#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1sfw n LEU 2 N 0.00 2.71 -0.37 0.00 0.00 -1.26 -2.06 117.00 116.02 1sfw n LEU 2 Ca 0.00 0.06 0.01 0.00 0.00 0.00 0.00 56.01 56.08 1sfw n LEU 2 Cb 0.00 -0.98 0.15 0.00 0.00 0.00 0.00 43.42 42.59 1sfw n LEU 2 CO 0.00 0.84 1.28 4.11 0.00 0.00 0.00 177.39 183.62 1sfw h TRP 3 N -0.12 1.22 -0.00 1.96 0.09 -2.03 0.25 115.95 117.33 1sfw h TRP 3 Ca -0.52 0.03 -0.11 0.00 0.09 0.00 0.00 58.89 58.37 1sfw h TRP 3 Cb 1.89 -0.41 -0.02 0.00 0.08 0.00 0.00 29.16 30.71 1sfw h TRP 3 CO 0.04 0.68 -0.54 1.96 0.09 0.00 0.00 178.44 180.67 1sfw h GLN 4 N 1.24 0.01 -0.17 0.12 4.20 -1.99 -3.09 115.11 115.43 1sfw h GLN 4 Ca 0.41 -0.01 -0.10 0.00 0.06 0.00 0.00 58.65 59.02 1sfw h GLN 4 Cb 0.06 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 27.84 1sfw h GLN 4 CO -0.14 0.55 -0.28 0.35 -0.67 0.00 0.00 178.83 178.63 1sfw h PHE 5 N 0.01 0.60 -0.89 2.96 3.04 -0.83 -3.34 116.94 118.49 1sfw h PHE 5 Ca -0.01 -0.21 0.24 0.00 3.98 0.00 0.00 57.97 61.98 1sfw h PHE 5 Cb 0.96 -0.12 -0.14 0.00 2.56 0.00 0.00 35.95 39.21 1sfw h PHE 5 CO 0.00 0.92 0.30 0.00 -2.02 0.00 0.00 178.31 177.51 1sfw h ARG 6 N 0.12 0.24 -0.97 1.11 -0.00 -0.57 -1.61 114.38 112.70 1sfw h ARG 6 Ca 0.01 -0.01 0.28 0.00 -0.50 0.00 0.00 59.98 59.76 1sfw h ARG 6 Cb 0.87 -0.06 -0.14 0.00 0.00 0.00 0.00 29.97 30.64 1sfw h ARG 6 CO 0.06 0.16 0.50 0.77 0.00 0.00 0.00 179.97 181.46 1sfw h SER 7 N 0.25 0.44 0.57 7.04 0.02 -1.65 -1.86 113.55 118.36 1sfw h SER 7 Ca 0.57 0.18 0.00 0.00 -0.84 0.00 0.00 61.79 61.70 1sfw h SER 7 Cb 1.17 0.14 0.00 0.00 0.14 0.00 0.00 62.40 63.85 1sfw h SER 7 CO -0.63 -0.08 -1.20 0.23 -1.14 0.00 0.00 176.83 174.02 1sfw n MET 8 N -5.05 0.48 0.21 3.45 2.81 -0.91 -3.44 117.12 114.67 1sfw n MET 8 Ca 0.28 0.01 0.05 0.00 -1.81 0.00 0.00 57.70 56.22 1sfw n MET 8 Cb 0.85 -1.67 0.45 0.00 -0.71 0.00 0.00 33.22 32.13 1sfw n MET 8 CO 0.00 0.00 0.00 0.82 1.51 0.00 0.00 175.97 178.30 1sfw h ILE 9 N 0.00 1.14 0.00 2.02 1.08 -0.46 0.19 117.51 121.48 1sfw h ILE 9 Ca 0.00 -0.95 -0.13 0.00 -0.39 0.00 0.00 64.86 63.39 1sfw h ILE 9 Cb 0.89 1.52 -0.02 0.00 -3.07 0.00 0.00 36.82 36.14 1sfw h ILE 9 CO 0.00 0.27 -0.62 0.11 -0.69 0.00 0.00 178.15 177.22 1sfw h LYS 10 N 0.00 0.00 -0.27 2.37 6.56 -1.59 -0.66 116.57 122.98 1sfw h LYS 10 Ca -0.00 0.00 -0.04 0.00 -1.06 0.00 0.00 60.65 59.55 1sfw h LYS 10 Cb 0.50 0.00 -0.01 0.00 -0.57 0.00 0.00 32.23 32.15 1sfw h LYS 10 CO 0.04 0.62 0.01 0.00 -2.06 0.00 0.00 179.45 178.05 1sfw h ALA 12 N 0.83 1.40 -3.32 0.00 0.00 -0.64 -3.29 119.26 114.24 1sfw h ALA 12 Ca 0.08 -0.15 -0.68 0.00 0.00 0.00 0.00 54.91 54.16 1sfw h ALA 12 Cb 0.40 -0.19 -0.37 0.00 0.00 0.00 0.00 17.79 17.63 1sfw h ALA 12 CO 0.01 0.45 -0.59 0.42 0.00 0.00 0.00 179.25 179.54 1sfw s ILE 13 N -5.25 2.97 0.21 0.00 1.09 -0.26 -4.71 121.20 115.25 1sfw s ILE 13 Ca -0.09 -2.28 -0.21 0.00 -1.10 0.00 0.00 60.65 56.97 1sfw s ILE 13 Cb 0.16 -3.07 0.16 0.00 -1.06 0.00 0.00 42.46 38.65 1sfw s ILE 13 CO 0.77 -0.68 1.56 -0.65 -0.10 0.00 0.00 174.94 175.83 1sfw h PRO 14 N 7.76 -0.05 0.00 2.79 0.11 -1.62 -3.35 132.00 137.64 1sfw h PRO 14 Ca -0.09 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.02 1sfw h PRO 14 Cb 1.02 0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.14 1sfw h PRO 14 CO 0.64 -0.03 0.00 0.41 -0.21 0.00 0.00 178.00 178.81 1sfw n GLY 15 N -1.43 0.39 0.00 -0.55 0.00 -1.26 -4.79 105.19 97.54 1sfw n GLY 15 Ca 0.07 -0.84 0.00 0.00 0.00 0.00 0.00 46.02 45.26 1sfw n GLY 15 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1sfw n SER 16 N -1.41 0.00 -4.76 1.61 2.88 -1.26 -5.13 113.62 105.55 1sfw n SER 16 Ca 0.00 0.00 -0.41 0.00 -1.33 0.00 0.00 58.87 57.13 1sfw n SER 16 Cb 0.00 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.44 