#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xkb s VAL 17 N 0.00 4.84 0.00 1.39 1.01 0.11 -3.83 120.40 123.92 1xkb s VAL 17 Ca 0.00 0.01 0.00 0.00 0.00 0.00 0.00 61.98 61.99 1xkb s VAL 17 Cb 0.00 -3.28 0.00 0.00 0.00 0.00 0.00 36.38 33.10 1xkb s VAL 17 CO 0.00 0.29 0.00 0.61 0.00 0.00 0.00 175.10 176.00 1xkb n GLY 18 N 4.98 -0.52 7.00 4.51 0.00 -1.26 -1.35 105.19 118.55 1xkb n GLY 18 Ca -0.15 -1.40 0.00 0.00 0.00 0.00 0.00 46.02 44.47 1xkb n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xkb n GLY 19 N 0.00 0.94 3.82 -0.02 0.00 -1.26 -4.89 105.19 103.77 1xkb n GLY 19 Ca 0.00 -0.67 -0.07 0.00 0.00 0.00 0.00 46.02 45.27 1xkb n GLY 19 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1xkb s GLN 20 N 0.00 1.79 0.28 1.61 -2.07 -0.46 -4.98 119.66 115.83 1xkb s GLN 20 Ca 0.00 -1.06 -0.29 0.00 -1.82 0.00 0.00 55.36 52.19 1xkb s GLN 20 Cb 0.00 0.59 -0.09 0.00 -1.09 0.00 0.00 33.01 32.42 1xkb s GLN 20 CO 0.00 -0.81 1.12 -1.21 -1.32 0.00 0.00 175.29 173.07 1xkb s GLU 21 N -3.82 4.61 0.34 9.60 2.02 -1.26 0.44 118.70 130.63 1xkb s GLU 21 Ca 0.13 1.83 -0.28 0.00 0.02 0.00 0.00 54.97 56.67 1xkb s GLU 21 Cb -0.05 -3.19 -0.10 0.00 0.10 0.00 0.00 34.13 30.90 1xkb s GLU 21 CO 0.08 0.17 1.20 0.00 0.02 0.00 0.00 175.26 176.73 1xkb s LYS 23 N -1.83 2.20 0.39 0.00 1.02 -1.26 -4.92 119.74 115.34 1xkb s LYS 23 Ca 0.50 0.20 -0.27 0.00 0.02 0.00 0.00 55.97 56.42 1xkb s LYS 23 Cb -0.35 -1.97 -0.11 0.00 -0.52 0.00 0.00 37.83 34.89 1xkb s LYS 23 CO 0.45 -1.45 1.34 -3.47 -0.92 0.00 0.00 175.35 171.30 1xkb n ASP 24 N -3.23 2.95 -2.05 2.83 -0.08 -1.26 -1.53 116.55 114.17 1xkb n ASP 24 Ca 0.08 1.17 -0.16 0.00 -1.51 0.00 0.00 54.79 54.37 1xkb n ASP 24 Cb 0.60 -1.53 -0.03 0.00 2.34 0.00 0.00 41.12 42.50 1xkb n ASP 24 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1xkb n GLY 25 N 0.70 0.27 0.11 0.27 0.00 -1.26 -4.85 105.19 100.43 1xkb n GLY 25 Ca 0.05 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.93 1xkb n GLY 25 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1xkb n GLU 26 N -2.56 0.68 -2.97 1.61 2.13 -0.58 -4.53 120.64 114.42 1xkb n GLU 26 Ca -0.18 0.17 -0.21 0.00 0.66 0.00 0.00 57.16 57.60 1xkb n GLU 26 Cb 0.59 -1.64 -0.02 0.00 0.27 0.00 0.00 31.44 30.64 1xkb n GLU 26 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1xkb h PRO 28 N 2.95 0.00 -0.59 0.00 0.13 -1.79 -2.72 132.00 129.97 1xkb h PRO 28 Ca 0.11 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.24 1xkb h PRO 28 Cb 0.81 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.94 1xkb h PRO 28 CO 0.66 0.00 0.00 -2.67 -0.23 0.00 0.00 178.00 175.76 1xkb n TRP 29 N -2.34 0.90 -3.14 1.56 2.14 -1.06 -1.86 117.44 113.64 1xkb n TRP 29 Ca 0.00 -0.36 -0.40 0.00 2.07 0.00 0.00 57.50 58.81 1xkb n TRP 29 Cb 0.13 -0.17 -0.07 0.00 -0.81 0.00 0.00 31.31 30.40 1xkb n TRP 29 CO 0.00 0.00 0.00 -1.14 2.07 0.00 0.00 177.69 178.62 1xkb s GLN 30 N -1.72 4.10 0.42 -2.67 2.00 -1.03 -1.48 119.66 119.29 1xkb s GLN 30 Ca 0.30 0.50 0.07 0.00 -2.00 0.00 0.00 55.36 54.24 1xkb s GLN 30 Cb 0.20 -3.65 -0.03 0.00 0.80 0.00 0.00 33.01 30.33 1xkb s GLN 30 CO 0.15 -0.40 0.33 0.00 -0.50 0.00 0.00 175.29 174.87 1xkb s ALA 31 N 2.45 3.96 -0.11 1.58 0.00 -1.10 -4.38 121.76 124.17 1xkb s ALA 31 Ca 0.25 -1.92 -0.05 0.00 0.00 0.00 0.00 51.96 50.24 1xkb s ALA 31 Cb -0.16 -0.84 0.05 0.00 0.00 0.00 0.00 23.12 22.17 1xkb s ALA 31 CO 0.09 -0.22 0.24 -1.17 0.00 0.00 0.00 175.76 174.69 1xkb s LEU 32 N -4.08 0.08 -0.22 0.00 2.96 0.38 -2.80 118.68 115.00 1xkb s LEU 32 Ca 0.46 0.53 -0.22 0.00 -0.22 0.00 0.00 54.13 54.67 1xkb s LEU 32 Cb -0.01 0.67 -0.02 0.00 0.50 0.00 0.00 46.19 47.33 1xkb s LEU 32 CO 0.26 -0.20 0.72 -0.76 -1.32 0.00 0.00 176.35 175.05 1xkb s LEU 33 N 1.83 4.11 -0.09 -0.68 1.43 0.62 0.64 118.68 126.53 1xkb s LEU 33 Ca -0.04 0.91 -0.01 0.00 -1.03 0.00 0.00 54.13 53.96 1xkb s LEU 33 Cb -0.11 -3.02 -0.03 0.00 0.03 0.00 0.00 46.19 43.06 1xkb s LEU 33 CO -0.08 -0.39 -0.04 0.27 0.23 0.00 0.00 176.35 176.34 1xkb s ILE 34 N 2.39 3.99 0.00 -0.59 -4.36 -1.03 0.11 121.20 121.70 1xkb s ILE 34 Ca 0.31 -0.37 0.00 0.00 -0.26 0.00 0.00 60.65 60.34 1xkb s ILE 34 Cb -0.16 -2.66 0.00 0.00 1.25 0.00 0.00 42.46 40.89 1xkb s ILE 34 CO 0.09 0.59 0.00 -0.46 0.24 0.00 0.00 174.94 175.40 1xkb n ASN 35 N 2.34 -0.05 0.08 4.36 0.23 0.50 -1.93 115.26 120.78 1xkb n ASN 35 Ca -0.18 -0.58 0.08 0.00 -0.53 0.00 0.00 54.58 53.37 1xkb n ASN 35 Cb 0.53 0.00 0.53 0.00 -2.08 0.00 0.00 39.78 38.76 1xkb n ASN 35 CO 0.00 0.00 0.00 1.05 -0.93 0.00 0.00 177.26 177.38 1xkb h GLU 36 N 0.00 0.29 -0.80 -3.83 9.09 -1.86 -0.38 114.58 117.10 1xkb h GLU 36 Ca 0.00 -0.02 -0.04 0.00 0.05 0.00 0.00 59.36 59.36 1xkb h GLU 36 Cb 0.00 -0.07 -0.02 0.00 -1.65 0.00 0.00 28.75 27.01 1xkb h GLU 36 CO 0.00 0.19 0.05 0.39 0.05 0.00 0.00 179.01 179.69 1xkb n GLU 37 N -4.49 3.02 -1.85 1.06 -0.58 -1.26 -4.85 120.64 111.69 1xkb n GLU 37 Ca 0.02 -1.76 -0.16 0.00 -0.42 0.00 0.00 57.16 54.84 1xkb n GLU 37 Cb 0.15 -1.90 -0.04 0.00 -0.57 0.00 0.00 31.44 29.08 1xkb n GLU 37 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 1xkb n ASN 38 N 0.25 -4.45 -4.63 1.62 3.02 -0.15 -4.91 115.26 106.01 1xkb n ASN 38 Ca 0.18 0.28 -0.40 0.00 -0.03 0.00 0.00 54.58 54.61 1xkb n ASN 38 Cb 0.83 -3.92 -0.07 0.00 -0.61 0.00 0.00 39.78 36.02 1xkb n ASN 38 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 1xkb s GLU 39 N -4.03 4.11 0.23 3.52 2.02 -1.26 -4.74 118.70 118.55 1xkb s GLU 39 Ca 0.00 0.49 -0.31 0.00 0.02 0.00 0.00 54.97 55.18 1xkb s GLU 39 Cb 0.00 -3.64 -0.11 0.00 0.10 0.00 0.00 34.13 30.48 1xkb s GLU 39 CO 0.00 -0.38 1.56 0.20 0.02 0.00 0.00 175.26 176.66 1xkb s GLY 40 N 1.47 1.89 0.00 -1.39 0.00 -1.26 -0.37 107.32 107.65 1xkb s GLY 40 Ca 0.25 1.44 0.00 0.00 0.00 0.00 0.00 44.72 46.41 1xkb s GLY 40 CO 0.09 2.54 0.01 1.97 0.00 0.00 0.00 173.10 177.71 1xkb n PHE 41 N 2.99 0.00 -3.43 1.90 1.16 0.12 -4.89 117.46 115.32 1xkb n PHE 41 Ca 0.10 0.00 -0.12 0.00 -1.87 0.00 0.00 57.45 55.56 1xkb n PHE 41 Cb 0.38 0.00 -0.02 0.00 -1.61 0.00 0.00 39.48 38.23 1xkb n PHE 41 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 1xkb s GLY 43 N -2.64 1.99 0.39 0.00 0.00 0.71 -0.28 107.32 107.49 1xkb s GLY 43 Ca 0.00 -1.79 -0.15 0.00 0.00 0.00 0.00 44.72 42.78 1xkb s GLY 43 CO -0.11 -1.77 0.78 -0.32 0.00 0.00 0.00 173.10 171.68 1xkb s GLY 44 N -4.48 0.47 -0.12 0.20 0.00 -1.12 -3.04 107.32 99.24 1xkb s GLY 44 Ca 0.51 -0.83 -0.01 0.00 0.00 0.00 0.00 44.72 44.39 1xkb s GLY 44 CO 0.32 -0.37 -0.03 -1.59 0.00 0.00 0.00 173.10 171.42 1xkb s THR 45 N -2.26 0.77 0.01 0.90 2.01 0.58 -2.70 115.64 114.95 1xkb s THR 45 Ca 0.17 -0.24 -0.30 0.00 0.31 0.00 0.00 61.69 61.63 1xkb s THR 45 Cb -0.05 -0.91 -0.08 0.00 0.01 0.00 0.00 72.50 71.47 1xkb s THR 45 CO 0.12 0.23 1.81 -0.63 -0.69 0.00 0.00 174.62 175.46 1xkb s ILE 46 N 1.80 3.23 -0.16 1.82 1.01 -0.55 -0.58 121.20 127.77 1xkb s ILE 46 Ca 0.04 0.34 0.18 0.00 0.00 0.00 0.00 60.65 61.21 1xkb s ILE 46 Cb -0.13 -3.22 -0.25 0.00 0.01 0.00 0.00 42.46 38.86 1xkb s ILE 46 CO -0.07 -0.03 0.21 0.18 0.00 0.00 0.00 174.94 175.24 1xkb n LEU 47 N 7.12 0.12 0.00 2.97 4.77 -0.67 -2.37 117.00 128.94 1xkb n LEU 47 Ca 0.18 0.06 -0.01 0.00 -0.03 0.00 0.00 56.01 56.21 1xkb n LEU 47 Cb 0.42 0.39 0.00 0.00 -2.33 0.00 0.00 43.42 41.90 1xkb n LEU 47 CO 0.65 0.41 0.14 -1.54 -1.33 0.00 0.00 177.39 175.72 1xkb n SER 48 N -2.72 -0.36 0.05 -1.43 3.41 -1.16 -4.67 113.62 106.75 1xkb n SER 48 Ca -0.27 -1.21 0.09 0.00 -0.26 0.00 0.00 58.87 57.23 1xkb n SER 48 Cb 1.06 0.58 0.40 0.00 -0.26 0.00 0.00 64.21 65.99 1xkb n SER 48 CO 0.00 0.00 0.00 -1.84 -0.16 0.00 0.00 