#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kfb s GLY 2 N 0.00 -0.25 -0.30 1.08 0.00 -1.26 -3.82 107.32 102.76 2kfb s GLY 2 Ca 0.00 0.31 -0.12 0.00 0.00 0.00 0.00 44.72 44.91 2kfb s GLY 2 CO 0.00 1.30 0.99 1.25 0.00 0.00 0.00 173.10 176.64 2kfb s LYS 3 N -2.52 0.25 0.40 2.90 2.20 -1.02 -4.63 119.74 117.32 2kfb s LYS 3 Ca 0.17 0.46 0.07 0.00 -0.36 0.00 0.00 55.97 56.32 2kfb s LYS 3 Cb 0.02 0.26 -0.08 0.00 -1.51 0.00 0.00 37.83 36.52 2kfb s LYS 3 CO -0.01 -0.24 0.00 0.96 -0.36 0.00 0.00 175.35 175.70 2kfb s ILE 4 N 2.87 2.04 -0.13 5.43 -0.00 -1.10 -1.83 121.20 128.48 2kfb s ILE 4 Ca 0.02 -2.02 -0.00 0.00 -0.00 0.00 0.00 60.65 58.65 2kfb s ILE 4 Cb -0.10 -2.96 0.02 0.00 -0.00 0.00 0.00 42.46 39.42 2kfb s ILE 4 CO -0.13 -0.03 -0.11 -0.89 -0.00 0.00 0.00 174.94 173.79 2kfb s THR 5 N -2.69 1.27 -0.15 8.37 2.01 0.15 -2.21 115.64 122.37 2kfb s THR 5 Ca 0.35 -0.44 -0.06 0.00 0.31 0.00 0.00 61.69 61.85 2kfb s THR 5 Cb 0.09 -1.23 -0.04 0.00 0.01 0.00 0.00 72.50 71.33 2kfb s THR 5 CO 0.18 0.41 0.04 -0.76 -0.69 0.00 0.00 174.62 173.80 2kfb s LEU 6 N 1.59 3.74 -0.16 4.42 1.43 0.67 -0.55 118.68 129.82 2kfb s LEU 6 Ca 0.05 0.10 -0.00 0.00 -1.03 0.00 0.00 54.13 53.24 2kfb s LEU 6 Cb -0.13 -1.92 -0.01 0.00 0.03 0.00 0.00 46.19 44.17 2kfb s LEU 6 CO -0.09 0.23 -0.13 -0.31 0.23 0.00 0.00 176.35 176.28 2kfb s TYR 7 N 0.01 2.82 0.44 0.29 1.51 -0.93 -0.35 117.35 121.12 2kfb s TYR 7 Ca 0.05 -0.92 0.20 0.00 -1.01 0.00 0.00 57.07 55.38 2kfb s TYR 7 Cb -0.12 -1.91 1.15 0.00 -0.11 0.00 0.00 41.96 40.97 2kfb s TYR 7 CO 0.01 -0.41 1.85 1.49 -1.11 0.00 0.00 175.55 177.38 2kfb h GLU 8 N 7.25 0.33 -6.58 -0.62 4.81 -0.48 -2.61 114.58 116.68 2kfb h GLU 8 Ca -0.32 -0.02 -0.66 0.00 -0.13 0.00 0.00 59.36 58.23 2kfb h GLU 8 Cb 1.19 -0.07 -0.16 0.00 0.63 0.00 0.00 28.75 30.33 2kfb h GLU 8 CO 0.57 0.22 -0.76 -0.51 -0.73 0.00 0.00 179.01 177.80 2kfb s ASP 9 N -5.61 4.13 0.92 1.04 1.01 -1.23 -2.91 116.67 114.02 2kfb s ASP 9 Ca -0.08 -0.53 -0.04 0.00 0.71 0.00 0.00 52.55 52.62 2kfb s ASP 9 Cb 0.23 -0.67 0.06 0.00 1.01 0.00 0.00 42.92 43.55 2kfb s ASP 9 CO 0.78 0.15 0.14 -2.11 0.21 0.00 0.00 175.17 174.35 2kfb n ARG 10 N 0.51 -1.77 -1.60 8.23 1.85 -1.26 -2.20 116.66 120.42 2kfb n ARG 10 Ca -0.13 -0.24 -0.02 0.00 -1.00 0.00 0.00 57.85 56.45 2kfb n ARG 10 Cb 0.54 -0.35 -0.01 0.00 -1.05 0.00 0.00 32.46 31.59 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 -0.85 -0.05 3.35 2.89 0.00 -0.93 -1.22 105.19 108.39 2kfb n GLY 11 Ca 0.02 0.00 -0.10 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 -1.73 -2.60 -3.14 1.61 3.72 -1.20 -5.02 117.46 109.10 2kfb n PHE 12 Ca -0.03 1.01 0.00 0.00 -0.05 0.00 0.00 57.45 58.38 2kfb n PHE 12 Cb 0.25 -3.61 0.00 0.00 -0.94 0.00 0.00 39.48 35.18 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 -2.17 1.55 0.00 -1.08 6.02 -0.36 -5.04 117.38 116.30 2kfb n GLN 13 Ca -0.12 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.87 2kfb n GLN 13 Cb 0.58 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.84 2kfb n GLN 13 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2kfb n GLY 14 N 2.08 1.01 3.78 1.08 0.00 -1.26 -3.51 105.19 108.37 2kfb n GLY 14 Ca 0.00 -0.56 -0.36 0.00 0.00 0.00 0.00 46.02 45.11 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 3.78 0.05 1.61 0.52 -1.26 -4.82 118.95 118.82 2kfb s ARG 15 Ca 0.00 1.56 0.01 0.00 -0.52 0.00 0.00 55.73 56.79 2kfb s ARG 15 Cb 0.00 -2.26 -0.03 0.00 0.52 0.00 0.00 34.95 33.18 2kfb s ARG 15 CO 0.00 -0.49 -0.06 -3.38 0.02 0.00 0.00 175.30 171.39 2kfb s HIS 16 N -1.74 0.61 -0.06 -0.53 -3.43 -1.26 0.11 115.29 108.98 2kfb s HIS 16 Ca 0.65 -0.60 -0.07 0.00 -0.80 0.00 0.00 55.06 54.25 2kfb s HIS 16 Cb -0.23 -0.37 0.02 0.00 -1.43 0.00 0.00 32.58 30.57 2kfb s HIS 16 CO 0.27 -0.13 0.18 -0.47 -2.00 0.00 0.00 174.74 172.59 2kfb s TYR 17 N -1.86 -0.17 -0.20 0.38 5.04 0.52 -4.99 117.35 116.07 2kfb s TYR 17 Ca -0.07 0.41 -0.04 0.00 -2.44 0.00 0.00 57.07 54.92 2kfb s TYR 17 Cb -0.07 0.05 -0.02 0.00 0.35 0.00 0.00 41.96 42.28 2kfb s TYR 17 CO -0.01 -0.13 -0.03 -2.00 -1.34 0.00 0.00 175.55 172.04 2kfb s GLU 18 N -0.14 3.49 -0.17 4.97 2.12 -1.26 -0.24 118.70 127.48 2kfb s GLU 18 Ca -0.02 -0.58 -0.02 0.00 0.36 0.00 0.00 54.97 54.70 2kfb s GLU 18 Cb -0.02 -3.01 -0.02 0.00 0.26 0.00 0.00 34.13 31.34 2kfb s GLU 18 CO 0.01 -0.06 -0.07 0.00 -0.54 0.00 0.00 175.26 174.59 2kfb n SER 20 N 3.91 2.18 -3.88 0.00 3.41 -1.26 -2.71 113.62 115.26 2kfb n SER 20 Ca -0.18 -2.13 -0.08 0.00 -0.26 0.00 0.00 58.87 56.21 2kfb n SER 20 Cb 0.52 -0.08 -0.04 0.00 -0.26 0.00 0.00 64.21 64.35 2kfb n SER 20 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2kfb s SER 21 N -1.22 -0.20 0.31 4.04 1.04 -1.26 -4.77 113.70 111.64 2kfb s SER 21 Ca 0.07 -0.70 -0.29 0.00 0.48 0.00 0.00 55.95 55.51 2kfb s SER 21 Cb 0.05 0.64 -0.12 0.00 0.10 0.00 0.00 66.02 66.70 2kfb s SER 21 CO 0.02 -1.21 1.53 -0.90 0.98 0.00 0.00 173.24 173.66 2kfb n ASP 22 N -0.41 3.64 -4.08 7.02 5.75 -1.26 -4.61 116.55 122.61 2kfb n ASP 22 Ca -0.04 1.17 -0.19 0.00 -0.01 0.00 0.00 54.79 55.72 2kfb n ASP 22 Cb 0.61 -1.58 -0.14 0.00 -1.03 0.00 0.00 41.12 38.98 2kfb n ASP 22 CO 0.00 0.00 0.00 -1.00 -0.11 0.00 0.00 177.20 176.09 2kfb s HIS 23 N -0.39 1.01 -0.17 2.11 3.76 0.13 -4.98 115.29 116.75 2kfb s HIS 23 Ca 0.61 -0.27 0.05 0.00 -0.15 0.00 0.00 55.06 55.30 2kfb s HIS 23 Cb -0.51 -0.62 -0.05 0.00 1.11 0.00 0.00 32.58 32.50 2kfb s HIS 23 CO 0.54 -0.00 0.17 0.25 -0.85 0.00 0.00 174.74 174.85 2kfb n THR 24 N 2.37 0.00 -3.41 1.30 -2.24 -1.26 -2.34 114.28 