#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 -0.02 0.17 0.00 -1.41 0.00 0.00 60.65 59.39 2kf3 s ILE 4 Cb 0.00 -1.03 0.28 0.00 0.13 0.00 0.00 42.46 41.84 2kf3 s ILE 4 CO 0.00 0.00 1.11 -0.46 -1.91 0.00 0.00 174.94 173.68 2kf3 n ASN 5 N -0.20 0.28 -4.83 4.50 0.23 -1.26 -4.91 115.26 109.07 2kf3 n ASN 5 Ca -0.06 -2.00 -0.25 0.00 -0.53 0.00 0.00 54.58 51.74 2kf3 n ASN 5 Cb 0.61 -0.08 -0.05 0.00 -2.08 0.00 0.00 39.78 38.18 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 -0.08 4.60 0.05 5.53 -4.23 -1.26 0.35 115.64 120.60 2kf3 s THR 6 Ca 0.22 -1.11 -0.33 0.00 -1.18 0.00 0.00 61.69 59.29 2kf3 s THR 6 Cb 0.25 -3.39 -0.18 0.00 1.34 0.00 0.00 72.50 70.52 2kf3 s THR 6 CO -0.11 -0.17 1.49 2.19 -0.54 0.00 0.00 174.62 177.48 2kf3 h PHE 7 N 2.13 -1.10 -0.87 3.99 -0.00 -1.97 0.14 116.94 119.25 2kf3 h PHE 7 Ca -0.48 -0.02 0.05 0.00 -0.00 0.00 0.00 57.97 57.52 2kf3 h PHE 7 Cb 1.21 0.37 -0.06 0.00 -0.00 0.00 0.00 35.95 37.47 2kf3 h PHE 7 CO 0.56 -0.67 0.55 -0.44 -0.00 0.00 0.00 178.31 178.31 2kf3 h ASP 8 N -1.16 0.89 -0.59 -0.68 5.19 -1.98 0.40 116.42 118.48 2kf3 h ASP 8 Ca -0.12 0.01 0.04 0.00 -0.62 0.00 0.00 57.03 56.35 2kf3 h ASP 8 Cb 0.90 -0.18 -0.05 0.00 0.18 0.00 0.00 39.33 40.18 2kf3 h ASP 8 CO 0.18 0.58 0.33 1.23 -3.12 0.00 0.00 179.24 178.44 2kf3 h GLY 9 N 1.03 0.84 1.02 2.75 0.00 -1.93 0.59 103.07 107.37 2kf3 h GLY 9 Ca 0.37 -0.23 -0.10 0.00 0.00 0.00 0.00 47.33 47.36 2kf3 h GLY 9 CO -0.15 0.16 -0.12 -2.08 0.00 0.00 0.00 176.54 174.35 2kf3 h VAL 10 N 0.63 1.27 0.76 4.60 2.07 0.12 -1.23 116.25 124.48 2kf3 h VAL 10 Ca 0.25 -1.24 -0.04 0.00 0.82 0.00 0.00 66.70 66.50 2kf3 h VAL 10 Cb 0.12 1.16 0.01 0.00 -1.52 0.00 0.00 31.29 31.05 2kf3 h VAL 10 CO -0.15 0.42 -0.37 0.00 0.02 0.00 0.00 177.57 177.50 2kf3 h ALA 11 N 0.86 -1.03 -0.31 1.67 0.00 -0.12 0.62 119.26 120.95 2kf3 h ALA 11 Ca 0.11 -0.23 0.07 0.00 0.00 0.00 0.00 54.91 54.86 2kf3 h ALA 11 Cb 0.67 0.40 -0.08 0.00 0.00 0.00 0.00 17.79 18.77 2kf3 h ALA 11 CO 0.05 -1.04 -0.33 -0.44 0.00 0.00 0.00 179.25 177.48 2kf3 h ASP 12 N -1.10 -1.09 -0.35 0.00 5.19 0.15 2.42 116.42 121.64 2kf3 h ASP 12 Ca -0.10 0.18 0.03 0.00 -0.62 0.00 0.00 57.03 56.52 2kf3 h ASP 12 Cb 0.80 0.49 -0.03 0.00 0.18 0.00 0.00 39.33 40.77 2kf3 h ASP 12 CO 0.17 -0.34 0.15 0.22 -3.12 0.00 0.00 179.24 176.33 2kf3 h TYR 13 N -0.31 0.27 -0.06 4.55 5.03 -1.10 -0.96 116.97 124.39 2kf3 h TYR 13 Ca 0.14 0.02 -0.13 0.00 2.58 0.00 0.00 58.73 61.34 2kf3 h TYR 13 Cb 0.54 -0.07 0.01 0.00 1.55 0.00 0.00 36.73 38.76 2kf3 h TYR 13 CO -0.50 0.13 -0.49 1.25 -1.32 0.00 0.00 178.16 177.23 2kf3 h LEU 14 N 0.32 0.53 -2.54 2.82 6.46 0.13 -0.33 115.31 122.71 2kf3 h LEU 14 Ca 0.16 -0.68 0.00 0.00 -0.12 0.00 0.00 57.88 57.23 2kf3 h LEU 14 Cb 0.10 -0.16 0.00 0.00 -0.73 0.00 0.00 40.66 39.87 2kf3 h LEU 14 CO -0.13 1.14 0.00 1.56 -0.62 0.00 0.00 178.44 180.38 2kf3 h GLN 15 N -0.03 0.00 0.03 1.25 4.20 0.42 0.59 115.11 121.57 2kf3 h GLN 15 Ca -0.04 0.00 -0.39 0.00 0.06 0.00 0.00 58.65 58.28 2kf3 h GLN 15 Cb 1.16 0.00 -0.05 0.00 0.30 0.00 0.00 27.48 28.88 2kf3 h GLN 15 CO 0.10 0.00 -2.26 2.41 -0.67 0.00 0.00 178.83 178.40 2kf3 n THR 16 N -3.07 1.57 -0.46 -0.54 -1.04 -0.37 -4.54 114.28 105.82 2kf3 n THR 16 Ca -0.02 -0.49 0.08 0.00 -2.04 0.00 0.00 64.05 61.58 2kf3 n THR 16 Cb 0.14 -1.66 