175.04 173.04 1xkb n GLU 49 N -0.13 0.09 0.00 4.33 0.28 -1.26 -3.79 120.64 120.16 1xkb n GLU 49 Ca -0.01 0.30 0.00 0.00 -0.16 0.00 0.00 57.16 57.29 1xkb n GLU 49 Cb 0.11 -1.66 0.00 0.00 1.43 0.00 0.00 31.44 31.32 1xkb n GLU 49 CO 0.00 0.00 0.00 1.19 -0.16 0.00 0.00 177.13 178.16 1xkb n PHE 50 N -1.82 0.00 -4.26 -1.84 3.72 -1.26 0.86 117.46 112.86 1xkb n PHE 50 Ca 0.03 0.00 -0.32 0.00 -0.05 0.00 0.00 57.45 57.11 1xkb n PHE 50 Cb 0.21 0.00 -0.09 0.00 -0.94 0.00 0.00 39.48 38.67 1xkb n PHE 50 CO 0.00 0.00 0.00 0.71 -0.05 0.00 0.00 176.76 177.42 1xkb s TYR 51 N -1.79 3.07 -0.09 1.38 1.51 -1.25 0.41 117.35 120.59 1xkb s TYR 51 Ca 0.00 0.07 0.02 0.00 -1.01 0.00 0.00 57.07 56.14 1xkb s TYR 51 Cb 0.00 -1.65 0.01 0.00 -0.11 0.00 0.00 41.96 40.21 1xkb s TYR 51 CO 0.00 0.46 -0.14 0.42 -1.11 0.00 0.00 175.55 175.19 1xkb s ILE 52 N -1.12 1.35 0.01 2.71 -1.09 -0.57 -1.67 121.20 120.83 1xkb s ILE 52 Ca 0.20 -0.56 -0.21 0.00 -2.23 0.00 0.00 60.65 57.85 1xkb s ILE 52 Cb -0.12 -1.24 -0.05 0.00 -1.58 0.00 0.00 42.46 39.47 1xkb s ILE 52 CO 0.11 0.41 0.63 -0.22 -1.23 0.00 0.00 174.94 174.64 1xkb s LEU 53 N 0.94 4.43 0.32 2.97 2.96 0.26 -1.34 118.68 129.22 1xkb s LEU 53 Ca -0.08 1.23 -0.07 0.00 -0.22 0.00 0.00 54.13 54.99 1xkb s LEU 53 Cb -0.15 -2.99 0.01 0.00 0.50 0.00 0.00 46.19 43.56 1xkb s LEU 53 CO -0.00 0.10 0.51 0.28 -1.32 0.00 0.00 176.35 175.92 1xkb s THR 54 N -0.24 0.00 0.21 3.68 -1.32 -0.32 -0.31 115.64 117.34 1xkb s THR 54 Ca 0.32 -1.47 -0.15 0.00 -1.21 0.00 0.00 61.69 59.18 1xkb s THR 54 Cb -0.19 -2.55 -0.08 0.00 -1.51 0.00 0.00 72.50 68.18 1xkb s THR 54 CO 0.19 0.00 0.62 0.00 -2.21 0.00 0.00 174.62 173.22 1xkb s ALA 55 N -3.25 3.49 0.18 11.08 0.00 -1.26 0.16 121.76 132.16 1xkb s ALA 55 Ca 0.26 -0.06 -0.10 0.00 0.00 0.00 0.00 51.96 52.06 1xkb s ALA 55 Cb -0.01 -2.61 0.07 0.00 0.00 0.00 0.00 23.12 20.57 1xkb s ALA 55 CO 0.16 0.42 1.66 0.00 0.00 0.00 0.00 175.76 177.99 1xkb h ALA 56 N 3.11 0.82 0.00 0.00 0.00 -1.72 -2.77 119.26 118.70 1xkb h ALA 56 Ca -0.48 -0.28 -0.00 0.00 0.00 0.00 0.00 54.91 54.15 1xkb h ALA 56 Cb 1.19 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.75 1xkb h ALA 56 CO 0.66 0.61 -0.01 1.12 0.00 0.00 0.00 179.25 181.63 1xkb h HIS 57 N 0.94 0.00 0.00 0.00 2.07 -1.92 -0.10 115.15 116.14 1xkb h HIS 57 Ca 0.18 0.00 -0.01 0.00 -2.85 0.00 0.00 60.37 57.69 1xkb h HIS 57 Cb 0.48 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 30.46 1xkb h HIS 57 CO 0.04 0.01 -0.04 0.00 -3.07 0.00 0.00 177.93 174.87 1xkb n LEU 59 N -3.14 0.10 -0.91 0.00 4.77 -0.05 -2.83 117.00 114.94 1xkb n LEU 59 Ca 0.01 0.53 -0.00 0.00 -0.03 0.00 0.00 56.01 56.52 1xkb n LEU 59 Cb 0.36 -0.52 0.19 0.00 -2.33 0.00 0.00 43.42 41.12 1xkb n LEU 59 CO 0.29 -0.33 0.46 -1.22 -1.33 0.00 0.00 177.39 175.26 1xkb n TYR 60 N -1.61 0.59 -1.67 -1.77 4.01 -0.98 -4.64 117.16 111.08 1xkb n TYR 60 Ca 0.03 -1.61 0.05 0.00 -0.16 0.00 0.00 57.90 56.21 1xkb n TYR 60 Cb 0.16 -0.35 0.10 0.00 -0.31 0.00 0.00 39.34 38.94 1xkb n TYR 60 CO 0.00 0.00 0.00 1.04 -0.46 0.00 0.00 176.86 177.44 1xkb n GLN 61 N -1.09 0.79 -3.64 -0.72 6.02 -1.13 -5.02 117.38 112.58 1xkb n GLN 61 Ca 0.26 -2.21 -0.03 0.00 -0.01 0.00 0.00 57.00 55.00 1xkb n GLN 61 Cb 0.82 -1.01 -0.07 0.00 1.02 0.00 0.00 30.24 31.01 1xkb n GLN 61 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1xkb s ALA 61 N -1.70 -2.24 0.23 -1.58 0.00 -1.26 -5.02 121.76 110.19 1xkb s ALA 61 Ca 0.25 2.08 -0.03 0.00 0.00 0.00 0.00 51.96 54.26 1xkb s ALA 61 Cb 0.24 -1.68 0.24 0.00 0.00 0.00 0.00 23.12 21.92 1xkb s ALA 61 CO -0.03 -0.30 1.67 0.87 0.00 0.00 0.00 175.76 177.96 1xkb h LYS 62 N 5.37 0.74 -3.07 0.00 1.57 -1.95 -3.43 116.57 115.79 1xkb h LYS 62 Ca -0.28 -0.28 -0.20 0.00 -1.87 0.00 0.00 60.65 58.02 1xkb h LYS 62 Cb 1.19 -0.05 -0.30 0.00 0.08 0.00 0.00 32.23 33.15 1xkb h LYS 62 CO 0.18 0.87 -0.50 1.03 -0.57 0.00 0.00 179.45 180.46 1xkb s ARG 63 N -4.66 0.19 0.13 3.15 0.52 -1.26 -5.11 118.95 111.91 1xkb s ARG 63 Ca -0.09 0.49 0.01 0.00 -0.52 0.00 0.00 55.73 55.62 1xkb s ARG 63 Cb 0.13 -0.12 -0.04 0.00 0.52 0.00 0.00 34.95 35.44 1xkb s ARG 63 CO 0.82 -0.16 -0.02 -0.59 0.02 0.00 0.00 175.30 175.38 1xkb s PHE 64 N 1.19 1.00 0.33 -0.53 -0.12 -1.26 -2.97 117.98 115.62 1xkb s PHE 64 Ca -0.09 -1.02 0.03 0.00 -0.05 0.00 0.00 56.93 55.81 1xkb s PHE 64 Cb -0.10 -0.58 -0.01 0.00 -0.63 0.00 0.00 43.02 41.70 1xkb s PHE 64 CO -0.08 -0.24 0.10 1.63 -0.05 0.00 0.00 175.22 176.58 1xkb n LYS 65 N -0.12 0.70 -3.99 1.99 5.02 -0.81 -4.53 118.16 116.41 1xkb n LYS 65 Ca -0.09 -2.77 -0.30 0.00 -2.02 0.00 0.00 58.31 53.13 1xkb n LYS 65 Cb 0.62 1.41 -0.16 0.00 -0.02 0.00 0.00 35.03 36.88 1xkb n LYS 65 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1xkb s VAL 66 N -2.73 1.51 -0.23 -0.18 1.01 -0.32 -2.45 120.40 117.02 1xkb s VAL 66 Ca 0.14 -0.78 -0.07 0.00 0.00 0.00 0.00 61.98 61.27 1xkb s VAL 66 Cb 0.01 -1.54 -0.03 0.00 0.00 0.00 0.00 36.38 34.82 1xkb s VAL 66 CO 0.10 0.28 0.06 -0.60 0.00 0.00 0.00 175.10 174.94 1xkb s ARG 67 N 1.48 3.71 0.33 2.72 3.52 0.21 -0.78 118.95 130.14 1xkb s ARG 67 Ca 0.02 -0.46 0.10 0.00 -0.13 0.00 0.00 55.73 55.25 1xkb s ARG 67 Cb -0.15 -3.25 -0.06 0.00 -1.56 0.00 0.00 34.95 29.93 1xkb s ARG 67 CO -0.09 -0.05 -0.11 0.14 -0.81 0.00 0.00 175.30 174.38 1xkb s VAL 68 N 1.23 2.21 0.00 7.11 -7.23 -0.73 -0.47 120.40 122.53 1xkb s VAL 68 Ca 0.04 -2.22 0.00 0.00 -1.81 0.00 0.00 61.98 57.99 1xkb s VAL 68 Cb -0.14 -2.58 0.00 0.00 0.56 0.00 0.00 36.38 34.22 1xkb s VAL 68 CO 0.03 -0.24 0.00 0.61 -0.31 0.00 0.00 175.10 175.19 1xkb n GLY 69 N -0.75 2.52 3.74 2.32 0.00 -1.24 -1.78 105.19 110.00 1xkb n GLY 69 Ca -0.05 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.56 1xkb n GLY 69 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1xkb s ASP 70 N -2.15 6.98 0.00 1.61 2.15 -1.26 -4.34 116.67 119.66 1xkb s ASP 70 Ca 0.00 2.33 0.00 0.00 0.43 0.00 0.00 52.55 55.31 1xkb s ASP 70 Cb 0.00 -2.61 0.00 0.00 -0.30 0.00 0.00 42.92 40.01 1xkb s ASP 70 CO 0.00 -0.46 0.12 0.54 -0.17 0.00 0.00 175.17 175.20 1xkb n ARG 71 N 2.58 0.45 -3.30 4.34 1.74 -1.26 -4.86 116.66 116.35 1xkb n ARG 71 Ca 0.05 -0.12 -0.08 0.00 -0.77 0.00 0.00 57.85 56.93 1xkb n ARG 71 Cb 0.44 -0.53 -0.06 0.00 -1.02 0.00 0.00 32.46 31.29 1xkb n ARG 71 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 1xkb s ASN 72 N -0.10 0.25 0.55 0.55 3.84 -1.25 -1.82 114.94 116.96 1xkb s ASN 72 Ca 0.00 -0.26 0.25 0.00 0.21 0.00 0.00 52.86 53.06 1xkb s ASN 72 Cb 0.00 1.17 1.49 0.00 -0.55 0.00 0.00 41.25 43.36 1xkb s ASN 72 CO 0.00 -0.34 2.08 0.71 -2.79 0.00 0.00 177.10 176.76 1xkb h THR 73 N 6.15 0.68 0.02 -5.21 1.35 -0.48 -3.23 112.91 112.19 1xkb h THR 73 Ca -0.10 0.00 -0.00 0.00 -0.55 0.00 0.00 66.41 65.76 1xkb h THR 73 Cb 1.13 0.85 0.00 0.00 -1.73 0.00 0.00 68.15 68.40 1xkb h THR 73 CO 0.26 0.00 -0.01 -0.33 -0.25 0.00 0.00 175.52 175.19 1xkb h GLU 74 N 0.00 -0.02 -5.49 4.72 5.08 -1.93 -3.45 114.58 113.49 1xkb h GLU 74 Ca 0.12 0.00 -0.59 0.00 -1.00 0.00 0.00 59.36 57.89 1xkb h GLU 74 Cb 0.52 0.00 -0.10 0.00 0.50 0.00 0.00 28.75 29.68 1xkb h GLU 74 CO -0.00 0.53 -0.32 -0.65 -1.00 0.00 0.00 179.01 177.57 1xkb s GLN 75 N -2.08 4.26 -1.59 2.33 -1.52 -1.22 -4.99 119.66 114.84 1xkb s GLN 75 Ca -0.11 0.10 -0.11 0.00 -1.95 0.00 0.00 55.36 53.29 1xkb s GLN 75 Cb -0.01 -3.43 -0.06 0.00 -0.22 0.00 0.00 33.01 29.29 1xkb s GLN 75 CO 0.40 0.23 2.80 0.39 -0.25 0.00 0.00 175.29 178.86 1xkb n GLU 76 N 3.61 3.55 -0.34 2.91 -0.58 -1.26 -4.69 120.64 123.83 1xkb n GLU 76 Ca -0.12 -2.31 0.30 0.00 -0.42 0.00 0.00 57.16 54.61 1xkb n GLU 76 Cb 0.52 -2.90 0.63 0.00 -0.57 0.00 