1sfw n SER 16 CO 0.00 0.00 0.00 -1.38 -1.23 0.00 0.00 175.04 172.43 1sfw s HIS 17 N 2.13 3.03 0.00 0.66 0.00 -1.26 -4.76 115.29 115.09 1sfw s HIS 17 Ca 0.00 1.33 0.00 0.00 -3.00 0.00 0.00 55.06 53.39 1sfw s HIS 17 Cb 0.00 -3.71 0.00 0.00 -4.00 0.00 0.00 32.58 24.87 1sfw s HIS 17 CO 0.00 -2.03 0.36 -0.35 -1.00 0.00 0.00 174.74 171.71 1sfw n PRO 18 N 1.13 0.00 -0.18 -0.38 -0.04 -1.26 -4.50 135.00 129.76 1sfw n PRO 18 Ca 0.01 0.26 -0.08 0.00 -0.04 0.00 0.00 63.50 63.65 1sfw n PRO 18 Cb 0.41 -1.00 0.01 0.00 -0.04 0.00 0.00 33.50 32.89 1sfw n PRO 18 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 1sfw h LEU 19 N 0.00 0.73 0.00 1.53 3.38 -1.95 -3.36 115.31 115.64 1sfw h LEU 19 Ca 0.00 -0.19 0.00 0.00 0.09 0.00 0.00 57.88 57.78 1sfw h LEU 19 Cb 0.00 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 40.56 1sfw h LEU 19 CO 0.00 0.72 0.00 0.23 0.09 0.00 0.00 178.44 179.48 1sfw n MET 20 N -4.51 0.18 0.00 1.13 2.81 -1.26 0.15 117.12 115.62 1sfw n MET 20 Ca 0.02 0.16 0.08 0.00 -1.81 0.00 0.00 57.70 56.15 1sfw n MET 20 Cb 0.18 -1.50 0.43 0.00 -0.71 0.00 0.00 33.22 31.62 1sfw n MET 20 CO 0.00 0.00 0.00 -3.47 1.51 0.00 0.00 175.97 174.01 1sfw n ASP 21 N -1.30 0.00 0.00 7.83 2.03 -1.26 -4.43 116.55 119.42 1sfw n ASP 21 Ca 0.06 -0.31 0.00 0.00 0.52 0.00 0.00 54.79 55.06 1sfw n ASP 21 Cb 0.12 -0.09 0.00 0.00 -0.72 0.00 0.00 41.12 40.43 1sfw n ASP 21 CO 0.00 0.00 0.00 0.49 -1.92 0.00 0.00 177.20 175.77 1sfw n PHE 22 N -1.09 0.00 -0.28 -0.67 3.01 0.40 -4.59 117.46 114.24 1sfw n PHE 22 Ca 0.10 0.00 0.07 0.00 1.01 0.00 0.00 57.45 58.63 1sfw n PHE 22 Cb 0.07 0.00 0.18 0.00 -0.01 0.00 0.00 39.48 39.72 1sfw n PHE 22 CO 0.00 0.00 0.00 -0.97 1.01 0.00 0.00 176.76 176.80 1sfw h ASN 23 N 0.00 -0.45 0.17 4.37 -1.24 -0.02 -1.15 115.58 117.26 1sfw h ASN 23 Ca 0.00 0.22 -0.35 0.00 0.71 0.00 0.00 56.30 56.88 1sfw h ASN 23 Cb 0.00 0.41 -0.05 0.00 0.73 0.00 0.00 38.32 39.40 1sfw h ASN 23 CO 0.00 -0.23 -2.13 0.59 -1.29 0.00 0.00 177.43 174.37 1sfw n ASN 24 N -5.41 1.10 -3.87 1.15 4.13 -1.26 -2.62 115.26 108.48 1sfw n ASN 24 Ca 0.16 0.13 -0.46 0.00 1.68 0.00 0.00 54.58 56.09 1sfw n ASN 24 Cb 0.53 0.02 -0.12 0.00 -1.54 0.00 0.00 39.78 38.67 1sfw n ASN 24 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1sfw n TYR 25 N -3.09 0.80 0.00 3.10 4.19 -0.97 -3.77 117.16 117.41 1sfw n TYR 25 Ca -0.31 0.53 0.00 0.00 3.31 0.00 0.00 57.90 61.43 1sfw n TYR 25 Cb 1.07 -2.07 0.00 0.00 0.49 0.00 0.00 39.34 38.83 1sfw n TYR 25 CO 0.00 0.00 0.00 0.41 0.91 0.00 0.00 176.86 178.18 1sfw n GLY 26 N 6.27 1.78 0.00 2.98 0.00 -1.26 -3.01 105.19 111.96 1sfw n GLY 26 Ca 0.53 0.12 -0.00 0.00 0.00 0.00 0.00 46.02 46.67 1sfw n GLY 26 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1sfw n TYR 28 N -1.87 0.00 0.00 0.00 0.18 -1.16 -3.58 117.16 110.73 1sfw n TYR 28 Ca -0.01 0.00 0.00 0.00 1.88 0.00 0.00 57.90 59.77 1sfw n TYR 28 Cb 0.36 0.00 0.00 0.00 -0.38 0.00 0.00 39.34 39.32 1sfw n TYR 28 CO 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 176.86 174.78 1sfw h GLY 30 N 0.00 0.33 0.00 0.00 0.00 -1.83 -3.43 103.07 98.14 1sfw h GLY 30 Ca 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 47.33 47.11 1sfw h GLY 30 CO 0.00 0.20 -0.01 -0.10 0.00 0.00 0.00 176.54 176.63 1sfw n LEU 31 N -4.77 0.03 0.00 3.11 7.94 -1.06 -4.97 117.00 117.29 1sfw n LEU 31 Ca -0.04 0.01 0.00 0.00 -1.11 0.00 0.00 56.01 54.86 1sfw n LEU 31 Cb 0.18 -0.42 0.00 0.00 0.53 0.00 0.00 43.42 43.71 1sfw n LEU 31 CO 0.36 -0.50 0.00 0.61 -1.11 0.00 0.00 177.39 176.75 1sfw n GLY 32 N 1.84 -1.18 0.00 -3.96 0.00 -0.62 -5.01 105.19 96.27 1sfw n GLY 32 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1sfw n GLY 32 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1sfw n