108.69 2kfb n THR 24 Ca -0.16 -0.34 -0.11 0.00 -2.27 0.00 0.00 64.05 61.17 2kfb n THR 24 Cb 0.56 0.88 -0.09 0.00 -2.10 0.00 0.00 70.33 69.58 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 -1.64 0.44 0.00 3.42 2.47 -1.25 -0.96 114.94 117.41 2kfb s ASN 25 Ca 0.01 0.20 0.02 0.00 0.42 0.00 0.00 52.86 53.51 2kfb s ASN 25 Cb 0.03 0.97 0.00 0.00 -1.45 0.00 0.00 41.25 40.81 2kfb s ASN 25 CO 0.19 -0.30 0.40 0.18 -3.72 0.00 0.00 177.10 173.85 2kfb n LEU 26 N 5.36 0.81 -0.18 3.21 4.77 0.16 -4.74 117.00 126.38 2kfb n LEU 26 Ca -0.04 -0.82 -0.04 0.00 -0.03 0.00 0.00 56.01 55.07 2kfb n LEU 26 Cb 0.50 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.61 2kfb n LEU 26 CO 0.06 0.19 0.67 1.56 -1.33 0.00 0.00 177.39 178.54 2kfb h GLN 27 N 0.30 -0.13 -0.56 3.23 4.20 -1.69 1.45 115.11 121.92 2kfb h GLN 27 Ca 0.00 0.01 0.11 0.00 0.06 0.00 0.00 58.65 58.83 2kfb h GLN 27 Cb 0.08 0.03 -0.03 0.00 0.30 0.00 0.00 27.48 27.86 2kfb h GLN 27 CO 0.00 -0.08 0.38 -1.00 -0.67 0.00 0.00 178.83 177.46 2kfb h PRO 28 N -0.13 0.26 0.01 1.46 0.13 -1.96 -3.08 132.00 128.68 2kfb h PRO 28 Ca 0.24 -0.02 -0.29 0.00 -0.87 0.00 0.00 66.00 65.07 2kfb h PRO 28 Cb 0.51 -0.06 -0.04 0.00 0.13 0.00 0.00 31.00 31.54 2kfb h PRO 28 CO -0.62 0.17 -1.56 0.66 -0.23 0.00 0.00 178.00 176.42 2kfb n TYR 29 N -4.45 0.82 -4.80 1.56 4.01 0.47 -4.91 117.16 109.85 2kfb n TYR 29 Ca 0.09 0.34 -0.31 0.00 -0.16 0.00 0.00 57.90 57.87 2kfb n TYR 29 Cb 0.44 -1.08 -0.17 0.00 -0.31 0.00 0.00 39.34 38.22 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 -7.75 2.01 0.04 7.72 1.43 0.47 -4.87 118.68 117.73 2kfb s LEU 30 Ca -0.31 -0.54 0.23 0.00 -1.03 0.00 0.00 54.13 52.48 2kfb s LEU 30 Cb 0.08 -1.34 0.01 0.00 0.03 0.00 0.00 46.19 44.97 2kfb s LEU 30 CO 0.58 0.09 0.99 -0.24 0.23 0.00 0.00 176.35 178.00 2kfb n SER 31 N 3.90 0.61 0.10 2.29 2.88 -1.25 -3.48 113.62 118.67 2kfb n SER 31 Ca -0.20 -0.25 0.00 0.00 -1.33 0.00 0.00 58.87 57.10 2kfb n SER 31 Cb 0.52 0.86 0.00 0.00 -0.75 0.00 0.00 64.21 64.84 2kfb n SER 31 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 2kfb n ARG 32 N -1.95 0.00 -2.81 -1.46 1.74 -1.26 -4.96 116.66 105.95 2kfb n ARG 32 Ca 0.02 0.00 -0.07 0.00 -0.77 0.00 0.00 57.85 57.02 2kfb n ARG 32 Cb 0.44 0.00 0.01 0.00 -1.02 0.00 0.00 32.46 31.89 2kfb n ARG 32 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2kfb n ASN 34 N -0.38 2.48 -3.54 0.00 3.02 -0.99 -4.81 115.26 111.05 2kfb n ASN 34 Ca 0.11 -1.85 -0.12 0.00 -0.03 0.00 0.00 54.58 52.69 2kfb n ASN 34 Cb 0.45 -0.17 -0.04 0.00 -0.61 0.00 0.00 39.78 39.40 2kfb n ASN 34 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 2kfb s SER 35 N -1.52 -0.42 0.04 6.41 1.04 -1.22 -0.23 113.70 117.80 2kfb s SER 35 Ca 0.35 -0.02 -0.20 0.00 0.48 0.00 0.00 55.95 56.55 2kfb s SER 35 Cb 0.20 0.52 0.04 0.00 0.10 0.00 0.00 66.02 66.88 2kfb s SER 35 CO 0.28 -0.84 0.46 0.00 0.98 0.00 0.00 173.24 174.13 2kfb s ALA 36 N -3.28 -1.17 -0.08 5.32 0.00 0.97 -2.20 121.76 121.33 2kfb s ALA 36 Ca -0.01 0.47 -0.00 0.00 0.00 0.00 0.00 51.96 52.42 2kfb s ALA 36 Cb 0.00 0.34 0.02 0.00 0.00 0.00 0.00 23.12 23.49 2kfb s ALA 36 CO -0.08 -0.47 -0.04 1.03 0.00 0.00 0.00 175.76 176.20 2kfb s ARG 37 N -2.39 0.98 -0.29 0.00 0.52 0.29 0.50 118.95 118.57 2kfb s ARG 37 Ca -0.06 -0.07 -0.07 0.00 -0.52 0.00 0.00 55.73 55.01 2kfb s ARG 37 Cb -0.01 -1.15 0.00 0.00 0.52 0.00 0.00 34.95 34.31 2kfb s ARG 37 CO -0.02 -0.23 0.08 0.08 0.02 0.00 0.00 175.30 175.23 2kfb s VAL 38 N 1.61 4.04 -0.01 3.52 1.01 0.79 0.29 120.40 131.66 2kfb s VAL 38 Ca 0.01 -0.58 -0.20 0.00 0.00 0.00 0.00 61.98 61.21 2kfb s VAL 38 Cb -0.13 -3.04 -0.29 0.00 0.00 0.00 0.00 36.38 32.92 2kfb s VAL 38 CO -0.05 0.13 0.99 -0.78 0.00 0.00 0.00 175.10 175.40 2kfb h ASP 39 N 8.24 0.57 -4.98 3.32 1.82 -1.62 0.13 116.42 123.89 2kfb h ASP 39 Ca -0.33 -0.88 -0.01 0.00 -0.39 0.00 0.00 57.03 55.42 2kfb h ASP 39 Cb 1.14 -0.18 -0.12 0.00 0.68 0.00 0.00 39.33 40.84 2kfb h ASP 39 CO 0.60 1.39 0.23 -0.44 -1.61 0.00 0.00 179.24 179.41 2kfb s SER 40 N -7.00 -0.56 0.00 2.28 0.01 -1.25 -4.80 113.70 102.37 2kfb s SER 40 Ca -0.13 0.01 0.00 0.00 1.31 0.00 0.00 55.95 57.15 2kfb s SER 40 Cb 0.02 0.59 0.00 0.00 0.21 0.00 0.00 66.02 66.84 2kfb s SER 40 CO 0.85 -0.94 0.00 0.61 0.41 0.00 0.00 173.24 174.17 2kfb n GLY 41 N -0.35 -1.54 3.50 3.44 0.00 -1.25 -2.45 105.19 106.55 2kfb n GLY 41 Ca -0.17 -1.52 -0.33 0.00 0.00 0.00 0.00 46.02 44.00 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 -0.55 1.49 -0.03 0.00 0.52 -0.84 -2.37 118.94 117.16 2kfb s TRP 43 Ca 0.08 -0.42 0.04 0.00 0.02 0.00 0.00 56.10 55.82 2kfb s TRP 43 Cb -0.12 -0.84 -0.00 0.00 -1.15 0.00 0.00 33.47 31.36 2kfb s TRP 43 CO 0.02 0.11 -0.15 1.41 0.02 0.00 0.00 176.95 178.36 2kfb s MET 44 N -1.65 1.42 -0.06 4.98 1.75 -0.74 -0.62 119.30 124.39 2kfb s MET 44 Ca 0.03 -0.52 0.03 0.00 -1.25 0.00 0.00 55.69 53.97 2kfb s MET 44 Cb -0.10 -1.29 -0.03 0.00 2.84 0.00 0.00 34.83 36.25 2kfb s MET 44 CO 0.03 0.25 -0.13 -0.51 -0.65 0.00 0.00 175.02 174.01 2kfb s LEU 45 N -0.07 2.84 -0.11 4.11 1.43 -1.11 -0.57 118.68 125.20 2kfb s LEU 45 Ca -0.00 -0.16 -0.02 0.00 -1.03 0.00 0.00 54.13 52.93 2kfb s LEU 45 Cb -0.09 -1.59 -0.03 0.00 0.03 0.00 0.00 46.19 44.52 2kfb s LEU 45 CO 0.01 0.35 -0.05 -0.31 0.23 0.00 0.00 176.35 176.57 2kfb s TYR 46 N -0.72 2.99 0.46 0.29 1.51 0.07 -2.08 117.35 119.88 2kfb s TYR 46 Ca 0.11 -0.14 0.14 0.00 -1.01 0.00 0.00 57.07 56.17 2kfb s TYR 46 Cb -0.11 -1.84 1.09 0.00 -0.11 0.00 0.00 41.96 41.00 2kfb s TYR 46 CO 0.01 0.15 2.04 1.05 -1.11 0.00 0.00 175.55 