#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kf3 s ILE 4 N 0.00 0.00 -0.01 2.52 2.07 -1.26 -5.05 121.20 119.47 2kf3 s ILE 4 Ca 0.00 -0.01 0.18 0.00 -1.41 0.00 0.00 60.65 59.40 2kf3 s ILE 4 Cb 0.00 -1.03 0.29 0.00 0.13 0.00 0.00 42.46 41.86 2kf3 s ILE 4 CO 0.00 0.00 1.12 -0.46 -1.91 0.00 0.00 174.94 173.69 2kf3 n ASN 5 N -0.20 0.35 -4.86 4.50 0.23 -1.26 -4.89 115.26 109.14 2kf3 n ASN 5 Ca -0.06 -2.00 -0.23 0.00 -0.53 0.00 0.00 54.58 51.76 2kf3 n ASN 5 Cb 0.61 -0.10 -0.04 0.00 -2.08 0.00 0.00 39.78 38.16 2kf3 n ASN 5 CO 0.00 0.00 0.00 0.42 -0.93 0.00 0.00 177.26 176.75 2kf3 s THR 6 N -0.05 4.69 0.05 5.53 -4.23 -1.26 0.30 115.64 120.66 2kf3 s THR 6 Ca 0.23 -1.18 -0.31 0.00 -1.18 0.00 0.00 61.69 59.24 2kf3 s THR 6 Cb 0.26 -3.49 -0.17 0.00 1.34 0.00 0.00 72.50 70.44 2kf3 s THR 6 CO -0.11 -0.27 1.45 2.19 -0.54 0.00 0.00 174.62 177.34 2kf3 h PHE 7 N 1.71 -1.04 -0.87 3.99 -0.00 -1.97 0.36 116.94 119.12 2kf3 h PHE 7 Ca -0.49 -0.02 0.07 0.00 -0.00 0.00 0.00 57.97 57.53 2kf3 h PHE 7 Cb 1.22 0.34 -0.06 0.00 -0.00 0.00 0.00 35.95 37.45 2kf3 h PHE 7 CO 0.54 -0.65 0.53 -0.44 -0.00 0.00 0.00 178.31 178.30 2kf3 h ASP 8 N -1.14 0.83 -0.53 -0.68 5.19 -1.98 0.64 116.42 118.75 2kf3 h ASP 8 Ca -0.11 0.02 0.03 0.00 -0.62 0.00 0.00 57.03 56.35 2kf3 h ASP 8 Cb 0.86 -0.15 -0.04 0.00 0.18 0.00 0.00 39.33 40.18 2kf3 h ASP 8 CO 0.19 0.51 0.30 1.23 -3.12 0.00 0.00 179.24 178.36 2kf3 h GLY 9 N 0.95 0.75 1.03 2.75 0.00 -1.94 0.61 103.07 107.22 2kf3 h GLY 9 Ca 0.39 -0.22 -0.09 0.00 0.00 0.00 0.00 47.33 47.40 2kf3 h GLY 9 CO -0.19 0.18 -0.05 -2.08 0.00 0.00 0.00 176.54 174.40 2kf3 h VAL 10 N 0.60 1.27 0.89 4.60 2.07 0.09 -0.51 116.25 125.26 2kf3 h VAL 10 Ca 0.22 -1.16 -0.04 0.00 0.82 0.00 0.00 66.70 66.54 2kf3 h VAL 10 Cb 0.06 1.01 0.01 0.00 -1.52 0.00 0.00 31.29 30.85 2kf3 h VAL 10 CO -0.11 0.40 -0.43 0.00 0.02 0.00 0.00 177.57 177.45 2kf3 h ALA 11 N 0.92 -1.20 -0.42 1.67 0.00 -0.14 0.58 119.26 120.67 2kf3 h ALA 11 Ca 0.13 -0.26 0.09 0.00 0.00 0.00 0.00 54.91 54.87 2kf3 h ALA 11 Cb 0.58 0.46 -0.09 0.00 0.00 0.00 0.00 17.79 18.75 2kf3 h ALA 11 CO 0.03 -1.14 -0.22 -0.44 0.00 0.00 0.00 179.25 177.48 2kf3 h ASP 12 N -1.27 -0.75 -0.22 0.00 5.19 0.24 2.40 116.42 122.01 2kf3 h ASP 12 Ca -0.12 0.17 0.01 0.00 -0.62 0.00 0.00 57.03 56.46 2kf3 h ASP 12 Cb 0.92 0.40 -0.01 0.00 0.18 0.00 0.00 39.33 40.81 2kf3 h ASP 12 CO 0.20 -0.25 0.13 0.22 -3.12 0.00 0.00 179.24 176.42 2kf3 h TYR 13 N -0.14 0.25 -0.11 4.55 3.20 -0.94 -1.00 116.97 122.78 2kf3 h TYR 13 Ca 0.20 0.01 -0.12 0.00 3.14 0.00 0.00 58.73 61.96 2kf3 h TYR 13 Cb 0.46 -0.08 0.00 0.00 1.54 0.00 0.00 36.73 38.65 2kf3 h TYR 13 CO -0.46 0.15 -0.41 1.25 -1.64 0.00 0.00 178.16 177.05 2kf3 h LEU 14 N 0.27 0.54 -2.36 2.82 6.46 0.12 -0.37 115.31 122.79 2kf3 h LEU 14 Ca 0.09 -0.62 -0.01 0.00 -0.12 0.00 0.00 57.88 57.22 2kf3 h LEU 14 Cb -0.01 -0.16 -0.00 0.00 -0.73 0.00 0.00 40.66 39.76 2kf3 h LEU 14 CO -0.04 1.07 -0.04 1.56 -0.62 0.00 0.00 178.44 180.38 2kf3 h GLN 15 N 0.05 0.00 0.05 1.25 4.20 0.41 0.54 115.11 121.61 2kf3 h GLN 15 Ca -0.02 0.00 -0.37 0.00 0.06 0.00 0.00 58.65 58.32 2kf3 h GLN 15 Cb 1.04 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 28.78 2kf3 h GLN 15 CO 0.09 0.04 -2.16 2.41 -0.67 0.00 0.00 178.83 178.53 2kf3 n THR 16 N -3.42 1.62 -0.74 -0.54 -1.04 -0.39 -4.51 114.28 105.26 2kf3 n THR 16 Ca -0.02 -0.53 0.08 0.00 -2.04 0.00 0.00 64.05 61.54 2kf3 n THR 16 Cb 0.15 -1.67 0.25 0.00 -1.82 0.00 0.00 70.33 67.24 2kf3 n THR 16 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 2kf3 n TYR 17 N -3.58 0.92 -1.76 -1.42 4.01 -0.16 -4.95 117.16 110.23 2kf3 n TYR 17 Ca -0.40 -0.74 -0.07 0.00 -0.16 0.00 0.00 57.90 56.53 2kf3 n TYR 17 Cb 0.97 -0.24 -0.02 0.00 -0.31 0.00 0.00 39.34 39.74 2kf3 n TYR 17 CO 0.00 0.00 0.00 0.72 -0.46 0.00 0.00 176.86 177.12 2kf3 n HIS 18 N -0.03 -1.09 -3.96 -0.72 8.25 0.19 -4.87 115.22 112.97 2kf3 n HIS 18 Ca 0.19 0.00 -0.09 0.00 -0.26 0.00 0.00 57.72 57.56 2kf3 n HIS 18 Cb 0.78 -1.93 -0.10 0.00 1.12 0.00 0.00 29.99 29.86 2kf3 n HIS 18 CO 0.00 0.00 0.00 -1.59 0.64 0.00 0.00 176.34 175.39 2kf3 s LYS 19 N -3.66 0.41 0.49 -0.41 -2.85 -1.23 -5.03 119.74 107.45 2kf3 s LYS 19 Ca 0.00 -0.64 -0.20 0.00 -1.00 0.00 0.00 55.97 54.13 2kf3 s LYS 19 Cb 0.00 0.15 -0.08 0.00 -2.06 0.00 0.00 37.83 35.84 2kf3 s LYS 19 CO 0.00 -0.08 1.03 -0.51 0.10 0.00 0.00 175.35 175.89 2kf3 s LEU 20 N -1.65 3.83 0.60 2.77 1.02 -1.26 -3.15 118.68 120.83 2kf3 s LEU 20 Ca -0.12 1.89 -0.18 0.00 0.02 0.00 0.00 54.13 55.74 2kf3 s LEU 20 Cb -0.07 -4.56 -0.15 0.00 0.02 0.00 0.00 46.19 41.44 2kf3 s LEU 20 CO -0.02 -0.77 -0.23 -2.65 0.02 0.00 0.00 176.35 172.71 2kf3 n PRO 21 N -1.02 0.01 -0.28 1.29 -0.02 -1.26 -4.67 135.00 129.05 2kf3 n PRO 21 Ca 0.09 0.01 -0.03 0.00 -2.02 0.00 0.00 63.50 61.55 2kf3 n PRO 21 Cb 0.53 -1.02 -0.04 0.00 -0.02 0.00 0.00 33.50 32.94 2kf3 n PRO 21 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 2kf3 n ASP 22 N 2.61 1.68 -0.63 2.55 5.68 -1.26 -2.31 116.55 124.87 2kf3 n ASP 22 Ca 0.06 -1.73 -0.03 0.00 -0.50 0.00 0.00 54.79 52.60 2kf3 n ASP 22 Cb 0.49 -0.43 -0.03 0.00 -1.14 0.00 0.00 41.12 40.01 2kf3 n ASP 22 CO 0.00 0.00 0.00 -0.46 -1.33 0.00 0.00 177.20 175.41 2kf3 n ASN 23 N 2.60 -0.37 -4.13 -1.12 6.94 -1.26 -4.68 115.26 113.23 2kf3 n ASN 23 Ca 0.10 -0.86 -0.33 0.00 -0.02 0.00 0.00 54.58 53.47 2kf3 n ASN 23 Cb 0.26 0.11 -0.16 0.00 -2.36 0.00 0.00 39.78 37.64 2kf3 n ASN 23 CO 0.00 0.00 0.00 -0.31 -1.03 0.00 0.00 177.26 175.92 2kf3 s TYR 24 N 0.00 2.88 -0.03 -2.53 2.02 -0.98 -0.58 117.35 118.13 2kf3 s TYR 24 Ca 0.00 -1.70 0.07 0.00 -0.37 0.00 0.00 57.07 55.07 2kf3 s TYR 24 Cb 0.00 -1.94 -0.02 0.00 -0.40 0.00 0.00 41.96 39.60 2kf3 s TYR 24 CO 0.00 -0.80 -0.26 0.96 -1.57 0.00 0.00 175.55 173.88 2kf3 s ILE 25 N 1.28 2.07 0.96 2.71 -4.36 -0.06 -4.81 121.20 118.98 2kf3 s ILE 25 Ca 0.03 -1.09 -0.12 0.00 -0.26 0.00 0.00 60.65 59.21 2kf3 s ILE 25 Cb -0.14 -1.72 0.16 0.00 1.25 0.00 0.00 42.46 42.01 2kf3 s ILE 25 CO -0.11 0.58 1.09 0.42 0.24 0.00 0.00 174.94 177.16 2kf3 s THR 26 N -0.49 2.37 0.23 8.37 -4.23 -0.78 -0.07 115.64 121.04 2kf3 s THR 26 Ca 0.06 0.12 0.01 0.00 -1.18 0.00 0.00 61.69 60.70 2kf3 s THR 26 Cb -0.11 -2.57 -0.02 0.00 1.34 0.00 0.00 72.50 71.14 2kf3 s THR 26 CO 0.00 -0.16 1.58 0.11 -0.54 0.00 0.00 174.62 175.62 2kf3 h LYS 27 N -1.77 0.42 -0.14 3.99 1.57 -1.95 -0.69 116.57 118.01 2kf3 h LYS 27 Ca -0.52 -0.24 0.02 0.00 -1.87 0.00 0.00 60.65 58.03 2kf3 h LYS 27 Cb 1.30 0.02 -0.03 0.00 0.08 0.00 0.00 32.23 33.61 2kf3 h LYS 27 CO 0.55 0.82 -0.17 0.77 -0.57 0.00 0.00 179.45 180.85 2kf3 h SER 28 N 0.34 -0.57 0.83 0.86 0.02 -1.98 1.73 113.55 114.77 2kf3 h SER 28 Ca 0.02 0.08 -0.04 0.00 -0.84 0.00 0.00 61.79 61.00 2kf3 h SER 28 Cb 0.98 0.24 0.01 0.00 0.14 0.00 0.00 62.40 63.77 2kf3 h SER 28 CO 0.09 -0.12 -0.40 -0.33 -1.14 0.00 0.00 176.83 174.93 2kf3 h GLU 29 N -0.11 -1.08 -0.88 3.45 5.08 -1.91 -0.97 114.58 118.16 2kf3 h GLU 29 Ca 0.02 0.07 0.15 0.00 -1.00 0.00 0.00 59.36 58.61 2kf3 h GLU 29 Cb 0.17 0.24 -0.15 0.00 0.50 0.00 0.00 28.75 29.52 2kf3 h GLU 29 CO -0.19 -0.71 -0.29 0.00 -1.00 0.00 0.00 179.01 176.81 2kf3 n ALA 30 N -2.58 0.02 0.30 