#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kfb n GLY 2 N 0.00 0.19 3.63 1.69 0.00 -1.26 -4.29 105.19 105.16 2kfb n GLY 2 Ca 0.00 -0.96 -0.09 0.00 0.00 0.00 0.00 46.02 44.96 2kfb n GLY 2 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2kfb s LYS 3 N -2.00 0.51 0.20 1.61 2.20 -0.82 -4.68 119.74 116.75 2kfb s LYS 3 Ca 0.24 0.55 -0.10 0.00 -0.36 0.00 0.00 55.97 56.30 2kfb s LYS 3 Cb -0.00 0.25 -0.01 0.00 -1.51 0.00 0.00 37.83 36.56 2kfb s LYS 3 CO -0.02 -0.07 0.34 0.96 -0.36 0.00 0.00 175.35 176.20 2kfb s ILE 4 N 0.10 0.03 -0.12 5.43 -0.00 -1.12 -0.96 121.20 124.56 2kfb s ILE 4 Ca 0.03 -1.44 0.00 0.00 -0.00 0.00 0.00 60.65 59.24 2kfb s ILE 4 Cb -0.05 -2.03 0.02 0.00 -0.00 0.00 0.00 42.46 40.40 2kfb s ILE 4 CO -0.06 -0.15 -0.11 -0.89 -0.00 0.00 0.00 174.94 173.73 2kfb s THR 5 N -4.00 1.29 -0.15 8.37 2.01 0.15 -2.28 115.64 121.04 2kfb s THR 5 Ca 0.21 -0.47 -0.05 0.00 0.31 0.00 0.00 61.69 61.70 2kfb s THR 5 Cb 0.02 -1.25 -0.04 0.00 0.01 0.00 0.00 72.50 71.25 2kfb s THR 5 CO 0.04 0.41 0.02 -0.76 -0.69 0.00 0.00 174.62 173.65 2kfb s LEU 6 N 1.49 3.63 -0.15 4.42 1.43 0.73 -0.55 118.68 129.69 2kfb s LEU 6 Ca 0.03 0.06 0.00 0.00 -1.03 0.00 0.00 54.13 53.19 2kfb s LEU 6 Cb -0.13 -1.88 -0.00 0.00 0.03 0.00 0.00 46.19 44.20 2kfb s LEU 6 CO -0.08 0.24 -0.15 -0.31 0.23 0.00 0.00 176.35 176.28 2kfb s TYR 7 N -0.04 2.78 0.54 0.29 1.51 -0.97 -0.34 117.35 121.12 2kfb s TYR 7 Ca 0.04 -0.95 0.27 0.00 -1.01 0.00 0.00 57.07 55.43 2kfb s TYR 7 Cb -0.13 -1.88 1.44 0.00 -0.11 0.00 0.00 41.96 41.29 2kfb s TYR 7 CO 0.02 -0.42 1.97 1.49 -1.11 0.00 0.00 175.55 177.50 2kfb h GLU 8 N 7.16 0.00 -6.62 -0.62 4.81 -0.58 -2.73 114.58 116.00 2kfb h GLU 8 Ca -0.31 0.00 -0.65 0.00 -0.13 0.00 0.00 59.36 58.27 2kfb h GLU 8 Cb 1.20 0.00 -0.18 0.00 0.63 0.00 0.00 28.75 30.40 2kfb h GLU 8 CO 0.56 0.00 -0.80 -0.51 -0.73 0.00 0.00 179.01 177.53 2kfb s ASP 9 N -5.96 3.68 1.14 1.04 1.01 -1.25 -3.36 116.67 112.98 2kfb s ASP 9 Ca -0.05 -0.75 -0.10 0.00 0.71 0.00 0.00 52.55 52.36 2kfb s ASP 9 Cb 0.19 -0.40 0.16 0.00 1.01 0.00 0.00 42.92 43.89 2kfb s ASP 9 CO 0.71 0.13 0.36 -2.11 0.21 0.00 0.00 175.17 174.48 2kfb n ARG 10 N 0.35 -2.91 -1.99 8.23 1.85 -1.26 -2.45 116.66 118.47 2kfb n ARG 10 Ca -0.13 -0.61 -0.03 0.00 -1.00 0.00 0.00 57.85 56.07 2kfb n ARG 10 Cb 0.55 -0.84 -0.01 0.00 -1.05 0.00 0.00 32.46 31.12 2kfb n ARG 10 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2kfb n GLY 11 N -2.33 -0.21 3.45 2.89 0.00 -0.80 -1.25 105.19 106.93 2kfb n GLY 11 Ca 0.06 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.94 2kfb n GLY 11 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2kfb n PHE 12 N -2.20 -2.46 -2.65 1.61 3.72 -1.21 -5.01 117.46 109.27 2kfb n PHE 12 Ca -0.04 0.94 0.00 0.00 -0.05 0.00 0.00 57.45 58.30 2kfb n PHE 12 Cb 0.38 -3.45 0.00 0.00 -0.94 0.00 0.00 39.48 35.47 2kfb n PHE 12 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 176.76 177.75 2kfb n GLN 13 N -2.40 2.13 0.00 -1.08 1.13 -0.38 -5.04 117.38 111.74 2kfb n GLN 13 Ca -0.15 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 54.91 2kfb n GLN 13 Cb 0.60 0.00 0.00 0.00 0.11 0.00 0.00 30.24 30.95 2kfb n GLN 13 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2kfb n GLY 14 N 2.66 0.80 3.77 1.08 0.00 -1.26 -3.75 105.19 108.49 2kfb n GLY 14 Ca 0.00 -0.64 -0.37 0.00 0.00 0.00 0.00 46.02 45.01 2kfb n GLY 14 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2kfb s ARG 15 N 0.00 3.63 0.05 1.61 0.52 -1.26 -4.80 118.95 118.69 2kfb s ARG 15 Ca 0.00 1.77 0.02 0.00 -0.52 0.00 0.00 55.73 57.00 2kfb s ARG 15 Cb 0.00 -2.31 -0.03 0.00 0.52 0.00 0.00 34.95 33.13 2kfb s ARG 15 CO 0.00 -0.66 -0.08 -3.38 0.02 0.00 0.00 175.30 171.20 2kfb s HIS 16 N -1.57 0.70 -0.06 -0.53 -3.43 -1.26 0.01 115.29 109.15 2kfb s HIS 16 Ca 0.66 -0.52 -0.07 0.00 -0.80 0.00 0.00 55.06 54.33 2kfb s HIS 16 Cb -0.28 -0.42 0.02 0.00 -1.43 0.00 0.00 32.58 30.46 2kfb s HIS 16 CO 0.34 -0.08 0.18 -0.47 -2.00 0.00 0.00 174.74 172.71 2kfb s TYR 17 N -1.50 -0.16 -0.21 0.38 5.04 0.54 -4.99 117.35 116.45 2kfb s TYR 17 Ca -0.09 0.38 -0.04 0.00 -2.44 0.00 0.00 57.07 54.88 2kfb s TYR 17 Cb -0.09 0.05 -0.02 0.00 0.35 0.00 0.00 41.96 42.25 2kfb s TYR 17 CO 0.00 -0.14 -0.03 -2.00 -1.34 0.00 0.00 175.55 172.04 2kfb s GLU 18 N -0.22 3.48 -0.17 4.97 2.12 -1.26 -0.19 118.70 127.43 2kfb s GLU 18 Ca -0.03 -0.59 -0.03 0.00 0.36 0.00 0.00 54.97 54.68 2kfb s GLU 18 Cb -0.03 -3.02 -0.02 0.00 0.26 0.00 0.00 34.13 31.33 2kfb s GLU 18 CO 0.01 -0.09 -0.05 0.00 -0.54 0.00 0.00 175.26 174.59 2kfb n SER 20 N 3.91 2.20 -3.65 0.00 2.88 -1.26 -2.78 113.62 114.92 2kfb n SER 20 Ca -0.18 -2.39 -0.08 0.00 -1.33 0.00 0.00 58.87 54.89 2kfb n SER 20 Cb 0.52 -0.17 -0.02 0.00 -0.75 0.00 0.00 64.21 63.80 2kfb n SER 20 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2kfb s SER 21 N -1.65 -0.13 0.31 -3.46 0.01 -1.26 -4.77 113.70 102.75 2kfb s SER 21 Ca 0.13 -0.81 -0.29 0.00 1.31 0.00 0.00 55.95 56.28 2kfb s SER 21 Cb 0.11 0.73 -0.11 0.00 0.21 0.00 0.00 66.02 66.96 2kfb s SER 21 CO 0.02 -1.39 1.49 1.51 0.41 0.00 0.00 173.24 175.27 2kfb s ASP 22 N -2.98 6.48 0.02 2.44 -4.77 -1.26 -4.57 116.67 112.02 2kfb s ASP 22 Ca 0.14 2.88 0.03 0.00 -3.30 0.00 0.00 52.55 52.31 2kfb s ASP 22 Cb -0.05 -2.64 -0.01 0.00 -1.09 0.00 0.00 42.92 39.12 2kfb s ASP 22 CO 0.09 -0.80 -0.10 -1.00 0.70 0.00 0.00 175.17 174.06 2kfb s HIS 23 N -0.52 0.86 -0.16 2.11 3.76 0.14 -4.99 115.29 116.50 2kfb s HIS 23 Ca 0.57 -0.27 0.08 0.00 -0.15 0.00 0.00 55.06 55.30 2kfb s HIS 23 Cb -0.45 -0.53 -0.11 0.00 1.11 0.00 0.00 32.58 32.60 2kfb s HIS 23 CO 0.52 -0.01 0.25 0.25 -0.85 0.00 0.00 174.74 