177.69 2kfb h GLU 47 N 5.97 0.29 -6.45 -0.62 4.11 -1.49 -2.61 114.58 113.77 2kfb h GLU 47 Ca -0.40 -0.02 -0.63 0.00 0.07 0.00 0.00 59.36 58.39 2kfb h GLU 47 Cb 1.19 -0.06 -0.15 0.00 0.50 0.00 0.00 28.75 30.22 2kfb h GLU 47 CO 0.57 0.19 -0.74 1.14 0.07 0.00 0.00 179.01 180.24 2kfb s GLN 48 N -5.29 1.93 0.57 1.06 -2.07 -1.26 -3.60 119.66 111.00 2kfb s GLN 48 Ca -0.07 -1.37 -0.19 0.00 -1.82 0.00 0.00 55.36 51.91 2kfb s GLN 48 Cb 0.18 -2.06 -0.07 0.00 -1.09 0.00 0.00 33.01 29.97 2kfb s GLN 48 CO 0.72 0.41 0.83 -0.35 -1.32 0.00 0.00 175.29 175.58 2kfb n PRO 49 N -0.02 0.82 0.00 9.60 -0.04 -1.26 -4.38 135.00 139.72 2kfb n PRO 49 Ca -0.10 0.31 0.00 0.00 -0.04 0.00 0.00 63.50 63.67 2kfb n PRO 49 Cb 0.56 -2.00 0.00 0.00 -0.04 0.00 0.00 33.50 32.02 2kfb n PRO 49 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 2kfb n ASN 50 N -0.20 0.00 -2.98 3.54 5.03 -0.13 -4.27 115.26 116.25 2kfb n ASN 50 Ca 0.13 0.00 -0.15 0.00 0.87 0.00 0.00 54.58 55.43 2kfb n ASN 50 Cb 0.46 0.00 -0.02 0.00 -1.02 0.00 0.00 39.78 39.21 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 12.42 -2.18 -1.82 3.10 4.01 -1.26 -4.56 117.16 126.86 2kfb n TYR 51 Ca 0.00 -2.46 0.00 0.00 -0.16 0.00 0.00 57.90 55.28 2kfb n TYR 51 Cb 0.00 0.78 0.00 0.00 -0.31 0.00 0.00 39.34 39.81 2kfb n TYR 51 CO 0.00 0.00 0.00 0.43 -0.46 0.00 0.00 176.86 176.83 2kfb n SER 52 N 1.99 0.00 -0.53 7.72 7.64 -1.26 -5.11 113.62 124.07 2kfb n SER 52 Ca 0.17 -1.82 0.00 0.00 1.01 0.00 0.00 58.87 58.24 2kfb n SER 52 Cb 0.56 -0.16 0.00 0.00 -1.01 0.00 0.00 64.21 63.60 2kfb n SER 52 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2kfb n GLY 53 N 0.00 4.81 3.73 0.23 0.00 -1.26 -4.94 105.19 107.75 2kfb n GLY 53 Ca 0.00 -1.60 -0.38 0.00 0.00 0.00 0.00 46.02 44.04 2kfb n GLY 53 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2kfb n LEU 54 N 0.00 5.44 -4.35 0.99 7.94 -1.26 -4.70 117.00 121.06 2kfb n LEU 54 Ca 0.00 0.96 -0.27 0.00 -1.11 0.00 0.00 56.01 55.59 2kfb n LEU 54 Cb 0.00 -1.56 -0.13 0.00 0.53 0.00 0.00 43.42 42.26 2kfb n LEU 54 CO 0.00 -0.71 -0.55 0.00 -1.11 0.00 0.00 177.39 175.03 2kfb s GLN 55 N -2.91 1.30 -0.12 1.96 -2.07 -1.26 -1.87 119.66 114.69 2kfb s GLN 55 Ca 0.73 -1.28 0.01 0.00 -1.82 0.00 0.00 55.36 53.00 2kfb s GLN 55 Cb -0.42 -1.70 0.02 0.00 -1.09 0.00 0.00 33.01 29.82 2kfb s GLN 55 CO 0.48 0.40 -0.14 0.71 -1.32 0.00 0.00 175.29 175.42 2kfb s TYR 56 N -1.11 1.96 -0.19 9.60 2.02 -0.88 -4.66 117.35 124.08 2kfb s TYR 56 Ca 0.11 -0.97 -0.26 0.00 -0.37 0.00 0.00 57.07 55.58 2kfb s TYR 56 Cb -0.10 -1.44 -0.01 0.00 -0.40 0.00 0.00 41.96 40.02 2kfb s TYR 56 CO 0.05 -0.52 0.87 0.12 -1.57 0.00 0.00 175.55 174.50 2kfb s PHE 57 N 1.18 3.39 0.05 2.71 5.36 -1.26 -2.74 117.98 126.66 2kfb s PHE 57 Ca -0.03 1.28 0.09 0.00 -0.96 0.00 0.00 56.93 57.31 2kfb s PHE 57 Cb -0.14 -3.07 -0.03 0.00 -0.34 0.00 0.00 43.02 39.43 2kfb s PHE 57 CO -0.04 -0.31 -0.23 -0.51 -1.46 0.00 0.00 175.22 172.66 2kfb s LEU 58 N 2.47 2.37 0.12 6.12 1.02 0.21 -4.91 118.68 126.08 2kfb s LEU 58 Ca 0.39 -0.54 0.04 0.00 0.02 0.00 0.00 54.13 54.04 2kfb s LEU 58 Cb -0.16 -1.38 -0.04 0.00 0.02 0.00 0.00 46.19 44.63 2kfb s LEU 58 CO 0.11 0.25 -0.10 -0.13 0.02 0.00 0.00 176.35 176.49 2kfb s ARG 59 N -1.41 0.97 -0.17 1.70 0.52 -1.26 -2.00 118.95 117.30 2kfb s ARG 59 Ca 0.13 -1.31 -0.31 0.00 -0.52 0.00 0.00 55.73 53.72 2kfb s ARG 59 Cb -0.10 -0.60 -0.14 0.00 0.52 0.00 0.00 34.95 34.63 2kfb s ARG 59 CO 0.04 0.08 0.95 2.89 0.02 0.00 0.00 175.30 179.28 2kfb n ARG 60 N 0.17 0.00 -3.13 3.54 1.85 -1.24 -4.73 116.66 113.12 2kfb n ARG 60 Ca -0.13 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.72 2kfb n ARG 60 Cb 0.59 -1.07 0.00 0.00 -1.05 0.00 0.00 32.46 30.93 2kfb n ARG 60 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2kfb n GLY 61 N 1.93 -1.89 3.30 2.89 0.00 0.03 -4.96 105.19 106.50 2kfb n GLY 61 Ca 0.18 -1.45 -0.33 0.00 0.00 0.00 0.00 46.02 44.42 2kfb n GLY 61 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2kfb s ASP 62 N -0.68 3.66 -0.22 1.61 -4.77 -1.26 -0.15 116.67 114.86 2kfb s ASP 62 Ca 0.00 -0.43 0.02 0.00 -3.30 0.00 0.00 52.55 48.84 2kfb s ASP 62 Cb 0.00 -1.54 0.05 0.00 -1.09 0.00 0.00 42.92 40.34 2kfb s ASP 62 CO 0.00 0.15 -0.11 -0.31 0.70 0.00 0.00 175.17 175.59 2kfb s TYR 63 N 0.45 2.78 -2.04 2.11 2.02 0.18 -4.97 117.35 117.88 2kfb s TYR 63 Ca -0.12 -1.89 0.26 0.00 -0.37 0.00 0.00 57.07 54.94 2kfb s TYR 63 Cb -0.16 -1.78 0.62 0.00 -0.40 0.00 0.00 41.96 40.24 2kfb s TYR 63 CO 0.05 -0.81 1.49 0.00 -1.57 0.00 0.00 175.55 174.71 2kfb n ALA 64 N 4.58 3.04 -3.31 3.71 0.00 -1.26 -0.02 120.51 127.24 2kfb n ALA 64 Ca -0.15 -0.48 -0.13 0.00 0.00 0.00 0.00 53.44 52.68 2kfb n ALA 64 Cb 0.45 -1.05 -0.12 0.00 0.00 0.00 0.00 19.45 18.73 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 -2.37 -0.30 0.31 0.00 1.01 -1.21 -2.18 116.67 111.95 2kfb s ASP 65 Ca 0.26 0.57 0.00 0.00 0.71 0.00 0.00 52.55 54.09 2kfb s ASP 65 Cb 0.19 0.54 0.53 0.00 1.01 0.00 0.00 42.92 45.19 2kfb s ASP 65 CO 0.48 -0.12 1.96 1.12 0.21 0.00 0.00 175.17 178.82 2kfb h HIS 66 N 6.11 0.98 0.00 4.23 2.07 -0.92 0.34 115.15 127.97 2kfb h HIS 66 Ca -0.30 0.02 0.00 0.00 -2.85 0.00 0.00 60.37 57.25 2kfb h HIS 66 Cb 1.18 -0.33 0.00 0.00 2.57 0.00 0.00 27.41 30.83 2kfb h HIS 66 CO 0.38 0.58 0.08 1.04 -3.07 0.00 0.00 177.93 176.94 2kfb n GLN 67 N -4.44 0.00 0.06 5.12 6.02 -1.26 -1.02 117.38 121.86 2kfb n GLN 67 Ca 0.10 0.31 -0.14 0.00 -0.01 0.00 0.00 57.00 57.26 2kfb n GLN 67 Cb 0.10 -1.58 -0.14 0.00 1.02 0.00 0.00 30.24 29.64 2kfb n GLN 67 CO 0.00 