#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 2.34 -0.33 0.00 7.94 -1.26 -2.48 117.00 123.22 1sfw n LEU 2 Ca 0.00 0.20 0.02 0.00 -1.11 0.00 0.00 56.01 55.12 1sfw n LEU 2 Cb 0.00 -0.93 0.15 0.00 0.53 0.00 0.00 43.42 43.17 1sfw n LEU 2 CO 0.00 0.67 1.21 4.11 -1.11 0.00 0.00 177.39 182.26 1sfw h TRP 3 N -0.53 1.04 0.00 1.96 0.09 -2.01 0.22 115.95 116.73 1sfw h TRP 3 Ca -0.54 0.03 -0.11 0.00 0.09 0.00 0.00 58.89 58.35 1sfw h TRP 3 Cb 1.71 -0.34 -0.02 0.00 0.08 0.00 0.00 29.16 30.60 1sfw h TRP 3 CO 0.01 0.52 -0.54 1.96 0.09 0.00 0.00 178.44 180.49 1sfw h GLN 4 N 1.01 0.00 0.00 0.12 4.20 -1.97 -2.83 115.11 115.64 1sfw h GLN 4 Ca 0.40 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.11 1sfw h GLN 4 Cb 0.19 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.97 1sfw h GLN 4 CO -0.18 0.54 0.00 0.35 -0.67 0.00 0.00 178.83 178.87 1sfw h PHE 5 N 0.00 0.00 0.00 2.96 3.04 -1.18 -3.35 116.94 118.41 1sfw h PHE 5 Ca -0.01 0.00 0.00 0.00 3.98 0.00 0.00 57.97 61.94 1sfw h PHE 5 Cb 1.03 0.00 0.00 0.00 2.56 0.00 0.00 35.95 39.54 1sfw h PHE 5 CO 0.00 0.00 0.00 0.54 -2.02 0.00 0.00 178.31 176.83 1sfw n ARG 6 N -2.90 0.75 0.00 1.11 3.00 0.76 -1.80 116.66 117.58 1sfw n ARG 6 Ca 0.04 0.00 0.00 0.00 -0.01 0.00 0.00 57.85 57.88 1sfw n ARG 6 Cb 0.48 -1.21 0.00 0.00 0.00 0.00 0.00 32.46 31.73 1sfw n ARG 6 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.63 178.08 1sfw n SER 7 N 0.47 0.00 -0.08 0.55 2.88 -1.26 -4.55 113.62 111.63 1sfw n SER 7 Ca 0.00 0.00 0.08 0.00 -1.33 0.00 0.00 58.87 57.62 1sfw n SER 7 Cb 0.31 -0.03 0.13 0.00 -0.75 0.00 0.00 64.21 63.88 1sfw n SER 7 CO 0.00 0.00 0.00 1.15 -1.23 0.00 0.00 175.04 174.96 1sfw n MET 8 N -1.38 -0.01 0.01 -1.46 -0.00 -1.26 -0.74 117.12 112.27 1sfw n MET 8 Ca 0.00 0.26 -0.02 0.00 -0.00 0.00 0.00 57.70 57.93 1sfw n MET 8 Cb 0.00 -0.49 0.23 0.00 -0.00 0.00 0.00 33.22 32.96 1sfw n MET 8 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 175.97 176.79 1sfw h ILE 9 N 0.00 1.24 -0.01 3.17 1.08 -1.63 -0.66 117.51 120.70 1sfw h ILE 9 Ca 0.17 -1.12 0.00 0.00 -0.39 0.00 0.00 64.86 63.53 1sfw h ILE 9 Cb 0.53 1.22 0.00 0.00 -3.07 0.00 0.00 36.82 35.50 1sfw h ILE 9 CO -0.11 0.36 0.00 2.29 -0.69 0.00 0.00 178.15 180.00 1sfw n LYS 10 N -4.17 1.37 -0.07 2.37 -0.00 0.08 -1.06 118.16 116.67 1sfw n LYS 10 Ca 0.00 -0.53 -0.11 0.00 -0.00 0.00 0.00 58.31 57.68 1sfw n LYS 10 Cb 0.35 -1.49 -0.09 0.00 -0.00 0.00 0.00 35.03 33.81 1sfw n LYS 10 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1sfw h ALA 12 N -0.35 2.33 -3.17 0.00 0.00 -1.13 -3.23 119.26 113.71 1sfw h ALA 12 Ca -0.03 0.12 -0.69 0.00 0.00 0.00 0.00 54.91 54.31 1sfw h ALA 12 Cb 0.74 0.13 -0.35 0.00 0.00 0.00 0.00 17.79 18.31 1sfw h ALA 12 CO -0.02 -0.88 -0.43 0.42 0.00 0.00 0.00 179.25 178.34 1sfw s ILE 13 N -5.48 3.53 -1.22 0.00 -1.09 -0.23 -4.46 121.20 112.25 1sfw s ILE 13 Ca -0.09 -2.69 -0.19 0.00 -2.23 0.00 0.00 60.65 55.45 1sfw s ILE 13 Cb 0.28 -3.34 -0.01 0.00 -1.58 0.00 0.00 42.46 37.81 1sfw s ILE 13 CO 0.80 -0.82 1.91 -0.81 -1.23 0.00 0.00 174.94 174.80 1sfw n PRO 14 N 3.82 2.44 0.00 2.79 -0.04 -1.22 -4.43 135.00 138.36 1sfw n PRO 14 Ca 0.04 -2.73 0.00 0.00 -0.04 0.00 0.00 63.50 60.78 1sfw n PRO 14 Cb 0.39 -3.45 0.00 0.00 -0.04 0.00 0.00 33.50 30.40 1sfw n PRO 14 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1sfw n GLY 15 N 5.16 4.04 0.00 0.55 0.00 -1.26 -5.15 105.19 108.53 1sfw n GLY 15 Ca 0.48 -0.84 0.00 0.00 0.00 0.00 0.00 46.02 45.66 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 0.00 0.00 -4.86 1.61 2.88 -1.26 -5.06 113.62 106.93 1sfw n SER 16 Ca 0.00 0.00 -0.35 0.00 -1.33 0.00 0.00 