GLY 33 N 0.90 -1.50 3.48 -0.02 0.00 -1.23 -4.98 105.19 101.85 1sfw n GLY 33 Ca 0.00 -1.23 -0.17 0.00 0.00 0.00 0.00 46.02 44.62 1sfw n GLY 33 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1sfw s SER 34 N -1.57 -0.60 0.00 1.61 0.15 -1.24 -4.82 113.70 107.23 1sfw s SER 34 Ca 0.00 0.58 0.00 0.00 0.70 0.00 0.00 55.95 57.23 1sfw s SER 34 Cb 0.00 0.52 0.00 0.00 -1.71 0.00 0.00 66.02 64.83 1sfw s SER 34 CO 0.00 -0.63 0.00 0.61 1.20 0.00 0.00 173.24 174.42 1sfw n GLY 35 N 0.81 0.82 3.20 9.45 0.00 -1.26 -4.99 105.19 113.22 1sfw n GLY 35 Ca -0.19 -0.71 -0.12 0.00 0.00 0.00 0.00 46.02 45.00 1sfw n GLY 35 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1sfw s THR 36 N 0.00 0.60 0.00 2.61 -4.23 -1.26 -5.06 115.64 108.29 1sfw s THR 36 Ca 0.00 -1.95 0.00 0.00 -1.18 0.00 0.00 61.69 58.56 1sfw s THR 36 Cb 0.00 -1.94 0.00 0.00 1.34 0.00 0.00 72.50 71.90 1sfw s THR 36 CO 0.00 -0.63 0.00 -0.81 -0.54 0.00 0.00 174.62 172.64 1sfw n PRO 37 N -0.14 2.79 0.09 3.99 -0.04 -1.26 -4.74 135.00 135.69 1sfw n PRO 37 Ca -0.09 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.37 1sfw n PRO 37 Cb 0.62 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.08 1sfw n PRO 37 CO 0.00 0.00 0.00 1.33 -0.04 0.00 0.00 175.50 176.79 1sfw n VAL 38 N 0.00 0.47 -2.53 0.52 0.24 -1.26 -4.85 118.33 110.93 1sfw n VAL 38 Ca 0.00 0.16 -0.27 0.00 -2.04 0.00 0.00 64.34 62.19 1sfw n VAL 38 Cb 0.00 -0.97 0.02 0.00 -1.47 0.00 0.00 33.84 31.42 1sfw n VAL 38 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 1sfw s ASP 39 N -5.38 5.87 0.22 -1.34 2.15 -1.26 -4.95 116.67 111.97 1sfw s ASP 39 Ca 0.00 0.76 -0.08 0.00 0.43 0.00 0.00 52.55 53.66 1sfw s ASP 39 Cb 0.00 -1.90 0.35 0.00 -0.30 0.00 0.00 42.92 41.07 1sfw s ASP 39 CO 0.00 -0.85 1.70 -0.08 -0.17 0.00 0.00 175.17 175.77 1sfw h GLU 40 N 0.02 0.26 -0.22 4.34 4.57 -1.98 -1.99 114.58 119.58 1sfw h GLU 40 Ca -0.46 -0.02 0.00 0.00 -1.18 0.00 0.00 59.36 57.70 1sfw h GLU 40 Cb 1.24 -0.06 -0.01 0.00 -0.16 0.00 0.00 28.75 29.76 1sfw h GLU 40 CO 0.61 0.17 0.13 1.25 -1.18 0.00 0.00 179.01 179.99 1sfw h LEU 41 N 0.26 0.25 -0.10 1.64 7.12 -1.92 -2.38 115.31 120.18 1sfw h LEU 41 Ca 0.35 -0.01 0.00 0.00 0.13 0.00 0.00 57.88 58.35 1sfw h LEU 41 Cb 0.55 -0.06 0.00 0.00 -0.53 0.00 0.00 40.66 40.62 1sfw h LEU 41 CO -0.44 0.19 0.00 -0.78 -0.13 0.00 0.00 178.44 177.28 1sfw h ASP 42 N 0.30 0.00 -0.28 1.25 3.58 -1.82 -3.34 116.42 116.10 1sfw h ASP 42 Ca 0.08 0.00 -0.17 0.00 0.42 0.00 0.00 57.03 57.36 1sfw h ASP 42 Cb -0.02 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 41.03 1sfw h ASP 42 CO -0.02 0.00 -0.47 0.03 -2.88 0.00 0.00 179.24 175.91 1sfw h ARG 43 N 0.00 0.85 -0.15 0.28 2.47 -0.82 -2.12 114.38 114.89 1sfw h ARG 43 Ca 0.00 -0.49 0.04 0.00 -1.26 0.00 0.00 59.98 58.27 1sfw h ARG 43 Cb 0.71 0.04 -0.01 0.00 -1.65 0.00 0.00 29.97 29.06 1sfw h ARG 43 CO 0.00 1.13 0.26 0.00 0.56 0.00 0.00 179.97 181.92 1sfw h GLU 46 N 0.00 0.62 0.00 0.00 4.81 -0.59 -3.41 114.58 116.01 1sfw h GLU 46 Ca 0.00 -0.09 0.00 0.00 -0.13 0.00 0.00 59.36 59.14 1sfw h GLU 46 Cb 0.83 -0.11 0.00 0.00 0.63 0.00 0.00 28.75 30.10 1sfw h GLU 46 CO 0.00 0.53 0.00 2.41 -0.73 0.00 0.00 179.01 181.22 1sfw n THR 47 N -4.67 0.00 -0.79 0.32 -1.04 -0.83 -2.68 114.28 104.59 1sfw n THR 47 Ca 0.01 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.02 1sfw n THR 47 Cb 0.11 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.62 1sfw n THR 47 CO 0.00 0.00 0.00 1.57 -0.64 0.00 0.00 175.07 176.00 1sfw n HIS 48 N 0.00 0.00 0.00 -1.42 -0.00 0.68 -2.52 115.22 111.96 1sfw n HIS 48 Ca 0.00 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.18 1sfw n HIS 48 Cb 0.00 0.00 0.00 0.00 -0.12 0.00 0.00 29.99 29.87 1sfw n HIS 48 CO 0.00 0.00 0.00 -0.25 0.46 0.00 0.00 