0.00 0.00 1.96 -1.01 0.00 0.00 177.06 178.01 2kfb h GLN 68 N 0.00 0.18 -0.63 -1.09 1.08 -1.31 -3.28 115.11 110.07 2kfb h GLN 68 Ca 0.00 -0.31 0.00 0.00 -1.45 0.00 0.00 58.65 56.89 2kfb h GLN 68 Cb 0.17 0.12 0.00 0.00 -0.05 0.00 0.00 27.48 27.71 2kfb h GLN 68 CO 0.00 1.05 0.00 -2.67 -0.95 0.00 0.00 178.83 176.26 2kfb n TRP 69 N -3.41 1.17 -1.89 2.96 2.14 -0.19 -4.87 117.44 113.35 2kfb n TRP 69 Ca -0.12 -0.45 -0.05 0.00 2.07 0.00 0.00 57.50 58.95 2kfb n TRP 69 Cb 1.02 -0.22 -0.01 0.00 -0.81 0.00 0.00 31.31 31.29 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 0.73 -0.38 -0.32 -2.67 2.81 -1.21 -4.36 117.12 111.72 2kfb n MET 70 Ca 0.19 0.33 0.00 0.00 -1.81 0.00 0.00 57.70 56.41 2kfb n MET 70 Cb 0.73 -4.08 0.00 0.00 -0.71 0.00 0.00 33.22 29.15 2kfb n MET 70 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2kfb n GLY 71 N -1.30 1.80 0.00 3.03 0.00 -0.83 -4.64 105.19 103.24 2kfb n GLY 71 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.96 2kfb n GLY 71 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2kfb n LEU 72 N 1.66 0.00 -4.50 0.99 4.77 -1.26 -2.74 117.00 115.92 2kfb n LEU 72 Ca 0.00 0.00 -0.38 0.00 -0.03 0.00 0.00 56.01 55.60 2kfb n LEU 72 Cb 0.33 0.00 -0.11 0.00 -2.33 0.00 0.00 43.42 41.30 2kfb n LEU 72 CO 0.00 0.00 -0.19 -0.94 -1.33 0.00 0.00 177.39 174.93 2kfb s SER 73 N -4.35 5.71 0.00 -1.43 1.04 -1.26 -4.95 113.70 108.46 2kfb s SER 73 Ca 0.00 -0.33 0.00 0.00 0.48 0.00 0.00 55.95 56.10 2kfb s SER 73 Cb 0.00 -2.05 0.00 0.00 0.10 0.00 0.00 66.02 64.07 2kfb s SER 73 CO 0.00 -0.14 0.54 -0.90 0.98 0.00 0.00 173.24 173.72 2kfb n ASP 74 N 5.02 1.47 -4.26 7.02 5.68 -1.11 -4.67 116.55 125.71 2kfb n ASP 74 Ca -0.14 -1.22 -0.33 0.00 -0.50 0.00 0.00 54.79 52.60 2kfb n ASP 74 Cb 0.50 -0.30 -0.16 0.00 -1.14 0.00 0.00 41.12 40.03 2kfb n ASP 74 CO 0.00 0.00 0.00 -0.55 -1.33 0.00 0.00 177.20 175.32 2kfb s SER 75 N 1.73 3.50 -0.30 -1.12 0.15 -1.26 -4.95 113.70 111.45 2kfb s SER 75 Ca 0.00 -0.49 -0.10 0.00 0.70 0.00 0.00 55.95 56.06 2kfb s SER 75 Cb 0.00 -1.52 0.15 0.00 -1.71 0.00 0.00 66.02 62.94 2kfb s SER 75 CO 0.00 0.11 0.76 0.54 1.20 0.00 0.00 173.24 175.86 2kfb s VAL 76 N 0.63 -0.82 -0.02 4.45 0.11 -1.24 -3.95 120.40 119.57 2kfb s VAL 76 Ca -0.10 0.00 0.02 0.00 -2.93 0.00 0.00 61.98 58.98 2kfb s VAL 76 Cb -0.16 -1.00 0.04 0.00 -1.53 0.00 0.00 36.38 33.73 2kfb s VAL 76 CO 0.03 0.00 0.82 0.54 -3.33 0.00 0.00 175.10 173.16 2kfb n ARG 77 N 5.31 1.09 -3.43 1.54 1.74 -0.99 -4.70 116.66 117.23 2kfb n ARG 77 Ca -0.09 -1.16 -0.12 0.00 -0.77 0.00 0.00 57.85 55.70 2kfb n ARG 77 Cb 0.51 -0.79 -0.02 0.00 -1.02 0.00 0.00 32.46 31.14 2kfb n ARG 77 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 2kfb s SER 78 N -0.85 -0.55 -0.10 0.55 0.01 -1.21 -0.67 113.70 110.88 2kfb s SER 78 Ca 0.04 0.03 -0.23 0.00 1.31 0.00 0.00 55.95 57.11 2kfb s SER 78 Cb 0.04 0.57 0.05 0.00 0.21 0.00 0.00 66.02 66.89 2kfb s SER 78 CO 0.00 -0.91 0.54 0.00 0.41 0.00 0.00 173.24 173.28 2kfb s ARG 80 N -0.72 1.12 -0.25 0.00 1.70 0.27 0.20 118.95 121.28 2kfb s ARG 80 Ca -0.08 -1.18 -0.09 0.00 -0.47 0.00 0.00 55.73 53.90 2kfb s ARG 80 Cb -0.03 -1.34 -0.04 0.00 -0.57 0.00 0.00 34.95 32.97 2kfb s ARG 80 CO 0.05 0.30 0.13 -1.17 -1.08 0.00 0.00 175.30 173.54 2kfb s LEU 81 N -2.01 3.80 -0.32 -1.89 0.20 -1.26 -1.79 118.68 115.42 2kfb s LEU 81 Ca 0.07 -0.05 -0.26 0.00 0.69 0.00 0.00 54.13 54.58 2kfb s LEU 81 Cb -0.09 -2.03 0.01 0.00 -0.43 0.00 0.00 46.19 43.64 2kfb s LEU 81 CO 0.04 -0.00 0.90 -0.63 -0.29 0.00 0.00 176.35 176.37 2kfb s ILE 82 N 1.45 4.68 0.62 6.68 1.01 -1.00 -4.84 121.20 129.80 2kfb s ILE 82 Ca 0.06 1.37 -0.18 0.00 0.00 0.00 0.00 60.65 61.91 2kfb s ILE 82 Cb -0.15 -4.26 -0.05 0.00 0.01 0.00 0.00 42.46 38.02 2kfb s ILE 82 CO 0.06 -0.35 0.84 -2.65 0.00 0.00 0.00 174.94 172.84 2kfb n PRO 83 N 6.48 0.72 -1.25 2.79 -0.02 -1.26 -4.41 135.00 138.04 2kfb n PRO 83 Ca 0.07 0.29 -0.30 0.00 -2.02 0.00 0.00 63.50 61.53 2kfb n PRO 83 Cb 0.48 -2.06 0.23 0.00 -0.02 0.00 0.00 33.50 32.13 2kfb n PRO 83 CO 0.00 0.00 0.00 -3.38 1.98 0.00 0.00 175.50 174.10 2kfb s HIS 84 N -1.62 0.73 -0.19 6.00 -3.43 -1.26 -4.81 115.29 110.71 2kfb s HIS 84 Ca 0.74 0.47 -0.29 0.00 -0.80 0.00 0.00 55.06 55.18 2kfb s HIS 84 Cb -0.41 -3.58 0.12 0.00 -1.43 0.00 0.00 32.58 27.29 2kfb s HIS 84 CO 0.49 -3.63 0.99 0.45 -2.00 0.00 0.00 174.74 171.05 2kfb s SER 85 N -4.08 -0.40 -0.22 7.38 0.15 -1.26 -4.93 113.70 110.34 2kfb s SER 85 Ca 0.71 0.53 -0.16 0.00 0.70 0.00 0.00 55.95 57.74 2kfb s SER 85 Cb -0.09 0.46 -0.08 0.00 -1.71 0.00 0.00 66.02 64.60 2kfb s SER 85 CO 0.55 -0.30 -0.33 0.61 1.20 0.00 0.00 173.24 174.97 2kfb n GLY 86 N 1.12 -0.53 3.84 9.45 0.00 -1.26 -4.97 105.19 112.84 2kfb n GLY 86 Ca -0.11 -0.24 -0.35 0.00 0.00 0.00 0.00 46.02 45.31 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 -6.52 6.84 -0.20 1.61 0.01 -1.26 -5.07 113.70 109.11 2kfb s SER 87 Ca -0.32 1.09 -0.02 0.00 1.31 0.00 0.00 55.95 58.00 2kfb s SER 87 Cb 0.08 -2.29 0.06 0.00 0.21 0.00 0.00 66.02 64.08 2kfb s SER 87 CO 0.45 0.11 0.02 -1.00 0.41 0.00 0.00 173.24 173.23 2kfb s HIS 88 N -1.45 1.19 -0.02 2.43 0.09 -1.26 -3.16 115.29 113.11 2kfb s HIS 88 Ca 0.37 -0.96 0.00 0.00 -0.00 0.00 0.00 55.06 54.48 2kfb s HIS 88 Cb -0.15 -1.09 0.02 0.00 -0.00 0.00 0.00 32.58 31.36 2kfb s HIS 88 CO 0.19 -0.63 -0.00 0.50 -0.00 0.00 0.00 174.74 174.80 2kfb s ARG 89 N 1.80 0.26 -0.02 1.40 3.52 -1.23 -4.36 118.95 120.31 2kfb s ARG 89 Ca -0.02 0.05 -0.12 0.00 -0.13 0.00 0.00 55.73 55.52 2kfb s ARG 89 Cb -0.17 -0.41 0.02 0.00 -1.56 