#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 0.40 -0.28 2.52 1.01 -1.26 -5.03 121.20 118.57 2kf5 s ILE 4 Ca 0.00 -1.04 0.18 0.00 0.00 0.00 0.00 60.65 59.79 2kf5 s ILE 4 Cb 0.00 -0.51 0.44 0.00 0.01 0.00 0.00 42.46 42.40 2kf5 s ILE 4 CO 0.00 -0.43 1.30 -0.46 0.00 0.00 0.00 174.94 175.36 2kf5 n ASN 5 N 1.48 0.11 -4.21 3.58 6.94 -1.26 -4.93 115.26 116.98 2kf5 n ASN 5 Ca -0.23 -2.11 -0.27 0.00 -0.02 0.00 0.00 54.58 51.96 2kf5 n ASN 5 Cb 0.55 0.07 -0.16 0.00 -2.36 0.00 0.00 39.78 37.89 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 -1.78 1.57 0.00 5.53 -4.23 -1.26 0.10 115.64 115.57 2kf5 s THR 6 Ca 0.18 -0.85 0.00 0.00 -1.18 0.00 0.00 61.69 59.84 2kf5 s THR 6 Cb 0.37 -1.30 0.00 0.00 1.34 0.00 0.00 72.50 72.90 2kf5 s THR 6 CO -0.08 0.44 0.69 0.49 -0.54 0.00 0.00 174.62 175.62 2kf5 n PHE 7 N 2.60 0.00 -0.24 3.99 3.72 -1.26 0.22 117.46 126.48 2kf5 n PHE 7 Ca -0.15 0.00 0.05 0.00 -0.05 0.00 0.00 57.45 57.30 2kf5 n PHE 7 Cb 0.53 -0.19 0.17 0.00 -0.94 0.00 0.00 39.48 39.06 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 -0.01 -0.45 4.37 5.19 -1.97 0.19 116.42 123.74 2kf5 h ASP 8 Ca 0.00 0.15 0.01 0.00 -0.62 0.00 0.00 57.03 56.57 2kf5 h ASP 8 Cb 0.00 0.20 -0.03 0.00 0.18 0.00 0.00 39.33 39.69 2kf5 h ASP 8 CO 0.00 -0.04 0.28 1.23 -3.12 0.00 0.00 179.24 177.59 2kf5 h GLY 9 N 0.26 0.63 0.92 2.75 0.00 -1.79 0.56 103.07 106.40 2kf5 h GLY 9 Ca 0.41 -0.22 -0.05 0.00 0.00 0.00 0.00 47.33 47.47 2kf5 h GLY 9 CO -0.51 0.20 0.04 -2.08 0.00 0.00 0.00 176.54 174.19 2kf5 h VAL 10 N 0.57 1.24 0.81 4.60 2.07 0.95 0.14 116.25 126.63 2kf5 h VAL 10 Ca 0.17 -0.88 -0.04 0.00 0.82 0.00 0.00 66.70 66.77 2kf5 h VAL 10 Cb -0.02 1.10 0.01 0.00 -1.52 0.00 0.00 31.29 30.86 2kf5 h VAL 10 CO -0.06 0.30 -0.39 0.00 0.02 0.00 0.00 177.57 177.44 2kf5 h ALA 11 N 0.90 -1.09 -0.46 1.67 0.00 -0.59 0.53 119.26 120.21 2kf5 h ALA 11 Ca 0.11 -0.24 0.09 0.00 0.00 0.00 0.00 54.91 54.87 2kf5 h ALA 11 Cb 0.39 0.42 -0.09 0.00 0.00 0.00 0.00 17.79 18.51 2kf5 h ALA 11 CO 0.01 -1.09 -0.14 -0.44 0.00 0.00 0.00 179.25 177.59 2kf5 h ASP 12 N -1.13 -0.51 -0.39 0.00 5.19 0.13 1.24 116.42 120.95 2kf5 h ASP 12 Ca -0.11 0.15 0.04 0.00 -0.62 0.00 0.00 57.03 56.49 2kf5 h ASP 12 Cb 0.84 0.32 -0.04 0.00 0.18 0.00 0.00 39.33 40.63 2kf5 h ASP 12 CO 0.18 -0.18 0.15 0.22 -3.12 0.00 0.00 179.24 176.49 2kf5 h TYR 13 N -0.03 0.26 -0.19 4.55 3.20 -0.77 0.22 116.97 124.21 2kf5 h TYR 13 Ca 0.22 0.02 -0.05 0.00 3.14 0.00 0.00 58.73 62.06 2kf5 h TYR 13 Cb 0.37 -0.06 -0.01 0.00 1.54 0.00 0.00 36.73 38.58 2kf5 h TYR 13 CO -0.42 0.11 -0.06 -0.07 -1.64 0.00 0.00 178.16 176.08 2kf5 h LEU 14 N 0.31 0.38 -2.05 2.82 3.38 0.19 0.93 115.31 121.27 2kf5 h LEU 14 Ca 0.18 -0.38 -0.01 0.00 0.09 0.00 0.00 57.88 57.75 2kf5 h LEU 14 Cb 0.15 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 40.79 2kf5 h LEU 14 CO -0.17 0.68 -0.07 1.56 0.09 0.00 0.00 178.44 180.53 2kf5 h GLN 15 N 0.08 0.00 0.00 1.13 4.20 0.18 0.37 115.11 121.08 2kf5 h GLN 15 Ca 0.05 0.00 -0.42 0.00 0.06 0.00 0.00 58.65 58.34 2kf5 h GLN 15 Cb 0.52 0.00 -0.06 0.00 0.30 0.00 0.00 27.48 28.23 2kf5 h GLN 15 CO 0.02 0.07 -2.41 2.41 -0.67 0.00 0.00 178.83 178.25 2kf5 n THR 16 N -3.41 1.39 0.25 -0.54 -1.04 0.75 -4.68 114.28 107.00 2kf5 n THR 16 Ca -0.02 -0.37 0.11 0.00 -2.04 0.00 0.00 64.05 61.73 2kf5 n THR 16 Cb 0.22 -1.79 -0.14 0.00 -1.82 0.00 0.00 70.33 66.79 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 -4.04 0.06 0.00 -1.42 4.01 0.32 -4.94 117.16 111.15 2kf5 n TYR 17 Ca -0.49 0.02 0.00 0.00 -0.16 0.00 0.00 57.90 57.27 2kf5 n TYR 17 Cb 0.86 -0.41 0.00 0.00 -0.31 0.00 0.00 39.34 39.49 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 -2.09 0.00 -2.93 -0.72 8.25 0.13 -4.87 115.22 112.99 2kf5 n HIS 18 Ca -0.02 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.03 2kf5 n HIS 18 Cb 0.51 -0.67 -0.05 0.00 1.12 0.00 0.00 29.99 30.90 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 4.13 -0.26 -0.41 2.20 -1.26 -4.91 119.74 119.23 2kf5 s LYS 19 Ca 0.00 0.82 -0.41 0.00 -0.36 0.00 0.00 55.97 56.02 2kf5 s LYS 19 Cb 0.00 -3.66 -0.17 0.00 -1.51 0.00 0.00 37.83 32.48 2kf5 s LYS 19 CO 0.00 -0.54 1.60 1.28 -0.36 0.00 0.00 175.35 177.32 2kf5 n LEU 20 N 6.02 1.79 -2.33 5.43 4.77 -1.26 -4.61 117.00 126.82 2kf5 n LEU 20 Ca 0.04 1.12 -0.33 0.00 -0.03 0.00 0.00 56.01 56.81 2kf5 n LEU 20 Cb 0.48 -1.06 -0.05 0.00 -2.33 0.00 0.00 43.42 40.45 2kf5 n LEU 20 CO 0.47 -0.74 0.60 -2.65 -1.33 0.00 0.00 177.39 173.75 2kf5 n PRO 21 N 4.32 0.00 -1.27 3.23 -0.02 -1.26 -4.50 135.00 135.49 2kf5 n PRO 21 Ca 0.26 0.00 -0.07 0.00 -2.02 0.00 0.00 63.50 61.67 2kf5 n PRO 21 Cb 0.09 -0.74 -0.06 0.00 -0.02 0.00 0.00 33.50 32.76 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 2.18 -0.48 0.00 2.55 9.92 -1.26 -2.13 116.55 127.32 2kf5 n ASP 22 Ca 0.17 -1.84 0.00 0.00 -0.53 0.00 0.00 54.79 52.58 2kf5 n ASP 22 Cb -0.03 -1.11 0.00 0.00 -0.64 0.00 0.00 41.12 39.34 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 11.50 0.00 -4.75 -2.24 6.94 -1.26 0.33 115.26 125.79 2kf5 n ASN 23 Ca 0.21 0.00 -0.23 0.00 -0.02 0.00 0.00 54.58 54.54 2kf5 n ASN 23 Cb 0.47 0.00 -0.06 0.00 -2.36 0.00 0.00 39.78 37.84 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 2.80 -0.08 -2.53 2.02 -0.91 -1.86 117.35 116.80 2kf5 s TYR 24 Ca 0.00 -0.29 -0.26 0.00 -0.37 0.00 0.00 57.07 56.16 2kf5 s TYR 24 Cb 0.00 -1.52 0.06 0.00 -0.40 0.00 0.00 41.96 40.10 2kf5 s TYR 24 CO 0.00 0.41 0.59 0.96 -1.57 0.00 0.00 175.55 175.94 2kf5 s ILE 25 N -2.33 0.01 0.64 2.71 -4.36 -0.79 -4.90 121.20 112.18 2kf5 s ILE 25 Ca 0.36 -0.10 -0.16 0.00 -0.26 0.00 0.00 60.65 60.49 2kf5 s ILE 25 Cb -0.05 -0.89 -0.01 0.00 1.25 0.00 0.00 42.46 42.76 2kf5 s ILE 25 CO 0.23 -0.06 1.13 0.42 0.24 0.00 0.00 174.94 176.91 2kf5 s THR 26 N -0.94 3.07 0.16 8.37 -4.23 -1.13 0.12 115.64 121.06 2kf5 s THR 26 Ca -0.10 0.54 -0.17 0.00 -1.18 0.00 0.00 61.69 60.78 2kf5 s THR 26 Cb -0.02 -3.09 0.05 0.00 1.34 0.00 0.00 72.50 70.79 2kf5 s THR 26 CO 0.07 -0.27 1.69 0.11 -0.54 0.00 0.00 174.62 175.68 2kf5 h LYS 27 N 0.24 0.04 -0.23 3.99 1.57 -1.90 -0.27 116.57 120.00 2kf5 h LYS 27 Ca -0.48 -0.00 0.04 0.00 -1.87 0.00 0.00 60.65 58.35 2kf5 h LYS 27 Cb 1.26 -0.01 -0.07 0.00 0.08 0.00 0.00 32.23 33.49 2kf5 h LYS 27 CO 0.54 0.02 -0.50 1.03 -0.57 0.00 0.00 179.45 179.98 2kf5 h SER 28 N 0.04 -1.60 -0.13 0.86 0.87 -1.98 0.94 113.55 112.56 2kf5 h SER 28 Ca 0.17 0.21 0.04 0.00 -1.23 0.00 0.00 61.79 60.98 2kf5 h SER 28 Cb 0.25 0.65 -0.07 0.00 -0.44 0.00 0.00 62.40 62.79 2kf5 h SER 28 CO -0.33 -0.44 -0.42 -0.33 -0.53 0.00 0.00 176.83 174.79 2kf5 h GLU 29 N -0.48 -0.47 -0.39 2.24 5.08 -1.72 1.09 114.58 119.93 2kf5 h GLU 29 Ca 0.07 0.03 0.07 0.00 -1.00 0.00 0.00 59.36 58.53 2kf5 h GLU 29 Cb 0.64 0.11 -0.06 0.00 0.50 0.00 0.00 28.75 29.94 2kf5 h GLU 29 CO -0.48 -0.31 0.03 0.00 -1.00 0.00 0.00 