58.87 57.19 1sfw n SER 16 Cb 0.00 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.40 1sfw n SER 16 CO 0.00 0.00 0.00 -2.28 -1.23 0.00 0.00 175.04 171.53 1sfw s HIS 17 N 2.39 3.62 0.21 0.66 5.65 -1.26 -4.98 115.29 121.57 1sfw s HIS 17 Ca 0.00 0.79 -0.09 0.00 0.25 0.00 0.00 55.06 56.01 1sfw s HIS 17 Cb 0.00 -2.15 0.25 0.00 -1.18 0.00 0.00 32.58 29.50 1sfw s HIS 17 CO 0.00 0.57 1.79 -1.00 -0.65 0.00 0.00 174.74 175.45 1sfw h PRO 18 N 4.03 0.61 0.00 2.88 0.13 -1.87 -3.06 132.00 134.71 1sfw h PRO 18 Ca -0.50 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 64.59 1sfw h PRO 18 Cb 1.20 -0.14 0.00 0.00 0.13 0.00 0.00 31.00 32.19 1sfw h PRO 18 CO 0.65 0.40 0.00 1.28 -0.23 0.00 0.00 178.00 180.10 1sfw n LEU 19 N -4.83 0.00 0.00 1.56 4.77 -1.26 -4.57 117.00 112.67 1sfw n LEU 19 Ca 0.08 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.06 1sfw n LEU 19 Cb 0.20 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.29 1sfw n LEU 19 CO 0.28 0.00 0.00 0.23 -1.33 0.00 0.00 177.39 176.57 1sfw n MET 20 N 0.00 0.00 0.13 3.23 2.81 -1.26 0.28 117.12 122.32 1sfw n MET 20 Ca 0.00 0.00 0.03 0.00 -1.81 0.00 0.00 57.70 55.92 1sfw n MET 20 Cb 0.00 0.00 0.14 0.00 -0.71 0.00 0.00 33.22 32.65 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 -0.30 0.14 0.00 7.83 2.03 -1.16 -4.41 116.55 120.68 1sfw n ASP 21 Ca 0.00 0.35 0.00 0.00 0.52 0.00 0.00 54.79 55.66 1sfw n ASP 21 Cb 0.00 -0.23 0.00 0.00 -0.72 0.00 0.00 41.12 40.17 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 -1.76 0.00 -0.29 -0.67 3.01 0.14 -4.91 117.46 112.98 1sfw n PHE 22 Ca -0.00 0.00 0.22 0.00 1.01 0.00 0.00 57.45 58.68 1sfw n PHE 22 Cb 0.51 0.00 0.42 0.00 -0.01 0.00 0.00 39.48 40.39 1sfw n PHE 22 CO 0.00 0.00 0.00 -1.71 1.01 0.00 0.00 176.76 176.06 1sfw n ASN 23 N -1.04 0.15 -3.78 4.37 2.85 -0.96 -1.82 115.26 115.02 1sfw n ASN 23 Ca 0.00 1.47 -0.29 0.00 -0.11 0.00 0.00 54.58 55.65 1sfw n ASN 23 Cb 0.00 -0.65 -0.13 0.00 1.24 0.00 0.00 39.78 40.25 1sfw n ASN 23 CO 0.00 0.00 0.00 0.20 -2.11 0.00 0.00 177.26 175.35 1sfw s ASN 24 N -4.75 3.84 -0.36 1.20 -0.87 -1.26 -2.66 114.94 110.08 1sfw s ASN 24 Ca -0.09 -2.97 0.05 0.00 -1.57 0.00 0.00 52.86 48.28 1sfw s ASN 24 Cb 0.28 -1.24 0.17 0.00 -0.02 0.00 0.00 41.25 40.44 1sfw s ASN 24 CO 0.69 -0.22 0.53 -0.47 -2.57 0.00 0.00 177.10 175.05 1sfw s TYR 25 N -0.15 -1.31 0.00 2.20 6.14 -1.05 -1.77 117.35 121.42 1sfw s TYR 25 Ca 0.20 0.17 0.00 0.00 0.64 0.00 0.00 57.07 58.08 1sfw s TYR 25 Cb -0.19 0.07 0.00 0.00 0.42 0.00 0.00 41.96 42.26 1sfw s TYR 25 CO -0.04 -1.08 0.00 0.41 0.64 0.00 0.00 175.55 175.47 1sfw n GLY 26 N 4.72 1.61 0.13 8.97 0.00 -1.26 -3.55 105.19 115.81 1sfw n GLY 26 Ca 0.08 -0.35 -0.27 0.00 0.00 0.00 0.00 46.02 45.48 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 -4.30 0.00 0.00 0.00 0.18 -1.24 -3.92 117.16 107.88 1sfw n TYR 28 Ca -0.48 0.00 0.00 0.00 1.88 0.00 0.00 57.90 59.30 1sfw n TYR 28 Cb 0.82 0.00 0.00 0.00 -0.38 0.00 0.00 39.34 39.78 1sfw n TYR 28 CO 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 176.86 174.78 1sfw n GLY 30 N 0.00 2.09 0.01 0.00 0.00 -1.26 -2.26 105.19 103.76 1sfw n GLY 30 Ca 0.00 -0.32 0.00 0.00 0.00 0.00 0.00 46.02 45.70 1sfw n GLY 30 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1sfw n LEU 31 N 0.00 0.00 0.00 0.99 7.94 -0.85 -4.97 117.00 120.11 1sfw n LEU 31 Ca 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.90 1sfw n LEU 31 Cb 0.00 -0.03 0.00 0.00 0.53 0.00 0.00 43.42 43.92 1sfw n LEU 31 CO 0.00 -0.04 0.00 0.61 -1.11 0.00 0.00 177.39 176.85 1sfw n GLY 32 N 2.69 -0.49 7.00 -3.96 0.00 -0.13 -5.01 105.19 105.29 1sfw n GLY 32 Ca 