0.00 0.00 34.95 32.82 2kfb s ARG 89 CO -0.08 -0.10 0.25 -1.50 -0.81 0.00 0.00 175.30 173.06 2kfb s ILE 90 N 0.83 0.06 -0.35 4.11 2.07 -1.05 -2.49 121.20 124.36 2kfb s ILE 90 Ca -0.08 -0.46 0.02 0.00 -1.41 0.00 0.00 60.65 58.72 2kfb s ILE 90 Cb -0.11 -0.52 0.11 0.00 0.13 0.00 0.00 42.46 42.06 2kfb s ILE 90 CO -0.02 -0.25 0.11 -0.13 -1.91 0.00 0.00 174.94 172.74 2kfb s ARG 91 N -1.09 1.20 0.18 3.50 0.52 0.10 -1.56 118.95 121.79 2kfb s ARG 91 Ca -0.12 -1.64 -0.30 0.00 -0.52 0.00 0.00 55.73 53.16 2kfb s ARG 91 Cb -0.05 -2.64 -0.08 0.00 0.52 0.00 0.00 34.95 32.70 2kfb s ARG 91 CO 0.03 -1.00 1.10 -0.51 0.02 0.00 0.00 175.30 174.94 2kfb s LEU 92 N 1.02 4.49 -0.04 2.53 1.43 -0.18 -0.64 118.68 127.29 2kfb s LEU 92 Ca 0.12 2.09 0.06 0.00 -1.03 0.00 0.00 54.13 55.36 2kfb s LEU 92 Cb -0.19 -3.60 -0.02 0.00 0.03 0.00 0.00 46.19 42.40 2kfb s LEU 92 CO -0.13 -0.21 -0.21 -0.31 0.23 0.00 0.00 176.35 175.71 2kfb s TYR 93 N -0.27 2.50 0.04 0.29 1.51 0.12 -1.22 117.35 120.32 2kfb s TYR 93 Ca 0.49 -0.43 -0.18 0.00 -1.01 0.00 0.00 57.07 55.94 2kfb s TYR 93 Cb -0.29 -1.59 -0.09 0.00 -0.11 0.00 0.00 41.96 39.88 2kfb s TYR 93 CO 0.35 -0.02 1.28 0.93 -1.11 0.00 0.00 175.55 176.98 2kfb h GLU 94 N 5.65 -0.54 -6.72 -0.62 4.39 -1.11 -2.98 114.58 112.66 2kfb h GLU 94 Ca -0.40 0.04 -0.45 0.00 0.34 0.00 0.00 59.36 58.88 2kfb h GLU 94 Cb 1.15 0.12 0.04 0.00 -0.10 0.00 0.00 28.75 29.96 2kfb h GLU 94 CO 0.49 -0.36 -0.10 1.03 -1.16 0.00 0.00 179.01 178.91 2kfb s ARG 95 N -4.44 2.43 1.06 2.33 1.81 0.79 -1.90 118.95 121.03 2kfb s ARG 95 Ca -0.09 -1.18 -0.12 0.00 -1.72 0.00 0.00 55.73 52.62 2kfb s ARG 95 Cb 0.02 -2.58 0.23 0.00 -0.45 0.00 0.00 34.95 32.16 2kfb s ARG 95 CO 0.30 -0.73 1.06 -1.21 -0.68 0.00 0.00 175.30 174.04 2kfb s GLU 96 N -4.68 -0.11 -1.36 3.54 2.02 -1.23 -2.97 118.70 113.91 2kfb s GLU 96 Ca 0.59 0.86 -0.11 0.00 0.02 0.00 0.00 54.97 56.33 2kfb s GLU 96 Cb -0.08 -1.65 0.09 0.00 0.10 0.00 0.00 34.13 32.59 2kfb s GLU 96 CO 0.38 -3.18 0.57 -3.47 0.02 0.00 0.00 175.26 169.57 2kfb n ASP 97 N -4.54 -3.74 -3.20 -0.19 -0.08 -0.57 -0.40 116.55 103.82 2kfb n ASP 97 Ca 0.05 -0.51 -0.23 0.00 -1.51 0.00 0.00 54.79 52.59 2kfb n ASP 97 Cb 0.55 -3.08 0.02 0.00 2.34 0.00 0.00 41.12 40.95 2kfb n ASP 97 CO 0.00 0.00 0.00 -1.22 0.12 0.00 0.00 177.20 176.10 2kfb n TYR 98 N -4.06 -1.98 -3.87 -0.67 4.01 -1.23 -4.97 117.16 104.39 2kfb n TYR 98 Ca 0.00 0.55 -0.32 0.00 -0.16 0.00 0.00 57.90 57.98 2kfb n TYR 98 Cb 0.53 -4.00 -0.04 0.00 -0.31 0.00 0.00 39.34 35.52 2kfb n TYR 98 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 2kfb s ARG 99 N -5.88 3.47 0.76 -0.72 0.52 0.46 -4.97 118.95 112.60 2kfb s ARG 99 Ca 0.37 -0.35 0.00 0.00 -0.52 0.00 0.00 55.73 55.23 2kfb s ARG 99 Cb -0.18 -3.03 0.00 0.00 0.52 0.00 0.00 34.95 32.27 2kfb s ARG 99 CO 0.45 0.61 0.00 0.41 0.02 0.00 0.00 175.30 176.79 2kfb n GLY 100 N 0.44 -1.79 3.76 -3.53 0.00 -1.26 -0.15 105.19 102.65 2kfb n GLY 100 Ca -0.06 -1.70 -0.38 0.00 0.00 0.00 0.00 46.02 43.88 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 0.00 3.34 0.13 1.61 2.00 -1.26 -4.72 119.66 120.75 2kfb s GLN 101 Ca 0.00 2.12 0.04 0.00 -2.00 0.00 0.00 55.36 55.52 2kfb s GLN 101 Cb 0.00 -2.32 -0.04 0.00 0.80 0.00 0.00 33.01 31.44 2kfb s GLN 101 CO 0.00 -1.00 -0.10 0.00 -0.50 0.00 0.00 175.29 173.70 2kfb s MET 102 N -2.82 0.97 -0.10 1.67 0.23 -1.26 -0.81 119.30 117.18 2kfb s MET 102 Ca 0.69 -1.35 -0.12 0.00 -1.03 0.00 0.00 55.69 53.88 2kfb s MET 102 Cb -0.38 -0.55 0.03 0.00 -1.53 0.00 0.00 34.83 32.40 2kfb s MET 102 CO 0.45 0.07 0.31 -1.50 -2.03 0.00 0.00 175.02 172.32 2kfb s ILE 103 N -3.11 0.01 -0.02 3.16 2.07 -0.36 -5.01 121.20 117.94 2kfb s ILE 103 Ca 0.13 -0.10 0.04 0.00 -1.41 0.00 0.00 60.65 59.30 2kfb s ILE 103 Cb 0.01 -0.48 -0.03 0.00 0.13 0.00 0.00 42.46 42.10 2kfb s ILE 103 CO -0.00 -0.06 -0.13 -0.70 -1.91 0.00 0.00 174.94 172.14 2kfb s GLU 104 N -0.14 2.45 0.09 3.50 2.12 -1.26 -1.01 118.70 124.45 2kfb s GLU 104 Ca -0.03 -0.75 0.06 0.00 0.36 0.00 0.00 54.97 54.61 2kfb s GLU 104 Cb -0.03 -2.38 -0.03 0.00 0.26 0.00 0.00 34.13 31.94 2kfb s GLU 104 CO 0.01 0.61 -0.15 -0.06 -0.54 0.00 0.00 175.26 175.13 2kfb s PHE 105 N -0.83 1.37 0.00 5.30 0.08 -0.60 -5.01 117.98 118.28 2kfb s PHE 105 Ca 0.13 -0.49 0.00 0.00 0.12 0.00 0.00 56.93 56.70 2kfb s PHE 105 Cb -0.11 -0.75 0.00 0.00 -0.57 0.00 0.00 43.02 41.59 2kfb s PHE 105 CO 0.03 0.11 0.76 0.25 -0.10 0.00 0.00 175.22 176.27 2kfb n THR 106 N 0.98 0.00 -2.91 0.64 -2.24 -1.26 -2.52 114.28 106.96 2kfb n THR 106 Ca -0.19 0.00 -0.01 0.00 -2.27 0.00 0.00 64.05 61.59 2kfb n THR 106 Cb 0.55 0.53 0.01 0.00 -2.10 0.00 0.00 70.33 69.32 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 0.63 0.00 -0.78 -1.05 -1.26 -4.83 118.70 111.40 2kfb s GLU 107 Ca 0.00 -0.39 0.00 0.00 -0.15 0.00 0.00 54.97 54.43 2kfb s GLU 107 Cb 0.00 0.03 0.00 0.00 -0.44 0.00 0.00 34.13 33.72 2kfb s GLU 107 CO 0.00 -0.85 0.00 -3.47 0.95 0.00 0.00 175.26 171.89 2kfb n ASP 108 N 3.62 0.00 -3.55 0.83 2.03 -1.26 -4.93 116.55 113.28 2kfb n ASP 108 Ca 0.11 0.00 -0.26 0.00 0.52 0.00 0.00 54.79 55.16 2kfb n ASP 108 Cb 0.60 0.00 -0.15 0.00 -0.72 0.00 0.00 41.12 40.84 2kfb n ASP 108 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2kfb h SER 110 N 8.39 0.19 -2.84 0.00 0.02 -1.92 -2.42 113.55 114.97 2kfb h SER 110 Ca -0.17 -0.04 -0.59 0.00 -0.84 0.00 0.00 61.79 60.15 2kfb h SER 110 Cb 1.08 -0.05 -0.39 0.00 0.14 0.00 0.00 62.40 63.18 2kfb h SER 110 CO 0.36 0.37 -0.82 0.00 -1.14 0.00 0.00 176.83 175.60 2kfb h LEU 112 N 6.96 0.81 0.00 