#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kf5 s ILE 4 N 0.00 0.10 -0.13 2.52 1.01 -1.26 -5.02 121.20 118.41 2kf5 s ILE 4 Ca 0.00 -0.67 0.18 0.00 0.00 0.00 0.00 60.65 60.16 2kf5 s ILE 4 Cb 0.00 -0.21 0.37 0.00 0.01 0.00 0.00 42.46 42.64 2kf5 s ILE 4 CO 0.00 -0.36 1.18 -0.46 0.00 0.00 0.00 174.94 175.30 2kf5 n ASN 5 N 1.99 0.43 -4.34 3.58 6.94 -1.26 -4.93 115.26 117.67 2kf5 n ASN 5 Ca -0.21 -2.04 -0.30 0.00 -0.02 0.00 0.00 54.58 52.01 2kf5 n ASN 5 Cb 0.56 -0.10 -0.15 0.00 -2.36 0.00 0.00 39.78 37.74 2kf5 n ASN 5 CO 0.00 0.00 0.00 0.42 -1.03 0.00 0.00 177.26 176.65 2kf5 s THR 6 N -1.13 2.13 0.00 5.53 -4.23 -1.26 0.91 115.64 117.60 2kf5 s THR 6 Ca 0.22 -1.35 0.00 0.00 -1.18 0.00 0.00 61.69 59.38 2kf5 s THR 6 Cb 0.31 -1.81 0.00 0.00 1.34 0.00 0.00 72.50 72.33 2kf5 s THR 6 CO -0.09 0.40 0.80 0.49 -0.54 0.00 0.00 174.62 175.67 2kf5 n PHE 7 N 1.87 0.00 -0.21 3.99 3.72 -1.26 0.36 117.46 125.93 2kf5 n PHE 7 Ca -0.17 0.00 0.02 0.00 -0.05 0.00 0.00 57.45 57.25 2kf5 n PHE 7 Cb 0.52 -0.30 0.12 0.00 -0.94 0.00 0.00 39.48 38.88 2kf5 n PHE 7 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 176.76 176.27 2kf5 h ASP 8 N 0.00 -0.04 -0.35 4.37 5.19 -1.98 0.18 116.42 123.78 2kf5 h ASP 8 Ca 0.00 0.13 0.06 0.00 -0.62 0.00 0.00 57.03 56.59 2kf5 h ASP 8 Cb 0.00 0.18 -0.05 0.00 0.18 0.00 0.00 39.33 39.64 2kf5 h ASP 8 CO 0.00 -0.02 0.02 1.23 -3.12 0.00 0.00 179.24 177.35 2kf5 h GLY 9 N 0.24 0.36 0.94 2.75 0.00 -1.85 0.51 103.07 106.03 2kf5 h GLY 9 Ca 0.33 0.02 -0.04 0.00 0.00 0.00 0.00 47.33 47.65 2kf5 h GLY 9 CO -0.44 -0.06 0.11 -2.08 0.00 0.00 0.00 176.54 174.06 2kf5 h VAL 10 N 0.13 1.23 0.27 4.60 2.07 0.95 0.63 116.25 126.12 2kf5 h VAL 10 Ca 0.17 -0.78 -0.01 0.00 0.82 0.00 0.00 66.70 66.90 2kf5 h VAL 10 Cb 0.22 0.93 0.00 0.00 -1.52 0.00 0.00 31.29 30.92 2kf5 h VAL 10 CO -0.26 0.27 -0.13 0.00 0.02 0.00 0.00 177.57 177.47 2kf5 h ALA 11 N 0.96 -0.36 -0.35 1.67 0.00 -0.37 0.35 119.26 121.18 2kf5 h ALA 11 Ca 0.13 -0.12 0.04 0.00 0.00 0.00 0.00 54.91 54.97 2kf5 h ALA 11 Cb 0.30 0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.19 2kf5 h ALA 11 CO -0.00 -0.65 0.10 -0.44 0.00 0.00 0.00 179.25 178.27 2kf5 h ASP 12 N -0.48 0.09 -0.17 0.00 5.19 0.04 1.38 116.42 122.48 2kf5 h ASP 12 Ca -0.04 0.04 0.03 0.00 -0.62 0.00 0.00 57.03 56.45 2kf5 h ASP 12 Cb 0.36 0.04 -0.03 0.00 0.18 0.00 0.00 39.33 39.88 2kf5 h ASP 12 CO 0.06 0.09 -0.05 0.22 -3.12 0.00 0.00 179.24 176.44 2kf5 h TYR 13 N 0.24 -0.11 -0.20 4.55 3.20 -0.65 0.92 116.97 124.93 2kf5 h TYR 13 Ca 0.16 0.02 -0.03 0.00 3.14 0.00 0.00 58.73 62.02 2kf5 h TYR 13 Cb 0.15 0.07 -0.01 0.00 1.54 0.00 0.00 36.73 38.49 2kf5 h TYR 13 CO -0.16 -0.08 0.02 -0.07 -1.64 0.00 0.00 178.16 176.23 2kf5 h LEU 14 N -0.01 0.32 -2.06 2.82 3.38 0.63 0.71 115.31 121.10 2kf5 h LEU 14 Ca 0.08 -0.28 -0.01 0.00 0.09 0.00 0.00 57.88 57.76 2kf5 h LEU 14 Cb 0.14 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 40.80 2kf5 h LEU 14 CO -0.18 0.52 -0.06 1.56 0.09 0.00 0.00 178.44 180.36 2kf5 h GLN 15 N 0.11 0.00 0.00 1.13 4.20 0.21 0.18 115.11 120.94 2kf5 h GLN 15 Ca 0.06 0.00 -0.37 0.00 0.06 0.00 0.00 58.65 58.40 2kf5 h GLN 15 Cb 0.34 0.00 -0.06 0.00 0.30 0.00 0.00 27.48 28.06 2kf5 h GLN 15 CO 0.01 0.06 -2.25 2.41 -0.67 0.00 0.00 178.83 178.39 2kf5 n THR 16 N -3.37 1.23 0.23 -0.54 -1.04 0.29 -4.68 114.28 106.40 2kf5 n THR 16 Ca -0.01 -0.35 0.11 0.00 -2.04 0.00 0.00 64.05 61.76 2kf5 n THR 16 Cb 0.21 -1.69 -0.10 0.00 -1.82 0.00 0.00 70.33 66.93 2kf5 n THR 16 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 2kf5 n TYR 17 N -3.82 0.20 0.00 -1.42 4.01 0.24 -4.93 117.16 111.44 2kf5 n TYR 17 Ca -0.43 0.06 0.00 0.00 -0.16 0.00 0.00 57.90 57.37 2kf5 n TYR 17 Cb 0.83 -0.50 0.00 0.00 -0.31 0.00 0.00 39.34 39.36 2kf5 n TYR 17 CO 0.00 0.00 0.00 0.72 -0.46 0.00 0.00 176.86 177.12 2kf5 n HIS 18 N -2.18 0.00 -3.00 -0.72 8.25 0.62 -4.87 115.22 113.32 2kf5 n HIS 18 Ca -0.01 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.03 2kf5 n HIS 18 Cb 0.51 -0.89 -0.05 0.00 1.12 0.00 0.00 29.99 30.68 2kf5 n HIS 18 CO 0.00 0.00 0.00 0.21 0.64 0.00 0.00 176.34 177.19 2kf5 s LYS 19 N 0.00 3.90 -0.47 -0.41 2.20 -1.26 -4.92 119.74 118.78 2kf5 s LYS 19 Ca 0.00 0.44 -0.46 0.00 -0.36 0.00 0.00 55.97 55.59 2kf5 s LYS 19 Cb 0.00 -3.75 -0.20 0.00 -1.51 0.00 0.00 37.83 32.37 2kf5 s LYS 19 CO 0.00 -0.69 1.56 1.28 -0.36 0.00 0.00 175.35 177.15 2kf5 n LEU 20 N 6.15 1.13 -2.59 5.43 4.77 -1.26 -4.56 117.00 126.08 2kf5 n LEU 20 Ca 0.02 1.18 -0.37 0.00 -0.03 0.00 0.00 56.01 56.81 2kf5 n LEU 20 Cb 0.48 -0.88 -0.06 0.00 -2.33 0.00 0.00 43.42 40.64 2kf5 n LEU 20 CO 0.50 -0.90 0.65 -2.65 -1.33 0.00 0.00 177.39 173.66 2kf5 n PRO 21 N 3.83 0.00 -1.24 3.23 -0.02 -1.26 -4.50 135.00 135.04 2kf5 n PRO 21 Ca 0.30 0.00 -0.08 0.00 -2.02 0.00 0.00 63.50 61.70 2kf5 n PRO 21 Cb -0.05 -0.82 -0.06 0.00 -0.02 0.00 0.00 33.50 32.55 2kf5 n PRO 21 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 2kf5 n ASP 22 N 2.33 -0.35 0.00 2.55 9.92 -1.26 -2.48 116.55 127.25 2kf5 n ASP 22 Ca 0.18 -1.90 0.00 0.00 -0.53 0.00 0.00 54.79 52.54 2kf5 n ASP 22 Cb -0.03 -1.09 0.00 0.00 -0.64 0.00 0.00 41.12 39.36 2kf5 n ASP 22 CO 0.00 0.00 0.00 -0.46 0.13 0.00 0.00 177.20 176.87 2kf5 n ASN 23 N 11.70 0.00 -4.72 -2.24 6.94 -1.26 0.37 115.26 126.05 2kf5 n ASN 23 Ca 0.20 0.00 -0.23 0.00 -0.02 0.00 0.00 54.58 54.53 2kf5 n ASN 23 Cb 0.47 0.00 -0.07 0.00 -2.36 0.00 0.00 39.78 37.83 2kf5 n ASN 23 CO 0.00 0.00 0.00 -0.31 -1.03 0.00 0.00 177.26 175.92 2kf5 s TYR 24 N 0.00 2.69 -0.04 -2.53 2.02 -1.04 -2.05 117.35 116.40 2kf5 s TYR 24 Ca 0.00 -0.39 -0.28 0.00 -0.37 0.00 0.00 57.07 56.03 2kf5 s TYR 24 Cb 0.00 -1.62 0.06 0.00 -0.40 0.00 0.00 41.96 40.00 2kf5 s TYR 24 CO 0.00 0.36 0.61 0.96 -1.57 0.00 0.00 175.55 175.91 2kf5 s ILE 25 N -2.44 0.01 0.62 2.71 -4.36 -0.73 -4.91 121.20 112.11 2kf5 s ILE 25 Ca 0.37 -0.09 -0.17 0.00 -0.26 0.00 0.00 60.65 60.51 2kf5 s ILE 25 Cb -0.02 -0.93 -0.02 0.00 1.25 0.00 0.00 42.46 42.74 2kf5 s ILE 25 CO 0.22 -0.05 1.14 0.42 0.24 0.00 0.00 174.94 176.91 2kf5 s THR 26 N -1.24 3.05 0.15 8.37 -4.23 -1.15 0.12 115.64 120.71 2kf5 s THR 26 Ca -0.11 0.56 -0.19 0.00 -1.18 0.00 0.00 61.69 60.76 2kf5 s THR 26 Cb -0.01 -3.12 0.03 0.00 1.34 0.00 0.00 72.50 70.74 2kf5 s THR 26 CO 0.09 -0.24 1.68 0.11 -0.54 0.00 0.00 174.62 175.72 2kf5 h LYS 27 N 0.44 -0.04 -0.27 3.99 1.57 -1.91 0.03 116.57 120.37 2kf5 h LYS 27 Ca -0.48 0.00 0.04 0.00 -1.87 0.00 0.00 60.65 58.34 2kf5 h LYS 27 Cb 1.26 0.01 -0.07 0.00 0.08 0.00 0.00 32.23 33.51 2kf5 h LYS 27 CO 0.55 -0.03 -0.55 1.03 -0.57 0.00 0.00 179.45 179.88 2kf5 h SER 28 N -0.04 -1.79 -0.22 0.86 0.87 -1.98 0.90 113.55 112.16 2kf5 h SER 28 Ca 0.14 0.22 0.05 0.00 -1.23 0.00 0.00 61.79 60.98 2kf5 h SER 28 Cb 0.25 0.72 -0.07 0.00 -0.44 0.00 0.00 62.40 62.85 2kf5 h SER 28 CO -0.31 -0.44 -0.41 -0.33 -0.53 0.00 0.00 176.83 174.82 2kf5 h GLU 29 N -0.48 -0.41 -0.40 2.24 5.08 -1.74 1.03 114.58 119.90 2kf5 h GLU 29 Ca 0.05 0.03 0.08 0.00 -1.00 0.00 0.00 59.36 58.52 2kf5 h GLU 29 Cb 0.63 0.09 -0.09 0.00 0.50 0.00 0.00 28.75 29.89 2kf5 h GLU 29 CO -0.52 -0.27 -0.20 0.00 -1.00 0.00 0.00 179.01 177.02 2kf5 h ALA 30 N 0.27 0.09 0.21 3.43 