#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 1.81 -0.30 1.08 0.00 -1.26 -4.58 107.32 104.07 2kfb s GLY 2 Ca 0.00 -1.52 -0.13 0.00 0.00 0.00 0.00 44.72 43.07 2kfb s GLY 2 CO 0.00 -1.15 1.02 1.25 0.00 0.00 0.00 173.10 174.22 2kfb s LYS 3 N -4.84 0.23 0.46 2.90 2.20 -1.00 -4.66 119.74 115.02 2kfb s LYS 3 Ca 0.60 0.45 0.04 0.00 -0.36 0.00 0.00 55.97 56.71 2kfb s LYS 3 Cb -0.09 0.26 -0.05 0.00 -1.51 0.00 0.00 37.83 36.44 2kfb s LYS 3 CO 0.40 -0.20 0.01 0.96 -0.36 0.00 0.00 175.35 176.15 2kfb s ILE 4 N 2.79 1.60 -0.10 5.43 -0.00 -1.11 -1.42 121.20 128.39 2kfb s ILE 4 Ca 0.00 -2.00 -0.01 0.00 -0.00 0.00 0.00 60.65 58.65 2kfb s ILE 4 Cb -0.09 -2.61 0.03 0.00 -0.00 0.00 0.00 42.46 39.78 2kfb s ILE 4 CO -0.13 0.00 -0.05 -0.89 -0.00 0.00 0.00 174.94 173.86 2kfb s THR 5 N -2.79 0.83 -0.15 8.37 2.01 0.17 -2.44 115.64 121.63 2kfb s THR 5 Ca 0.21 -0.17 -0.06 0.00 0.31 0.00 0.00 61.69 61.99 2kfb s THR 5 Cb 0.06 -0.88 -0.04 0.00 0.01 0.00 0.00 72.50 71.65 2kfb s THR 5 CO 0.11 0.33 0.04 -0.76 -0.69 0.00 0.00 174.62 173.65 2kfb s LEU 6 N 1.73 3.70 -0.13 4.42 1.43 0.35 -0.71 118.68 129.47 2kfb s LEU 6 Ca 0.04 0.08 0.00 0.00 -1.03 0.00 0.00 54.13 53.22 2kfb s LEU 6 Cb -0.13 -1.91 -0.01 0.00 0.03 0.00 0.00 46.19 44.17 2kfb s LEU 6 CO -0.07 0.23 -0.14 -0.31 0.23 0.00 0.00 176.35 176.29 2kfb s TYR 7 N 0.02 2.78 0.57 0.29 1.51 -1.05 -0.53 117.35 120.94 2kfb s TYR 7 Ca 0.04 -0.73 0.27 0.00 -1.01 0.00 0.00 57.07 55.65 2kfb s TYR 7 Cb -0.12 -1.84 1.55 0.00 -0.11 0.00 0.00 41.96 41.43 2kfb s TYR 7 CO 0.01 -0.26 2.03 1.49 -1.11 0.00 0.00 175.55 177.71 2kfb h GLU 8 N 6.78 0.00 -6.23 -0.62 4.81 -0.39 -3.05 114.58 115.88 2kfb h GLU 8 Ca -0.26 0.00 -0.58 0.00 -0.13 0.00 0.00 59.36 58.39 2kfb h GLU 8 Cb 1.21 0.00 -0.18 0.00 0.63 0.00 0.00 28.75 30.41 2kfb h GLU 8 CO 0.55 0.00 -0.80 -0.51 -0.73 0.00 0.00 179.01 177.52 2kfb s ASP 9 N -5.79 3.01 1.11 1.04 1.01 -1.24 -4.04 116.67 111.77 2kfb s ASP 9 Ca -0.05 -0.86 -0.09 0.00 0.71 0.00 0.00 52.55 52.26 2kfb s ASP 9 Cb 0.16 -0.20 0.14 0.00 1.01 0.00 0.00 42.92 44.03 2kfb s ASP 9 CO 0.59 0.03 0.32 -2.11 0.21 0.00 0.00 175.17 174.21 2kfb n ARG 10 N 0.29 -2.73 -2.10 8.23 1.85 -1.26 -2.44 116.66 118.50 2kfb n ARG 10 Ca -0.13 -0.53 -0.03 0.00 -1.00 0.00 0.00 57.85 56.16 2kfb n ARG 10 Cb 0.57 -0.73 -0.00 0.00 -1.05 0.00 0.00 32.46 31.25 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 -2.02 -0.29 3.50 2.89 0.00 -0.95 -1.08 105.19 107.24 2kfb n GLY 11 Ca 0.05 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.90 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 -2.27 -2.35 -3.02 1.61 3.72 -1.22 -5.00 117.46 108.93 2kfb n PHE 12 Ca -0.03 0.85 0.00 0.00 -0.05 0.00 0.00 57.45 58.22 2kfb n PHE 12 Cb 0.40 -3.43 0.00 0.00 -0.94 0.00 0.00 39.48 35.52 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 -2.72 2.54 0.00 -1.08 6.02 -0.24 -5.04 117.38 116.87 2kfb n GLN 13 Ca -0.15 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.84 2kfb n GLN 13 Cb 0.60 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.86 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 3.20 0.94 3.79 1.08 0.00 -1.26 -3.63 105.19 109.31 2kfb n GLY 14 Ca 0.00 -0.57 -0.35 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 3.61 0.03 1.61 0.52 -1.26 -4.81 118.95 118.65 2kfb s ARG 15 Ca 0.00 1.49 0.01 0.00 -0.52 0.00 0.00 55.73 56.71 2kfb s ARG 15 Cb 0.00 -2.07 -0.02 0.00 0.52 0.00 0.00 34.95 33.38 2kfb s ARG 15 CO 0.00 -0.61 -0.06 -3.38 0.02 0.00 0.00 175.30 171.27 2kfb s HIS 16 N -1.87 0.49 -0.02 -0.53 -3.43 -1.26 0.18 115.29 108.85 2kfb s HIS 16 Ca 0.69 -0.46 -0.02 0.00 -0.80 0.00 0.00 55.06 54.47 2kfb s HIS 16 Cb -0.20 -0.31 0.00 0.00 -1.43 0.00 0.00 32.58 30.64 2kfb s HIS 16 CO 0.24 -0.11 0.06 -0.47 -2.00 0.00 0.00 174.74 172.46 2kfb s TYR 17 N -1.25 -0.02 -0.21 0.38 5.04 0.31 -4.99 117.35 116.61 2kfb s TYR 17 Ca -0.11 0.06 -0.04 0.00 -2.44 0.00 0.00 57.07 54.54 2kfb s TYR 17 Cb -0.09 -0.01 -0.01 0.00 0.35 0.00 0.00 41.96 42.20 2kfb s TYR 17 CO -0.00 -0.08 -0.03 -2.00 -1.34 0.00 0.00 175.55 172.10 2kfb s GLU 18 N -0.29 3.47 -0.18 4.97 2.12 -1.26 -0.49 118.70 127.04 2kfb s GLU 18 Ca -0.03 -0.59 -0.03 0.00 0.36 0.00 0.00 54.97 54.67 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 0.00 -0.09 -0.04 0.00 -0.54 0.00 0.00 175.26 174.59 2kfb n SER 20 N 3.97 2.18 -3.88 0.00 3.41 -1.26 -2.76 113.62 115.28 2kfb n SER 20 Ca -0.18 -2.16 -0.08 0.00 -0.26 0.00 0.00 58.87 56.19 2kfb n SER 20 Cb 0.52 -0.09 -0.04 0.00 -0.26 0.00 0.00 64.21 64.34 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 -1.26 -0.20 0.35 4.04 1.04 -1.26 -4.80 113.70 111.61 2kfb s SER 21 Ca 0.07 -0.69 -0.29 0.00 0.48 0.00 0.00 55.95 55.52 2kfb s SER 21 Cb 0.06 0.64 -0.11 0.00 0.10 0.00 0.00 66.02 66.71 2kfb s SER 21 CO 0.02 -1.21 1.51 0.47 0.98 0.00 0.00 173.24 175.01 2kfb n ASP 22 N -0.41 3.76 -4.04 7.02 8.00 -1.26 -4.59 116.55 125.04 2kfb n ASP 22 Ca -0.04 1.20 -0.17 0.00 0.71 0.00 0.00 54.79 56.49 2kfb n ASP 22 Cb 0.61 -1.61 -0.13 0.00 -0.02 0.00 0.00 41.12 39.97 2kfb n ASP 22 CO 0.00 0.00 0.00 -1.00 -0.39 0.00 0.00 177.20 175.81 2kfb s HIS 23 N -0.78 0.75 -0.07 1.24 3.76 0.95 -4.97 115.29 116.17 2kfb s HIS 23 Ca 0.57 -0.26 0.09 0.00 -0.15 0.00 0.00 55.06 55.31 2kfb s HIS 23 Cb -0.49 -0.47 -0.14 0.00 1.11 0.00 0.00 32.58 32.60 2kfb s HIS 23 CO 0.59 -0.02 0.23 0.25 -0.85 0.00 0.00 174.74 174.95 2kfb n THR 24 N 2.35 0.00 -3.42 1.30 -2.24 -1.26 -2.40 114.28 108.60 2kfb n THR 24 Ca -0.16 -0.23 -0.14 0.00 -2.27 0.00 0.00 64.05 61.25 2kfb n THR 24 Cb 0.56 0.38 -0.10 0.00 -2.10 0.00 0.00 70.33 69.07 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 -2.92 0.82 0.00 3.42 2.47 -1.25 -1.75 114.94 115.73 2kfb s ASN 25 Ca -0.02 0.00 0.14 0.00 0.42 0.00 0.00 52.86 53.40 2kfb s ASN 25 Cb 0.06 0.74 0.14 0.00 -1.45 0.00 0.00 41.25 40.74 2kfb s ASN 25 CO 0.39 -0.31 0.99 0.18 -3.72 0.00 0.00 177.10 174.63 2kfb n LEU 26 N 5.34 2.29 -0.14 3.21 4.77 0.90 -4.59 117.00 128.78 2kfb n LEU 26 Ca -0.05 -1.10 -0.03 0.00 -0.03 0.00 0.00 56.01 54.80 2kfb n LEU 26 Cb 0.50 -0.03 0.05 0.00 -2.33 0.00 0.00 43.42 41.61 2kfb n LEU 26 CO 0.07 0.44 0.88 1.56 -1.33 0.00 0.00 177.39 179.01 2kfb h GLN 27 N 2.78 0.16 -0.68 3.23 4.20 -1.69 1.14 115.11 124.26 2kfb h GLN 27 Ca 0.00 -0.01 0.08 0.00 0.06 0.00 0.00 58.65 58.78 2kfb h GLN 27 Cb 0.61 -0.04 -0.04 0.00 0.30 0.00 0.00 27.48 28.32 2kfb h GLN 27 CO 0.00 0.11 0.45 -1.00 -0.67 0.00 0.00 178.83 177.71 2kfb h PRO 28 N 0.16 0.59 0.03 1.46 0.13 -1.96 -3.15 132.00 129.27 2kfb h PRO 28 Ca 0.23 -0.04 -0.30 0.00 -0.87 0.00 0.00 66.00 65.02 2kfb h PRO 28 Cb 0.31 -0.13 -0.03 0.00 0.13 0.00 0.00 31.00 31.28 2kfb h PRO 28 CO -0.34 0.39 -1.64 0.66 -0.23 0.00 0.00 178.00 176.84 2kfb n TYR 29 N -4.48 0.95 -5.01 1.56 4.01 -0.63 -4.91 117.16 108.65 2kfb n TYR 29 Ca 0.11 0.33 -0.32 0.00 -0.16 0.00 0.00 57.90 57.86 2kfb n TYR 29 Cb 0.30 -1.11 -0.17 0.00 -0.31 0.00 0.00 39.34 38.06 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 -7.56 2.11 0.10 7.72 1.43 0.39 -4.90 118.68 117.97 2kfb s LEU 30 Ca -0.28 -0.57 0.23 0.00 -1.03 0.00 0.00 54.13 52.48 2kfb s LEU 30 Cb 0.07 -1.43 0.17 0.00 0.03 0.00 0.00 46.19 45.04 2kfb s LEU 30 CO 0.63 0.13 1.16 -0.24 0.23 0.00 0.00 176.35 178.26 2kfb n SER 31 N 3.72 0.67 -3.25 2.29 2.88 -1.26 -3.54 113.62 115.14 2kfb n SER 31 Ca -0.19 0.02 0.03 0.00 -1.33 0.00 0.00 58.87 57.40 2kfb n SER 31 Cb 0.52 0.48 -0.04 0.00 -0.75 0.00 0.00 64.21 64.42 2kfb n SER 31 CO 0.00 0.00 0.00 -0.60 -1.23 0.00 0.00 175.04 173.21 2kfb s ARG 32 N -3.21 0.11 -0.41 -1.46 3.52 -1.26 -5.04 118.95 111.19 2kfb s ARG 32 Ca 0.04 0.28 -0.15 0.00 -0.13 0.00 0.00 55.73 55.77 2kfb s ARG 32 Cb 0.13 0.17 0.02 0.00 -1.56 0.00 0.00 34.95 33.71 2kfb s ARG 32 CO 0.76 -0.04 0.32 0.00 -0.81 0.00 0.00 175.30 175.54 2kfb n ASN 34 N 5.22 2.06 -3.52 0.00 3.02 -1.15 -4.76 115.26 116.13 2kfb n ASN 34 Ca -0.10 -1.53 -0.13 0.00 -0.03 0.00 0.00 54.58 52.78 2kfb n ASN 34 Cb 0.47 0.33 -0.04 0.00 -0.61 0.00 0.00 39.78 39.93 2kfb n ASN 34 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 2kfb s SER 35 N -1.99 -0.49 0.05 6.41 0.15 -1.25 -0.22 113.70 116.35 2kfb s SER 35 Ca 0.18 0.15 -0.18 0.00 0.70 0.00 0.00 55.95 56.80 2kfb s SER 35 Cb 0.16 0.53 0.04 0.00 -1.71 0.00 0.00 66.02 65.03 2kfb s SER 35 CO 0.41 -0.80 0.41 0.00 1.20 0.00 0.00 173.24 174.45 2kfb s ALA 36 N -2.84 -0.99 -0.08 5.45 0.00 0.85 -2.53 121.76 121.63 2kfb s ALA 36 Ca -0.03 0.26 -0.01 0.00 0.00 0.00 0.00 51.96 52.18 2kfb s ALA 36 Cb -0.00 0.39 0.03 0.00 0.00 0.00 0.00 23.12 23.53 2kfb s ALA 36 CO -0.05 -0.48 -0.03 1.03 0.00 0.00 0.00 175.76 176.24 2kfb s ARG 37 N -2.64 0.87 -0.27 0.00 0.52 0.12 0.22 118.95 117.76 2kfb s ARG 37 Ca -0.04 -0.02 -0.07 0.00 -0.52 0.00 0.00 55.73 55.08 2kfb s ARG 37 Cb -0.00 -1.09 -0.01 0.00 0.52 0.00 0.00 34.95 34.37 2kfb s ARG 37 CO -0.04 -0.25 0.08 0.08 0.02 0.00 0.00 175.30 175.19 2kfb s VAL 38 N 1.69 4.14 -0.01 3.52 1.01 0.90 0.43 120.40 132.07 2kfb s VAL 38 Ca 0.02 -0.42 -0.20 0.00 0.00 0.00 0.00 61.98 61.38 2kfb s VAL 38 Cb -0.13 -3.03 -0.30 0.00 0.00 0.00 0.00 36.38 32.92 2kfb s VAL 38 CO -0.05 0.22 0.98 -0.78 0.00 0.00 0.00 175.10 175.47 2kfb h ASP 39 N 8.24 0.58 -4.91 3.32 1.82 -1.50 -0.50 116.42 123.46 2kfb h ASP 39 Ca -0.35 -0.89 0.05 0.00 -0.39 0.00 0.00 57.03 55.45 2kfb h ASP 39 Cb 1.15 -0.18 -0.12 0.00 0.68 0.00 0.00 39.33 40.86 2kfb h ASP 39 CO 0.59 1.42 0.33 -0.55 -1.61 0.00 0.00 179.24 179.42 2kfb s SER 40 N -7.04 -0.43 0.03 2.28 0.15 -1.25 -4.79 113.70 102.64 2kfb s SER 40 Ca -0.12 -0.11 0.00 0.00 0.70 0.00 0.00 55.95 56.42 2kfb s SER 40 Cb 0.02 0.53 0.00 0.00 -1.71 0.00 0.00 66.02 64.87 2kfb s SER 40 CO 0.85 -0.89 0.00 0.61 1.20 0.00 0.00 173.24 175.01 2kfb n GLY 41 N -0.35 -1.50 3.39 9.45 0.00 -1.26 -2.38 105.19 112.54 2kfb n GLY 41 Ca -0.12 -1.50 -0.33 0.00 0.00 0.00 0.00 46.02 44.07 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 0.07 2.29 -0.09 0.00 0.52 -0.86 -1.68 118.94 119.19 2kfb s TRP 43 Ca -0.05 -0.40 0.04 0.00 0.02 0.00 0.00 56.10 55.71 2kfb s TRP 43 Cb -0.15 -1.32 -0.00 0.00 -1.15 0.00 0.00 33.47 30.85 2kfb s TRP 43 CO 0.04 0.20 -0.24 1.41 0.02 0.00 0.00 176.95 178.39 2kfb s MET 44 N -1.54 2.87 -0.14 4.98 1.75 -0.62 -0.90 119.30 125.69 2kfb s MET 44 Ca 0.12 -0.86 -0.03 0.00 -1.25 0.00 0.00 55.69 53.67 2kfb s MET 44 Cb -0.10 -2.22 -0.03 0.00 2.84 0.00 0.00 34.83 35.33 2kfb s MET 44 CO 0.03 0.22 -0.05 -0.51 -0.65 0.00 0.00 175.02 174.06 2kfb s LEU 45 N 0.25 3.20 -0.12 4.11 1.02 -0.97 -0.80 118.68 125.38 2kfb s LEU 45 Ca -0.15 -0.13 -0.01 0.00 0.02 0.00 0.00 54.13 53.86 2kfb s LEU 45 Cb -0.17 -1.76 -0.02 0.00 0.02 0.00 0.00 46.19 44.26 2kfb s LEU 45 CO 0.08 0.20 -0.09 -0.31 0.02 0.00 0.00 176.35 176.24 2kfb s TYR 46 N 0.20 2.90 0.35 0.29 1.51 -0.88 -1.18 117.35 120.53 2kfb s TYR 46 Ca -0.03 -0.34 0.04 0.00 -1.01 0.00 0.00 57.07 55.74 2kfb s TYR 46 Cb -0.14 -1.83 0.68 0.00 -0.11 0.00 0.00 41.96 40.56 2kfb s TYR 46 CO 0.03 0.00 1.95 1.05 -1.11 