0.00 5.85 -1.59 -2.62 115.31 124.72 2kfb h LEU 112 Ca 0.04 -0.11 0.00 0.00 0.84 0.00 0.00 57.88 58.64 2kfb h LEU 112 Cb 0.96 -0.21 0.00 0.00 0.37 0.00 0.00 40.66 41.78 2kfb h LEU 112 CO 0.32 0.69 0.41 0.00 -0.34 0.00 0.00 178.44 179.53 2kfb n GLN 113 N -4.52 0.00 0.04 1.25 3.00 -1.26 0.31 117.38 116.20 2kfb n GLN 113 Ca 0.04 0.07 0.10 0.00 -0.01 0.00 0.00 57.00 57.20 2kfb n GLN 113 Cb 0.11 -1.91 -0.10 0.00 0.00 0.00 0.00 30.24 28.34 2kfb n GLN 113 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.06 176.81 2kfb n ASP 114 N -1.06 0.40 -0.06 1.08 8.00 -0.99 -4.52 116.55 119.41 2kfb n ASP 114 Ca 0.00 0.16 -0.07 0.00 0.71 0.00 0.00 54.79 55.59 2kfb n ASP 114 Cb 0.41 1.20 -0.07 0.00 -0.02 0.00 0.00 41.12 42.65 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 -2.49 1.19 -5.16 -1.24 5.12 0.92 -5.01 116.66 109.98 2kfb n ARG 115 Ca -0.04 0.04 -0.30 0.00 -1.93 0.00 0.00 57.85 55.62 2kfb n ARG 115 Cb 0.61 -1.26 -0.16 0.00 -1.16 0.00 0.00 32.46 30.48 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 -2.25 2.19 0.00 -1.55 -0.71 -0.07 -5.07 117.98 110.51 2kfb s PHE 116 Ca -0.12 -0.55 0.00 0.00 -1.04 0.00 0.00 56.93 55.21 2kfb s PHE 116 Cb 0.04 -1.43 0.00 0.00 -1.21 0.00 0.00 43.02 40.42 2kfb s PHE 116 CO 0.35 -0.13 0.23 0.54 -1.34 0.00 0.00 175.22 174.86 2kfb n ARG 117 N 2.79 0.00 -0.86 1.99 1.74 -1.26 -4.18 116.66 116.89 2kfb n ARG 117 Ca -0.17 0.47 -0.28 0.00 -0.77 0.00 0.00 57.85 57.10 2kfb n ARG 117 Cb 0.52 -1.09 -0.01 0.00 -1.02 0.00 0.00 32.46 30.87 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 -1.90 -1.17 -0.33 -1.55 3.72 -1.26 -4.85 117.46 110.12 2kfb n PHE 118 Ca 0.00 0.45 0.09 0.00 -0.05 0.00 0.00 57.45 57.94 2kfb n PHE 118 Cb 0.00 -1.18 0.26 0.00 -0.94 0.00 0.00 39.48 37.63 2kfb n PHE 118 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 2kfb n ASN 119 N 1.48 3.64 -3.87 4.37 5.03 -1.26 -4.95 115.26 119.70 2kfb n ASN 119 Ca 0.08 -2.05 -0.12 0.00 0.87 0.00 0.00 54.58 53.37 2kfb n ASN 119 Cb 0.24 -0.40 -0.13 0.00 -1.02 0.00 0.00 39.78 38.47 2kfb n ASN 119 CO 0.00 0.00 0.00 -1.61 -1.83 0.00 0.00 177.26 173.82 2kfb s GLU 120 N -1.09 0.10 -0.19 3.52 2.02 -1.26 -2.58 118.70 119.21 2kfb s GLU 120 Ca 0.40 -0.05 0.01 0.00 0.02 0.00 0.00 54.97 55.35 2kfb s GLU 120 Cb 0.21 0.04 0.04 0.00 0.10 0.00 0.00 34.13 34.52 2kfb s GLU 120 CO 0.26 -0.02 -0.14 0.42 0.02 0.00 0.00 175.26 175.81 2kfb s ILE 121 N -0.23 1.80 -0.36 -1.63 -1.09 -1.13 -4.73 121.20 113.84 2kfb s ILE 121 Ca -0.03 -1.00 0.07 0.00 -2.23 0.00 0.00 60.65 57.46 2kfb s ILE 121 Cb -0.02 -1.78 0.54 0.00 -1.58 0.00 0.00 42.46 39.62 2kfb s ILE 121 CO -0.00 0.29 1.60 1.41 -1.23 0.00 0.00 174.94 177.01 2kfb n HIS 122 N 4.65 1.80 0.00 3.97 8.25 -0.80 -4.70 115.22 128.39 2kfb n HIS 122 Ca -0.17 -1.80 0.00 0.00 -0.26 0.00 0.00 57.72 55.50 2kfb n HIS 122 Cb 0.47 -0.66 0.00 0.00 1.12 0.00 0.00 29.99 30.93 2kfb n HIS 122 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 2kfb n SER 123 N -1.10 0.00 -3.47 0.41 2.88 -1.20 -3.19 113.62 107.95 2kfb n SER 123 Ca 0.42 0.00 -0.14 0.00 -1.33 0.00 0.00 58.87 57.82 2kfb n SER 123 Cb 1.17 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 64.59 2kfb n SER 123 CO 0.00 0.00 0.00 -1.48 -1.23 0.00 0.00 175.04 172.33 2kfb s LEU 124 N 0.00 -0.55 -0.25 2.46 0.05 -0.88 0.13 118.68 119.63 2kfb s LEU 124 Ca 0.00 0.26 0.01 0.00 0.05 0.00 0.00 54.13 54.45 2kfb s LEU 124 Cb 0.00 2.53 0.07 0.00 -2.05 0.00 0.00 46.19 46.74 2kfb s LEU 124 CO 0.00 -0.82 -0.01 0.21 -0.55 0.00 0.00 176.35 175.18 2kfb s ASN 125 N -2.14 3.90 -0.40 1.48 3.04 0.19 -1.22 114.94 119.80 2kfb s ASN 125 Ca -0.04 -1.33 -0.11 0.00 0.04 0.00 0.00 52.86 51.42 2kfb s ASN 125 Cb -0.01 -1.12 0.05 0.00 -1.54 0.00 0.00 41.25 38.63 2kfb s ASN 125 CO -0.04 -0.29 0.24 0.54 -3.04 0.00 0.00 177.10 174.51 2kfb s VAL 126 N 1.42 4.55 0.12 -5.21 0.11 -1.10 0.00 120.40 120.29 2kfb s VAL 126 Ca -0.01 -1.03 0.00 0.00 -2.93 0.00 0.00 61.98 58.01 2kfb s VAL 126 Cb -0.18 -3.63 -0.22 0.00 -1.53 0.00 0.00 36.38 30.82 2kfb s VAL 126 CO -0.10 -0.35 1.26 -0.07 -3.33 0.00 0.00 175.10 172.52 2kfb h LEU 127 N 8.46 0.29 -8.01 2.54 -0.00 -1.72 -2.49 115.31 114.38 2kfb h LEU 127 Ca -0.25 -0.28 -0.09 0.00 -0.00 0.00 0.00 57.88 57.26 2kfb h LEU 127 Cb 1.10 -0.09 -0.12 0.00 -0.00 0.00 0.00 40.66 41.54 2kfb h LEU 127 CO 0.71 1.16 -0.28 -1.83 -0.00 0.00 0.00 178.44 178.20 2kfb s GLU 128 N -2.89 1.16 0.40 1.13 -1.05 -1.22 -4.85 118.70 111.38 2kfb s GLU 128 Ca -0.03 -1.11 0.00 0.00 -0.15 0.00 0.00 54.97 53.68 2kfb s GLU 128 Cb 0.09 0.39 0.00 0.00 -0.44 0.00 0.00 34.13 34.17 2kfb s GLU 128 CO 0.85 -0.43 0.00 0.41 0.95 0.00 0.00 175.26 177.04 2kfb n GLY 129 N -0.22 -2.12 3.48 -3.83 0.00 -1.19 -3.57 105.19 97.74 2kfb n GLY 129 Ca -0.08 -0.86 -0.30 0.00 0.00 0.00 0.00 46.02 44.77 2kfb n GLY 129 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2kfb s SER 130 N -6.40 3.91 0.29 1.61 0.15 -1.26 -4.18 113.70 107.82 2kfb s SER 130 Ca 0.00 -0.44 0.11 0.00 0.70 0.00 0.00 55.95 56.32 2kfb s SER 130 Cb 0.00 -0.63 -0.05 0.00 -1.71 0.00 0.00 66.02 63.62 2kfb s SER 130 CO 0.00 0.23 -0.17 0.26 1.20 0.00 0.00 173.24 174.76 2kfb s TRP 131 N -1.01 2.25 -0.31 3.44 0.52 -0.94 -0.68 118.94 122.20 2kfb s TRP 131 Ca 0.16 -0.40 -0.02 0.00 0.02 0.00 0.00 56.10 55.86 2kfb s TRP 131 Cb -0.11 -1.06 0.11 0.00 -1.15 0.00 0.00 33.47 31.26 2kfb s TRP 131 CO 0.07 0.64 0.13 0.08 0.02 0.00 0.00 176.95 177.90 2kfb s VAL 132 N -2.59 0.45 0.28 4.03 1.01 0.59 -0.34 120.40 123.82 2kfb s VAL 132 Ca 0.30 -1.23 -0.29 0.00 0.00 0.00 0.00 61.98 