0.00 -0.05 1.11 119.26 124.32 2kf5 h ALA 30 Ca 0.10 0.14 -0.01 0.00 0.00 0.00 0.00 54.91 55.14 2kf5 h ALA 30 Cb 0.60 0.48 0.00 0.00 0.00 0.00 0.00 17.79 18.88 2kf5 h ALA 30 CO -0.45 -0.57 -0.10 1.96 0.00 0.00 0.00 179.25 180.10 2kf5 h GLN 31 N -0.13 -0.28 -0.11 0.00 4.20 0.23 0.21 115.11 119.24 2kf5 h GLN 31 Ca 0.20 0.02 -0.05 0.00 0.06 0.00 0.00 58.65 58.87 2kf5 h GLN 31 Cb 0.43 0.06 -0.01 0.00 0.30 0.00 0.00 27.48 28.26 2kf5 h GLN 31 CO -0.48 -0.09 -0.17 0.00 -0.67 0.00 0.00 178.83 177.42 2kf5 h ALA 32 N 0.35 1.51 0.00 3.87 0.00 0.15 -1.41 119.26 123.74 2kf5 h ALA 32 Ca -0.03 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.66 2kf5 h ALA 32 Cb 0.31 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.03 2kf5 h ALA 32 CO 0.05 0.35 0.00 -0.07 0.00 0.00 0.00 179.25 179.58 2kf5 h LEU 33 N 0.17 0.00 0.00 0.00 3.38 0.15 -3.44 115.31 115.56 2kf5 h LEU 33 Ca 0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.00 2kf5 h LEU 33 Cb 0.41 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.16 2kf5 h LEU 33 CO 0.03 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.17 2kf5 n GLY 34 N -0.49 0.21 3.64 0.83 0.00 -0.54 -5.07 105.19 103.77 2kf5 n GLY 34 Ca -0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.59 2kf5 n GLY 34 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 2kf5 s TRP 35 N -1.13 1.23 -0.03 1.61 -0.00 0.74 -4.82 118.94 116.54 2kf5 s TRP 35 Ca 0.00 -0.11 0.08 0.00 -0.00 0.00 0.00 56.10 56.06 2kf5 s TRP 35 Cb 0.00 -4.14 -0.02 0.00 -0.00 0.00 0.00 33.47 29.32 2kf5 s TRP 35 CO 0.00 -5.06 -0.26 0.08 -0.00 0.00 0.00 176.95 171.71 2kf5 s VAL 36 N 5.84 2.03 0.08 5.86 1.01 -1.26 -4.46 120.40 129.50 2kf5 s VAL 36 Ca 0.93 -1.09 -0.34 0.00 0.00 0.00 0.00 61.98 61.47 2kf5 s VAL 36 Cb -0.39 -1.69 -0.17 0.00 0.00 0.00 0.00 36.38 34.13 2kf5 s VAL 36 CO 0.39 0.57 1.59 0.00 0.00 0.00 0.00 175.10 177.66 2kf5 h ALA 37 N 5.58 -1.02 0.00 5.51 0.00 -1.99 0.56 119.26 127.90 2kf5 h ALA 37 Ca -0.41 -0.19 -0.12 0.00 0.00 0.00 0.00 54.91 54.19 2kf5 h ALA 37 Cb 1.13 0.56 -0.04 0.00 0.00 0.00 0.00 17.79 19.44 2kf5 h ALA 37 CO 0.47 -1.10 0.07 -1.13 0.00 0.00 0.00 179.25 177.57 2kf5 n SER 38 N -5.54 3.18 0.00 0.00 3.41 -1.26 -3.12 113.62 110.29 2kf5 n SER 38 Ca -0.12 -2.09 0.00 0.00 -0.26 0.00 0.00 58.87 56.39 2kf5 n SER 38 Cb 0.43 -0.85 0.00 0.00 -0.26 0.00 0.00 64.21 63.53 2kf5 n SER 38 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 2kf5 n LYS 39 N 2.76 0.00 -2.21 4.33 4.81 -0.99 -5.01 118.16 121.84 2kf5 n LYS 39 Ca 0.26 0.00 -0.15 0.00 -0.87 0.00 0.00 58.31 57.55 2kf5 n LYS 39 Cb 0.53 0.00 -0.01 0.00 0.02 0.00 0.00 35.03 35.57 2kf5 n LYS 39 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2kf5 n GLY 40 N -1.19 -0.10 3.74 3.14 0.00 0.19 -4.92 105.19 106.06 2kf5 n GLY 40 Ca 0.00 -0.25 -0.42 0.00 0.00 0.00 0.00 46.02 45.35 2kf5 n GLY 40 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2kf5 s ASN 41 N -2.36 6.43 0.20 1.61 4.22 -1.26 -4.63 114.94 119.14 2kf5 s ASN 41 Ca 0.00 2.88 0.00 0.00 -2.14 0.00 0.00 52.86 53.60 2kf5 s ASN 41 Cb 0.00 -2.63 0.00 0.00 1.28 0.00 0.00 41.25 39.90 2kf5 s ASN 41 CO 0.00 -0.89 0.00 -0.11 -2.04 0.00 0.00 177.10 174.06 2kf5 n LEU 42 N 2.55 -1.77 0.08 3.54 7.94 -1.26 -4.63 117.00 123.44 2kf5 n LEU 42 Ca 0.09 0.60 0.18 0.00 -1.11 0.00 0.00 56.01 55.77 2kf5 n LEU 42 Cb 0.38 1.89 0.72 0.00 0.53 0.00 0.00 43.42 46.94 2kf5 n LEU 42 CO 0.63 0.10 1.17 0.00 -1.11 0.00 0.00 177.39 178.17 2kf5 h ALA 43 N 0.00 2.27 0.17 1.96 0.00 -1.80 2.00 119.26 123.86 2kf5 h ALA 43 Ca 0.00 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 