0.23 0.00 -1.82 0.00 0.00 70.33 67.22 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 -3.66 0.82 -1.74 -1.42 4.01 -0.14 -4.94 117.16 110.09 2kf3 n TYR 17 Ca -0.44 -0.60 -0.10 0.00 -0.16 0.00 0.00 57.90 56.60 2kf3 n TYR 17 Cb 0.95 -0.13 -0.03 0.00 -0.31 0.00 0.00 39.34 39.82 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 0.52 -0.93 -3.98 -0.72 8.25 0.21 -4.89 115.22 113.68 2kf3 n HIS 18 Ca 0.18 0.00 -0.09 0.00 -0.26 0.00 0.00 57.72 57.55 2kf3 n HIS 18 Cb 0.64 -2.24 -0.10 0.00 1.12 0.00 0.00 29.99 29.41 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 -3.68 0.47 0.45 -0.41 -2.85 -1.24 -5.03 119.74 107.45 2kf3 s LYS 19 Ca 0.00 -0.77 -0.21 0.00 -1.00 0.00 0.00 55.97 53.99 2kf3 s LYS 19 Cb 0.00 0.17 -0.10 0.00 -2.06 0.00 0.00 37.83 35.85 2kf3 s LYS 19 CO 0.00 -0.10 0.99 -0.51 0.10 0.00 0.00 175.35 175.83 2kf3 s LEU 20 N -1.97 3.92 0.54 2.77 1.02 -1.26 -3.19 118.68 120.50 2kf3 s LEU 20 Ca -0.08 1.80 -0.17 0.00 0.02 0.00 0.00 54.13 55.70 2kf3 s LEU 20 Cb -0.03 -4.52 -0.15 0.00 0.02 0.00 0.00 46.19 41.51 2kf3 s LEU 20 CO -0.04 -0.53 -0.19 -2.65 0.02 0.00 0.00 176.35 172.97 2kf3 n PRO 21 N -0.72 0.00 -0.15 1.29 -0.02 -1.26 -4.62 135.00 129.51 2kf3 n PRO 21 Ca 0.08 0.00 -0.02 0.00 -2.02 0.00 0.00 63.50 61.54 2kf3 n PRO 21 Cb 0.53 -0.97 -0.02 0.00 -0.02 0.00 0.00 33.50 33.02 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 2.52 0.91 -0.60 2.55 5.68 -1.26 -2.36 116.55 123.98 2kf3 n ASP 22 Ca 0.07 -1.58 -0.02 0.00 -0.50 0.00 0.00 54.79 52.76 2kf3 n ASP 22 Cb 0.46 -0.23 -0.02 0.00 -1.14 0.00 0.00 41.12 40.19 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 2.70 -0.35 -4.12 -1.12 6.94 -1.26 -4.69 115.26 113.36 2kf3 n ASN 23 Ca 0.06 -0.86 -0.33 0.00 -0.02 0.00 0.00 54.58 53.43 2kf3 n ASN 23 Cb 0.14 0.11 -0.15 0.00 -2.36 0.00 0.00 39.78 37.52 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 3.09 -0.02 -2.53 2.02 -1.00 -0.50 117.35 118.40 2kf3 s TYR 24 Ca 0.00 -1.92 0.06 0.00 -0.37 0.00 0.00 57.07 54.84 2kf3 s TYR 24 Cb 0.00 -1.97 -0.02 0.00 -0.40 0.00 0.00 41.96 39.57 2kf3 s TYR 24 CO 0.00 -0.82 -0.21 0.96 -1.57 0.00 0.00 175.55 173.92 2kf3 s ILE 25 N 1.22 2.53 0.93 2.71 -4.36 -0.02 -4.77 121.20 119.45 2kf3 s ILE 25 Ca -0.03 -0.97 -0.12 0.00 -0.26 0.00 0.00 60.65 59.28 2kf3 s ILE 25 Cb -0.17 -1.95 0.15 0.00 1.25 0.00 0.00 42.46 41.73 2kf3 s ILE 25 CO -0.07 0.55 1.09 0.42 0.24 0.00 0.00 174.94 177.18 2kf3 s THR 26 N -0.70 2.44 0.24 8.37 -4.23 -0.46 0.64 115.64 121.95 2kf3 s THR 26 Ca 0.11 0.14 -0.00 0.00 -1.18 0.00 0.00 61.69 60.76 2kf3 s THR 26 Cb -0.10 -2.65 0.03 0.00 1.34 0.00 0.00 72.50 71.11 2kf3 s THR 26 CO 0.00 -0.19 1.64 0.11 -0.54 0.00 0.00 174.62 175.64 2kf3 h LYS 27 N -1.65 0.55 -0.24 3.99 1.57 -1.94 -1.00 116.57 117.85 2kf3 h LYS 27 Ca -0.51 -0.25 0.03 0.00 -1.87 0.00 0.00 60.65 58.04 2kf3 h LYS 27 Cb 1.30 -0.01 -0.04 0.00 0.08 0.00 0.00 32.23 33.56 2kf3 h LYS 27 CO 0.56 0.82 -0.26 0.77 -0.57 0.00 0.00 179.45 180.77 2kf3 h SER 28 N 0.47 -0.88 0.16 0.86 0.02 -1.98 1.27 113.55 113.48 2kf3 h SER 28 Ca 0.05 0.12 -0.01 0.00 -0.84 0.00 0.00 61.79 61.11 2kf3 h SER 28 Cb 0.81 0.36 0.00 0.00 0.14 0.00 0.00 62.40 63.71 2kf3 h SER 28 CO 0.07 -0.17 -0.08 -0.33 -1.14 0.00 0.00 176.83 175.18 2kf3 h GLU 29 N -0.15 -0.21 -0.90 3.45 5.08 -1.91 -1.42 114.58 118.52 