 CO -0.10 -1.63 0.03 -1.17 -0.33 0.00 0.00 177.00 173.80 1fv1 s LEU 174 N -4.80 3.60 -0.06 -5.54 2.96 0.11 -4.94 118.68 110.01 1fv1 s LEU 174 Ca 0.75 -0.07 0.02 0.00 -0.22 0.00 0.00 54.13 54.62 1fv1 s LEU 174 Cb -0.30 -2.25 0.01 0.00 0.50 0.00 0.00 46.19 44.16 1fv1 s LEU 174 CO 0.42 0.20 -0.12 -0.76 -1.32 0.00 0.00 176.35 174.77 1fv1 s LEU 175 N -2.12 1.64 -0.18 -0.68 1.43 -1.26 -0.42 118.68 117.09 1fv1 s LEU 175 Ca 0.25 -0.29 0.01 0.00 -1.03 0.00 0.00 54.13 53.07 1fv1 s LEU 175 Cb -0.12 -0.81 0.02 0.00 0.03 0.00 0.00 46.19 45.32 1fv1 s LEU 175 CO 0.17 0.03 -0.19 -0.54 0.23 0.00 0.00 176.35 176.06 1fv1 s LYS 176 N 0.65 2.83 0.25 1.70 -0.14 -0.60 -4.96 119.74 119.48 1fv1 s LYS 176 Ca -0.14 -0.82 -0.15 0.00 -1.36 0.00 0.00 55.97 53.50 1fv1 s LYS 176 Cb -0.15 -2.52 -0.08 0.00 -1.68 0.00 0.00 37.83 33.40 1fv1 s LYS 176 CO 0.04 -0.24 0.67 -1.58 -0.76 0.00 0.00 175.35 173.48 1fv1 s HIS 177 N 1.31 3.49 -0.20 3.18 2.46 -1.26 -1.36 115.29 122.90 1fv1 s HIS 177 Ca 0.04 1.17 -0.17 0.00 0.47 0.00 0.00 55.06 56.57 1fv1 s HIS 177 Cb -0.13 -2.48 0.05 0.00 -0.13 0.00 0.00 32.58 29.89 1fv1 s HIS 177 CO -0.12 0.24 0.52 -0.46 -2.47 0.00 0.00 174.74 172.44 1fv1 s TRP 178 N -1.76 -0.61 0.09 3.88 -0.00 -0.37 -4.91 118.94 115.26 1fv1 s TRP 178 Ca 0.48 1.43 -0.25 0.00 -0.00 0.00 0.00 56.10 57.75 1fv1 s TRP 178 Cb -0.13 0.23 0.07 0.00 -0.00 0.00 0.00 33.47 33.65 1fv1 s TRP 178 CO 0.19 -0.30 0.64 -1.83 -0.00 0.00 0.00 176.95 175.65 1fv1 s GLU 179 N 0.51 1.19 -0.18 5.86 -1.05 -1.26 -0.81 118.70 122.96 1fv1 s GLU 179 Ca -0.02 -0.27 -0.24 0.00 -0.15 0.00 0.00 54.97 54.30 1fv1 s GLU 179 Cb -0.04 0.55 -0.02 0.00 -0.44 0.00 0.00 34.13 34.18 1fv1 s GLU 179 CO -0.02 -0.48 0.76 0.12 0.95 0.00 0.00 175.26 176.58 1fv1 s PHE 180 N -3.03 3.40 -2.43 4.83 2.19 -1.26 -5.08 117.98 116.60 1fv1 s PHE 180 Ca -0.02 1.13 0.29 0.00 0.33 0.00 0.00 56.93 58.66 1fv1 s PHE 180 Cb -0.01 -2.93 1.16 0.00 -1.31 0.00 0.00 43.02 39.93 1fv1 s PHE 180 CO -0.07 -0.21 1.81 -0.25 1.83 0.00 0.00 175.22 178.33