3.43 0.00 -0.27 0.10 120.51 121.51 2kf3 n ALA 30 Ca -0.15 0.92 -0.17 0.00 0.00 0.00 0.00 53.44 54.04 2kf3 n ALA 30 Cb 0.45 -0.47 -0.08 0.00 0.00 0.00 0.00 19.45 19.34 2kf3 n ALA 30 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 2kf3 h GLN 31 N 0.00 -0.75 0.00 0.00 4.20 0.29 -2.30 115.11 116.55 2kf3 h GLN 31 Ca 0.35 0.05 -0.02 0.00 0.06 0.00 0.00 58.65 59.09 2kf3 h GLN 31 Cb 0.57 0.17 -0.00 0.00 0.30 0.00 0.00 27.48 28.52 2kf3 h GLN 31 CO -0.89 -0.50 -0.10 0.00 -0.67 0.00 0.00 178.83 176.67 2kf3 h ALA 32 N -0.34 1.74 0.00 3.87 0.00 0.41 -0.77 119.26 124.18 2kf3 h ALA 32 Ca -0.07 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.73 2kf3 h ALA 32 Cb 0.62 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.39 2kf3 h ALA 32 CO 0.08 0.13 -0.09 1.25 0.00 0.00 0.00 179.25 180.62 2kf3 h LEU 33 N 0.00 0.00 0.00 0.00 5.85 0.12 -3.45 115.31 117.83 2kf3 h LEU 33 Ca -0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 2kf3 h LEU 33 Cb 0.19 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.22 2kf3 h LEU 33 CO 0.01 0.09 0.00 0.61 -0.34 0.00 0.00 178.44 178.81 2kf3 n GLY 34 N -1.10 0.74 3.81 3.75 0.00 -0.31 -5.07 105.19 107.02 2kf3 n GLY 34 Ca -0.03 -0.21 -0.35 0.00 0.00 0.00 0.00 46.02 45.44 2kf3 n GLY 34 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 2kf3 s TRP 35 N 0.00 3.53 -0.05 1.61 -0.00 -1.08 -4.95 118.94 118.00 2kf3 s TRP 35 Ca 0.00 1.50 -0.00 0.00 -0.00 0.00 0.00 56.10 57.60 2kf3 s TRP 35 Cb 0.00 -2.73 0.03 0.00 -0.00 0.00 0.00 33.47 30.77 2kf3 s TRP 35 CO 0.00 0.16 -0.01 0.08 -0.00 0.00 0.00 176.95 177.18 2kf3 s VAL 36 N -1.78 0.37 0.09 5.86 1.01 -1.26 -4.96 120.40 119.73 2kf3 s VAL 36 Ca 0.51 0.05 -0.26 0.00 0.00 0.00 0.00 61.98 62.28 2kf3 s VAL 36 Cb -0.14 -0.47 -0.14 0.00 0.00 0.00 0.00 36.38 35.63 2kf3 s VAL 36 CO 0.19 0.22 1.69 0.00 0.00 0.00 0.00 175.10 177.20 2kf3 h ALA 37 N 7.74 -0.31 0.00 5.51 0.00 -1.99 0.83 119.26 131.04 2kf3 h ALA 37 Ca -0.30 -0.05 -0.12 0.00 0.00 0.00 0.00 54.91 54.43 2kf3 h ALA 37 Cb 1.14 0.18 -0.03 0.00 0.00 0.00 0.00 17.79 19.08 2kf3 h ALA 37 CO 0.37 -0.69 0.28 -1.13 0.00 0.00 0.00 179.25 178.08 2kf3 n SER 38 N -5.26 2.90 0.00 0.00 3.41 -1.26 -3.05 113.62 110.36 2kf3 n SER 38 Ca -0.08 -2.04 0.00 0.00 -0.26 0.00 0.00 58.87 56.49 2kf3 n SER 38 Cb 0.18 -0.77 0.00 0.00 -0.26 0.00 0.00 64.21 63.36 2kf3 n SER 38 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 2kf3 n LYS 39 N 2.89 0.00 -3.19 4.33 4.81 -1.03 -5.04 118.16 120.93 2kf3 n LYS 39 Ca 0.24 0.00 -0.15 0.00 -0.87 0.00 0.00 58.31 57.54 2kf3 n LYS 39 Cb 0.44 0.00 0.07 0.00 0.02 0.00 0.00 35.03 35.56 2kf3 n LYS 39 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2kf3 n GLY 40 N -1.01 -0.81 3.76 3.14 0.00 0.29 -4.97 105.19 105.59 2kf3 n GLY 40 Ca 0.00 0.39 -0.30 0.00 0.00 0.00 0.00 46.02 46.11 2kf3 n GLY 40 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2kf3 s ASN 41 N -3.63 4.04 0.01 1.61 4.22 -1.26 -4.51 114.94 115.41 2kf3 s ASN 41 Ca 0.30 1.44 0.00 0.00 -2.14 0.00 0.00 52.86 52.46 2kf3 s ASN 41 Cb -0.04 -2.15 0.00 0.00 1.28 0.00 0.00 41.25 40.34 2kf3 s ASN 41 CO 0.69 -2.27 0.00 -0.11 -2.04 0.00 0.00 177.10 173.36 2kf3 n LEU 42 N -3.64 -0.10 0.31 3.54 7.94 -1.26 -4.92 117.00 118.87 2kf3 n LEU 42 Ca 0.07 0.17 0.18 0.00 -1.11 0.00 0.00 56.01 55.33 2kf3 n LEU 42 Cb 0.55 0.27 1.04 0.00 0.53 0.00 0.00 43.42 45.82 2kf3 n LEU 42 CO 0.56 -0.02 1.15 0.00 -1.11 0.00 0.00 177.39 177.97 2kf3 h ALA 43 N 0.00 1.31 0.11 1.96 0.00 -1.81 0.96 119.26 121.79 2kf3 h ALA 43 Ca 0.00 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 2kf3 h