2kf5 h ALA 43 Cb 0.00 0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.82 2kf5 h ALA 43 CO 0.00 -0.52 -0.08 0.38 0.00 0.00 0.00 179.25 179.03 2kf5 h ASP 44 N 0.00 -0.19 0.46 0.00 2.03 -1.94 0.07 116.42 116.85 2kf5 h ASP 44 Ca 0.19 0.01 -0.09 0.00 -0.73 0.00 0.00 57.03 56.40 2kf5 h ASP 44 Cb 0.82 0.05 -0.01 0.00 -0.83 0.00 0.00 39.33 39.35 2kf5 h ASP 44 CO -0.00 0.01 -0.45 -0.37 -1.03 0.00 0.00 179.24 177.40 2kf5 h VAL 45 N -0.52 1.31 -2.34 4.15 -1.51 -1.87 -3.36 116.25 112.11 2kf5 h VAL 45 Ca -0.02 -1.54 -0.59 0.00 -1.23 0.00 0.00 66.70 63.32 2kf5 h VAL 45 Cb 0.17 1.83 -0.38 0.00 -2.13 0.00 0.00 31.29 30.79 2kf5 h VAL 45 CO 0.04 0.44 -0.98 0.00 -1.23 0.00 0.00 177.57 175.83 2kf5 n ALA 46 N -2.45 2.83 -0.00 5.19 0.00 0.68 -5.02 120.51 121.73 2kf5 n ALA 46 Ca -0.02 -3.10 0.00 0.00 0.00 0.00 0.00 53.44 50.32 2kf5 n ALA 46 Cb 0.47 -0.75 0.00 0.00 0.00 0.00 0.00 19.45 19.17 2kf5 n ALA 46 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 2kf5 n PRO 47 N 2.79 0.00 0.00 0.00 -0.02 0.01 -2.72 135.00 135.06 2kf5 n PRO 47 Ca 0.30 -0.02 0.00 0.00 -2.02 0.00 0.00 63.50 61.75 2kf5 n PRO 47 Cb 0.48 -1.38 0.00 0.00 -0.02 0.00 0.00 33.50 32.58 2kf5 n PRO 47 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2kf5 n GLY 48 N 2.83 0.00 3.36 -1.23 0.00 -1.21 -4.90 105.19 104.03 2kf5 n GLY 48 Ca 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.74 2kf5 n GLY 48 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2kf5 s LYS 49 N 0.00 1.41 -0.08 1.61 2.20 -1.10 -5.01 119.74 118.77 2kf5 s LYS 49 Ca 0.00 -1.28 0.04 0.00 -0.36 0.00 0.00 55.97 54.38 2kf5 s LYS 49 Cb 0.00 -1.82 -0.01 0.00 -1.51 0.00 0.00 37.83 34.49 2kf5 s LYS 49 CO 0.00 0.44 -0.21 -1.12 -0.36 0.00 0.00 175.35 174.09 2kf5 s SER 50 N -1.90 3.38 0.77 1.43 0.01 -0.87 -4.89 113.70 111.63 2kf5 s SER 50 Ca 0.12 -0.44 -0.10 0.00 1.31 0.00 0.00 55.95 56.84 2kf5 s SER 50 Cb -0.10 -1.07 0.06 0.00 0.21 0.00 0.00 66.02 65.12 2kf5 s SER 50 CO 0.05 0.23 1.09 -0.63 0.41 0.00 0.00 173.24 174.39 2kf5 s ILE 51 N -0.07 3.33 0.00 1.44 -1.09 -1.26 -3.24 121.20 120.31 2kf5 s ILE 51 Ca -0.05 0.43 0.00 0.00 -2.23 0.00 0.00 60.65 58.80 2kf5 s ILE 51 Cb -0.14 -2.92 0.00 0.00 -1.58 0.00 0.00 42.46 37.82 2kf5 s ILE 51 CO 0.04 -0.56 0.00 0.61 -1.23 0.00 0.00 174.94 173.80 2kf5 n GLY 52 N -1.21 4.27 0.00 6.18 0.00 0.33 0.17 105.19 114.94 2kf5 n GLY 52 Ca 0.09 -1.28 0.00 0.00 0.00 0.00 0.00 46.02 44.83 2kf5 n GLY 52 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2kf5 n GLY 53 N -1.80 1.45 0.00 -0.02 0.00 -0.35 -1.78 105.19 102.69 2kf5 n GLY 53 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2kf5 n GLY 53 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2kf5 n ASP 54 N 0.00 -0.55 -3.95 1.61 8.00 -1.26 -4.64 116.55 115.75 2kf5 n ASP 54 Ca 0.00 -0.47 -0.22 0.00 0.71 0.00 0.00 54.79 54.81 2kf5 n ASP 54 Cb 0.00 0.00 -0.16 0.00 -0.02 0.00 0.00 41.12 40.94 2kf5 n ASP 54 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2kf5 s ILE 55 N -0.74 0.81 -0.02 0.53 -1.09 -1.26 -4.67 121.20 114.76 2kf5 s ILE 55 Ca 0.00 -0.29 -0.04 0.00 -2.23 0.00 0.00 60.65 58.09 2kf5 s ILE 55 Cb 0.00 -0.78 0.00 0.00 -1.58 0.00 0.00 42.46 40.10 2kf5 s ILE 55 CO 0.00 0.28 0.10 0.12 -1.23 0.00 0.00 174.94 174.21 2kf5 s PHE 56 N 0.80 -0.03 -0.44 3.97 5.36 -0.43 -5.03 117.98 122.18 2kf5 s PHE 56 Ca -0.13 0.09 0.23 0.00 -0.96 0.00 0.00 56.93 56.16 2kf5 s PHE 56 Cb -0.15 -0.01 0.01 0.00 -0.34 0.00 0.00 43.02 42.53 2kf5 s PHE 56 CO 0.02 -0.13 0.98 -1.13 -1.46 0.00 0.00 175.22 173.50 2kf5 n SER 57 N 2.46 0.60 -1.07 6.13 3.41 -1.26 -0.49 113.62 