174.90 2kfb n THR 24 N 2.34 0.00 -3.53 1.30 -2.24 -1.26 -2.30 114.28 108.58 2kfb n THR 24 Ca -0.16 -0.24 -0.11 0.00 -2.27 0.00 0.00 64.05 61.27 2kfb n THR 24 Cb 0.56 0.58 -0.10 0.00 -2.10 0.00 0.00 70.33 69.27 2kfb n THR 24 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 2kfb s ASN 25 N -2.50 0.24 0.00 3.42 2.47 -1.24 -1.52 114.94 115.82 2kfb s ASN 25 Ca -0.01 0.49 0.03 0.00 0.42 0.00 0.00 52.86 53.79 2kfb s ASN 25 Cb 0.06 1.01 0.02 0.00 -1.45 0.00 0.00 41.25 40.89 2kfb s ASN 25 CO 0.34 -0.27 0.60 0.18 -3.72 0.00 0.00 177.10 174.24 2kfb n LEU 26 N 5.36 1.26 -0.30 3.21 4.77 0.20 -4.69 117.00 126.81 2kfb n LEU 26 Ca -0.06 -1.05 0.07 0.00 -0.03 0.00 0.00 56.01 54.94 2kfb n LEU 26 Cb 0.50 -0.00 0.22 0.00 -2.33 0.00 0.00 43.42 41.81 2kfb n LEU 26 CO 0.04 0.29 1.12 1.56 -1.33 0.00 0.00 177.39 179.07 2kfb h GLN 27 N 0.50 0.67 -0.42 3.23 4.20 -1.68 1.40 115.11 123.02 2kfb h GLN 27 Ca 0.00 -0.04 0.02 0.00 0.06 0.00 0.00 58.65 58.69 2kfb h GLN 27 Cb 0.13 -0.15 -0.02 0.00 0.30 0.00 0.00 27.48 27.73 2kfb h GLN 27 CO 0.00 0.45 0.28 -1.35 -0.67 0.00 0.00 178.83 177.53 2kfb h PRO 28 N 0.69 0.47 0.00 1.46 0.11 -1.95 -3.27 132.00 129.51 2kfb h PRO 28 Ca 0.46 -0.03 -0.26 0.00 0.11 0.00 0.00 66.00 66.28 2kfb h PRO 28 Cb 0.60 -0.11 -0.04 0.00 0.11 0.00 0.00 31.00 31.57 2kfb h PRO 28 CO -0.33 0.31 -1.65 0.66 -0.21 0.00 0.00 178.00 176.78 2kfb n TYR 29 N -4.48 0.40 -4.66 0.65 4.01 0.10 -4.94 117.16 108.25 2kfb n TYR 29 Ca 0.04 0.17 -0.33 0.00 -0.16 0.00 0.00 57.90 57.63 2kfb n TYR 29 Cb 0.12 -0.91 -0.16 0.00 -0.31 0.00 0.00 39.34 38.09 2kfb n TYR 29 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 2kfb s LEU 30 N -7.78 2.38 0.00 7.72 1.43 0.46 -4.90 118.68 118.00 2kfb s LEU 30 Ca -0.31 -0.49 0.24 0.00 -1.03 0.00 0.00 54.13 52.53 2kfb s LEU 30 Cb 0.09 -1.53 0.33 0.00 0.03 0.00 0.00 46.19 45.11 2kfb s LEU 30 CO 0.47 0.10 1.29 -0.24 0.23 0.00 0.00 176.35 178.20 2kfb n SER 31 N 3.95 1.02 0.17 2.29 2.88 -1.26 -3.48 113.62 119.20 2kfb n SER 31 Ca -0.19 -0.81 0.00 0.00 -1.33 0.00 0.00 58.87 56.54 2kfb n SER 31 Cb 0.52 0.42 0.00 0.00 -0.75 0.00 0.00 64.21 64.40 2kfb n SER 31 CO 0.00 0.00 0.00 -1.14 -1.23 0.00 0.00 175.04 172.67 2kfb n ARG 32 N -1.00 0.00 -2.58 -1.46 3.00 -1.26 -4.90 116.66 108.46 2kfb n ARG 32 Ca 0.08 0.00 -0.03 0.00 -0.00 0.00 0.00 57.85 57.89 2kfb n ARG 32 Cb 0.36 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.82 2kfb n ARG 32 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2kfb n ASN 34 N -0.87 2.18 -3.59 0.00 5.03 -1.03 -4.79 115.26 112.20 2kfb n ASN 34 Ca 0.05 -1.77 -0.12 0.00 0.87 0.00 0.00 54.58 53.61 2kfb n ASN 34 Cb 0.41 -0.11 -0.05 0.00 -1.02 0.00 0.00 39.78 39.01 2kfb n ASN 34 CO 0.00 0.00 0.00 -0.94 -1.83 0.00 0.00 177.26 174.49 2kfb s SER 35 N -1.67 -0.36 0.05 6.41 1.04 -1.23 0.13 113.70 118.08 2kfb s SER 35 Ca 0.34 -0.05 -0.20 0.00 0.48 0.00 0.00 55.95 56.52 2kfb s SER 35 Cb 0.19 0.49 0.04 0.00 0.10 0.00 0.00 66.02 66.85 2kfb s SER 35 CO 0.29 -0.79 0.46 0.00 0.98 0.00 0.00 173.24 174.18 2kfb s ALA 36 N -3.12 -1.15 -0.08 5.32 0.00 0.79 -2.30 121.76 121.22 2kfb s ALA 36 Ca -0.01 0.41 -0.01 0.00 0.00 0.00 0.00 51.96 52.35 2kfb s ALA 36 Cb 0.00 0.41 0.03 0.00 0.00 0.00 0.00 23.12 23.55 2kfb s ALA 36 CO -0.07 -0.50 -0.03 1.03 0.00 0.00 0.00 175.76 176.19 2kfb s ARG 37 N -2.61 0.88 -0.30 0.00 0.52 0.28 0.24 118.95 117.96 2kfb s ARG 37 Ca -0.04 -0.02 -0.07 0.00 -0.52 0.00 0.00 55.73 55.07 2kfb s ARG 37 Cb -0.01 -1.09 0.01 0.00 0.52 0.00 0.00 34.95 34.38 2kfb s ARG 37 CO -0.03 -0.25 0.09 0.08 0.02 0.00 0.00 175.30 175.21 2kfb s VAL 38 N 1.69 4.03 0.01 3.52 1.01 0.07 0.34 120.40 131.06 2kfb s VAL 38 Ca 0.02 -0.69 -0.20 0.00 0.00 0.00 0.00 61.98 61.11 2kfb s VAL 38 Cb -0.13 -3.09 -0.20 0.00 0.00 0.00 0.00 36.38 32.96 2kfb s VAL 38 CO -0.05 0.06 1.16 0.44 0.00 0.00 0.00 175.10 176.72 2kfb h ASP 39 N 8.25 0.48 -4.80 3.32 3.32 -1.31 -1.16 116.42 124.51 2kfb h ASP 39 Ca -0.31 -0.69 0.01 0.00 0.02 0.00 0.00 57.03 56.06 2kfb h ASP 39 Cb 1.13 -0.14 -0.17 0.00 0.22 0.00 0.00 39.33 40.37 2kfb h ASP 39 CO 0.61 1.10 0.31 -0.55 -1.72 0.00 0.00 179.24 178.98 2kfb s SER 40 N -6.56 -0.53 0.00 6.45 0.15 -1.23 -4.81 113.70 107.17 2kfb s SER 40 Ca -0.14 0.30 0.00 0.00 0.70 0.00 0.00 55.95 56.82 2kfb s SER 40 Cb 0.04 0.49 0.00 0.00 -1.71 0.00 0.00 66.02 64.84 2kfb s SER 40 CO 0.80 -0.69 0.00 0.61 1.20 0.00 0.00 173.24 175.16 2kfb n GLY 41 N 0.25 -0.86 3.52 9.45 0.00 -1.26 -1.94 105.19 114.35 2kfb n GLY 41 Ca -0.15 -1.69 -0.33 0.00 0.00 0.00 0.00 46.02 43.85 2kfb n GLY 41 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2kfb s TRP 43 N -0.56 1.67 -0.09 0.00 0.52 -0.98 -2.40 118.94 117.10 2kfb s TRP 43 Ca 0.08 -0.38 0.04 0.00 0.02 0.00 0.00 56.10 55.86 2kfb s TRP 43 Cb -0.12 -0.97 0.00 0.00 -1.15 0.00 0.00 33.47 31.23 2kfb s TRP 43 CO 0.02 0.10 -0.22 1.41 0.02 0.00 0.00 176.95 178.28 2kfb s MET 44 N -1.34 2.77 -0.13 4.98 1.75 -0.76 -0.98 119.30 125.59 2kfb s MET 44 Ca 0.06 -0.81 -0.02 0.00 -1.25 0.00 0.00 55.69 53.67 2kfb s MET 44 Cb -0.09 -2.14 -0.03 0.00 2.84 0.00 0.00 34.83 35.42 2kfb s MET 44 CO 0.02 0.18 -0.06 -0.51 -0.65 0.00 0.00 175.02 174.01 2kfb s LEU 45 N 0.32 3.15 -0.15 4.11 1.43 -1.11 -0.94 118.68 125.49 2kfb s LEU 45 Ca -0.16 -0.13 -0.04 0.00 -1.03 0.00 0.00 54.13 52.76 2kfb s LEU 45 Cb -0.17 -1.74 -0.03 0.00 0.03 0.00 0.00 46.19 44.28 2kfb s LEU 45 CO 0.07 0.21 -0.02 -0.31 0.23 0.00 0.00 176.35 176.53 2kfb s TYR 46 N 0.11 3.07 0.40 0.29 1.51 -0.89 -2.15 117.35 119.68 2kfb s TYR 46 Ca -0.02 -0.20 0.08 0.00 -1.01 0.00 0.00 57.07 55.93 2kfb s TYR 46 Cb -0.14 -1.96 0.85 0.00 -0.11 0.00 0.00 41.96 40.61 2kfb