0.00 -1.22 0.00 0.00 0.00 0.00 0.00 46.02 44.80 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 3.44 0.51 3.61 -0.02 0.00 -1.25 -4.68 105.19 106.80 1sfw n GLY 33 Ca 0.00 -0.84 -0.11 0.00 0.00 0.00 0.00 46.02 45.07 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 -4.00 -0.46 0.00 1.61 0.15 -1.26 -4.96 113.70 104.78 1sfw s SER 34 Ca 0.00 0.74 0.00 0.00 0.70 0.00 0.00 55.95 57.39 1sfw s SER 34 Cb 0.00 0.70 0.00 0.00 -1.71 0.00 0.00 66.02 65.01 1sfw s SER 34 CO 0.00 -0.26 0.00 0.61 1.20 0.00 0.00 173.24 174.79 1sfw n GLY 35 N 1.65 0.93 3.28 9.45 0.00 -1.26 -4.99 105.19 114.25 1sfw n GLY 35 Ca -0.12 -1.08 -0.16 0.00 0.00 0.00 0.00 46.02 44.65 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 1.36 0.00 2.61 -4.23 -1.26 -5.04 115.64 109.07 1sfw s THR 36 Ca 0.00 -2.06 0.00 0.00 -1.18 0.00 0.00 61.69 58.45 1sfw s THR 36 Cb 0.00 -1.86 0.00 0.00 1.34 0.00 0.00 72.50 71.98 1sfw s THR 36 CO 0.00 -0.66 0.00 -0.81 -0.54 0.00 0.00 174.62 172.61 1sfw n PRO 37 N -0.16 3.47 0.11 3.99 -0.04 -1.26 -4.69 135.00 136.41 1sfw n PRO 37 Ca -0.10 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.36 1sfw n PRO 37 Cb 0.60 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.06 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 0.32 -2.85 0.52 0.24 -1.26 -4.75 118.33 110.56 1sfw n VAL 38 Ca 0.00 0.11 -0.29 0.00 -2.04 0.00 0.00 64.34 62.12 1sfw n VAL 38 Cb 0.00 -0.82 -0.02 0.00 -1.47 0.00 0.00 33.84 31.53 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 -5.26 6.41 0.27 -1.34 2.15 -1.26 -4.96 116.67 112.68 1sfw s ASP 39 Ca 0.00 0.99 -0.01 0.00 0.43 0.00 0.00 52.55 53.96 1sfw s ASP 39 Cb 0.00 -2.27 0.58 0.00 -0.30 0.00 0.00 42.92 40.93 1sfw s ASP 39 CO 0.00 -0.44 1.67 -0.08 -0.17 0.00 0.00 175.17 176.16 1sfw h GLU 40 N 0.93 0.26 -0.51 4.34 4.57 -2.00 -1.38 114.58 120.78 1sfw h GLU 40 Ca -0.47 -0.02 0.04 0.00 -1.18 0.00 0.00 59.36 57.73 1sfw h GLU 40 Cb 1.19 -0.06 -0.04 0.00 -0.16 0.00 0.00 28.75 29.68 1sfw h GLU 40 CO 0.63 0.17 0.27 1.25 -1.18 0.00 0.00 179.01 180.16 1sfw h LEU 41 N 0.27 0.41 -0.33 1.64 7.12 -1.92 -2.54 115.31 119.95 1sfw h LEU 41 Ca 0.48 0.02 0.00 0.00 0.13 0.00 0.00 57.88 58.51 1sfw h LEU 41 Cb 0.89 -0.06 0.00 0.00 -0.53 0.00 0.00 40.66 40.96 1sfw h LEU 41 CO -0.57 0.28 0.00 -0.67 -0.13 0.00 0.00 178.44 177.36 1sfw n ASP 42 N -4.86 0.28 -0.07 1.25 2.03 -0.89 -3.34 116.55 110.96 1sfw n ASP 42 Ca 0.04 0.57 -0.15 0.00 0.52 0.00 0.00 54.79 55.78 1sfw n ASP 42 Cb 0.12 -0.63 -0.05 0.00 -0.72 0.00 0.00 41.12 39.84 1sfw n ASP 42 CO 0.00 0.00 0.00 0.03 -1.92 0.00 0.00 177.20 175.31 1sfw h ARG 43 N 0.00 0.84 0.00 -0.67 2.47 -0.82 -2.56 114.38 113.64 1sfw h ARG 43 Ca 0.00 -0.55 0.00 0.00 -1.26 0.00 0.00 59.98 58.17 1sfw h ARG 43 Cb 0.27 0.07 0.00 0.00 -1.65 0.00 0.00 29.97 28.66 1sfw h ARG 43 CO 0.00 1.18 0.00 0.00 0.56 0.00 0.00 179.97 181.71 1sfw h GLU 46 N 0.01 1.19 0.00 0.00 4.81 -0.99 -3.10 114.58 116.50 1sfw h GLU 46 Ca -0.31 -0.07 0.00 0.00 -0.13 0.00 0.00 59.36 58.85 1sfw h GLU 46 Cb 2.02 -0.27 0.00 0.00 0.63 0.00 0.00 28.75 31.13 1sfw h GLU 46 CO 0.08 0.79 -0.81 1.15 -0.73 0.00 0.00 179.01 179.49 1sfw h THR 47 N 1.22 0.00 -0.87 0.32 2.02 -1.59 -2.29 112.91 111.73 1sfw h THR 47 Ca 0.40 -0.92 -0.74 0.00 0.77 0.00 0.00 66.41 65.93 1sfw h THR 47 Cb 0.05 1.50 -0.11 0.00 -1.74 0.00 0.00 68.15 67.85 1sfw h THR 47 CO -0.14 0.00 2.44 1.57 0.37 0.00 0.00 175.52 179.76 1sfw n HIS 48 N -2.64 3.22 0.00 3.16 -0.00 0.21 -0.24 115.22 118.93 1sfw n HIS 48 Ca 0.01 -2.87 0.00 0.00 0.46 0.00 0.00 57.72 55.32 1sfw n HIS 48 Cb 0.53 -2.19 0.00 0.00 -0.12 0.00 0.00 29.99 28.21 