176.34 176.55 1sfw n ASP 49 N 0.19 0.00 0.17 0.26 8.00 -1.26 -4.73 116.55 119.18 1sfw n ASP 49 Ca 0.00 0.00 0.06 0.00 0.71 0.00 0.00 54.79 55.56 1sfw n ASP 49 Cb 0.00 0.00 0.14 0.00 -0.02 0.00 0.00 41.12 41.24 1sfw n ASP 49 CO 0.00 0.00 0.00 0.78 -0.39 0.00 0.00 177.20 177.59 1sfw h ASN 50 N 0.00 0.00 0.49 -2.24 2.35 -1.27 -2.74 115.58 112.18 1sfw h ASN 50 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1sfw h ASN 50 Cb 0.00 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.37 1sfw h ASN 50 CO 0.00 0.33 -0.62 0.00 -1.65 0.00 0.00 177.43 175.49 1sfw h TYR 52 N 0.00 0.43 -0.93 0.00 3.20 -1.82 -3.32 116.97 114.54 1sfw h TYR 52 Ca 0.00 -0.31 0.16 0.00 3.14 0.00 0.00 58.73 61.71 1sfw h TYR 52 Cb 0.56 -0.02 -0.16 0.00 1.54 0.00 0.00 36.73 38.65 1sfw h TYR 52 CO 0.00 1.40 -0.34 0.07 -1.64 0.00 0.00 178.16 177.65 1sfw h ARG 53 N -0.43 -0.02 0.00 1.82 -0.00 -1.77 -3.37 114.38 110.61 1sfw h ARG 53 Ca -0.21 0.00 0.00 0.00 -0.00 0.00 0.00 59.98 59.77 1sfw h ARG 53 Cb 1.63 0.00 0.00 0.00 -0.00 0.00 0.00 29.97 31.60 1sfw h ARG 53 CO 0.08 -0.01 0.00 -3.47 -0.00 0.00 0.00 179.97 176.57 1sfw n ASP 54 N -5.50 0.00 -0.32 0.08 2.03 -1.25 -0.38 116.55 111.21 1sfw n ASP 54 Ca 0.11 0.04 0.15 0.00 0.52 0.00 0.00 54.79 55.61 1sfw n ASP 54 Cb 0.41 -0.20 0.34 0.00 -0.72 0.00 0.00 41.12 40.96 1sfw n ASP 54 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1sfw h ALA 55 N 2.42 1.55 -1.03 -1.67 0.00 -1.84 0.71 119.26 119.40 1sfw h ALA 55 Ca 0.00 0.17 0.26 0.00 0.00 0.00 0.00 54.91 55.34 1sfw h ALA 55 Cb 0.05 0.15 -0.12 0.00 0.00 0.00 0.00 17.79 17.87 1sfw h ALA 55 CO 0.00 -0.38 0.63 1.57 0.00 0.00 0.00 179.25 181.07 1sfw h LYS 56 N 0.40 0.47 0.00 0.00 2.10 -0.93 -3.09 116.57 115.52 1sfw h LYS 56 Ca 0.60 -0.03 0.00 0.00 -2.00 0.00 0.00 60.65 59.22 1sfw h LYS 56 Cb 1.18 -0.11 0.00 0.00 -0.90 0.00 0.00 32.23 32.41 1sfw h LYS 56 CO -0.54 0.31 -1.35 -1.71 -2.00 0.00 0.00 179.45 174.15 1sfw n ASN 57 N -4.80 0.50 -3.54 7.07 5.15 -0.80 -2.93 115.26 115.92 1sfw n ASN 57 Ca 0.27 -0.28 -0.37 0.00 -0.60 0.00 0.00 54.58 53.60 1sfw n ASN 57 Cb 0.83 1.23 -0.02 0.00 -0.53 0.00 0.00 39.78 41.30 1sfw n ASN 57 CO 0.00 0.00 0.00 -0.11 1.40 0.00 0.00 177.26 178.55 1sfw n LEU 58 N -2.01 -1.56 -0.20 1.20 7.94 0.18 -4.63 117.00 117.92 1sfw n LEU 58 Ca 0.00 0.81 0.16 0.00 -1.11 0.00 0.00 56.01 55.88 1sfw n LEU 58 Cb 0.47 -0.75 0.49 0.00 0.53 0.00 0.00 43.42 44.16 1sfw n LEU 58 CO 0.43 -2.83 1.22 0.44 -1.11 0.00 0.00 177.39 175.53 1sfw h ASP 59 N 0.59 0.42 0.00 1.96 3.32 -1.92 -2.75 116.42 118.03 1sfw h ASP 59 Ca -0.26 0.03 -0.20 0.00 0.02 0.00 0.00 57.03 56.62 1sfw h ASP 59 Cb 1.17 -0.05 -0.04 0.00 0.22 0.00 0.00 39.33 40.63 1sfw h ASP 59 CO 0.43 0.20 -1.99 -0.24 -1.72 0.00 0.00 179.24 175.92 1sfw n SER 60 N -4.50 1.11 -3.66 6.45 2.88 -1.26 -4.79 113.62 109.86 1sfw n SER 60 Ca 0.16 0.00 -0.28 0.00 -1.33 0.00 0.00 58.87 57.42 1sfw n SER 60 Cb 0.58 1.16 -0.12 0.00 -0.75 0.00 0.00 64.21 65.09 1sfw n SER 60 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1sfw s LYS 62 N -0.17 3.30 0.00 0.00 -2.85 -1.05 -2.37 119.74 116.61 1sfw s LYS 62 Ca 0.24 -1.69 0.00 0.00 -1.00 0.00 0.00 55.97 53.52 1sfw s LYS 62 Cb -0.11 -4.45 0.00 0.00 -2.06 0.00 0.00 37.83 31.21 1sfw s LYS 62 CO -0.10 -1.53 0.00 1.97 0.10 0.00 0.00 175.35 175.78 1sfw n PHE 63 N 5.82 0.00 0.11 1.78 -1.74 -1.15 -5.04 117.46 117.24 1sfw n PHE 63 Ca 0.03 0.00 0.00 0.00 -0.56 0.00 0.00 57.45 56.92 1sfw n PHE 63 Cb 0.45 0.00 0.00 0.00 1.52 0.00 0.00 39.48 41.45 1sfw n PHE 63 CO 0.00 0.00 0.00 1.47 -0.56 0.00 0.00 176.76 177.67 1sfw n LEU 64 N 0.00 0.06 -3.64 5.98 -0.00 -1.24 -4.93 117.00 113.23 1sfw n LEU 64 Ca 0.00 0.35 -0.10 0.00 -0.00 0.00 0.00 56.01 56.26 1sfw n LEU 64 Cb 0.00 0.22 -0.07 