#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fv1 n GLU 4 N 0.00 0.16 -4.01 5.31 2.13 -1.26 -5.10 120.64 117.87 1fv1 n GLU 4 Ca 0.00 0.06 -0.11 0.00 0.66 0.00 0.00 57.16 57.78 1fv1 n GLU 4 Cb 0.00 -0.77 -0.11 0.00 0.27 0.00 0.00 31.44 30.83 1fv1 n GLU 4 CO 0.00 0.00 0.00 -1.01 -0.41 0.00 0.00 177.13 175.71 1fv1 s HIS 5 N -2.23 0.40 -0.04 4.31 3.76 -1.26 -5.07 115.29 115.16 1fv1 s HIS 5 Ca -0.09 -0.50 0.01 0.00 -0.15 0.00 0.00 55.06 54.33 1fv1 s HIS 5 Cb 0.02 -0.26 0.02 0.00 1.11 0.00 0.00 32.58 33.47 1fv1 s HIS 5 CO 0.13 -0.14 -0.03 0.08 -0.85 0.00 0.00 174.74 173.93 1fv1 s VAL 6 N -1.37 0.40 -0.13 -0.90 1.01 -1.26 -5.03 120.40 113.12 1fv1 s VAL 6 Ca -0.13 -0.03 0.01 0.00 0.00 0.00 0.00 61.98 61.82 1fv1 s VAL 6 Cb -0.10 -0.47 -0.01 0.00 0.00 0.00 0.00 36.38 35.81 1fv1 s VAL 6 CO -0.00 0.20 -0.15 -0.63 0.00 0.00 0.00 175.10 174.52 1fv1 s ILE 7 N 1.06 2.83 -0.07 2.22 1.01 -1.26 -1.58 121.20 125.42 1fv1 s ILE 7 Ca -0.09 -0.74 0.02 0.00 0.00 0.00 0.00 60.65 59.85 1fv1 s ILE 7 Cb -0.14 -2.18 0.01 0.00 0.01 0.00 0.00 42.46 40.17 1fv1 s ILE 7 CO -0.01 0.53 -0.13 -0.63 0.00 0.00 0.00 174.94 174.69 1fv1 s ILE 8 N 0.44 1.25 -0.52 2.92 1.01 0.96 -4.95 121.20 122.31 1fv1 s ILE 8 Ca -0.11 -0.54 -0.18 0.00 0.00 0.00 0.00 60.65 59.82 1fv1 s ILE 8 Cb -0.16 -1.14 0.08 0.00 0.01 0.00 0.00 42.46 41.25 1fv1 s ILE 8 CO 0.05 0.38 0.59 -1.58 0.00 0.00 0.00 174.94 174.38 1fv1 s GLN 9 N 0.70 3.06 -0.16 2.79 0.74 -1.26 0.72 119.66 126.26 1fv1 s GLN 9 Ca -0.14 -1.15 -0.03 0.00 0.05 0.00 0.00 55.36 54.09 1fv1 s GLN 9 Cb -0.16 -4.16 -0.02 0.00 1.10 0.00 0.00 33.01 29.77 1fv1 s GLN 9 CO 0.03 -1.27 -0.06 0.00 -0.55 0.00 0.00 175.29 173.45 1fv1 s ALA 10 N 2.36 2.89 0.06 1.58 0.00 0.14 -4.98 121.76 123.80 1fv1 s ALA 10 Ca 0.11 -0.88 0.01 0.00 0.00 0.00 0.00 51.96 51.19 1fv1 s ALA 10 Cb -0.22 -1.50 -0.03 0.00 0.00 0.00 0.00 23.12 21.36 1fv1 s ALA 10 CO 0.09 0.14 -0.05 -1.83 0.00 0.00 0.00 175.76 174.10 1fv1 s GLU 11 N 0.51 0.62 0.12 0.00 -1.05 -1.26 -0.62 118.70 117.02 1fv1 s GLU 11 Ca -0.05 -1.08 -0.21 0.00 -0.15 0.00 0.00 54.97 53.49 1fv1 s GLU 11 Cb -0.15 -0.02 0.05 0.00 -0.44 0.00 0.00 34.13 33.57 1fv1 s GLU 11 CO 0.03 -0.04 0.52 -0.59 0.95 0.00 0.00 175.26 176.12 1fv1 s PHE 12 N -3.01 -0.40 -0.02 4.83 -0.12 -0.12 -4.96 117.98 114.18 1fv1 s PHE 12 Ca 0.02 0.23 0.01 0.00 -0.05 0.00 0.00 56.93 57.14 1fv1 s PHE 12 Cb 0.01 0.41 0.02 0.00 -0.63 0.00 0.00 43.02 42.82 1fv1 s PHE 12 CO -0.05 -0.75 -0.02 -0.47 -0.05 0.00 0.00 175.22 173.88 1fv1 s TYR 13 N -3.42 0.36 -0.14 3.49 6.14 -1.26 -0.65 117.35 121.86 1fv1 s TYR 13 Ca 0.00 -0.04 0.02 0.00 0.64 0.00 0.00 57.07 57.69 1fv1 s TYR 13 Cb 0.00 -0.36 0.01 0.00 0.42 0.00 0.00 41.96 42.03 1fv1 s TYR 13 CO -0.10 -0.09 -0.21 -1.17 0.64 0.00 0.00 175.55 174.62 1fv1 s LEU 14 N 0.61 2.08 0.07 6.97 2.96 0.21 -4.96 118.68 126.62 1fv1 s LEU 14 Ca -0.06 -0.60 0.04 0.00 -0.22 0.00 0.00 54.13 53.29 1fv1 s LEU 14 Cb -0.09 -1.42 -0.04 0.00 0.50 0.00 0.00 46.19 45.14 1fv1 s LEU 14 CO -0.01 0.06 -0.02 0.20 -1.32 0.00 0.00 176.35 175.27 1fv1 s ASN 15 N 0.91 4.95 0.00 3.68 0.01 -1.26 0.14 114.94 123.36 1fv1 s ASN 15 Ca -0.05 -0.17 0.23 0.00 -0.71 0.00 0.00 52.86 52.16 1fv1 s ASN 15 Cb -0.15 -1.17 1.05 0.00 0.41 0.00 0.00 41.25 41.38 1fv1 s ASN 15 CO -0.04 0.20 1.72 -0.81 -1.51 0.00 0.00 177.10 176.66 1fv1 n PRO 16 N 0.79 1.45 0.29 -0.60 -0.04 -1.26 -4.86 135.00 130.76 1fv1 n PRO 16 Ca -0.12 -0.67 0.14 0.00 -0.04 0.00 0.00 63.50 62.81 1fv1 n PRO 16 Cb 0.52 -1.40 0.85 0.00 -0.04 0.00 0.00 33.50 33.43 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 1.44 0.00 -4.98 3.54 5.19 -2.00 -3.46 116.42 116.16 1fv1 h ASP 17 Ca 0.00 0.00 -0.30 0.00 -0.62 0.00 0.00 57.03 56.11 1fv1 h ASP 17 Cb 0.31 0.00 0.13 0.00 0.18 0.00 0.00 39.33 39.95 1fv1 h ASP 17 CO 0.00 0.02 -0.59 0.00 -3.12 0.00 0.00 179.24 175.56 1fv1 n GLN 18 N -3.90 -6.07 -4.47 3.56 6.02 0.37 -5.00 117.38 107.89 1fv1 n GLN 18 Ca -0.03 0.69 -0.34 0.00 -0.01 0.00 0.00 57.00 57.30 1fv1 n GLN 18 Cb 0.11 -5.27 -0.10 0.00 1.02 0.00 0.00 30.24 26.00 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 -3.63 4.97 0.09 1.08 0.01 -0.88 -4.90 113.70 110.44 1fv1 s SER 19 Ca 0.28 0.06 0.03 0.00 1.31 0.00 0.00 55.95 57.62 1fv1 s SER 19 Cb -0.12 -1.38 -0.04 0.00 0.21 0.00 0.00 66.02 64.69 1fv1 s SER 19 CO 0.60 0.35 -0.08 -0.83 0.41 0.00 0.00 173.24 173.69 1fv1 s GLY 20 N -0.74 0.78 -0.04 3.44 0.00 -1.26 0.65 107.32 110.15 1fv1 s GLY 20 Ca 0.11 -1.23 -0.12 0.00 0.00 0.00 0.00 44.72 43.49 1fv1 s GLY 20 CO 0.02 -1.31 0.27 1.85 0.00 0.00 0.00 173.10 173.93 1fv1 s GLU 21 N -3.16 0.52 -0.09 2.90 2.12 0.17 -4.90 118.70 116.25 1fv1 s GLU 21 Ca 0.07 -0.02 -0.03 0.00 0.36 0.00 0.00 54.97 55.35 1fv1 s GLU 21 Cb 0.00 0.23 0.05 0.00 0.26 0.00 0.00 34.13 34.67 1fv1 s GLU 21 CO -0.02 -0.12 0.11 0.12 -0.54 0.00 0.00 175.26 174.81 1fv1 s PHE 22 N -0.81 -0.02 0.15 5.30 2.19 -1.26 -0.94 117.98 122.58 1fv1 s PHE 22 Ca -0.09 0.25 -0.06 0.00 0.33 0.00 0.00 56.93 57.36 1fv1 s PHE 22 Cb -0.05 -0.44 -0.02 0.00 -1.31 0.00 0.00 43.02 41.20 1fv1 s PHE 22 CO 0.02 -0.32 0.20 0.00 1.83 0.00 0.00 175.22 176.95 1fv1 s MET 23 N 2.22 1.06 -0.07 10.12 0.23 0.21 -1.32 119.30 131.76 1fv1 s MET 23 Ca 0.04 -1.27 0.05 0.00 -1.03 0.00 0.00 55.69 53.49 1fv1 s MET 23 Cb -0.13 0.33 -0.01 0.00 -1.53 0.00 0.00 34.83 33.48 1fv1 s MET 23 CO -0.06 -0.36 -0.23 -0.06 -2.03 0.00 0.00 175.02 172.28 1fv1 s PHE 24 N -3.99 2.50 -0.03 3.16 0.40 -0.30 -0.68 117.98 119.03 1fv1 s PHE 24 Ca 0.19 -0.68 0.07 0.00 -0.60 0.00 0.00 56.93 55.91 1fv1 s PHE 24 Cb 0.05 -1.63 -0.02 0.00 0.51 0.00 0.00 43.02 41.93 1fv1 s PHE 24 CO 0.00 -0.19 -0.23 0.34 0.70 0.00 0.00 175.22 175.84 1fv1 s ASP 25 N -0.14 3.31 -0.21 1.36 -1.08 0.22 -0.70 116.67 119.43 1fv1 s ASP 25 Ca -0.04 -0.40 -0.00 0.00 -0.52 0.00 0.00 52.55 51.59 1fv1 s ASP 25 Cb -0.14 -0.51 0.06 0.00 -1.46 0.00 0.00 42.92 40.86 1fv1 s ASP 25 CO 0.04 