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 4.79 0.00 0.07 0.26 8.00 -1.26 -4.76 116.55 123.66 1sfw n ASP 49 Ca 0.44 0.00 -0.02 0.00 0.71 0.00 0.00 54.79 55.93 1sfw n ASP 49 Cb 0.38 0.00 -0.06 0.00 -0.02 0.00 0.00 41.12 41.42 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 0.35 -2.24 2.35 -0.88 -2.47 115.58 112.68 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 0.70 -0.38 0.00 -1.65 0.00 0.00 177.43 176.10 1sfw h TYR 52 N 0.63 0.37 -0.96 0.00 3.20 -1.49 -3.28 116.97 115.44 1sfw h TYR 52 Ca 0.00 -0.27 0.27 0.00 3.14 0.00 0.00 58.73 61.87 1sfw h TYR 52 Cb 0.51 -0.01 -0.17 0.00 1.54 0.00 0.00 36.73 38.59 1sfw h TYR 52 CO 0.00 1.33 0.08 0.07 -1.64 0.00 0.00 178.16 178.01 1sfw h ARG 53 N -0.53 0.04 0.00 1.82 -0.00 -1.71 -3.34 114.38 110.66 1sfw h ARG 53 Ca -0.18 -0.00 0.00 0.00 -0.00 0.00 0.00 59.98 59.80 1sfw h ARG 53 Cb 1.52 -0.01 0.00 0.00 -0.00 0.00 0.00 29.97 31.49 1sfw h ARG 53 CO 0.07 0.02 0.00 -3.47 -0.00 0.00 0.00 179.97 176.59 1sfw n ASP 54 N -5.43 0.00 -0.41 0.08 2.03 -1.24 -1.72 116.55 109.86 1sfw n ASP 54 Ca 0.23 -0.39 0.33 0.00 0.52 0.00 0.00 54.79 55.48 1sfw n ASP 54 Cb 0.76 -0.06 0.63 0.00 -0.72 0.00 0.00 41.12 41.73 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 2.98 2.69 -0.32 -1.67 0.00 -1.81 0.25 119.26 121.38 1sfw h ALA 55 Ca 0.00 0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 1sfw h ALA 55 Cb 0.03 0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 1sfw h ALA 55 CO 0.00 -1.22 0.14 1.57 0.00 0.00 0.00 179.25 179.74 1sfw h LYS 56 N 0.17 0.47 0.00 0.00 -0.00 -1.56 -3.40 116.57 112.25 1sfw h LYS 56 Ca 0.73 -0.08 0.00 0.00 -0.00 0.00 0.00 60.65 61.30 1sfw h LYS 56 Cb 2.29 -0.08 0.00 0.00 -0.00 0.00 0.00 32.23 34.43 1sfw h LYS 56 CO -0.31 0.45 -0.07 -0.97 -0.00 0.00 0.00 179.45 178.55 1sfw h ASN 57 N 0.38 0.00 -3.41 7.07 -1.24 -1.56 -2.83 115.58 113.99 1sfw h ASN 57 Ca 0.11 0.00 0.05 0.00 0.71 0.00 0.00 56.30 57.16 1sfw h ASN 57 Cb 0.15 0.00 -0.03 0.00 0.73 0.00 0.00 38.32 39.17 1sfw h ASN 57 CO -0.01 0.16 -0.84 -0.11 -1.29 0.00 0.00 177.43 175.34 1sfw n LEU 58 N -2.79 -1.29 0.22 0.34 7.94 0.84 -2.76 117.00 119.50 1sfw n LEU 58 Ca -0.01 2.29 0.05 0.00 -1.11 0.00 0.00 56.01 57.22 1sfw n LEU 58 Cb 0.04 -2.89 0.48 0.00 0.53 0.00 0.00 43.42 41.57 1sfw n LEU 58 CO 0.01 -0.85 0.87 0.44 -1.11 0.00 0.00 177.39 176.76 1sfw h ASP 59 N -0.10 0.00 0.00 1.96 3.32 -1.96 -3.36 116.42 116.28 1sfw h ASP 59 Ca -0.03 -0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.02 1sfw h ASP 59 Cb 0.85 -0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.40 1sfw h ASP 59 CO 0.01 0.22 -1.00 -0.24 -1.72 0.00 0.00 179.24 176.50 1sfw n SER 60 N -4.29 4.99 -3.71 6.45 2.88 -1.26 -4.97 113.62 113.71 1sfw n SER 60 Ca -0.02 0.00 -0.29 0.00 -1.33 0.00 0.00 58.87 57.23 1sfw n SER 60 Cb 0.27 0.61 -0.12 0.00 -0.75 0.00 0.00 64.21 64.22 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 -0.24 3.73 0.34 0.00 1.02 -1.11 -3.88 119.74 119.60 1sfw s LYS 62 Ca 0.23 -2.05 -0.03 0.00 0.02 0.00 0.00 55.97 54.13 1sfw s LYS 62 Cb -0.13 -4.90 0.01 0.00 -0.52 0.00 0.00 37.83 32.29 1sfw s LYS 62 CO -0.08 -1.71 0.49 -0.59 -0.92 0.00 0.00 175.35 172.53 1sfw s PHE 63 N 2.09 1.00 0.76 3.18 -0.71 -1.07 -5.06 117.98 118.17 1sfw s PHE 63 Ca 0.34 -1.26 -0.14 0.00 -1.04 0.00 0.00 56.93 54.83 1sfw s PHE 63 Cb -0.05 -0.03 0.05 0.00 -1.21 0.00 0.00 43.02 41.78 1sfw s PHE 63 CO -0.07 -1.16 1.16 -0.48 -1.34 0.00 0.00 175.22 173.33 1sfw s LEU 64 N -3.22 3.21 -0.14 -1.99 -0.00 -1.26 -4.63 118.68 110.64 1sfw s LEU 64 Ca 0.30 2.19 -0.09 0.00 -0.00 0.00 0.00 54.13 56.53 1sfw s LEU 64 Cb -0.01 -4.57 0.04 0.00 -0.00 0.00 0.00 46.19 