123.41 2kf5 n SER 57 Ca -0.16 -0.02 -0.11 0.00 -0.26 0.00 0.00 58.87 58.32 2kf5 n SER 57 Cb 0.58 0.81 -0.03 0.00 -0.26 0.00 0.00 64.21 65.32 2kf5 n SER 57 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 2kf5 n ASN 58 N -2.20 -3.97 -0.28 4.04 5.15 -1.26 -4.59 115.26 112.14 2kf5 n ASN 58 Ca 0.01 0.13 0.15 0.00 -0.60 0.00 0.00 54.58 54.27 2kf5 n ASN 58 Cb 0.48 -2.84 0.42 0.00 -0.53 0.00 0.00 39.78 37.31 2kf5 n ASN 58 CO 0.00 0.00 0.00 0.03 1.40 0.00 0.00 177.26 178.69 2kf5 h ARG 59 N 0.00 0.57 0.00 1.20 3.08 -1.93 0.97 114.38 118.28 2kf5 h ARG 59 Ca -0.25 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 59.77 2kf5 h ARG 59 Cb 0.97 -0.13 0.00 0.00 0.08 0.00 0.00 29.97 30.89 2kf5 h ARG 59 CO 0.32 0.38 0.00 0.39 -1.07 0.00 0.00 179.97 179.99 2kf5 n GLU 60 N -4.59 0.06 -3.41 0.04 4.71 -1.26 -4.83 120.64 111.35 2kf5 n GLU 60 Ca 0.20 0.51 -0.20 0.00 -0.01 0.00 0.00 57.16 57.66 2kf5 n GLU 60 Cb 0.60 -1.67 0.07 0.00 -1.01 0.00 0.00 31.44 29.43 2kf5 n GLU 60 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 2kf5 n GLY 61 N -1.15 -0.34 0.02 0.62 0.00 0.34 -4.89 105.19 99.80 2kf5 n GLY 61 Ca 0.00 0.12 0.12 0.00 0.00 0.00 0.00 46.02 46.26 2kf5 n GLY 61 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2kf5 n LYS 62 N -4.29 0.13 -4.16 1.61 0.00 -1.26 -4.91 118.16 105.29 2kf5 n LYS 62 Ca -0.06 0.03 -0.10 0.00 0.00 0.00 0.00 58.31 58.18 2kf5 n LYS 62 Cb 0.58 -1.57 -0.10 0.00 0.00 0.00 0.00 35.03 33.93 2kf5 n LYS 62 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.40 176.89 2kf5 s LEU 63 N -3.52 2.24 0.35 3.14 1.43 -1.26 -5.02 118.68 116.04 2kf5 s LEU 63 Ca 0.08 -1.09 -0.21 0.00 -1.03 0.00 0.00 54.13 51.88 2kf5 s LEU 63 Cb 0.16 0.11 -0.15 0.00 0.03 0.00 0.00 46.19 46.33 2kf5 s LEU 63 CO 0.72 -0.59 0.14 -2.65 0.23 0.00 0.00 176.35 174.20 2kf5 n PRO 64 N -0.05 0.00 -1.25 1.29 -0.02 -1.26 -5.00 135.00 128.71 2kf5 n PRO 64 Ca -0.10 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.38 2kf5 n PRO 64 Cb 0.62 -0.94 0.00 0.00 -0.02 0.00 0.00 33.50 33.16 2kf5 n PRO 64 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2kf5 n GLY 65 N 2.16 4.36 0.00 -1.23 0.00 -1.26 -4.95 105.19 104.27 2kf5 n GLY 65 Ca 0.11 -1.55 0.00 0.00 0.00 0.00 0.00 46.02 44.59 2kf5 n GLY 65 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2kf5 n LYS 66 N 0.00 0.00 -1.96 1.61 2.85 -1.26 -4.97 118.16 114.43 2kf5 n LYS 66 Ca 0.00 0.00 -0.34 0.00 -1.05 0.00 0.00 58.31 56.92 2kf5 n LYS 66 Cb 0.00 0.00 -0.05 0.00 -0.65 0.00 0.00 35.03 34.33 2kf5 n LYS 66 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 177.40 176.22 2kf5 n SER 67 N 0.00 3.28 -0.91 -5.58 3.41 -1.26 -4.30 113.62 108.27 2kf5 n SER 67 Ca 0.00 -2.73 0.00 0.00 -0.26 0.00 0.00 58.87 55.88 2kf5 n SER 67 Cb 0.00 -1.62 0.00 0.00 -0.26 0.00 0.00 64.21 62.33 2kf5 n SER 67 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2kf5 n GLY 68 N 5.42 -2.07 3.25 5.00 0.00 -1.26 -5.09 105.19 110.45 2kf5 n GLY 68 Ca 0.47 -0.61 -0.26 0.00 0.00 0.00 0.00 46.02 45.62 2kf5 n GLY 68 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2kf5 s ARG 69 N -1.43 1.39 -0.15 1.61 6.06 -1.26 -5.11 118.95 120.06 2kf5 s ARG 69 Ca 0.00 -0.95 -0.03 0.00 -2.50 0.00 0.00 55.73 52.26 2kf5 s ARG 69 Cb 0.00 -1.51 -0.02 0.00 0.06 0.00 0.00 34.95 33.48 2kf5 s ARG 69 CO 0.00 0.39 -0.06 0.95 -2.50 0.00 0.00 175.30 174.07 2kf5 s THR 70 N -0.81 3.63 -0.02 4.11 -4.23 -1.26 -4.64 115.64 112.43 2kf5 s THR 70 Ca 0.07 -0.45 0.06 0.00 -1.18 0.00 0.00 61.69 60.20 2kf5 s THR 70 Cb -0.09 -2.58 -0.01 0.00 1.34 0.00 0.00 72.50 71.16 2kf5 s THR 70 CO 0.02 0.50 -0.21 0.26 -0.54 0.00 0.00 174.62 174.65 2kf5 s TRP 71 N 0.42 1.91 0.03 3.99 0.52 0.36 -1.14 118.94 125.02 2kf5 s TRP 71 Ca -0.06 -0.39 0.01 0.00 0.02 0.00 0.00 56.10 55.68 2kf5 s TRP 71 Cb -0.15 -1.24 -0.02 0.00 -1.15 0.00 0.00 33.47 30.92 2kf5 s TRP 71 CO 0.04 -0.05 -0.04 1.03 0.02 0.00 0.00 176.95 177.94 2kf5 s ARG 72 N -0.43 0.38 0.46 4.98 3.00 0.22 -1.32 118.95 126.24 2kf5 s ARG 72 Ca 0.06 -0.65 0.04 0.00 0.00 0.00 0.00 55.73 55.18 2kf5 s ARG 72 Cb -0.09 -0.02 -0.04 0.00 0.00 0.00 0.00 34.95 34.81 2kf5 s ARG 72 CO -0.00 -0.02 0.04 -1.83 0.00 0.00 0.00 175.30 173.49 2kf5 s GLU 73 N -1.49 2.10 -0.20 3.54 4.04 -1.26 -0.32 118.70 125.11 2kf5 s GLU 73 Ca -0.14 -2.22 -0.27 0.00 0.04 0.00 0.00 54.97 52.38 2kf5 s GLU 73 Cb -0.10 -1.64 0.08 0.00 0.02 0.00 0.00 34.13 32.50 2kf5 s GLU 73 CO -0.01 -0.22 0.78 0.00 -1.84 0.00 0.00 175.26 173.98 2kf5 s ALA 74 N -2.78 -1.82 0.62 -0.84 0.00 -0.70 -1.21 121.76 115.02 2kf5 s ALA 74 Ca 0.22 1.76 -0.17 0.00 0.00 0.00 0.00 51.96 53.77 2kf5 s ALA 74 Cb 0.05 -0.84 -0.02 0.00 0.00 0.00 0.00 23.12 22.31 2kf5 s ALA 74 CO 0.12 -0.33 1.14 -0.51 0.00 0.00 0.00 175.76 176.17 2kf5 s ASP 75 N -0.24 5.26 0.05 0.00 1.11 0.13 -2.12 116.67 120.86 2kf5 s ASP 75 Ca -0.03 2.14 0.02 0.00 0.18 0.00 0.00 52.55 54.86 2kf5 s ASP 75 Cb -0.03 -2.57 -0.03 0.00 1.07 0.00 0.00 42.92 41.36 2kf5 s ASP 75 CO 0.02 -1.53 -0.07 -0.63 1.18 0.00 0.00 175.17 174.14 2kf5 s ILE 76 N -2.02 0.56 -0.89 0.77 -1.09 -0.92 -4.76 121.20 112.84 2kf5 s ILE 76 Ca 0.71 -1.26 -0.05 0.00 -2.23 0.00 0.00 60.65 57.81 2kf5 s ILE 76 Cb -0.24 -0.84 -0.02 0.00 -1.58 0.00 0.00 42.46 39.79 2kf5 s ILE 76 CO 0.36 -0.49 0.76 0.59 -1.23 0.00 0.00 174.94 174.92 2kf5 n ASN 77 N 1.13 -6.76 -4.29 3.58 3.02 0.26 -4.55 115.26 107.65 2kf5 n ASN 77 Ca -0.20 -0.50 -0.18 0.00 -0.03 0.00 0.00 54.58 53.67 2kf5 n ASN 77 Cb 0.56 -4.54 -0.10 0.00 -0.61 0.00 0.00 39.78 35.09 2kf5 n ASN 77 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 2kf5 s TYR 78 N -3.17 1.55 0.00 3.10 5.04 -1.26 -4.84 117.35 117.76 2kf5 s TYR 78 Ca 0.19 -0.59 0.00 0.00 -2.44 0.00 0.00 57.07 54.23 2kf5 s TYR 78 Cb -0.04 -0.76 0.00 0.00 0.35 0.00 0.00 41.96 41.51 2kf5 s TYR 78 CO 0.78 0.24 0.00 0.25 -1.34 0.00 0.00 175.55 175.48 2kf5 n THR 79 N 0.01 0.00 -3.33 4.34 -2.24 -1.26 -4.97 114.28 106.82 2kf5 n THR 79 Ca -0.11 0.00 -0.13 0.00 -2.27 0.00 0.00 64.05 61.54 2kf5 n THR 79 Cb 0.59 -0.02 -0.07 0.00 -2.10 0.00 0.00 70.33 68.73 2kf5 n THR 79 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 2kf5 s SER 80 N 1.00 0.75 0.00 3.42 0.15 -1.26 -3.36 113.70 114.40 2kf5 s SER 80 Ca 0.00 -0.93 0.00 0.00 0.70 0.00 0.00 55.95 55.72 2kf5 s SER 80 Cb 0.00 0.87 0.00 0.00 -1.71 0.00 0.00 66.02 65.18 2kf5 s SER 80 CO 0.00 -0.31 0.00 0.61 1.20 0.00 0.00 173.24 174.74 2kf5 n GLY 81 N 4.85 -0.88 2.99 9.45 0.00 -1.26 -4.88 105.19 115.46 2kf5 n GLY 81 Ca 0.05 0.31 -0.26 0.00 0.00 0.00 0.00 46.02 46.13 2kf5 n GLY 81 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 2kf5 n PHE 82 N 0.00 0.74 -0.13 1.61 7.35 -1.26 -4.58 117.46 121.18 2kf5 n PHE 82 Ca 0.00 -2.13 0.00 0.00 -0.76 0.00 0.00 57.45 54.56 2kf5 n PHE 82 Cb 0.00 -0.20 0.00 0.00 0.35 0.00 0.00 39.48 39.63 2kf5 n PHE 82 CO 0.00 0.00 0.00 0.54 -0.76 0.00 0.00 176.76 176.54 2kf5 n ARG 83 N -0.98 3.36 0.00 -4.13 1.74 -1.26 -4.76 116.66 110.63 2kf5 n ARG 83 Ca -0.14 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 56.94 2kf5 n ARG 83 Cb 0.53 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.97 2kf5 n ARG 83 CO 0.00 0.00 0.00 0.27 -1.52 0.00 0.00 177.63 176.38 2kf5 n ASN 84 N 0.00 1.28 -0.00 0.55 0.23 -1.26 -5.03 115.26 111.03 2kf5 n ASN 84 Ca 0.00 0.00 0.03 0.00 -0.53 0.00 0.00 54.58 54.08 2kf5 n ASN 84 Cb 0.00 0.00 -0.03 0.00 -2.08 0.00 0.00 39.78 37.67 2kf5 n ASN 84 CO 0.00 0.00 0.00 -1.54 -0.93 0.00 0.00 177.26 174.79 2kf5 n SER 85 N 0.00 1.32 -4.61 0.53 3.41 -1.26 -4.75 113.62 108.26 2kf5 n SER 85 Ca 0.00 -0.43 -0.43 0.00 -0.26 0.00 0.00 58.87 57.75 2kf5 n SER 85 Cb 0.00 1.08 -0.02 0.00 -0.26 0.00 0.00 64.21 65.00 2kf5 n SER 85 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 2kf5 s ASP 86 N -1.84 6.19 0.00 4.04 1.01 -1.26 -2.66 116.67 122.14 2kf5 s ASP 86 Ca 0.01 1.34 0.00 0.00 0.71 0.00 0.00 52.55 54.61 2kf5 s ASP 86 Cb 0.04 -2.53 -0.00 0.00 1.01 0.00 0.00 42.92 41.43 2kf5 s ASP 86 CO 0.22 -1.46 -0.01 -0.13 0.21 0.00 0.00 175.17 174.00 2kf5 s ARG 87 N 5.10 0.07 0.06 8.23 1.81 0.15 -2.17 118.95 132.20 2kf5 s ARG 87 Ca 0.73 -0.14 0.08 0.00 -1.72 0.00 0.00 55.73 54.68 2kf5 s ARG 87 Cb -0.22 0.02 -0.03 0.00 -0.45 0.00 0.00 34.95 34.27 2kf5 s ARG 87 CO 0.32 -0.01 -0.19 -1.50 -0.68 0.00 0.00 175.30 173.24 2kf5 s ILE 88 N -0.33 2.74 -0.08 1.52 2.07 -0.90 -0.82 121.20 125.40 2kf5 s ILE 88 Ca -0.04 -1.28 0.05 0.00 -1.41 0.00 0.00 60.65 57.97 2kf5 s ILE 88 Cb -0.02 -2.17 -0.00 0.00 0.13 0.00 0.00 42.46 40.39 2kf5 s ILE 88 CO -0.00 0.28 -0.24 -0.76 -1.91 0.00 0.00 174.94 172.31 2kf5 s LEU 89 N -1.59 2.06 -0.00 8.50 2.01 0.68 -1.71 118.68 128.63 2kf5 s LEU 89 Ca 0.15 -0.53 0.03 0.00 0.01 0.00 0.00 54.13 53.79 2kf5 s LEU 89 Cb -0.10 -1.37 -0.01 0.00 0.01 0.00 0.00 46.19 44.72 2kf5 s LEU 89 CO 0.06 0.18 -0.10 -0.72 1.01 0.00 0.00 176.35 176.78 2kf5 s TYR 90 N 0.19 0.89 0.44 0.29 -0.85 0.56 -0.50 117.35 118.37 2kf5 s TYR 90 Ca -0.14 -0.19 0.05 0.00 -0.52 0.00 0.00 57.07 56.27 2kf5 s TYR 90 Cb -0.16 -0.57 0.05 0.00 0.38 0.00 0.00 41.96 41.66 2kf5 s TYR 90 CO 0.07 -0.01 0.44 -1.13 -1.52 0.00 0.00 175.55 173.40 2kf5 n SER 91 N 2.71 2.10 0.12 -0.18 3.41 -0.75 -0.61 113.62 120.42 2kf5 n SER 91 Ca -0.14 -2.38 -0.13 0.00 -0.26 0.00 0.00 58.87 55.96 2kf5 n SER 91 Cb 0.56 -0.15 -0.06 0.00 -0.26 0.00 0.00 64.21 64.30 2kf5 n SER 91 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 2kf5 h SER 92 N 0.34 -0.52 0.00 4.04 4.64 -1.49 0.18 113.55 120.74 2kf5 h SER 92 Ca -0.25 0.06 0.00 0.00 -0.47 0.00 0.00 61.79 61.13 2kf5 h SER 92 Cb 0.99 0.19 0.00 0.00 -0.31 0.00 0.00 62.40 63.27 2kf5 h SER 92 CO 0.38 -0.28 0.00 -0.90 -0.87 0.00 0.00 176.83 175.16 2kf5 n ASP 93 N -5.32 0.00 -1.00 4.97 5.75 -1.26 -4.78 116.55 114.92 2kf5 n ASP 93 Ca -0.07 -0.34 -0.12 0.00 -0.01 0.00 0.00 54.79 54.26 2kf5 n ASP 93 Cb 0.23 0.00 -0.04 0.00 -1.03 0.00 0.00 41.12 40.28 2kf5 n ASP 93 CO 0.00 0.00 0.00 0.79 -0.11 0.00 0.00 177.20 177.88 2kf5 n TRP 94 N -0.82 -0.14 -2.40 2.11 7.02 0.05 -4.97 117.44 118.29 2kf5 n TRP 94 Ca 0.04 0.00 -0.42 0.00 -1.02 0.00 0.00 57.50 56.09 2kf5 n TRP 94 Cb 0.02 -2.28 -0.03 0.00 -2.42 0.00 0.00 31.31 26.60 2kf5 n TRP 94 CO 0.00 0.00 0.00 -0.51 -2.02 0.00 0.00 177.69 175.16 2kf5 s LEU 95 N -2.80 4.29 -0.07 -0.99 1.43 -1.26 -4.69 118.68 114.58 2kf5 s LEU 95 Ca 0.00 1.89 0.03 0.00 -1.03 0.00 0.00 54.13 55.02 2kf5 s LEU 95 Cb 0.00 -3.56 -0.02 0.00 0.03 0.00 0.00 46.19 42.64 2kf5 s LEU 95 CO 0.00 -0.62 -0.15 -0.63 0.23 0.00 0.00 176.35 175.18 2kf5 s ILE 96 N 2.26 2.95 0.15 -0.59 1.09 -1.04 -1.81 121.20 124.21 2kf5 s ILE 96 Ca 0.58 -0.74 0.06 0.00 -1.10 0.00 0.00 60.65 59.45 2kf5 s ILE 96 Cb -0.26 -2.17 -0.04 0.00 -1.06 0.00 0.00 42.46 38.93 2kf5 s ILE 96 CO 0.23 0.57 -0.14 -0.31 -0.10 0.00 0.00 174.94 175.19 2kf5 s TYR 97 N -0.36 1.49 0.05 3.97 