s TYR 46 CO 0.03 0.04 2.02 1.05 -1.11 0.00 0.00 175.55 177.58 2kfb h GLU 47 N 6.54 0.57 -6.33 -0.62 4.11 -1.40 -3.08 114.58 114.38 2kfb h GLU 47 Ca -0.34 -0.03 -0.62 0.00 0.07 0.00 0.00 59.36 58.44 2kfb h GLU 47 Cb 1.19 -0.13 -0.11 0.00 0.50 0.00 0.00 28.75 30.20 2kfb h GLU 47 CO 0.63 0.38 -0.65 -0.65 0.07 0.00 0.00 179.01 178.79 2kfb s GLN 48 N -5.53 2.51 0.88 1.06 -0.21 -0.29 -3.57 119.66 114.52 2kfb s GLN 48 Ca -0.09 -0.98 -0.10 0.00 0.02 0.00 0.00 55.36 54.21 2kfb s GLN 48 Cb 0.18 -2.46 0.12 0.00 1.00 0.00 0.00 33.01 31.86 2kfb s GLN 48 CO 0.75 0.49 1.13 -1.25 -2.12 0.00 0.00 175.29 174.28 2kfb s PRO 49 N -2.74 1.34 -1.29 2.91 0.04 -1.26 -2.66 135.00 131.35 2kfb s PRO 49 Ca 0.27 1.42 -0.07 0.00 0.04 0.00 0.00 61.00 62.66 2kfb s PRO 49 Cb -0.10 -1.77 0.01 0.00 0.04 0.00 0.00 34.50 32.67 2kfb s PRO 49 CO 0.19 -2.36 0.87 0.09 0.04 0.00 0.00 177.00 175.83 2kfb n ASN 50 N -4.04 -5.85 -3.34 6.66 5.03 -0.57 -3.56 115.26 109.59 2kfb n ASN 50 Ca 0.11 -0.40 -0.20 0.00 0.87 0.00 0.00 54.58 54.96 2kfb n ASN 50 Cb 0.52 -4.54 0.01 0.00 -1.02 0.00 0.00 39.78 34.75 2kfb n ASN 50 CO 0.00 0.00 0.00 -1.22 -1.83 0.00 0.00 177.26 174.21 2kfb n TYR 51 N -4.62 -2.77 -3.92 3.10 4.01 -1.24 -5.02 117.16 106.70 2kfb n TYR 51 Ca -0.03 1.12 -0.10 0.00 -0.16 0.00 0.00 57.90 58.73 2kfb n TYR 51 Cb 0.57 -3.07 -0.09 0.00 -0.31 0.00 0.00 39.34 36.44 2kfb n TYR 51 CO 0.00 0.00 0.00 -1.12 -0.46 0.00 0.00 176.86 175.28 2kfb s SER 52 N -2.46 0.16 0.00 7.72 0.01 -1.09 -5.04 113.70 113.00 2kfb s SER 52 Ca 0.17 -0.49 0.00 0.00 1.31 0.00 0.00 55.95 56.94 2kfb s SER 52 Cb -0.03 0.22 0.00 0.00 0.21 0.00 0.00 66.02 66.43 2kfb s SER 52 CO 0.83 -0.49 0.00 0.61 0.41 0.00 0.00 173.24 174.60 2kfb n GLY 53 N 0.86 -0.27 3.78 3.44 0.00 -1.26 -1.13 105.19 110.60 2kfb n GLY 53 Ca -0.19 -1.39 -0.37 0.00 0.00 0.00 0.00 46.02 44.06 2kfb n GLY 53 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2kfb s LEU 54 N 0.00 4.24 0.14 0.99 2.96 -1.26 -4.83 118.68 120.91 2kfb s LEU 54 Ca 0.00 2.10 0.10 0.00 -0.22 0.00 0.00 54.13 56.11 2kfb s LEU 54 Cb 0.00 -4.05 -0.04 0.00 0.50 0.00 0.00 46.19 42.60 2kfb s LEU 54 CO 0.00 -0.41 -0.23 0.00 -1.32 0.00 0.00 176.35 174.39 2kfb s GLN 55 N -2.24 1.31 -0.09 1.98 -2.07 -1.26 -1.78 119.66 115.52 2kfb s GLN 55 Ca 0.55 -1.33 0.01 0.00 -1.82 0.00 0.00 55.36 52.77 2kfb s GLN 55 Cb -0.25 -1.64 0.02 0.00 -1.09 0.00 0.00 33.01 30.05 2kfb s GLN 55 CO 0.31 0.37 -0.12 0.71 -1.32 0.00 0.00 175.29 175.25 2kfb s TYR 56 N -1.35 1.57 -0.16 9.60 2.02 -0.91 -4.51 117.35 123.61 2kfb s TYR 56 Ca 0.13 -0.68 -0.26 0.00 -0.37 0.00 0.00 57.07 55.89 2kfb s TYR 56 Cb -0.09 -1.19 -0.01 0.00 -0.40 0.00 0.00 41.96 40.27 2kfb s TYR 56 CO 0.06 -0.39 0.87 0.12 -1.57 0.00 0.00 175.55 174.65 2kfb s PHE 57 N 1.03 3.43 0.05 2.71 5.36 -1.26 -2.73 117.98 126.57 2kfb s PHE 57 Ca -0.07 1.32 0.08 0.00 -0.96 0.00 0.00 56.93 57.30 2kfb s PHE 57 Cb -0.15 -3.06 -0.03 0.00 -0.34 0.00 0.00 43.02 39.45 2kfb s PHE 57 CO -0.01 -0.25 -0.21 -0.51 -1.46 0.00 0.00 175.22 172.79 2kfb s LEU 58 N 2.17 2.49 0.12 6.12 1.02 -0.15 -4.92 118.68 125.54 2kfb s LEU 58 Ca 0.40 -0.49 0.04 0.00 0.02 0.00 0.00 54.13 54.10 2kfb s LEU 58 Cb -0.17 -1.45 -0.04 0.00 0.02 0.00 0.00 46.19 44.56 2kfb s LEU 58 CO 0.13 0.25 -0.11 -0.13 0.02 0.00 0.00 176.35 176.51 2kfb s ARG 59 N -1.48 0.95 -0.14 1.70 0.52 -1.26 -2.32 118.95 116.92 2kfb s ARG 59 Ca 0.14 -1.29 -0.35 0.00 -0.52 0.00 0.00 55.73 53.72 2kfb s ARG 59 Cb -0.10 -0.62 -0.16 0.00 0.52 0.00 0.00 34.95 34.59 2kfb s ARG 59 CO 0.05 0.09 1.02 -2.13 0.02 0.00 0.00 175.30 174.35 2kfb n ARG 60 N 0.25 0.00 -3.19 3.54 0.63 -1.24 -4.75 116.66 111.91 2kfb n ARG 60 Ca -0.14 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.79 2kfb n ARG 60 Cb 0.59 -1.22 0.00 0.00 0.45 0.00 0.00 32.46 32.27 2kfb n ARG 60 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2kfb n GLY 61 N 1.93 -1.89 3.32 5.14 0.00 -0.44 -4.97 105.19 108.28 2kfb n GLY 61 Ca 0.19 -1.44 -0.33 0.00 0.00 0.00 0.00 46.02 44.45 2kfb n GLY 61 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2kfb s ASP 62 N -0.84 3.72 -0.22 1.61 1.01 -1.26 -0.75 116.67 119.93 2kfb s ASP 62 Ca 0.00 -0.41 0.01 0.00 0.71 0.00 0.00 52.55 52.87 2kfb s ASP 62 Cb 0.00 -1.55 0.05 0.00 1.01 0.00 0.00 42.92 42.43 2kfb s ASP 62 CO 0.00 0.16 -0.10 -0.31 0.21 0.00 0.00 175.17 175.13 2kfb s TYR 63 N 0.39 2.64 -1.91 4.23 2.02 0.14 -4.97 117.35 119.89 2kfb s TYR 63 Ca -0.13 -1.81 0.26 0.00 -0.37 0.00 0.00 57.07 55.02 2kfb s TYR 63 Cb -0.16 -1.72 0.69 0.00 -0.40 0.00 0.00 41.96 40.37 2kfb s TYR 63 CO 0.06 -0.79 1.53 0.00 -1.57 0.00 0.00 175.55 174.78 2kfb n ALA 64 N 4.62 3.06 -3.20 3.71 0.00 -1.26 -0.15 120.51 127.28 2kfb n ALA 64 Ca -0.14 -0.44 -0.13 0.00 0.00 0.00 0.00 53.44 52.73 2kfb n ALA 64 Cb 0.45 -1.09 -0.11 0.00 0.00 0.00 0.00 19.45 18.70 2kfb n ALA 64 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2kfb s ASP 65 N -2.42 -0.29 0.23 0.00 1.01 -1.22 -1.91 116.67 112.08 2kfb s ASP 65 Ca 0.25 0.56 -0.08 0.00 0.71 0.00 0.00 52.55 54.00 2kfb s ASP 65 Cb 0.19 0.56 0.21 0.00 1.01 0.00 0.00 42.92 44.90 2kfb s ASP 65 CO 0.50 -0.10 1.91 1.12 0.21 0.00 0.00 175.17 178.80 2kfb h HIS 66 N 5.80 1.12 0.00 4.23 2.07 0.74 -0.48 115.15 128.64 2kfb h HIS 66 Ca -0.27 0.03 0.00 0.00 -2.85 0.00 0.00 60.37 57.28 2kfb h HIS 66 Cb 1.19 -0.38 0.00 0.00 2.57 0.00 0.00 27.41 30.79 2kfb h HIS 66 CO 0.40 0.71 0.12 1.04 -3.07 0.00 0.00 177.93 177.12 2kfb n GLN 67 N -4.46 0.00 0.06 5.12 1.13 -1.26 -0.77 117.38 117.21 2kfb n GLN 67 Ca 0.10 0.26 -0.16 0.00 -1.94 0.00 0.00 57.00 55.26 2kfb n GLN 67 Cb 0.01 -1.62 -0.14 0.00 0.11 0.00 0.00 30.24 28.61 2kfb