0.32 -0.04 0.12 0.52 0.00 0.00 175.17 176.13 1fv1 s PHE 26 N -0.60 2.00 -1.61 -5.34 5.36 0.15 -0.03 117.98 117.91 1fv1 s PHE 26 Ca 0.09 -1.45 -0.13 0.00 -0.96 0.00 0.00 56.93 54.49 1fv1 s PHE 26 Cb -0.10 -1.43 0.11 0.00 -0.34 0.00 0.00 43.02 41.26 1fv1 s PHE 26 CO -0.00 -0.71 0.66 -0.25 -1.46 0.00 0.00 175.22 173.46 1fv1 n ASP 27 N 4.78 -2.38 0.00 6.13 8.00 -0.61 -1.00 116.55 131.47 1fv1 n ASP 27 Ca -0.12 -1.01 0.00 0.00 0.71 0.00 0.00 54.79 54.37 1fv1 n ASP 27 Cb 0.45 -2.85 0.00 0.00 -0.02 0.00 0.00 41.12 38.71 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 -1.62 1.01 3.48 0.44 0.00 -1.26 -5.05 105.19 102.19 1fv1 n GLY 28 Ca -0.05 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.67 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 -3.03 3.88 -0.11 1.61 1.01 -0.17 -5.07 116.67 114.79 1fv1 s ASP 29 Ca 0.00 -0.53 -0.26 0.00 0.71 0.00 0.00 52.55 52.47 1fv1 s ASP 29 Cb 0.00 -0.57 -0.02 0.00 1.01 0.00 0.00 42.92 43.34 1fv1 s ASP 29 CO 0.00 0.19 0.86 -0.70 0.21 0.00 0.00 175.17 175.73 1fv1 s GLU 30 N -2.00 4.39 -0.11 8.23 2.12 -1.26 0.33 118.70 130.40 1fv1 s GLU 30 Ca 0.17 1.12 -0.24 0.00 0.36 0.00 0.00 54.97 56.38 1fv1 s GLU 30 Cb -0.11 -3.53 -0.27 0.00 0.26 0.00 0.00 34.13 30.49 1fv1 s GLU 30 CO 0.09 -0.21 0.72 0.82 -0.54 0.00 0.00 175.26 176.15 1fv1 h ILE 31 N 5.03 1.50 -2.05 -3.70 2.04 -1.26 -3.40 117.51 115.67 1fv1 h ILE 31 Ca -0.34 -2.40 0.22 0.00 1.00 0.00 0.00 64.86 63.35 1fv1 h ILE 31 Cb 1.16 3.11 -0.10 0.00 -0.74 0.00 0.00 36.82 40.25 1fv1 h ILE 31 CO 0.81 0.63 0.60 0.72 0.00 0.00 0.00 178.15 180.90 1fv1 s PHE 32 N -2.34 -0.11 0.15 1.37 -0.71 -1.24 -1.55 117.98 113.55 1fv1 s PHE 32 Ca -0.18 -0.13 -0.07 0.00 -1.04 0.00 0.00 56.93 55.51 1fv1 s PHE 32 Cb 0.00 0.61 -0.02 0.00 -1.21 0.00 0.00 43.02 42.40 1fv1 s PHE 32 CO 0.74 -0.64 0.21 -3.38 -1.34 0.00 0.00 175.22 170.81 1fv1 s HIS 33 N -3.00 0.50 -0.18 3.49 -3.43 -0.67 -1.15 115.29 110.85 1fv1 s HIS 33 Ca 0.13 -0.88 -0.05 0.00 -0.80 0.00 0.00 55.06 53.45 1fv1 s HIS 33 Cb 0.01 -0.17 -0.03 0.00 -1.43 0.00 0.00 32.58 30.95 1fv1 s HIS 33 CO 0.00 -0.65 0.01 0.08 -2.00 0.00 0.00 174.74 172.18 1fv1 s VAL 34 N -3.98 4.24 -0.48 -5.38 1.01 -0.43 -0.11 120.40 115.26 1fv1 s VAL 34 Ca 0.18 -0.23 -0.28 0.00 0.00 0.00 0.00 61.98 61.65 1fv1 s VAL 34 Cb 0.05 -2.90 0.01 0.00 0.00 0.00 0.00 36.38 33.54 1fv1 s VAL 34 CO -0.00 0.46 1.45 -0.62 0.00 0.00 0.00 175.10 176.39 1fv1 s ASP 35 N 0.56 6.18 0.25 3.32 -1.08 0.81 -4.60 116.67 122.11 1fv1 s ASP 35 Ca -0.00 0.61 -0.06 0.00 -0.52 0.00 0.00 52.55 52.58 1fv1 s ASP 35 Cb -0.14 -2.54 0.28 0.00 -1.46 0.00 0.00 42.92 39.06 1fv1 s ASP 35 CO 0.02 -1.61 1.92 0.24 0.52 0.00 0.00 175.17 176.26 1fv1 h MET 36 N 11.17 1.27 0.78 4.34 2.86 -1.90 0.42 114.93 133.87 1fv1 h MET 36 Ca -0.27 -0.09 -0.04 0.00 -2.06 0.00 0.00 59.70 57.23 1fv1 h MET 36 Cb 1.11 -0.28 0.01 0.00 0.06 0.00 0.00 31.60 32.50 1fv1 h MET 36 CO 1.13 0.86 -0.37 0.00 1.06 0.00 0.00 176.91 179.59 1fv1 h ALA 37 N 1.36 -1.11 0.00 6.32 0.00 -1.97 -3.17 119.26 120.69 1fv1 h ALA 37 Ca 0.35 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 55.03 1fv1 h ALA 37 Cb -0.11 0.40 0.00 0.00 0.00 0.00 0.00 17.79 18.09 1fv1 h ALA 37 CO -0.07 -1.03 0.00 1.63 0.00 0.00 0.00 179.25 179.78 1fv1 n LYS 38 N -5.24 0.19 -3.70 0.00 5.02 -1.19 -4.91 118.16 108.33 1fv1 n LYS 38 Ca -0.13 0.07 -0.25 0.00 -2.02 0.00 0.00 58.31 55.98 1fv1 n LYS 38 Cb 0.41 -1.50 0.06 0.00 -0.02 0.00 0.00 35.03 33.98 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 -1.38 -6.66 -4.02 1.97 4.01 0.15 -4.99 118.16 107.23 1fv1 n LYS 39 Ca 0.09 0.73 -0.10 0.00 -0.51 0.00 0.00 58.31 58.52 1fv1 n LYS 39 Cb 0.23 -5.67 -0.11 0.00 -0.51 0.00 0.00 35.03 28.97 1fv1 n LYS 39 CO 0.00 0.00 0.00 -1.83 -1.11 0.00 0.00 177.40 174.46 1fv1 s GLU 40 N -6.28 0.43 0.12 1.97 -1.05 -1.10 -4.77 118.70 108.02 1fv1 s GLU 40 Ca 0.49 -0.74 -0.29 0.00 -0.15 0.00 0.00 54.97 54.28 1fv1 s GLU 40 Cb -0.23 -0.02 -0.06 0.00 -0.44 0.00 0.00 34.13 33.37 1fv1 s GLU 40 CO 0.77 -0.02 0.91 0.95 0.95 0.00 0.00 175.26 178.82 1fv1 s THR 41 N -1.75 4.46 -0.22 1.83 -4.23 -1.26 -0.13 115.64 114.33 1fv1 s THR 41 Ca -0.11 1.98 0.01 0.00 -1.18 0.00 0.00 61.69 62.38 1fv1 s THR 41 Cb -0.08 -4.28 0.03 0.00 1.34 0.00 0.00 72.50 69.52 1fv1 s THR 41 CO -0.02 0.37 -0.13 -0.69 -0.54 0.00 0.00 174.62 173.61 1fv1 s VAL 42 N -0.28 2.39 0.16 2.29 1.01 0.84 -4.92 120.40 121.89 1fv1 s VAL 42 Ca 0.44 -1.13 -0.28 0.00 0.00 0.00 0.00 61.98 61.01 1fv1 s VAL 42 Cb -0.23 -2.18 -0.07 0.00 0.00 0.00 0.00 36.38 33.90 1fv1 s VAL 42 CO 0.29 0.29 0.89 0.26 0.00 0.00 0.00 175.10 176.82 1fv1 s TRP 43 N 1.26 3.89 0.16 5.22 0.52 -1.26 -1.67 118.94 127.05 1fv1 s TRP 43 Ca 0.00 1.76 -0.15 0.00 0.02 0.00 0.00 56.10 57.74 1fv1 s TRP 43 Cb -0.16 -2.94 0.04 0.00 -1.15 0.00 0.00 33.47 29.26 1fv1 s TRP 43 CO -0.08 0.37 1.79 -0.09 0.02 0.00 0.00 176.95 178.96 1fv1 h ARG 44 N 4.82 0.65 -5.39 4.98 9.65 -1.50 -3.40 114.38 124.19 1fv1 h ARG 44 Ca -0.45 -0.06 -0.67 0.00 -1.10 0.00 0.00 59.98 57.70 1fv1 h ARG 44 Cb 1.21 -0.13 -0.30 0.00 -1.39 0.00 0.00 29.97 29.35 1fv1 h ARG 44 CO 0.69 0.48 -0.83 -0.51 2.80 0.00 0.00 179.97 182.59 1fv1 s LEU 45 N -10.05 2.34 0.31 3.80 1.43 -1.26 -5.03 118.68 110.22 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 0.11 -1.49 0.86 0.00 0.03 0.00 0.00 46.19 45.70 1fv1 s LEU 45 CO 0.74 0.17 1.69 -0.08 0.23 0.00 0.00 176.35 179.10 1fv1 h GLU 46 N 6.64 0.38 -0.36 1.70 4.81 -1.99 -0.07 114.58 125.70 1fv1 h GLU 46 Ca -0.23 -0.02 0.10 0.00 -0.13 0.00 0.00 59.36 59.08 1fv1 h GLU 46 Cb 1.22 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 30.50 1fv1 h GLU 46 CO 0.50 0.25 0.26 0.93 -0.73 0.00 0.00 179.01 180.22 1fv1 h GLU 47 N 0.40 0.01 -0.04 1.92 3.07 -1.96 -2.67 114.58 115.32 1fv1 h GLU 47 Ca 0.62 -0.00 0.02 0.00 -0.50 0.00 0.00 59.36 59.51 1fv1 h GLU 47 Cb 1.27 -0.00 -0.03 0.00 -0.84 0.00 0.00 28.75 29.15 1fv1 h GLU 47 CO -0.56 