60.76 2kfb s VAL 132 Cb -0.03 -1.35 -0.10 0.00 0.00 0.00 0.00 36.38 34.90 2kfb s VAL 132 CO 0.14 -0.74 1.25 -0.76 0.00 0.00 0.00 175.10 174.99 2kfb s LEU 133 N 1.70 4.46 -0.08 3.92 1.02 -0.62 -2.65 118.68 126.42 2kfb s LEU 133 Ca 0.11 2.49 0.04 0.00 0.02 0.00 0.00 54.13 56.79 2kfb s LEU 133 Cb -0.18 -3.63 -0.01 0.00 0.02 0.00 0.00 46.19 42.39 2kfb s LEU 133 CO -0.26 -0.42 -0.21 -0.31 0.02 0.00 0.00 176.35 175.16 2kfb s TYR 134 N -0.81 2.57 0.21 0.29 1.51 -1.04 -0.93 117.35 119.13 2kfb s TYR 134 Ca 0.50 -0.74 -0.22 0.00 -1.01 0.00 0.00 57.07 55.60 2kfb s TYR 134 Cb -0.37 -1.68 0.13 0.00 -0.11 0.00 0.00 41.96 39.94 2kfb s TYR 134 CO 0.46 -0.23 1.54 -1.91 -1.11 0.00 0.00 175.55 174.30 2kfb n GLU 135 N 3.14 -0.30 -4.54 -0.62 4.07 -1.09 -0.51 120.64 120.78 2kfb n GLU 135 Ca -0.18 1.52 -0.25 0.00 -0.06 0.00 0.00 57.16 58.19 2kfb n GLU 135 Cb 0.52 -2.26 -0.11 0.00 -0.06 0.00 0.00 31.44 29.54 2kfb n GLU 135 CO 0.00 0.00 0.00 -0.48 -0.06 0.00 0.00 177.13 176.59 2kfb s LEU 136 N -10.79 2.52 0.90 4.31 0.05 -1.26 -1.64 118.68 112.78 2kfb s LEU 136 Ca -0.13 -1.39 -0.12 0.00 0.05 0.00 0.00 54.13 52.54 2kfb s LEU 136 Cb 0.17 -0.64 0.13 0.00 -2.05 0.00 0.00 46.19 43.80 2kfb s LEU 136 CO 0.68 -0.55 1.13 -0.94 -0.55 0.00 0.00 176.35 176.12 2kfb s SER 137 N -3.61 3.61 -1.03 1.48 1.04 -1.26 -3.73 113.70 110.20 2kfb s SER 137 Ca 0.35 1.03 0.00 0.00 0.48 0.00 0.00 55.95 57.80 2kfb s SER 137 Cb 0.09 -1.63 0.00 0.00 0.10 0.00 0.00 66.02 64.58 2kfb s SER 137 CO 0.16 -2.49 0.00 -3.20 0.98 0.00 0.00 173.24 168.69 2kfb n ASN 138 N -3.74 -4.70 -3.28 7.02 5.15 -1.03 -4.04 115.26 110.65 2kfb n ASN 138 Ca 0.07 0.24 -0.36 0.00 -0.60 0.00 0.00 54.58 53.93 2kfb n ASN 138 Cb 0.59 -3.05 0.04 0.00 -0.53 0.00 0.00 39.78 36.82 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 -2.54 -2.41 -2.75 1.20 4.01 -1.24 -4.93 117.16 108.49 2kfb n TYR 139 Ca -0.10 1.01 -0.01 0.00 -0.16 0.00 0.00 57.90 58.65 2kfb n TYR 139 Cb 0.41 -1.57 0.08 0.00 -0.31 0.00 0.00 39.34 37.95 2kfb n TYR 139 CO 0.00 0.00 0.00 -2.13 -0.46 0.00 0.00 176.86 174.27 2kfb n ARG 140 N -0.15 1.54 0.00 -0.72 3.00 -1.26 -5.10 116.66 113.97 2kfb n ARG 140 Ca -0.08 -2.46 0.00 0.00 -0.00 0.00 0.00 57.85 55.31 2kfb n ARG 140 Cb 0.62 -0.68 0.00 0.00 0.00 0.00 0.00 32.46 32.41 2kfb n ARG 140 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2kfb n GLY 141 N -1.00 4.34 3.92 5.14 0.00 -1.26 -4.92 105.19 111.40 2kfb n GLY 141 Ca -0.04 -0.41 -0.29 0.00 0.00 0.00 0.00 46.02 45.28 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 4.63 1.64 -0.13 1.61 0.52 -1.26 -4.85 118.95 121.10 2kfb s ARG 142 Ca 0.00 -0.12 -0.10 0.00 -0.52 0.00 0.00 55.73 54.99 2kfb s ARG 142 Cb 0.00 -1.97 0.04 0.00 0.52 0.00 0.00 34.95 33.54 2kfb s ARG 142 CO 0.00 -1.75 0.34 1.14 0.02 0.00 0.00 175.30 175.04 2kfb s GLN 143 N -5.60 0.35 -0.11 3.54 -2.07 -1.26 -2.67 119.66 111.84 2kfb s GLN 143 Ca 0.65 0.57 -0.01 0.00 -1.82 0.00 0.00 55.36 54.76 2kfb s GLN 143 Cb -0.09 0.06 0.03 0.00 -1.09 0.00 0.00 33.01 31.91 2kfb s GLN 143 CO 0.49 -0.11 -0.07 0.71 -1.32 0.00 0.00 175.29 175.00 2kfb s TYR 144 N 0.78 1.41 0.03 9.60 2.02 -0.11 -4.65 117.35 126.43 2kfb s TYR 144 Ca -0.05 -0.69 -0.30 0.00 -0.37 0.00 0.00 57.07 55.66 2kfb s TYR 144 Cb -0.06 -1.20 -0.04 0.00 -0.40 0.00 0.00 41.96 40.27 2kfb s TYR 144 CO -0.05 -0.50 0.98 -1.17 -1.57 0.00 0.00 175.55 173.23 2kfb s LEU 145 N 1.73 4.40 -0.32 -1.29 2.96 -1.26 -1.59 118.68 123.31 2kfb s LEU 145 Ca 0.05 1.70 0.01 0.00 -0.22 0.00 0.00 54.13 55.67 2kfb s LEU 145 Cb -0.12 -3.58 0.08 0.00 0.50 0.00 0.00 46.19 43.07 2kfb s LEU 145 CO -0.08 -0.21 0.03 -0.76 -1.32 0.00 0.00 176.35 174.01 2kfb s LEU 146 N 0.74 4.32 0.65 -0.68 1.43 0.53 -4.93 118.68 120.74 2kfb s LEU 146 Ca 0.51 -1.72 -0.11 0.00 -1.03 0.00 0.00 54.13 51.78 2kfb s LEU 146 Cb -0.22 -1.67 -0.02 0.00 0.03 0.00 0.00 46.19 44.31 2kfb s LEU 146 CO 0.29 -0.33 1.04 -0.04 0.23 0.00 0.00 176.35 177.53 2kfb s MET 147 N 1.09 3.31 -0.17 1.70 -1.94 -1.26 -2.22 119.30 119.80 2kfb s MET 147 Ca 0.01 0.87 -0.32 0.00 -1.71 0.00 0.00 55.69 54.54 2kfb s MET 147 Cb -0.20 -2.04 -0.09 0.00 2.01 0.00 0.00 34.83 34.51 2kfb s MET 147 CO -0.05 -0.80 2.07 -0.35 -0.01 0.00 0.00 175.02 175.88 2kfb n PRO 148 N -2.84 1.98 -1.61 2.03 -0.04 -1.26 -4.78 135.00 128.47 2kfb n PRO 148 Ca 0.07 0.65 0.00 0.00 -0.04 0.00 0.00 63.50 64.17 2kfb n PRO 148 Cb 0.54 -2.85 0.00 0.00 -0.04 0.00 0.00 33.50 31.15 2kfb n PRO 148 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2kfb n GLY 149 N 5.30 -0.64 3.25 0.55 0.00 -0.94 -5.06 105.19 107.65 2kfb n GLY 149 Ca 0.28 -0.55 -0.30 0.00 0.00 0.00 0.00 46.02 45.46 2kfb n GLY 149 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2kfb s ASP 150 N -4.00 2.88 -0.09 1.61 -4.77 -1.26 -2.70 116.67 108.34 2kfb s ASP 150 Ca 0.00 -0.47 0.02 0.00 -3.30 0.00 0.00 52.55 48.79 2kfb s ASP 150 Cb 0.00 -0.71 0.02 0.00 -1.09 0.00 0.00 42.92 41.13 2kfb s ASP 150 CO 0.00 0.24 -0.13 -0.31 0.70 0.00 0.00 175.17 175.67 2kfb s TYR 151 N -0.20 1.69 -0.37 2.11 1.51 -0.36 -4.99 117.35 116.74 2kfb s TYR 151 Ca -0.01 -0.73 0.03 0.00 -1.01 0.00 0.00 57.07 55.35 2kfb s TYR 151 Cb -0.13 -1.25 0.05 0.00 -0.11 0.00 0.00 41.96 40.53 2kfb s TYR 151 CO 0.03 -0.39 0.78 2.89 -1.11 0.00 0.00 175.55 177.74 2kfb n ARG 152 N 4.12 0.75 -3.47 -0.62 1.85 -1.26 -2.08 116.66 115.95 2kfb n ARG 152 Ca -0.20 -1.05 -0.10 0.00 -1.00 0.00 0.00 57.85 55.49 2kfb n ARG 152 Cb 0.51 -1.07 -0.02 0.00 -1.05 0.00 0.00 32.46 30.83 2kfb n ARG 152 CO 0.00 0.00 0.00 -0.98 -0.01 0.00 0.00 177.63 