179.01 177.24 2kf5 h ALA 30 N 0.12 0.39 0.21 3.43 0.00 -0.22 1.33 119.26 124.52 2kf5 h ALA 30 Ca 0.08 0.10 -0.01 0.00 0.00 0.00 0.00 54.91 55.08 2kf5 h ALA 30 Cb 0.63 0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.58 2kf5 h ALA 30 CO -0.40 -0.37 -0.10 1.96 0.00 0.00 0.00 179.25 180.34 2kf5 h GLN 31 N 0.14 -0.27 -0.15 0.00 4.20 0.20 0.27 115.11 119.50 2kf5 h GLN 31 Ca 0.19 0.02 -0.07 0.00 0.06 0.00 0.00 58.65 58.85 2kf5 h GLN 31 Cb 0.26 0.06 -0.01 0.00 0.30 0.00 0.00 27.48 28.09 2kf5 h GLN 31 CO -0.30 -0.11 -0.24 0.00 -0.67 0.00 0.00 178.83 177.51 2kf5 h ALA 32 N 0.39 1.33 0.00 3.87 0.00 0.16 -1.87 119.26 123.15 2kf5 h ALA 32 Ca -0.03 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.59 2kf5 h ALA 32 Cb 0.29 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.99 2kf5 h ALA 32 CO 0.05 0.46 0.00 -0.07 0.00 0.00 0.00 179.25 179.68 2kf5 h LEU 33 N 0.24 0.00 0.00 0.00 3.38 0.20 -3.44 115.31 115.68 2kf5 h LEU 33 Ca 0.04 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.01 2kf5 h LEU 33 Cb 0.55 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.30 2kf5 h LEU 33 CO 0.04 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.18 2kf5 n GLY 34 N -0.59 0.53 3.65 0.83 0.00 -0.71 -5.06 105.19 103.84 2kf5 n GLY 34 Ca -0.00 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.57 2kf5 n GLY 34 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 173.32 175.19 2kf5 n TRP 35 N 0.00 2.33 -5.05 1.61 -0.00 0.93 -4.84 117.44 112.42 2kf5 n TRP 35 Ca 0.00 -0.18 -0.28 0.00 -0.00 0.00 0.00 57.50 57.04 2kf5 n TRP 35 Cb 0.00 -2.73 -0.16 0.00 -0.00 0.00 0.00 31.31 28.42 2kf5 n TRP 35 CO 0.00 0.00 0.00 0.08 -0.00 0.00 0.00 177.69 177.77 2kf5 s VAL 36 N 5.05 1.70 0.09 5.87 1.01 -1.26 -4.47 120.40 128.40 2kf5 s VAL 36 Ca 0.93 -0.90 -0.33 0.00 0.00 0.00 0.00 61.98 61.69 2kf5 s VAL 36 Cb -0.53 -1.43 -0.15 0.00 0.00 0.00 0.00 36.38 34.27 2kf5 s VAL 36 CO 0.45 0.48 1.60 0.00 0.00 0.00 0.00 175.10 177.63 2kf5 h ALA 37 N 5.86 -0.88 0.00 5.51 0.00 -1.99 0.41 119.26 128.17 2kf5 h ALA 37 Ca -0.36 -0.15 -0.17 0.00 0.00 0.00 0.00 54.91 54.23 2kf5 h ALA 37 Cb 1.15 0.55 -0.03 0.00 0.00 0.00 0.00 17.79 19.47 2kf5 h ALA 37 CO 0.48 -1.03 0.51 -1.13 0.00 0.00 0.00 179.25 178.07 2kf5 n SER 38 N -5.50 3.57 0.02 0.00 3.41 -1.26 -3.20 113.62 110.67 2kf5 n SER 38 Ca -0.11 -2.14 0.00 0.00 -0.26 0.00 0.00 58.87 56.36 2kf5 n SER 38 Cb 0.39 -0.91 0.00 0.00 -0.26 0.00 0.00 64.21 63.44 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 2.98 0.00 -1.87 4.33 4.81 -1.00 -5.01 118.16 122.40 2kf5 n LYS 39 Ca 0.30 0.00 -0.10 0.00 -0.87 0.00 0.00 58.31 57.64 2kf5 n LYS 39 Cb 0.47 0.00 -0.02 0.00 0.02 0.00 0.00 35.03 35.50 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 -1.17 0.37 3.72 3.14 0.00 0.14 -4.94 105.19 106.46 2kf5 n GLY 40 Ca 0.00 -0.52 -0.42 0.00 0.00 0.00 0.00 46.02 45.07 2kf5 n GLY 40 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2kf5 n ASN 41 N 0.26 3.82 0.07 1.61 6.94 -1.26 -4.61 115.26 122.09 2kf5 n ASN 41 Ca -0.11 1.10 0.00 0.00 -0.02 0.00 0.00 54.58 55.55 2kf5 n ASN 41 Cb 0.49 -1.56 0.00 0.00 -2.36 0.00 0.00 39.78 36.35 2kf5 n ASN 41 CO 0.00 0.00 0.00 -0.11 -1.03 0.00 0.00 177.26 176.12 2kf5 n LEU 42 N 3.24 -1.19 0.12 -4.53 7.94 -1.26 -4.64 117.00 116.67 2kf5 n LEU 42 Ca 0.13 0.46 0.19 0.00 -1.11 0.00 0.00 56.01 55.68 2kf5 n LEU 42 Cb 0.35 1.37 0.76 0.00 0.53 0.00 0.00 43.42 46.43 2kf5 n LEU 