0.01 -0.11 0.74 -1.40 0.00 0.00 179.01 177.70 1fv1 h PHE 48 N 0.01 -0.27 0.00 4.33 0.04 -1.40 -1.56 116.94 118.10 1fv1 h PHE 48 Ca 0.17 0.01 0.00 0.00 2.80 0.00 0.00 57.97 60.95 1fv1 h PHE 48 Cb 0.66 0.13 0.00 0.00 2.20 0.00 0.00 35.95 38.94 1fv1 h PHE 48 CO -0.00 -0.16 0.00 0.41 -0.60 0.00 0.00 178.31 177.96 1fv1 n GLY 49 N -1.24 -0.38 0.25 -1.45 0.00 -1.00 -0.99 105.19 100.38 1fv1 n GLY 49 Ca -0.05 -0.01 0.12 0.00 0.00 0.00 0.00 46.02 46.09 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 -1.30 0.78 0.00 1.61 5.12 -0.59 -4.26 116.66 118.03 1fv1 n ARG 50 Ca 0.01 -0.51 0.00 0.00 -1.93 0.00 0.00 57.85 55.43 1fv1 n ARG 50 Cb 0.02 -1.49 0.00 0.00 -1.16 0.00 0.00 32.46 29.83 1fv1 n ARG 50 CO 0.00 0.00 0.00 1.19 -1.93 0.00 0.00 177.63 176.89 1fv1 n PHE 51 N -0.67 0.00 -4.19 -1.55 3.01 -0.16 -5.09 117.46 108.82 1fv1 n PHE 51 Ca 0.11 0.00 -0.11 0.00 1.01 0.00 0.00 57.45 58.45 1fv1 n PHE 51 Cb 0.36 0.00 -0.10 0.00 -0.01 0.00 0.00 39.48 39.73 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 -1.77 1.10 0.16 4.37 0.00 -0.77 -5.15 121.76 119.70 1fv1 s ALA 52 Ca 0.00 -1.43 0.03 0.00 0.00 0.00 0.00 51.96 50.56 1fv1 s ALA 52 Cb 0.00 0.29 -0.05 0.00 0.00 0.00 0.00 23.12 23.37 1fv1 s ALA 52 CO 0.00 -0.26 -0.04 -1.12 0.00 0.00 0.00 175.76 174.33 1fv1 s SER 53 N -3.09 1.50 -0.19 0.00 0.01 -1.26 -4.40 113.70 106.28 1fv1 s SER 53 Ca 0.16 -1.10 -0.08 0.00 1.31 0.00 0.00 55.95 56.23 1fv1 s SER 53 Cb 0.05 0.05 0.08 0.00 0.21 0.00 0.00 66.02 66.41 1fv1 s SER 53 CO -0.02 -0.47 0.42 0.12 0.41 0.00 0.00 173.24 173.71 1fv1 s PHE 54 N -3.50 -0.71 -0.64 2.43 5.36 -1.26 -5.10 117.98 114.55 1fv1 s PHE 54 Ca 0.20 1.43 -0.27 0.00 -0.96 0.00 0.00 56.93 57.33 1fv1 s PHE 54 Cb 0.05 0.30 0.02 0.00 -0.34 0.00 0.00 43.02 43.04 1fv1 s PHE 54 CO 0.02 -0.42 1.36 -2.00 -1.46 0.00 0.00 175.22 172.73 1fv1 s GLU 55 N 2.02 3.23 0.53 10.12 2.56 -1.26 -4.70 118.70 131.19 1fv1 s GLU 55 Ca -0.06 0.16 0.26 0.00 0.00 0.00 0.00 54.97 55.33 1fv1 s GLU 55 Cb -0.10 -4.15 1.39 0.00 2.00 0.00 0.00 34.13 33.27 1fv1 s GLU 55 CO -0.13 -2.05 1.97 0.00 -0.56 0.00 0.00 175.26 174.50 1fv1 h ALA 56 N 10.75 2.54 -0.68 6.30 0.00 -1.94 -0.94 119.26 135.28 1fv1 h ALA 56 Ca -0.27 -0.02 0.11 0.00 0.00 0.00 0.00 54.91 54.74 1fv1 h ALA 56 Cb 1.08 0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.86 1fv1 h ALA 56 CO 1.22 -0.71 0.45 0.37 0.00 0.00 0.00 179.25 180.59 1fv1 h GLN 57 N 0.03 0.45 -0.98 0.00 5.75 -1.89 0.46 115.11 118.92 1fv1 h GLN 57 Ca 0.29 -0.03 0.02 0.00 -0.15 0.00 0.00 58.65 58.78 1fv1 h GLN 57 Cb 1.12 -0.10 -0.05 0.00 1.07 0.00 0.00 27.48 29.51 1fv1 h GLN 57 CO -0.01 0.30 0.65 0.78 -2.65 0.00 0.00 178.83 177.90 1fv1 h GLY 58 N 0.47 1.40 0.87 2.39 0.00 -1.57 -1.86 103.07 104.76 1fv1 h GLY 58 Ca 0.32 -0.51 -0.06 0.00 0.00 0.00 0.00 47.33 47.08 1fv1 h GLY 58 CO -0.10 0.48 -0.08 0.00 0.00 0.00 0.00 176.54 176.84 1fv1 h ALA 59 N 1.37 0.37 -1.00 3.60 0.00 -1.06 -2.67 119.26 119.87 1fv1 h ALA 59 Ca 0.37 -0.28 0.05 0.00 0.00 0.00 0.00 54.91 55.05 1fv1 h ALA 59 Cb -0.11 -0.09 -0.06 0.00 0.00 0.00 0.00 17.79 17.52 1fv1 h ALA 59 CO -0.09 0.20 0.65 -0.07 0.00 0.00 0.00 179.25 179.94 1fv1 h LEU 60 N 0.28 1.06 -0.44 0.00 3.38 -1.10 -0.41 115.31 118.08 1fv1 h LEU 60 Ca 0.07 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.99 1fv1 h LEU 60 Cb 0.56 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.07 1fv1 h LEU 60 CO 0.03 0.70 0.09 0.00 0.09 0.00 0.00 178.44 179.35 1fv1 h ALA 61 N 1.43 0.59 -0.78 1.53 0.00 -1.27 -1.97 119.26 118.79 1fv1 h ALA 61 Ca 0.42 -0.21 -0.03 0.00 0.00 0.00 0.00 54.91 55.08 1fv1 h ALA 61 Cb 0.10 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.68 1fv1 h ALA 61 CO -0.15 0.29 0.36 -0.91 0.00 0.00 0.00 179.25 178.84 1fv1 h ASN 62 N 0.59 1.02 -0.46 0.00 4.21 -1.00 -2.05 115.58 117.89 1fv1 h ASN 62 Ca 0.14 -0.12 -0.10 0.00 1.21 0.00 0.00 56.30 57.43 1fv1 h ASN 62 Cb 0.35 -0.26 -0.01 0.00 -1.12 0.00 0.00 38.32 37.28 1fv1 h ASN 62 CO 0.01 0.87 -0.09 0.40 -1.29 0.00 0.00 177.43 177.33 1fv1 h ILE 63 N 1.11 1.27 -0.51 2.81 1.08 -0.86 0.17 117.51 122.58 1fv1 h ILE 63 Ca 0.27 -1.20 -0.03 0.00 -0.39 0.00 0.00 64.86 63.51 1fv1 h ILE 63 Cb 0.13 1.09 -0.02 0.00 -3.07 0.00 0.00 36.82 34.95 1fv1 h ILE 63 CO -0.03 0.41 0.20 0.00 -0.69 0.00 0.00 178.15 178.04 1fv1 h ALA 64 N 0.89 1.40 -0.29 1.87 0.00 -1.15 -0.53 119.26 121.44 1fv1 h ALA 64 Ca 0.12 -0.14 -0.17 0.00 0.00 0.00 0.00 54.91 54.73 1fv1 h ALA 64 Cb 0.63 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.21 1fv1 h ALA 64 CO 0.04 0.46 -0.46 0.28 0.00 0.00 0.00 179.25 179.56 1fv1 h VAL 65 N 0.73 1.28 -0.99 0.00 2.07 -0.95 -2.43 116.25 115.96 1fv1 h VAL 65 Ca 0.18 -1.65 0.00 0.00 0.82 0.00 0.00 66.70 66.05 1fv1 h VAL 65 Cb 0.15 1.62 -0.05 0.00 -1.52 0.00 0.00 31.29 31.49 1fv1 h VAL 65 CO -0.02 0.54 0.64 0.44 0.02 0.00 0.00 177.57 179.18 1fv1 h ASP 66 N 0.60 1.15 -0.15 0.57 3.32 0.16 0.12 116.42 122.19 1fv1 h ASP 66 Ca 0.02 -0.04 -0.00 0.00 0.02 0.00 0.00 57.03 57.03 1fv1 h ASP 66 Cb 1.07 -0.29 -0.01 0.00 0.22 0.00 0.00 39.33 40.32 1fv1 h ASP 66 CO 0.11 0.85 0.08 0.50 -1.72 0.00 0.00 179.24 179.05 1fv1 h LYS 67 N 1.34 0.21 -0.69 3.56 3.64 -1.04 0.14 116.57 123.74 1fv1 h LYS 67 Ca 0.36 -0.03 0.02 0.00 -1.27 0.00 0.00 60.65 59.73 1fv1 h LYS 67 Cb -0.13 -0.04 -0.04 0.00 -0.41 0.00 0.00 32.23 31.62 1fv1 h LYS 67 CO -0.07 0.23 0.44 0.00 -2.27 0.00 0.00 179.45 177.78 1fv1 h ALA 68 N 0.97 0.88 -0.46 5.00 0.00 -0.90 -1.78 119.26 122.97 1fv1 h ALA 68 Ca 0.05 -0.03 -0.09 0.00 0.00 0.00 0.00 54.91 54.84 1fv1 h ALA 68 Cb 0.08 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 1fv1 h ALA 68 CO -0.01 0.24 -0.08 -0.91 0.00 0.00 0.00 179.25 178.49 1fv1 h ASN 69 N 0.88 0.79 -0.56 0.00 4.21 -0.49 -2.95 115.58 117.46 1fv1 h ASN 69 Ca 0.26 -0.23 -0.01 0.00 1.21 0.00 0.00 56.30 57.54 1fv1 h ASN 69 Cb -0.04 -0.21 -0.03 0.00 -1.12 0.00 0.00 38.32 36.92 1fv1 h ASN 69 CO -0.08 