0.00 31.44 29.12 1xkb n GLU 76 CO 0.00 0.00 0.00 0.93 -0.48 0.00 0.00 177.13 177.58 1xkb h GLU 77 N 5.20 0.19 0.00 3.49 3.07 -1.94 -3.47 114.58 121.12 1xkb h GLU 77 Ca 0.81 -0.01 0.00 0.00 -0.50 0.00 0.00 59.36 59.66 1xkb h GLU 77 Cb 0.36 -0.04 0.00 0.00 -0.84 0.00 0.00 28.75 28.22 1xkb h GLU 77 CO 1.80 0.12 0.00 0.41 -1.40 0.00 0.00 179.01 179.95 1xkb n GLY 78 N -1.60 -0.01 3.09 -3.84 0.00 -1.26 -4.97 105.19 96.59 1xkb n GLY 78 Ca 0.27 -1.86 0.00 0.00 0.00 0.00 0.00 46.02 44.43 1xkb n GLY 78 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xkb n GLY 79 N 0.00 0.00 3.12 -0.02 0.00 -1.26 -4.81 105.19 102.22 1xkb n GLY 79 Ca 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.76 1xkb n GLY 79 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1xkb n GLU 80 N 0.23 0.90 -3.56 1.61 0.28 -1.26 -4.64 120.64 114.20 1xkb n GLU 80 Ca 0.00 -3.05 -0.15 0.00 -0.16 0.00 0.00 57.16 53.80 1xkb n GLU 80 Cb 0.32 0.65 -0.06 0.00 1.43 0.00 0.00 31.44 33.78 1xkb n GLU 80 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1xkb s ALA 81 N -2.71 -1.83 -0.16 -1.84 0.00 -0.73 -4.98 121.76 109.50 1xkb s ALA 81 Ca 0.09 1.53 -0.02 0.00 0.00 0.00 0.00 51.96 53.57 1xkb s ALA 81 Cb -0.01 -0.47 -0.01 0.00 0.00 0.00 0.00 23.12 22.63 1xkb s ALA 81 CO 0.06 -0.34 -0.09 0.08 0.00 0.00 0.00 175.76 175.47 1xkb s VAL 82 N -0.84 3.22 0.02 0.00 1.01 -1.26 -1.77 120.40 120.77 1xkb s VAL 82 Ca -0.06 -0.58 0.07 0.00 0.00 0.00 0.00 61.98 61.41 1xkb s VAL 82 Cb -0.01 -2.40 -0.03 0.00 0.00 0.00 0.00 36.38 33.94 1xkb s VAL 82 CO 0.05 0.49 -0.19 -1.00 0.00 0.00 0.00 175.10 174.45 1xkb s HIS 83 N 0.74 2.52 -0.01 5.22 3.76 0.04 -4.92 115.29 122.64 1xkb s HIS 83 Ca -0.04 -0.28 -0.21 0.00 -0.15 0.00 0.00 55.06 54.38 1xkb s HIS 83 Cb -0.15 -1.49 -0.05 0.00 1.11 0.00 0.00 32.58 32.00 1xkb s HIS 83 CO 0.02 0.18 0.61 -1.21 -0.85 0.00 0.00 174.74 173.49 1xkb s GLU 84 N -1.16 4.34 -0.34 1.40 2.02 -1.26 -1.17 118.70 122.53 1xkb s GLU 84 Ca 0.13 0.75 -0.29 0.00 0.02 0.00 0.00 54.97 55.59 1xkb s GLU 84 Cb -0.10 -3.35 -0.00 0.00 0.10 0.00 0.00 34.13 30.77 1xkb s GLU 84 CO 0.03 0.33 1.45 0.08 0.02 0.00 0.00 175.26 177.17 1xkb s VAL 85 N -0.08 3.89 -0.01 2.63 1.01 -1.26 -0.21 120.40 126.37 1xkb s VAL 85 Ca 0.32 0.96 -0.25 0.00 0.00 0.00 0.00 61.98 63.00 1xkb s VAL 85 Cb -0.18 -4.06 -0.20 0.00 0.00 0.00 0.00 36.38 31.95 1xkb s VAL 85 CO 0.17 -0.57 1.28 -0.08 0.00 0.00 0.00 175.10 175.90 1xkb h GLU 86 N 10.54 -0.04 -3.78 2.72 4.81 -0.76 -3.45 114.58 124.61 1xkb h GLU 86 Ca -0.29 0.00 -0.15 0.00 -0.13 0.00 0.00 59.36 58.79 1xkb h GLU 86 Cb 1.12 0.01 -0.20 0.00 0.63 0.00 0.00 28.75 30.30 1xkb h GLU 86 CO 1.05 0.41 -0.59 0.54 -0.73 0.00 0.00 179.01 179.69 1xkb s VAL 87 N -4.36 0.11 -0.19 0.32 0.11 -0.61 -4.99 120.40 110.79 1xkb s VAL 87 Ca -0.15 -0.89 0.01 0.00 -2.93 0.00 0.00 61.98 58.01 1xkb s VAL 87 Cb 0.02 -0.48 0.02 0.00 -1.53 0.00 0.00 36.38 34.41 1xkb s VAL 87 CO 0.66 -0.49 -0.19 -0.69 -3.33 0.00 0.00 175.10 171.06 1xkb s VAL 88 N -1.71 2.10 -0.62 2.04 1.01 -1.26 0.17 120.40 122.13 1xkb s VAL 88 Ca -0.13 -0.96 -0.05 0.00 0.00 0.00 0.00 61.98 60.84 1xkb s VAL 88 Cb -0.07 -1.90 0.16 0.00 0.00 0.00 0.00 36.38 34.57 1xkb s VAL 88 CO -0.01 0.51 0.46 -0.63 0.00 0.00 0.00 175.10 175.43 1xkb s ILE 89 N 1.29 4.06 0.24 2.22 1.01 0.14 -5.00 121.20 125.16 1xkb s ILE 89 Ca 0.04 -2.66 -0.09 0.00 0.00 0.00 0.00 60.65 57.94 1xkb s ILE 89 Cb -0.13 -3.63 -0.07 0.00 0.01 0.00 0.00 42.46 38.64 1xkb s ILE 89 CO -0.12 -0.88 0.56 -0.75 0.00 0.00 0.00 174.94 173.75 1xkb s LYS 90 N 0.25 3.79 -0.19 2.79 2.20 -1.26 -2.01 119.74 125.30 1xkb s LYS 90 Ca 0.15 0.26 -0.29 0.00 -0.36 0.00 0.00 55.97 55.73 1xkb s LYS 90 Cb -0.19 -2.64 -0.03 0.00 -1.51 0.00 0.00 37.83 33.46 1xkb s LYS 90 CO -0.04 0.29 1.67 -1.58 -0.36 0.00 0.00 175.35 175.33 1xkb s HIS 91 N -1.86 2.00 -0.81 4.03 5.65 -1.14 -4.82 115.29 118.33 1xkb s HIS 91 Ca 0.47 0.47 0.00 0.00 0.25 0.00 0.00 55.06 56.25 1xkb s HIS 91 Cb -0.11 -3.98 0.00 0.00 -1.18 0.00 0.00 32.58 27.31 1xkb s HIS 91 CO 0.22 -3.20 0.72 0.27 -0.65 0.00 0.00 174.74 172.10 1xkb n ASN 92 N 8.48 0.00 -0.71 9.88 6.94 -1.26 -0.17 115.26 138.43 1xkb n ASN 92 Ca 0.19 0.26 0.07 0.00 -0.02 0.00 0.00 54.58 55.08 1xkb n ASN 92 Cb 0.45 -0.26 0.15 0.00 -2.36 0.00 0.00 39.78 37.76 1xkb n ASN 92 CO 0.00 0.00 0.00 0.54 -1.03 0.00 0.00 177.26 176.77 1xkb n ARG 93 N -1.22 2.23 -1.66 -3.83 5.12 -1.26 -5.02 116.66 111.03 1xkb n ARG 93 Ca 0.00 -1.90 -0.45 0.00 -1.93 0.00 0.00 57.85 53.56 1xkb n ARG 93 Cb 0.13 -1.31 -0.03 0.00 -1.16 0.00 0.00 32.46 30.09 1xkb n ARG 93 CO 0.00 0.00 0.00 0.34 -1.93 0.00 0.00 177.63 176.04 1xkb n PHE 94 N 0.75 2.08 -3.99 -1.55 7.35 0.76 -4.59 117.46 118.27 1xkb n PHE 94 Ca 0.12 0.44 -0.33 0.00 -0.76 0.00 0.00 57.45 56.93 1xkb n PHE 94 Cb 0.43 -2.45 -0.14 0.00 0.35 0.00 0.00 39.48 37.66 1xkb n PHE 94 CO 0.00 0.00 0.00 0.99 -0.76 0.00 0.00 176.76 176.99 1xkb s THR 95 N 0.05 2.49 0.54 -2.13 2.01 -0.48 -4.98 115.64 113.13 1xkb s THR 95 Ca 0.70 -1.83 0.25 0.00 0.31 0.00 0.00 61.69 61.12 1xkb s THR 95 Cb -0.68 -2.59 0.38 0.00 0.01 0.00 0.00 72.50 69.62 1xkb s THR 95 CO 0.48 -0.28 2.01 0.07 -0.69 0.00 0.00 174.62 176.22 1xkb h LYS 96 N 7.80 0.00 0.23 4.92 2.10 -1.93 0.97 116.57 130.66 1xkb h LYS 96 Ca -0.14 0.00 -0.34 0.00 -2.00 0.00 0.00 60.65 58.16 1xkb h LYS 96 Cb 1.04 0.00 0.03 0.00 -0.90 0.00 0.00 32.23 32.40 1xkb h LYS 96 CO 0.52 0.00 -1.58 1.49 -2.00 0.00 0.00 179.45 177.88 1xkb h GLU 97 N 0.00 0.49 0.00 0.07 4.57 -1.98 -3.37 114.58 114.36 1xkb h GLU 97 Ca 0.22 -0.84 -0.08 0.00 -1.18 0.00 0.00 59.36 57.49 1xkb h GLU 97 Cb 0.91 0.31 -0.01 0.00 -0.16 0.00 0.00 28.75 29.79 1xkb h GLU 97 CO -0.00 1.40 -2.07 0.25 -1.18 0.00 0.00 179.01 177.41 1xkb n THR 98 N -3.67 0.29 -1.13 0.32 -2.24 -1.10 -4.99 114.28 101.76 1xkb n THR 98 Ca -0.19 -0.57 -0.04 0.00 -2.27 0.00 0.00 64.05 60.97 1xkb n THR 98 Cb 1.10 -0.09 -0.02 0.00 -2.10 0.00 0.00 70.33 69.21 1xkb n THR 98 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 1xkb n TYR 99 N -2.35 -0.00 -1.72 4.78 4.02 0.33 -4.99 117.16 117.23 1xkb n TYR 99 Ca -0.10 0.00 -0.33 0.00 -0.01 0.00 0.00 57.90 57.46 1xkb n TYR 99 Cb 0.69 -1.11 0.05 0.00 -0.02 0.00 0.00 39.34 38.95 1xkb n TYR 99 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 176.86 176.19 1xkb s ASP 100 N -2.95 5.07 -1.47 7.72 2.15 -1.22 -3.13 116.67 122.83 1xkb s ASP 100 Ca 0.00 1.98 -0.12 0.00 0.43 0.00 0.00 52.55 54.84 1xkb s ASP 100 Cb 0.00 -2.55 0.06 0.00 -0.30 0.00 0.00 42.92 40.13 1xkb s ASP 100 CO 0.00 -1.66 1.03 0.49 -0.17 0.00 0.00 175.17 174.86 1xkb n PHE 101 N -2.51 -2.48 -2.44 -5.34 3.01 -1.26 -1.38 117.46 105.06 1xkb n PHE 101 Ca 0.10 0.92 -0.43 0.00 1.01 0.00 0.00 57.45 59.05 1xkb n PHE 101 Cb 0.52 -4.33 0.00 0.00 -0.01 0.00 0.00 39.48 35.67 1xkb n PHE 101 CO 0.00 0.00 0.00 -3.47 1.01 0.00 0.00 176.76 174.30 1xkb n ASP 102 N -2.87 4.78 -3.71 4.37 2.03 -1.18 -4.04 116.55 115.92 1xkb n ASP 102 Ca 0.03 -2.94 -0.14 0.00 0.52 0.00 0.00 54.79 52.25 1xkb n ASP 102 Cb 0.54 -1.65 -0.08 0.00 -0.72 0.00 0.00 41.12 39.21 1xkb n ASP 102 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 1xkb s ILE 103 N 2.81 0.04 0.22 5.18 2.07 -1.26 -4.13 121.20 126.14 1xkb s ILE 103 Ca 0.48 -0.37 -0.17 0.00 -1.41 0.00 0.00 60.65 59.18 1xkb s ILE 103 Cb 0.06 -0.69 0.02 0.00 0.13 0.00 0.00 42.46 41.98 1xkb s ILE 103 CO 0.01 -0.20 0.54 0.00 -1.91 0.00 0.00 174.94 173.38 1xkb s ALA 104 N -1.25 -0.79 -0.03 1.50 0.00 0.41 -2.88 121.76 118.72 1xkb s ALA 104 Ca -0.13 -0.41 -0.01 0.00 0.00 0.00 0.00 51.96 51.41 1xkb s ALA 104 Cb -0.04 0.90 0.03 0.00 0.00 0.00 0.00 