2kf3 h GLU 29 Ca 0.04 0.01 0.17 0.00 -1.00 0.00 0.00 59.36 58.58 2kf3 h GLU 29 Cb 0.25 0.05 -0.16 0.00 0.50 0.00 0.00 28.75 29.39 2kf3 h GLU 29 CO -0.30 0.04 -0.29 0.00 -1.00 0.00 0.00 179.01 177.46 2kf3 h ALA 30 N 0.36 0.40 0.69 3.43 0.00 -0.56 1.01 119.26 124.60 2kf3 h ALA 30 Ca -0.02 0.31 -0.03 0.00 0.00 0.00 0.00 54.91 55.17 2kf3 h ALA 30 Cb 0.34 0.80 0.01 0.00 0.00 0.00 0.00 17.79 18.93 2kf3 h ALA 30 CO 0.04 -0.49 -0.33 1.96 0.00 0.00 0.00 179.25 180.43 2kf3 h GLN 31 N -0.02 -0.89 -0.07 0.00 4.20 0.19 -2.18 115.11 116.34 2kf3 h GLN 31 Ca 0.39 0.06 0.00 0.00 0.06 0.00 0.00 58.65 59.16 2kf3 h GLN 31 Cb 0.63 0.20 -0.00 0.00 0.30 0.00 0.00 27.48 28.61 2kf3 h GLN 31 CO -0.93 -0.59 0.05 0.00 -0.67 0.00 0.00 178.83 176.69 2kf3 h ALA 32 N -0.59 1.97 0.00 3.87 0.00 -0.07 -0.87 119.26 123.56 2kf3 h ALA 32 Ca -0.09 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.78 2kf3 h ALA 32 Cb 0.71 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.47 2kf3 h ALA 32 CO 0.15 0.03 -0.17 1.25 0.00 0.00 0.00 179.25 180.51 2kf3 h LEU 33 N 0.08 0.00 0.00 0.00 5.85 0.15 -3.45 115.31 117.94 2kf3 h LEU 33 Ca 0.03 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.75 2kf3 h LEU 33 Cb 0.01 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.04 2kf3 h LEU 33 CO -0.01 0.17 0.00 0.61 -0.34 0.00 0.00 178.44 178.88 2kf3 n GLY 34 N -1.03 0.41 3.84 3.75 0.00 -0.35 -5.07 105.19 106.74 2kf3 n GLY 34 Ca -0.02 -0.31 -0.35 0.00 0.00 0.00 0.00 46.02 45.33 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 3.59 -0.06 1.61 -0.00 -1.06 -4.95 118.94 118.07 2kf3 s TRP 35 Ca 0.00 1.19 -0.00 0.00 -0.00 0.00 0.00 56.10 57.29 2kf3 s TRP 35 Cb 0.00 -2.48 0.03 0.00 -0.00 0.00 0.00 33.47 31.02 2kf3 s TRP 35 CO 0.00 0.35 -0.01 0.08 -0.00 0.00 0.00 176.95 177.37 2kf3 s VAL 36 N -1.56 0.40 0.11 5.86 1.01 -1.26 -4.95 120.40 120.00 2kf3 s VAL 36 Ca 0.42 0.04 -0.26 0.00 0.00 0.00 0.00 61.98 62.18 2kf3 s VAL 36 Cb -0.15 -0.51 -0.10 0.00 0.00 0.00 0.00 36.38 35.63 2kf3 s VAL 36 CO 0.20 0.23 1.66 0.00 0.00 0.00 0.00 175.10 177.20 2kf3 h ALA 37 N 7.83 -0.33 0.00 5.51 0.00 -1.99 0.72 119.26 131.00 2kf3 h ALA 37 Ca -0.28 -0.03 -0.07 0.00 0.00 0.00 0.00 54.91 54.52 2kf3 h ALA 37 Cb 1.13 0.29 -0.03 0.00 0.00 0.00 0.00 17.79 19.19 2kf3 h ALA 37 CO 0.35 -0.72 0.10 -1.13 0.00 0.00 0.00 179.25 177.86 2kf3 n SER 38 N -5.31 2.25 0.00 0.00 3.41 -1.26 -2.98 113.62 109.72 2kf3 n SER 38 Ca -0.07 -1.87 0.00 0.00 -0.26 0.00 0.00 58.87 56.67 2kf3 n SER 38 Cb 0.23 -0.59 0.00 0.00 -0.26 0.00 0.00 64.21 63.59 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 2.64 0.00 -3.12 4.33 4.81 -1.00 -5.05 118.16 120.78 2kf3 n LYS 39 Ca 0.16 0.00 -0.14 0.00 -0.87 0.00 0.00 58.31 57.46 2kf3 n LYS 39 Cb 0.37 0.00 0.07 0.00 0.02 0.00 0.00 35.03 35.48 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 -1.04 -0.65 3.80 3.14 0.00 0.25 -4.97 105.19 105.71 2kf3 n GLY 40 Ca 0.00 0.30 -0.31 0.00 0.00 0.00 0.00 46.02 46.01 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 -3.68 4.85 0.03 1.61 4.22 -1.26 -4.51 114.94 116.21 2kf3 s ASN 41 Ca 0.24 1.60 0.00 0.00 -2.14 0.00 0.00 52.86 52.57 2kf3 s ASN 41 Cb -0.03 -2.40 0.00 0.00 1.28 0.00 0.00 41.25 40.10 2kf3 s ASN 41 CO 0.64 -1.78 0.00 -0.11 -2.04 0.00 0.00 177.10 173.81 2kf3 n LEU 42 N -3.35 -0.28 0.30 