n GLN 67 CO 0.00 0.00 0.00 1.96 -1.44 0.00 0.00 177.06 177.58 2kfb h GLN 68 N 0.00 0.23 -0.61 -1.09 1.08 -1.41 -3.29 115.11 110.03 2kfb h GLN 68 Ca 0.00 -0.40 0.00 0.00 -1.45 0.00 0.00 58.65 56.80 2kfb h GLN 68 Cb 0.23 0.15 0.00 0.00 -0.05 0.00 0.00 27.48 27.81 2kfb h GLN 68 CO 0.00 1.10 0.00 -2.67 -0.95 0.00 0.00 178.83 176.31 2kfb n TRP 69 N -3.44 0.95 -0.81 2.96 2.14 0.05 -4.84 117.44 114.45 2kfb n TRP 69 Ca -0.15 -0.37 0.00 0.00 2.07 0.00 0.00 57.50 59.05 2kfb n TRP 69 Cb 1.04 -0.19 0.00 0.00 -0.81 0.00 0.00 31.31 31.35 2kfb n TRP 69 CO 0.00 0.00 0.00 -1.33 2.07 0.00 0.00 177.69 178.43 2kfb n MET 70 N 0.56 0.00 -1.69 -2.67 2.81 -1.21 -4.42 117.12 110.50 2kfb n MET 70 Ca 0.16 0.26 -0.38 0.00 -1.81 0.00 0.00 57.70 55.93 2kfb n MET 70 Cb 0.61 -2.95 -0.03 0.00 -0.71 0.00 0.00 33.22 30.14 2kfb n MET 70 CO 0.00 0.00 0.00 0.20 1.51 0.00 0.00 175.97 177.68 2kfb s GLY 71 N -2.52 -0.14 0.10 3.03 0.00 -0.60 -4.77 107.32 102.42 2kfb s GLY 71 Ca 0.00 -0.04 -0.05 0.00 0.00 0.00 0.00 44.72 44.63 2kfb s GLY 71 CO 0.00 3.90 1.21 1.41 0.00 0.00 0.00 173.10 179.62 2kfb h LEU 72 N 18.14 0.52 -7.92 0.66 3.38 -1.93 -3.35 115.31 124.81 2kfb h LEU 72 Ca -0.27 -0.48 -0.60 0.00 0.09 0.00 0.00 57.88 56.62 2kfb h LEU 72 Cb 1.24 -0.16 -0.36 0.00 0.09 0.00 0.00 40.66 41.47 2kfb h LEU 72 CO 1.15 1.32 -0.83 -0.55 0.09 0.00 0.00 178.44 179.61 2kfb s SER 73 N -7.15 2.65 0.00 -0.43 0.15 -1.26 -4.99 113.70 102.66 2kfb s SER 73 Ca -0.05 -0.48 0.00 0.00 0.70 0.00 0.00 55.95 56.12 2kfb s SER 73 Cb 0.08 -1.17 0.00 0.00 -1.71 0.00 0.00 66.02 63.22 2kfb s SER 73 CO 0.88 -0.04 0.89 -0.90 1.20 0.00 0.00 173.24 175.27 2kfb n ASP 74 N 4.66 2.45 -3.78 5.45 5.75 -1.26 -4.39 116.55 125.43 2kfb n ASP 74 Ca -0.17 -1.51 -0.34 0.00 -0.01 0.00 0.00 54.79 52.75 2kfb n ASP 74 Cb 0.50 -0.49 -0.05 0.00 -1.03 0.00 0.00 41.12 40.06 2kfb n ASP 74 CO 0.00 0.00 0.00 -1.20 -0.11 0.00 0.00 177.20 175.89 2kfb n SER 75 N 1.31 4.76 -4.57 -1.12 7.64 -1.26 -4.75 113.62 115.64 2kfb n SER 75 Ca 0.00 -3.37 -0.39 0.00 1.01 0.00 0.00 58.87 56.13 2kfb n SER 75 Cb 0.28 -0.96 -0.11 0.00 -1.01 0.00 0.00 64.21 62.41 2kfb n SER 75 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 2kfb s VAL 76 N -2.34 5.30 0.00 0.44 1.01 -1.25 -4.00 120.40 119.56 2kfb s VAL 76 Ca 0.34 0.06 0.00 0.00 0.00 0.00 0.00 61.98 62.38 2kfb s VAL 76 Cb 0.06 -3.59 0.00 0.00 0.00 0.00 0.00 36.38 32.85 2kfb s VAL 76 CO 0.00 0.17 0.55 0.54 0.00 0.00 0.00 175.10 176.35 2kfb n ARG 77 N 5.08 0.20 -3.55 2.72 1.74 -1.16 -4.59 116.66 117.10 2kfb n ARG 77 Ca -0.13 -0.67 -0.09 0.00 -0.77 0.00 0.00 57.85 56.19 2kfb n ARG 77 Cb 0.51 -0.89 -0.02 0.00 -1.02 0.00 0.00 32.46 31.04 2kfb n ARG 77 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 2kfb s SER 78 N -0.24 -0.41 -0.09 0.55 1.04 -1.22 0.59 113.70 113.92 2kfb s SER 78 Ca 0.00 -0.13 -0.23 0.00 0.48 0.00 0.00 55.95 56.08 2kfb s SER 78 Cb 0.00 0.52 0.05 0.00 0.10 0.00 0.00 66.02 66.69 2kfb s SER 78 CO 0.00 -0.88 0.53 0.00 0.98 0.00 0.00 173.24 173.87 2kfb s ARG 80 N -0.80 1.03 -0.19 0.00 1.70 -0.12 0.26 118.95 120.83 2kfb s ARG 80 Ca -0.09 -1.17 -0.07 0.00 -0.47 0.00 0.00 55.73 53.93 2kfb s ARG 80 Cb -0.03 -1.06 -0.04 0.00 -0.57 0.00 0.00 34.95 33.25 2kfb s ARG 80 CO 0.06 0.23 0.05 -1.17 -1.08 0.00 0.00 175.30 173.38 2kfb s LEU 81 N -2.17 3.70 -0.34 -1.89 0.20 -1.26 -1.83 118.68 115.09 2kfb s LEU 81 Ca 0.07 0.02 -0.20 0.00 0.69 0.00 0.00 54.13 54.70 2kfb s LEU 81 Cb -0.08 -1.94 -0.00 0.00 -0.43 0.00 0.00 46.19 43.75 2kfb s LEU 81 CO 0.04 0.14 0.64 -0.63 -0.29 0.00 0.00 176.35 176.25 2kfb s ILE 82 N 0.54 4.90 0.74 6.68 1.01 -1.01 -4.86 121.20 129.21 2kfb s ILE 82 Ca 0.02 0.70 -0.16 0.00 0.00 0.00 0.00 60.65 61.21 2kfb s ILE 82 Cb -0.13 -4.05 -0.02 0.00 0.01 0.00 0.00 42.46 38.27 2kfb s ILE 82 CO 0.01 -0.25 0.67 -2.65 0.00 0.00 0.00 174.94 172.72 2kfb n PRO 83 N 5.99 0.32 -0.62 2.79 -0.02 -1.26 -4.25 135.00 137.95 2kfb n PRO 83 Ca -0.01 0.16 -0.14 0.00 -2.02 0.00 0.00 63.50 61.49 2kfb n PRO 83 Cb 0.49 -1.96 0.11 0.00 -0.02 0.00 0.00 33.50 32.11 2kfb n PRO 83 CO 0.00 0.00 0.00 0.72 1.98 0.00 0.00 175.50 178.20 2kfb n HIS 84 N -2.51 -3.62 -3.64 6.00 8.25 -1.26 -4.79 115.22 113.65 2kfb n HIS 84 Ca 0.11 -0.49 -0.08 0.00 -0.26 0.00 0.00 57.72 57.00 2kfb n HIS 84 Cb 0.50 -0.51 -0.07 0.00 1.12 0.00 0.00 29.99 31.03 2kfb n HIS 84 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 2kfb s SER 85 N -3.00 -0.49 0.00 0.41 0.15 -1.26 -4.83 113.70 104.69 2kfb s SER 85 Ca 0.33 0.89 0.00 0.00 0.70 0.00 0.00 55.95 57.87 2kfb s SER 85 Cb -0.02 0.98 0.00 0.00 -1.71 0.00 0.00 66.02 65.26 2kfb s SER 85 CO 0.25 -0.15 0.00 0.61 1.20 0.00 0.00 173.24 175.15 2kfb n GLY 86 N 2.62 0.12 3.87 9.45 0.00 -1.26 -4.91 105.19 115.07 2kfb n GLY 86 Ca -0.14 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.57 2kfb n GLY 86 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2kfb s SER 87 N -2.42 6.63 -0.09 1.61 0.01 -1.26 -5.08 113.70 113.10 2kfb s SER 87 Ca 0.00 1.13 -0.01 0.00 1.31 0.00 0.00 55.95 58.38 2kfb s SER 87 Cb 0.00 -2.32 0.03 0.00 0.21 0.00 0.00 66.02 63.94 2kfb s SER 87 CO 0.00 -0.26 -0.04 -1.00 0.41 0.00 0.00 173.24 172.35 2kfb s HIS 88 N -2.11 1.12 -0.10 2.43 0.09 -1.26 -4.02 115.29 111.43 2kfb s HIS 88 Ca 0.51 -0.48 -0.07 0.00 -0.00 0.00 0.00 55.06 55.02 2kfb s HIS 88 Cb -0.10 -1.04 0.04 0.00 -0.00 0.00 0.00 32.58 31.48 2kfb s HIS 88 CO 0.24 -0.43 0.25 -0.98 -0.00 0.00 0.00 174.74 173.83 2kfb s ARG 89 N 1.80 0.25 -0.11 1.40 1.70 -1.25 -4.41 118.95 118.34 2kfb s ARG 89 Ca 0.05 0.45 -0.09 0.00 -0.47 0.00 0.00 55.73 55.67 2kfb s ARG 89 Cb -0.12 0.01 0.03 0.00 -0.57 0.00 0.00 34.95 34.29 