23.12 24.01 1xkb s ALA 104 CO 0.05 -0.85 0.06 0.08 0.00 0.00 0.00 175.76 175.11 1xkb s VAL 105 N -3.92 -0.04 -0.17 0.00 1.01 -0.85 -1.18 120.40 115.26 1xkb s VAL 105 Ca 0.13 0.16 -0.00 0.00 0.00 0.00 0.00 61.98 62.27 1xkb s VAL 105 Cb -0.02 -0.12 -0.00 0.00 0.00 0.00 0.00 36.38 36.24 1xkb s VAL 105 CO 0.02 0.07 -0.14 -0.76 0.00 0.00 0.00 175.10 174.29 1xkb s LEU 106 N 0.88 2.53 -0.39 3.92 1.43 -0.45 0.25 118.68 126.86 1xkb s LEU 106 Ca -0.07 -0.46 -0.20 0.00 -1.03 0.00 0.00 54.13 52.37 1xkb s LEU 106 Cb -0.10 -1.59 0.01 0.00 0.03 0.00 0.00 46.19 44.54 1xkb s LEU 106 CO -0.03 0.07 0.61 -0.60 0.23 0.00 0.00 176.35 176.63 1xkb s ARG 107 N 0.92 3.51 0.71 1.70 3.52 0.13 -1.51 118.95 127.93 1xkb s ARG 107 Ca -0.03 -0.16 -0.15 0.00 -0.13 0.00 0.00 55.73 55.26 1xkb s ARG 107 Cb -0.15 -3.87 0.03 0.00 -1.56 0.00 0.00 34.95 29.40 1xkb s ARG 107 CO -0.01 -0.83 1.16 -0.51 -0.81 0.00 0.00 175.30 174.30 1xkb s LEU 108 N 2.69 3.32 0.10 -0.88 1.43 0.17 -0.17 118.68 125.33 1xkb s LEU 108 Ca 0.22 2.19 -0.05 0.00 -1.03 0.00 0.00 54.13 55.46 1xkb s LEU 108 Cb -0.15 -4.57 -0.20 0.00 0.03 0.00 0.00 46.19 41.30 1xkb s LEU 108 CO 0.16 -2.03 1.21 0.50 0.23 0.00 0.00 176.35 176.42 1xkb h LYS 109 N -0.25 0.35 -6.30 1.70 3.64 -0.90 -3.39 116.57 111.41 1xkb h LYS 109 Ca -0.47 -0.48 -0.66 0.00 -1.27 0.00 0.00 60.65 57.78 1xkb h LYS 109 Cb 1.27 0.16 -0.30 0.00 -0.41 0.00 0.00 32.23 32.95 1xkb h LYS 109 CO 0.51 1.18 -0.87 0.95 -2.27 0.00 0.00 179.45 178.95 1xkb s THR 110 N -2.93 1.87 0.12 1.00 -4.23 -1.26 -4.99 115.64 105.23 1xkb s THR 110 Ca -0.05 -1.01 -0.31 0.00 -1.18 0.00 0.00 61.69 59.14 1xkb s THR 110 Cb 0.08 -1.56 -0.09 0.00 1.34 0.00 0.00 72.50 72.27 1xkb s THR 110 CO 0.88 0.53 1.53 -2.84 -0.54 0.00 0.00 174.62 174.18 1xkb s PRO 111 N -0.51 4.24 0.34 3.99 0.02 -1.26 -4.87 135.00 136.95 1xkb s PRO 111 Ca 0.08 2.26 -0.29 0.00 0.02 0.00 0.00 61.00 63.07 1xkb s PRO 111 Cb -0.10 -3.30 -0.11 0.00 0.02 0.00 0.00 34.50 31.02 1xkb s PRO 111 CO -0.00 -0.59 1.44 0.42 -0.33 0.00 0.00 177.00 177.93 1xkb s ILE 112 N 1.54 2.33 -0.57 2.83 1.01 0.25 -4.94 121.20 123.65 1xkb s ILE 112 Ca 0.69 0.32 -0.14 0.00 0.00 0.00 0.00 60.65 61.52 1xkb s ILE 112 Cb -0.40 -3.20 0.14 0.00 0.01 0.00 0.00 42.46 39.01 1xkb s ILE 112 CO 0.31 0.07 0.50 -0.89 0.00 0.00 0.00 174.94 174.93 1xkb s THR 113 N -0.87 4.97 0.40 2.92 2.01 -1.26 -4.75 115.64 119.05 1xkb s THR 113 Ca 0.53 -1.75 -0.25 0.00 0.31 0.00 0.00 61.69 60.53 1xkb s THR 113 Cb -0.44 -4.19 -0.11 0.00 0.01 0.00 0.00 72.50 67.77 1xkb s THR 113 CO 0.56 -0.87 1.13 0.49 -0.69 0.00 0.00 174.62 175.24 1xkb n PHE 114 N 4.93 1.63 -3.71 4.92 3.72 -1.26 -4.95 117.46 122.74 1xkb n PHE 114 Ca -0.08 0.55 -0.02 0.00 -0.05 0.00 0.00 57.45 57.86 1xkb n PHE 114 Cb 0.41 -2.30 0.01 0.00 -0.94 0.00 0.00 39.48 36.66 1xkb n PHE 114 CO 0.00 0.00 0.00 2.89 -0.05 0.00 0.00 176.76 179.60 1xkb n ARG 115 N 0.20 0.35 -1.67 -1.08 1.85 0.66 -4.99 116.66 111.98 1xkb n ARG 115 Ca 0.08 -0.82 -0.49 0.00 -1.00 0.00 0.00 57.85 55.62 1xkb n ARG 115 Cb 0.38 1.12 -0.05 0.00 -1.05 0.00 0.00 32.46 32.86 1xkb n ARG 115 CO 0.00 0.00 0.00 -0.12 -0.01 0.00 0.00 177.63 177.50 1xkb n MET 116 N -0.42 1.93 -0.89 2.89 0.00 -1.26 0.18 117.12 119.55 1xkb n MET 116 Ca -0.01 0.70 0.00 0.00 -0.00 0.00 0.00 57.70 58.39 1xkb n MET 116 Cb 0.33 -2.48 0.00 0.00 0.00 0.00 0.00 33.22 31.07 1xkb n MET 116 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 175.97 176.06 1xkb n ASN 117 N 4.85 -0.60 -3.50 6.12 3.02 -1.26 -4.91 115.26 118.98 1xkb n ASN 117 Ca 0.20 0.00 -0.28 0.00 -0.03 0.00 0.00 54.58 54.47 1xkb n ASN 117 Cb 0.26 -0.10 -0.13 0.00 -0.61 0.00 0.00 39.78 39.20 1xkb n ASN 117 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1xkb s VAL 118 N -3.38 -0.01 0.04 2.41 1.01 0.13 -3.74 120.40 116.86 1xkb s VAL 118 Ca 0.00 -1.14 -0.17 0.00 0.00 0.00 0.00 61.98 60.68 1xkb s VAL 118 Cb 0.00 -1.03 0.03 0.00 0.00 0.00 0.00 36.38 35.38 1xkb s VAL 118 CO 0.00 -0.82 0.38 0.00 0.00 0.00 0.00 175.10 174.65 1xkb s ALA 119 N 1.68 -0.91 0.60 5.51 0.00 -0.78 -0.25 121.76 127.62 1xkb s ALA 119 Ca 0.13 0.23 -0.09 0.00 0.00 0.00 0.00 51.96 52.23 1xkb s ALA 119 Cb -0.19 0.32 -0.03 0.00 0.00 0.00 0.00 23.12 23.23 1xkb s ALA 119 CO -0.21 -0.43 0.97 -1.25 0.00 0.00 0.00 175.76 174.84 1xkb s PRO 120 N -2.41 3.40 -0.06 0.00 0.04 -1.26 -2.56 135.00 132.14 1xkb s PRO 120 Ca -0.06 0.49 -0.01 0.00 0.04 0.00 0.00 61.00 61.46 1xkb s PRO 120 Cb -0.01 -2.16 -0.03 0.00 0.04 0.00 0.00 34.50 32.33 1xkb s PRO 120 CO -0.02 -0.57 0.01 0.00 0.04 0.00 0.00 177.00 176.45 1xkb s ALA 121 N -3.08 3.30 0.49 8.56 0.00 -1.00 -4.85 121.76 125.19 1xkb s ALA 121 Ca 0.54 -0.84 -0.21 0.00 0.00 0.00 0.00 51.96 51.45 1xkb s ALA 121 Cb -0.11 -1.45 -0.07 0.00 0.00 0.00 0.00 23.12 21.48 1xkb s ALA 121 CO 0.50 0.61 1.09 0.00 0.00 0.00 0.00 175.76 177.97 1xkb s LEU 123 N -3.44 3.83 0.86 0.00 1.43 -1.26 -0.51 118.68 119.60 1xkb s LEU 123 Ca 0.68 0.01 -0.13 0.00 -1.03 0.00 0.00 54.13 53.66 1xkb s LEU 123 Cb -0.22 -2.01 0.13 0.00 0.03 0.00 0.00 46.19 44.12 1xkb s LEU 123 CO 0.26 0.07 1.22 -2.16 0.23 0.00 0.00 176.35 175.97 1xkb s PRO 124 N 0.99 1.44 -0.07 1.29 0.04 -1.26 -4.99 135.00 132.44 1xkb s PRO 124 Ca 0.05 -0.16 -0.21 0.00 0.04 0.00 0.00 61.00 60.72 1xkb s PRO 124 Cb -0.14 -1.93 -0.04 0.00 0.04 0.00 0.00 34.50 32.43 1xkb s PRO 124 CO 0.03 -1.90 0.62 -1.21 0.04 0.00 0.00 177.00 174.59 1xkb s GLU 124 N -5.67 4.39 0.03 4.56 2.02 -1.26 -4.96 118.70 117.81 1xkb s GLU 124 Ca 0.67 0.74 -0.06 0.00 0.02 0.00 0.00 54.97 56.33 1xkb s GLU 124 Cb -0.08 -3.43 -0.01 0.00 0.10 0.00 0.00 34.13 30.71 1xkb s GLU 124 CO 0.50 0.14 1.06 -2.13 0.02 0.00 0.00 175.26 174.85 1xkb n ARG 125 N 3.57 -0.09 -0.30 1.61 0.63 -1.26 -0.85 116.66 119.98 1xkb n ARG 125 Ca -0.04 1.05 0.02 0.00 -0.92 0.00 0.00 57.85 57.96 1xkb n ARG 125 Cb 0.51 -1.56 0.15 0.00 0.45 0.00 0.00 32.46 32.01 1xkb n ARG 125 CO 0.00 0.00 0.00 -0.44 -2.51 0.00 0.00 177.63 174.68 1xkb h ASP 126 N 0.00 0.74 -0.08 6.15 3.32 -1.96 -2.22 116.42 122.36 1xkb h ASP 126 Ca 0.03 0.03 -0.11 0.00 0.02 0.00 0.00 57.03 57.00 1xkb h ASP 126 Cb 0.08 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 39.51 1xkb h ASP 126 CO -0.19 0.44 -0.31 -0.25 -1.72 0.00 0.00 179.24 177.21 1xkb h TRP 127 N 0.86 0.65 0.10 4.55 7.01 -1.88 -3.19 115.95 124.04 1xkb h TRP 127 Ca 0.38 -0.16 -0.00 0.00 2.11 0.00 0.00 58.89 61.22 1xkb h TRP 127 Cb 0.28 -0.15 0.00 0.00 -2.10 0.00 0.00 29.16 27.19 1xkb h TRP 127 CO -0.05 0.81 -0.05 0.00 -2.79 0.00 0.00 178.44 176.36 1xkb h ALA 128 N 1.18 -0.13 -0.38 2.65 0.00 -0.39 -0.87 119.26 121.32 1xkb h ALA 128 Ca 0.06 -0.09 0.11 0.00 0.00 0.00 0.00 54.91 54.99 1xkb h ALA 128 Cb 0.78 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.61 1xkb h ALA 128 CO 0.06 -0.50 0.33 0.93 0.00 0.00 0.00 179.25 180.07 1xkb h GLU 129 N -0.27 0.00 0.00 0.00 4.39 -1.46 0.94 114.58 118.18 1xkb h GLU 129 Ca -0.01 0.00 -0.38 0.00 0.34 0.00 0.00 59.36 59.31 1xkb h GLU 129 Cb 0.23 0.00 -0.07 0.00 -0.10 0.00 0.00 28.75 28.81 1xkb h GLU 129 CO 0.02 0.00 -2.43 -1.13 -1.16 0.00 0.00 179.01 174.32 1xkb n SER 130 N -4.06 1.16 -0.03 1.42 3.41 -1.14 -4.09 113.62 110.29 1xkb n SER 130 Ca 0.06 -0.08 0.06 0.00 -0.26 0.00 0.00 58.87 58.66 1xkb n SER 130 Cb 0.51 0.20 -0.16 0.00 -0.26 0.00 0.00 64.21 64.50 1xkb n SER 130 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 1xkb n THR 131 N -3.03 0.26 -0.03 6.66 -1.04 -0.34 -4.41 114.28 112.34 1xkb n THR 131 Ca -0.40 -0.53 -0.08 0.00 -2.04 0.00 0.00 64.05 60.99 1xkb n THR 131 Cb 1.06 -0.07 -0.03 0.00 -1.82 0.00 0.00 70.33 69.47 1xkb n THR 131 