3.54 7.94 -1.26 -4.92 117.00 118.98 2kf3 n LEU 42 Ca 0.08 0.12 0.20 0.00 -1.11 0.00 0.00 56.01 55.30 2kf3 n LEU 42 Cb 0.54 0.46 1.08 0.00 0.53 0.00 0.00 43.42 46.02 2kf3 n LEU 42 CO 0.55 -0.12 1.11 0.00 -1.11 0.00 0.00 177.39 177.82 2kf3 h ALA 43 N 0.00 1.00 0.05 1.96 0.00 -1.81 0.51 119.26 120.97 2kf3 h ALA 43 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 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 -0.02 0.38 0.00 0.00 0.00 179.25 179.61 2kf3 h ASP 44 N 0.00 -0.06 0.79 0.00 2.03 -1.95 -2.22 116.42 115.01 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 0.02 0.01 0.00 0.00 -0.83 0.00 0.00 39.33 38.54 2kf3 h ASP 44 CO 0.00 0.24 0.00 1.33 -1.03 0.00 0.00 179.24 179.78 2kf3 n VAL 45 N -3.74 0.45 -2.99 4.15 0.24 -1.14 -4.11 118.33 111.19 2kf3 n VAL 45 Ca -0.01 0.11 -0.16 0.00 -2.04 0.00 0.00 64.34 62.24 2kf3 n VAL 45 Cb 0.03 -0.72 -0.02 0.00 -1.47 0.00 0.00 33.84 31.66 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 -1.51 0.55 -1.68 2.33 0.00 0.18 -5.06 120.51 115.33 2kf3 n ALA 46 Ca 0.05 -2.38 -0.45 0.00 0.00 0.00 0.00 53.44 50.66 2kf3 n ALA 46 Cb 0.27 -1.07 -0.04 0.00 0.00 0.00 0.00 19.45 18.60 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 1.69 2.41 -2.83 0.00 -0.02 -0.84 -2.46 135.00 132.96 2kf3 n PRO 47 Ca 0.16 0.88 -0.09 0.00 -2.02 0.00 0.00 63.50 62.43 2kf3 n PRO 47 Cb 0.57 -2.73 0.03 0.00 -0.02 0.00 0.00 33.50 31.35 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 4.09 0.32 3.28 -1.23 0.00 -1.26 -5.04 105.19 105.35 2kf3 n GLY 48 Ca 0.19 -0.34 -0.15 0.00 0.00 0.00 0.00 46.02 45.72 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 -5.37 1.38 0.11 1.61 -0.14 -1.03 -4.82 119.74 111.48 2kf3 s LYS 49 Ca 0.20 -1.75 -0.06 0.00 -1.36 0.00 0.00 55.97 53.00 2kf3 s LYS 49 Cb -0.09 -0.01 -0.02 0.00 -1.68 0.00 0.00 37.83 36.04 2kf3 s LYS 49 CO 0.25 -0.38 0.14 -1.12 -0.76 0.00 0.00 175.35 173.48 2kf3 s SER 50 N -3.27 0.21 -0.09 2.83 0.01 0.34 -4.83 113.70 108.91 2kf3 s SER 50 Ca 0.38 -0.88 -0.25 0.00 1.31 0.00 0.00 55.95 56.51 2kf3 s SER 50 Cb 0.07 0.32 -0.03 0.00 0.21 0.00 0.00 66.02 66.59 2kf3 s SER 50 CO 0.14 -0.74 0.80 -0.63 0.41 0.00 0.00 173.24 173.22 2kf3 s ILE 51 N -3.93 4.96 0.00 1.44 -1.09 -1.26 -0.84 121.20 120.48 2kf3 s ILE 51 Ca 0.12 1.62 0.00 0.00 -2.23 0.00 0.00 60.65 60.16 2kf3 s ILE 51 Cb 0.06 -4.12 0.00 0.00 -1.58 0.00 0.00 42.46 36.81 2kf3 s ILE 51 CO -0.06 0.16 0.00 0.61 -1.23 0.00 0.00 174.94 174.42 2kf3 n GLY 52 N 3.19 1.81 0.00 6.18 0.00 0.21 0.41 105.19 116.99 2kf3 n GLY 52 Ca 0.02 -0.58 0.00 0.00 0.00 0.00 0.00 46.02 45.46 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 -0.40 1.89 0.00 -0.02 0.00 -0.71 -1.35 105.19 104.60 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 -4.15 1.61 9.92 -1.26 -4.87 116.55 117.80 2kf3 n ASP 54 Ca 0.00 0.00 -0.24 0.00 -0.53 0.00 0.00 54.79 54.02 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 1.32 -0.71 0.53 1.09 -1.26 -3.95 121.20 118.21 2kf3 s ILE 55 Ca 0.00 -0.73 -0.09 0.00 -1.10 0.00 0.00 60.65 58.73 2kf3 s ILE 55 Cb 0.00 -1.10 0.19 0.00 -1.06 0.00 0.00 42.46 40.48 2kf3 s ILE 55 CO 0.00 0.36 0.60 0.12 -0.10 0.00 0.00 174.94 175.92 2kf3 s PHE 56 N -0.41 3.58 0.00 3.97 2.19 0.37 -4.79 117.98 122.88 2kf3 s PHE 56 Ca 0.06 -2.27 0.00 0.00 0.33 0.00 0.00 56.93 55.06 