ALA 43 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 2kf3 h ALA 43 CO 0.00 -0.00 -0.05 0.38 0.00 0.00 0.00 179.25 179.58 2kf3 h ASP 44 N 0.00 -0.12 0.88 0.00 2.03 -1.95 -1.85 116.42 115.41 2kf3 h ASP 44 Ca 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 2kf3 h ASP 44 Cb 0.00 0.03 0.00 0.00 -0.83 0.00 0.00 39.33 38.53 2kf3 h ASP 44 CO -0.00 0.15 0.00 1.33 -1.03 0.00 0.00 179.24 179.69 2kf3 n VAL 45 N -3.73 0.44 -3.02 4.15 0.24 -1.12 -4.13 118.33 111.15 2kf3 n VAL 45 Ca -0.02 0.06 -0.18 0.00 -2.04 0.00 0.00 64.34 62.16 2kf3 n VAL 45 Cb 0.06 -0.71 -0.02 0.00 -1.47 0.00 0.00 33.84 31.69 2kf3 n VAL 45 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2kf3 n ALA 46 N -1.55 0.96 -1.68 2.33 0.00 0.33 -5.04 120.51 115.86 2kf3 n ALA 46 Ca 0.05 -2.63 -0.45 0.00 0.00 0.00 0.00 53.44 50.41 2kf3 n ALA 46 Cb 0.29 -1.01 -0.04 0.00 0.00 0.00 0.00 19.45 18.69 2kf3 n ALA 46 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 2kf3 n PRO 47 N 1.52 2.43 -2.58 0.00 -0.02 -0.69 -2.35 135.00 133.31 2kf3 n PRO 47 Ca 0.17 0.89 -0.07 0.00 -2.02 0.00 0.00 63.50 62.46 2kf3 n PRO 47 Cb 0.57 -2.75 0.01 0.00 -0.02 0.00 0.00 33.50 31.32 2kf3 n PRO 47 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2kf3 n GLY 48 N 4.17 0.36 3.22 -1.23 0.00 -1.26 -5.04 105.19 105.40 2kf3 n GLY 48 Ca 0.20 -0.47 -0.13 0.00 0.00 0.00 0.00 46.02 45.62 2kf3 n GLY 48 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2kf3 s LYS 49 N -5.02 1.20 0.09 1.61 -0.14 -0.99 -4.82 119.74 111.66 2kf3 s LYS 49 Ca 0.12 -1.62 -0.04 0.00 -1.36 0.00 0.00 55.97 53.07 2kf3 s LYS 49 Cb -0.05 0.13 -0.03 0.00 -1.68 0.00 0.00 37.83 36.20 2kf3 s LYS 49 CO 0.14 -0.34 0.08 -1.12 -0.76 0.00 0.00 175.35 173.36 2kf3 s SER 50 N -3.18 0.31 -0.10 2.83 0.01 0.26 -4.81 113.70 109.01 2kf3 s SER 50 Ca 0.36 -0.96 -0.25 0.00 1.31 0.00 0.00 55.95 56.40 2kf3 s SER 50 Cb 0.07 0.28 -0.02 0.00 0.21 0.00 0.00 66.02 66.56 2kf3 s SER 50 CO 0.10 -0.70 0.81 -0.63 0.41 0.00 0.00 173.24 173.23 2kf3 s ILE 51 N -3.95 4.94 0.00 1.44 -1.09 -1.26 -0.88 121.20 120.40 2kf3 s ILE 51 Ca 0.12 1.63 0.00 0.00 -2.23 0.00 0.00 60.65 60.17 2kf3 s ILE 51 Cb 0.07 -4.13 0.00 0.00 -1.58 0.00 0.00 42.46 36.81 2kf3 s ILE 51 CO -0.06 0.13 0.00 0.61 -1.23 0.00 0.00 174.94 174.39 2kf3 n GLY 52 N 3.24 1.95 0.00 6.18 0.00 0.90 0.49 105.19 117.95 2kf3 n GLY 52 Ca 0.03 -0.53 0.00 0.00 0.00 0.00 0.00 46.02 45.52 2kf3 n GLY 52 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2kf3 n GLY 53 N -0.43 1.99 0.00 -0.02 0.00 -0.62 -1.87 105.19 104.24 2kf3 n GLY 53 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2kf3 n GLY 53 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2kf3 n ASP 54 N 0.00 0.00 -4.12 1.61 9.92 -1.26 -4.87 116.55 117.84 2kf3 n ASP 54 Ca 0.00 0.00 -0.23 0.00 -0.53 0.00 0.00 54.79 54.03 2kf3 n ASP 54 Cb 0.00 0.00 -0.15 0.00 -0.64 0.00 0.00 41.12 40.33 2kf3 n ASP 54 CO 0.00 0.00 0.00 -0.63 0.13 0.00 0.00 177.20 176.70 2kf3 s ILE 55 N 0.00 1.16 -0.77 0.53 1.09 -1.26 -3.94 121.20 118.01 2kf3 s ILE 55 Ca 0.00 -0.62 -0.10 0.00 -1.10 0.00 0.00 60.65 58.82 2kf3 s ILE 55 Cb 0.00 -0.97 0.20 0.00 -1.06 0.00 0.00 42.46 40.63 2kf3 s ILE 55 CO 0.00 0.33 0.67 0.12 -0.10 0.00 0.00 174.94 175.96 2kf3 s PHE 56 N -0.31 3.65 0.00 3.97 2.19 0.24 -4.80 117.98 122.92 2kf3 s PHE 56 Ca 0.05 -2.24 0.00 0.00 0.33 0.00 0.00 56.93 55.07 2kf3 s PHE 56 Cb -0.06 -3.62 0.00 0.00 -1.31 0.00 0.00 43.02 38.03 2kf3 s PHE 56 CO -0.00 -0.94 0.00 -1.13 1.83 0.00 0.00 175.22 174.98 2kf3 n SER 57 N 3.78 0.00 -4.24 6.13 3.41 -1.26 -4.36 113.62 117.08 2kf3 n SER 57 Ca 