0.00 0.00 175.55 177.47 2kfb h GLU 47 N 6.26 0.81 -6.28 -0.62 4.11 -1.38 -2.91 114.58 114.56 2kfb h GLU 47 Ca -0.34 -0.05 -0.61 0.00 0.07 0.00 0.00 59.36 58.43 2kfb h GLU 47 Cb 1.19 -0.18 -0.10 0.00 0.50 0.00 0.00 28.75 30.16 2kfb h GLU 47 CO 0.57 0.53 -0.62 -0.65 0.07 0.00 0.00 179.01 178.91 2kfb s GLN 48 N -5.74 2.65 0.85 1.06 -0.21 -0.33 -3.56 119.66 114.39 2kfb s GLN 48 Ca -0.10 -0.93 -0.11 0.00 0.02 0.00 0.00 55.36 54.25 2kfb s GLN 48 Cb 0.19 -2.53 0.11 0.00 1.00 0.00 0.00 33.01 31.78 2kfb s GLN 48 CO 0.78 0.49 1.13 -1.25 -2.12 0.00 0.00 175.29 174.33 2kfb s PRO 49 N -2.80 1.51 -1.31 2.91 0.04 -1.26 -2.71 135.00 131.38 2kfb s PRO 49 Ca 0.28 1.45 -0.05 0.00 0.04 0.00 0.00 61.00 62.72 2kfb s PRO 49 Cb -0.10 -1.79 0.01 0.00 0.04 0.00 0.00 34.50 32.65 2kfb s PRO 49 CO 0.20 -2.25 0.72 0.09 0.04 0.00 0.00 177.00 175.81 2kfb n ASN 50 N -3.86 -5.69 -3.26 6.66 5.03 -0.71 -3.62 115.26 109.80 2kfb n ASN 50 Ca 0.11 -0.33 -0.18 0.00 0.87 0.00 0.00 54.58 55.05 2kfb n ASN 50 Cb 0.52 -4.44 0.01 0.00 -1.02 0.00 0.00 39.78 34.85 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 -4.49 -2.89 -3.91 3.10 4.01 -1.24 -5.03 117.16 106.72 2kfb n TYR 51 Ca -0.06 1.17 -0.10 0.00 -0.16 0.00 0.00 57.90 58.74 2kfb n TYR 51 Cb 0.59 -3.20 -0.10 0.00 -0.31 0.00 0.00 39.34 36.32 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 -2.45 0.12 0.00 7.72 0.01 -1.10 -5.04 113.70 112.96 2kfb s SER 52 Ca 0.19 -0.41 0.00 0.00 1.31 0.00 0.00 55.95 57.03 2kfb s SER 52 Cb -0.03 0.22 0.00 0.00 0.21 0.00 0.00 66.02 66.41 2kfb s SER 52 CO 0.82 -0.46 0.00 0.61 0.41 0.00 0.00 173.24 174.62 2kfb n GLY 53 N 1.03 -0.12 3.77 3.44 0.00 -1.26 -1.18 105.19 110.87 2kfb n GLY 53 Ca -0.20 -1.33 -0.38 0.00 0.00 0.00 0.00 46.02 44.11 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 4.32 0.14 0.99 2.96 -1.26 -4.84 118.68 120.98 2kfb s LEU 54 Ca 0.00 2.10 0.11 0.00 -0.22 0.00 0.00 54.13 56.11 2kfb s LEU 54 Cb 0.00 -3.96 -0.04 0.00 0.50 0.00 0.00 46.19 42.69 2kfb s LEU 54 CO 0.00 -0.31 -0.25 0.00 -1.32 0.00 0.00 176.35 174.46 2kfb s GLN 55 N -2.05 1.38 -0.12 1.98 -2.07 -1.26 -1.69 119.66 115.83 2kfb s GLN 55 Ca 0.52 -1.35 0.01 0.00 -1.82 0.00 0.00 55.36 52.72 2kfb s GLN 55 Cb -0.25 -1.81 0.02 0.00 -1.09 0.00 0.00 33.01 29.88 2kfb s GLN 55 CO 0.32 0.42 -0.15 0.71 -1.32 0.00 0.00 175.29 175.27 2kfb s TYR 56 N -1.19 2.03 -0.17 9.60 2.02 -0.32 -4.66 117.35 124.65 2kfb s TYR 56 Ca 0.14 -1.00 -0.26 0.00 -0.37 0.00 0.00 57.07 55.57 2kfb s TYR 56 Cb -0.10 -1.47 -0.01 0.00 -0.40 0.00 0.00 41.96 39.98 2kfb s TYR 56 CO 0.06 -0.52 0.89 0.12 -1.57 0.00 0.00 175.55 174.53 2kfb s PHE 57 N 1.10 3.41 0.04 2.71 5.36 -1.26 -2.29 117.98 127.06 2kfb s PHE 57 Ca -0.04 1.33 0.09 0.00 -0.96 0.00 0.00 56.93 57.35 2kfb s PHE 57 Cb -0.14 -3.08 -0.03 0.00 -0.34 0.00 0.00 43.02 39.43 2kfb s PHE 57 CO -0.04 -0.29 -0.25 -0.51 -1.46 0.00 0.00 175.22 172.68 2kfb s LEU 58 N 2.34 2.23 0.13 6.12 1.02 -0.08 -4.92 118.68 125.52 2kfb s LEU 58 Ca 0.40 -0.55 0.04 0.00 0.02 0.00 0.00 54.13 54.04 2kfb s LEU 58 Cb -0.16 -1.33 -0.04 0.00 0.02 0.00 0.00 46.19 44.68 2kfb s LEU 58 CO 0.12 0.26 -0.10 0.00 0.02 0.00 0.00 176.35 176.66 2kfb s ARG 59 N -1.21 0.98 -0.20 1.70 3.03 -1.26 -2.04 118.95 119.95 2kfb s ARG 59 Ca 0.12 -1.37 -0.37 0.00 2.03 0.00 0.00 55.73 56.14 2kfb s ARG 59 Cb -0.10 -0.55 -0.17 0.00 -1.03 0.00 0.00 34.95 33.09 2kfb s ARG 59 CO 0.02 0.07 1.13 -2.13 -1.13 0.00 0.00 175.30 173.25 2kfb n ARG 60 N -0.00 0.00 -3.32 3.89 0.63 -1.23 -4.75 116.66 111.89 2kfb n ARG 60 Ca -0.12 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.81 2kfb n ARG 60 Cb 0.60 -1.28 0.00 0.00 0.45 0.00 0.00 32.46 32.23 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 2.28 -2.27 3.44 5.14 0.00 -0.20 -4.98 105.19 108.60 2kfb n GLY 61 Ca 0.21 -1.44 -0.33 0.00 0.00 0.00 0.00 46.02 44.47 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 -0.01 4.02 -0.18 1.61 1.01 -1.26 -0.07 116.67 121.78 2kfb s ASP 62 Ca 0.00 -0.25 -0.01 0.00 0.71 0.00 0.00 52.55 53.01 2kfb s ASP 62 Cb 0.00 -1.13 0.05 0.00 1.01 0.00 0.00 42.92 42.85 2kfb s ASP 62 CO 0.00 0.28 -0.02 -0.31 0.21 0.00 0.00 175.17 175.32 2kfb s TYR 63 N -0.33 1.58 -1.98 4.23 2.02 0.13 -4.98 117.35 118.03 2kfb s TYR 63 Ca 0.03 -1.10 0.26 0.00 -0.37 0.00 0.00 57.07 55.89 2kfb s TYR 63 Cb -0.13 -1.25 0.69 0.00 -0.40 0.00 0.00 41.96 40.87 2kfb s TYR 63 CO 0.02 -0.63 1.53 0.00 -1.57 0.00 0.00 175.55 174.90 2kfb n ALA 64 N 4.90 3.02 -3.40 3.71 0.00 -1.26 -0.11 120.51 127.37 2kfb n ALA 64 Ca -0.11 -0.45 -0.12 0.00 0.00 0.00 0.00 53.44 52.75 2kfb n ALA 64 Cb 0.47 -1.08 -0.12 0.00 0.00 0.00 0.00 19.45 18.72 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 -2.38 -0.30 0.26 0.00 1.01 -1.22 -2.25 116.67 111.78 2kfb s ASP 65 Ca 0.26 0.57 -0.03 0.00 0.71 0.00 0.00 52.55 54.07 2kfb s ASP 65 Cb 0.19 0.53 0.41 0.00 1.01 0.00 0.00 42.92 45.06 2kfb s ASP 65 CO 0.48 -0.13 1.85 1.12 0.21 0.00 0.00 175.17 178.70 2kfb h HIS 66 N 6.35 1.05 0.00 4.23 2.07 -0.90 0.19 115.15 128.14 2kfb h HIS 66 Ca -0.32 0.03 0.00 0.00 -2.85 0.00 0.00 60.37 57.23 2kfb h HIS 66 Cb 1.18 -0.34 0.00 0.00 2.57 0.00 0.00 27.41 30.82 2kfb h HIS 66 CO 0.37 0.50 0.10 1.04 -3.07 0.00 0.00 177.93 176.87 2kfb n GLN 67 N -4.61 0.00 0.07 5.12 1.13 -1.26 -0.90 117.38 116.93 2kfb n GLN 67 Ca 0.15 0.25 -0.15 0.00 -1.94 0.00 0.00 57.00 55.31 2kfb n GLN 67 Cb 0.23 -1.60 -0.14 0.00 0.11 0.00 0.00 30.24 28.85 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 0.21 -0.63 -1.09 1.08 -1.01 -3.26 115.11 110.40 2kfb h GLN 68 Ca 0.00 -0.36 0.00 0.00 -1.45 0.00 0.00 58.65 56.84 2kfb h GLN 68 Cb 0.19 0.13 0.00 0.00 -0.05 0.00 0.00 27.48 27.75 2kfb h GLN 68 CO 0.00 1.09 0.00 -2.67 -0.95 0.00 0.00 178.83 176.30 2kfb n TRP 69 N -3.44 1.18 -1.87 2.96 2.14 -0.08 -4.86 117.44 113.47 2kfb n TRP 69 Ca -0.12 -0.46 -0.04 0.00 2.07 0.00 0.00 57.50 58.95 2kfb n TRP 69 Cb 1.03 -0.23 -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 -0.31 -0.32 -2.67 2.81 -1.21 -4.46 117.12 111.70 2kfb n MET 70 Ca 0.19 0.29 0.00 0.00 -1.81 0.00 0.00 57.70 56.37 2kfb n MET 70 Cb 0.74 -4.00 0.00 0.00 -0.71 0.00 0.00 33.22 29.24 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 -1.32 1.80 0.00 3.03 0.00 -0.83 -4.64 105.19 103.23 2kfb n GLY 71 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.97 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 1.63 0.00 -4.45 0.99 4.77 -1.26 -2.62 117.00 116.06 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 -0.12 0.00 -2.33 0.00 0.00 43.42 41.30 2kfb n LEU 72 CO 0.00 0.00 -0.22 -0.55 -1.33 0.00 0.00 177.39 175.29 2kfb s SER 73 N -4.28 5.51 0.00 -1.43 0.15 -1.26 -4.96 113.70 107.43 2kfb s SER 73 Ca 0.00 -0.42 0.00 0.00 0.70 0.00 0.00 55.95 56.23 2kfb s SER 73 Cb 0.00 -2.00 0.00 0.00 -1.71 0.00 0.00 66.02 62.31 2kfb s SER 73 CO 0.00 -0.15 0.66 -0.67 1.20 0.00 0.00 173.24 174.28 2kfb n ASP 74 N 4.98 1.79 -4.26 5.45 2.03 -1.08 -4.68 116.55 120.78 2kfb n ASP 74 Ca -0.14 -1.33 -0.33 0.00 0.52 0.00 0.00 54.79 53.50 2kfb n ASP 74 Cb 0.50 -0.36 -0.15 0.00 -0.72 0.00 0.00 41.12 40.38 2kfb n ASP 74 CO 0.00 0.00 0.00 -0.55 -1.92 0.00 0.00 177.20 174.73 2kfb s SER 75 N 1.75 3.57 -0.30 1.67 0.15 -1.26 -4.79 113.70 114.49 2kfb s SER 75 Ca 0.00 -0.48 -0.08 0.00 0.70 0.00 0.00 55.95 56.09 2kfb s SER 75 Cb 0.00 -1.54 0.17 0.00 -1.71 0.00 0.00 66.02 62.95 2kfb s SER 75 CO 0.00 0.10 0.78 0.54 1.20 0.00 0.00 173.24 175.86 2kfb s VAL 76 N 0.69 -0.77 -0.04 4.45 0.11 -1.25 -3.89 120.40 119.70 2kfb s VAL 76 Ca -0.08 0.00 0.06 0.00 -2.93 0.00 0.00 61.98 59.03 2kfb s VAL 76 Cb -0.16 -1.00 0.09 0.00 -1.53 0.00 0.00 36.38 33.78 2kfb s VAL 76 CO 0.02 0.00 1.01 0.54 -3.33 0.00 0.00 175.10 173.34 2kfb n ARG 77 N 5.37 2.15 -3.56 1.54 1.74 -1.10 -4.62 116.66 118.18 2kfb n ARG 77 Ca -0.06 -1.74 -0.09 0.00 -0.77 0.00 0.00 57.85 55.20 2kfb n ARG 77 Cb 0.51 -1.10 -0.02 0.00 -1.02 0.00 0.00 32.46 30.84 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 -1.50 -0.40 -0.06 0.55 1.04 -1.22 -0.07 113.70 112.03 2kfb s SER 78 Ca 0.10 -0.14 -0.27 0.00 0.48 0.00 0.00 55.95 56.12 2kfb s SER 78 Cb 0.09 0.52 0.06 0.00 0.10 0.00 0.00 66.02 66.79 2kfb s SER 78 CO 0.01 -0.88 0.60 0.00 0.98 0.00 0.00 173.24 173.95 2kfb s ARG 80 N -1.05 0.96 -0.24 0.00 1.70 0.02 -0.03 118.95 120.31 2kfb s ARG 80 Ca -0.10 -1.06 -0.10 0.00 -0.47 0.00 0.00 55.73 54.00 2kfb s ARG 80 Cb -0.02 -1.07 -0.05 0.00 -0.57 0.00 0.00 34.95 33.25 2kfb s ARG 80 CO 0.08 0.24 0.14 -1.17 -1.08 0.00 0.00 175.30 173.51 2kfb s LEU 81 N -1.87 3.96 -0.34 -1.89 0.20 -1.26 -1.59 118.68 115.89 2kfb s LEU 81 Ca 0.02 0.04 -0.24 0.00 0.69 0.00 0.00 54.13 54.64 2kfb s LEU 81 Cb -0.10 -2.06 0.01 0.00 -0.43 0.00 0.00 46.19 43.61 2kfb s LEU 81 CO 0.03 0.05 0.84 -0.63 -0.29 0.00 0.00 176.35 176.35 2kfb s ILE 82 N 1.16 4.71 0.69 6.68 1.01 -0.67 -4.83 121.20 129.94 2kfb s ILE 82 Ca 0.07 1.16 -0.17 0.00 0.00 0.00 0.00 60.65 61.71 2kfb s ILE 82 Cb -0.14 -4.23 -0.03 0.00 0.01 0.00 0.00 42.46 38.07 2kfb s ILE 82 CO 0.05 -0.38 0.74 -2.65 0.00 0.00 0.00 174.94 172.70 2kfb n PRO 83 N 6.45 0.47 -1.17 2.79 -0.02 -1.26 -4.38 135.00 137.88 2kfb n PRO 83 Ca 0.05 0.20 -0.29 0.00 -2.02 0.00 0.00 63.50 61.45 2kfb n PRO 83 Cb 0.48 -2.00 0.23 0.00 -0.02 0.00 0.00 33.50 32.20 2kfb n PRO 83 CO 0.00 0.00 0.00 -2.39 1.98 0.00 0.00 175.50 175.09 2kfb n HIS 84 N -2.27 -3.89 -3.63 6.00 1.44 -1.26 -4.83 115.22 106.78 2kfb n HIS 84 Ca 0.12 -0.99 -0.11 0.00 -2.01 0.00 0.00 57.72 54.73 2kfb n HIS 84 Cb 0.49 -1.08 -0.07 0.00 0.12 0.00 0.00 29.99 29.46 2kfb n HIS 84 CO 0.00 0.00 0.00 0.45 -2.81 0.00 0.00 176.34 173.98 2kfb s SER 85 N -4.61 -0.56 0.00 4.39 0.15 -1.26 -4.86 113.70 106.95 2kfb s SER 85 Ca 0.69 1.05 0.00 0.00 0.70 0.00 0.00 55.95 58.39 2kfb s SER 85 Cb -0.06 1.05 0.00 0.00 -1.71 0.00 0.00 66.02 65.31 2kfb s SER 85 CO 0.52 -0.20 0.00 0.61 1.20 0.00 0.00 173.24 175.37 2kfb n GLY 86 N 2.29 -0.43 3.88 9.45 0.00 -1.26 -4.94 105.19 114.19 2kfb n GLY 86 Ca -0.13 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.59 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 -3.11 6.53 -0.09 1.61 0.01 -1.26 -5.08 113.70 112.31 2kfb s SER 87 Ca 0.00 0.95 -0.01 0.00 1.31 0.00 0.00 55.95 58.20 2kfb s SER 87 Cb 0.00 -2.24 0.03 0.00 0.21 0.00 0.00 66.02 64.01 2kfb s SER 87 CO 0.00 -0.25 -0.04 -1.00 0.41 0.00 0.00 173.24 172.36 2kfb s HIS 88 N -2.13 1.11 -0.08 2.43 0.09 -1.26 -3.99 115.29 111.45 2kfb s HIS 88 Ca 0.48 -0.47 -0.06 0.00 -0.00 0.00 0.00 55.06 55.01 2kfb s HIS 88 Cb -0.11 -1.03 0.03 0.00 -0.00 0.00 0.00 32.58 31.47 2kfb s HIS 88 CO 0.28 -0.43 0.20 0.50 -0.00 0.00 0.00 174.74 175.29 2kfb s ARG 89 N 1.82 0.20 -0.06 1.40 3.52 -1.23 -4.39 118.95 120.21 2kfb s ARG 89 Ca 0.05 0.37 -0.12 0.00 -0.13 0.00 0.00 55.73 55.90 2kfb s ARG 89 Cb -0.12 -0.01 0.02 0.00 -1.56 0.00 0.00 34.95 33.28 2kfb s ARG 89 CO -0.07 -0.09 0.28 -1.50 -0.81 0.00 0.00 175.30 173.11 2kfb s ILE 90 N 0.63 0.03 -0.33 4.11 2.07 -1.08 -2.59 121.20 124.05 2kfb s ILE 90 Ca -0.04 -0.26 0.02 0.00 -1.41 0.00 0.00 60.65 58.96 2kfb s ILE 90 Cb -0.06 -0.49 0.10 0.00 0.13 0.00 0.00 42.46 42.14 2kfb s ILE 90 CO -0.03 -0.14 0.07 -0.13 -1.91 0.00 0.00 174.94 172.79 2kfb s ARG 91 N -0.57 1.20 0.45 3.50 0.52 0.13 -1.74 118.95 122.44 2kfb s ARG 91 Ca -0.07 -1.59 -0.18 0.00 -0.52 0.00 0.00 55.73 53.38 2kfb s ARG 91 Cb -0.04 -2.76 -0.09 0.00 0.52 0.00 0.00 34.95 32.58 2kfb s ARG 91 CO 0.02 -0.96 0.93 -0.51 0.02 0.00 0.00 175.30 174.80 2kfb s LEU 92 N 1.16 3.81 -0.02 2.53 1.02 -0.71 -0.99 118.68 125.47 2kfb s LEU 92 Ca 0.11 1.55 0.04 0.00 0.02 0.00 0.00 54.13 55.84 2kfb s LEU 92 Cb -0.18 -4.43 -0.01 0.00 0.02 0.00 0.00 46.19 41.59 2kfb s LEU 92 CO -0.14 -0.45 -0.13 -0.31 0.02 0.00 0.00 176.35 175.34 2kfb s TYR 93 N -2.37 1.24 0.10 0.29 2.02 0.33 -2.40 117.35 116.57 2kfb s TYR 93 Ca 0.59 -0.28 -0.31 0.00 -0.37 0.00 0.00 57.07 56.70 2kfb s TYR 93 Cb -0.10 -0.83 -0.12 0.00 -0.40 0.00 0.00 41.96 40.52 2kfb s TYR 93 CO 0.23 -0.07 1.60 1.05 -1.57 0.00 0.00 175.55 176.79 2kfb h GLU 94 N 6.06 -0.67 -6.23 -0.62 -0.00 -1.77 -2.92 114.58 108.43 2kfb h GLU 94 Ca -0.33 0.05 -0.51 0.00 -0.00 0.00 0.00 59.36 58.56 2kfb h GLU 94 Cb 1.17 0.15 -0.02 0.00 -0.00 0.00 0.00 28.75 30.05 2kfb h GLU 94 CO 0.49 -0.45 -0.29 1.03 -0.00 0.00 0.00 179.01 179.79 2kfb s ARG 95 N -5.97 2.45 0.90 1.06 0.52 -1.26 -2.50 118.95 114.14 2kfb s ARG 95 Ca -0.17 -1.65 -0.11 0.00 -0.52 0.00 0.00 55.73 53.28 2kfb s ARG 95 Cb 0.07 -2.40 0.11 0.00 0.52 0.00 0.00 34.95 33.25 2kfb s ARG 95 CO 0.63 -0.44 1.00 0.39 0.02 0.00 0.00 175.30 176.90 2kfb n GLU 96 N -1.77 -0.30 -1.83 3.54 1.02 -1.24 -4.21 120.64 115.84 2kfb n GLU 96 Ca 0.05 -0.02 0.00 0.00 -0.02 0.00 0.00 57.16 57.17 2kfb n GLU 96 Cb 0.62 -2.27 0.00 0.00 -0.02 0.00 0.00 31.44 29.77 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 -3.42 -6.31 -3.92 1.62 9.92 -1.06 -3.92 116.55 109.46 2kfb n ASP 97 Ca 0.11 1.27 -0.07 0.00 -0.53 0.00 0.00 54.79 55.57 2kfb n ASP 97 Cb 0.52 -3.99 -0.02 0.00 -0.64 0.00 0.00 41.12 36.99 2kfb n ASP 97 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2kfb n TYR 98 N 0.90 0.00 -2.61 1.24 4.11 -1.26 -4.66 117.16 114.87 2kfb n TYR 98 Ca 0.00 -0.08 0.00 0.00 -0.00 0.00 0.00 57.90 57.82 2kfb n TYR 98 Cb 0.00 -0.46 0.00 0.00 -0.00 0.00 0.00 39.34 38.88 2kfb n TYR 98 CO 0.00 0.00 0.00 -2.13 -0.00 0.00 0.00 176.86 174.73 2kfb n ARG 99 N 4.24 3.74 0.00 -3.48 3.00 -1.25 -5.08 116.66 117.82 2kfb n ARG 99 Ca 0.08 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.93 2kfb n ARG 99 Cb 0.28 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.74 2kfb n ARG 99 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2kfb n GLY 100 N 4.67 0.51 3.77 5.14 0.00 -1.26 -4.41 105.19 113.60 2kfb n GLY 100 Ca 0.00 -0.44 -0.38 0.00 0.00 0.00 0.00 46.02 45.20 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 3.79 0.08 1.61 2.00 -1.26 -4.91 119.66 120.96 2kfb s GLN 101 Ca 0.00 1.87 0.05 0.00 -2.00 0.00 0.00 55.36 55.28 2kfb s GLN 101 Cb 0.00 -2.49 -0.03 0.00 0.80 0.00 0.00 33.01 31.29 2kfb s GLN 101 CO 0.00 -0.56 -0.14 0.00 -0.50 0.00 0.00 175.29 174.10 2kfb s MET 102 N -2.58 0.83 -0.07 1.67 0.23 -1.26 -2.90 119.30 115.22 2kfb s MET 102 Ca 0.62 -1.00 -0.06 0.00 -1.03 0.00 0.00 55.69 54.22 2kfb s MET 102 Cb -0.31 -0.79 0.02 0.00 -1.53 0.00 0.00 34.83 32.22 2kfb s MET 102 CO 0.38 0.17 0.19 -1.50 -2.03 0.00 0.00 175.02 172.23 2kfb s ILE 103 N -1.48 -0.00 0.00 3.16 2.07 -1.01 -5.02 121.20 118.92 2kfb s ILE 103 Ca -0.00 0.01 0.04 0.00 -1.41 0.00 0.00 60.65 59.29 2kfb s ILE 103 Cb -0.09 -0.27 -0.03 0.00 0.13 0.00 0.00 42.46 42.20 2kfb s ILE 103 CO 0.02 0.01 -0.10 -0.70 -1.91 0.00 0.00 174.94 172.26 2kfb s GLU 104 N 0.19 2.45 0.13 3.50 2.12 -1.26 -1.75 118.70 124.09 2kfb s GLU 104 Ca -0.01 -0.77 0.06 0.00 0.36 0.00 0.00 54.97 54.62 2kfb s GLU 104 Cb -0.02 -2.42 -0.04 0.00 0.26 0.00 0.00 34.13 31.91 2kfb s GLU 104 CO -0.00 0.59 -0.14 -0.06 -0.54 0.00 0.00 175.26 175.11 2kfb s PHE 105 N -0.94 1.42 0.00 5.30 0.08 -0.71 -5.00 117.98 118.13 2kfb s PHE 105 Ca 0.16 -0.55 0.00 0.00 0.12 0.00 0.00 56.93 56.65 2kfb s PHE 105 Cb -0.11 -0.74 0.00 0.00 -0.57 0.00 0.00 43.02 41.60 2kfb s PHE 105 CO 0.06 0.15 0.39 0.25 -0.10 0.00 0.00 175.22 175.97 2kfb n THR 106 N 0.50 0.00 -2.76 0.64 -2.24 -1.26 -2.62 114.28 106.55 2kfb n THR 106 Ca -0.15 0.00 -0.05 0.00 -2.27 0.00 0.00 64.05 61.58 2kfb n THR 106 Cb 0.57 0.84 0.02 0.00 -2.10 0.00 0.00 70.33 69.66 2kfb n THR 106 CO 0.00 0.00 0.00 -1.84 -0.57 0.00 0.00 175.07 172.66 2kfb n GLU 107 N 0.00 0.57 -0.06 -0.78 0.28 -1.26 -4.81 120.64 114.58 2kfb n GLU 107 Ca 0.00 -1.97 0.00 0.00 -0.16 0.00 0.00 57.16 55.03 2kfb n GLU 107 Cb 0.49 -1.45 0.00 0.00 1.43 0.00 0.00 31.44 31.91 2kfb n GLU 107 CO 0.00 0.00 0.00 -0.40 -0.16 0.00 0.00 177.13 176.57 2kfb n ASP 108 N 2.72 0.00 -3.43 -1.84 5.75 -1.26 -4.91 116.55 113.58 2kfb n ASP 108 Ca 0.16 0.00 -0.16 0.00 -0.01 0.00 0.00 54.79 54.78 2kfb n ASP 108 Cb 0.57 -0.18 -0.11 0.00 -1.03 0.00 0.00 41.12 40.37 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 8.27 0.00 -2.36 0.00 4.64 -1.91 -2.45 113.55 119.74 2kfb h SER 110 Ca -0.16 0.00 -0.44 0.00 -0.47 0.00 0.00 61.79 60.71 2kfb h SER 110 Cb 1.12 0.00 -0.36 0.00 -0.31 0.00 0.00 62.40 62.86 2kfb h SER 110 CO 0.30 0.09 -0.73 0.00 -0.87 0.00 0.00 176.83 175.62 2kfb h LEU 112 N 7.75 0.60 0.00 0.00 5.85 -1.43 -2.40 115.31 125.69 2kfb h LEU 112 Ca -0.06 -0.19 0.00 0.00 0.84 0.00 0.00 57.88 58.47 2kfb h LEU 112 Cb 1.03 -0.16 0.00 0.00 0.37 0.00 0.00 40.66 41.90 2kfb h LEU 112 CO 0.31 0.63 0.29 0.00 -0.34 0.00 0.00 178.44 179.34 2kfb n GLN 113 N -4.60 0.00 -0.02 1.25 1.13 -1.25 0.20 117.38 114.10 2kfb n GLN 113 Ca 0.00 0.16 0.01 0.00 -1.94 0.00 0.00 57.00 55.24 2kfb n GLN 113 Cb 0.16 -1.79 -0.13 0.00 0.11 0.00 0.00 30.24 28.59 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 -1.14 0.28 -0.06 1.08 8.00 -0.90 -4.56 116.55 119.24 2kfb n ASP 114 Ca 0.00 0.12 -0.08 0.00 0.71 0.00 0.00 54.79 55.54 2kfb n ASP 114 Cb 0.29 1.08 -0.07 0.00 -0.02 0.00 0.00 41.12 42.40 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 -2.62 0.97 -4.05 -1.24 5.12 0.55 -4.96 116.66 110.43 2kfb n ARG 115 Ca -0.15 0.05 -0.29 0.00 -1.93 0.00 0.00 57.85 55.53 2kfb n ARG 115 Cb 0.84 -1.28 -0.17 0.00 -1.16 0.00 0.00 32.46 30.70 2kfb n ARG 115 CO 0.00 0.00 0.00 0.12 -1.93 0.00 0.00 177.63 175.82 2kfb s PHE 116 N -2.27 2.02 0.06 -1.55 5.36 0.22 -5.04 117.98 116.78 2kfb s PHE 116 Ca -0.14 -1.10 -0.37 0.00 -0.96 0.00 0.00 56.93 54.36 2kfb s PHE 116 Cb 0.04 -1.51 -0.21 0.00 -0.34 0.00 0.00 43.02 41.01 2kfb s PHE 116 CO 0.36 -0.62 1.54 0.00 -1.46 0.00 0.00 175.22 175.04 2kfb h ARG 117 N 8.00 -1.29 -6.02 10.12 3.08 -1.83 -3.30 114.38 123.14 2kfb h ARG 117 Ca -0.36 0.09 -0.69 0.00 0.07 0.00 0.00 59.98 59.09 2kfb h ARG 117 Cb 1.14 0.29 0.10 0.00 0.08 0.00 0.00 29.97 31.58 2kfb h ARG 117 CO 0.50 -0.86 -0.38 1.19 -1.07 0.00 0.00 179.97 179.35 2kfb n PHE 118 N -5.64 -0.18 0.61 3.04 3.01 -1.26 -4.85 117.46 112.18 2kfb n PHE 118 Ca -0.17 0.98 0.11 0.00 1.01 0.00 0.00 57.45 59.38 2kfb n PHE 118 Cb 0.53 -2.00 0.14 0.00 -0.01 0.00 0.00 39.48 38.14 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 1.88 3.04 -3.96 4.37 3.02 -1.26 -4.86 115.26 117.49 2kfb n ASN 119 Ca 0.18 -1.93 -0.17 0.00 -0.03 0.00 0.00 54.58 52.63 2kfb n ASN 119 Cb 0.22 -0.11 -0.15 0.00 -0.61 0.00 0.00 39.78 39.13 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 -1.61 0.56 -0.16 3.52 2.02 -1.26 -1.22 118.70 120.54 2kfb s GLU 120 Ca 0.30 -0.19 0.02 0.00 0.02 0.00 0.00 54.97 55.11 2kfb s GLU 120 Cb 0.19 -0.55 0.02 0.00 0.10 0.00 0.00 34.13 33.89 2kfb s GLU 120 CO 0.28 0.09 -0.20 0.42 0.02 0.00 0.00 175.26 175.87 2kfb s ILE 121 N 0.07 1.95 -0.20 -1.63 -1.09 -0.01 -4.56 121.20 115.74 2kfb s ILE 121 Ca -0.00 -0.89 0.15 0.00 -2.23 0.00 0.00 60.65 57.68 2kfb s ILE 121 Cb -0.05 -1.76 0.50 0.00 -1.58 0.00 0.00 42.46 39.57 2kfb s ILE 121 CO -0.00 0.53 1.40 1.41 -1.23 0.00 0.00 174.94 177.05 2kfb n HIS 122 N 4.41 0.88 0.00 3.97 8.25 -1.04 -4.48 115.22 127.21 2kfb n HIS 122 Ca -0.20 -1.03 0.00 0.00 -0.26 0.00 0.00 57.72 56.23 2kfb n HIS 122 Cb 0.51 -0.33 0.00 0.00 1.12 0.00 0.00 29.99 31.28 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 -0.73 0.00 -3.49 0.41 3.41 -1.24 -2.92 113.62 109.05 2kfb n SER 123 Ca 0.23 0.00 -0.10 0.00 -0.26 0.00 0.00 58.87 58.74 2kfb n SER 123 Cb 0.90 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.82 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 -0.43 -0.15 1.04 0.05 -0.91 -0.52 118.68 117.76 2kfb s LEU 124 Ca 0.00 0.09 0.00 0.00 0.05 0.00 0.00 54.13 54.27 2kfb s LEU 124 Cb 0.00 2.17 0.03 0.00 -2.05 0.00 0.00 46.19 46.33 2kfb s LEU 124 CO 0.00 -0.67 -0.13 0.21 -0.55 0.00 0.00 176.35 175.22 2kfb s ASN 125 N -2.31 2.74 -0.45 1.48 3.04 -0.16 -1.36 114.94 117.92 2kfb s ASN 125 Ca 0.02 -0.53 -0.13 0.00 0.04 0.00 0.00 52.86 52.27 2kfb s ASN 125 Cb -0.01 -1.15 0.08 0.00 -1.54 0.00 0.00 41.25 38.63 2kfb s ASN 125 CO -0.08 -0.08 0.34 -0.69 -3.04 0.00 0.00 177.10 173.55 2kfb s VAL 126 N 1.50 4.79 0.02 -5.21 1.01 -1.01 -0.69 120.40 120.81 2kfb s VAL 126 Ca 0.04 -1.22 -0.17 0.00 0.00 0.00 0.00 61.98 60.63 2kfb s VAL 126 Cb -0.13 -3.89 -0.32 0.00 0.00 0.00 0.00 36.38 32.04 2kfb s VAL 126 CO -0.10 -0.55 1.03 -0.07 0.00 0.00 0.00 175.10 175.40 2kfb h LEU 127 N 8.60 0.78 -7.88 3.92 -0.00 -1.76 -2.55 115.31 116.42 2kfb h LEU 127 Ca -0.26 -0.88 -0.18 0.00 -0.00 0.00 0.00 57.88 56.56 2kfb h LEU 127 Cb 1.10 -0.25 -0.23 0.00 -0.00 0.00 0.00 40.66 41.28 2kfb h LEU 127 CO 0.83 1.59 -0.68 -0.70 -0.00 0.00 0.00 178.44 179.47 2kfb s GLU 128 N -2.77 0.24 1.08 1.13 2.56 -1.20 -4.90 118.70 114.84 2kfb s GLU 128 Ca -0.10 -0.41 0.00 0.00 0.00 0.00 0.00 54.97 54.46 2kfb s GLU 128 Cb 0.04 0.09 0.00 0.00 2.00 0.00 0.00 34.13 36.26 2kfb s GLU 128 CO 0.91 -0.04 0.00 0.41 -0.56 0.00 0.00 175.26 175.98 2kfb n GLY 129 N 2.01 -1.47 3.47 -1.50 0.00 -1.26 -3.55 105.19 102.89 2kfb n GLY 129 Ca -0.20 -1.09 -0.27 0.00 0.00 0.00 0.00 46.02 44.45 2kfb n GLY 129 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2kfb s SER 130 N -5.70 3.71 0.20 1.61 0.01 -1.26 -3.64 113.70 108.63 2kfb s SER 130 Ca 0.00 -0.73 0.08 0.00 1.31 0.00 0.00 55.95 56.61 2kfb s SER 130 Cb 0.00 -0.42 -0.05 0.00 0.21 0.00 0.00 66.02 65.76 2kfb s SER 130 CO 0.00 0.13 -0.15 0.26 0.41 0.00 0.00 173.24 173.89 2kfb s TRP 131 N -1.53 1.72 -0.03 2.43 0.52 -0.08 -1.59 118.94 120.38 2kfb s TRP 131 Ca 0.21 -0.56 0.03 0.00 0.02 0.00 0.00 56.10 55.80 2kfb s TRP 131 Cb -0.09 -0.80 -0.00 0.00 -1.15 0.00 0.00 33.47 31.43 2kfb s TRP 131 CO 0.11 0.36 -0.11 0.08 0.02 0.00 0.00 176.95 177.40 2kfb s VAL 132 N -2.85 0.95 -0.06 4.03 1.01 0.15 0.26 120.40 123.89 2kfb s VAL 132 Ca 0.22 -0.46 -0.00 0.00 0.00 0.00 0.00 61.98 61.73 2kfb s VAL 132 Cb -0.01 -0.82 -0.03 0.00 0.00 0.00 0.00 36.38 35.51 2kfb s VAL 132 CO 0.07 0.28 -0.01 -0.76 0.00 0.00 0.00 175.10 174.68 2kfb s LEU 133 N 0.08 3.49 -0.08 3.92 1.43 -0.96 -0.69 118.68 125.87 2kfb s LEU 133 Ca -0.02 0.07 0.04 0.00 -1.03 0.00 0.00 54.13 53.19 2kfb s LEU 133 Cb -0.08 -1.85 -0.01 0.00 0.03 0.00 0.00 46.19 44.27 2kfb s LEU 133 CO 0.01 0.35 -0.20 -0.31 0.23 0.00 0.00 176.35 176.42 2kfb s TYR 134 N -0.93 2.59 0.22 0.29 1.51 -1.03 -2.10 117.35 117.89 2kfb s TYR 134 Ca 0.15 -0.64 -0.14 0.00 -1.01 0.00 0.00 57.07 55.43 2kfb s TYR 134 Cb -0.11 -1.67 0.26 0.00 -0.11 0.00 0.00 41.96 40.32 2kfb s TYR 134 CO 0.05 -0.17 1.61 1.49 -1.11 0.00 0.00 175.55 177.42 2kfb h GLU 135 N 6.15 -0.03 -5.61 -0.62 4.57 -1.74 0.37 114.58 117.67 2kfb h GLU 135 Ca -0.32 0.00 -0.54 0.00 -1.18 0.00 0.00 59.36 57.32 2kfb h GLU 135 Cb 1.19 0.01 -0.14 0.00 -0.16 0.00 0.00 28.75 29.65 2kfb h GLU 135 CO 0.50 -0.02 -0.66 -0.48 -1.18 0.00 0.00 179.01 177.17 2kfb s LEU 136 N -10.91 2.56 1.21 1.64 2.34 -1.26 -1.20 118.68 113.06 2kfb s LEU 136 Ca -0.14 -1.24 -0.19 0.00 0.06 0.00 0.00 54.13 52.62 2kfb s LEU 136 Cb 0.20 -0.74 0.29 0.00 -0.56 0.00 0.00 46.19 45.38 2kfb s LEU 136 CO 0.74 -0.35 1.09 -0.44 -1.06 0.00 0.00 176.35 176.32 2kfb s SER 137 N -3.53 0.82 -2.00 1.48 0.01 -1.26 -3.69 113.70 105.53 2kfb s SER 137 Ca 0.32 0.72 0.00 0.00 1.31 0.00 0.00 55.95 58.30 2kfb s SER 137 Cb 0.05 -1.03 0.00 0.00 0.21 0.00 0.00 66.02 65.25 2kfb s SER 137 CO 0.14 -4.20 0.00 0.59 0.41 0.00 0.00 173.24 170.19 2kfb n ASN 138 N -4.82 -5.29 -3.22 2.44 5.03 -1.03 -3.56 115.26 104.82 2kfb n ASN 138 Ca 0.12 0.38 -0.29 0.00 0.87 0.00 0.00 54.58 55.67 2kfb n ASN 138 Cb 0.59 -4.63 0.02 0.00 -1.02 0.00 0.00 39.78 34.74 2kfb n ASN 138 CO 0.00 0.00 0.00 -1.22 -1.83 0.00 0.00 177.26 174.21 2kfb n TYR 139 N -2.66 -2.03 -2.77 3.10 4.01 -1.24 -4.91 117.16 110.66 2kfb n TYR 139 Ca -0.21 0.85 -0.02 0.00 -0.16 0.00 0.00 57.90 58.37 2kfb n TYR 139 Cb 0.65 -1.67 0.07 0.00 -0.31 0.00 0.00 39.34 38.08 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 -0.79 1.56 0.00 -0.72 1.74 -1.23 -5.10 116.66 112.11 2kfb n ARG 140 Ca -0.13 -2.78 0.00 0.00 -0.77 0.00 0.00 57.85 54.17 2kfb n ARG 140 Cb 0.57 -0.94 0.00 0.00 -1.02 0.00 0.00 32.46 31.06 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 -0.83 4.36 3.69 -0.13 0.00 -1.26 -4.87 105.19 106.16 2kfb n GLY 141 Ca -0.00 -0.66 -0.29 0.00 0.00 0.00 0.00 46.02 45.07 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 3.01 0.64 -0.10 1.61 0.52 -1.26 -4.79 118.95 118.57 2kfb s ARG 142 Ca 0.00 0.58 -0.07 0.00 -0.52 0.00 0.00 55.73 55.72 2kfb s ARG 142 Cb 0.00 -1.76 0.04 0.00 0.52 0.00 0.00 34.95 33.75 2kfb s ARG 142 CO 0.00 -2.61 0.25 1.14 0.02 0.00 0.00 175.30 174.11 2kfb s GLN 143 N -4.97 0.25 -0.02 3.54 0.00 -1.26 -2.85 119.66 114.36 2kfb s GLN 143 Ca 0.65 0.44 0.05 0.00 -0.00 0.00 0.00 55.36 56.50 2kfb s GLN 143 Cb -0.18 0.02 -0.01 0.00 0.00 0.00 0.00 33.01 32.84 2kfb s GLN 143 CO 0.57 -0.10 -0.16 0.71 0.00 0.00 0.00 175.29 176.32 2kfb s TYR 144 N 0.68 1.52 -0.17 9.60 2.02 -0.89 -4.60 117.35 125.51 2kfb s TYR 144 Ca -0.05 -0.35 -0.19 0.00 -0.37 0.00 0.00 57.07 56.12 2kfb s TYR 144 Cb -0.06 -1.00 -0.04 0.00 -0.40 0.00 0.00 41.96 40.46 2kfb s TYR 144 CO -0.04 -0.08 0.51 -1.17 -1.57 0.00 0.00 175.55 173.20 2kfb s LEU 145 N -0.18 4.19 -0.37 -1.29 0.20 -1.26 -2.26 118.68 117.71 2kfb s LEU 145 Ca 0.02 0.74 -0.01 0.00 0.69 0.00 0.00 54.13 55.57 2kfb s LEU 145 Cb -0.08 -2.72 0.09 0.00 -0.43 0.00 0.00 46.19 43.05 2kfb s LEU 145 CO 0.00 -0.12 0.12 -0.76 -0.29 0.00 0.00 176.35 175.30 2kfb s LEU 146 N 1.29 4.79 0.63 -0.68 1.43 0.14 -4.91 118.68 121.36 2kfb s LEU 146 Ca 0.25 -1.85 -0.10 0.00 -1.03 0.00 0.00 54.13 51.40 2kfb s LEU 146 Cb -0.15 -1.76 -0.02 0.00 0.03 0.00 0.00 46.19 44.29 2kfb s LEU 146 CO 0.10 -0.43 1.01 -0.04 0.23 0.00 0.00 176.35 177.21 2kfb s MET 147 N 1.12 3.29 -0.12 1.70 -1.94 -1.26 -0.90 119.30 121.18 2kfb s MET 147 Ca 0.05 0.51 -0.34 0.00 -1.71 0.00 0.00 55.69 54.19 2kfb s MET 147 Cb -0.21 -2.12 -0.12 0.00 2.01 0.00 0.00 34.83 34.39 2kfb s MET 147 CO -0.04 -0.68 1.91 -2.30 -0.01 0.00 0.00 175.02 173.89 2kfb n PRO 148 N -2.75 2.05 -0.85 2.03 -0.02 -1.24 -4.77 135.00 129.45 2kfb n PRO 148 Ca 0.05 0.74 0.00 0.00 -2.02 0.00 0.00 63.50 62.28 2kfb n PRO 148 Cb 0.56 -2.62 0.00 0.00 -0.02 0.00 0.00 33.50 31.41 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 4.56 -0.62 3.12 -1.23 0.00 -0.96 -5.03 105.19 105.04 2kfb n GLY 149 Ca 0.24 -0.60 -0.25 0.00 0.00 0.00 0.00 46.02 45.41 2kfb n GLY 149 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2kfb s ASP 150 N -4.00 1.98 -0.08 1.61 1.01 -1.26 -2.41 116.67 113.51 2kfb s ASP 150 Ca 0.00 -0.32 0.02 0.00 0.71 0.00 0.00 52.55 52.97 2kfb s ASP 150 Cb 0.00 -0.47 0.01 0.00 1.01 0.00 0.00 42.92 43.47 2kfb s ASP 150 CO 0.00 0.15 -0.15 -0.31 0.21 0.00 0.00 175.17 175.07 2kfb s TYR 151 N -0.03 1.74 -0.44 4.23 1.51 -0.46 -4.99 117.35 118.90 2kfb s TYR 151 Ca -0.01 -0.70 0.04 0.00 -1.01 0.00 0.00 57.07 55.39 2kfb s TYR 151 Cb -0.10 -1.25 0.01 0.00 -0.11 0.00 0.00 41.96 40.51 2kfb s TYR 151 CO 0.01 -0.34 0.49 0.54 -1.11 0.00 0.00 175.55 175.14 2kfb n ARG 152 N 3.85 1.51 -3.55 -0.62 1.74 -1.26 -2.14 116.66 116.18 2kfb n ARG 152 Ca -0.21 -0.53 -0.11 0.00 -0.77 0.00 0.00 57.85 56.23 2kfb n ARG 152 Cb 0.52 -0.96 -0.04 0.00 -1.02 0.00 0.00 32.46 30.96 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 -0.68 1.13 0.48 5.56 1.70 -1.15 -2.55 118.95 123.45 2kfb s ARG 153 Ca 0.04 -0.55 0.27 0.00 -0.47 0.00 0.00 55.73 55.02 2kfb s ARG 153 Cb 0.03 0.51 0.84 0.00 -0.57 0.00 0.00 34.95 35.76 2kfb s ARG 153 CO 