176.64 2kfb s ARG 153 N -0.54 1.16 0.40 2.89 1.70 -1.19 -1.51 118.95 121.85 2kfb s ARG 153 Ca 0.05 -0.45 0.27 0.00 -0.47 0.00 0.00 55.73 55.14 2kfb s ARG 153 Cb 0.03 0.52 0.90 0.00 -0.57 0.00 0.00 34.95 35.84 2kfb s ARG 153 CO 0.04 -0.51 1.79 0.10 -1.08 0.00 0.00 175.30 175.64 2kfb h TYR 154 N 2.00 0.00 0.00 5.89 -0.00 -1.84 -3.10 116.97 119.92 2kfb h TYR 154 Ca -0.29 0.00 -0.00 0.00 -0.00 0.00 0.00 58.73 58.43 2kfb h TYR 154 Cb 1.28 0.00 -0.00 0.00 -0.00 0.00 0.00 36.73 38.01 2kfb h TYR 154 CO 0.25 0.00 -0.02 1.96 -0.00 0.00 0.00 178.16 180.35 2kfb h GLN 155 N 0.00 0.00 -0.51 0.10 4.20 -1.94 -2.79 115.11 114.17 2kfb h GLN 155 Ca 0.00 0.00 0.10 0.00 0.06 0.00 0.00 58.65 58.81 2kfb h GLN 155 Cb 0.66 0.00 -0.09 0.00 0.30 0.00 0.00 27.48 28.35 2kfb h GLN 155 CO 0.00 0.02 -0.08 0.22 -0.67 0.00 0.00 178.83 178.32 2kfb h ASP 156 N 0.00 -0.38 -0.55 1.46 1.82 -1.97 0.30 116.42 117.10 2kfb h ASP 156 Ca -0.00 0.14 0.00 0.00 -0.39 0.00 0.00 57.03 56.78 2kfb h ASP 156 Cb 0.33 0.28 0.00 0.00 0.68 0.00 0.00 39.33 40.62 2kfb h ASP 156 CO 0.00 -0.14 0.00 -2.67 -1.61 0.00 0.00 179.24 174.82 2kfb n TRP 157 N -5.32 1.86 -3.20 0.28 2.14 -1.18 -4.98 117.44 107.05 2kfb n TRP 157 Ca 0.05 -0.73 -0.14 0.00 2.07 0.00 0.00 57.50 58.75 2kfb n TRP 157 Cb 0.28 -0.45 0.01 0.00 -0.81 0.00 0.00 31.31 30.33 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 0.55 -1.02 0.46 -1.67 0.00 0.10 -4.98 105.19 98.62 2kfb n GLY 158 Ca 0.27 0.89 -0.03 0.00 0.00 0.00 0.00 46.02 47.15 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 -1.14 0.07 0.00 4.61 0.00 -1.06 -5.01 120.51 117.97 2kfb n ALA 159 Ca -0.03 -0.24 0.00 0.00 0.00 0.00 0.00 53.44 53.17 2kfb n ALA 159 Cb 0.55 0.05 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 0.25 0.00 0.00 0.00 177.50 177.75 2kfb n THR 160 N -1.39 0.00 -0.05 0.00 -2.24 -1.26 -4.94 114.28 104.39 2kfb n THR 160 Ca 0.02 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.80 2kfb n THR 160 Cb 0.07 -0.55 0.00 0.00 -2.10 0.00 0.00 70.33 67.75 2kfb n THR 160 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 2kfb n ASN 161 N -2.48 0.00 0.00 3.42 5.15 -1.26 -5.02 115.26 115.07 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 0.47 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.72 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 -1.67 5.20 0.00 -1.26 -4.87 120.51 117.91 2kfb n ALA 162 Ca 0.00 0.00 -0.60 0.00 0.00 0.00 0.00 53.44 52.84 2kfb n ALA 162 Cb 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.37 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 -1.75 0.62 -4.43 0.00 1.85 -1.26 -2.83 116.66 108.86 2kfb n ARG 163 Ca 0.00 0.23 -0.26 0.00 -1.00 0.00 0.00 57.85 56.82 2kfb n ARG 163 Cb 0.00 -1.82 -0.11 0.00 -1.05 0.00 0.00 32.46 29.48 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 2.23 2.46 0.00 8.89 1.01 -1.07 -4.61 120.40 129.32 2kfb s VAL 164 Ca 0.97 -2.12 0.00 0.00 0.00 0.00 0.00 61.98 60.82 2kfb s VAL 164 Cb -1.21 -2.22 0.00 0.00 0.00 0.00 0.00 36.38 32.95 2kfb s VAL 164 CO 0.66 -0.21 0.00 0.61 0.00 0.00 0.00 175.10 176.16 2kfb n GLY 165 N -0.04 0.00 0.00 4.51 0.00 0.34 -4.77 105.19 105.23 2kfb n GLY 165 Ca -0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.92 2kfb n GLY 165 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2kfb n SER 166 N -1.71 0.00 -3.65 1.61 3.41 -1.08 -2.14 113.62 110.07 2kfb n SER 166 Ca 0.00 -0.77 -0.04 0.00 -0.26 0.00 0.00 58.87 57.80 2kfb n SER 166 Cb 0.30 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.18 2kfb n SER 166 CO 0.00 0.00 0.00 -1.48 -0.16 0.00 0.00 175.04 173.40 2kfb s LEU 167 N 0.00 -0.22 0.07 1.04 0.05 -0.91 -2.50 118.68 116.21 2kfb s LEU 167 Ca 0.00 0.41 0.04 0.00 0.05 0.00 0.00 54.13 54.63 2kfb s LEU 167 Cb 0.00 1.40 -0.03 0.00 -2.05 0.00 0.00 46.19 45.51 2kfb s LEU 167 CO 0.00 -0.07 -0.13 0.00 -0.55 0.00 0.00 176.35 175.61 2kfb s ARG 168 N 0.42 0.75 0.46 1.48 1.70 -1.09 -0.10 118.95 122.58 2kfb s ARG 168 Ca 0.02 -0.92 -0.16 0.00 -0.47 0.00 0.00 55.73 54.19 2kfb s ARG 168 Cb -0.04 -0.70 -0.08 0.00 -0.57 0.00 0.00 34.95 33.55 2kfb s ARG 168 CO -0.12 0.15 0.92 1.03 -1.08 0.00 0.00 175.30 176.20 2kfb s ARG 169 N -1.74 3.98 -1.00 3.89 0.52 -1.26 -0.30 118.95 123.04 2kfb s ARG 169 Ca -0.04 0.89 -0.19 0.00 -0.52 0.00 0.00 55.73 55.87 2kfb s ARG 169 Cb -0.10 -2.21 0.12 0.00 0.52 0.00 0.00 34.95 33.28 2kfb s ARG 169 CO 0.02 -0.15 1.24 0.08 0.02 0.00 0.00 175.30 176.51 2kfb s VAL 170 N -2.44 4.63 -0.02 3.52 1.01 0.15 -4.89 120.40 122.35 2kfb s VAL 170 Ca 0.58 -1.63 0.01 0.00 0.00 0.00 0.00 61.98 60.94 2kfb s VAL 170 Cb -0.10 -4.86 0.01 0.00 0.00 0.00 0.00 36.38 31.44 2kfb s VAL 170 CO 0.26 -1.61 -0.01 -0.63 0.00 0.00 0.00 175.10 173.11 2kfb s ILE 171 N 2.92 0.21 -1.42 2.22 1.09 -1.26 -4.59 121.20 120.36 2kfb s ILE 171 Ca 0.37 -0.01 0.18 0.00 -1.10 0.00 0.00 60.65 60.09 2kfb s ILE 171 Cb -0.03 -0.24 -0.06 0.00 -1.06 0.00 0.00 42.46 41.06 2kfb s ILE 171 CO -0.08 0.11 0.88 -0.90 -0.10 0.00 0.00 174.94 174.85 2kfb n ASP 172 N 3.62 1.48 -0.04 3.58 5.75 -1.26 -4.63 116.55 125.06 2kfb n ASP 172 Ca -0.21 -1.24 -0.03 0.00 -0.01 0.00 0.00 54.79 53.30 2kfb n ASP 172 Cb 0.54 0.64 -0.01 0.00 -1.03 0.00 0.00 41.12 41.26 2kfb n ASP 172 CO 0.00 0.00 0.00 0.33 -0.11 0.00 0.00 177.20 177.42 2kfb n PHE 173 N -0.49 0.18 0.00 2.11 7.35 -1.26 -4.89 117.46 120.45 2kfb n PHE 173 Ca 0.06 0.08 0.00 0.00 -0.76 0.00 0.00 57.45 56.83 2kfb n PHE 173 Cb 0.35 -0.34 0.00 0.00 0.35 0.00 0.00 39.48 39.84 2kfb n PHE 173 CO 0.00 0.00 0.00 0.43 -0.76 0.00 0.00 176.76 176.43