0.12 -0.49 -0.38 0.00 -0.26 0.00 0.00 58.87 57.86 2kf3 n SER 57 Cb 0.44 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.32 2kf3 n SER 57 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 2kf3 n ASN 58 N 1.48 -1.65 -1.91 4.04 5.15 -1.26 -4.68 115.26 116.43 2kf3 n ASN 58 Ca 0.00 -1.10 -0.02 0.00 -0.60 0.00 0.00 54.58 52.86 2kf3 n ASN 58 Cb 0.00 -1.45 -0.03 0.00 -0.53 0.00 0.00 39.78 37.77 2kf3 n ASN 58 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 2kf3 n ARG 59 N -3.72 0.69 0.00 1.20 1.74 -1.26 -2.34 116.66 112.96 2kf3 n ARG 59 Ca 0.11 -0.17 0.00 0.00 -0.77 0.00 0.00 57.85 57.02 2kf3 n ARG 59 Cb 0.41 -1.41 0.00 0.00 -1.02 0.00 0.00 32.46 30.44 2kf3 n ARG 59 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 2kf3 n GLU 60 N 2.08 1.49 -1.95 5.56 1.02 -1.26 -5.02 120.64 122.55 2kf3 n GLU 60 Ca 0.07 0.00 -0.04 0.00 -0.02 0.00 0.00 57.16 57.18 2kf3 n GLU 60 Cb 0.33 -0.27 -0.00 0.00 -0.02 0.00 0.00 31.44 31.48 2kf3 n GLU 60 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2kf3 n GLY 61 N 0.02 0.28 0.56 0.62 0.00 -0.99 -4.92 105.19 100.75 2kf3 n GLY 61 Ca 0.00 -0.76 0.05 0.00 0.00 0.00 0.00 46.02 45.31 2kf3 n GLY 61 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2kf3 n LYS 62 N -1.54 2.38 -4.38 1.61 5.02 -1.26 -4.98 118.16 115.02 2kf3 n LYS 62 Ca -0.04 -1.83 -0.20 0.00 -2.02 0.00 0.00 58.31 54.22 2kf3 n LYS 62 Cb 0.48 -1.24 -0.14 0.00 -0.02 0.00 0.00 35.03 34.11 2kf3 n LYS 62 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2kf3 s LEU 63 N -0.97 2.12 0.11 -0.35 1.43 -1.26 -5.00 118.68 114.75 2kf3 s LEU 63 Ca 0.20 -0.37 -0.31 0.00 -1.03 0.00 0.00 54.13 52.62 2kf3 s LEU 63 Cb 0.11 -0.56 -0.10 0.00 0.03 0.00 0.00 46.19 45.67 2kf3 s LEU 63 CO 0.14 0.05 1.80 -2.16 0.23 0.00 0.00 176.35 176.42 2kf3 s PRO 64 N -0.86 4.15 0.19 1.29 0.04 -1.26 -5.01 135.00 133.54 2kf3 s PRO 64 Ca 0.02 2.54 0.03 0.00 0.04 0.00 0.00 61.00 63.63 2kf3 s PRO 64 Cb -0.07 -3.62 0.03 0.00 0.04 0.00 0.00 34.50 30.89 2kf3 s PRO 64 CO 0.01 -0.83 0.25 0.41 0.04 0.00 0.00 177.00 176.88 2kf3 n GLY 65 N 4.20 2.05 0.00 0.56 0.00 -1.26 -5.03 105.19 105.71 2kf3 n GLY 65 Ca 0.17 -2.17 0.00 0.00 0.00 0.00 0.00 46.02 44.03 2kf3 n GLY 65 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2kf3 n LYS 66 N -1.37 0.00 -0.51 1.61 4.81 -1.26 -5.01 118.16 116.43 2kf3 n LYS 66 Ca 0.05 0.00 -0.14 0.00 -0.87 0.00 0.00 58.31 57.35 2kf3 n LYS 66 Cb 0.20 0.00 -0.02 0.00 0.02 0.00 0.00 35.03 35.23 2kf3 n LYS 66 CO 0.00 0.00 0.00 -1.13 1.17 0.00 0.00 177.40 177.44 2kf3 n SER 67 N 0.00 3.36 0.00 3.14 3.41 -1.26 -3.64 113.62 118.63 2kf3 n SER 67 Ca 0.00 -2.18 0.00 0.00 -0.26 0.00 0.00 58.87 56.43 2kf3 n SER 67 Cb 0.00 -0.88 0.00 0.00 -0.26 0.00 0.00 64.21 63.07 2kf3 n SER 67 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2kf3 n GLY 68 N 3.68 -0.63 3.65 5.00 0.00 -1.26 -5.19 105.19 110.44 2kf3 n GLY 68 Ca 0.30 0.26 -0.01 0.00 0.00 0.00 0.00 46.02 46.56 2kf3 n GLY 68 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2kf3 s ARG 69 N 0.00 0.63 0.04 1.61 3.52 -1.24 -5.03 118.95 118.48 2kf3 s ARG 69 Ca 0.00 -0.33 -0.05 0.00 -0.13 0.00 0.00 55.73 55.22 2kf3 s ARG 69 Cb 0.00 0.23 -0.01 0.00 -1.56 0.00 0.00 34.95 33.60 2kf3 s ARG 69 CO 0.00 -0.29 0.08 0.99 -0.81 0.00 0.00 175.30 175.28 2kf3 s THR 70 N -2.70 0.14 -0.03 4.11 2.01 -1.26 -4.94 115.64 112.97 2kf3 s THR 70 Ca 0.12 -1.14 0.05 0.00 0.31 0.00 0.00 61.69 61.04 2kf3 s THR 70 Cb 0.02 -0.92 -0.01 0.00 0.01 0.00 0.00 72.50 71.60 2kf3 s THR 70 CO -0.03 -0.63 -0.19 0.26 -0.69 0.00 0.00 174.62 173.35 2kf3 s TRP 71 N -2.67 1.75 