2kfb s ARG 89 CO -0.07 -0.10 0.28 -1.50 -1.08 0.00 0.00 175.30 172.83 2kfb s ILE 90 N 0.74 -0.01 -0.34 4.99 2.07 -1.07 -2.88 121.20 124.70 2kfb s ILE 90 Ca -0.05 0.02 0.02 0.00 -1.41 0.00 0.00 60.65 59.23 2kfb s ILE 90 Cb -0.06 -0.40 0.09 0.00 0.13 0.00 0.00 42.46 42.22 2kfb s ILE 90 CO -0.05 0.01 0.06 -0.13 -1.91 0.00 0.00 174.94 172.92 2kfb s ARG 91 N 0.31 1.78 0.31 3.50 0.52 -0.12 -1.83 118.95 123.42 2kfb s ARG 91 Ca -0.01 -1.74 -0.19 0.00 -0.52 0.00 0.00 55.73 53.26 2kfb s ARG 91 Cb -0.03 -3.25 -0.09 0.00 0.52 0.00 0.00 34.95 32.10 2kfb s ARG 91 CO -0.01 -0.89 0.80 -0.51 0.02 0.00 0.00 175.30 174.71 2kfb s LEU 92 N 1.01 4.18 -0.08 2.53 1.02 -0.83 -0.87 118.68 125.65 2kfb s LEU 92 Ca 0.06 1.49 0.04 0.00 0.02 0.00 0.00 54.13 55.74 2kfb s LEU 92 Cb -0.20 -3.99 -0.01 0.00 0.02 0.00 0.00 46.19 42.00 2kfb s LEU 92 CO -0.06 -0.13 -0.21 -0.31 0.02 0.00 0.00 176.35 175.65 2kfb s TYR 93 N -1.81 2.56 0.37 0.29 2.02 0.98 -2.70 117.35 119.06 2kfb s TYR 93 Ca 0.51 -0.72 0.09 0.00 -0.37 0.00 0.00 57.07 56.58 2kfb s TYR 93 Cb -0.13 -1.67 0.82 0.00 -0.40 0.00 0.00 41.96 40.58 2kfb s TYR 93 CO 0.19 -0.22 1.90 1.05 -1.57 0.00 0.00 175.55 176.90 2kfb h GLU 94 N 6.25 0.66 -5.07 -0.62 9.09 -1.72 -3.06 114.58 120.10 2kfb h GLU 94 Ca -0.29 -0.04 -0.42 0.00 0.05 0.00 0.00 59.36 58.66 2kfb h GLU 94 Cb 1.19 -0.15 -0.14 0.00 -1.65 0.00 0.00 28.75 28.01 2kfb h GLU 94 CO 0.49 0.43 -0.61 1.03 0.05 0.00 0.00 179.01 180.40 2kfb s ARG 95 N -5.64 1.55 0.63 1.06 0.52 -1.26 -3.82 118.95 111.98 2kfb s ARG 95 Ca -0.10 -1.85 -0.18 0.00 -0.52 0.00 0.00 55.73 53.09 2kfb s ARG 95 Cb 0.21 -0.59 -0.12 0.00 0.52 0.00 0.00 34.95 34.97 2kfb s ARG 95 CO 0.78 -0.24 -0.03 0.39 0.02 0.00 0.00 175.30 176.22 2kfb n GLU 96 N -0.59 0.12 0.00 3.54 1.02 -1.23 -3.95 120.64 119.55 2kfb n GLU 96 Ca -0.01 0.05 0.00 0.00 -0.02 0.00 0.00 57.16 57.18 2kfb n GLU 96 Cb 0.66 -1.24 0.00 0.00 -0.02 0.00 0.00 31.44 30.85 2kfb n GLU 96 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 2kfb n ASP 97 N 1.91 0.00 -1.96 1.62 8.00 -0.95 -3.04 116.55 122.13 2kfb n ASP 97 Ca 0.07 0.00 -0.02 0.00 0.71 0.00 0.00 54.79 55.55 2kfb n ASP 97 Cb 0.49 0.00 0.06 0.00 -0.02 0.00 0.00 41.12 41.65 2kfb n ASP 97 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2kfb n TYR 98 N 0.00 -1.08 -2.74 1.24 0.18 -1.25 -4.65 117.16 108.85 2kfb n TYR 98 Ca 0.00 -0.97 -0.43 0.00 1.88 0.00 0.00 57.90 58.38 2kfb n TYR 98 Cb 0.00 1.05 0.01 0.00 -0.38 0.00 0.00 39.34 40.02 2kfb n TYR 98 CO 0.00 0.00 0.00 0.54 -2.08 0.00 0.00 176.86 175.32 2kfb n ARG 99 N -0.81 4.07 -2.07 -3.48 1.74 -1.17 -4.89 116.66 110.05 2kfb n ARG 99 Ca -0.14 -4.11 0.00 0.00 -0.77 0.00 0.00 57.85 52.83 2kfb n ARG 99 Cb 0.71 -2.70 0.00 0.00 -1.02 0.00 0.00 32.46 29.45 2kfb n ARG 99 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2kfb n GLY 100 N 2.06 -0.51 3.74 -0.13 0.00 -1.26 -4.71 105.19 104.38 2kfb n GLY 100 Ca 0.32 -0.91 -0.41 0.00 0.00 0.00 0.00 46.02 45.01 2kfb n GLY 100 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2kfb s GLN 101 N -1.82 4.22 -0.03 1.61 2.00 -1.26 -4.86 119.66 119.52 2kfb s GLN 101 Ca 0.00 2.39 0.07 0.00 -2.00 0.00 0.00 55.36 55.82 2kfb s GLN 101 Cb 0.00 -3.09 -0.01 0.00 0.80 0.00 0.00 33.01 30.71 2kfb s GLN 101 CO 0.00 -0.50 -0.23 1.41 -0.50 0.00 0.00 175.29 175.47 2kfb s MET 102 N -0.23 1.97 -0.00 1.67 -2.45 -1.26 -2.35 119.30 116.65 2kfb s MET 102 Ca 0.62 -0.81 0.00 0.00 -1.25 0.00 0.00 55.69 54.25 2kfb s MET 102 Cb -0.44 -1.83 0.00 0.00 1.25 0.00 0.00 34.83 33.82 2kfb s MET 102 CO 0.43 0.44 0.00 -1.50 1.05 0.00 0.00 175.02 175.45 2kfb s ILE 103 N -0.40 -0.01 0.06 10.11 2.07 -1.10 -5.03 121.20 126.90 2kfb s ILE 103 Ca 0.05 0.03 0.06 0.00 -1.41 0.00 0.00 60.65 59.38 2kfb s ILE 103 Cb -0.10 -0.02 -0.04 0.00 0.13 0.00 0.00 42.46 42.43 2kfb s ILE 103 CO 0.00 0.01 -0.11 -0.70 -1.91 0.00 0.00 174.94 172.24 2kfb s GLU 104 N 0.15 2.25 0.11 3.50 2.12 -1.26 -1.96 118.70 123.61 2kfb s GLU 104 Ca -0.01 -0.92 0.05 0.00 0.36 0.00 0.00 54.97 54.44 2kfb s GLU 104 Cb -0.02 -2.34 -0.04 0.00 0.26 0.00 0.00 34.13 31.99 2kfb s GLU 104 CO -0.00 0.54 -0.13 -0.06 -0.54 0.00 0.00 175.26 175.07 2kfb s PHE 105 N -1.09 1.28 0.00 5.30 0.08 -0.76 -5.00 117.98 117.79 2kfb s PHE 105 Ca 0.19 -0.58 0.00 0.00 0.12 0.00 0.00 56.93 56.66 2kfb s PHE 105 Cb -0.11 -0.68 0.00 0.00 -0.57 0.00 0.00 43.02 41.66 2kfb s PHE 105 CO 0.10 0.10 0.39 0.25 -0.10 0.00 0.00 175.22 175.96 2kfb n THR 106 N 0.60 0.00 -2.85 0.64 -2.24 -1.26 -2.60 114.28 106.57 2kfb n THR 106 Ca -0.16 0.00 -0.05 0.00 -2.27 0.00 0.00 64.05 61.57 2kfb n THR 106 Cb 0.57 0.89 -0.00 0.00 -2.10 0.00 0.00 70.33 69.69 2kfb n THR 106 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 2kfb s GLU 107 N 0.00 1.04 0.00 -0.78 -1.05 -1.26 -4.82 118.70 111.82 2kfb s GLU 107 Ca 0.00 -1.06 0.00 0.00 -0.15 0.00 0.00 54.97 53.76 2kfb s GLU 107 Cb 0.00 -0.14 0.00 0.00 -0.44 0.00 0.00 34.13 33.55 2kfb s GLU 107 CO 0.00 -1.32 0.00 -0.40 0.95 0.00 0.00 175.26 174.49 2kfb n ASP 108 N 3.09 0.00 -3.41 0.83 5.75 -1.26 -4.92 116.55 116.63 2kfb n ASP 108 Ca 0.18 0.00 -0.14 0.00 -0.01 0.00 0.00 54.79 54.82 2kfb n ASP 108 Cb 0.55 0.00 -0.10 0.00 -1.03 0.00 0.00 41.12 40.55 2kfb n ASP 108 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2kfb h SER 110 N 8.24 0.00 -2.13 0.00 4.64 -1.92 -2.46 113.55 119.93 2kfb h SER 110 Ca -0.17 0.00 -0.38 0.00 -0.47 0.00 0.00 61.79 60.78 2kfb h SER 110 Cb 1.14 0.00 -0.33 0.00 -0.31 0.00 0.00 62.40 62.90 2kfb h SER 110 CO 0.29 0.00 -0.68 0.00 -0.87 0.00 0.00 176.83 175.57 2kfb h LEU 112 N 7.66 0.86 -0.40 0.00 6.46 -1.42 -2.24 115.31 126.23 2kfb h LEU 112 Ca -0.04 -0.13 