42 CO 0.64 0.03 1.17 0.00 -1.11 0.00 0.00 177.39 178.11 2kf5 h ALA 43 N 0.00 2.09 0.04 1.96 0.00 -1.81 2.30 119.26 123.85 2kf5 h ALA 43 Ca 0.00 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 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 -0.51 -0.02 0.38 0.00 0.00 0.00 179.25 179.10 2kf5 h ASP 44 N 0.00 -0.05 0.39 0.00 2.03 -1.94 -0.46 116.42 116.39 2kf5 h ASP 44 Ca 0.16 0.00 -0.06 0.00 -0.73 0.00 0.00 57.03 56.41 2kf5 h ASP 44 Cb 0.82 0.01 -0.01 0.00 -0.83 0.00 0.00 39.33 39.32 2kf5 h ASP 44 CO -0.00 0.03 -0.27 -0.37 -1.03 0.00 0.00 179.24 177.59 2kf5 h VAL 45 N -0.18 1.03 -2.25 4.15 -1.51 -1.87 -3.34 116.25 112.28 2kf5 h VAL 45 Ca -0.01 -1.00 -0.56 0.00 -1.23 0.00 0.00 66.70 63.91 2kf5 h VAL 45 Cb 0.04 1.56 -0.37 0.00 -2.13 0.00 0.00 31.29 30.40 2kf5 h VAL 45 CO 0.01 0.27 -0.96 0.00 -1.23 0.00 0.00 177.57 175.66 2kf5 n ALA 46 N -2.41 2.53 0.00 5.19 0.00 0.78 -5.02 120.51 121.58 2kf5 n ALA 46 Ca -0.02 -2.99 0.00 0.00 0.00 0.00 0.00 53.44 50.43 2kf5 n ALA 46 Cb 0.35 -0.80 0.00 0.00 0.00 0.00 0.00 19.45 19.00 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 2.75 0.00 0.00 0.00 -0.02 -0.18 -2.59 135.00 134.95 2kf5 n PRO 47 Ca 0.29 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.77 2kf5 n PRO 47 Cb 0.49 -1.32 0.00 0.00 -0.02 0.00 0.00 33.50 32.65 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 2.70 0.00 3.41 -1.23 0.00 -1.23 -4.91 105.19 103.93 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 1.48 -0.06 1.61 2.20 -1.07 -5.00 119.74 118.90 2kf5 s LYS 49 Ca 0.00 -1.43 0.06 0.00 -0.36 0.00 0.00 55.97 54.23 2kf5 s LYS 49 Cb 0.00 -1.88 -0.01 0.00 -1.51 0.00 0.00 37.83 34.43 2kf5 s LYS 49 CO 0.00 0.42 -0.24 -1.12 -0.36 0.00 0.00 175.35 174.05 2kf5 s SER 50 N -2.39 3.01 0.72 1.43 0.01 -0.78 -4.89 113.70 110.82 2kf5 s SER 50 Ca 0.18 -0.51 -0.12 0.00 1.31 0.00 0.00 55.95 56.81 2kf5 s SER 50 Cb -0.09 -0.91 0.03 0.00 0.21 0.00 0.00 66.02 65.26 2kf5 s SER 50 CO 0.08 0.23 1.09 -0.63 0.41 0.00 0.00 173.24 174.42 2kf5 s ILE 51 N -0.07 3.40 0.00 1.44 -1.09 -1.26 -3.33 121.20 120.28 2kf5 s ILE 51 Ca -0.06 0.52 0.00 0.00 -2.23 0.00 0.00 60.65 58.88 2kf5 s ILE 51 Cb -0.14 -3.04 0.00 0.00 -1.58 0.00 0.00 42.46 37.69 2kf5 s ILE 51 CO 0.04 -0.53 0.00 0.61 -1.23 0.00 0.00 174.94 173.83 2kf5 n GLY 52 N -1.08 4.02 0.00 6.18 0.00 0.32 -0.05 105.19 114.58 2kf5 n GLY 52 Ca 0.09 -1.24 0.00 0.00 0.00 0.00 0.00 46.02 44.87 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 -1.65 1.46 0.00 -0.02 0.00 -0.47 -1.88 105.19 102.63 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 -0.38 -3.99 1.61 8.00 -1.26 -4.61 116.55 115.91 2kf5 n ASP 54 Ca 0.00 -0.57 -0.22 0.00 0.71 0.00 0.00 54.79 54.71 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 -0.76 0.88 -0.05 0.53 -1.09 -1.26 -4.67 121.20 114.78 2kf5 s ILE 55 Ca 0.00 -0.37 -0.07 0.00 -2.23 0.00 0.00 60.65 57.98 2kf5 s ILE 55 Cb 0.00 -0.81 0.01 0.00 -1.58 0.00 0.00 42.46 40.08 2kf5 s ILE 55 CO 0.00 0.29 0.17 0.12 -1.23 0.00 0.00 174.94 174.29 2kf5 s PHE 56 N 0.48 -0.14 -0.68 3.97 5.36 -0.22 -5.01 117.98 121.74 2kf5 s PHE 56 Ca -0.09 0.34 0.23 0.00 -0.96 0.00 0.00 56.93 56.46 2kf5 s PHE 56 Cb -0.12 0.04 0.13 0.00 -0.34 0.00 0.00 43.02 42.73 2kf5 s PHE 56 CO 0.02 -0.14 1.11 -1.13 -1.46 0.00 0.00 175.22 173.61 2kf5 n SER 57 N 2.61 0.63 -2.05 6.13 3.41 -1.26 -0.05 113.62 123.04 2kf5 n SER 57 Ca -0.15 -0.20 -0.17 0.00 -0.26 0.00 