1.51 0.35 -1.86 117.35 122.49 2kf5 s TYR 97 Ca 0.03 -0.58 0.07 0.00 -1.01 0.00 0.00 57.07 55.59 2kf5 s TYR 97 Cb -0.12 -0.75 -0.03 0.00 -0.11 0.00 0.00 41.96 40.95 2kf5 s TYR 97 CO 0.02 0.20 -0.21 -1.59 -1.11 0.00 0.00 175.55 172.86 2kf5 s LYS 98 N -3.03 1.37 -0.03 -0.62 -2.85 0.29 -0.23 119.74 114.64 2kf5 s LYS 98 Ca 0.13 -0.96 0.01 0.00 -1.00 0.00 0.00 55.97 54.15 2kf5 s LYS 98 Cb -0.03 -1.50 0.02 0.00 -2.06 0.00 0.00 37.83 34.26 2kf5 s LYS 98 CO 0.04 0.38 -0.01 -0.08 0.10 0.00 0.00 175.35 175.78 2kf5 s THR 99 N -0.83 0.25 -0.15 3.79 -1.32 0.00 -0.41 115.64 116.98 2kf5 s THR 99 Ca 0.07 0.02 0.07 0.00 -1.21 0.00 0.00 61.69 60.65 2kf5 s THR 99 Cb -0.09 -0.32 0.14 0.00 -1.51 0.00 0.00 72.50 70.72 2kf5 s THR 99 CO 0.02 0.15 1.09 0.35 -2.21 0.00 0.00 174.62 174.02 2kf5 n THR 100 N 4.01 1.30 -1.74 5.08 -2.24 -1.24 0.31 114.28 119.76 2kf5 n THR 100 Ca -0.26 -1.37 -0.12 0.00 -2.27 0.00 0.00 64.05 60.04 2kf5 n THR 100 Cb 0.51 0.27 0.12 0.00 -2.10 0.00 0.00 70.33 69.13 2kf5 n THR 100 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 2kf5 n ASP 101 N -0.62 3.66 -3.03 3.42 5.68 -1.21 -4.34 116.55 120.11 2kf5 n ASP 101 Ca 0.07 -3.81 -0.05 0.00 -0.50 0.00 0.00 54.79 50.49 2kf5 n ASP 101 Cb 0.40 -0.50 0.03 0.00 -1.14 0.00 0.00 41.12 39.91 2kf5 n ASP 101 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2kf5 n ALA 102 N -0.93 -2.41 -3.53 2.12 0.00 -1.09 -3.55 120.51 111.13 2kf5 n ALA 102 Ca 0.36 0.05 -0.22 0.00 0.00 0.00 0.00 53.44 53.62 2kf5 n ALA 102 Cb 0.88 -2.97 0.08 0.00 0.00 0.00 0.00 19.45 17.43 2kf5 n ALA 102 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2kf5 n TYR 103 N -2.26 -2.69 0.00 0.00 4.01 -1.26 -4.95 117.16 110.01 2kf5 n TYR 103 Ca -0.03 0.96 0.00 0.00 -0.16 0.00 0.00 57.90 58.67 2kf5 n TYR 103 Cb 0.54 -4.84 0.00 0.00 -0.31 0.00 0.00 39.34 34.73 2kf5 n TYR 103 CO 0.00 0.00 0.00 1.04 -0.46 0.00 0.00 176.86 177.44 2kf5 n GLN 104 N -4.71 0.00 -3.41 -0.72 1.13 -1.23 -5.01 117.38 103.43 2kf5 n GLN 104 Ca -0.02 0.00 -0.37 0.00 -1.94 0.00 0.00 57.00 54.67 2kf5 n GLN 104 Cb 0.57 -0.15 -0.06 0.00 0.11 0.00 0.00 30.24 30.70 2kf5 n GLN 104 CO 0.00 0.00 0.00 0.95 -1.44 0.00 0.00 177.06 176.57 2kf5 s THR 105 N -0.68 5.21 -0.80 5.09 -4.23 -1.26 -5.03 115.64 113.93 2kf5 s THR 105 Ca 0.00 0.80 -0.02 0.00 -1.18 0.00 0.00 61.69 61.29 2kf5 s THR 105 Cb 0.00 -3.74 0.20 0.00 1.34 0.00 0.00 72.50 70.30 2kf5 s THR 105 CO 0.00 0.38 0.66 -0.36 -0.54 0.00 0.00 174.62 174.76 2kf5 s PHE 106 N 0.33 3.72 0.35 3.99 0.40 -1.26 -3.82 117.98 121.69 2kf5 s PHE 106 Ca 0.23 -2.90 -0.26 0.00 -0.60 0.00 0.00 56.93 53.40 2kf5 s PHE 106 Cb -0.15 -3.24 -0.09 0.00 0.51 0.00 0.00 43.02 40.06 2kf5 s PHE 106 CO 0.09 -0.78 1.04 0.99 0.70 0.00 0.00 175.22 177.26 2kf5 s THR 107 N -0.87 3.76 0.49 0.64 2.01 0.45 -4.71 115.64 117.41 2kf5 s THR 107 Ca 0.24 1.47 -0.17 0.00 0.31 0.00 0.00 61.69 63.53 2kf5 s THR 107 Cb -0.12 -3.82 -0.08 0.00 0.01 0.00 0.00 72.50 68.49 2kf5 s THR 107 CO -0.09 0.12 0.96 -0.75 -0.69 0.00 0.00 174.62 174.17 2kf5 s LYS 108 N -2.15 3.99 0.00 4.92 2.20 -1.26 0.11 119.74 127.55 2kf5 s LYS 108 Ca 0.53 0.95 0.00 0.00 -0.36 0.00 0.00 55.97 57.09 2kf5 s LYS 108 Cb -0.24 -2.17 0.00 0.00 -1.51 0.00 0.00 37.83 33.92 2kf5 s LYS 108 CO 0.30 -0.20 0.00 0.44 -0.36 0.00 0.00 175.35 175.53 2kf5 n ILE 109 N -1.35 0.00 -1.15 5.43 -5.35 -0.78 -4.77 119.36 111.39 2kf5 n ILE 109 Ca 0.06 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.54 2kf5 n ILE 109 Cb 0.54 -0.35 0.00 0.00 -1.74 0.00 0.00 39.64 38.09 2kf5 n ILE 109 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33