0.14 4.92 0.52 -1.26 -0.26 118.94 122.07 2kf3 s TRP 71 Ca -0.04 -0.39 0.06 0.00 0.02 0.00 0.00 56.10 55.74 2kf3 s TRP 71 Cb -0.01 -1.15 -0.04 0.00 -1.15 0.00 0.00 33.47 31.13 2kf3 s TRP 71 CO -0.05 -0.08 -0.13 1.03 0.02 0.00 0.00 176.95 177.74 2kf3 s ARG 72 N -0.29 1.06 0.37 4.98 0.52 -0.31 0.80 118.95 126.08 2kf3 s ARG 72 Ca 0.03 -1.31 0.08 0.00 -0.52 0.00 0.00 55.73 54.01 2kf3 s ARG 72 Cb -0.09 -0.88 -0.07 0.00 0.52 0.00 0.00 34.95 34.43 2kf3 s ARG 72 CO 0.00 0.16 -0.04 -1.83 0.02 0.00 0.00 175.30 173.61 2kf3 s GLU 73 N -2.96 1.87 -0.28 3.54 -1.05 -1.25 -1.33 118.70 117.24 2kf3 s GLU 73 Ca 0.12 -2.02 -0.21 0.00 -0.15 0.00 0.00 54.97 52.71 2kf3 s GLU 73 Cb -0.03 -1.62 0.12 0.00 -0.44 0.00 0.00 34.13 32.15 2kf3 s GLU 73 CO 0.03 0.03 0.94 0.00 0.95 0.00 0.00 175.26 177.21 2kf3 s ALA 74 N -2.70 -2.04 0.73 -0.84 0.00 -0.76 -1.59 121.76 114.58 2kf3 s ALA 74 Ca 0.34 2.06 -0.15 0.00 0.00 0.00 0.00 51.96 54.20 2kf3 s ALA 74 Cb 0.07 -1.50 0.03 0.00 0.00 0.00 0.00 23.12 21.72 2kf3 s ALA 74 CO 0.17 -0.30 1.14 -0.25 0.00 0.00 0.00 175.76 176.52 2kf3 n ASP 75 N 2.97 1.09 -3.96 0.00 9.92 0.18 -1.38 116.55 125.37 2kf3 n ASP 75 Ca -0.15 0.68 -0.16 0.00 -0.53 0.00 0.00 54.79 54.63 2kf3 n ASP 75 Cb 0.57 -1.48 -0.14 0.00 -0.64 0.00 0.00 41.12 39.42 2kf3 n ASP 75 CO 0.00 0.00 0.00 -0.63 0.13 0.00 0.00 177.20 176.70 2kf3 s ILE 76 N -1.81 0.42 -0.75 0.53 -1.09 -0.82 -4.71 121.20 112.96 2kf3 s ILE 76 Ca 0.76 -0.28 -0.01 0.00 -2.23 0.00 0.00 60.65 58.89 2kf3 s ILE 76 Cb -0.33 -0.36 -0.01 0.00 -1.58 0.00 0.00 42.46 40.18 2kf3 s ILE 76 CO 0.48 0.08 0.70 0.59 -1.23 0.00 0.00 174.94 175.56 2kf3 n ASN 77 N 2.85 -7.55 -4.35 3.58 3.02 0.15 -4.61 115.26 108.34 2kf3 n ASN 77 Ca -0.13 -0.13 -0.19 0.00 -0.03 0.00 0.00 54.58 54.09 2kf3 n ASN 77 Cb 0.58 -5.20 -0.10 0.00 -0.61 0.00 0.00 39.78 34.45 2kf3 n ASN 77 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 2kf3 s TYR 78 N -3.04 1.74 0.00 3.10 5.04 -1.26 -4.97 117.35 117.97 2kf3 s TYR 78 Ca 0.05 -0.55 0.00 0.00 -2.44 0.00 0.00 57.07 54.13 2kf3 s TYR 78 Cb -0.01 -0.81 0.00 0.00 0.35 0.00 0.00 41.96 41.49 2kf3 s TYR 78 CO 0.73 0.37 0.00 0.25 -1.34 0.00 0.00 175.55 175.56 2kf3 n THR 79 N -0.31 0.00 -3.35 4.34 -2.24 -1.26 -4.95 114.28 106.51 2kf3 n THR 79 Ca -0.08 0.00 -0.10 0.00 -2.27 0.00 0.00 64.05 61.59 2kf3 n THR 79 Cb 0.60 -0.01 -0.08 0.00 -2.10 0.00 0.00 70.33 68.74 2kf3 n THR 79 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 2kf3 s SER 80 N 0.12 0.42 0.00 3.42 0.15 -1.26 -4.56 113.70 111.99 2kf3 s SER 80 Ca 0.00 0.02 0.00 0.00 0.70 0.00 0.00 55.95 56.67 2kf3 s SER 80 Cb 0.00 1.04 0.00 0.00 -1.71 0.00 0.00 66.02 65.35 2kf3 s SER 80 CO 0.00 -0.32 0.00 0.61 1.20 0.00 0.00 173.24 174.73 2kf3 n GLY 81 N 5.36 -0.97 0.00 9.45 0.00 -1.26 -4.98 105.19 112.78 2kf3 n GLY 81 Ca -0.03 0.39 0.00 0.00 0.00 0.00 0.00 46.02 46.38 2kf3 n GLY 81 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 2kf3 n PHE 82 N 0.00 0.00 0.00 1.61 7.35 -1.26 -4.37 117.46 120.78 2kf3 n PHE 82 Ca 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.69 2kf3 n PHE 82 Cb 0.00 0.00 0.00 0.00 0.35 0.00 0.00 39.48 39.83 2kf3 n PHE 82 CO 0.00 0.00 0.00 0.54 -0.76 0.00 0.00 176.76 176.54 2kf3 n ARG 83 N 0.00 1.46 0.00 -4.13 1.74 -1.26 -4.88 116.66 109.59 2kf3 n ARG 83 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 2kf3 n ARG 83 Cb 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.44 2kf3 n ARG 83 CO 0.00 0.00 0.00 0.27 -1.52 0.00 0.00 177.63 176.38 2kf3 n ASN 84 N 0.00 0.00 -0.03 0.55 0.23 -1.26 -5.03 115.26 109.71 2kf3 n ASN 84 Ca 0.00 