0.00 -0.00 0.00 0.00 43.42 43.57 1sfw n LEU 64 CO 0.00 -0.72 0.55 -0.69 -0.00 0.00 0.00 177.39 176.53 1sfw s VAL 65 N -2.00 0.00 -0.11 1.47 1.01 -1.26 -4.80 120.40 114.71 1sfw s VAL 65 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 61.98 61.96 1sfw s VAL 65 Cb 0.00 -1.00 -0.01 0.00 0.00 0.00 0.00 36.38 35.37 1sfw s VAL 65 CO 0.00 0.00 0.01 0.44 0.00 0.00 0.00 175.10 175.55 1sfw h ASP 66 N 5.10 0.00 0.00 3.32 5.19 -1.91 -3.48 116.42 124.64 1sfw h ASP 66 Ca -0.29 -0.03 0.00 0.00 -0.62 0.00 0.00 57.03 56.09 1sfw h ASP 66 Cb 1.18 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.69 1sfw h ASP 66 CO 0.10 0.55 0.00 -3.20 -3.12 0.00 0.00 179.24 173.57 1sfw n ASN 67 N -4.76 0.00 0.00 6.45 5.15 -1.26 -4.82 115.26 116.02 1sfw n ASN 67 Ca -0.01 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.97 1sfw n ASN 67 Cb 0.05 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.30 1sfw n ASN 67 CO 0.00 0.00 0.00 -0.81 1.40 0.00 0.00 177.26 177.85 1sfw n PRO 68 N 0.00 0.00 0.00 1.20 -0.04 -1.26 -5.05 135.00 129.85 1sfw n PRO 68 Ca 0.00 0.40 0.00 0.00 -0.04 0.00 0.00 63.50 63.86 1sfw n PRO 68 Cb 0.00 -0.95 0.00 0.00 -0.04 0.00 0.00 33.50 32.51 1sfw n PRO 68 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1sfw n TYR 69 N -1.71 0.00 -1.74 0.54 4.01 -1.26 -5.06 117.16 111.95 1sfw n TYR 69 Ca 0.00 0.00 -0.01 0.00 -0.16 0.00 0.00 57.90 57.73 1sfw n TYR 69 Cb 0.00 0.00 -0.01 0.00 -0.31 0.00 0.00 39.34 39.02 1sfw n TYR 69 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65 1sfw n THR 70 N 0.00 -4.86 0.00 -0.72 -2.24 -1.26 -4.88 114.28 100.32 1sfw n THR 70 Ca 0.00 0.54 0.00 0.00 -2.27 0.00 0.00 64.05 62.32 1sfw n THR 70 Cb 0.00 -4.27 0.00 0.00 -2.10 0.00 0.00 70.33 63.96 1sfw n THR 70 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1sfw n GLU 71 N 0.31 0.00 -3.88 -0.78 -0.58 -1.26 -4.77 120.64 109.68 1sfw n GLU 71 Ca -0.07 0.00 -0.07 0.00 -0.42 0.00 0.00 57.16 56.60 1sfw n GLU 71 Cb 0.11 0.00 -0.02 0.00 -0.57 0.00 0.00 31.44 30.96 1sfw n GLU 71 CO 0.00 0.00 0.00 0.45 -0.48 0.00 0.00 177.13 177.10 1sfw s SER 72 N 0.26 -0.21 0.00 1.62 0.15 -1.26 -4.49 113.70 109.77 1sfw s SER 72 Ca 0.00 -0.70 0.00 0.00 0.70 0.00 0.00 55.95 55.95 1sfw s SER 72 Cb 0.00 0.72 0.00 0.00 -1.71 0.00 0.00 66.02 65.03 1sfw s SER 72 CO 0.00 -1.35 0.00 -1.22 1.20 0.00 0.00 173.24 171.87 1sfw n TYR 73 N -0.46 0.00 -2.84 3.44 4.01 -1.26 -3.07 117.16 116.99 1sfw n TYR 73 Ca -0.04 0.00 0.01 0.00 -0.16 0.00 0.00 57.90 57.71 1sfw n TYR 73 Cb 0.59 0.00 0.01 0.00 -0.31 0.00 0.00 39.34 39.63 1sfw n TYR 73 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 1sfw s SER 74 N 0.00 -0.59 0.00 7.72 0.15 -0.94 -4.93 113.70 115.11 1sfw s SER 74 Ca 0.00 -0.36 0.00 0.00 0.70 0.00 0.00 55.95 56.29 1sfw s SER 74 Cb 0.00 0.76 0.00 0.00 -1.71 0.00 0.00 66.02 65.07 1sfw s SER 74 CO 0.00 -0.06 0.00 0.00 1.20 0.00 0.00 173.24 174.38 1sfw n TYR 75 N 3.67 0.00 -1.61 3.44 4.11 -1.16 -3.48 117.16 122.13 1sfw n TYR 75 Ca 0.08 0.00 0.00 0.00 -0.00 0.00 0.00 57.90 57.98 1sfw n TYR 75 Cb 0.62 0.00 0.00 0.00 -0.00 0.00 0.00 39.34 39.96 1sfw n TYR 75 CO 0.00 0.00 0.00 0.43 -0.00 0.00 0.00 176.86 177.29 1sfw n SER 76 N 0.00 0.00 -3.65 9.48 7.64 -1.26 -4.97 113.62 120.86 1sfw n SER 76 Ca 0.00 0.00 -0.02 0.00 1.01 0.00 0.00 58.87 59.86 1sfw n SER 76 Cb 0.00 0.00 -0.07 0.00 -1.01 0.00 0.00 64.21 63.13 1sfw n SER 76 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1sfw n SER 78 N 2.34 0.00 -0.09 0.00 7.64 0.22 -4.86 113.62 118.86 1sfw n SER 78 Ca -0.14 0.00 -0.13 0.00 1.01 0.00 0.00 58.87 59.61 1sfw n SER 78 Cb 0.57 0.00 -0.06 0.00 -1.01 0.00 0.00 64.21 63.70 1sfw n SER 78 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1sfw n ASN 79 N 0.00 1.84 0.00 6.43 3.02 -1.26 -4.91 115.26 120.38 1sfw n ASN 79 Ca 0.00 0.53 0.00 0.00 -0.03 0.00 0.00 54.58 55.08 1sfw n ASN 79 Cb 0.00 -0.91 0.00 0.00 -0.61 0.00 0.00 39.78 38.26 1sfw n ASN 79 CO 0.00 0.00 0.00 1.07 -2.62 0.00 0.00 177.26 175.71 1sfw n THR 80 N -4.52 0.00 0.00 3.41 5.66 -1.26 -5.00 114.28 112.56 1sfw n THR 80 Ca -0.20 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.80 1sfw n THR 80 Cb 0.47 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.25 1sfw n THR 80 CO 0.00 0.00 0.00 -1.84 -3.05 0.00 0.00 175.07 170.18 1sfw n GLU 81 N 0.00 0.00 0.00 1.09 0.28 -1.26 -4.69 120.64 116.06 1sfw n GLU 81 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.00 1sfw n GLU 81 Cb 0.00 0.00 0.00 0.00 1.43 0.00 0.00 31.44 32.87 1sfw n GLU 81 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 177.13 176.08 1sfw n ILE 82 N -0.63 0.00 0.00 3.84 -0.00 -1.26 -0.61 119.36 120.70 1sfw n ILE 82 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 62.75 62.75 1sfw n ILE 82 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 39.64 39.64 1sfw n ILE 82 CO 0.00 0.00 0.00 1.07 -0.00 0.00 0.00 176.55 177.62 1sfw n THR 83 N 0.00 0.00 0.00 1.39 5.66 -1.26 -4.61 114.28 115.46 1sfw n THR 83 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 1sfw n THR 83 Cb 0.00 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 68.78 1sfw n THR 83 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1sfw n ASN 85 N -0.11 2.32 -2.88 0.00 2.04 -1.23 -2.21 115.26 113.20 1sfw n ASN 85 Ca 0.00 -1.81 -0.12 0.00 -0.44 0.00 0.00 54.58 52.20 1sfw n ASN 85 Cb 0.00 0.10 0.02 0.00 -2.53 0.00 0.00 39.78 37.37 1sfw n ASN 85 CO 0.00 0.00 0.00 -1.20 -0.44 0.00 0.00 177.26 175.62 1sfw n SER 86 N -1.32 0.49 0.24 0.53 7.64 -1.23 -4.79 113.62 115.18 1sfw n SER 86 Ca -0.06 -2.90 0.00 0.00 1.01 0.00 0.00 58.87 56.92 1sfw n SER 86 Cb 0.24 -0.16 0.00 0.00 -1.01 0.00 0.00 64.21 63.28 1sfw n SER 86 CO 0.00 0.00 0.00 2.29 -3.01 0.00 0.00 175.04 174.32 1sfw n LYS 87 N 0.06 0.00 -0.77 1.43 0.00 -1.26 -5.11 118.16 112.51 1sfw n LYS 87 Ca 0.14 0.00 0.10 0.00 -0.00 0.00 0.00 58.31 58.55 1sfw n LYS 87 Cb 0.75 0.00 -0.03 0.00 -0.00 0.00 0.00 35.03 35.75 1sfw n LYS 87 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.40 177.67 1sfw n ASN 88 N -3.48 -4.57 0.00 -5.58 6.94 -1.26 -5.08 115.26 102.23 1sfw n ASN 88 Ca 0.00 0.34 0.00 0.00 -0.02 0.00 0.00 54.58 54.90 1sfw n ASN 88 Cb 0.00 -2.35 0.00 0.00 -2.36 0.00 0.00 39.78 35.07 1sfw n ASN 88 CO 0.00 0.00 0.00 -3.20 -1.03 0.00 0.00 177.26 173.03 1sfw n ASN 89 N -2.85 -0.13 -0.36 0.53 2.85 -1.26 -4.82 115.26 109.22 1sfw n ASN 89 Ca 0.00 0.00 0.04 0.00 -0.11 0.00 0.00 54.58 54.52 1sfw n ASN 89 Cb 0.35 0.07 0.21 0.00 1.24 0.00 0.00 39.78 41.65 1sfw n ASN 89 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1sfw h ALA 90 N 0.00 1.46 -0.17 5.20 0.00 -1.93 -1.78 119.26 122.04 1sfw h ALA 90 Ca 0.00 -0.01 0.03 0.00 0.00 0.00 0.00 54.91 54.93 1sfw h ALA 90 Cb 0.00 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.49 1sfw h ALA 90 CO 0.00 0.36 -0.06 0.00 0.00 0.00 0.00 179.25 179.54 1sfw n GLU 92 N -4.25 0.49 0.19 0.00 0.00 -0.93 -4.59 120.64 111.55 1sfw n GLU 92 Ca 0.02 0.38 0.04 0.00 0.00 0.00 0.00 57.16 57.60 1sfw n GLU 92 Cb 0.07 -1.57 0.36 0.00 0.00 0.00 0.00 31.44 30.30 1sfw n GLU 92 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1sfw h ALA 93 N -1.00 1.15 -0.48 -1.84 0.00 -1.29 -1.48 119.26 114.32 1sfw h ALA 93 Ca 0.00 -0.35 -0.09 0.00 0.00 0.00 0.00 54.91 54.47 1sfw h ALA 93 Cb 0.73 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.44 1sfw h ALA 93 CO 0.00 0.48 -0.07 0.35 0.00 0.00 0.00 179.25 180.01 1sfw h PHE 94 N 0.00 0.93 -0.12 0.00 3.04 -0.96 -1.99 116.94 117.84 1sfw h PHE 94 Ca -0.00 -0.16 -0.13 0.00 3.98 