#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1f0r s VAL 17 N 0.00 5.42 0.00 1.39 1.01 0.33 -4.00 120.40 124.55 1f0r s VAL 17 Ca 0.00 0.23 0.00 0.00 0.00 0.00 0.00 61.98 62.21 1f0r s VAL 17 Cb 0.00 -3.47 0.00 0.00 0.00 0.00 0.00 36.38 32.91 1f0r s VAL 17 CO 0.00 0.47 0.00 0.61 0.00 0.00 0.00 175.10 176.18 1f0r n GLY 18 N 3.19 0.01 7.00 4.51 0.00 -1.25 -2.49 105.19 116.15 1f0r n GLY 18 Ca -0.16 -0.96 0.00 0.00 0.00 0.00 0.00 46.02 44.89 1f0r n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1f0r n GLY 19 N 0.00 -0.41 3.16 -0.02 0.00 -1.26 -4.94 105.19 101.72 1f0r n GLY 19 Ca 0.00 -1.09 -0.10 0.00 0.00 0.00 0.00 46.02 44.84 1f0r n GLY 19 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1f0r s GLN 20 N 0.00 0.94 0.39 1.61 -1.52 -0.42 -4.98 119.66 115.68 1f0r s GLN 20 Ca 0.00 -1.43 -0.27 0.00 -1.95 0.00 0.00 55.36 51.72 1f0r s GLN 20 Cb 0.00 0.25 -0.09 0.00 -0.22 0.00 0.00 33.01 32.95 1f0r s GLN 20 CO 0.00 -0.27 1.32 -1.21 -0.25 0.00 0.00 175.29 174.88 1f0r s GLU 21 N -4.05 4.02 0.01 2.91 2.02 -1.26 0.28 118.70 122.64 1f0r s GLU 21 Ca 0.24 2.21 -0.30 0.00 0.02 0.00 0.00 54.97 57.13 1f0r s GLU 21 Cb 0.07 -2.82 -0.04 0.00 0.10 0.00 0.00 34.13 31.45 1f0r s GLU 21 CO 0.02 -0.46 1.14 0.00 0.02 0.00 0.00 175.26 175.97 1f0r s LYS 23 N 1.43 2.28 -0.12 0.00 -0.14 -1.26 -4.91 119.74 117.02 1f0r s LYS 23 Ca 0.56 -0.07 -0.38 0.00 -1.36 0.00 0.00 55.97 54.71 1f0r s LYS 23 Cb -0.26 -2.11 -0.16 0.00 -1.68 0.00 0.00 37.83 33.62 1f0r s LYS 23 CO 0.26 -1.25 1.58 -3.47 -0.76 0.00 0.00 175.35 171.72 1f0r n ASP 24 N -2.99 2.14 0.00 2.83 2.03 -1.26 -1.10 116.55 118.20 1f0r n ASP 24 Ca 0.07 1.09 0.00 0.00 0.52 0.00 0.00 54.79 56.47 1f0r n ASP 24 Cb 0.60 -1.17 0.00 0.00 -0.72 0.00 0.00 41.12 39.83 1f0r n ASP 24 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1f0r n GLY 25 N 3.51 2.52 0.19 0.27 0.00 -1.26 -4.91 105.19 105.52 1f0r n GLY 25 Ca 0.23 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.32 1f0r n GLY 25 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1f0r h GLU 26 N 2.07 0.00 -2.05 1.61 5.08 -1.46 -3.36 114.58 116.47 1f0r h GLU 26 Ca 0.00 0.00 -0.51 0.00 -1.00 0.00 0.00 59.36 57.85 1f0r h GLU 26 Cb 0.00 0.00 -0.40 0.00 0.50 0.00 0.00 28.75 28.85 1f0r h GLU 26 CO 0.00 0.34 -1.10 0.00 -1.00 0.00 