0.91 0.32 0.25 -1.29 0.00 0.00 177.43 177.54 1fv1 h LEU 70 N 0.74 0.68 -0.77 1.61 5.85 -0.17 -0.69 115.31 122.56 1fv1 h LEU 70 Ca 0.13 -0.08 0.09 0.00 0.84 0.00 0.00 57.88 58.86 1fv1 h LEU 70 Cb 0.56 -0.17 -0.07 0.00 0.37 0.00 0.00 40.66 41.35 1fv1 h LEU 70 CO 0.03 0.56 0.43 -0.33 -0.34 0.00 0.00 178.44 178.79 1fv1 h GLU 71 N 0.75 0.71 -0.19 1.25 3.07 -1.17 0.42 114.58 119.43 1fv1 h GLU 71 Ca 0.20 -0.04 -0.07 0.00 -0.50 0.00 0.00 59.36 58.94 1fv1 h GLU 71 Cb 0.01 -0.16 -0.00 0.00 -0.84 0.00 0.00 28.75 27.76 1fv1 h GLU 71 CO -0.03 0.47 -0.17 0.82 -1.40 0.00 0.00 179.01 178.69 1fv1 h ILE 72 N 0.74 1.33 -0.79 3.13 2.04 -1.40 -2.87 117.51 119.70 1fv1 h ILE 72 Ca 0.37 -1.32 -0.02 0.00 1.00 0.00 0.00 64.86 64.88 1fv1 h ILE 72 Cb 0.33 1.78 -0.04 0.00 -0.74 0.00 0.00 36.82 38.15 1fv1 h ILE 72 CO -0.24 0.40 0.39 0.24 0.00 0.00 0.00 178.15 178.94 1fv1 h MET 73 N 0.11 1.12 -0.27 2.37 2.86 -0.52 0.42 114.93 121.01 1fv1 h MET 73 Ca 0.03 -0.15 0.01 0.00 -2.06 0.00 0.00 59.70 57.53 1fv1 h MET 73 Cb 0.71 -0.21 -0.02 0.00 0.06 0.00 0.00 31.60 32.14 1fv1 h MET 73 CO 0.04 0.85 0.17 1.15 1.06 0.00 0.00 176.91 180.18 1fv1 h THR 74 N 1.11 1.05 -0.14 2.22 2.02 -0.16 -0.47 112.91 118.55 1fv1 h THR 74 Ca 0.27 -0.12 -0.03 0.00 0.77 0.00 0.00 66.41 67.31 1fv1 h THR 74 Cb 0.09 0.67 -0.00 0.00 -1.74 0.00 0.00 68.15 67.17 1fv1 h THR 74 CO -0.04 0.06 -0.01 0.50 0.37 0.00 0.00 175.52 176.40 1fv1 h LYS 75 N 0.34 0.25 -0.71 6.66 3.64 -1.25 -0.44 116.57 125.07 1fv1 h LYS 75 Ca 0.10 -0.09 0.16 0.00 -1.27 0.00 0.00 60.65 59.56 1fv1 h LYS 75 Cb -0.02 -0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 31.74 1fv1 h LYS 75 CO -0.04 0.51 0.48 -0.09 -2.27 0.00 0.00 179.45 178.04 1fv1 h ARG 76 N -0.03 0.25 -0.00 1.90 2.43 -0.70 0.17 114.38 118.40 1fv1 h ARG 76 Ca 0.04 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.19 1fv1 h ARG 76 Cb 0.40 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 29.90 1fv1 h ARG 76 CO 0.01 0.17 -0.01 -1.13 -1.51 0.00 0.00 179.97 177.49 1fv1 n SER 77 N -4.43 0.12 -0.82 -3.80 3.41 -0.20 -4.86 113.62 103.03 1fv1 n SER 77 Ca 0.14 -0.63 -0.05 0.00 -0.26 0.00 0.00 58.87 58.07 1fv1 n SER 77 Cb 0.59 -0.12 0.01 0.00 -0.26 0.00 0.00 64.21 64.43 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 -1.06 -2.51 -3.57 4.04 5.15 0.60 -3.72 115.26 114.19 1fv1 n ASN 78 Ca 0.19 -0.05 -0.24 0.00 -0.60 0.00 0.00 54.58 53.87 1fv1 n ASN 78 Cb 0.19 -1.57 0.07 0.00 -0.53 0.00 0.00 39.78 37.95 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 -3.66 -2.79 -2.78 1.20 4.01 -0.19 -4.96 117.16 107.99 1fv1 n TYR 79 Ca -0.04 0.97 -0.42 0.00 -0.16 0.00 0.00 57.90 58.25 1fv1 n TYR 79 Cb 0.53 -4.94 -0.03 0.00 -0.31 0.00 0.00 39.34 34.60 1fv1 n TYR 79 CO 0.00 0.00 0.00 -0.08 -0.46 0.00 0.00 176.86 176.32 1fv1 s THR 80 N -3.31 4.75 0.72 -0.72 -1.32 -1.24 -5.03 115.64 109.49 1fv1 s THR 80 Ca 0.57 1.76 -0.11 0.00 -1.21 0.00 0.00 61.69 62.70 1fv1 s THR 80 Cb -0.26 -4.21 0.02 0.00 -1.51 0.00 0.00 72.50 66.54 1fv1 s THR 80 CO 0.71 -0.14 1.09 -2.16 -2.21 0.00 0.00 174.62 171.90 1fv1 s PRO 81 N 3.03 2.77 0.51 7.08 0.04 -1.26 -5.04 135.00 142.13 1fv1 s PRO 81 Ca 0.39 0.58 -0.19 0.00 0.04 0.00 0.00 61.00 61.82 1fv1 s PRO 81 Cb -0.15 -2.00 -0.07 0.00 0.04 0.00 0.00 34.50 32.31 1fv1 s PRO 81 CO 0.07 -1.13 1.04 -1.50 0.04 0.00 0.00 177.00 175.53 1fv1 s ILE 82 N -3.26 3.81 -0.15 0.56 2.07 -1.26 -5.02 121.20 117.95 1fv1 s ILE 82 Ca 0.58 1.06 -0.20 0.00 -1.41 0.00 0.00 60.65 60.69 1fv1 s ILE 82 Cb -0.12 -3.44 -0.03 0.00 0.13 0.00 0.00 42.46 38.99 1fv1 s ILE 82 CO 0.53 -0.30 0.59 -0.89 -1.91 0.00 0.00 174.94 172.95 1fv1 s THR 83 N -2.09 5.08 0.15 4.00 2.01 -1.26 -5.01 115.64 118.53 1fv1 s THR 83 Ca 0.66 1.14 -0.31 0.00 0.31 0.00 0.00 61.69 63.49 1fv1 s THR 83 Cb -0.16 -3.91 -0.10 0.00 0.01 0.00 0.00 72.50 68.34 1fv1 s THR 83 CO 0.24 0.21 1.54 0.20 -0.69 0.00 0.00 174.62 176.11 1fv1 s ASN 84 N 0.96 6.63 -0.27 3.53 0.01 -1.26 -4.67 114.94 119.87 1fv1 s ASN 84 Ca 0.29 2.56 0.02 0.00 -0.71 0.00 0.00 52.86 55.02 1fv1 s ASN 84 Cb -0.16 -2.59 0.06 0.00 0.41 0.00 0.00 41.25 38.97 1fv1 s ASN 84 CO 0.12 -0.79 -0.08 -0.69 -1.51 0.00 0.00 177.10 174.15 1fv1 s VAL 85 N 1.16 2.34 0.54 1.60 1.01 0.10 -4.83 120.40 122.33 1fv1 s VAL 85 Ca 0.69 -1.63 -0.21 0.00 0.00 0.00 0.00 61.98 60.83 1fv1 s VAL 85 Cb -0.42 -2.40 -0.05 0.00 0.00 0.00 0.00 36.38 33.51 1fv1 s VAL 85 CO 0.31 -0.08 1.27 -2.16 0.00 0.00 0.00 175.10 174.44 1fv1 s PRO 86 N 1.12 3.20 0.57 2.72 0.04 -1.26 -1.72 135.00 139.67 1fv1 s PRO 86 Ca -0.07 2.02 -0.14 0.00 0.04 0.00 0.00 61.00 62.85 1fv1 s PRO 86 Cb -0.20 -2.19 -0.06 0.00 0.04 0.00 0.00 34.50 32.09 1fv1 s PRO 86 CO -0.04 -1.08 1.01 -1.25 0.04 0.00 0.00 177.00 175.68 1fv1 s PRO 87 N -2.99 3.75 -0.17 0.56 0.04 -1.26 -4.53 135.00 130.41 1fv1 s PRO 87 Ca 0.72 0.88 -0.09 0.00 0.04 0.00 0.00 61.00 62.55 1fv1 s PRO 87 Cb -0.35 -2.10 -0.05 0.00 0.04 0.00 0.00 34.50 32.04 1fv1 s PRO 87 CO 0.41 -0.44 0.12 -1.21 0.04 0.00 0.00 177.00 175.92 1fv1 s GLU 88 N -4.56 3.91 -0.07 4.56 2.02 0.06 -4.90 118.70 119.72 1fv1 s GLU 88 Ca 0.57 -0.22 0.04 0.00 0.02 0.00 0.00 54.97 55.38 1fv1 s GLU 88 Cb -0.11 -3.31 0.00 0.00 0.10 0.00 0.00 34.13 30.82 1fv1 s GLU 88 CO 0.42 0.44 -0.20 0.08 0.02 0.00 0.00 175.26 176.02 1fv1 s VAL 89 N -0.06 1.69 -0.01 2.63 1.01 -1.26 -0.25 120.40 124.15 1fv1 s VAL 89 Ca 0.09 -0.83 0.02 0.00 0.00 0.00 0.00 61.98 61.27 1fv1 s VAL 89 Cb -0.11 -1.47 -0.00 0.00 0.00 0.00 0.00 36.38 34.80 1fv1 s VAL 89 CO 0.00 0.48 -0.07 0.42 0.00 0.00 0.00 175.10 175.93 1fv1 s THR 90 N 0.27 0.53 -0.13 3.92 -4.23 -0.67 -4.99 115.64 110.34 1fv1 s THR 90 Ca -0.12 -0.27 0.01 0.00 -1.18 0.00 0.00 61.69 60.12 1fv1 s THR 90 Cb -0.15 -0.45 -0.01 0.00 1.34 0.00 0.00 72.50 73.23 1fv1 s THR 90 CO 0.05 0.15 -0.15 -0.69 -0.54 0.00 0.00 174.62 173.44 1fv1 s VAL 91 N -0.09 2.80 0.19 2.29 1.01 -1.26 -0.56 120.40 124.78 1fv1 s VAL 91 Ca 0.02 -0.74 -0.06 