0.00 0.00 57.97 61.65 1sfw h PHE 94 Cb 0.79 -0.24 0.00 0.00 2.56 0.00 0.00 35.95 39.06 1sfw h PHE 94 CO 0.00 0.88 -0.43 0.82 -2.02 0.00 0.00 178.31 177.56 1sfw h ILE 95 N 0.77 1.37 -0.94 1.41 5.03 -1.56 -2.55 117.51 121.04 1sfw h ILE 95 Ca 0.13 -1.75 0.22 0.00 -0.12 0.00 0.00 64.86 63.35 1sfw h ILE 95 Cb 0.57 2.15 -0.07 0.00 -3.03 0.00 0.00 36.82 36.43 1sfw h ILE 95 CO 0.03 0.52 0.62 0.00 -0.68 0.00 0.00 178.15 178.65 1sfw h ASN 97 N 0.36 0.50 -0.69 0.00 -1.24 -1.13 -1.11 115.58 112.27 1sfw h ASN 97 Ca 0.49 -0.64 -0.07 0.00 0.71 0.00 0.00 56.30 56.80 1sfw h ASN 97 Cb 1.31 -0.15 -0.03 0.00 0.73 0.00 0.00 38.32 40.19 1sfw h ASN 97 CO -0.18 1.05 0.16 0.00 -1.29 0.00 0.00 177.43 177.17 1sfw h ASP 99 N 1.04 -0.58 -0.92 0.00 3.32 -1.39 -1.69 116.42 116.20 1sfw h ASP 99 Ca 0.22 0.04 0.08 0.00 0.02 0.00 0.00 57.03 57.39 1sfw h ASP 99 Cb 0.38 0.18 -0.07 0.00 0.22 0.00 0.00 39.33 40.03 1sfw h ASP 99 CO 0.00 -0.33 0.57 0.03 -1.72 0.00 0.00 179.24 177.79 1sfw h ARG 100 N -0.52 0.96 0.00 3.56 2.47 -1.29 0.32 114.38 119.87 1sfw h ARG 100 Ca -0.04 -0.06 0.00 0.00 -1.26 0.00 0.00 59.98 58.62 1sfw h ARG 100 Cb 0.42 -0.22 0.00 0.00 -1.65 0.00 0.00 29.97 28.53 1sfw h ARG 100 CO 0.02 0.63 0.00 0.09 0.56 0.00 0.00 179.97 181.28 1sfw n ASN 101 N -4.62 0.00 0.05 7.04 4.13 -0.63 -1.73 115.26 119.50 1sfw n ASN 101 Ca 0.15 0.40 0.00 0.00 1.68 0.00 0.00 54.58 56.81 1sfw n ASN 101 Cb 0.24 -0.45 -0.07 0.00 -1.54 0.00 0.00 39.78 37.96 1sfw n ASN 101 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1sfw h ALA 102 N 2.71 0.65 -0.47 5.41 0.00 -0.22 -2.39 119.26 124.94 1sfw h ALA 102 Ca 0.00 -0.78 0.09 0.00 0.00 0.00 0.00 54.91 54.22 1sfw h ALA 102 Cb 0.29 0.23 -0.03 0.00 0.00 0.00 0.00 17.79 18.28 1sfw h ALA 102 CO 0.00 0.87 0.33 0.00 0.00 0.00 0.00 179.25 180.44 1sfw h ALA 103 N 1.44 2.13 -0.20 0.00 0.00 0.45 0.17 119.26 123.25 1sfw h ALA 103 Ca -0.14 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.76 1sfw h ALA 103 Cb 1.55 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.30 1sfw h ALA 103 CO 0.05 -0.24 0.00 -0.89 0.00 0.00 0.00 179.25 178.17 1sfw n ILE 104 N -4.46 0.00 -0.25 0.00 -0.00 -1.03 -0.90 119.36 112.72 1sfw n ILE 104 Ca 0.07 1.04 0.30 0.00 -0.00 0.00 0.00 62.75 64.17 1sfw n ILE 104 Cb 0.37 -2.02 0.71 0.00 -0.00 0.00 0.00 39.64 38.71 1sfw n ILE 104 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 1sfw h PHE 106 N 0.05 0.08 -0.02 0.00 0.04 -0.77 -2.03 116.94 114.29 1sfw h PHE 106 Ca 0.49 -0.06 -0.12 0.00 2.80 0.00 0.00 57.97 61.08 1sfw h PHE 106 Cb 1.88 -0.00 -0.02 0.00 2.20 0.00 0.00 35.95 40.01 1sfw h PHE 106 CO -0.00 1.09 -0.56 1.03 -0.60 0.00 0.00 178.31 179.27 1sfw h SER 107 N 0.01 0.06 0.00 2.17 0.87 0.40 -3.45 113.55 113.62 1sfw h SER 107 Ca -0.21 -0.03 0.00 0.00 -1.23 0.00 0.00 61.79 60.32 1sfw h SER 107 Cb 1.95 -0.02 0.00 0.00 -0.44 0.00 0.00 62.40 63.89 1sfw h SER 107 CO 0.11 0.61 0.00 2.29 -0.53 0.00 0.00 176.83 179.30 1sfw n LYS 108 N -3.88 0.00 -0.44 2.24 -0.00 0.01 -4.94 118.16 111.14 1sfw n LYS 108 Ca -0.02 -0.16 -0.18 0.00 -0.00 0.00 0.00 58.31 57.95 1sfw n LYS 108 Cb 0.57 -0.20 0.17 0.00 -0.00 0.00 0.00 35.03 35.58 1sfw n LYS 108 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1sfw n ALA 109 N 0.00 -1.09 -1.41 0.58 0.00 -0.76 -4.80 120.51 113.03 1sfw n ALA 109 Ca 0.00 -1.17 -0.39 0.00 0.00 0.00 0.00 53.44 51.88 1sfw n ALA 109 Cb 0.45 -0.94 -0.06 0.00 0.00 0.00 0.00 19.45 18.90 1sfw n ALA 109 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1sfw n PRO 110 N -2.60 1.50 -1.49 0.00 -0.02 -1.26 -4.93 135.00 126.20 1sfw n PRO 110 Ca 0.08 -2.01 -0.32 0.00 -2.02 0.00 0.00 63.50 59.22 1sfw n PRO 110 Cb 0.36 -3.15 0.07 0.00 -0.02 0.00 0.00 33.50 30.77 1sfw n PRO 110 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 