2kf3 s PHE 56 Cb -0.07 -3.54 0.00 0.00 -1.31 0.00 0.00 43.02 38.10 2kf3 s PHE 56 CO -0.01 -0.93 0.04 -1.13 1.83 0.00 0.00 175.22 175.03 2kf3 n SER 57 N 3.86 0.12 -3.77 6.13 3.41 -1.26 -4.34 113.62 117.77 2kf3 n SER 57 Ca 0.09 -0.67 -0.28 0.00 -0.26 0.00 0.00 58.87 57.76 2kf3 n SER 57 Cb 0.43 -0.02 -0.05 0.00 -0.26 0.00 0.00 64.21 64.30 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 1.61 -1.49 -1.88 4.04 5.15 -1.26 -4.66 115.26 116.77 2kf3 n ASN 58 Ca 0.00 -0.67 -0.01 0.00 -0.60 0.00 0.00 54.58 53.30 2kf3 n ASN 58 Cb 0.01 -1.34 -0.02 0.00 -0.53 0.00 0.00 39.78 37.91 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 -3.40 0.58 0.00 1.20 1.74 -1.26 -1.92 116.66 113.59 2kf3 n ARG 59 Ca 0.08 -0.11 0.00 0.00 -0.77 0.00 0.00 57.85 57.05 2kf3 n ARG 59 Cb 0.44 -1.37 0.00 0.00 -1.02 0.00 0.00 32.46 30.51 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 1.99 1.61 -2.53 5.56 1.02 -1.26 -5.02 120.64 122.01 2kf3 n GLU 60 Ca 0.05 0.00 -0.17 0.00 -0.02 0.00 0.00 57.16 57.02 2kf3 n GLU 60 Cb 0.28 -0.13 0.01 0.00 -0.02 0.00 0.00 31.44 31.57 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 0.00 -0.29 0.39 0.62 0.00 -0.81 -4.87 105.19 100.24 2kf3 n GLY 61 Ca 0.00 -0.14 0.04 0.00 0.00 0.00 0.00 46.02 45.91 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 -2.88 1.92 -4.39 1.61 5.02 -1.26 -4.99 118.16 113.20 2kf3 n LYS 62 Ca -0.15 -1.56 -0.20 0.00 -2.02 0.00 0.00 58.31 54.38 2kf3 n LYS 62 Cb 0.63 -1.17 -0.14 0.00 -0.02 0.00 0.00 35.03 34.33 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 -0.87 2.12 0.09 -0.35 1.43 -1.26 -5.01 118.68 114.83 2kf3 s LEU 63 Ca 0.13 -0.38 -0.31 0.00 -1.03 0.00 0.00 54.13 52.55 2kf3 s LEU 63 Cb 0.08 -0.58 -0.09 0.00 0.03 0.00 0.00 46.19 45.63 2kf3 s LEU 63 CO 0.10 0.06 1.76 -2.16 0.23 0.00 0.00 176.35 176.34 2kf3 s PRO 64 N -0.87 4.16 0.15 1.29 0.04 -1.26 -5.01 135.00 133.50 2kf3 s PRO 64 Ca 0.02 2.47 0.02 0.00 0.04 0.00 0.00 61.00 63.56 2kf3 s PRO 64 Cb -0.07 -3.66 0.02 0.00 0.04 0.00 0.00 34.50 30.84 2kf3 s PRO 64 CO 0.01 -0.81 0.20 0.41 0.04 0.00 0.00 177.00 176.85 2kf3 n GLY 65 N 4.16 2.05 0.00 0.56 0.00 -1.26 -5.03 105.19 105.67 2kf3 n GLY 65 Ca 0.17 -2.16 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 -1.28 0.00 -0.57 1.61 4.81 -1.26 -5.01 118.16 116.47 2kf3 n LYS 66 Ca 0.04 0.00 -0.17 0.00 -0.87 0.00 0.00 58.31 57.30 2kf3 n LYS 66 Cb 0.16 0.00 -0.01 0.00 0.02 0.00 0.00 35.03 35.19 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 3.74 0.00 3.14 3.41 -1.26 -3.67 113.62 118.97 2kf3 n SER 67 Ca 0.00 -2.25 0.00 0.00 -0.26 0.00 0.00 58.87 56.36 2kf3 n SER 67 Cb 0.00 -0.96 0.00 0.00 -0.26 0.00 0.00 64.21 62.99 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 3.84 -0.30 3.63 5.00 0.00 -1.26 -5.19 105.19 110.91 2kf3 n GLY 68 Ca 0.34 0.14 -0.01 0.00 0.00 0.00 0.00 46.02 46.49 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 0.52 0.05 1.61 3.52 -1.24 -5.03 118.95 118.38 2kf3 s ARG 69 Ca 0.00 -0.27 -0.05 0.00 -0.13 0.00 0.00 55.73 55.28 2kf3 s ARG 69 Cb 0.00 0.19 -0.01 0.00 -1.56 0.00 0.00 34.95 33.57 2kf3 s ARG 69 CO 0.00 -0.24 0.10 0.99 -0.81 0.00 0.00 175.30 175.34 2kf3 s THR 70 N -2.59 0.15 -0.02 4.11 2.01 -1.26 -4.93 115.64 113.10 2kf3 s THR 70 Ca 0.12 -1.22 0.05 0.00 0.31 0.00 0.00 61.69 60.95 2kf3 s THR 70 Cb 0.02 -1.08 -0.01 0.00 0.01 0.00 0.00 72.50 71.44 2kf3 s THR 70 CO -0.03 -0.67 -0.16 0.26 -0.69 0.00 0.00 174.62 173.32 2kf3 s TRP 71 N -3.06 1.53 0.11 4.92 0.52 -1.26 -0.07 118.94 121.63 2kf3 s TRP 71 Ca -0.01 -0.35 0.05 0.00 0.02 0.00 0.00 56.10 55.82 2kf3 s TRP 71 Cb 0.01 -1.01 -0.04 0.00 -1.15 0.00 0.00 33.47 31.29 2kf3 s TRP 71 CO -0.07 -0.08 -0.13 1.03 0.02 0.00 0.00 176.95 177.72 2kf3 s ARG 72 N -0.22 0.97 0.37 4.98 0.52 -0.50 0.14 118.95 125.22 2kf3 s ARG 72 Ca 0.03 -1.19 0.08 0.00 -0.52 0.00 0.00 55.73 54.12 2kf3 s ARG 72 Cb -0.08 -0.84 -0.06 0.00 0.52 0.00 0.00 34.95 34.48 2kf3 s ARG 72 CO 0.00 0.16 -0.01 -1.83 0.02 0.00 0.00 175.30 173.65 2kf3 s GLU 73 N -2.58 1.97 -0.28 3.54 -1.05 -1.25 -1.40 118.70 117.64 2kf3 s GLU 73 Ca 0.07 -1.93 -0.20 0.00 -0.15 0.00 0.00 54.97 52.76 2kf3 s GLU 73 Cb -0.05 -1.78 0.11 0.00 -0.44 0.00 0.00 34.13 31.97 2kf3 s GLU 73 CO 0.02 0.06 0.88 0.00 0.95 0.00 0.00 175.26 177.17 2kf3 s ALA 74 N -2.61 -2.01 0.72 -0.84 0.00 -0.64 -1.75 121.76 114.64 2kf3 s ALA 74 Ca 0.35 2.14 -0.16 0.00 0.00 0.00 0.00 51.96 54.28 2kf3 s ALA 74 Cb 0.04 -1.48 0.02 0.00 0.00 0.00 0.00 23.12 21.70 2kf3 s ALA 74 CO 0.18 -0.32 1.05 -0.25 0.00 0.00 0.00 175.76 176.42 2kf3 n ASP 75 N 3.25 0.79 -3.99 0.00 9.92 0.17 -1.26 116.55 125.43 2kf3 n ASP 75 Ca -0.16 0.68 -0.15 0.00 -0.53 0.00 0.00 54.79 54.63 2kf3 n ASP 75 Cb 0.57 -1.44 -0.13 0.00 -0.64 0.00 0.00 41.12 39.47 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 -1.80 0.46 -0.76 0.53 -1.09 -0.81 -4.70 121.20 113.03 2kf3 s ILE 76 Ca 0.75 -0.52 -0.00 0.00 -2.23 0.00 0.00 60.65 58.65 2kf3 s ILE 76 Cb -0.34 -0.44 -0.00 0.00 -1.58 0.00 0.00 42.46 40.10 2kf3 s ILE 76 CO 0.49 -0.06 0.69 0.59 -1.23 0.00 0.00 174.94 175.43 2kf3 n ASN 77 N 2.44 -7.47 -4.32 3.58 3.02 0.15 -4.61 115.26 108.04 2kf3 n ASN 77 Ca -0.16 -0.18 -0.17 0.00 -0.03 0.00 0.00 54.58 54.03 2kf3 n ASN 77 Cb 0.57 -4.94 -0.10 0.00 -0.61 0.00 0.00 39.78 34.70 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 -3.01 1.60 0.00 3.10 5.04 -1.26 -4.96 117.35 117.86 2kf3 s TYR 78 Ca 0.01 -0.63 0.00 0.00 -2.44 0.00 0.00 57.07 54.01 2kf3 s TYR 78 Cb -0.00 -0.76 0.00 0.00 0.35 0.00 0.00 41.96 41.54 2kf3 s TYR 78 CO 0.77 0.28 0.00 0.25 -1.34 0.00 0.00 175.55 175.51 2kf3 n THR 79 N -0.34 0.00 -3.35 4.34 -2.24 -1.26 -4.94 114.28 106.49 2kf3 n THR 79 Ca -0.08 0.00 -0.11 0.00 -2.27 0.00 0.00 64.05 61.59 2kf3 n THR 79 Cb 0.61 0.00 -0.08 0.00 -2.10 0.00 0.00 70.33 68.76 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 0.56 0.59 0.00 3.42 0.15 -1.26 -4.56 113.70 112.60 2kf3 s SER 80 Ca 0.00 -0.16 0.00 0.00 0.70 0.00 0.00 55.95 56.49 2kf3 s SER 80 Cb 0.00 0.97 0.00 0.00 -1.71 0.00 0.00 66.02 65.28 2kf3 s SER 80 CO 0.00 -0.33 0.00 0.61 1.20 0.00 0.00 173.24 174.72 2kf3 n GLY 81 N 5.35 -1.32 0.00 9.45 0.00 -1.26 -4.98 105.19 112.43 2kf3 n GLY 81 Ca -0.02 0.51 0.00 0.00 0.00 0.00 0.00 46.02 46.50 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 -0.24 0.00 1.61 7.35 -1.26 -4.30 117.46 120.62 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 1.60 0.00 -4.13 1.74 -1.26 -4.87 116.66 109.73 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 -0.34 0.55 0.23 -1.26 -5.03 115.26 109.41 2kf3 n ASN 84 Ca 0.00 0.00 0.11 0.00 -0.53 0.00 0.00 54.58 54.16 2kf3 n ASN 84 Cb 0.00 