0.00 58.87 58.09 2kf5 n SER 57 Cb 0.58 0.65 0.00 0.00 -0.26 0.00 0.00 64.21 65.18 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 -1.91 -4.96 0.08 4.04 5.15 -1.26 -4.63 115.26 111.76 2kf5 n ASN 58 Ca 0.03 -0.08 0.08 0.00 -0.60 0.00 0.00 54.58 54.00 2kf5 n ASN 58 Cb 0.42 -3.98 0.53 0.00 -0.53 0.00 0.00 39.78 36.22 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 -0.36 0.28 0.00 1.20 3.08 -1.93 0.17 114.38 116.83 2kf5 h ARG 59 Ca -0.40 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 59.63 2kf5 h ARG 59 Cb 1.29 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 31.27 2kf5 h ARG 59 CO 0.46 0.19 0.00 0.93 -1.07 0.00 0.00 179.97 180.47 2kf5 h GLU 60 N 0.29 0.00 -2.49 0.04 3.07 -1.99 -3.46 114.58 110.04 2kf5 h GLU 60 Ca 0.13 0.00 -0.22 0.00 -0.50 0.00 0.00 59.36 58.77 2kf5 h GLU 60 Cb 0.14 0.00 0.03 0.00 -0.84 0.00 0.00 28.75 28.08 2kf5 h GLU 60 CO -0.03 0.00 -0.32 0.41 -1.40 0.00 0.00 179.01 177.67 2kf5 n GLY 61 N -0.69 0.01 0.11 -3.84 0.00 0.61 -4.90 105.19 96.49 2kf5 n GLY 61 Ca -0.01 -0.31 0.12 0.00 0.00 0.00 0.00 46.02 45.82 2kf5 n GLY 61 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2kf5 h LYS 62 N -0.64 0.00 -5.11 1.61 3.11 -1.89 -3.47 116.57 110.18 2kf5 h LYS 62 Ca -0.28 0.00 -0.37 0.00 -2.81 0.00 0.00 60.65 57.19 2kf5 h LYS 62 Cb 1.20 0.00 -0.14 0.00 -1.00 0.00 0.00 32.23 32.28 2kf5 h LYS 62 CO 0.31 0.00 -0.68 -0.51 -2.81 0.00 0.00 179.45 175.76 2kf5 s LEU 63 N -4.83 2.30 0.40 5.20 1.43 -1.26 -5.01 118.68 116.91 2kf5 s LEU 63 Ca 0.06 -1.16 -0.22 0.00 -1.03 0.00 0.00 54.13 51.78 2kf5 s LEU 63 Cb 0.11 -0.31 -0.14 0.00 0.03 0.00 0.00 46.19 45.88 2kf5 s LEU 63 CO 0.69 -0.45 0.40 -2.65 0.23 0.00 0.00 176.35 174.58 2kf5 n PRO 64 N -0.36 0.35 -1.27 1.29 -0.02 -1.26 -5.00 135.00 128.73 2kf5 n PRO 64 Ca -0.07 0.13 0.00 0.00 -2.02 0.00 0.00 63.50 61.54 2kf5 n PRO 64 Cb 0.63 -1.31 0.00 0.00 -0.02 0.00 0.00 33.50 32.80 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 1.97 4.52 0.00 -1.23 0.00 -1.26 -4.95 105.19 104.24 2kf5 n GLY 65 Ca 0.12 -1.61 0.00 0.00 0.00 0.00 0.00 46.02 44.53 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 -0.09 -2.01 1.61 2.85 -1.26 -4.98 118.16 114.28 2kf5 n LYS 66 Ca 0.00 0.00 -0.27 0.00 -1.05 0.00 0.00 58.31 56.99 2kf5 n LYS 66 Cb 0.00 0.00 -0.07 0.00 -0.65 0.00 0.00 35.03 34.31 2kf5 n LYS 66 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 177.40 175.81 2kf5 s SER 67 N -4.00 4.84 0.00 -5.58 1.04 -1.26 -4.19 113.70 104.55 2kf5 s SER 67 Ca 0.00 -1.57 0.00 0.00 0.48 0.00 0.00 55.95 54.86 2kf5 s SER 67 Cb 0.00 -2.59 0.00 0.00 0.10 0.00 0.00 66.02 63.53 2kf5 s SER 67 CO 0.00 -3.27 0.00 0.61 0.98 0.00 0.00 173.24 171.56 2kf5 n GLY 68 N 5.86 -2.27 3.19 7.32 0.00 -1.26 -5.09 105.19 112.95 2kf5 n GLY 68 Ca 0.44 -0.59 -0.23 0.00 0.00 0.00 0.00 46.02 45.64 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 -1.50 1.23 -0.12 1.61 6.06 -1.26 -5.11 118.95 119.87 2kf5 s ARG 69 Ca 0.00 -0.78 -0.01 0.00 -2.50 0.00 0.00 55.73 52.44 2kf5 s ARG 69 Cb 0.00 -1.27 -0.02 0.00 0.06 0.00 0.00 34.95 33.72 2kf5 s ARG 69 CO 0.00 0.33 -0.09 0.95 -2.50 0.00 0.00 175.30 173.98 2kf5 s THR 70 N -0.70 3.42 0.03 4.11 -4.23 -1.26 -4.58 115.64 112.42 2kf5 s THR 70 Ca 0.05 -0.54 0.07 0.00 -1.18 0.00 0.00 61.69 60.09 2kf5 s THR 70 Cb -0.08 -2.44 -0.02 0.00 1.34 0.00 0.00 72.50 71.30 2kf5 s THR 70 CO 0.01 0.53 -0.21 0.26 -0.54 0.00 0.00 174.62 174.68 2kf5 s TRP 