41.65 1sfw s LEU 64 CO 0.20 -2.27 0.18 1.33 -0.00 0.00 0.00 176.35 175.79 1sfw n VAL 65 N -3.04-10.29 -2.82 1.48 0.24 -1.26 -4.90 118.33 97.74 1sfw n VAL 65 Ca 0.12 2.05 0.01 0.00 -2.04 0.00 0.00 64.34 64.47 1sfw n VAL 65 Cb 0.51 -5.76 0.01 0.00 -1.47 0.00 0.00 33.84 27.13 1sfw n VAL 65 CO 0.00 0.00 0.00 -1.81 -2.14 0.00 0.00 176.83 172.88 1sfw s ASP 66 N -0.50 -0.56 0.00 -1.34 1.01 -1.26 -4.80 116.67 109.22 1sfw s ASP 66 Ca -0.21 -0.36 0.00 0.00 0.71 0.00 0.00 52.55 52.69 1sfw s ASP 66 Cb 0.01 0.72 0.00 0.00 1.01 0.00 0.00 42.92 44.66 1sfw s ASP 66 CO 0.59 -0.05 0.00 0.59 0.21 0.00 0.00 175.17 176.50 1sfw n ASN 67 N 3.61 0.94 0.15 0.27 4.13 -1.26 -4.51 115.26 118.59 1sfw n ASN 67 Ca 0.08 0.00 -0.08 0.00 1.68 0.00 0.00 54.58 56.26 1sfw n ASN 67 Cb 0.62 0.00 -0.04 0.00 -1.54 0.00 0.00 39.78 38.82 1sfw n ASN 67 CO 0.00 0.00 0.00 -0.65 0.28 0.00 0.00 177.26 176.89 1sfw h PRO 68 N 0.00 -0.43 0.00 3.52 0.11 -1.99 -3.46 132.00 129.74 1sfw h PRO 68 Ca 0.00 0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.14 1sfw h PRO 68 Cb 0.49 0.10 0.00 0.00 0.11 0.00 0.00 31.00 31.70 1sfw h PRO 68 CO 0.00 -0.29 0.00 0.66 -0.21 0.00 0.00 178.00 178.16 1sfw n TYR 69 N -3.57 0.00 -0.98 0.65 4.01 -1.26 -5.05 117.16 110.95 1sfw n TYR 69 Ca -0.05 0.00 -0.34 0.00 -0.16 0.00 0.00 57.90 57.35 1sfw n TYR 69 Cb 0.20 0.00 0.11 0.00 -0.31 0.00 0.00 39.34 39.34 1sfw n TYR 69 CO 0.00 0.00 0.00 -2.37 -0.46 0.00 0.00 176.86 174.03 1sfw n THR 70 N -0.68 0.98 0.00 -0.72 5.66 -1.26 -4.78 114.28 113.48 1sfw n THR 70 Ca 0.00 -0.23 0.00 0.00 -3.05 0.00 0.00 64.05 60.77 1sfw n THR 70 Cb 0.00 -0.84 0.00 0.00 -1.55 0.00 0.00 70.33 67.94 1sfw n THR 70 CO 0.00 0.00 0.00 1.21 -3.05 0.00 0.00 175.07 173.23 1sfw n GLU 71 N -2.11 0.00 -3.84 1.09 2.13 -1.26 -4.82 120.64 111.83 1sfw n GLU 71 Ca 0.10 0.00 -0.07 0.00 0.66 0.00 0.00 57.16 57.85 1sfw n GLU 71 Cb 0.52 -0.34 -0.01 0.00 0.27 0.00 0.00 31.44 31.88 1sfw n GLU 71 CO 0.00 0.00 0.00 0.45 -0.41 0.00 0.00 177.13 177.17 1sfw s SER 72 N -4.92 -0.19 0.00 4.31 0.15 -1.26 -4.66 113.70 107.12 1sfw s SER 72 Ca 0.00 -0.71 0.00 0.00 0.70 0.00 0.00 55.95 55.94 1sfw s SER 72 Cb 0.00 0.73 0.00 0.00 -1.71 0.00 0.00 66.02 65.04 1sfw s SER 72 CO 0.00 -1.37 0.00 -1.22 1.20 0.00 0.00 173.24 171.85 1sfw n TYR 73 N -0.48 0.00 -2.72 3.44 4.01 -1.26 -0.90 117.16 119.24 1sfw n TYR 73 Ca -0.05 0.00 -0.02 0.00 -0.16 0.00 0.00 57.90 57.67 1sfw n TYR 73 Cb 0.59 0.00 0.02 0.00 -0.31 0.00 0.00 39.34 39.65 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 -0.48 0.00 7.72 0.15 0.74 -4.92 113.70 116.91 1sfw s SER 74 Ca 0.00 -0.50 0.00 0.00 0.70 0.00 0.00 55.95 56.15 1sfw s SER 74 Cb 0.00 0.63 0.00 0.00 -1.71 0.00 0.00 66.02 64.94 1sfw s SER 74 CO 0.00 -0.03 0.00 0.00 1.20 0.00 0.00 173.24 174.41 1sfw n TYR 75 N 2.93 0.00 -0.61 3.44 4.11 -1.13 -3.47 117.16 122.42 1sfw n TYR 75 Ca 0.11 0.00 0.00 0.00 -0.00 0.00 0.00 57.90 58.01 1sfw n TYR 75 Cb 0.63 0.00 0.00 0.00 -0.00 0.00 0.00 39.34 39.97 1sfw n TYR 75 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.86 177.31 1sfw n SER 76 N 0.00 0.00 -4.76 9.48 2.88 -1.26 -4.92 113.62 115.04 1sfw n SER 76 Ca 0.00 -0.05 -0.38 0.00 -1.33 0.00 0.00 58.87 57.11 1sfw n SER 76 Cb 0.00 0.00 0.02 0.00 -0.75 0.00 0.00 64.21 63.48 1sfw n SER 76 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1sfw n SER 78 N -0.85 0.00 -0.15 0.00 7.64 -1.14 -4.95 113.62 114.17 1sfw n SER 78 Ca 0.09 0.00 -0.03 0.00 1.01 0.00 0.00 58.87 59.94 1sfw n SER 78 Cb 0.47 0.00 0.03 0.00 -1.01 0.00 0.00 64.21 63.70 1sfw n SER 78 CO 0.00 0.00 0.00 0.78 -3.01 0.00 0.00 175.04 172.81 1sfw h ASN 79 N 0.00 -0.48 0.00 6.43 2.35 -1.96 -3.43 115.58 118.48 1sfw h ASN 79 Ca 0.00 0.15 0.00 0.00 -0.55 0.00 0.00 56.30 55.90 1sfw h ASN 79 Cb 0.00 0.31 0.00 0.00 0.05 0.00 0.00 38.32 38.68 1sfw h ASN 79 CO 0.00 -0.17 0.00 0.35 -1.65 0.00 0.00 177.43 175.96 1sfw n THR 80 N -5.36 0.00 -3.81 2.81 -2.24 -1.26 -4.77 114.28 99.65 1sfw n THR 80 Ca 0.04 0.00 -0.35 0.00 -2.27 0.00 0.00 64.05 61.47 1sfw n THR 80 Cb 0.26 0.00 -0.08 0.00 -2.10 0.00 0.00 70.33 68.42 1sfw n THR 80 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1sfw s GLU 81 N 0.00 3.95 0.17 -0.78 2.02 -1.26 -3.36 118.70 119.43 1sfw s GLU 81 Ca 0.00 -0.21 -0.00 0.00 0.02 0.00 0.00 54.97 54.78 1sfw s GLU 81 Cb 0.00 -3.33 -0.04 0.00 0.10 0.00 0.00 34.13 30.86 1sfw s GLU 81 CO 0.00 0.43 0.06 0.42 0.02 0.00 0.00 175.26 176.19 1sfw s ILE 82 N -0.03 0.26 0.00 -1.63 1.09 -1.26 -2.88 121.20 116.75 1sfw s ILE 82 Ca 0.09 -1.95 0.00 0.00 -1.10 0.00 0.00 60.65 57.69 1sfw s ILE 82 Cb -0.11 -2.22 0.00 0.00 -1.06 0.00 0.00 42.46 39.07 1sfw s ILE 82 CO -0.00 -0.32 0.00 1.07 -0.10 0.00 0.00 174.94 175.59 1sfw n THR 83 N -0.20 0.00 0.01 2.92 5.66 -1.26 -5.03 114.28 116.37 1sfw n THR 83 Ca -0.04 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.96 1sfw n THR 83 Cb 0.64 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.42 1sfw n THR 83 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1sfw s ASN 85 N -3.68 1.85 -0.40 0.00 6.03 -1.23 -0.18 114.94 117.34 1sfw s ASN 85 Ca 0.00 -1.55 0.11 0.00 -1.03 0.00 0.00 52.86 50.39 1sfw s ASN 85 Cb 0.00 0.34 0.34 0.00 -3.03 0.00 0.00 41.25 38.90 1sfw s ASN 85 CO 0.00 -0.86 0.73 -1.20 -2.03 0.00 0.00 177.10 173.75 1sfw n SER 86 N -0.95 1.19 0.06 3.54 7.64 -1.24 -4.85 113.62 119.01 1sfw n SER 86 Ca -0.01 -3.06 0.00 0.00 1.01 0.00 0.00 58.87 56.82 1sfw n SER 86 Cb 0.65 -0.62 0.00 0.00 -1.01 0.00 0.00 64.21 63.23 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 0.33 0.00 -1.92 1.43 0.00 -1.26 -5.10 118.16 111.64 1sfw n LYS 87 Ca 0.25 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.56 1sfw n LYS 87 Cb 0.62 0.00 0.00 0.00 -0.00 0.00 0.00 35.03 35.65 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 -2.75 -7.34 0.00 -5.58 6.94 -1.26 -5.08 115.26 100.18 1sfw n ASN 88 Ca 0.00 1.33 0.00 0.00 -0.02 0.00 0.00 54.58 55.89 1sfw n ASN 88 Cb 0.00 -4.42 0.00 0.00 -2.36 0.00 0.00 39.78 33.00 1sfw n ASN 88 CO 0.00 0.00 0.00 -0.46 -1.03 0.00 0.00 177.26 175.77 1sfw n ASN 89 N 1.25 0.00 -0.09 0.53 6.94 -1.26 -4.99 115.26 117.63 1sfw n ASN 89 Ca 0.00 0.00 -0.12 0.00 -0.02 0.00 0.00 54.58 54.44 1sfw n ASN 89 Cb 0.00 0.00 -0.10 0.00 -2.36 0.00 0.00 39.78 37.32 1sfw n ASN 89 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1sfw n ALA 90 N -3.00 1.58 -0.16 -2.53 0.00 -1.26 -4.36 120.51 110.79 1sfw n ALA 90 Ca 0.00 -0.90 0.02 0.00 0.00 0.00 0.00 53.44 52.56 1sfw n ALA 90 Cb 0.00 0.01 0.05 0.00 0.00 0.00 0.00 19.45 19.51 1sfw n ALA 90 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1sfw n GLU 92 N -4.68 0.48 0.18 0.00 0.00 -1.26 -4.58 120.64 110.78 1sfw n GLU 92 Ca 0.06 0.45 0.03 0.00 0.00 0.00 0.00 57.16 57.70 1sfw n GLU 92 Cb 0.20 -1.63 0.35 0.00 0.00 0.00 0.00 31.44 30.37 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 -0.97 1.31 -0.38 -1.84 0.00 -1.73 -2.19 119.26 113.46 1sfw h ALA 93 Ca -0.03 -0.35 -0.13 0.00 0.00 0.00 0.00 54.91 54.40 1sfw h ALA 93 Cb 0.70 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 1sfw h ALA 93 CO -0.02 0.48 -0.27 0.35 0.00 0.00 0.00 179.25 179.79 1sfw h PHE 94 N 0.00 0.92 0.06 0.00 3.04 -0.76 -1.70 116.94 118.49 1sfw h PHE 94 Ca -0.00 -0.23 -0.00 0.00 3.98 0.00 0.00 57.97 61.72 1sfw