1sfw s TYR 111 N 6.85 2.48 -0.29 6.00 5.04 -1.26 -4.04 117.35 132.12 1sfw s TYR 111 Ca 0.61 1.57 0.04 0.00 -2.44 0.00 0.00 57.07 56.86 1sfw s TYR 111 Cb 0.10 -3.17 0.18 0.00 0.35 0.00 0.00 41.96 39.42 1sfw s TYR 111 CO 0.13 -1.90 0.52 -0.80 -1.34 0.00 0.00 175.55 172.16 1sfw s ASN 112 N -2.80 -0.88 -1.28 4.32 0.01 -1.26 -4.99 114.94 108.07 1sfw s ASN 112 Ca 0.66 0.03 -0.05 0.00 -0.71 0.00 0.00 52.86 52.78 1sfw s ASN 112 Cb -0.20 1.70 0.15 0.00 0.41 0.00 0.00 41.25 43.31 1sfw s ASN 112 CO 0.48 -0.32 2.23 2.29 -1.51 0.00 0.00 177.10 180.27 1sfw n LYS 113 N 5.40 4.57 0.18 -0.60 -0.00 -1.26 -4.03 118.16 122.41 1sfw n LYS 113 Ca 0.03 -3.64 0.00 0.00 -0.00 0.00 0.00 58.31 54.70 1sfw n LYS 113 Cb 0.52 -2.65 0.00 0.00 -0.00 0.00 0.00 35.03 32.90 1sfw n LYS 113 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.40 175.49 1sfw n GLU 114 N 1.79 0.00 -3.02 -1.58 4.07 -1.26 -4.78 120.64 115.86 1sfw n GLU 114 Ca 0.57 0.00 -0.44 0.00 -0.06 0.00 0.00 57.16 57.22 1sfw n GLU 114 Cb 0.26 0.00 -0.03 0.00 -0.06 0.00 0.00 31.44 31.62 1sfw n GLU 114 CO 0.00 0.00 0.00 -3.38 -0.06 0.00 0.00 177.13 173.69 1sfw s HIS 115 N -2.00 3.20 0.00 4.31 -3.43 -1.26 -4.80 115.29 111.32 1sfw s HIS 115 Ca 0.00 -1.41 0.00 0.00 -0.80 0.00 0.00 55.06 52.85 1sfw s HIS 115 Cb 0.00 -4.17 0.00 0.00 -1.43 0.00 0.00 32.58 26.98 1sfw s HIS 115 CO 0.00 -1.39 0.00 0.36 -2.00 0.00 0.00 174.74 171.71 1sfw n LYS 116 N 6.11 2.50 -0.75 -0.38 0.00 -1.26 -4.00 118.16 120.38 1sfw n LYS 116 Ca 0.17 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.48 1sfw n LYS 116 Cb 0.48 -0.87 0.27 0.00 -0.00 0.00 0.00 35.03 34.91 1sfw n LYS 116 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.40 175.69 1sfw n ASN 117 N -1.44 3.98 -2.83 -5.58 2.85 -1.26 -2.28 115.26 108.70 1sfw n ASN 117 Ca 0.00 -3.26 0.00 0.00 -0.11 0.00 0.00 54.58 51.21 1sfw n ASN 117 Cb 0.25 -0.64 0.00 0.00 1.24 0.00 0.00 39.78 40.63 1sfw n ASN 117 CO 0.00 0.00 0.00 0.18 -2.11 0.00 0.00 177.26 175.33 1sfw n LEU 118 N -0.49 0.00 0.00 1.20 4.32 -1.25 -4.97 117.00 115.81 1sfw n LEU 118 Ca 0.31 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 56.30 1sfw n LEU 118 Cb 1.12 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.92 1sfw n LEU 118 CO 0.27 -1.25 0.00 -0.67 -1.22 0.00 0.00 177.39 174.52 1sfw n ASP 119 N -2.87 0.00 -0.33 -1.43 -0.08 -1.26 -4.85 116.55 105.73 1sfw n ASP 119 Ca 0.00 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.28 1sfw n ASP 119 Cb 0.00 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.46 1sfw n ASP 119 CO 0.00 0.00 0.00 0.35 0.12 0.00 0.00 177.20 177.67 1sfw n THR 120 N -1.43 0.00 0.09 5.18 -2.24 -1.26 -4.92 114.28 109.70 1sfw n THR 120 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 1sfw n THR 120 Cb 0.00 -0.82 0.00 0.00 -2.10 0.00 0.00 70.33 67.41 1sfw n THR 120 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1sfw n LYS 121 N -0.33 0.00 -0.04 -0.78 5.02 -1.21 -3.95 118.16 116.87 1sfw n LYS 121 Ca 0.00 0.00 -0.08 0.00 -2.02 0.00 0.00 58.31 56.21 1sfw n LYS 121 Cb 0.17 0.00 -0.03 0.00 -0.02 0.00 0.00 35.03 35.15 1sfw n LYS 121 CO 0.00 0.00 0.00 0.87 -0.52 0.00 0.00 177.40 177.75 1sfw h LYS 122 N 0.00 0.05 0.09 1.97 1.57 -1.98 -3.34 116.57 114.92 1sfw h LYS 122 Ca 0.00 -0.00 -0.30 0.00 -1.87 0.00 0.00 60.65 58.48 1sfw h LYS 122 Cb 0.00 -0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.28 1sfw h LYS 122 CO 0.00 0.03 -1.54 1.88 -0.57 0.00 0.00 179.45 179.25 1sfw h TYR 123 N 0.05 0.33 0.00 -1.35 0.05 -1.87 -3.53 116.97 110.65 1sfw h TYR 123 Ca 0.09 -0.24 0.00 0.00 0.05 0.00 0.00 58.73 58.63 1sfw h TYR 123 Cb 0.13 -0.01 0.00 0.00 1.01 0.00 0.00 36.73 37.85 1sfw h TYR 123 CO -0.19 1.31 0.00 0.00 -1.05 0.00 0.00 178.16 178.23