71 N 0.05 1.82 -0.00 3.99 0.52 0.93 -0.93 118.94 125.31 2kf5 s TRP 71 Ca -0.03 -0.37 -0.06 0.00 0.02 0.00 0.00 56.10 55.67 2kf5 s TRP 71 Cb -0.14 -1.11 0.00 0.00 -1.15 0.00 0.00 33.47 31.07 2kf5 s TRP 71 CO 0.04 0.06 0.12 1.03 0.02 0.00 0.00 176.95 178.21 2kf5 s ARG 72 N -0.98 0.41 0.49 4.98 3.00 0.01 -1.05 118.95 125.81 2kf5 s ARG 72 Ca 0.08 -0.34 0.03 0.00 0.00 0.00 0.00 55.73 55.50 2kf5 s ARG 72 Cb -0.09 0.17 -0.03 0.00 0.00 0.00 0.00 34.95 35.01 2kf5 s ARG 72 CO 0.01 -0.09 0.03 -1.83 0.00 0.00 0.00 175.30 173.42 2kf5 s GLU 73 N -1.17 2.14 -0.18 3.54 4.04 -1.26 -0.52 118.70 125.29 2kf5 s GLU 73 Ca -0.13 -2.30 -0.28 0.00 0.04 0.00 0.00 54.97 52.31 2kf5 s GLU 73 Cb -0.07 -1.60 0.08 0.00 0.02 0.00 0.00 34.13 32.57 2kf5 s GLU 73 CO 0.01 -0.29 0.76 0.00 -1.84 0.00 0.00 175.26 173.90 2kf5 s ALA 74 N -2.83 -1.81 0.71 -0.84 0.00 -0.70 -1.37 121.76 114.92 2kf5 s ALA 74 Ca 0.15 1.70 -0.14 0.00 0.00 0.00 0.00 51.96 53.66 2kf5 s ALA 74 Cb 0.03 -0.71 0.03 0.00 0.00 0.00 0.00 23.12 22.47 2kf5 s ALA 74 CO 0.08 -0.34 1.14 -0.51 0.00 0.00 0.00 175.76 176.13 2kf5 s ASP 75 N -0.38 4.63 0.02 0.00 1.11 0.93 -2.08 116.67 120.90 2kf5 s ASP 75 Ca -0.04 2.10 -0.04 0.00 0.18 0.00 0.00 52.55 54.76 2kf5 s ASP 75 Cb -0.03 -2.56 -0.01 0.00 1.07 0.00 0.00 42.92 41.39 2kf5 s ASP 75 CO 0.04 -1.95 0.05 -0.63 1.18 0.00 0.00 175.17 173.85 2kf5 s ILE 76 N -2.30 0.11 -1.02 0.77 -1.09 -0.96 -4.74 121.20 111.98 2kf5 s ILE 76 Ca 0.69 -0.91 -0.08 0.00 -2.23 0.00 0.00 60.65 58.12 2kf5 s ILE 76 Cb -0.23 -0.49 -0.05 0.00 -1.58 0.00 0.00 42.46 40.11 2kf5 s ILE 76 CO 0.45 -0.50 0.86 0.59 -1.23 0.00 0.00 174.94 175.11 2kf5 n ASN 77 N 1.33 -6.56 -4.33 3.58 3.02 0.28 -4.55 115.26 108.04 2kf5 n ASN 77 Ca -0.22 -0.68 -0.20 0.00 -0.03 0.00 0.00 54.58 53.45 2kf5 n ASN 77 Cb 0.56 -4.84 -0.11 0.00 -0.61 0.00 0.00 39.78 34.79 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 -3.34 1.72 0.00 3.10 5.04 -1.26 -4.84 117.35 117.76 2kf5 s TYR 78 Ca 0.39 -0.53 0.00 0.00 -2.44 0.00 0.00 57.07 54.49 2kf5 s TYR 78 Cb -0.07 -0.83 0.00 0.00 0.35 0.00 0.00 41.96 41.41 2kf5 s TYR 78 CO 0.77 0.33 0.00 0.25 -1.34 0.00 0.00 175.55 175.55 2kf5 n THR 79 N -0.04 0.00 -3.36 4.34 -2.24 -1.26 -4.97 114.28 106.75 2kf5 n THR 79 Ca -0.11 0.00 -0.14 0.00 -2.27 0.00 0.00 64.05 61.53 2kf5 n THR 79 Cb 0.59 -0.04 -0.08 0.00 -2.10 0.00 0.00 70.33 68.70 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 1.13 0.00 3.42 0.15 -1.26 -3.47 113.70 114.67 2kf5 s SER 80 Ca 0.00 -0.78 0.00 0.00 0.70 0.00 0.00 55.95 55.87 2kf5 s SER 80 Cb 0.00 0.73 0.00 0.00 -1.71 0.00 0.00 66.02 65.04 2kf5 s SER 80 CO 0.00 -0.35 0.00 0.61 1.20 0.00 0.00 173.24 174.70 2kf5 n GLY 81 N 5.12 -0.75 3.42 9.45 0.00 -1.26 -4.89 105.19 116.29 2kf5 n GLY 81 Ca 0.01 0.25 -0.29 0.00 0.00 0.00 0.00 46.02 45.99 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 0.87 -0.12 1.61 7.35 -1.26 -4.60 117.46 121.30 2kf5 n PHE 82 Ca 0.00 -2.44 0.00 0.00 -0.76 0.00 0.00 57.45 54.25 2kf5 n PHE 82 Cb 0.00 -0.24 0.00 0.00 0.35 0.00 0.00 39.48 39.59 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 -1.13 3.16 0.00 -4.13 1.74 -1.26 -4.76 116.66 110.28 2kf5 n ARG 83 Ca -0.16 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 56.92 2kf5 n ARG 83 Cb 0.61 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 32.05 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 3.24 -0.00 0.55 0.23 -1.26 -5.03 115.26 