0.00 0.10 0.00 -0.53 0.00 0.00 54.58 54.15 2kf3 n ASN 84 Cb 0.00 0.00 -0.05 0.00 -2.08 0.00 0.00 39.78 37.65 2kf3 n ASN 84 CO 0.00 0.00 0.00 -1.54 -0.93 0.00 0.00 177.26 174.79 2kf3 n SER 85 N 0.00 0.98 -4.62 0.53 3.41 -1.26 -4.72 113.62 107.93 2kf3 n SER 85 Ca 0.00 -0.90 -0.42 0.00 -0.26 0.00 0.00 58.87 57.29 2kf3 n SER 85 Cb 0.00 0.84 -0.05 0.00 -0.26 0.00 0.00 64.21 64.74 2kf3 n SER 85 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2kf3 s ASP 86 N -2.96 6.70 0.02 4.04 2.15 -1.26 -1.15 116.67 124.20 2kf3 s ASP 86 Ca 0.09 0.75 0.00 0.00 0.43 0.00 0.00 52.55 53.82 2kf3 s ASP 86 Cb 0.16 -2.42 -0.02 0.00 -0.30 0.00 0.00 42.92 40.35 2kf3 s ASP 86 CO 0.82 -0.60 -0.03 -0.13 -0.17 0.00 0.00 175.17 175.06 2kf3 s ARG 87 N 2.96 0.28 -0.04 4.34 1.81 -1.16 -1.95 118.95 125.19 2kf3 s ARG 87 Ca 0.33 -0.53 0.05 0.00 -1.72 0.00 0.00 55.73 53.86 2kf3 s ARG 87 Cb -0.14 0.06 -0.02 0.00 -0.45 0.00 0.00 34.95 34.39 2kf3 s ARG 87 CO 0.12 -0.03 -0.18 -1.50 -0.68 0.00 0.00 175.30 173.02 2kf3 s ILE 88 N -1.23 2.75 -0.16 1.52 2.07 -0.48 -1.09 121.20 124.59 2kf3 s ILE 88 Ca -0.13 -0.84 0.00 0.00 -1.41 0.00 0.00 60.65 58.27 2kf3 s ILE 88 Cb -0.08 -2.05 -0.00 0.00 0.13 0.00 0.00 42.46 40.45 2kf3 s ILE 88 CO -0.01 0.59 -0.15 -0.76 -1.91 0.00 0.00 174.94 172.70 2kf3 s LEU 89 N -0.65 2.51 -0.13 8.50 2.01 0.44 -1.83 118.68 129.54 2kf3 s LEU 89 Ca 0.10 -0.46 0.02 0.00 0.01 0.00 0.00 54.13 53.80 2kf3 s LEU 89 Cb -0.11 -1.57 -0.00 0.00 0.01 0.00 0.00 46.19 44.52 2kf3 s LEU 89 CO 0.00 0.08 -0.18 -0.72 1.01 0.00 0.00 176.35 176.54 2kf3 s TYR 90 N 0.82 2.71 0.30 0.29 1.13 -0.44 0.90 117.35 123.06 2kf3 s TYR 90 Ca -0.05 -1.02 -0.01 0.00 -1.41 0.00 0.00 57.07 54.59 2kf3 s TYR 90 Cb -0.15 -1.82 -0.04 0.00 -1.10 0.00 0.00 41.96 38.85 2kf3 s TYR 90 CO -0.00 -0.43 0.51 -1.54 -2.51 0.00 0.00 175.55 171.58 2kf3 s SER 91 N 0.59 6.35 0.56 -0.18 1.04 0.18 -1.16 113.70 121.08 2kf3 s SER 91 Ca -0.10 0.49 0.35 0.00 0.48 0.00 0.00 55.95 57.16 2kf3 s SER 91 Cb -0.16 -2.05 1.49 0.00 0.10 0.00 0.00 66.02 65.40 2kf3 s SER 91 CO 0.03 -0.21 2.03 0.77 0.98 0.00 0.00 173.24 176.84 2kf3 h SER 92 N 1.23 0.00 -0.08 7.02 4.64 -0.96 -1.81 113.55 123.58 2kf3 h SER 92 Ca -0.49 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.83 2kf3 h SER 92 Cb 1.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 2kf3 h SER 92 CO 0.64 0.00 0.00 0.47 -0.87 0.00 0.00 176.83 177.07 2kf3 n ASP 93 N -3.10 0.43 -0.21 4.97 8.00 -1.26 -4.84 116.55 120.55 2kf3 n ASP 93 Ca 0.00 -1.97 -0.02 0.00 0.71 0.00 0.00 54.79 53.51 2kf3 n ASP 93 Cb 0.28 -0.05 -0.00 0.00 -0.02 0.00 0.00 41.12 41.32 2kf3 n ASP 93 CO 0.00 0.00 0.00 1.87 -0.39 0.00 0.00 177.20 178.68 2kf3 n TRP 94 N -0.28 -0.08 -3.96 1.24 -0.00 -0.68 -5.04 117.44 108.64 2kf3 n TRP 94 Ca 0.03 0.00 -0.36 0.00 -0.00 0.00 0.00 57.50 57.18 2kf3 n TRP 94 Cb 0.07 -1.23 -0.08 0.00 -0.00 0.00 0.00 31.31 30.07 2kf3 n TRP 94 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 177.69 177.18 2kf3 s LEU 95 N -0.52 4.11 -0.23 5.87 1.43 -1.24 -4.92 118.68 123.18 2kf3 s LEU 95 Ca 0.00 0.29 -0.05 0.00 -1.03 0.00 0.00 54.13 53.34 2kf3 s LEU 95 Cb 0.00 -2.01 -0.01 0.00 0.03 0.00 0.00 46.19 44.20 2kf3 s LEU 95 CO 0.00 0.31 -0.01 -0.63 0.23 0.00 0.00 176.35 176.26 2kf3 s ILE 96 N -0.45 3.65 0.02 -0.59 -1.09 -1.26 -0.64 121.20 120.84 2kf3 s ILE 96 Ca 0.11 -0.42 0.08 0.00 -2.23 0.00 0.00 60.65 58.20 2kf3 s ILE 96 Cb -0.12 -2.69 -0.03 0.00 -1.58 0.00 0.00 42.46 38.05 2kf3 s ILE 96 CO 0.02 0.38 -0.24 -0.31 -1.23 0.00 0.00 174.94 173.56 2kf3 s TYR 97 N 1.52 2.38 0.04 3.97 1.51 0.26 -2.24 117.35 