0.00 -0.01 0.00 -2.08 0.00 0.00 39.78 37.69 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 1.67 -4.62 0.53 3.41 -1.26 -4.73 113.62 108.63 2kf3 n SER 85 Ca 0.00 -1.32 -0.41 0.00 -0.26 0.00 0.00 58.87 56.88 2kf3 n SER 85 Cb 0.00 0.60 -0.06 0.00 -0.26 0.00 0.00 64.21 64.49 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 -2.63 6.58 0.02 4.04 2.15 -1.26 -1.35 116.67 124.22 2kf3 s ASP 86 Ca 0.16 0.62 -0.01 0.00 0.43 0.00 0.00 52.55 53.75 2kf3 s ASP 86 Cb 0.18 -2.35 -0.02 0.00 -0.30 0.00 0.00 42.92 40.43 2kf3 s ASP 86 CO 0.65 -0.46 -0.00 -0.13 -0.17 0.00 0.00 175.17 175.06 2kf3 s ARG 87 N 2.64 0.35 -0.06 4.34 1.81 -1.17 -1.92 118.95 124.95 2kf3 s ARG 87 Ca 0.27 -0.60 0.05 0.00 -1.72 0.00 0.00 55.73 53.73 2kf3 s ARG 87 Cb -0.15 0.13 -0.02 0.00 -0.45 0.00 0.00 34.95 34.46 2kf3 s ARG 87 CO 0.10 -0.06 -0.22 -1.50 -0.68 0.00 0.00 175.30 172.94 2kf3 s ILE 88 N -1.56 2.34 -0.17 1.52 2.07 -0.39 -1.12 121.20 123.89 2kf3 s ILE 88 Ca -0.15 -0.97 -0.01 0.00 -1.41 0.00 0.00 60.65 58.10 2kf3 s ILE 88 Cb -0.09 -1.87 -0.01 0.00 0.13 0.00 0.00 42.46 40.63 2kf3 s ILE 88 CO -0.01 0.57 -0.11 -0.76 -1.91 0.00 0.00 174.94 172.72 2kf3 s LEU 89 N -0.31 2.68 -0.14 8.50 2.01 0.40 -1.62 118.68 130.20 2kf3 s LEU 89 Ca 0.01 -0.41 0.01 0.00 0.01 0.00 0.00 54.13 53.75 2kf3 s LEU 89 Cb -0.13 -1.64 -0.00 0.00 0.01 0.00 0.00 46.19 44.43 2kf3 s LEU 89 CO 0.02 0.06 -0.17 -0.72 1.01 0.00 0.00 176.35 176.56 2kf3 s TYR 90 N 0.97 2.74 0.32 0.29 1.13 -0.49 0.99 117.35 123.29 2kf3 s TYR 90 Ca -0.02 -0.95 -0.01 0.00 -1.41 0.00 0.00 57.07 54.68 2kf3 s TYR 90 Cb -0.15 -1.84 -0.04 0.00 -1.10 0.00 0.00 41.96 38.83 2kf3 s TYR 90 CO -0.01 -0.40 0.55 -1.54 -2.51 0.00 0.00 175.55 171.64 2kf3 s SER 91 N 0.60 6.34 0.57 -0.18 1.04 0.33 -1.41 113.70 120.99 2kf3 s SER 91 Ca -0.09 0.54 0.35 0.00 0.48 0.00 0.00 55.95 57.23 2kf3 s SER 91 Cb -0.16 -2.07 1.51 0.00 0.10 0.00 0.00 66.02 65.40 2kf3 s SER 91 CO 0.03 -0.26 2.04 0.77 0.98 0.00 0.00 173.24 176.80 2kf3 h SER 92 N 1.11 0.00 -0.09 7.02 4.64 -0.81 -1.81 113.55 123.61 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 0.63 0.00 0.00 0.47 -0.87 0.00 0.00 176.83 177.06 2kf3 n ASP 93 N -3.09 0.51 -0.32 4.97 8.00 -1.26 -4.83 116.55 120.52 2kf3 n ASP 93 Ca 0.00 -2.00 -0.03 0.00 0.71 0.00 0.00 54.79 53.47 2kf3 n ASP 93 Cb 0.27 -0.07 -0.00 0.00 -0.02 0.00 0.00 41.12 41.30 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 -0.23 -0.13 -4.06 1.24 -0.00 -0.68 -5.04 117.44 108.53 2kf3 n TRP 94 Ca 0.03 0.01 -0.36 0.00 -0.00 0.00 0.00 57.50 57.18 2kf3 n TRP 94 Cb 0.08 -1.37 -0.08 0.00 -0.00 0.00 0.00 31.31 29.95 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 -0.78 4.04 -0.22 5.87 1.43 -1.24 -4.92 118.68 122.87 2kf3 s LEU 95 Ca 0.00 0.31 -0.04 0.00 -1.03 0.00 0.00 54.13 53.38 2kf3 s LEU 95 Cb -0.00 -1.97 -0.01 0.00 0.03 0.00 0.00 46.19 44.24 2kf3 s LEU 95 CO 0.00 0.37 -0.05 -0.63 0.23 0.00 0.00 176.35 176.28 2kf3 s ILE 96 N -0.80 3.32 0.02 -0.59 -1.09 -1.26 -0.52 121.20 120.28 2kf3 s ILE 96 Ca 0.13 -0.53 0.09 0.00 -2.23 0.00 0.00 60.65 58.11 2kf3 s ILE 96 Cb -0.12 -2.51 -0.03 0.00 -1.58 0.00 0.00 42.46 38.22 2kf3 s ILE 96 CO 0.03 0.41 -0.26 -0.31 -1.23 0.00 0.00 174.94 173.58 2kf3 s TYR 97 N 1.47 2.33 0.05 3.97 1.51 0.28 -2.19 117.35 124.77 2kf3 s TYR 97 Ca 0.06 -0.42 0.05 