112.99 2kf5 n ASN 84 Ca 0.00 0.00 0.05 0.00 -0.53 0.00 0.00 54.58 54.10 2kf5 n ASN 84 Cb 0.00 0.00 -0.07 0.00 -2.08 0.00 0.00 39.78 37.63 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 0.95 -4.61 0.53 3.41 -1.26 -4.76 113.62 107.88 2kf5 n SER 85 Ca 0.00 -0.58 -0.43 0.00 -0.26 0.00 0.00 58.87 57.60 2kf5 n SER 85 Cb 0.00 1.11 -0.02 0.00 -0.26 0.00 0.00 64.21 65.04 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 -2.28 6.20 -0.00 4.04 1.01 -1.26 -2.72 116.67 121.66 2kf5 s ASP 86 Ca 0.02 1.25 -0.01 0.00 0.71 0.00 0.00 52.55 54.52 2kf5 s ASP 86 Cb 0.08 -2.53 -0.00 0.00 1.01 0.00 0.00 42.92 41.47 2kf5 s ASP 86 CO 0.44 -1.47 0.01 -0.13 0.21 0.00 0.00 175.17 174.23 2kf5 s ARG 87 N 5.09 0.11 0.10 8.23 1.81 0.11 -2.26 118.95 132.14 2kf5 s ARG 87 Ca 0.71 -0.15 0.08 0.00 -1.72 0.00 0.00 55.73 54.65 2kf5 s ARG 87 Cb -0.20 0.04 -0.04 0.00 -0.45 0.00 0.00 34.95 34.30 2kf5 s ARG 87 CO 0.32 -0.02 -0.16 -1.50 -0.68 0.00 0.00 175.30 173.26 2kf5 s ILE 88 N -0.41 2.99 -0.08 1.52 2.07 -0.88 -0.95 121.20 125.46 2kf5 s ILE 88 Ca -0.05 -1.40 0.03 0.00 -1.41 0.00 0.00 60.65 57.83 2kf5 s ILE 88 Cb -0.03 -2.37 0.01 0.00 0.13 0.00 0.00 42.46 40.20 2kf5 s ILE 88 CO -0.00 0.13 -0.17 -0.76 -1.91 0.00 0.00 174.94 172.23 2kf5 s LEU 89 N -2.07 1.85 -0.00 8.50 2.01 0.24 -1.72 118.68 127.49 2kf5 s LEU 89 Ca 0.18 -0.41 0.04 0.00 0.01 0.00 0.00 54.13 53.96 2kf5 s LEU 89 Cb -0.11 -1.07 -0.01 0.00 0.01 0.00 0.00 46.19 45.01 2kf5 s LEU 89 CO 0.10 0.10 -0.13 -0.72 1.01 0.00 0.00 176.35 176.72 2kf5 s TYR 90 N 0.45 1.12 0.43 0.29 -0.85 0.32 -0.54 117.35 118.56 2kf5 s TYR 90 Ca -0.15 -0.23 0.06 0.00 -0.52 0.00 0.00 57.07 56.23 2kf5 s TYR 90 Cb -0.16 -0.71 0.06 0.00 0.38 0.00 0.00 41.96 41.53 2kf5 s TYR 90 CO 0.06 -0.01 0.49 -1.13 -1.52 0.00 0.00 175.55 173.43 2kf5 n SER 91 N 2.67 1.90 0.08 -0.18 3.41 -0.73 -0.81 113.62 119.96 2kf5 n SER 91 Ca -0.14 -2.28 -0.12 0.00 -0.26 0.00 0.00 58.87 56.07 2kf5 n SER 91 Cb 0.56 -0.21 -0.05 0.00 -0.26 0.00 0.00 64.21 64.25 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 0.24 -0.44 0.00 4.04 4.64 -1.39 0.10 113.55 120.74 2kf5 h SER 92 Ca -0.23 0.06 0.00 0.00 -0.47 0.00 0.00 61.79 61.15 2kf5 h SER 92 Cb 0.96 0.18 0.00 0.00 -0.31 0.00 0.00 62.40 63.23 2kf5 h SER 92 CO 0.34 -0.22 0.00 -0.90 -0.87 0.00 0.00 176.83 175.18 2kf5 n ASP 93 N -5.29 0.00 -0.81 4.97 5.75 -1.26 -4.79 116.55 115.13 2kf5 n ASP 93 Ca -0.06 -0.56 -0.10 0.00 -0.01 0.00 0.00 54.79 54.06 2kf5 n ASP 93 Cb 0.20 0.00 -0.04 0.00 -1.03 0.00 0.00 41.12 40.25 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 -0.76 -0.05 -2.35 2.11 7.02 0.36 -4.98 117.44 118.78 2kf5 n TRP 94 Ca 0.05 0.00 -0.42 0.00 -1.02 0.00 0.00 57.50 56.11 2kf5 n TRP 94 Cb 0.02 -1.98 -0.03 0.00 -2.42 0.00 0.00 31.31 26.90 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 -2.34 4.32 -0.08 -0.99 1.43 -1.26 -4.67 118.68 115.10 2kf5 s LEU 95 Ca 0.00 2.01 0.02 0.00 -1.03 0.00 0.00 54.13 55.13 2kf5 s LEU 95 Cb 0.00 -3.57 -0.02 0.00 0.03 0.00 0.00 46.19 42.63 2kf5 s LEU 95 CO 0.00 -0.60 -0.14 -0.63 0.23 0.00 0.00 176.35 175.21 2kf5 s ILE 96 N 1.87 3.08 0.11 -0.59 1.09 -1.11 -1.77 121.20 123.88 2kf5 s ILE 96 Ca 0.60 -0.69 0.06 0.00 -1.10 0.00 0.00 60.65 59.52 2kf5 s ILE 96 Cb -0.29 -2.24 -0.04 0.00 -1.06 0.00 0.00 42.46 38.83 2kf5 s ILE 96 CO 0.26 0.57 -0.15 -0.31 -0.10 0.00 0.00 174.94 175.21 2kf5 s TYR 97 N -0.37 1.44 0.09 3.97 1.51 0.29 -2.05 