124.80 2kf3 s TYR 97 Ca 0.06 -0.38 0.04 0.00 -1.01 0.00 0.00 57.07 55.78 2kf3 s TYR 97 Cb -0.15 -1.44 -0.02 0.00 -0.11 0.00 0.00 41.96 40.24 2kf3 s TYR 97 CO -0.01 0.11 -0.11 0.21 -1.11 0.00 0.00 175.55 174.63 2kf3 s LYS 98 N -1.09 0.74 0.32 -0.62 2.47 0.20 0.17 119.74 121.94 2kf3 s LYS 98 Ca 0.12 -0.75 0.03 0.00 -1.56 0.00 0.00 55.97 53.81 2kf3 s LYS 98 Cb -0.10 -0.68 -0.06 0.00 -1.46 0.00 0.00 37.83 35.53 2kf3 s LYS 98 CO 0.02 0.16 0.07 -0.08 0.16 0.00 0.00 175.35 175.68 2kf3 s THR 99 N -1.04 1.01 0.00 3.43 -1.32 -0.25 -0.55 115.64 116.92 2kf3 s THR 99 Ca -0.03 -2.00 0.00 0.00 -1.21 0.00 0.00 61.69 58.45 2kf3 s THR 99 Cb -0.08 -2.71 0.00 0.00 -1.51 0.00 0.00 72.50 68.20 2kf3 s THR 99 CO 0.01 0.00 0.00 0.35 -2.21 0.00 0.00 174.62 172.77 2kf3 n THR 100 N -0.68 0.00 -0.97 5.08 -2.24 -1.23 -3.01 114.28 111.24 2kf3 n THR 100 Ca -0.02 0.00 0.09 0.00 -2.27 0.00 0.00 64.05 61.84 2kf3 n THR 100 Cb 0.66 1.21 0.21 0.00 -2.10 0.00 0.00 70.33 70.31 2kf3 n THR 100 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 2kf3 n ASP 101 N 0.00 3.24 -1.68 3.42 5.68 -1.14 -4.23 116.55 121.85 2kf3 n ASP 101 Ca 0.00 -2.98 -0.01 0.00 -0.50 0.00 0.00 54.79 51.30 2kf3 n ASP 101 Cb 0.16 -0.48 0.00 0.00 -1.14 0.00 0.00 41.12 39.67 2kf3 n ASP 101 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2kf3 n ALA 102 N -0.81 -1.04 0.00 2.12 0.00 -0.30 -3.81 120.51 116.66 2kf3 n ALA 102 Ca 0.18 0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.63 2kf3 n ALA 102 Cb 0.77 -0.73 0.00 0.00 0.00 0.00 0.00 19.45 19.48 2kf3 n ALA 102 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2kf3 n TYR 103 N -1.46 0.00 0.00 0.00 4.01 -1.26 -4.86 117.16 113.59 2kf3 n TYR 103 Ca -0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.74 2kf3 n TYR 103 Cb 0.51 -0.41 0.00 0.00 -0.31 0.00 0.00 39.34 39.13 2kf3 n TYR 103 CO 0.00 0.00 0.00 1.04 -0.46 0.00 0.00 176.86 177.44 2kf3 n GLN 104 N -1.76 0.00 -2.41 -0.72 6.02 -1.25 -4.73 117.38 112.52 2kf3 n GLN 104 Ca 0.00 0.54 -0.15 0.00 -0.01 0.00 0.00 57.00 57.38 2kf3 n GLN 104 Cb 0.00 -1.29 0.06 0.00 1.02 0.00 0.00 30.24 30.03 2kf3 n GLN 104 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 2kf3 n THR 105 N -1.75 0.00 -3.64 5.09 -2.24 -1.26 -5.07 114.28 105.41 2kf3 n THR 105 Ca 0.00 -1.40 -0.10 0.00 -2.27 0.00 0.00 64.05 60.28 2kf3 n THR 105 Cb 0.00 -0.69 -0.07 0.00 -2.10 0.00 0.00 70.33 67.47 2kf3 n THR 105 CO 0.00 0.00 0.00 -0.36 -0.57 0.00 0.00 175.07 174.14 2kf3 s PHE 106 N -1.74 -0.94 -0.01 4.78 0.08 -1.26 -4.62 117.98 114.27 2kf3 s PHE 106 Ca 0.46 2.03 0.05 0.00 0.12 0.00 0.00 56.93 59.58 2kf3 s PHE 106 Cb -0.03 0.48 -0.01 0.00 -0.57 0.00 0.00 43.02 42.88 2kf3 s PHE 106 CO 0.29 -0.46 -0.17 0.99 -0.10 0.00 0.00 175.22 175.78 2kf3 s THR 107 N 1.09 1.30 0.13 0.64 2.01 0.29 -4.98 115.64 116.12 2kf3 s THR 107 Ca -0.06 -0.70 -0.23 0.00 0.31 0.00 0.00 61.69 61.01 2kf3 s THR 107 Cb -0.05 -1.08 -0.07 0.00 0.01 0.00 0.00 72.50 71.30 2kf3 s THR 107 CO -0.11 0.37 0.69 -0.75 -0.69 0.00 0.00 174.62 174.13 2kf3 s LYS 108 N -0.39 4.40 -0.07 4.92 2.20 -1.26 -0.62 119.74 128.92 2kf3 s LYS 108 Ca 0.06 0.97 0.05 0.00 -0.36 0.00 0.00 55.97 56.69 2kf3 s LYS 108 Cb -0.06 -3.23 -0.07 0.00 -1.51 0.00 0.00 37.83 32.95 2kf3 s LYS 108 CO -0.01 0.59 0.01 0.44 -0.36 0.00 0.00 175.35 176.02 2kf3 n ILE 109 N 1.61 0.44 -1.31 5.43 -5.35 -0.95 -4.91 119.36 114.33 2kf3 n ILE 109 Ca -0.08 -0.26 0.00 0.00 -0.27 0.00 0.00 62.75 62.15 2kf3 n ILE 109 Cb 0.50 -0.82 0.00 0.00 -1.74 0.00 0.00 39.64 37.57 2kf3 n ILE 109 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33