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 1xkb n LEU 131 N -2.31 1.12 0.09 -4.42 4.32 0.18 -4.52 117.00 111.46 1xkb n LEU 131 Ca -0.09 0.18 0.08 0.00 -0.02 0.00 0.00 56.01 56.15 1xkb n LEU 131 Cb 0.65 -0.42 0.37 0.00 -1.62 0.00 0.00 43.42 42.40 1xkb n LEU 131 CO 0.43 -0.14 0.73 0.23 -1.22 0.00 0.00 177.39 177.42 1xkb n MET 131 N -3.70 0.09 0.00 3.23 2.81 -0.33 -0.71 117.12 118.52 1xkb n MET 131 Ca -0.15 0.51 0.12 0.00 -1.81 0.00 0.00 57.70 56.37 1xkb n MET 131 Cb 0.45 -1.75 0.16 0.00 -0.71 0.00 0.00 33.22 31.37 1xkb n MET 131 CO 0.00 0.00 0.00 0.25 1.51 0.00 0.00 175.97 177.73 1xkb n THR 132 N -1.94 0.00 -0.94 2.03 -2.24 -1.26 -4.96 114.28 104.97 1xkb n THR 132 Ca 0.00 -0.21 -0.29 0.00 -2.27 0.00 0.00 64.05 61.28 1xkb n THR 132 Cb 0.08 0.91 0.18 0.00 -2.10 0.00 0.00 70.33 69.40 1xkb n THR 132 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 1xkb s GLN 133 N -2.47 0.38 0.11 -0.78 -0.21 0.12 -4.98 119.66 111.82 1xkb s GLN 133 Ca 0.21 0.83 -0.10 0.00 0.02 0.00 0.00 55.36 56.33 1xkb s GLN 133 Cb 0.19 -1.71 -0.14 0.00 1.00 0.00 0.00 33.01 32.35 1xkb s GLN 133 CO 0.54 -2.85 1.28 -0.22 -2.12 0.00 0.00 175.29 171.93 1xkb h LYS 134 N -1.99 0.64 -4.41 2.91 3.64 -1.93 -3.42 116.57 112.01 1xkb h LYS 134 Ca -0.54 -0.61 -0.24 0.00 -1.27 0.00 0.00 60.65 58.00 1xkb h LYS 134 Cb 1.31 0.15 -0.13 0.00 -0.41 0.00 0.00 32.23 33.15 1xkb h LYS 134 CO 0.53 1.22 -0.47 0.95 -2.27 0.00 0.00 179.45 179.40 1xkb s THR 135 N -3.49 0.00 0.33 1.00 -4.23 -1.26 -1.64 115.64 106.35 1xkb s THR 135 Ca -0.09 -1.85 0.07 0.00 -1.18 0.00 0.00 61.69 58.64 1xkb s THR 135 Cb 0.08 -2.45 -0.03 0.00 1.34 0.00 0.00 72.50 71.44 1xkb s THR 135 CO 0.90 0.00 0.27 -0.83 -0.54 0.00 0.00 174.62 174.42 1xkb s GLY 136 N -3.16 2.35 -0.10 3.99 0.00 -0.84 -4.78 107.32 104.77 1xkb s GLY 136 Ca 0.35 -2.04 -0.00 0.00 0.00 0.00 0.00 44.72 43.03 1xkb s GLY 136 CO 0.14 -1.49 -0.07 -0.42 0.00 0.00 0.00 173.10 171.26 1xkb s ILE 137 N -3.44 0.94 -0.04 0.90 -1.09 0.30 -1.29 121.20 117.48 1xkb s ILE 137 Ca 0.40 -0.26 0.05 0.00 -2.23 0.00 0.00 60.65 58.61 1xkb s ILE 137 Cb 0.02 -0.96 -0.02 0.00 -1.58 0.00 0.00 42.46 39.92 1xkb s ILE 137 CO 0.27 0.35 -0.19 0.54 -1.23 0.00 0.00 174.94 174.68 1xkb s VAL 138 N 1.54 2.67 0.22 2.92 0.11 -0.24 0.70 120.40 128.33 1xkb s VAL 138 Ca 0.01 -0.87 0.01 0.00 -2.93 0.00 0.00 61.98 58.20 1xkb s VAL 138 Cb -0.13 -2.01 -0.05 0.00 -1.53 0.00 0.00 36.38 32.66 1xkb s VAL 138 CO -0.06 0.58 0.08 -0.94 -3.33 0.00 0.00 175.10 171.43 1xkb s SER 139 N -0.62 1.02 0.00 3.54 1.04 -1.11 -0.28 113.70 117.29 1xkb s SER 139 Ca 0.09 -1.33 0.00 0.00 0.48 0.00 0.00 55.95 55.20 1xkb s SER 139 Cb -0.11 0.19 0.00 0.00 0.10 0.00 0.00 66.02 66.20 1xkb s SER 139 CO 0.00 -0.71 0.00 0.61 0.98 0.00 0.00 173.24 174.13 1xkb n GLY 140 N -0.37 0.04 1.39 7.32 0.00 -0.41 -4.30 105.19 108.86 1xkb n GLY 140 Ca -0.01 -1.22 0.03 0.00 0.00 0.00 0.00 46.02 44.82 1xkb n GLY 140 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1xkb n PHE 141 N -0.91 1.56 0.00 1.61 3.01 -1.26 -1.71 117.46 119.77 1xkb n PHE 141 Ca 0.00 -1.00 0.00 0.00 1.01 0.00 0.00 57.45 57.46 1xkb n PHE 141 Cb 0.00 -0.47 0.00 0.00 -0.01 0.00 0.00 39.48 39.00 1xkb n PHE 141 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1xkb n GLY 142 N -0.26 -3.31 3.80 1.37 0.00 -1.26 -3.11 105.19 102.42 1xkb n GLY 142 Ca 0.29 -1.12 -0.39 0.00 0.00 0.00 0.00 46.02 44.80 1xkb n GLY 142 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1xkb s ARG 143 N 0.00 4.33 0.00 1.61 0.52 -0.70 -0.90 118.95 123.81 1xkb s ARG 143 Ca 0.00 0.89 0.31 0.00 -0.52 0.00 0.00 55.73 56.41 1xkb s ARG 143 Cb 0.00 -3.23 1.83 0.00 0.52 0.00 0.00 34.95 34.07 1xkb s ARG 143 CO 0.00 0.61 2.16 0.25 0.02 0.00 0.00 175.30 178.33 1xkb n THR 144 N 1.62 0.00 -3.55 0.02 -2.24 -1.00 -1.75 114.28 107.38 1xkb n THR 144 Ca -0.08 0.00 -0.08 0.00 -2.27 0.00 0.00 64.05 61.62 1xkb n THR 144 Cb 0.50 -0.52 -0.03 0.00 -2.10 0.00 0.00 70.33 68.18 1xkb n THR 144 CO 0.00 0.00 0.00 -2.28 -0.57 0.00 0.00 175.07 172.22 1xkb s HIS 145 N -2.00 -0.28 0.24 4.78 5.65 -1.26 -4.45 115.29 117.97 1xkb s HIS 145 Ca 0.46 0.29 -0.04 0.00 0.25 0.00 0.00 55.06 56.02 1xkb s HIS 145 Cb 0.21 0.50 0.45 0.00 -1.18 0.00 0.00 32.58 32.56 1xkb s HIS 145 CO 0.35 -0.37 1.74 1.49 -0.65 0.00 0.00 174.74 177.31 1xkb h GLU 146 N 2.16 0.49 0.01 2.88 4.81 -1.87 -2.79 114.58 120.27 1xkb h GLU 146 Ca -0.17 -0.03 -0.29 0.00 -0.13 0.00 0.00 59.36 58.74 1xkb h GLU 146 Cb 1.20 -0.11 -0.05 0.00 0.63 0.00 0.00 28.75 30.42 1xkb h GLU 146 CO 0.28 0.32 -1.69 -0.22 -0.73 0.00 0.00 179.01 176.98 1xkb h LYS 147 N 0.50 0.01 0.00 1.92 3.64 -1.96 -3.48 116.57 117.20 1xkb h LYS 147 Ca 0.41 -0.02 -0.02 0.00 -1.27 0.00 0.00 60.65 59.75 1xkb h LYS 147 Cb 0.58 0.01 0.01 0.00 -0.41 0.00 0.00 32.23 32.42 1xkb h LYS 147 CO -0.37 0.55 -0.01 0.41 -2.27 0.00 0.00 179.45 177.76 1xkb n GLY 149 N 1.57 -3.00 3.82 5.01 0.00 -1.05 -5.05 105.19 106.49 1xkb n GLY 149 Ca -0.17 -0.99 -0.23 0.00 0.00 0.00 0.00 46.02 44.63 1xkb n GLY 149 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1xkb s ARG 150 N -2.52 2.38 0.33 1.61 1.70 -1.26 -4.78 118.95 116.40 1xkb s ARG 150 Ca 0.03 -1.72 -0.29 0.00 -0.47 0.00 0.00 55.73 53.28 1xkb s ARG 150 Cb -0.01 -2.18 -0.11 0.00 -0.57 0.00 0.00 34.95 32.09 1xkb s ARG 150 CO 0.03 -0.21 1.43 -0.65 -1.08 0.00 0.00 175.30 174.81 1xkb s GLN 151 N -4.06 4.22 0.75 3.89 -0.21 -1.26 -2.37 119.66 120.62 1xkb s GLN 151 Ca 0.44 2.41 -0.13 0.00 0.02 0.00 0.00 55.36 58.09 1xkb s GLN 151 Cb -0.00 -3.03 0.05 0.00 1.00 0.00 0.00 33.01 31.02 1xkb s GLN 151 CO 0.25 -0.41 1.14 -1.54 -2.12 0.00 0.00 175.29 172.62 1xkb s SER 152 N -0.11 4.34 0.05 5.90 1.04 -0.07 -4.89 113.70 119.96 1xkb s SER 152 Ca 0.54 2.11 -0.16 0.00 0.48 0.00 0.00 55.95 58.92 1xkb s SER 152 Cb -0.44 -2.56 -0.21 0.00 0.10 0.00 0.00 66.02 62.92 1xkb s SER 152 CO 0.55 -2.15 1.20 0.74 0.98 0.00 0.00 173.24 174.55 1xkb h THR 153 N -0.60 1.34 -2.36 2.02 2.02 -1.92 -3.44 112.91 109.96 1xkb h THR 153 Ca -0.46 -2.05 -0.59 0.00 0.77 0.00 0.00 66.41 64.09 1xkb h THR 153 Cb 1.26 2.32 -0.12 0.00 -1.74 0.00 0.00 68.15 69.87 1xkb h THR 153 CO 0.50 0.62 -0.70 -0.13 0.37 0.00 0.00 175.52 176.18 1xkb s ARG 154 N -3.46 2.02 0.29 6.66 0.52 -1.26 0.27 118.95 123.99 1xkb s ARG 154 Ca -0.12 -1.52 -0.30 0.00 -0.52 0.00 0.00 55.73 53.27 1xkb s ARG 154 Cb 0.06 -2.01 -0.11 0.00 0.52 0.00 0.00 34.95 33.40 1xkb s ARG 154 CO 0.87 0.36 1.58 -1.17 0.02 0.00 0.00 175.30 176.96 1xkb s LEU 155 N -3.46 4.35 0.35 2.53 2.96 -0.76 -4.78 118.68 119.87 1xkb s LEU 155 Ca 0.30 2.93 0.07 0.00 -0.22 0.00 0.00 54.13 57.21 1xkb s LEU 155 Cb -0.06 -3.63 -0.07 0.00 0.50 0.00 0.00 46.19 42.93 1xkb s LEU 155 CO 0.17 -0.90 -0.03 -0.54 -1.32 0.00 0.00 176.35 173.73 1xkb s LYS 156 N -0.51 1.78 0.14 1.98 1.02 -0.69 -1.70 119.74 121.76 1xkb s LYS 156 Ca 0.63 -1.95 -0.04 0.00 0.02 0.00 0.00 55.97 54.62 1xkb s LYS 156 Cb -0.47 -1.43 -0.03 0.00 -0.52 0.00 0.00 37.83 35.37 1xkb s LYS 156 CO 0.48 0.01 0.14 0.00 -0.92 0.00 0.00 175.35 175.06 1xkb s MET 157 N -3.71 1.01 -0.24 1.68 0.23 0.17 -1.29 119.30 117.15 1xkb s MET 157 Ca 0.33 -1.34 -0.20 0.00 -1.03 0.00 0.00 55.69 53.45 1xkb s MET 157 Cb 0.06 0.29 0.06 0.00 -1.53 0.00 0.00 34.83 33.72 1xkb s MET 157 CO 0.16 -0.32 0.63 -1.17 -2.03 0.00 0.00 175.02 172.29 1xkb s LEU 158 N -3.02 -0.47 -0.31 0.18 0.20 0.62 -1.35 118.68 114.53 1xkb s LEU 158 Ca 0.21 1.29 -0.18 0.00 0.69 0.00 0.00 54.13 56.14 1xkb s LEU 158 Cb 0.06 2.16 -0.01 0.00 -0.43 0.00 0.00 46.19 47.96 1xkb s LEU 158 CO 0.01 -0.22 0.51 -0.70 -0.29 0.00 0.00 176.35 175.66 1xkb s GLU 159 N 0.57 3.82 -0.19 1.98 2.12 -1.26 -1.07 118.70 124.66 1xkb s GLU 159 Ca -0.02 0.04 -0.01 0.00 0.36 0.00 0.00 54.97 55.35 1xkb s GLU 159 Cb -0.05 -3.74 0.01 0.00 0.26 0.00 0.00 34.13 30.61 1xkb s GLU 159 CO -0.03 -0.52 -0.14 0.14 -0.54 0.00 0.00 175.26 174.17 1xkb s VAL 160 N 2.36 2.55 0.46 3.70 -7.23 -0.41 -4.93 120.40 116.90 1xkb s VAL 160 Ca 0.20 -0.78 -0.25 0.00 -1.81 0.00 0.00 61.98 59.34 1xkb s VAL 160 Cb -0.15 -2.11 -0.08 0.00 0.56 0.00 0.00 36.38 34.60 1xkb s VAL 160 CO 0.12 0.50 1.39 -2.84 -0.31 0.00 0.00 175.10 173.96 1xkb s PRO 161 N 1.30 3.62 0.32 4.82 0.02 -1.26 -1.99 135.00 141.84 1xkb s PRO 161 Ca 0.04 2.33 -0.28 0.00 0.02 0.00 0.00 61.00 63.11 1xkb s PRO 161 Cb -0.14 -2.59 -0.09 0.00 0.02 0.00 0.00 34.50 31.70 1xkb s PRO 161 CO -0.08 -0.84 1.13 0.71 -0.33 0.00 0.00 177.00 177.59 1xkb s TYR 162 N -1.24 3.37 0.02 6.54 2.02 -0.65 -0.78 117.35 126.63 1xkb s TYR 162 Ca 0.63 1.63 0.05 0.00 -0.37 0.00 0.00 57.07 59.00 1xkb s TYR 162 Cb -0.42 -3.34 -0.03 0.00 -0.40 0.00 0.00 41.96 37.77 1xkb s TYR 162 CO 0.53 -0.88 -0.13 0.08 -1.57 0.00 0.00 175.55 173.58 1xkb s VAL 163 N -1.27 3.17 0.29 0.71 1.01 -1.11 -4.88 120.40 118.32 1xkb s VAL 163 Ca 0.49 -0.97 -0.29 0.00 0.00 0.00 0.00 61.98 61.21 1xkb s VAL 163 Cb -0.32 -2.34 -0.09 0.00 0.00 0.00 0.00 36.38 33.62 1xkb s VAL 163 CO 0.41 0.39 1.10 1.51 0.00 0.00 0.00 175.10 178.50 1xkb s ASP 164 N -1.35 7.21 0.22 3.32 -4.77 -1.26 -4.34 116.67 115.70 1xkb s ASP 164 Ca 0.15 2.25 -0.18 0.00 -3.30 0.00 0.00 52.55 51.48 1xkb s ASP 164 Cb -0.11 -2.62 0.23 0.00 -1.09 0.00 0.00 42.92 39.32 1xkb s ASP 164 CO 0.06 -0.18 1.56 -0.09 0.70 0.00 0.00 175.17 177.22 1xkb h ARG 165 N 3.68 -0.04 -0.03 2.11 2.43 -1.98 0.22 114.38 120.77 1xkb h ARG 165 Ca -0.47 0.00 0.03 0.00 -0.81 0.00 0.00 59.98 58.73 1xkb h ARG 165 Cb 1.21 0.01 -0.06 0.00 -0.42 0.00 0.00 29.97 30.71 1xkb h ARG 165 CO 0.66 -0.03 -0.48 -0.91 -1.51 0.00 0.00 179.97 177.71 1xkb h ASN 166 N -0.05 -1.46 -0.97 -3.80 2.35 -1.99 0.43 115.58 110.09 1xkb h ASN 166 Ca 0.32 0.17 0.07 0.00 -0.55 0.00 0.00 56.30 56.32 1xkb h ASN 166 Cb 0.59 0.57 -0.07 0.00 0.05 0.00 0.00 38.32 39.46 1xkb h ASN 166 CO -0.90 -0.49 0.62 0.28 -1.65 0.00 0.00 177.43 175.30 1xkb h SER 167 N -0.61 0.99 0.44 5.81 0.02 -1.65 0.59 113.55 119.15 1xkb h SER 167 Ca 0.04 0.02 -0.02 0.00 -0.84 0.00 0.00 61.79 60.99 1xkb h SER 167 Cb 0.69 -0.19 -0.00 0.00 0.14 0.00 0.00 62.40 63.03 1xkb h SER 167 CO -0.35 0.62 -0.26 0.00 -1.14 0.00 0.00 176.83 175.70 1xkb h LYS 169 N -0.66 0.83 0.00 0.00 1.57 0.34 -1.54 116.57 117.10 1xkb h LYS 169 Ca -0.05 -0.13 0.00 0.00 -1.87 0.00 0.00 60.65 58.60 1xkb h LYS 169 Cb 0.54 -0.15 0.00 0.00 0.08 0.00 0.00 32.23 32.70 1xkb h LYS 169 CO 0.06 0.68 0.00 1.25 -0.57 0.00 0.00 179.45 180.87 1xkb h LEU 170 N 0.81 0.00 0.00 2.94 5.85 -0.78 -2.85 115.31 121.28 1xkb h LEU 170 Ca 0.19 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.91 1xkb h LEU 170 Cb 0.17 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.20 1xkb h LEU 170 CO -0.02 0.00 -1.82 -1.54 -0.34 0.00 0.00 178.44 174.72 1xkb n SER 171 N -2.40 0.16 -4.80 1.25 3.41 -0.65 -4.97 113.62 105.61 1xkb n SER 171 Ca 0.02 0.06 -0.36 0.00 -0.26 0.00 0.00 58.87 58.33 1xkb n SER 171 Cb 0.26 1.69 -0.06 0.00 -0.26 0.00 0.00 64.21 65.84 1xkb n SER 171 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1xkb s SER 172 N -4.69 7.16 0.00 4.04 0.15 -0.77 -4.80 113.70 114.78 1xkb s SER 172 Ca -0.07 1.58 0.23 0.00 0.70 0.00 0.00 55.95 58.39 1xkb s SER 172 Cb 0.13 -2.48 0.26 0.00 -1.71 0.00 0.00 66.02 62.22 1xkb s SER 172 CO 0.89 -0.02 1.27 -1.20 1.20 0.00 0.00 173.24 175.38 1xkb n SER 173 N 0.61 3.07 -4.23 5.45 7.64 -1.26 -4.89 113.62 120.01 1xkb n SER 173 Ca -0.00 -1.96 -0.19 0.00 1.01 0.00 0.00 58.87 57.73 1xkb n SER 173 Cb 0.51 -0.08 -0.12 0.00 -1.01 0.00 0.00 64.21 63.51 1xkb n SER 173 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 1xkb s PHE 174 N -1.75 1.42 0.35 1.43 0.08 -1.26 -5.12 117.98 113.14 1xkb s PHE 174 Ca 0.30 -0.51 -0.28 0.00 0.12 0.00 0.00 56.93 56.56 1xkb s PHE 174 Cb 0.20 -0.76 -0.11 0.00 -0.57 0.00 0.00 43.02 41.79 1xkb s PHE 174 CO 0.29 0.14 1.38 -1.50 -0.10 0.00 0.00 175.22 175.43 1xkb s ILE 175 N -1.78 2.44 -0.45 0.64 2.07 -1.26 -4.97 121.20 117.88 1xkb s ILE 175 Ca 0.06 0.44 -0.07 0.00 -1.41 0.00 0.00 60.65 59.67 1xkb s ILE 175 Cb -0.07 -3.28 0.11 0.00 0.13 0.00 0.00 42.46 39.35 1xkb s ILE 175 CO 0.03 0.11 0.29 -0.63 -1.91 0.00 0.00 174.94 172.83 1xkb s ILE 176 N -1.14 3.94 0.82 2.00 -1.09 -1.26 -5.06 121.20 119.41 1xkb s ILE 176 Ca 0.51 -1.81 -0.12 0.00 -2.23 0.00 0.00 60.65 56.99 1xkb s ILE 176 Cb -0.42 -3.60 0.08 0.00 -1.58 0.00 0.00 42.46 36.94 1xkb s ILE 176 CO 0.57 -0.72 1.13 0.42 -1.23 0.00 0.00 174.94 175.12 1xkb s THR 177 N 1.31 2.51 -0.80 2.92 -4.23 -1.26 -4.93 115.64 111.15 1xkb s THR 177 Ca 0.06 0.16 0.17 0.00 -1.18 0.00 0.00 61.69 60.91 1xkb s THR 177 Cb -0.25 -3.03 0.16 0.00 1.34 0.00 0.00 72.50 70.72 1xkb s THR 177 CO -0.01 -0.22 1.54 0.00 -0.54 0.00 0.00 174.62 175.40 1xkb n GLN 178 N -3.42 0.07 -0.49 3.99 1.13 -1.26 -1.59 117.38 115.81 1xkb n GLN 178 Ca 0.07 0.32 -0.01 0.00 -1.94 0.00 0.00 57.00 55.45 1xkb n GLN 178 Cb 0.59 -1.64 0.17 0.00 0.11 0.00 0.00 30.24 29.47 1xkb n GLN 178 CO 0.00 0.00 0.00 0.09 -1.44 0.00 0.00 177.06 175.71 1xkb n ASN 179 N -1.77 3.37 -4.08 1.08 3.02 -1.26 -4.80 115.26 110.81 1xkb n ASN 179 Ca 0.03 -2.55 -0.09 0.00 -0.03 0.00 0.00 54.58 51.94 1xkb n ASN 179 Cb 0.19 -0.61 -0.09 0.00 -0.61 0.00 0.00 39.78 38.65 1xkb n ASN 179 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 1xkb s MET 180 N -1.82 0.83 0.13 3.52 -1.94 -0.62 -2.30 119.30 117.10 1xkb s MET 180 Ca 0.28 -1.29 -0.21 0.00 -1.71 0.00 0.00 55.69 52.75 1xkb s MET 180 Cb 0.22 0.25 0.06 0.00 2.01 0.00 0.00 34.83 37.37 1xkb s MET 180 CO 0.07 -0.22 0.53 -0.59 -0.01 0.00 0.00 175.02 174.80 1xkb s PHE 181 N -3.98 -0.43 0.22 -0.03 -0.12 -0.69 -4.68 117.98 108.27 1xkb s PHE 181 Ca 0.16 0.25 0.05 0.00 -0.05 0.00 0.00 56.93 57.33 1xkb s PHE 181 Cb 0.07 0.44 -0.03 0.00 -0.63 0.00 0.00 43.02 42.86 1xkb s PHE 181 CO -0.04 -0.77 0.33 0.00 -0.05 0.00 0.00 175.22 174.69 1xkb s ALA 183 N -1.93 -2.13 0.00 0.00 0.00 -1.04 -2.74 121.76 113.92 1xkb s ALA 183 Ca 0.34 2.27 0.00 0.00 0.00 0.00 0.00 51.96 54.57 1xkb s ALA 183 Cb -0.09 -1.60 0.00 0.00 0.00 0.00 0.00 23.12 21.42 1xkb s ALA 183 CO 0.29 -0.35 0.00 0.41 0.00 0.00 0.00 175.76 176.10 1xkb n GLY 184 N 3.85 0.82 3.39 0.00 0.00 0.04 -2.59 105.19 110.71 1xkb n GLY 184 Ca -0.19 -1.70 -0.28 0.00 0.00 0.00 0.00 46.02 43.85 1xkb n GLY 184 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1xkb s TYR 185 N -3.58 2.26 -0.01 1.61 1.51 -1.26 -4.06 117.35 113.82 1xkb s TYR 185 Ca 0.00 -0.38 -0.09 0.00 -1.01 0.00 0.00 57.07 55.59 1xkb s TYR 185 Cb 0.00 -1.18 -0.05 0.00 -0.11 0.00 0.00 41.96 40.62 1xkb s TYR 185 CO 0.00 0.39 0.68 0.22 -1.11 0.00 0.00 175.55 175.73 1xkb h ASP 185 N 3.61 -0.29 0.00 2.29 1.82 -1.92 -3.40 116.42 118.53 1xkb h ASP 185 Ca -0.49 0.01 0.00 0.00 -0.39 0.00 0.00 57.03 56.16 1xkb h ASP 185 Cb 1.19 0.07 0.00 0.00 0.68 0.00 0.00 39.33 41.27 1xkb h ASP 185 CO 0.43 -0.10 -0.54 0.35 -1.61 0.00 0.00 179.24 177.77 1xkb n THR 185 N -3.49 0.00 -1.91 2.25 -2.24 -1.26 -1.10 114.28 106.53 1xkb n THR 185 Ca -0.04 -0.30 -0.42 0.00 -2.27 0.00 0.00 64.05 61.02 1xkb n THR 185 Cb 0.13 0.87 -0.03 0.00 -2.10 0.00 0.00 70.33 69.20 1xkb n THR 185 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 1xkb s LYS 186 N -1.86 4.20 -0.15 -0.78 2.20 -1.26 -4.78 119.74 117.31 1xkb s LYS 186 Ca 0.02 2.38 -0.02 0.00 -0.36 0.00 0.00 55.97 57.99 