117.35 122.23 2kf5 s TYR 97 Ca 0.04 -0.51 0.10 0.00 -1.01 0.00 0.00 57.07 55.69 2kf5 s TYR 97 Cb -0.12 -0.76 -0.04 0.00 -0.11 0.00 0.00 41.96 40.93 2kf5 s TYR 97 CO 0.02 0.15 -0.26 -1.59 -1.11 0.00 0.00 175.55 172.76 2kf5 s LYS 98 N -2.38 1.59 -0.03 -0.62 -2.85 0.30 -0.59 119.74 115.17 2kf5 s LYS 98 Ca 0.07 -1.24 -0.01 0.00 -1.00 0.00 0.00 55.97 53.79 2kf5 s LYS 98 Cb -0.07 -1.95 0.03 0.00 -2.06 0.00 0.00 37.83 33.78 2kf5 s LYS 98 CO 0.03 0.48 0.06 -0.08 0.10 0.00 0.00 175.35 175.94 2kf5 s THR 99 N -0.97 -0.05 -0.06 3.79 -1.32 -0.12 -0.29 115.64 116.62 2kf5 s THR 99 Ca 0.13 0.17 0.09 0.00 -1.21 0.00 0.00 61.69 60.88 2kf5 s THR 99 Cb -0.10 -0.12 0.14 0.00 -1.51 0.00 0.00 72.50 70.92 2kf5 s THR 99 CO 0.05 0.07 1.06 0.35 -2.21 0.00 0.00 174.62 173.94 2kf5 n THR 100 N 3.99 1.40 -1.70 5.08 -2.24 -1.24 0.03 114.28 119.60 2kf5 n THR 100 Ca -0.25 -1.59 -0.07 0.00 -2.27 0.00 0.00 64.05 59.88 2kf5 n THR 100 Cb 0.52 0.14 0.14 0.00 -2.10 0.00 0.00 70.33 69.04 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 -0.94 3.05 -2.88 3.42 5.68 -1.21 -4.41 116.55 119.26 2kf5 n ASP 101 Ca 0.08 -3.84 -0.06 0.00 -0.50 0.00 0.00 54.79 50.48 2kf5 n ASP 101 Cb 0.46 -0.51 0.03 0.00 -1.14 0.00 0.00 41.12 39.96 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 -0.99 -2.26 -3.53 2.12 0.00 -1.10 -3.65 120.51 111.10 2kf5 n ALA 102 Ca 0.31 0.05 -0.20 0.00 0.00 0.00 0.00 53.44 53.60 2kf5 n ALA 102 Cb 0.84 -2.92 0.08 0.00 0.00 0.00 0.00 19.45 17.45 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 -2.23 -2.44 0.00 0.00 4.01 -1.26 -4.95 117.16 110.29 2kf5 n TYR 103 Ca -0.03 0.96 0.00 0.00 -0.16 0.00 0.00 57.90 58.68 2kf5 n TYR 103 Cb 0.55 -5.00 0.00 0.00 -0.31 0.00 0.00 39.34 34.58 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 -4.49 0.00 -3.38 -0.72 1.13 -1.24 -5.00 117.38 103.67 2kf5 n GLN 104 Ca -0.17 0.00 -0.38 0.00 -1.94 0.00 0.00 57.00 54.51 2kf5 n GLN 104 Cb 0.62 -0.08 -0.08 0.00 0.11 0.00 0.00 30.24 30.82 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 -0.63 5.19 -0.93 5.09 -4.23 -1.26 -5.02 115.64 113.86 2kf5 s THR 105 Ca 0.00 0.69 -0.06 0.00 -1.18 0.00 0.00 61.69 61.13 2kf5 s THR 105 Cb 0.00 -3.73 0.23 0.00 1.34 0.00 0.00 72.50 70.35 2kf5 s THR 105 CO 0.00 0.23 0.85 -0.36 -0.54 0.00 0.00 174.62 174.80 2kf5 s PHE 106 N 1.48 3.95 0.30 3.99 0.40 -1.26 -3.87 117.98 122.96 2kf5 s PHE 106 Ca 0.18 -2.72 -0.28 0.00 -0.60 0.00 0.00 56.93 53.52 2kf5 s PHE 106 Cb -0.15 -3.53 -0.09 0.00 0.51 0.00 0.00 43.02 39.76 2kf5 s PHE 106 CO 0.08 -0.86 1.01 0.99 0.70 0.00 0.00 175.22 177.14 2kf5 s THR 107 N -0.93 3.86 0.50 0.64 2.01 0.60 -4.70 115.64 117.61 2kf5 s THR 107 Ca 0.26 1.72 -0.20 0.00 0.31 0.00 0.00 61.69 63.78 2kf5 s THR 107 Cb -0.10 -4.03 -0.08 0.00 0.01 0.00 0.00 72.50 68.29 2kf5 s THR 107 CO -0.09 0.30 1.04 -0.75 -0.69 0.00 0.00 174.62 174.43 2kf5 s LYS 108 N -1.68 3.74 0.00 4.92 2.20 -1.26 0.11 119.74 127.77 2kf5 s LYS 108 Ca 0.47 1.35 0.00 0.00 -0.36 0.00 0.00 55.97 57.43 2kf5 s LYS 108 Cb -0.26 -2.09 0.00 0.00 -1.51 0.00 0.00 37.83 33.98 2kf5 s LYS 108 CO 0.32 -0.48 0.00 0.44 -0.36 0.00 0.00 175.35 175.27 2kf5 n ILE 109 N -1.09 0.00 -1.02 5.43 -5.35 -0.87 -4.74 119.36 111.71 2kf5 n ILE 109 Ca 0.09 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.57 2kf5 n ILE 109 Cb 0.52 -0.12 0.00 0.00 -1.74 0.00 0.00 39.64 38.31 2kf5 n ILE 109 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33