0.00 179.01 177.25 1f0r n PRO 28 N 0.31 0.19 0.00 0.00 -0.04 -1.26 -2.57 135.00 131.63 1f0r n PRO 28 Ca 0.26 0.45 0.13 0.00 -0.04 0.00 0.00 63.50 64.30 1f0r n PRO 28 Cb 0.60 -1.88 0.42 0.00 -0.04 0.00 0.00 33.50 32.60 1f0r n PRO 28 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 1f0r n TRP 29 N -2.24 0.00 -2.14 0.54 2.14 -1.10 -1.51 117.44 113.13 1f0r n TRP 29 Ca 0.02 0.00 -0.42 0.00 2.07 0.00 0.00 57.50 59.17 1f0r n TRP 29 Cb 0.21 -0.04 -0.03 0.00 -0.81 0.00 0.00 31.31 30.63 1f0r n TRP 29 CO 0.00 0.00 0.00 -1.14 2.07 0.00 0.00 177.69 178.62 1f0r s GLN 30 N -2.19 4.29 0.19 -2.67 2.00 -1.06 0.14 119.66 120.34 1f0r s GLN 30 Ca 0.32 2.09 0.10 0.00 -2.00 0.00 0.00 55.36 55.87 1f0r s GLN 30 Cb 0.20 -3.39 -0.04 0.00 0.80 0.00 0.00 33.01 30.58 1f0r s GLN 30 CO 0.41 -0.53 -0.18 0.00 -0.50 0.00 0.00 175.29 174.49 1f0r s ALA 31 N 1.71 2.72 -0.09 1.58 0.00 -0.46 -4.39 121.76 122.82 1f0r s ALA 31 Ca 0.66 -1.57 0.01 0.00 0.00 0.00 0.00 51.96 51.06 1f0r s ALA 31 Cb -0.36 -0.51 0.02 0.00 0.00 0.00 0.00 23.12 22.27 1f0r s ALA 31 CO 0.29 0.45 -0.10 -1.17 0.00 0.00 0.00 175.76 175.23 1f0r s LEU 32 N -2.75 1.43 -0.05 0.00 2.96 0.07 -1.78 118.68 118.57 1f0r s LEU 32 Ca 0.23 -0.30 -0.20 0.00 -0.22 0.00 0.00 54.13 53.63 1f0r s LEU 32 Cb -0.08 -0.82 -0.05 0.00 0.50 0.00 0.00 46.19 45.74 1f0r s LEU 32 CO 0.12 -0.04 0.59 -0.76 -1.32 0.00 0.00 176.35 174.94 1f0r s LEU 33 N 1.16 4.36 0.04 -0.68 1.43 -0.20 -0.21 118.68 124.57 1f0r s LEU 33 Ca -0.05 1.08 0.07 0.00 -1.03 0.00 0.00 54.13 54.19 1f0r s LEU 33 Cb -0.14 -2.90 -0.02 0.00 0.03 0.00 0.00 46.19 43.16 1f0r s LEU 33 CO -0.02 0.03 -0.20 0.27 0.23 0.00 0.00 176.35 176.66 1f0r s ILE 34 N 0.22 1.59 0.82 -0.59 -4.36 0.06 -1.52 121.20 117.42 1f0r s ILE 34 Ca 0.31 -1.16 -0.05 0.00 -0.26 0.00 0.00 60.65 59.49 1f0r s ILE 34 Cb -0.17 -1.38 0.17 0.00 1.25 0.00 0.00 42.46 42.32 1f0r s ILE 34 CO 0.16 0.19 1.12 0.54 0.24 0.00 0.00 174.94 177.19 1f0r s ASN 35 N -1.15 3.79 0.47 4.36 2.20 -0.44 -1.44 114.94 122.73 1f0r s ASN 35 Ca 0.07 -0.29 0.27 0.00 -0.94 0.00 0.00 52.86 51.97 1f0r s ASN 35 Cb -0.09 0.10 1.32 0.00 -2.00 0.00 0.00 41.25 40.58 1f0r s ASN 35 CO 0.02 -2.26 1.79 1.05 -2.94 0.00 0.00 177.10 174.76 1f0r h GLU 36 N -0.95 0.20 -0.58 3.55 9.09 -1.91 0.97 114.58 124.94 1f0r h