1xkb s LYS 186 Cb 0.05 -3.20 -0.07 0.00 -1.51 0.00 0.00 37.83 33.11 1xkb s LYS 186 CO 0.31 -0.63 1.55 1.04 -0.36 0.00 0.00 175.35 177.26 1xkb n GLN 187 N 4.16 0.81 -3.87 4.03 1.13 -1.26 -4.69 117.38 117.68 1xkb n GLN 187 Ca 0.14 -0.54 -0.12 0.00 -1.94 0.00 0.00 57.00 54.55 1xkb n GLN 187 Cb 0.38 -1.84 -0.14 0.00 0.11 0.00 0.00 30.24 28.76 1xkb n GLN 187 CO 0.00 0.00 0.00 -1.21 -1.44 0.00 0.00 177.06 174.41 1xkb s GLU 188 N 2.85 0.03 0.00 -1.09 2.02 -1.26 -4.25 118.70 116.99 1xkb s GLU 188 Ca 0.22 -0.00 0.00 0.00 0.02 0.00 0.00 54.97 55.21 1xkb s GLU 188 Cb 0.09 0.01 0.00 0.00 0.10 0.00 0.00 34.13 34.33 1xkb s GLU 188 CO -0.01 -0.00 0.00 -3.47 0.02 0.00 0.00 175.26 171.80 1xkb n ASP 189 N 3.02 0.00 -4.19 -0.19 2.03 -0.45 -4.24 116.55 112.53 1xkb n ASP 189 Ca -0.12 0.00 -0.21 0.00 0.52 0.00 0.00 54.79 54.97 1xkb n ASP 189 Cb 0.60 0.00 0.11 0.00 -0.72 0.00 0.00 41.12 41.11 1xkb n ASP 189 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1xkb n ALA 190 N 0.00 -0.00 -3.83 -1.67 0.00 -1.26 0.07 120.51 113.82 1xkb n ALA 190 Ca 0.00 -1.71 -0.04 0.00 0.00 0.00 0.00 53.44 51.69 1xkb n ALA 190 Cb 0.00 0.24 0.01 0.00 0.00 0.00 0.00 19.45 19.70 1xkb n ALA 190 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1xkb n GLN 192 N -0.59 1.62 0.00 0.00 6.02 -1.26 -0.78 117.38 122.39 1xkb n GLN 192 Ca -0.05 0.58 0.00 0.00 -0.01 0.00 0.00 57.00 57.52 1xkb n GLN 192 Cb 0.60 -2.26 0.00 0.00 1.02 0.00 0.00 30.24 29.60 1xkb n GLN 192 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1xkb n GLY 193 N 2.80 2.10 0.12 1.08 0.00 -1.26 -1.72 105.19 108.30 1xkb n GLY 193 Ca 0.17 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.31 1xkb n GLY 193 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1xkb h ASP 194 N 0.69 0.00 -2.35 1.61 3.32 -1.27 -3.27 116.42 115.14 1xkb h ASP 194 Ca 0.00 -0.04 -0.61 0.00 0.02 0.00 0.00 57.03 56.40 1xkb h ASP 194 Cb 0.00 0.00 0.11 0.00 0.22 0.00 0.00 39.33 39.66 1xkb h ASP 194 CO 0.00 0.02 0.07 -1.20 -1.72 0.00 0.00 179.24 176.41 1xkb n SER 195 N -2.64 1.07 0.00 6.45 7.64 -1.25 -0.41 113.62 124.49 1xkb n SER 195 Ca 0.01 1.17 0.00 0.00 1.01 0.00 0.00 58.87 61.07 1xkb n SER 195 Cb 0.53 -1.26 0.00 0.00 -1.01 0.00 0.00 64.21 62.47 1xkb n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1xkb n GLY 196 N 1.29 3.15 3.50 0.23 0.00 0.18 -0.21 105.19 113.33 1xkb n GLY 196 Ca 0.10 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.83 1xkb n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1xkb s GLY 197 N -1.63 1.52 0.37 -0.02 0.00 0.46 -3.35 107.32 104.66 1xkb s GLY 197 Ca 0.00 -0.69 -0.24 0.00 0.00 0.00 0.00 44.72 43.78 1xkb s GLY 197 CO 0.00 0.16 0.96 2.56 0.00 0.00 0.00 173.10 176.78 1xkb s PRO 198 N -5.08 4.42 -0.17 2.90 0.05 -1.25 -2.01 135.00 133.85 1xkb s PRO 198 Ca 0.69 1.28 -0.01 0.00 0.05 0.00 0.00 61.00 63.01 1xkb s PRO 198 Cb -0.15 -2.56 0.05 0.00 0.05 0.00 0.00 34.50 31.89 1xkb s PRO 198 CO 0.58 0.13 -0.03 -1.58 0.05 0.00 0.00 177.00 176.16 1xkb s HIS 199 N -1.81 1.52 0.07 0.56 2.46 -0.33 -2.77 115.29 115.00 1xkb s HIS 199 Ca 0.55 -1.02 0.10 0.00 0.47 0.00 0.00 55.06 55.16 1xkb s HIS 199 Cb -0.16 -1.23 -0.03 0.00 -0.13 0.00 0.00 32.58 31.03 1xkb s HIS 199 CO 0.20 -0.61 -0.26 0.08 -2.47 0.00 0.00 174.74 171.69 1xkb s VAL 200 N 1.69 2.11 -0.07 0.89 1.01 0.22 -0.78 120.40 125.47 1xkb s VAL 200 Ca 0.00 -1.49 0.03 0.00 0.00 0.00 0.00 61.98 60.52 1xkb s VAL 200 Cb -0.16 -1.83 0.01 0.00 0.00 0.00 0.00 36.38 34.40 1xkb s VAL 200 CO -0.07 0.25 -0.15 -0.89 0.00 0.00 0.00 175.10 174.23 1xkb s THR 201 N -0.90 1.38 -0.07 3.92 2.01 -0.78 0.11 115.64 121.30 1xkb s THR 201 Ca 0.12 -0.63 -0.15 0.00 0.31 0.00 0.00 61.69 61.34 1xkb s THR 201 Cb -0.10 -1.23 -0.05 0.00 0.01 0.00 0.00 72.50 71.14 1xkb s THR 201 CO 0.03 0.41 0.39 -0.60 -0.69 0.00 0.00 174.62 174.16 1xkb s ARG 202 N 0.51 4.09 -0.09 4.92 3.52 -1.26 -1.38 118.95 129.25 1xkb s ARG 202 Ca -0.14 0.33 -0.03 0.00 -0.13 0.00 0.00 55.73 55.76 1xkb s ARG 202 Cb -0.16 -3.32 0.04 0.00 -1.56 0.00 0.00 34.95 29.95 1xkb s ARG 202 CO 0.05 0.45 0.05 0.12 -0.81 0.00 0.00 175.30 175.16 1xkb s PHE 203 N -0.27 0.34 -1.34 5.12 5.36 -0.36 -4.84 117.98 121.99 1xkb s PHE 203 Ca 0.22 -0.09 -0.00 0.00 -0.96 0.00 0.00 56.93 56.10 1xkb s PHE 203 Cb -0.15 -0.67 0.00 0.00 -0.34 0.00 0.00 43.02 41.86 1xkb s PHE 203 CO 0.10 -0.34 0.62 1.63 -1.46 0.00 0.00 175.22 175.77 1xkb n LYS 204 N 5.23 -4.47 -1.92 10.12 5.02 -1.26 -2.26 118.16 128.61 1xkb n LYS 204 Ca -0.06 0.56 -0.21 0.00 -2.02 0.00 0.00 58.31 56.59 1xkb n LYS 204 Cb 0.49 -5.00 -0.06 0.00 -0.02 0.00 0.00 35.03 30.44 1xkb n LYS 204 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 1xkb n ASP 205 N -3.04 -5.59 -4.21 4.39 2.03 -1.26 -4.99 116.55 103.89 1xkb n ASP 205 Ca -0.30 0.30 -0.30 0.00 0.52 0.00 0.00 54.79 55.01 1xkb n ASP 205 Cb 0.68 -4.82 -0.16 0.00 -0.72 0.00 0.00 41.12 36.10 1xkb n ASP 205 CO 0.00 0.00 0.00 -0.89 -1.92 0.00 0.00 177.20 174.39 1xkb s THR 206 N -2.86 1.81 -0.29 5.18 2.01 -0.96 -5.12 115.64 115.42 1xkb s THR 206 Ca 0.00 -0.92 -0.12 0.00 0.31 0.00 0.00 61.69 60.96 1xkb s THR 206 Cb 0.00 -1.55 -0.04 0.00 0.01 0.00 0.00 72.50 70.92 1xkb s THR 206 CO 0.00 0.51 0.24 -0.31 -0.69 0.00 0.00 174.62 174.36 1xkb s TYR 207 N 0.02 3.23 -0.17 4.92 1.51 -1.26 -1.23 117.35 124.37 1xkb s TYR 207 Ca -0.07 0.13 -0.05 0.00 -1.01 0.00 0.00 57.07 56.08 1xkb s TYR 207 Cb -0.14 -2.44 -0.03 0.00 -0.11 0.00 0.00 41.96 39.24 1xkb s TYR 207 CO 0.04 -0.20 -0.01 -0.06 -1.11 0.00 0.00 175.55 174.21 1xkb s PHE 208 N 1.82 3.07 -0.09 2.71 0.08 -0.48 -2.07 117.98 123.03 1xkb s PHE 208 Ca 0.09 -0.26 -0.33 0.00 0.12 0.00 0.00 56.93 56.54 1xkb s PHE 208 Cb -0.16 -2.01 -0.11 0.00 -0.57 0.00 0.00 43.02 40.17 1xkb s PHE 208 CO 0.11 -0.05 1.94 0.28 -0.10 0.00 0.00 175.22 177.40 1xkb n VAL 209 N 3.70 0.59 0.00 -0.44 0.31 0.33 -1.87 118.33 120.95 1xkb n VAL 209 Ca -0.17 -0.14 0.00 0.00 -0.01 0.00 0.00 64.34 64.02 1xkb n VAL 209 Cb 0.52 -1.99 0.00 0.00 -0.91 0.00 0.00 33.84 31.46 1xkb n VAL 209 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 1xkb n THR 210 N 5.50 0.00 -3.54 2.52 -2.24 0.04 -4.56 114.28 112.00 1xkb n THR 210 Ca 0.23 -0.11 -0.09 0.00 -2.27 0.00 0.00 64.05 61.82 1xkb n THR 210 Cb 0.32 0.59 -0.02 0.00 -2.10 0.00 0.00 70.33 69.13 1xkb n THR 210 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1xkb s GLY 211 N -1.68 -0.45 -0.05 3.38 0.00 -0.69 -3.37 107.32 104.46 1xkb s GLY 211 Ca 0.00 0.56 0.06 0.00 0.00 0.00 0.00 44.72 45.34 1xkb s GLY 211 CO 0.00 0.18 -0.23 -0.42 0.00 0.00 0.00 173.10 172.63 1xkb s ILE 212 N -3.47 1.91 -0.31 0.90 1.01 -1.19 -1.18 121.20 118.87 1xkb s ILE 212 Ca 0.05 -0.99 -0.29 0.00 0.00 0.00 0.00 60.65 59.42 1xkb s ILE 212 Cb -0.02 -1.61 -0.01 0.00 0.01 0.00 0.00 42.46 40.83 1xkb s ILE 212 CO -0.07 0.53 1.62 -0.69 0.00 0.00 0.00 174.94 176.33 1xkb s VAL 213 N -0.18 3.69 -0.04 2.92 1.01 -0.85 -1.27 120.40 125.67 1xkb s VAL 213 Ca -0.02 0.73 -0.03 0.00 0.00 0.00 0.00 61.98 62.66 1xkb s VAL 213 Cb -0.13 -3.83 -0.01 0.00 0.00 0.00 0.00 36.38 32.42 1xkb s VAL 213 CO 0.03 -0.46 -0.06 -0.24 0.00 0.00 0.00 175.10 174.37 1xkb n SER 214 N 9.17 0.46 -2.81 3.32 2.88 -0.71 0.50 113.62 126.43 1xkb n SER 214 Ca 0.20 0.25 -0.03 0.00 -1.33 0.00 0.00 58.87 57.96 1xkb n SER 214 Cb 0.46 -0.58 0.02 0.00 -0.75 0.00 0.00 64.21 63.36 1xkb n SER 214 CO 0.00 0.00 0.00 -2.67 -1.23 0.00 0.00 175.04 171.14 1xkb n TRP 215 N -2.90 -1.24 -3.58 0.66 4.27 -0.91 -4.82 117.44 108.94 1xkb n TRP 215 Ca -0.02 -1.03 -0.05 0.00 -3.89 0.00 0.00 57.50 52.50 1xkb n TRP 215 Cb 0.09 0.50 -0.02 0.00 -1.36 0.00 0.00 31.31 30.52 