0.00 -1.01 0.00 0.00 57.07 55.74 2kf3 s TYR 97 Cb -0.14 -1.44 -0.02 0.00 -0.11 0.00 0.00 41.96 40.25 2kf3 s TYR 97 CO -0.04 0.06 -0.14 0.21 -1.11 0.00 0.00 175.55 174.54 2kf3 s LYS 98 N -0.99 0.86 0.33 -0.62 2.47 0.40 0.15 119.74 122.34 2kf3 s LYS 98 Ca 0.11 -0.84 0.03 0.00 -1.56 0.00 0.00 55.97 53.72 2kf3 s LYS 98 Cb -0.10 -0.86 -0.06 0.00 -1.46 0.00 0.00 37.83 35.35 2kf3 s LYS 98 CO 0.01 0.20 0.07 -0.08 0.16 0.00 0.00 175.35 175.71 2kf3 s THR 99 N -1.04 1.06 0.00 3.43 -1.32 -0.27 -0.49 115.64 117.00 2kf3 s THR 99 Ca -0.00 -2.00 0.00 0.00 -1.21 0.00 0.00 61.69 58.48 2kf3 s THR 99 Cb -0.09 -2.72 0.00 0.00 -1.51 0.00 0.00 72.50 68.19 2kf3 s THR 99 CO 0.02 0.00 0.00 0.35 -2.21 0.00 0.00 174.62 172.78 2kf3 n THR 100 N -0.70 0.00 -0.97 5.08 -2.24 -1.22 -3.02 114.28 111.21 2kf3 n THR 100 Ca -0.03 0.00 0.09 0.00 -2.27 0.00 0.00 64.05 61.84 2kf3 n THR 100 Cb 0.66 1.17 0.19 0.00 -2.10 0.00 0.00 70.33 70.26 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 3.06 -1.59 3.42 5.68 -1.11 -4.29 116.55 121.71 2kf3 n ASP 101 Ca 0.00 -2.99 -0.01 0.00 -0.50 0.00 0.00 54.79 51.30 2kf3 n ASP 101 Cb 0.18 -0.46 0.00 0.00 -1.14 0.00 0.00 41.12 39.71 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 -0.92 -0.79 0.00 2.12 0.00 -0.46 -3.84 120.51 116.62 2kf3 n ALA 102 Ca 0.18 0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.62 2kf3 n ALA 102 Cb 0.74 -0.63 0.00 0.00 0.00 0.00 0.00 19.45 19.55 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 -1.48 0.00 0.00 0.00 4.01 -1.26 -4.86 117.16 113.57 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 0.50 -0.43 0.00 0.00 -0.31 0.00 0.00 39.34 39.11 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 -1.84 0.00 -2.46 -0.72 6.02 -1.25 -4.73 117.38 112.40 2kf3 n GLN 104 Ca 0.00 0.61 -0.14 0.00 -0.01 0.00 0.00 57.00 57.45 2kf3 n GLN 104 Cb 0.00 -1.38 0.05 0.00 1.02 0.00 0.00 30.24 29.93 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 -2.04 0.00 -3.64 5.09 -2.24 -1.26 -5.07 114.28 105.13 2kf3 n THR 105 Ca 0.00 -1.43 -0.10 0.00 -2.27 0.00 0.00 64.05 60.25 2kf3 n THR 105 Cb 0.00 -0.64 -0.07 0.00 -2.10 0.00 0.00 70.33 67.52 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 -1.66 -0.88 -0.01 4.78 0.08 -1.26 -4.62 117.98 114.40 2kf3 s PHE 106 Ca 0.45 1.94 0.05 0.00 0.12 0.00 0.00 56.93 59.48 2kf3 s PHE 106 Cb -0.04 0.44 -0.01 0.00 -0.57 0.00 0.00 43.02 42.85 2kf3 s PHE 106 CO 0.29 -0.43 -0.15 0.99 -0.10 0.00 0.00 175.22 175.81 2kf3 s THR 107 N 0.98 1.20 0.14 0.64 2.01 0.35 -4.98 115.64 115.98 2kf3 s THR 107 Ca -0.05 -0.65 -0.23 0.00 0.31 0.00 0.00 61.69 61.08 2kf3 s THR 107 Cb -0.05 -1.00 -0.08 0.00 0.01 0.00 0.00 72.50 71.38 2kf3 s THR 107 CO -0.10 0.34 0.71 -0.75 -0.69 0.00 0.00 174.62 174.13 2kf3 s LYS 108 N -0.33 4.44 -0.07 4.92 2.20 -1.26 -0.46 119.74 129.18 2kf3 s LYS 108 Ca 0.05 1.01 0.04 0.00 -0.36 0.00 0.00 55.97 56.72 2kf3 s LYS 108 Cb -0.06 -3.24 -0.08 0.00 -1.51 0.00 0.00 37.83 32.94 2kf3 s LYS 108 CO -0.00 0.59 -0.01 0.44 -0.36 0.00 0.00 175.35 176.00 2kf3 n ILE 109 N 1.60 0.48 -1.21 5.43 -5.35 -0.93 -4.90 119.36 114.48 2kf3 n ILE 109 Ca -0.07 -0.26 0.00 0.00 -0.27 0.00 0.00 62.75 62.15 2kf3 n ILE 109 Cb 0.49 -0.82 0.00 0.00 -1.74 0.00 0.00 39.64 37.58 2kf3 n ILE 109 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33