0.00 0.00 -0.12 0.00 0.00 57.88 57.59 2kfb h LEU 112 Cb 1.05 -0.22 0.00 0.00 -0.73 0.00 0.00 40.66 40.76 2kfb h LEU 112 CO 0.28 0.75 0.52 0.00 -0.62 0.00 0.00 178.44 179.37 2kfb n GLN 113 N -4.47 0.05 -0.18 1.25 1.13 -1.26 0.26 117.38 114.16 2kfb n GLN 113 Ca 0.05 0.50 0.09 0.00 -1.94 0.00 0.00 57.00 55.70 2kfb n GLN 113 Cb 0.13 -2.17 0.27 0.00 0.11 0.00 0.00 30.24 28.57 2kfb n GLN 113 CO 0.00 0.00 0.00 -0.25 -1.44 0.00 0.00 177.06 175.37 2kfb n ASP 114 N -1.85 2.43 0.00 1.08 8.00 -0.84 -4.40 116.55 120.96 2kfb n ASP 114 Ca -0.00 -1.90 0.00 0.00 0.71 0.00 0.00 54.79 53.59 2kfb n ASP 114 Cb 0.53 -0.23 0.00 0.00 -0.02 0.00 0.00 41.12 41.40 2kfb n ASP 114 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2kfb n ARG 115 N 0.82 0.00 -4.71 -1.24 5.12 0.72 -5.11 116.66 112.26 2kfb n ARG 115 Ca 0.17 0.00 -0.25 0.00 -1.93 0.00 0.00 57.85 55.83 2kfb n ARG 115 Cb 0.42 -0.44 -0.14 0.00 -1.16 0.00 0.00 32.46 31.13 2kfb n ARG 115 CO 0.00 0.00 0.00 -0.59 -1.93 0.00 0.00 177.63 175.11 2kfb s PHE 116 N -1.40 1.74 0.00 -1.55 -0.71 -0.61 -5.07 117.98 110.37 2kfb s PHE 116 Ca 0.00 -0.36 0.00 0.00 -1.04 0.00 0.00 56.93 55.53 2kfb s PHE 116 Cb 0.00 -1.06 0.00 0.00 -1.21 0.00 0.00 43.02 40.75 2kfb s PHE 116 CO 0.00 0.05 0.30 0.54 -1.34 0.00 0.00 175.22 174.77 2kfb n ARG 117 N 2.09 0.00 -0.72 1.99 1.74 -1.26 -4.34 116.66 116.16 2kfb n ARG 117 Ca -0.17 0.31 -0.24 0.00 -0.77 0.00 0.00 57.85 56.99 2kfb n ARG 117 Cb 0.53 -1.00 -0.01 0.00 -1.02 0.00 0.00 32.46 30.96 2kfb n ARG 117 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 2kfb n PHE 118 N -1.44 -0.53 -0.46 -1.55 3.01 -1.26 -4.85 117.46 110.39 2kfb n PHE 118 Ca 0.00 0.45 0.09 0.00 1.01 0.00 0.00 57.45 59.00 2kfb n PHE 118 Cb 0.00 -0.99 0.28 0.00 -0.01 0.00 0.00 39.48 38.76 2kfb n PHE 118 CO 0.00 0.00 0.00 0.09 1.01 0.00 0.00 176.76 177.86 2kfb n ASN 119 N 1.10 3.93 -3.83 4.37 3.02 -1.26 -4.93 115.26 117.66 2kfb n ASN 119 Ca 0.08 -2.24 -0.13 0.00 -0.03 0.00 0.00 54.58 52.27 2kfb n ASN 119 Cb 0.16 -0.45 -0.14 0.00 -0.61 0.00 0.00 39.78 38.74 2kfb n ASN 119 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 2kfb s GLU 120 N -1.44 0.08 -0.19 3.52 2.02 -1.26 -2.48 118.70 118.94 2kfb s GLU 120 Ca 0.42 0.13 0.01 0.00 0.02 0.00 0.00 54.97 55.55 2kfb s GLU 120 Cb 0.25 0.00 0.03 0.00 0.10 0.00 0.00 34.13 34.51 2kfb s GLU 120 CO 0.23 -0.03 -0.18 0.42 0.02 0.00 0.00 175.26 175.72 2kfb s ILE 121 N 0.21 2.03 -0.25 -1.63 -1.09 -1.13 -4.62 121.20 114.73 2kfb s ILE 121 Ca -0.01 -1.04 0.13 0.00 -2.23 0.00 0.00 60.65 57.49 2kfb s ILE 121 Cb -0.02 -1.90 0.56 0.00 -1.58 0.00 0.00 42.46 39.51 2kfb s ILE 121 CO -0.01 0.42 1.51 1.41 -1.23 0.00 0.00 174.94 177.04 2kfb n HIS 122 N 4.60 1.27 0.00 3.97 8.25 -1.16 -4.72 115.22 127.43 2kfb n HIS 122 Ca -0.19 -1.20 0.00 0.00 -0.26 0.00 0.00 57.72 56.07 2kfb n HIS 122 Cb 0.49 -0.45 0.00 0.00 1.12 0.00 0.00 29.99 31.15 2kfb n HIS 122 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 2kfb n SER 123 N -0.70 0.00 -3.48 0.41 3.41 -1.25 -2.84 113.62 109.18 2kfb n SER 123 Ca 0.29 0.00 -0.11 0.00 -0.26 0.00 0.00 58.87 58.79 2kfb n SER 123 Cb 1.04 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.96 2kfb n SER 123 CO 0.00 0.00 0.00 -1.48 -0.16 0.00 0.00 175.04 173.40 2kfb s LEU 124 N 0.00 -0.49 -0.14 1.04 0.05 -0.95 -0.02 118.68 118.17 2kfb s LEU 124 Ca 0.00 0.12 0.00 0.00 0.05 0.00 0.00 54.13 54.30 2kfb s LEU 124 Cb 0.00 2.31 0.02 0.00 -2.05 0.00 0.00 46.19 46.47 2kfb s LEU 124 CO 0.00 -0.74 -0.13 0.21 -0.55 0.00 0.00 176.35 175.14 2kfb s ASN 125 N -2.32 2.61 -0.45 1.48 3.04 -0.05 -1.32 114.94 117.93 2kfb s ASN 125 Ca 0.01 -0.46 -0.12 0.00 0.04 0.00 0.00 52.86 52.33 2kfb s ASN 125 Cb -0.01 -1.13 0.08 0.00 -1.54 0.00 0.00 41.25 38.65 2kfb s ASN 125 CO -0.07 -0.06 0.33 -0.69 -3.04 0.00 0.00 177.10 173.57 2kfb s VAL 126 N 1.49 4.66 0.03 -5.21 1.01 -1.06 -0.95 120.40 120.38 2kfb s VAL 126 Ca 0.04 -1.32 -0.16 0.00 0.00 0.00 0.00 61.98 60.54 2kfb s VAL 126 Cb -0.13 -3.85 -0.33 0.00 0.00 0.00 0.00 36.38 32.07 2kfb s VAL 126 CO -0.10 -0.58 1.03 -0.07 0.00 0.00 0.00 175.10 175.38 2kfb h LEU 127 N 8.57 0.84 -7.94 3.92 -0.00 -1.79 -2.80 115.31 116.12 2kfb h LEU 127 Ca -0.25 -0.88 -0.18 0.00 -0.00 0.00 0.00 57.88 56.56 2kfb h LEU 127 Cb 1.09 -0.27 -0.22 0.00 -0.00 0.00 0.00 40.66 41.26 2kfb h LEU 127 CO 0.83 1.66 -0.70 -0.70 -0.00 0.00 0.00 178.44 179.52 2kfb s GLU 128 N -2.74 0.26 0.82 1.13 2.56 -1.22 -4.93 118.70 114.59 2kfb s GLU 128 Ca -0.09 -0.51 0.00 0.00 0.00 0.00 0.00 54.97 54.37 2kfb s GLU 128 Cb 0.04 0.08 0.00 0.00 2.00 0.00 0.00 34.13 36.25 2kfb s GLU 128 CO 0.94 -0.04 0.00 0.41 -0.56 0.00 0.00 175.26 176.01 2kfb n GLY 129 N 1.86 -1.52 3.47 -1.50 0.00 -1.26 -3.77 105.19 102.47 2kfb n GLY 129 Ca -0.22 -1.05 -0.28 0.00 0.00 0.00 0.00 46.02 44.47 2kfb n GLY 129 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2kfb s SER 130 N -6.03 3.75 0.31 1.61 1.04 -1.26 -3.74 113.70 109.37 2kfb s SER 130 Ca 0.00 -0.67 0.05 0.00 0.48 0.00 0.00 55.95 55.81 2kfb s SER 130 Cb 0.00 -0.45 -0.06 0.00 0.10 0.00 0.00 66.02 65.61 2kfb s SER 130 CO 0.00 0.15 0.02 0.26 0.98 0.00 0.00 173.24 174.65 2kfb s TRP 131 N -1.34 1.94 -0.00 5.02 0.52 -0.08 -2.00 118.94 122.99 2kfb s TRP 131 Ca 0.19 -0.88 -0.02 0.00 0.02 0.00 0.00 56.10 55.41 2kfb s TRP 131 Cb -0.10 -1.22 -0.00 0.00 -1.15 0.00 0.00 33.47 31.00 2kfb s TRP 131 CO 0.10 0.09 0.04 0.54 0.02 0.00 0.00 176.95 177.74 2kfb s VAL 132 N -3.22 0.05 -0.02 4.03 0.11 -0.66 0.31 120.40 121.00 2kfb s VAL 132 Ca 0.34 -0.41 0.03 0.00 -2.93 0.00 0.00 61.98 59.01 2kfb s VAL 132 Cb 0.07 -0.20 -0.03 0.00 -1.53 0.00 0.00 36.38 34.69 2kfb s VAL 132 