1xkb n TRP 215 CO 0.00 0.00 0.00 0.20 -2.29 0.00 0.00 177.69 175.60 1xkb s GLY 216 N -3.11 -0.33 -1.03 -1.67 0.00 -1.26 -0.36 107.32 99.56 1xkb s GLY 216 Ca 0.18 1.44 -0.18 0.00 0.00 0.00 0.00 44.72 46.16 1xkb s GLY 216 CO 0.05 0.48 1.30 -0.54 0.00 0.00 0.00 173.10 174.38 1xkb s GLU 217 N -2.59 3.73 2.12 2.90 2.02 -1.26 -4.88 118.70 120.75 1xkb s GLU 217 Ca 0.08 -1.84 0.00 0.00 0.02 0.00 0.00 54.97 53.24 1xkb s GLU 217 Cb -0.01 -5.08 0.00 0.00 0.10 0.00 0.00 34.13 29.14 1xkb s GLU 217 CO -0.06 -1.89 0.00 0.41 0.02 0.00 0.00 175.26 173.75 1xkb n GLY 218 N 5.45 -0.56 3.06 -1.39 0.00 -1.26 -4.69 105.19 105.81 1xkb n GLY 218 Ca 0.30 -1.33 -0.12 0.00 0.00 0.00 0.00 46.02 44.87 1xkb n GLY 218 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xkb n ALA 221 N 5.30 -0.08 -1.86 0.00 0.00 -1.26 -4.57 120.51 118.04 1xkb n ALA 221 Ca -0.08 0.09 -0.42 0.00 0.00 0.00 0.00 53.44 53.03 1xkb n ALA 221 Cb 0.50 -1.23 -0.03 0.00 0.00 0.00 0.00 19.45 18.69 1xkb n ALA 221 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1xkb s ARG 222 N -2.05 4.18 0.45 0.00 0.52 -1.26 -4.63 118.95 116.16 1xkb s ARG 222 Ca 0.00 2.45 -0.23 0.00 -0.52 0.00 0.00 55.73 57.43 1xkb s ARG 222 Cb 0.00 -3.17 -0.10 0.00 0.52 0.00 0.00 34.95 32.20 1xkb s ARG 222 CO 0.00 -0.67 0.87 1.63 0.02 0.00 0.00 175.30 177.15 1xkb n LYS 223 N 4.12 1.07 0.00 3.54 4.01 -1.26 -1.51 118.16 128.14 1xkb n LYS 223 Ca 0.15 0.39 0.00 0.00 -0.51 0.00 0.00 58.31 58.34 1xkb n LYS 223 Cb 0.37 -1.91 0.00 0.00 -0.51 0.00 0.00 35.03 32.98 1xkb n LYS 223 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1xkb n GLY 223 N 1.37 2.73 3.61 0.72 0.00 -0.26 -4.95 105.19 108.41 1xkb n GLY 223 Ca 0.10 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.89 1xkb n GLY 223 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xkb s LYS 224 N 0.00 2.18 0.28 1.61 1.02 -0.57 -4.79 119.74 119.47 1xkb s LYS 224 Ca 0.00 -1.48 0.00 0.00 0.02 0.00 0.00 55.97 54.52 1xkb s LYS 224 Cb 0.00 -2.09 -0.00 0.00 -0.52 0.00 0.00 37.83 35.22 1xkb s LYS 224 CO 0.00 0.36 0.02 0.66 -0.92 0.00 0.00 175.35 175.47 1xkb n TYR 225 N -0.84 0.55 -3.81 3.18 4.01 -1.26 -4.53 117.16 114.47 1xkb n TYR 225 Ca -0.06 -1.44 -0.32 0.00 -0.16 0.00 0.00 57.90 55.92 1xkb n TYR 225 Cb 0.59 -0.15 -0.04 0.00 -0.31 0.00 0.00 39.34 39.42 1xkb n TYR 225 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 1xkb s GLY 226 N -2.56 2.21 -0.12 2.72 0.00 -1.07 -4.45 107.32 104.05 1xkb s GLY 226 Ca 0.02 -0.70 -0.00 0.00 0.00 0.00 0.00 44.72 44.04 1xkb s GLY 226 CO 0.02 -0.63 -0.11 -0.42 0.00 0.00 0.00 173.10 171.95 1xkb s ILE 227 N -1.53 3.23 0.24 0.90 -1.09 0.52 -2.51 121.20 120.95 1xkb s ILE 227 Ca 0.36 -0.61 0.09 0.00 -2.23 0.00 0.00 60.65 58.27 1xkb s ILE 227 Cb -0.13 -2.36 -0.05 0.00 -1.58 0.00 0.00 42.46 38.35 1xkb s ILE 227 CO 0.25 0.53 -0.16 -0.31 -1.23 0.00 0.00 174.94 174.02 1xkb s TYR 228 N 0.20 1.94 -0.39 3.97 1.51 -0.66 -1.74 117.35 122.19 1xkb s TYR 228 Ca -0.07 -0.50 -0.26 0.00 -1.01 0.00 0.00 57.07 55.24 1xkb s TYR 228 Cb -0.15 -0.90 0.02 0.00 -0.11 0.00 0.00 41.96 40.82 1xkb s TYR 228 CO 0.05 0.48 0.93 0.99 -1.11 0.00 0.00 175.55 176.88 1xkb s THR 229 N -2.81 4.56 -0.57 -0.71 2.01 -0.40 -1.70 115.64 116.03 1xkb s THR 229 Ca 0.26 1.11 -0.26 0.00 0.31 0.00 0.00 61.69 63.11 1xkb s THR 229 Cb -0.02 -4.35 -0.09 0.00 0.01 0.00 0.00 72.50 68.05 1xkb s THR 229 CO 0.10 -0.59 2.42 0.29 -0.69 0.00 0.00 174.62 176.15 1xkb n LYS 230 N 6.85 0.91 0.30 4.92 5.02 -0.97 -3.14 118.16 132.05 1xkb n LYS 230 Ca 0.07 -0.21 0.17 0.00 -2.02 0.00 0.00 58.31 56.32 1xkb n LYS 230 Cb 0.48 -3.49 0.95 0.00 -0.02 0.00 0.00 35.03 32.95 1xkb n LYS 230 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 1xkb h VAL 231 N 7.71 0.36 -0.26 -0.18 2.07 -1.90 -2.47 116.25 121.58 1xkb h VAL 231 Ca -0.18 -0.15 -0.03 0.00 0.82 0.00 0.00 66.70 67.16 1xkb h VAL 231 Cb 1.21 1.11 -0.01 0.00 -1.52 0.00 0.00 31.29 32.07 1xkb h VAL 231 CO 1.13 0.03 0.03 0.71 0.02 0.00 0.00 177.57 179.48 1xkb h THR 232 N 0.00 1.15 0.00 2.57 1.35 -1.86 0.25 112.91 116.36 1xkb h THR 232 Ca -0.00 -0.56 0.00 0.00 -0.55 0.00 0.00 66.41 65.30 1xkb h THR 232 Cb 0.11 0.93 0.00 0.00 -1.73 0.00 0.00 68.15 67.45 1xkb h THR 232 CO 0.00 0.19 0.00 0.00 -0.25 0.00 0.00 175.52 175.47 1xkb n ALA 233 N -2.49 1.66 -0.57 6.62 0.00 -0.93 -3.10 120.51 121.70 1xkb n ALA 233 Ca 0.01 0.06 0.04 0.00 0.00 0.00 0.00 53.44 53.55 1xkb n ALA 233 Cb 0.19 -1.36 0.06 0.00 0.00 0.00 0.00 19.45 18.33 1xkb n ALA 233 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1xkb n PHE 234 N -2.12 0.00 -0.29 0.00 3.72 -0.00 -4.75 117.46 114.01 1xkb n PHE 234 Ca 0.02 -0.65 -0.04 0.00 -0.05 0.00 0.00 57.45 56.73 1xkb n PHE 234 Cb 0.22 -0.09 0.07 0.00 -0.94 0.00 0.00 39.48 38.74 1xkb n PHE 234 CO 0.00 0.00 0.00 -0.07 -0.05 0.00 0.00 176.76 176.64 1xkb h LEU 235 N 0.00 0.92 -0.62 4.37 3.38 -1.28 0.54 115.31 122.63 1xkb h LEU 235 Ca 0.00 -0.04 -0.14 0.00 0.09 0.00 0.00 57.88 57.79 1xkb h LEU 235 Cb 0.77 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 41.27 1xkb h LEU 235 CO 0.00 0.69 -0.40 0.50 0.09 0.00 0.00 178.44 179.32 1xkb h LYS 236 N 1.07 0.63 -0.38 1.13 3.11 -1.85 -2.05 116.57 118.24 1xkb h LYS 236 Ca 0.29 -0.33 -0.05 0.00 -2.81 0.00 0.00 60.65 57.75 1xkb h LYS 236 Cb -0.08 0.01 -0.01 0.00 -1.00 0.00 0.00 32.23 31.14 1xkb h LYS 236 CO -0.06 0.93 0.05 2.35 -2.81 0.00 0.00 179.45 179.90 1xkb h TRP 237 N 0.52 0.68 0.30 1.91 7.01 -1.67 -2.59 115.95 122.11 1xkb h TRP 237 Ca 0.04 -0.10 -0.01 0.00 2.11 0.00 0.00 58.89 60.93 1xkb h TRP 237 Cb 0.92 -0.18 0.00 0.00 -2.10 0.00 0.00 29.16 27.80 1xkb h TRP 237 CO 0.04 0.69 -0.15 0.82 -2.79 0.00 0.00 178.44 177.06 1xkb h ILE 238 N 0.47 0.71 -0.97 2.65 2.04 0.21 -0.75 117.51 121.87 1xkb h ILE 238 Ca 0.11 -0.08 0.15 0.00 1.00 0.00 0.00 64.86 66.04 1xkb h ILE 238 Cb 0.39 0.76 -0.09 0.00 -0.74 0.00 0.00 36.82 37.14 1xkb h ILE 238 CO 0.01 0.02 0.61 0.44 0.00 0.00 0.00 178.15 179.23 1xkb h ASP 239 N -0.45 0.81 0.76 1.72 3.32 -1.40 0.63 116.42 121.81 1xkb h ASP 239 Ca -0.04 0.06 -0.03 0.00 0.02 0.00 0.00 57.03 57.03 1xkb h ASP 239 Cb 0.34 -0.10 -0.00 0.00 0.22 0.00 0.00 39.33 39.79 1xkb h ASP 239 CO 0.07 0.39 -0.45 0.03 -1.72 0.00 0.00 179.24 177.55 1xkb h ARG 240 N 0.84 -1.09 -0.95 3.56 3.08 -1.03 -2.08 114.38 116.71 1xkb h ARG 240 Ca 0.50 0.07 0.11 0.00 0.07 0.00 0.00 59.98 60.74 1xkb h ARG 240 Cb 0.67 0.25 -0.08 0.00 0.08 0.00 0.00 29.97 30.90 1xkb h ARG 240 CO -0.28 -0.73 0.61 0.77 -1.07 0.00 0.00 179.97 179.27 1xkb h SER 241 N -1.13 0.85 0.41 7.04 0.02 0.39 -0.71 113.55 120.42 1xkb h SER 241 Ca -0.10 0.04 0.00 0.00 -0.84 0.00 0.00 61.79 60.89 1xkb h SER 241 Cb 0.91 -0.14 0.00 0.00 0.14 0.00 0.00 62.40 63.31 1xkb h SER 241 CO 0.11 0.47 0.00 0.23 -1.14 0.00 0.00 176.83 176.50 1xkb n MET 242 N -4.57 0.19 -2.09 3.45 2.81 0.20 -3.32 117.12 113.79 1xkb n MET 242 Ca 0.17 0.14 -0.35 0.00 -1.81 0.00 0.00 57.70 55.84 1xkb n MET 242 Cb 0.35 -1.50 0.03 0.00 -0.71 0.00 0.00 33.22 31.39 1xkb n MET 242 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 1xkb n LYS 243 N -1.34 2.99 -4.18 0.03 5.02 -0.27 -5.00 118.16 115.40 1xkb n LYS 243 Ca 0.07 -3.85 -0.28 0.00 -2.02 0.00 0.00 58.31 52.23 1xkb n LYS 243 Cb 0.16 -2.26 -0.04 0.00 -0.02 0.00 0.00 35.03 32.87 1xkb n LYS 243 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 1xkb s THR 244 N -5.22 1.59 0.00 -0.18 -4.23 -1.21 -5.04 115.64 101.35 1xkb s THR 244 Ca 0.51 -1.67 0.00 0.00 -1.18 0.00 0.00 61.69 59.35 1xkb s THR 244 Cb 0.43 -2.26 0.00 0.00 1.34 0.00 0.00 72.50 72.01 1xkb s THR 244 CO -0.33 0.00 0.00 -2.11 -0.54 0.00 0.00 174.62 171.64