h PHE 94 Cb 0.71 -0.21 0.00 0.00 2.56 0.00 0.00 35.95 39.01 1sfw h PHE 94 CO 0.00 0.97 -0.03 0.82 -2.02 0.00 0.00 178.31 178.06 1sfw h ILE 95 N 0.68 1.22 0.00 1.41 1.08 -1.63 -2.65 117.51 117.62 1sfw h ILE 95 Ca 0.08 -1.00 -0.02 0.00 -0.39 0.00 0.00 64.86 63.53 1sfw h ILE 95 Cb 0.80 1.87 -0.00 0.00 -3.07 0.00 0.00 36.82 36.42 1sfw h ILE 95 CO 0.07 0.25 -0.09 0.00 -0.69 0.00 0.00 178.15 177.68 1sfw h ASN 97 N 0.00 0.49 -0.26 0.00 -1.24 -1.24 -1.19 115.58 112.14 1sfw h ASN 97 Ca -0.00 -0.44 -0.05 0.00 0.71 0.00 0.00 56.30 56.52 1sfw h ASN 97 Cb 0.23 -0.15 -0.02 0.00 0.73 0.00 0.00 38.32 39.11 1sfw h ASN 97 CO 0.01 1.27 0.03 0.00 -1.29 0.00 0.00 177.43 177.45 1sfw h ASP 99 N 0.53 -0.87 0.83 0.00 3.32 -1.37 -2.15 116.42 116.71 1sfw h ASP 99 Ca 0.12 0.03 -0.03 0.00 0.02 0.00 0.00 57.03 57.17 1sfw h ASP 99 Cb 0.30 0.23 -0.00 0.00 0.22 0.00 0.00 39.33 40.07 1sfw h ASP 99 CO 0.01 -0.61 -0.13 0.08 -1.72 0.00 0.00 179.24 176.86 1sfw h ARG 100 N -1.00 0.00 0.00 3.56 -0.00 -1.27 0.05 114.38 115.71 1sfw h ARG 100 Ca -0.10 0.00 0.00 0.00 -0.00 0.00 0.00 59.98 59.88 1sfw h ARG 100 Cb 0.77 0.00 0.00 0.00 -0.00 0.00 0.00 29.97 30.74 1sfw h ARG 100 CO 0.16 0.13 0.00 -0.97 -0.00 0.00 0.00 179.97 179.29 1sfw h ASN 101 N 0.00 0.00 1.12 0.08 -0.73 -1.31 -2.77 115.58 111.97 1sfw h ASN 101 Ca -0.00 0.00 -0.17 0.00 1.87 0.00 0.00 56.30 58.00 1sfw h ASN 101 Cb 0.58 0.00 -0.02 0.00 0.27 0.00 0.00 38.32 39.15 1sfw h ASN 101 CO 0.02 0.00 -0.80 0.00 -0.37 0.00 0.00 177.43 176.28 1sfw h ALA 102 N 2.35 0.52 0.00 1.57 0.00 -0.57 -2.49 119.26 120.63 1sfw h ALA 102 Ca 0.00 -0.73 0.00 0.00 0.00 0.00 0.00 54.91 54.18 1sfw h ALA 102 Cb 0.71 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.37 1sfw h ALA 102 CO 0.00 1.00 0.00 0.00 0.00 0.00 0.00 179.25 180.25 1sfw h ALA 103 N 1.20 1.00 0.09 0.00 0.00 -0.74 0.27 119.26 121.08 1sfw h ALA 103 Ca -0.01 0.00 -0.36 0.00 0.00 0.00 0.00 54.91 54.55 1sfw h ALA 103 Cb 1.57 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 19.33 1sfw h ALA 103 CO 0.10 0.00 -2.01 -0.89 0.00 0.00 0.00 179.25 176.46 1sfw n ILE 104 N -2.53 1.72 -0.12 0.00 -0.00 -1.15 -0.50 119.36 116.78 1sfw n ILE 104 Ca -0.01 -0.68 -0.10 0.00 -0.00 0.00 0.00 62.75 61.96 1sfw n ILE 104 Cb 0.11 -1.56 -0.02 0.00 -0.00 0.00 0.00 39.64 38.17 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 0.40 0.82 0.00 0.00 0.04 -0.58 -1.84 116.94 115.79 1sfw h PHE 106 Ca 0.10 -0.49 -0.05 0.00 2.80 0.00 0.00 57.97 60.33 1sfw h PHE 106 Cb 0.39 -0.07 -0.01 0.00 2.20 0.00 0.00 35.95 38.46 1sfw h PHE 106 CO 0.03 1.34 -0.23 0.66 -0.60 0.00 0.00 178.31 179.51 1sfw h SER 107 N 0.25 0.00 0.00 2.17 4.64 -0.99 -3.46 113.55 116.16 1sfw h SER 107 Ca -0.14 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.18 1sfw h SER 107 Cb 1.79 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.88 1sfw h SER 107 CO 0.21 0.23 0.00 2.29 -0.87 0.00 0.00 176.83 178.68 1sfw n LYS 108 N -3.79 0.00 0.00 4.77 2.85 -1.08 -4.93 118.16 115.98 1sfw n LYS 108 Ca -0.02 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.24 1sfw n LYS 108 Cb 0.33 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.71 1sfw n LYS 108 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1sfw n ALA 109 N -1.06 0.00 -1.58 0.58 0.00 -0.71 -2.95 120.51 114.79 1sfw n ALA 109 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 53.44 53.10 1sfw n ALA 109 Cb 0.00 0.00 0.06 0.00 0.00 0.00 0.00 19.45 19.51 1sfw n ALA 109 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1sfw n PRO 110 N 0.00 2.85 -1.10 0.00 -0.04 -1.26 -5.08 135.00 130.37 1sfw n PRO 110 Ca 0.00 -3.50 -0.37 0.00 -0.04 