CO 0.14 -0.22 -0.08 -0.76 -3.33 0.00 0.00 175.10 170.84 2kfb s LEU 133 N -0.68 3.09 -0.10 2.54 1.43 -0.87 -1.93 118.68 122.16 2kfb s LEU 133 Ca -0.08 -0.14 0.03 0.00 -1.03 0.00 0.00 54.13 52.91 2kfb s LEU 133 Cb -0.05 -1.74 -0.01 0.00 0.03 0.00 0.00 46.19 44.43 2kfb s LEU 133 CO -0.00 0.31 -0.20 -0.31 0.23 0.00 0.00 176.35 176.38 2kfb s TYR 134 N -0.92 2.64 0.30 0.29 1.51 -0.29 -2.21 117.35 118.67 2kfb s TYR 134 Ca 0.15 -0.79 0.03 0.00 -1.01 0.00 0.00 57.07 55.45 2kfb s TYR 134 Cb -0.11 -1.73 0.76 0.00 -0.11 0.00 0.00 41.96 40.77 2kfb s TYR 134 CO 0.05 -0.27 1.62 1.49 -1.11 0.00 0.00 175.55 177.33 2kfb h GLU 135 N 6.50 0.13 -5.09 -0.62 4.81 -1.72 0.48 114.58 119.07 2kfb h GLU 135 Ca -0.25 -0.01 -0.41 0.00 -0.13 0.00 0.00 59.36 58.55 2kfb h GLU 135 Cb 1.21 -0.03 -0.14 0.00 0.63 0.00 0.00 28.75 30.42 2kfb h GLU 135 CO 0.50 0.09 -0.62 -0.48 -0.73 0.00 0.00 179.01 177.77 2kfb s LEU 136 N -10.73 1.99 0.91 1.64 0.05 -1.26 -2.37 118.68 108.91 2kfb s LEU 136 Ca -0.12 -1.35 -0.12 0.00 0.05 0.00 0.00 54.13 52.58 2kfb s LEU 136 Cb 0.27 -0.22 0.14 0.00 -2.05 0.00 0.00 46.19 44.32 2kfb s LEU 136 CO 0.77 -0.63 1.12 -0.55 -0.55 0.00 0.00 176.35 176.51 2kfb s SER 137 N -3.40 3.47 -0.57 1.48 0.15 -1.26 -3.71 113.70 109.86 2kfb s SER 137 Ca 0.36 1.09 0.00 0.00 0.70 0.00 0.00 55.95 58.10 2kfb s SER 137 Cb 0.08 -1.72 0.00 0.00 -1.71 0.00 0.00 66.02 62.67 2kfb s SER 137 CO 0.14 -2.59 0.00 -3.20 1.20 0.00 0.00 173.24 168.79 2kfb n ASN 138 N -3.81 -4.48 -3.52 5.45 5.15 -1.03 -4.05 115.26 108.97 2kfb n ASN 138 Ca 0.06 0.13 -0.35 0.00 -0.60 0.00 0.00 54.58 53.82 2kfb n ASN 138 Cb 0.58 -2.46 0.03 0.00 -0.53 0.00 0.00 39.78 37.41 2kfb n ASN 138 CO 0.00 0.00 0.00 -1.22 1.40 0.00 0.00 177.26 177.44 2kfb n TYR 139 N -2.57 -2.64 -2.56 1.20 4.01 -1.24 -4.94 117.16 108.42 2kfb n TYR 139 Ca -0.05 1.10 -0.00 0.00 -0.16 0.00 0.00 57.90 58.78 2kfb n TYR 139 Cb 0.32 -2.05 0.04 0.00 -0.31 0.00 0.00 39.34 37.33 2kfb n TYR 139 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 2kfb n ARG 140 N -0.57 0.86 0.00 -0.72 1.74 -1.26 -5.11 116.66 111.60 2kfb n ARG 140 Ca -0.11 -2.18 0.00 0.00 -0.77 0.00 0.00 57.85 54.79 2kfb n ARG 140 Cb 0.68 -0.37 0.00 0.00 -1.02 0.00 0.00 32.46 31.75 2kfb n ARG 140 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2kfb n GLY 141 N -0.37 4.84 3.71 -0.13 0.00 -1.26 -4.92 105.19 107.06 2kfb n GLY 141 Ca -0.04 -0.95 -0.30 0.00 0.00 0.00 0.00 46.02 44.73 2kfb n GLY 141 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2kfb s ARG 142 N 1.99 1.17 -0.05 1.61 0.52 -1.26 -4.78 118.95 118.15 2kfb s ARG 142 Ca 0.00 0.81 -0.03 0.00 -0.52 0.00 0.00 55.73 55.99 2kfb s ARG 142 Cb 0.00 -1.80 0.02 0.00 0.52 0.00 0.00 34.95 33.69 2kfb s ARG 142 CO 0.00 -2.30 0.11 -0.65 0.02 0.00 0.00 175.30 172.48 2kfb s GLN 143 N -4.93 0.09 -0.10 3.54 -0.21 -1.26 -2.55 119.66 114.24 2kfb s GLN 143 Ca 0.64 0.24 0.01 0.00 0.02 0.00 0.00 55.36 56.27 2kfb s GLN 143 Cb -0.18 -0.07 0.02 0.00 1.00 0.00 0.00 33.01 33.78 2kfb s GLN 143 CO 0.57 -0.09 -0.13 0.71 -2.12 0.00 0.00 175.29 174.23 2kfb s TYR 144 N 0.60 1.77 -0.09 0.91 2.02 -0.94 -4.50 117.35 117.13 2kfb s TYR 144 Ca -0.05 -0.83 -0.28 0.00 -0.37 0.00 0.00 57.07 55.55 2kfb s TYR 144 Cb -0.06 -1.32 -0.02 0.00 -0.40 0.00 0.00 41.96 40.16 2kfb s TYR 144 CO -0.03 -0.46 0.91 -1.17 -1.57 0.00 0.00 175.55 173.23 2kfb s LEU 145 N 1.12 4.26 -0.39 -1.29 0.20 -1.26 -2.06 118.68 119.26 2kfb s LEU 145 Ca -0.05 1.41 -0.01 0.00 0.69 0.00 0.00 54.13 56.17 2kfb s LEU 145 Cb -0.14 -3.40 0.11 0.00 -0.43 0.00 0.00 46.19 42.32 2kfb s LEU 145 CO -0.03 -0.34 0.17 -0.76 -0.29 0.00 0.00 176.35 175.10 2kfb s LEU 146 N 1.65 5.14 0.55 -0.68 1.43 0.15 -4.94 118.68 121.98 2kfb s LEU 146 Ca 0.45 -2.06 -0.10 0.00 -1.03 0.00 0.00 54.13 51.38 2kfb s LEU 146 Cb -0.18 -1.78 -0.05 0.00 0.03 0.00 0.00 46.19 44.21 2kfb s LEU 146 CO 0.19 -0.50 0.94 0.00 0.23 0.00 0.00 176.35 177.20 2kfb s MET 147 N 1.08 3.66 -0.23 1.70 0.23 -1.26 -0.90 119.30 123.57 2kfb s MET 147 Ca 0.09 0.63 -0.40 0.00 -1.03 0.00 0.00 55.69 54.97 2kfb s MET 147 Cb -0.22 -2.19 -0.16 0.00 -1.53 0.00 0.00 34.83 30.73 2kfb s MET 147 CO -0.05 -0.39 1.66 -2.30 -2.03 0.00 0.00 175.02 171.91 2kfb n PRO 148 N -2.33 1.06 -1.72 3.16 -0.02 -1.24 -4.77 135.00 129.13 2kfb n PRO 148 Ca 0.04 0.39 0.00 0.00 -2.02 0.00 0.00 63.50 61.91 2kfb n PRO 148 Cb 0.54 -2.05 0.00 0.00 -0.02 0.00 0.00 33.50 31.97 2kfb n PRO 148 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2kfb n GLY 149 N 3.89 -0.58 3.00 -1.23 0.00 -1.06 -5.03 105.19 104.19 2kfb n GLY 149 Ca 0.25 -0.72 -0.24 0.00 0.00 0.00 0.00 46.02 45.32 2kfb n GLY 149 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2kfb s ASP 150 N -4.00 1.70 -0.10 1.61 -1.08 -1.26 -2.55 116.67 110.98 2kfb s ASP 150 Ca 0.00 -0.28 0.04 0.00 -0.52 0.00 0.00 52.55 51.79 2kfb s ASP 150 Cb 0.00 -0.78 -0.00 0.00 -1.46 0.00 0.00 42.92 40.68 2kfb s ASP 150 CO 0.00 0.01 -0.23 -0.31 0.52 0.00 0.00 175.17 175.17 2kfb s TYR 151 N 0.77 2.59 -0.22 -5.34 1.51 -0.43 -4.99 117.35 111.23 2kfb s TYR 151 Ca -0.13 -0.99 0.02 0.00 -1.01 0.00 0.00 57.07 54.96 2kfb s TYR 151 Cb -0.15 -1.72 0.00 0.00 -0.11 0.00 0.00 41.96 39.97 2kfb s TYR 151 CO 0.02 -0.39 0.39 0.54 -1.11 0.00 0.00 175.55 175.01 2kfb n ARG 152 N 3.51 1.98 -3.59 -0.62 1.74 -1.26 -2.25 116.66 116.17 2kfb n ARG 152 Ca -0.19 -0.40 -0.12 0.00 -0.77 0.00 0.00 57.85 56.37 2kfb n ARG 152 Cb 0.53 -0.88 -0.05 0.00 -1.02 0.00 0.00 32.46 31.05 2kfb n ARG 152 CO 0.00 0.00 0.00 -0.98 -1.52 0.00 0.00 177.63 175.13 2kfb s ARG 153 N -0.58 1.07 0.52 5.56 1.70 -1.13 -2.25 118.95 123.85 2kfb s ARG 153 Ca 0.02 -0.48 0.31 0.00 -0.47 