0.09 -0.46 1.79 0.10 -1.08 0.00 0.00 175.30 175.74 2kfb h TYR 154 N 2.31 0.00 0.00 5.89 -0.00 -1.85 -3.05 116.97 120.27 2kfb h TYR 154 Ca -0.33 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.40 2kfb h TYR 154 Cb 1.27 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 38.00 2kfb h TYR 154 CO 0.30 0.06 0.00 1.96 -0.00 0.00 0.00 178.16 180.48 2kfb h GLN 155 N 0.00 0.00 -0.42 0.10 4.20 -1.93 -3.02 115.11 114.05 2kfb h GLN 155 Ca -0.00 0.00 0.08 0.00 0.06 0.00 0.00 58.65 58.79 2kfb h GLN 155 Cb 0.78 0.00 -0.08 0.00 0.30 0.00 0.00 27.48 28.48 2kfb h GLN 155 CO 0.01 0.00 -0.11 0.22 -0.67 0.00 0.00 178.83 178.28 2kfb h ASP 156 N 0.00 -0.41 -0.46 1.46 1.82 -1.93 0.12 116.42 117.01 2kfb h ASP 156 Ca 0.00 0.13 -0.06 0.00 -0.39 0.00 0.00 57.03 56.71 2kfb h ASP 156 Cb 0.41 0.27 -0.03 0.00 0.68 0.00 0.00 39.33 40.66 2kfb h ASP 156 CO 0.00 -0.15 0.07 -2.67 -1.61 0.00 0.00 179.24 174.89 2kfb n TRP 157 N -5.32 1.63 -3.25 0.28 2.14 -1.19 -4.94 117.44 106.79 2kfb n TRP 157 Ca 0.03 -0.67 -0.16 0.00 2.07 0.00 0.00 57.50 58.77 2kfb n TRP 157 Cb 0.23 -0.46 0.01 0.00 -0.81 0.00 0.00 31.31 30.29 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 0.28 -0.97 3.43 -1.67 0.00 0.41 -4.89 105.19 101.79 2kfb n GLY 158 Ca 0.24 0.89 -0.30 0.00 0.00 0.00 0.00 46.02 46.85 2kfb n GLY 158 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2kfb s ALA 159 N -2.55 2.51 -0.22 4.61 0.00 -1.15 -5.02 121.76 119.95 2kfb s ALA 159 Ca 0.16 -1.33 0.26 0.00 0.00 0.00 0.00 51.96 51.05 2kfb s ALA 159 Cb -0.03 -0.57 0.68 0.00 0.00 0.00 0.00 23.12 23.19 2kfb s ALA 159 CO 0.81 0.56 1.73 0.00 0.00 0.00 0.00 175.76 178.87 2kfb h THR 160 N 3.84 0.08 -1.99 0.00 1.03 -1.95 -3.43 112.91 110.50 2kfb h THR 160 Ca -0.49 -0.93 0.00 0.00 -0.01 0.00 0.00 66.41 64.98 2kfb h THR 160 Cb 1.16 1.86 -0.00 0.00 -1.07 0.00 0.00 68.15 70.10 2kfb h THR 160 CO 0.44 0.04 0.04 0.59 -0.01 0.00 0.00 175.52 176.62 2kfb n ASN 161 N -3.12 -0.23 -0.00 0.00 5.03 -1.26 -5.04 115.26 110.64 2kfb n ASN 161 Ca 0.03 -1.15 0.06 0.00 0.87 0.00 0.00 54.58 54.38 2kfb n ASN 161 Cb 0.47 0.38 -0.07 0.00 -1.02 0.00 0.00 39.78 39.53 2kfb n ASN 161 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2kfb n ALA 162 N -2.75 3.46 -1.62 5.41 0.00 -1.26 -4.94 120.51 118.81 2kfb n ALA 162 Ca -0.02 -0.33 -0.57 0.00 0.00 0.00 0.00 53.44 52.52 2kfb n ALA 162 Cb 0.06 -0.43 -0.08 0.00 0.00 0.00 0.00 19.45 19.00 2kfb n ALA 162 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2kfb n ARG 163 N -1.33 0.95 -4.09 0.00 1.74 -1.26 -0.83 116.66 111.84 2kfb n ARG 163 Ca 0.02 0.33 -0.24 0.00 -0.77 0.00 0.00 57.85 57.18 2kfb n ARG 163 Cb 0.20 -2.08 -0.17 0.00 -1.02 0.00 0.00 32.46 29.39 2kfb n ARG 163 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2kfb s VAL 164 N 4.53 0.86 -0.11 1.55 1.01 -0.36 -4.44 120.40 123.45 2kfb s VAL 164 Ca 1.03 -0.24 0.20 0.00 0.00 0.00 0.00 61.98 62.97 2kfb s VAL 164 Cb -1.10 -0.88 -0.30 0.00 0.00 0.00 0.00 36.38 34.11 2kfb s VAL 164 CO 0.64 0.32 0.29 0.61 0.00 0.00 0.00 175.10 176.96 2kfb n GLY 165 N 4.54 -1.00 0.38 4.51 0.00 0.11 -4.60 105.19 109.13 2kfb n GLY 165 Ca -0.16 -0.44 -0.01 0.00 0.00 0.00 0.00 46.02 45.41 2kfb n GLY 165 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2kfb n SER 166 N -2.48 -0.23 -3.63 1.61 7.64 -1.13 -1.44 113.62 113.94 2kfb n SER 166 Ca -0.17 -1.16 -0.07 0.00 1.01 0.00 0.00 58.87 58.48 2kfb n SER 166 Cb 0.84 0.39 -0.07 0.00 -1.01 0.00 0.00 64.21 64.36 2kfb n SER 166 CO 0.00 0.00 0.00 -1.48 -3.01 0.00 0.00 175.04 170.55 2kfb s LEU 167 N 0.00 -0.27 0.17 -3.43 0.05 -0.92 -2.47 118.68 111.80 2kfb s LEU 167 Ca 0.02 0.48 0.03 0.00 0.05 0.00 0.00 54.13 54.71 2kfb s LEU 167 Cb -0.00 1.55 -0.05 0.00 -2.05 0.00 0.00 46.19 45.64 2kfb s LEU 167 CO 0.01 -0.12 -0.04 0.00 -0.55 0.00 0.00 176.35 175.65 2kfb s ARG 168 N -0.12 1.12 0.22 1.48 1.70 0.13 0.21 118.95 123.69 2kfb s ARG 168 Ca 0.04 -1.52 -0.02 0.00 -0.47 0.00 0.00 55.73 53.77 2kfb s ARG 168 Cb -0.04 -0.47 -0.05 0.00 -0.57 0.00 0.00 34.95 33.83 2kfb s ARG 168 CO -0.08 -0.04 0.43 -0.98 -1.08 0.00 0.00 175.30 173.55 2kfb s ARG 169 N -3.84 3.56 -0.98 3.89 1.04 -1.26 0.31 118.95 121.67 2kfb s ARG 169 Ca 0.21 -0.23 -0.19 0.00 -1.04 0.00 0.00 55.73 54.48 2kfb s ARG 169 Cb 0.05 -2.79 0.13 0.00 -2.04 0.00 0.00 34.95 30.30 2kfb s ARG 169 CO 0.03 0.35 1.21 0.08 -0.04 0.00 0.00 175.30 176.94 2kfb s VAL 170 N -1.91 4.66 -0.05 4.99 1.01 -0.62 -4.88 120.40 123.59 2kfb s VAL 170 Ca 0.40 -1.62 -0.01 0.00 0.00 0.00 0.00 61.98 60.75 2kfb s VAL 170 Cb -0.11 -4.84 0.03 0.00 0.00 0.00 0.00 36.38 31.46 2kfb s VAL 170 CO 0.29 -1.58 0.01 -0.63 0.00 0.00 0.00 175.10 173.19 2kfb s ILE 171 N 2.84 0.22 0.23 2.22 1.09 -1.26 -4.70 121.20 121.84 2kfb s ILE 171 Ca 0.36 0.17 0.00 0.00 -1.10 0.00 0.00 60.65 60.08 2kfb s ILE 171 Cb -0.04 -0.38 -0.02 0.00 -1.06 0.00 0.00 42.46 40.97 2kfb s ILE 171 CO -0.08 0.21 1.58 -2.24 -0.10 0.00 0.00 174.94 174.31 2kfb h ASP 172 N 8.00 0.51 -3.35 3.58 2.03 -1.93 -3.45 116.42 121.81 2kfb h ASP 172 Ca -0.25 -0.24 -0.42 0.00 -0.73 0.00 0.00 57.03 55.39 2kfb h ASP 172 Cb 1.13 -0.14 0.20 0.00 -0.83 0.00 0.00 39.33 39.68 2kfb h ASP 172 CO 0.30 0.90 0.03 -0.36 -1.03 0.00 0.00 179.24 179.09 2kfb s PHE 173 N -4.10 0.86 0.00 4.15 0.08 -1.26 -4.79 117.98 112.93 2kfb s PHE 173 Ca -0.06 0.85 0.00 0.00 0.12 0.00 0.00 56.93 57.84 2kfb s PHE 173 Cb 0.12 -3.14 0.00 0.00 -0.57 0.00 0.00 43.02 39.43 2kfb s PHE 173 CO 0.82 -3.99 0.00 0.45 -0.10 0.00 0.00 175.22 172.39