0.00 0.00 63.50 59.59 1sfw n PRO 110 Cb 0.00 -2.28 0.03 0.00 -0.04 0.00 0.00 33.50 31.21 1sfw n PRO 110 CO 0.00 0.00 0.00 0.98 -0.04 0.00 0.00 175.50 176.44 1sfw n TYR 111 N -0.80 -4.18 -3.53 0.54 9.36 -1.15 -4.95 117.16 112.45 1sfw n TYR 111 Ca 0.58 0.17 -0.20 0.00 3.32 0.00 0.00 57.90 61.76 1sfw n TYR 111 Cb 0.62 -1.55 -0.14 0.00 -0.63 0.00 0.00 39.34 37.64 1sfw n TYR 111 CO 0.00 0.00 0.00 -0.80 0.22 0.00 0.00 176.86 176.28 1sfw s ASN 112 N -1.02 1.64 -1.00 2.98 0.01 -1.26 -5.07 114.94 111.21 1sfw s ASN 112 Ca 0.47 -0.32 -0.01 0.00 -0.71 0.00 0.00 52.86 52.29 1sfw s ASN 112 Cb -0.31 0.20 0.32 0.00 0.41 0.00 0.00 41.25 41.87 1sfw s ASN 112 CO 0.76 -0.33 1.62 2.29 -1.51 0.00 0.00 177.10 179.92 1sfw n LYS 113 N 5.31 4.88 0.14 -0.60 -0.00 -1.26 -4.38 118.16 122.24 1sfw n LYS 113 Ca -0.06 -4.65 0.00 0.00 -0.00 0.00 0.00 58.31 53.61 1sfw n LYS 113 Cb 0.49 -2.46 0.00 0.00 -0.00 0.00 0.00 35.03 33.06 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 0.42 0.00 -2.93 -1.58 4.07 -1.26 -4.75 120.64 114.61 1sfw n GLU 114 Ca 0.38 0.00 -0.44 0.00 -0.06 0.00 0.00 57.16 57.05 1sfw n GLU 114 Cb 0.30 0.00 -0.04 0.00 -0.06 0.00 0.00 31.44 31.64 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 2.81 0.29 4.31 -3.43 -1.26 -5.00 115.29 111.01 1sfw s HIS 115 Ca 0.00 -0.76 0.09 0.00 -0.80 0.00 0.00 55.06 53.59 1sfw s HIS 115 Cb 0.00 -4.22 -0.06 0.00 -1.43 0.00 0.00 32.58 26.87 1sfw s HIS 115 CO 0.00 -1.54 -0.11 0.21 -2.00 0.00 0.00 174.74 171.30 1sfw s LYS 116 N 3.54 1.63 0.00 -0.38 2.47 -1.26 -4.32 119.74 121.42 1sfw s LYS 116 Ca 0.21 -1.81 0.00 0.00 -1.56 0.00 0.00 55.97 52.81 1sfw s LYS 116 Cb -0.17 -1.45 0.00 0.00 -1.46 0.00 0.00 37.83 34.75 1sfw s LYS 116 CO 0.07 0.15 0.00 -1.71 0.16 0.00 0.00 175.35 174.02 1sfw n ASN 117 N -0.63 -3.48 -4.19 1.43 2.85 -0.73 -4.96 115.26 105.55 1sfw n ASN 117 Ca -0.06 0.00 -0.29 0.00 -0.11 0.00 0.00 54.58 54.13 1sfw n ASN 117 Cb 0.62 -1.27 0.26 0.00 1.24 0.00 0.00 39.78 40.63 1sfw n ASN 117 CO 0.00 0.00 0.00 -0.76 -2.11 0.00 0.00 177.26 174.39 1sfw s LEU 118 N 0.00 0.31 0.00 1.20 1.02 -1.20 -5.01 118.68 115.00 1sfw s LEU 118 Ca 0.00 1.22 0.00 0.00 0.02 0.00 0.00 54.13 55.37 1sfw s LEU 118 Cb 0.00 -3.00 0.00 0.00 0.02 0.00 0.00 46.19 43.21 1sfw s LEU 118 CO 0.00 -4.44 0.00 -0.67 0.02 0.00 0.00 176.35 171.26 1sfw n ASP 119 N -5.05 0.00 -2.99 2.29 -0.08 -1.26 -4.76 116.55 104.69 1sfw n ASP 119 Ca 0.06 0.00 -0.15 0.00 -1.51 0.00 0.00 54.79 53.19 1sfw n ASP 119 Cb 0.57 0.00 0.02 0.00 2.34 0.00 0.00 41.12 44.04 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 0.00 -0.14 0.02 5.18 -2.24 -1.26 -4.41 114.28 111.43 1sfw n THR 120 Ca 0.00 -3.19 0.00 0.00 -2.27 0.00 0.00 64.05 58.59 1sfw n THR 120 Cb 0.00 0.36 0.00 0.00 -2.10 0.00 0.00 70.33 68.59 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 0.50 0.00 -0.25 -0.78 5.02 -1.26 -3.89 118.16 117.50 1sfw n LYS 121 Ca 0.17 0.00 0.02 0.00 -2.02 0.00 0.00 58.31 56.47 1sfw n LYS 121 Cb 0.66 0.00 0.15 0.00 -0.02 0.00 0.00 35.03 35.82 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 0.59 0.04 1.97 1.57 -1.98 -3.33 116.57 115.43 1sfw h LYS 122 Ca 0.00 -0.04 -0.00 0.00 -1.87 0.00 0.00 60.65 58.74 1sfw h LYS 122 Cb 0.00 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 32.18 1sfw h LYS 122 CO 0.00 0.39 -0.02 1.88 -0.57 0.00 0.00 179.45 181.13 1sfw h TYR 123 N 0.60 -0.05 0.00 -1.35 0.05 -1.84 -3.52 116.97 110.86 1sfw h TYR 123 Ca 0.36 -0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.14 1sfw h TYR 123 Cb 0.40 0.02 0.00 0.00 1.01 0.00 0.00 36.73 38.15 1sfw h TYR 123 CO -0.11 0.61 0.00 0.00 -1.05 0.00 0.00 178.16 177.61