0.00 0.00 0.00 0.00 61.98 61.19 1fv1 s VAL 91 Cb -0.03 -2.16 -0.02 0.00 0.00 0.00 0.00 36.38 34.16 1fv1 s VAL 91 CO -0.00 0.53 0.26 -1.48 0.00 0.00 0.00 175.10 174.40 1fv1 s LEU 92 N 0.48 0.95 0.07 3.92 2.34 -0.19 -4.98 118.68 121.27 1fv1 s LEU 92 Ca -0.11 -1.11 0.01 0.00 0.06 0.00 0.00 54.13 52.98 1fv1 s LEU 92 Cb -0.16 0.96 -0.04 0.00 -0.56 0.00 0.00 46.19 46.39 1fv1 s LEU 92 CO 0.05 -0.92 0.19 0.28 -1.06 0.00 0.00 176.35 174.89 1fv1 s THR 93 N -4.06 5.27 0.35 5.48 -1.32 -1.26 0.12 115.64 120.21 1fv1 s THR 93 Ca 0.27 -0.45 0.02 0.00 -1.21 0.00 0.00 61.69 60.32 1fv1 s THR 93 Cb 0.04 -3.57 0.27 0.00 -1.51 0.00 0.00 72.50 67.73 1fv1 s THR 93 CO 0.07 0.13 2.00 -1.13 -2.21 0.00 0.00 174.62 173.48 1fv1 h ASN 94 N 3.08 0.74 -5.09 8.08 -1.24 -1.07 -3.46 115.58 116.62 1fv1 h ASN 94 Ca -0.45 -0.02 -0.02 0.00 0.71 0.00 0.00 56.30 56.52 1fv1 h ASN 94 Cb 1.16 -0.18 -0.10 0.00 0.73 0.00 0.00 38.32 39.93 1fv1 h ASN 94 CO 0.74 0.52 0.03 -0.94 -1.29 0.00 0.00 177.43 176.49 1fv1 s SER 95 N -6.41 -0.25 0.08 1.15 1.04 -1.26 -5.04 113.70 103.00 1fv1 s SER 95 Ca -0.10 -0.51 -0.37 0.00 0.48 0.00 0.00 55.95 55.46 1fv1 s SER 95 Cb 0.18 0.58 -0.16 0.00 0.10 0.00 0.00 66.02 66.72 1fv1 s SER 95 CO 0.77 -1.06 1.37 -2.65 0.98 0.00 0.00 173.24 172.65 1fv1 n PRO 96 N -0.34 1.24 -2.44 4.02 -0.02 -1.26 -4.91 135.00 131.29 1fv1 n PRO 96 Ca -0.09 0.45 -0.32 0.00 -2.02 0.00 0.00 63.50 61.51 1fv1 n PRO 96 Cb 0.62 -2.10 -0.04 0.00 -0.02 0.00 0.00 33.50 31.96 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 0.62 4.50 -0.24 -1.45 1.01 -1.26 -5.07 120.40 118.51 1fv1 s VAL 97 Ca 0.84 1.24 -0.12 0.00 0.00 0.00 0.00 61.98 63.95 1fv1 s VAL 97 Cb -0.93 -3.70 0.08 0.00 0.00 0.00 0.00 36.38 31.83 1fv1 s VAL 97 CO 0.47 -0.64 0.57 -1.83 0.00 0.00 0.00 175.10 173.66 1fv1 s GLU 98 N -3.97 0.55 0.17 2.72 1.03 -1.26 -5.11 118.70 112.84 1fv1 s GLU 98 Ca 0.59 1.13 -0.31 0.00 0.03 0.00 0.00 54.97 56.41 1fv1 s GLU 98 Cb -0.10 0.25 -0.17 0.00 -0.80 0.00 0.00 34.13 33.32 1fv1 s GLU 98 CO 0.29 -0.17 0.87 1.47 -1.33 0.00 0.00 175.26 176.38 1fv1 n LEU 99 N 4.65 0.22 0.00 1.83 -0.00 -1.26 -1.43 117.00 121.01 1fv1 n LEU 99 Ca -0.18 1.15 0.00 0.00 -0.00 0.00 0.00 56.01 56.98 1fv1 n LEU 99 Cb 0.55 -1.07 0.00 0.00 -0.00 0.00 0.00 43.42 42.89 1fv1 n LEU 99 CO 0.01 -2.09 0.00 -2.11 -0.00 0.00 0.00 177.39 173.20 1fv1 n ARG 100 N 1.23 0.00 -3.20 1.47 -4.01 -1.21 -4.97 116.66 105.97 1fv1 n ARG 100 Ca 0.16 0.00 -0.41 0.00 -1.04 0.00 0.00 57.85 56.56 1fv1 n ARG 100 Cb 0.23 -3.01 -0.07 0.00 -3.04 0.00 0.00 32.46 26.56 1fv1 n ARG 100 CO 0.00 0.00 0.00 -2.00 -3.04 0.00 0.00 177.63 172.59 1fv1 s GLU 101 N -0.22 3.85 0.42 2.89 2.12 -0.51 -4.92 118.70 122.32 1fv1 s GLU 101 Ca 0.00 0.14 -0.24 0.00 0.36 0.00 0.00 54.97 55.23 1fv1 s GLU 101 Cb 0.00 -3.73 -0.10 0.00 0.26 0.00 0.00 34.13 30.55 1fv1 s GLU 101 CO 0.00 -0.53 1.02 -2.30 -0.54 0.00 0.00 175.26 172.90 1fv1 n PRO 102 N 5.74 1.36 -4.01 4.30 -0.02 -1.26 -4.29 135.00 136.82 1fv1 n PRO 102 Ca -0.03 0.49 -0.13 0.00 -2.02 0.00 0.00 63.50 61.80 1fv1 n PRO 102 Cb 0.49 -2.06 -0.02 0.00 -0.02 0.00 0.00 33.50 31.89 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 -0.74 0.69 -0.02 2.55 3.84 -0.21 -5.00 114.94 116.05 1fv1 s ASN 103 Ca 0.63 -1.40 0.01 0.00 0.21 0.00 0.00 52.86 52.32 1fv1 s ASN 103 Cb -0.55 0.72 0.01 0.00 -0.55 0.00 0.00 41.25 40.87 1fv1 s ASN 103 CO 0.57 -1.41 -0.05 -0.69 -2.79 0.00 0.00 177.10 172.73 1fv1 s VAL 104 N -2.83 0.46 -0.08 -5.21 1.01 -1.26 -0.21 120.40 112.28 1fv1 s VAL 104 Ca 0.26 -0.18 -0.17 0.00 0.00 0.00 0.00 61.98 61.90 1fv1 s VAL 104 Cb -0.02 -0.44 -0.05 0.00 0.00 0.00 0.00 36.38 35.87 1fv1 s VAL 104 CO 0.18 0.17 0.44 -0.76 0.00 0.00 0.00 175.10 175.13 1fv1 s LEU 105 N 0.33 4.35 -0.16 3.92 1.43 0.59 -0.37 118.68 128.76 1fv1 s LEU 105 Ca -0.04 0.85 -0.00 0.00 -1.03 0.00 0.00 54.13 53.91 1fv1 s LEU 105 Cb -0.08 -2.64 -0.00 0.00 0.03 0.00 0.00 46.19 43.50 1fv1 s LEU 105 CO -0.00 0.12 -0.14 -0.63 0.23 0.00 0.00 176.35 175.93 1fv1 s ILE 106 N 0.01 2.73 -0.33 -0.59 1.01 0.32 -0.63 121.20 123.72 1fv1 s ILE 106 Ca 0.24 -0.74 -0.08 0.00 0.00 0.00 0.00 60.65 60.07 1fv1 s ILE 106 Cb -0.16 -2.16 0.02 0.00 0.01 0.00 0.00 42.46 40.18 1fv1 s ILE 106 CO 0.11 0.51 0.13 0.00 0.00 0.00 0.00 174.94 175.69 1fv1 s PHE 108 N 1.48 3.22 -0.28 0.00 5.36 0.28 -1.25 117.98 126.79 1fv1 s PHE 108 Ca 0.01 -0.51 -0.10 0.00 -0.96 0.00 0.00 56.93 55.36 1fv1 s PHE 108 Cb -0.19 -2.44 -0.03 0.00 -0.34 0.00 0.00 43.02 40.02 1fv1 s PHE 108 CO 0.04 -0.47 0.16 0.42 -1.46 0.00 0.00 175.22 173.91 1fv1 s ILE 109 N 1.65 4.93 0.25 3.12 1.09 -0.44 -1.66 121.20 130.13 1fv1 s ILE 109 Ca 0.05 -0.07 0.07 0.00 -1.10 0.00 0.00 60.65 59.60 1fv1 s ILE 109 Cb -0.18 -3.39 -0.05 0.00 -1.06 0.00 0.00 42.46 37.78 1fv1 s ILE 109 CO 0.08 0.21 -0.08 -0.62 -0.10 0.00 0.00 174.94 174.43 1fv1 s ASP 110 N 1.69 2.57 -1.29 3.58 2.15 0.66 -0.97 116.67 125.05 1fv1 s ASP 110 Ca 0.06 -1.13 -0.17 0.00 0.43 0.00 0.00 52.55 51.74 1fv1 s ASP 110 Cb -0.16 -0.13 0.01 0.00 -0.30 0.00 0.00 42.92 42.34 1fv1 s ASP 110 CO 0.08 -0.31 0.54 0.29 -0.17 0.00 0.00 175.17 175.60 1fv1 n LYS 111 N -0.49 -1.32 -4.26 4.34 5.02 -0.82 -0.76 118.16 119.88 1fv1 n LYS 111 Ca -0.06 0.26 -0.14 0.00 -2.02 0.00 0.00 58.31 56.34 1fv1 n LYS 111 Cb 0.62 -3.59 -0.10 0.00 -0.02 0.00 0.00 35.03 31.94 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 -3.76 1.27 -0.18 2.13 -0.71 -1.09 -4.48 117.98 111.17 1fv1 s PHE 112 Ca 0.29 -0.96 -0.29 0.00 -1.04 0.00 0.00 56.93 54.93 1fv1 s PHE 112 Cb -0.14 -0.72 0.13 0.00 -1.21 0.00 0.00 43.02 41.09 1fv1 s PHE 112 CO 0.93 -0.14 1.01 -0.08 -1.34 0.00 0.00 175.22 175.60 1fv1 s THR 113 N -3.57 0.00 0.94 -4.49 -1.32 -0.70 -0.25 115.64 106.25 1fv1 s THR 113 Ca 0.23 0.00 -0.12 0.00 -1.21 0.00 0.00 61.69 60.59 1fv1 s THR 113 Cb 0.05 -1.00 0.15 0.00 -1.51 0.00 0.00 72.50 70.20 1fv1 s THR 113 CO 0.04 0.00 1.09 -2.16 -2.21 0.00 0.00 174.62 