0.00 0.00 55.73 55.11 2kfb s ARG 153 Cb 0.02 0.48 1.25 0.00 -0.57 0.00 0.00 34.95 36.13 2kfb s ARG 153 CO 0.05 -0.41 1.95 0.10 -1.08 0.00 0.00 175.30 175.90 2kfb h TYR 154 N 2.52 0.00 0.00 5.89 -0.00 -1.84 -2.82 116.97 120.71 2kfb h TYR 154 Ca -0.33 0.00 -0.01 0.00 -0.00 0.00 0.00 58.73 58.40 2kfb h TYR 154 Cb 1.24 0.00 -0.00 0.00 -0.00 0.00 0.00 36.73 37.97 2kfb h TYR 154 CO 0.33 0.07 -0.04 1.96 -0.00 0.00 0.00 178.16 180.48 2kfb h GLN 155 N 0.00 0.00 -0.59 0.10 4.20 -1.92 -2.80 115.11 114.09 2kfb h GLN 155 Ca -0.00 0.00 0.12 0.00 0.06 0.00 0.00 58.65 58.83 2kfb h GLN 155 Cb 0.57 0.00 -0.10 0.00 0.30 0.00 0.00 27.48 28.25 2kfb h GLN 155 CO 0.01 0.04 0.03 -0.44 -0.67 0.00 0.00 178.83 177.79 2kfb h ASP 156 N 0.00 -0.21 -0.55 1.46 3.32 -1.93 0.11 116.42 118.63 2kfb h ASP 156 Ca -0.00 0.14 0.00 0.00 0.02 0.00 0.00 57.03 57.19 2kfb h ASP 156 Cb 0.33 0.24 0.00 0.00 0.22 0.00 0.00 39.33 40.12 2kfb h ASP 156 CO 0.01 -0.08 0.00 -2.67 -1.72 0.00 0.00 179.24 174.77 2kfb n TRP 157 N -5.24 1.75 -3.21 4.55 2.14 -1.15 -4.98 117.44 111.30 2kfb n TRP 157 Ca 0.08 -0.72 -0.16 0.00 2.07 0.00 0.00 57.50 58.78 2kfb n TRP 157 Cb 0.34 -0.41 0.01 0.00 -0.81 0.00 0.00 31.31 30.44 2kfb n TRP 157 CO 0.00 0.00 0.00 0.41 2.07 0.00 0.00 177.69 180.17 2kfb n GLY 158 N 0.60 -0.97 0.42 -1.67 0.00 0.40 -4.94 105.19 99.03 2kfb n GLY 158 Ca 0.26 0.93 -0.02 0.00 0.00 0.00 0.00 46.02 47.19 2kfb n GLY 158 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2kfb n ALA 159 N -1.05 0.06 0.00 4.61 0.00 -1.07 -5.01 120.51 118.05 2kfb n ALA 159 Ca -0.03 -0.22 0.00 0.00 0.00 0.00 0.00 53.44 53.19 2kfb n ALA 159 Cb 0.56 0.04 0.00 0.00 0.00 0.00 0.00 19.45 20.05 2kfb n ALA 159 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 2kfb n THR 160 N -1.40 0.00 -0.03 0.00 5.66 -1.26 -4.94 114.28 112.31 2kfb n THR 160 Ca 0.02 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.02 2kfb n THR 160 Cb 0.06 -0.64 0.00 0.00 -1.55 0.00 0.00 70.33 68.20 2kfb n THR 160 CO 0.00 0.00 0.00 -3.20 -3.05 0.00 0.00 175.07 168.82 2kfb n ASN 161 N -2.19 0.00 0.00 1.09 5.15 -1.26 -5.02 115.26 113.03 2kfb n ASN 161 Ca 0.00 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.98 2kfb n ASN 161 Cb 0.46 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.71 2kfb n ASN 161 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2kfb n ALA 162 N 0.00 0.00 -1.68 5.20 0.00 -1.26 -4.88 120.51 117.88 2kfb n ALA 162 Ca 0.00 0.00 -0.63 0.00 0.00 0.00 0.00 53.44 52.81 2kfb n ALA 162 Cb 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.36 2kfb n ALA 162 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39 2kfb n ARG 163 N -1.61 0.34 -5.02 0.00 1.85 -1.26 -2.84 116.66 108.13 2kfb n ARG 163 Ca 0.00 0.12 -0.29 0.00 -1.00 0.00 0.00 57.85 56.69 2kfb n ARG 163 Cb 0.00 -1.68 -0.16 0.00 -1.05 0.00 0.00 32.46 29.57 2kfb n ARG 163 CO 0.00 0.00 0.00 0.08 -0.01 0.00 0.00 177.63 177.70 2kfb s VAL 164 N 2.40 1.72 -0.10 8.89 1.01 -1.04 -4.51 120.40 128.77 2kfb s VAL 164 Ca 0.99 -0.86 0.10 0.00 0.00 0.00 0.00 61.98 62.21 2kfb s VAL 164 Cb -1.32 -1.48 -0.14 0.00 0.00 0.00 0.00 36.38 33.44 2kfb s VAL 164 CO 0.71 0.49 0.05 0.61 0.00 0.00 0.00 175.10 176.96 2kfb n GLY 165 N 3.28 -0.53 3.83 4.51 0.00 0.14 -4.70 105.19 111.71 2kfb n GLY 165 Ca -0.19 -0.19 -0.06 0.00 0.00 0.00 0.00 46.02 45.59 2kfb n GLY 165 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2kfb s SER 166 N -4.28 -0.05 -0.21 1.61 0.01 -1.10 -1.46 113.70 108.22 2kfb s SER 166 Ca -0.05 -0.84 -0.27 0.00 1.31 0.00 0.00 55.95 56.10 2kfb s SER 166 Cb 0.03 0.68 0.07 0.00 0.21 0.00 0.00 66.02 67.01 2kfb s SER 166 CO 0.44 -1.32 0.72 -1.48 0.41 0.00 0.00 173.24 172.01 2kfb s LEU 167 N -3.15 -0.72 0.12 2.44 0.05 -0.92 -1.13 118.68 115.37 2kfb s LEU 167 Ca 0.17 1.25 0.04 0.00 0.05 0.00 0.00 54.13 55.64 2kfb s LEU 167 Cb -0.04 2.47 -0.04 0.00 -2.05 0.00 0.00 46.19 46.53 2kfb s LEU 167 CO 0.08 -0.34 -0.11 0.00 -0.55 0.00 0.00 176.35 175.43 2kfb s ARG 168 N -0.03 0.97 0.32 1.48 1.70 -0.81 0.16 118.95 122.74 2kfb s ARG 168 Ca -0.03 -1.30 -0.09 0.00 -0.47 0.00 0.00 55.73 53.84 2kfb s ARG 168 Cb -0.04 -0.63 -0.07 0.00 -0.57 0.00 0.00 34.95 33.65 2kfb s ARG 168 CO 0.03 0.09 0.66 1.03 -1.08 0.00 0.00 175.30 176.03 2kfb s ARG 169 N -3.20 3.77 -0.98 3.89 0.52 -1.26 -1.66 118.95 120.03 2kfb s ARG 169 Ca 0.11 0.32 -0.18 0.00 -0.52 0.00 0.00 55.73 55.46 2kfb s ARG 169 Cb -0.01 -2.52 0.13 0.00 0.52 0.00 0.00 34.95 33.07 2kfb s ARG 169 CO 0.01 0.13 1.21 0.08 0.02 0.00 0.00 175.30 176.75 2kfb s VAL 170 N -2.12 4.69 -0.00 3.52 1.01 -0.85 -4.94 120.40 121.71 2kfb s VAL 170 Ca 0.49 -1.66 0.00 0.00 0.00 0.00 0.00 61.98 60.80 2kfb s VAL 170 Cb -0.11 -4.83 0.00 0.00 0.00 0.00 0.00 36.38 31.45 2kfb s VAL 170 CO 0.27 -1.57 -0.00 -0.63 0.00 0.00 0.00 175.10 173.17 2kfb s ILE 171 N 2.75 0.06 -0.17 2.22 1.09 -1.26 -4.66 121.20 121.23 2kfb s ILE 171 Ca 0.36 -0.00 0.10 0.00 -1.10 0.00 0.00 60.65 60.00 2kfb s ILE 171 Cb -0.04 -0.08 -0.23 0.00 -1.06 0.00 0.00 42.46 41.05 2kfb s ILE 171 CO -0.08 0.04 0.16 -0.67 -0.10 0.00 0.00 174.94 174.28 2kfb n ASP 172 N 3.24 0.95 0.13 3.58 2.03 -1.26 -4.58 116.55 120.63 2kfb n ASP 172 Ca -0.15 0.08 -0.06 0.00 0.52 0.00 0.00 54.79 55.19 2kfb n ASP 172 Cb 0.58 0.19 -0.03 0.00 -0.72 0.00 0.00 41.12 41.14 2kfb n ASP 172 CO 0.00 0.00 0.00 0.15 -1.92 0.00 0.00 177.20 175.43 2kfb h PHE 173 N 0.01 -0.34 0.00 -0.67 3.57 -1.98 -3.48 116.94 114.06 2kfb h PHE 173 Ca -0.49 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.01 2kfb h PHE 173 Cb 2.09 0.11 0.00 0.00 2.79 0.00 0.00 35.95 40.94 2kfb h PHE 173 CO 0.02 -0.21 0.00 -1.13 -2.23 0.00 0.00 178.31 174.76