171.38 1fv1 s PRO 114 N -0.94 0.89 -1.18 7.08 0.04 -1.26 0.03 135.00 139.67 1fv1 s PRO 114 Ca -0.01 0.68 -0.13 0.00 0.04 0.00 0.00 61.00 61.58 1fv1 s PRO 114 Cb -0.01 -1.78 -0.06 0.00 0.04 0.00 0.00 34.50 32.69 1fv1 s PRO 114 CO 0.00 -2.45 2.28 -0.35 0.04 0.00 0.00 177.00 176.52 1fv1 n PRO 115 N -4.01 2.49 -3.71 0.56 -0.04 -1.26 -4.76 135.00 124.27 1fv1 n PRO 115 Ca 0.06 -2.02 -0.16 0.00 -0.04 0.00 0.00 63.50 61.35 1fv1 n PRO 115 Cb 0.56 -2.87 -0.16 0.00 -0.04 0.00 0.00 33.50 31.00 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 3.49 -0.15 -0.15 0.52 1.01 -1.26 -5.03 120.40 118.83 1fv1 s VAL 116 Ca 0.53 0.29 -0.21 0.00 0.00 0.00 0.00 61.98 62.59 1fv1 s VAL 116 Cb 0.14 -0.24 0.05 0.00 0.00 0.00 0.00 36.38 36.34 1fv1 s VAL 116 CO -0.01 0.12 0.55 0.54 0.00 0.00 0.00 175.10 176.30 1fv1 s VAL 117 N 1.77 0.01 -0.27 2.92 0.11 -1.26 -4.75 120.40 118.93 1fv1 s VAL 117 Ca -0.02 -0.07 -0.05 0.00 -2.93 0.00 0.00 61.98 58.91 1fv1 s VAL 117 Cb -0.12 -0.80 0.01 0.00 -1.53 0.00 0.00 36.38 33.94 1fv1 s VAL 117 CO -0.05 -0.04 0.02 0.21 -3.33 0.00 0.00 175.10 171.91 1fv1 s ASN 118 N -0.24 4.76 -0.09 3.54 3.84 -0.75 -4.97 114.94 121.04 1fv1 s ASN 118 Ca -0.04 -0.73 0.03 0.00 0.21 0.00 0.00 52.86 52.33 1fv1 s ASN 118 Cb -0.03 -1.79 -0.01 0.00 -0.55 0.00 0.00 41.25 38.86 1fv1 s ASN 118 CO 0.03 -0.15 -0.18 -0.69 -2.79 0.00 0.00 177.10 173.32 1fv1 s VAL 119 N 1.44 2.64 0.06 -5.21 1.01 -1.26 -0.61 120.40 118.47 1fv1 s VAL 119 Ca 0.02 -0.84 0.05 0.00 0.00 0.00 0.00 61.98 61.21 1fv1 s VAL 119 Cb -0.17 -2.04 -0.03 0.00 0.00 0.00 0.00 36.38 34.15 1fv1 s VAL 119 CO -0.01 0.56 -0.13 -0.89 0.00 0.00 0.00 175.10 174.63 1fv1 s THR 120 N -0.04 1.01 -0.09 3.92 2.01 -0.24 -4.97 115.64 117.23 1fv1 s THR 120 Ca -0.05 -1.19 -0.01 0.00 0.31 0.00 0.00 61.69 60.75 1fv1 s THR 120 Cb -0.14 -0.97 -0.03 0.00 0.01 0.00 0.00 72.50 71.36 1fv1 s THR 120 CO 0.04 -0.20 -0.03 0.26 -0.69 0.00 0.00 174.62 174.00 1fv1 s TRP 121 N -1.19 3.04 -0.06 4.92 0.52 -1.26 -0.35 118.94 124.57 1fv1 s TRP 121 Ca -0.02 0.02 0.04 0.00 0.02 0.00 0.00 56.10 56.15 1fv1 s TRP 121 Cb -0.09 -1.80 0.00 0.00 -1.15 0.00 0.00 33.47 30.43 1fv1 s TRP 121 CO 0.02 0.30 -0.18 -0.51 0.02 0.00 0.00 176.95 176.60 1fv1 s LEU 122 N -0.57 1.88 -0.22 2.99 1.43 0.14 -1.23 118.68 123.10 1fv1 s LEU 122 Ca 0.09 -0.39 -0.01 0.00 -1.03 0.00 0.00 54.13 52.79 1fv1 s LEU 122 Cb -0.12 -1.04 0.02 0.00 0.03 0.00 0.00 46.19 45.08 1fv1 s LEU 122 CO 0.02 0.13 -0.10 -0.60 0.23 0.00 0.00 176.35 176.03 1fv1 s ARG 123 N 0.26 2.99 -1.59 1.70 3.52 0.26 -0.58 118.95 125.51 1fv1 s ARG 123 Ca -0.10 -0.86 -0.16 0.00 -0.13 0.00 0.00 55.73 54.48 1fv1 s ARG 123 Cb -0.14 -2.87 0.12 0.00 -1.56 0.00 0.00 34.95 30.51 1fv1 s ARG 123 CO 0.04 -0.30 0.82 0.09 -0.81 0.00 0.00 175.30 175.13 1fv1 n ASN 124 N 4.68 -3.91 0.00 -2.12 3.02 0.14 -1.16 115.26 115.91 1fv1 n ASN 124 Ca -0.18 -0.84 0.00 0.00 -0.03 0.00 0.00 54.58 53.53 1fv1 n ASN 124 Cb 0.49 -3.17 0.00 0.00 -0.61 0.00 0.00 39.78 36.49 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 -1.45 1.69 3.49 7.41 0.00 -1.26 -5.04 105.19 110.03 1fv1 n GLY 125 Ca 0.06 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 -0.47 3.11 0.40 1.61 1.02 -0.31 -5.03 119.74 120.07 1fv1 s LYS 126 Ca 0.00 -0.60 -0.26 0.00 0.02 0.00 0.00 55.97 55.13 1fv1 s LYS 126 Cb 0.00 -2.65 -0.11 0.00 -0.52 0.00 0.00 37.83 34.55 1fv1 s LYS 126 CO 0.00 0.44 1.25 -2.30 -0.92 0.00 0.00 175.35 173.82 1fv1 n PRO 127 N 2.90 1.94 -4.28 -1.68 -0.02 -1.26 -0.57 135.00 132.02 1fv1 n PRO 127 Ca -0.18 0.69 -0.18 0.00 -2.02 0.00 0.00 63.50 61.81 1fv1 n PRO 127 Cb 0.53 -2.34 -0.15 0.00 -0.02 0.00 0.00 33.50 31.52 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 -1.17 0.60 0.00 -1.45 -7.23 -0.37 -4.81 120.40 105.97 1fv1 s VAL 128 Ca 0.59 -0.30 0.00 0.00 -1.81 0.00 0.00 61.98 60.46 1fv1 s VAL 128 Cb -0.53 -0.52 0.00 0.00 0.56 0.00 0.00 36.38 35.89 1fv1 s VAL 128 CO 0.59 0.18 0.11 0.35 -0.31 0.00 0.00 175.10 176.02 1fv1 n THR 129 N 3.05 0.00 -1.85 5.32 -2.24 -1.26 -4.34 114.28 112.97 1fv1 n THR 129 Ca -0.15 -0.22 -0.42 0.00 -2.27 0.00 0.00 64.05 60.99 1fv1 n THR 129 Cb 0.56 1.27 -0.03 0.00 -2.10 0.00 0.00 70.33 70.04 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 -0.23 3.31 0.00 4.28 -4.23 -1.26 -2.43 115.64 115.08 1fv1 s THR 130 Ca 0.00 0.36 0.00 0.00 -1.18 0.00 0.00 61.69 60.87 1fv1 s THR 130 Cb 0.00 -3.29 0.00 0.00 1.34 0.00 0.00 72.50 70.55 1fv1 s THR 130 CO 0.00 -0.10 0.00 0.61 -0.54 0.00 0.00 174.62 174.59 1fv1 n GLY 131 N 4.74 1.01 3.77 3.99 0.00 -1.26 -4.77 105.19 112.67 1fv1 n GLY 131 Ca 0.21 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 -3.77 3.23 0.20 1.61 -7.23 -1.02 -4.50 120.40 108.92 1fv1 s VAL 132 Ca 0.00 0.64 -0.08 0.00 -1.81 0.00 0.00 61.98 60.73 1fv1 s VAL 132 Cb 0.00 -3.18 -0.01 0.00 0.56 0.00 0.00 36.38 33.74 1fv1 s VAL 132 CO 0.00 -0.29 0.32 -0.94 -0.31 0.00 0.00 175.10 173.88 1fv1 s SER 133 N -2.28 0.02 0.20 4.85 1.04 -1.08 -5.01 113.70 111.44 1fv1 s SER 133 Ca 0.69 -1.02 -0.16 0.00 0.48 0.00 0.00 55.95 55.94 1fv1 s SER 133 Cb -0.22 0.48 0.02 0.00 0.10 0.00 0.00 66.02 66.40 1fv1 s SER 133 CO 0.36 -0.97 0.49 -1.83 0.98 0.00 0.00 173.24 172.26 1fv1 s GLU 134 N -4.03 1.37 0.38 4.02 -1.05 -1.26 -0.85 118.70 117.27 1fv1 s GLU 134 Ca 0.24 -0.96 0.08 0.00 -0.15 0.00 0.00 54.97 54.18 1fv1 s GLU 134 Cb 0.03 0.50 -0.02 0.00 -0.44 0.00 0.00 34.13 34.19 1fv1 s GLU 134 CO 0.06 -0.57 0.38 0.95 0.95 0.00 0.00 175.26 177.03 1fv1 s THR 135 N -3.90 3.20 0.37 1.83 -4.23 -0.39 -5.01 115.64 107.50 1fv1 s THR 135 Ca 0.12 -1.27 -0.05 0.00 -1.18 0.00 0.00 61.69 59.31 1fv1 s THR 135 Cb -0.00 -3.12 0.08 0.00 1.34 0.00 0.00 72.50 70.80 1fv1 s THR 135 CO -0.01 -0.08 0.50 1.33 -0.54 0.00 0.00 174.62 175.82 1fv1 n VAL 136 N -1.53 0.00 -2.48 2.29 0.24 -1.26 -4.61 118.33 110.99 1fv1 n VAL 136 Ca 0.02 -0.44 -0.42 0.00 -2.04 0.00 0.00 64.34 61.45 1fv1 n VAL 136 Cb 0.60 -1.67 -0.03 0.00 -1.47 0.00 0.00 33.84 31.28 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 -1.91 3.29 -0.09 6.34 0.40 -1.26 -4.64 117.98 120.10 1fv1 s PHE 137 Ca 0.29 1.28 -0.06 0.00 -0.60 0.00 0.00 56.93 57.84 1fv1 s PHE 137 Cb -0.01 -3.39 -0.04 0.00 0.51 0.00 0.00 43.02 40.09 1fv1 s PHE 137 CO 0.20 -1.18 0.15 -0.51 0.70 0.00 0.00 175.22 174.58 1fv1 s LEU 138 N 1.85 4.39 0.46 -0.37 1.43 0.47 -4.92 118.68 121.99 1fv1 s LEU 138 Ca 0.56 0.44 -0.22 0.00 -1.03 0.00 0.00 54.13 53.88 1fv1 s LEU 138 Cb -0.25 -2.20 -0.08 0.00 0.03 0.00 0.00 46.19 43.68 1fv1 s LEU 138 CO 0.24 0.37 1.08 -2.16 0.23 0.00 0.00 176.35 176.11 1fv1 s PRO 139 N -1.25 3.86 0.12 1.29 0.04 -1.26 -0.82 135.00 136.96 1fv1 s PRO 139 Ca 0.18 1.53 0.10 0.00 0.04 0.00 0.00 61.00 62.85 1fv1 s PRO 139 Cb -0.12 -2.30 -0.04 0.00 0.04 0.00 0.00 34.50 32.08 1fv1 s PRO 139 CO 0.08 -0.41 -0.24 1.03 0.04 0.00 0.00 177.00 177.49 1fv1 s ARG 140 N -2.88 1.26 0.59 4.56 0.52 -0.95 -4.81 118.95 117.24 1fv1 s ARG 140 Ca 0.64 -1.25 0.29 0.00 -0.52 0.00 0.00 55.73 54.89 1fv1 s ARG 140 Cb -0.22 -1.63 1.77 0.00 0.52 0.00 0.00 34.95 35.39 1fv1 s ARG 140 CO 0.27 0.38 2.23 0.93 0.02 0.00 0.00 175.30 179.13 1fv1 h GLU 141 N 3.99 0.00 -0.26 3.54 3.07 -1.98 0.19 114.58 123.13 1fv1 h GLU 141 Ca -0.48 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.38 1fv1 h GLU 141 Cb 1.18 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.09 1fv1 h GLU 141 CO 0.39 0.00 0.00 -0.40 -1.40 0.00 0.00 179.01 177.60 1fv1 n ASP 142 N -3.89 1.50 -0.53 1.42 5.68 -1.26 -4.90 116.55 114.57 1fv1 n ASP 142 Ca -0.02 -1.93 -0.07 0.00 -0.50 0.00 0.00 54.79 52.27 1fv1 n ASP 142 Cb 0.11 -0.17 -0.03 0.00 -1.14 0.00 0.00 41.12 39.89 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 0.29 0.00 -2.30 2.11 8.25 0.66 -5.02 115.22 119.21 1fv1 n HIS 143 Ca 0.11 0.00 -0.02 0.00 -0.26 0.00 0.00 57.72 57.55 1fv1 n HIS 143 Cb 0.25 -1.65 0.01 0.00 1.12 0.00 0.00 29.99 29.72 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 -0.79 0.00 -4.29 2.41 4.77 -1.26 -4.85 117.00 113.00 1fv1 n LEU 144 Ca -0.07 -0.16 -0.16 0.00 -0.03 0.00 0.00 56.01 55.59 1fv1 n LEU 144 Cb 0.31 -0.05 -0.10 0.00 -2.33 0.00 0.00 43.42 41.25 1fv1 n LEU 144 CO 0.11 -0.54 -0.36 -0.36 -1.33 0.00 0.00 177.39 174.91 1fv1 s PHE 145 N 0.02 1.41 0.19 -1.77 0.40 0.65 -2.23 117.98 116.65 1fv1 s PHE 145 Ca 0.05 -0.86 0.07 0.00 -0.60 0.00 0.00 56.93 55.59 1fv1 s PHE 145 Cb -0.00 -0.78 -0.05 0.00 0.51 0.00 0.00 43.02 42.70 1fv1 s PHE 145 CO 0.03 -0.00 -0.14 1.03 0.70 0.00 0.00 175.22 176.84 1fv1 s ARG 146 N -3.82 1.27 -0.10 0.44 0.52 -0.00 -1.95 118.95 115.31 1fv1 s ARG 146 Ca 0.23 -1.56 -0.30 0.00 -0.52 0.00 0.00 55.73 53.59 1fv1 s ARG 146 Cb 0.04 -1.01 0.08 0.00 0.52 0.00 0.00 34.95 34.59 1fv1 s ARG 146 CO 0.05 0.16 0.76 0.21 0.02 0.00 0.00 175.30 176.51 1fv1 s LYS 147 N -3.65 0.92 -0.04 3.54 2.20 -0.14 -0.39 119.74 122.17 1fv1 s LYS 147 Ca 0.21 0.32 0.04 0.00 -0.36 0.00 0.00 55.97 56.18 1fv1 s LYS 147 Cb -0.00 0.44 -0.00 0.00 -1.51 0.00 0.00 37.83 36.75 1fv1 s LYS 147 CO 0.05 -0.27 -0.17 -0.06 -0.36 0.00 0.00 175.35 174.55 1fv1 s PHE 148 N -0.97 1.71 0.04 4.03 0.40 -1.26 -1.32 117.98 120.61 1fv1 s PHE 148 Ca -0.07 -0.49 0.09 0.00 -0.60 0.00 0.00 56.93 55.85 1fv1 s PHE 148 Cb -0.01 -1.15 -0.03 0.00 0.51 0.00 0.00 43.02 42.34 1fv1 s PHE 148 CO 0.07 -0.16 -0.24 -1.01 0.70 0.00 0.00 175.22 174.57 1fv1 s HIS 149 N 0.03 2.14 0.05 0.36 3.76 -0.38 -1.26 115.29 119.99 1fv1 s HIS 149 Ca -0.04 -0.40 0.05 0.00 -0.15 0.00 0.00 55.06 54.53 1fv1 s HIS 149 Cb -0.11 -1.28 -0.02 0.00 1.11 0.00 0.00 32.58 32.27 1fv1 s HIS 149 CO 0.02 0.11 -0.16 0.71 -0.85 0.00 0.00 174.74 174.58 1fv1 s TYR 150 N -0.80 1.35 -0.27 1.40 2.02 -0.03 -0.61 117.35 120.42 1fv1 s TYR 150 Ca 0.10 -0.37 -0.04 0.00 -0.37 0.00 0.00 57.07 56.39 1fv1 s TYR 150 Cb -0.10 -0.80 0.09 0.00 -0.40 0.00 0.00 41.96 40.76 1fv1 s TYR 150 CO 0.02 0.06 0.12 -1.17 -1.57 0.00 0.00 175.55 173.00 1fv1 s LEU 151 N -1.24 0.66 0.39 -1.29 2.96 0.20 -2.62 118.68 117.74 1fv1 s LEU 151 Ca 0.02 -1.21 -0.26 0.00 -0.22 0.00 0.00 54.13 52.47 1fv1 s LEU 151 Cb -0.08 -0.38 -0.09 0.00 0.50 0.00 0.00 46.19 46.14 1fv1 s LEU 151 CO 0.02 -0.42 1.22 -2.16 -1.32 0.00 0.00 176.35 173.69 1fv1 s PRO 152 N 2.06 4.10 0.19 0.98 0.04 -1.26 -0.30 135.00 140.81 1fv1 s PRO 152 Ca 0.08 1.98 -0.21 0.00 0.04 0.00 0.00 61.00 62.89 1fv1 s PRO 152 Cb -0.16 -2.78 0.05 0.00 0.04 0.00 0.00 34.50 31.64 1fv1 s PRO 152 CO -0.31 -0.32 0.59 -0.59 0.04 0.00 0.00 177.00 176.41 1fv1 s PHE 153 N -1.32 -0.33 -0.40 0.56 -0.71 0.70 -4.90 117.98 111.58 1fv1 s PHE 153 Ca 0.55 0.02 -0.08 0.00 -1.04 0.00 0.00 56.93 56.39 1fv1 s PHE 153 Cb -0.34 0.53 0.08 0.00 -1.21 0.00 0.00 43.02 42.08 1fv1 s PHE 153 CO 0.44 -0.94 0.23 -1.17 -1.34 0.00 0.00 175.22 172.43 1fv1 s LEU 154 N -2.82 5.04 0.06 -1.99 2.96 -1.26 -1.04 118.68 119.62 1fv1 s LEU 154 Ca 0.05 -1.55 -0.37 0.00 -0.22 0.00 0.00 54.13 52.05 1fv1 s LEU 154 Cb -0.02 -1.94 -0.19 0.00 0.50 0.00 0.00 46.19 44.54 1fv1 s LEU 154 CO -0.06 -0.51 0.95 -2.65 -1.32 0.00 0.00 176.35 172.77 1fv1 n PRO 155 N 4.84 0.08 -3.75 0.98 -0.02 -1.26 -4.84 135.00 131.04 1fv1 n PRO 155 Ca -0.09 0.03 -0.13 0.00 -2.02 0.00 0.00 63.50 61.29 1fv1 n PRO 155 Cb 0.43 -1.42 -0.13 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 -0.22 -0.22 0.00 2.55 0.15 -1.26 -3.35 113.70 111.35 1fv1 s SER 156 Ca 0.84 0.45 0.18 0.00 0.70 0.00 0.00 55.95 58.12 1fv1 s SER 156 Cb -1.16 0.36 1.00 0.00 -1.71 0.00 0.00 66.02 64.51 1fv1 s SER 156 CO 0.56 -0.14 1.53 0.35 1.20 0.00 0.00 173.24 176.74 1fv1 n THR 157 N 3.92 0.26 0.64 6.45 -2.24 -1.26 -2.52 114.28 119.53 1fv1 n THR 157 Ca -0.23 0.06 0.07 0.00 -2.27 0.00 0.00 64.05 61.69 1fv1 n THR 157 Cb 0.54 -0.77 -0.01 0.00 -2.10 0.00 0.00 70.33 67.99 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 -1.16 1.89 -3.88 -0.78 -0.58 -1.26 -4.89 120.64 109.98 1fv1 n GLU 158 Ca 0.11 -0.65 -0.36 0.00 -0.42 0.00 0.00 57.16 55.85 1fv1 n GLU 158 Cb 0.11 -1.21 -0.06 0.00 -0.57 0.00 0.00 31.44 29.71 1fv1 n GLU 158 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 1fv1 s ASP 159 N -1.82 6.39 -0.11 1.62 1.01 -1.05 -4.99 116.67 117.72 1fv1 s ASP 159 Ca 0.11 0.43 0.01 0.00 0.71 0.00 0.00 52.55 53.81 1fv1 s ASP 159 Cb 0.11 -2.05 0.02 0.00 1.01 0.00 0.00 42.92 42.01 1fv1 s ASP 159 CO 0.39 0.35 -0.12 -0.69 0.21 0.00 0.00 175.17 175.31 1fv1 s VAL 160 N -1.15 1.32 0.07 -1.27 1.01 -1.26 -4.01 120.40 115.11 1fv1 s VAL 160 Ca 0.20 -0.51 0.05 0.00 0.00 0.00 0.00 61.98 61.72 1fv1 s VAL 160 Cb -0.12 -1.24 -0.04 0.00 0.00 0.00 0.00 36.38 34.98 1fv1 s VAL 160 CO 0.10 0.41 -0.04 -0.31 0.00 0.00 0.00 175.10 175.26 1fv1 s TYR 161 N 1.24 2.91 0.04 5.22 1.51 0.66 0.25 117.35 129.19 1fv1 s TYR 161 Ca -0.02 -0.06 0.05 0.00 -1.01 0.00 0.00 57.07 56.03 1fv1 s TYR 161 Cb -0.14 -1.53 -0.02 0.00 -0.11 0.00 0.00 41.96 40.16 1fv1 s TYR 161 CO -0.05 0.44 -0.15 -0.51 -1.11 0.00 0.00 175.55 174.18 1fv1 s ASP 162 N -2.06 1.76 -0.23 2.29 1.01 0.25 -0.99 116.67 118.70 1fv1 s ASP 162 Ca 0.22 -0.47 -0.05 0.00 0.71 0.00 0.00 52.55 52.96 1fv1 s ASP 162 Cb -0.11 -0.12 -0.01 0.00 1.01 0.00 0.00 42.92 43.69 1fv1 s ASP 162 CO 0.14 0.04 -0.01 0.00 0.21 0.00 0.00 175.17 175.56 1fv1 s ARG 164 N 1.51 3.82 -0.09 0.00 3.52 0.53 -1.40 118.95 126.84 1fv1 s ARG 164 Ca 0.06 -0.41 0.04 0.00 -0.13 0.00 0.00 55.73 55.29 1fv1 s ARG 164 Cb -0.14 -3.31 0.00 0.00 -1.56 0.00 0.00 34.95 29.93 1fv1 s ARG 164 CO -0.01 0.00 -0.21 0.08 -0.81 0.00 0.00 175.30 174.35 1fv1 s VAL 165 N 1.12 1.83 -0.08 7.11 1.01 0.47 -1.08 120.40 130.79 1fv1 s VAL 165 Ca 0.05 -0.89 0.03 0.00 0.00 0.00 0.00 61.98 61.17 1fv1 s VAL 165 Cb -0.14 -1.59 -0.02 0.00 0.00 0.00 0.00 36.38 34.63 1fv1 s VAL 165 CO 0.03 0.51 -0.17 -1.61 0.00 0.00 0.00 175.10 173.87 1fv1 s GLU 166 N 0.38 2.77 -0.25 2.72 2.02 0.22 -0.43 118.70 126.13 1fv1 s GLU 166 Ca -0.17 -0.75 -0.23 0.00 0.02 0.00 0.00 54.97 53.85 1fv1 s GLU 166 Cb -0.17 -2.40 0.07 0.00 0.10 0.00 0.00 34.13 31.73 1fv1 s GLU 166 CO 0.07 0.44 0.67 -1.58 0.02 0.00 0.00 175.26 174.89 1fv1 s HIS 167 N -0.27 -0.74 0.64 1.61 2.46 -1.26 -1.81 115.29 115.92 1fv1 s HIS 167 Ca 0.01 1.81 0.33 0.00 0.47 0.00 0.00 55.06 57.68 1fv1 s HIS 167 Cb -0.13 0.26 1.83 0.00 -0.13 0.00 0.00 32.58 34.41 1fv1 s HIS 167 CO 0.03 -0.36 2.07 -1.49 -2.47 0.00 0.00 174.74 172.52 1fv1 h TRP 168 N 5.14 0.00 -0.00 3.88 6.55 -1.96 0.11 115.95 129.67 1fv1 h TRP 168 Ca -0.29 0.00 0.00 0.00 0.95 0.00 0.00 58.89 59.55 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 0.38 0.00 -0.09 0.41 -1.05 0.00 0.00 178.44 178.10 1fv1 n GLY 169 N -1.25 -1.17 3.85 1.49 0.00 -1.26 -4.84 105.19 102.01 1fv1 n GLY 169 Ca -0.01 -0.21 -0.38 0.00 0.00 0.00 0.00 46.02 45.43 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 -2.63 4.45 0.25 0.99 1.43 0.39 -4.44 118.68 119.12 1fv1 s LEU 170 Ca 0.25 0.82 0.02 0.00 -1.03 0.00 0.00 54.13 54.19 1fv1 s LEU 170 Cb 0.20 -2.44 0.31 0.00 0.03 0.00 0.00 46.19 44.28 1fv1 s LEU 170 CO 0.50 0.35 1.63 0.44 0.23 0.00 0.00 176.35 179.49 1fv1 h ASP 171 N 4.77 0.44 -5.13 2.29 3.32 -1.88 -3.45 116.42 116.78 1fv1 h ASP 171 Ca -0.53 -0.20 -0.12 0.00 0.02 0.00 0.00 57.03 56.21 1fv1 h ASP 171 Cb 1.22 -0.12 -0.17 0.00 0.22 0.00 0.00 39.33 40.48 1fv1 h ASP 171 CO 0.60 0.81 -0.53 -1.61 -1.72 0.00 0.00 179.24 176.80 1fv1 s GLU 172 N -4.16 0.63 0.71 3.56 0.41 -1.26 -5.14 118.70 113.46 1fv1 s GLU 172 Ca -0.06 -0.88 -0.16 0.00 -0.41 0.00 0.00 54.97 53.46 1fv1 s GLU 172 Cb 0.13 0.24 0.03 0.00 -1.78 0.00 0.00 34.13 32.75 1fv1 s GLU 172 CO 0.80 -0.16 1.26 -2.14 -0.49 0.00 0.00 175.26 174.53 1fv1 s PRO 173 N -3.07 2.16 0.07 0.39 0.02 -1.26 -4.91 135.00 128.40 1fv1 s PRO 173 Ca -0.01 1.94 0.04 0.00 0.02 0.00 0.00 61.00 62.99 1fv1 s PRO 173 Cb 0.02 -1.81 -0.04 0.00 0.02 0.00 0.00 34.50 32.68 1fv1 s PRO 173 CO -0.07 -1.86 0.01 -1.17 -0.33 0.00 0.00 177.00 173.58 1fv1 s LEU 174 N -4.93 3.53 -0.07 -5.54 2.96 0.43 -4.94 118.68 110.13 1fv1 s LEU 174 Ca 0.79 -0.11 0.02 0.00 -0.22 0.00 0.00 54.13 54.61 1fv1 s LEU 174 Cb -0.34 -2.20 0.01 0.00 0.50 0.00 0.00 46.19 44.17 1fv1 s LEU 174 CO 0.44 0.20 -0.13 -0.76 -1.32 0.00 0.00 176.35 174.78 1fv1 s LEU 175 N -2.13 1.68 -0.20 -0.68 1.43 -1.26 -0.39 118.68 117.13 1fv1 s LEU 175 Ca 0.25 -0.31 0.01 0.00 -1.03 0.00 0.00 54.13 53.05 1fv1 s LEU 175 Cb -0.12 -0.86 0.04 0.00 0.03 0.00 0.00 46.19 45.28 1fv1 s LEU 175 CO 0.17 0.05 -0.14 -0.54 0.23 0.00 0.00 176.35 176.11 1fv1 s LYS 176 N 0.61 2.45 0.24 1.70 -0.14 -0.49 -4.95 119.74 119.15 1fv1 s LYS 176 Ca -0.14 -0.91 -0.19 0.00 -1.36 0.00 0.00 55.97 53.37 1fv1 s LYS 176 Cb -0.16 -2.53 -0.08 0.00 -1.68 0.00 0.00 37.83 33.38 1fv1 s LYS 176 CO 0.04 -0.36 0.73 -1.58 -0.76 0.00 0.00 175.35 173.43 1fv1 s HIS 177 N 1.31 3.62 -0.18 3.18 2.46 -1.26 -1.25 115.29 123.16 1fv1 s HIS 177 Ca 0.00 1.38 -0.15 0.00 0.47 0.00 0.00 55.06 56.76 1fv1 s HIS 177 Cb -0.15 -2.62 0.05 0.00 -0.13 0.00 0.00 32.58 29.73 1fv1 s HIS 177 CO -0.10 0.30 0.47 -0.46 -2.47 0.00 0.00 174.74 172.49 1fv1 s TRP 178 N -1.58 -0.57 0.00 3.88 -0.00 -0.16 -4.93 118.94 115.58 1fv1 s TRP 178 Ca 0.44 1.32 -0.22 0.00 -0.00 0.00 0.00 56.10 57.64 1fv1 s TRP 178 Cb -0.16 0.22 0.05 0.00 -0.00 0.00 0.00 33.47 33.58 1fv1 s TRP 178 CO 0.21 -0.29 0.49 -1.83 -0.00 0.00 0.00 176.95 175.53 1fv1 s GLU 179 N 0.60 0.93 0.01 5.86 -1.05 -1.26 -0.25 118.70 123.54 1fv1 s GLU 179 Ca -0.03 -0.10 -0.32 0.00 -0.15 0.00 0.00 54.97 54.37 1fv1 s GLU 179 Cb -0.05 0.42 -0.10 0.00 -0.44 0.00 0.00 34.13 33.97 1fv1 s GLU 179 CO -0.04 -0.30 1.93 0.34 0.95 0.00 0.00 175.26 178.14 1fv1 n PHE 180 N 0.80 2.46 0.00 4.83 -0.00 -1.26 -5.06 117.46 119.23 1fv1 n PHE 180 Ca -0.19 -0.23 0.00 0.00 -0.00 0.00 0.00 57.45 57.02 1fv1 n PHE 180 Cb 0.58 -2.75 0.00 0.00 -0.00 0.00 0.00 39.48 37.31 1fv1 n PHE 180 CO 0.00 0.00 0.00 -3.47 -0.00 0.00 0.00 176.76 173.29