GLU 36 Ca -0.37 -0.01 0.00 0.00 0.05 0.00 0.00 59.36 59.02 1f0r h GLU 36 Cb 1.25 -0.04 0.00 0.00 -1.65 0.00 0.00 28.75 28.30 1f0r h GLU 36 CO 0.36 0.13 0.00 -1.91 0.05 0.00 0.00 179.01 177.64 1f0r n GLU 37 N -4.43 2.25 -2.00 1.06 4.07 -1.26 -4.91 120.64 115.42 1f0r n GLU 37 Ca 0.25 -1.27 -0.20 0.00 -0.06 0.00 0.00 57.16 55.88 1f0r n GLU 37 Cb 1.04 -1.56 -0.05 0.00 -0.06 0.00 0.00 31.44 30.82 1f0r n GLU 37 CO 0.00 0.00 0.00 0.09 -0.06 0.00 0.00 177.13 177.16 1f0r n ASN 38 N 0.35 -5.55 -4.88 4.31 5.03 0.33 -5.00 115.26 109.86 1f0r n ASN 38 Ca 0.11 0.22 -0.36 0.00 0.87 0.00 0.00 54.58 55.42 1f0r n ASN 38 Cb 0.48 -4.69 -0.06 0.00 -1.02 0.00 0.00 39.78 34.49 1f0r n ASN 38 CO 0.00 0.00 0.00 -0.70 -1.83 0.00 0.00 177.26 174.73 1f0r s GLU 39 N -4.38 3.49 0.05 3.52 2.56 -1.25 -4.79 118.70 117.90 1f0r s GLU 39 Ca 0.00 -0.11 -0.30 0.00 0.00 0.00 0.00 54.97 54.55 1f0r s GLU 39 Cb 0.00 -3.17 -0.05 0.00 2.00 0.00 0.00 34.13 32.91 1f0r s GLU 39 CO 0.00 0.75 1.11 0.20 -0.56 0.00 0.00 175.26 176.75 1f0r s GLY 40 N -1.23 2.63 -0.00 -1.50 0.00 -1.26 -1.32 107.32 104.64 1f0r s GLY 40 Ca 0.19 0.73 0.00 0.00 0.00 0.00 0.00 44.72 45.64 1f0r s GLY 40 CO 0.08 1.87 0.01 1.97 0.00 0.00 0.00 173.10 177.04 1f0r n PHE 41 N 3.79 0.00 -3.97 1.90 1.16 -0.57 -4.96 117.46 114.80 1f0r n PHE 41 Ca 0.07 0.00 -0.09 0.00 -1.87 0.00 0.00 57.45 55.56 1f0r n PHE 41 Cb 0.48 -0.01 -0.04 0.00 -1.61 0.00 0.00 39.48 38.30 1f0r n PHE 41 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 1f0r s GLY 43 N -3.03 2.22 0.12 0.00 0.00 0.12 -1.04 107.32 105.72 1f0r s GLY 43 Ca 0.21 -1.42 -0.26 0.00 0.00 0.00 0.00 44.72 43.25 1f0r s GLY 43 CO 0.10 -1.90 0.89 -0.32 0.00 0.00 0.00 173.10 171.88 1f0r s GLY 44 N -4.41 -0.31 -0.06 0.20 0.00 -0.73 -3.53 107.32 98.49 1f0r s GLY 44 Ca 0.40 0.35 0.04 0.00 0.00 0.00 0.00 44.72 45.51 1f0r s GLY 44 CO 0.25 0.09 -0.18 -1.59 0.00 0.00 0.00 173.10 171.68 1f0r s THR 45 N -3.33 1.53 -0.12 0.90 2.01 0.13 -1.36 115.64 115.41 1f0r s THR 45 Ca 0.09 -0.76 -0.30 0.00 0.31 0.00 0.00 61.69 61.04 1f0r s THR 45 Cb -0.02 -1.33 -0.02 0.00 0.01 0.00 0.00 72.50 71.15 1f0r s THR 45 CO -0.01 0.44 1.16 -0.63 -0.69 0.00 0.00 174.62 174.88 1f0r s ILE 46 N 0.17 4.42 -0.18 1.82 1.01 0.12 -0.14 121.20 128.41 1f0r s ILE 46 Ca -0.08 1.72 0.18 0.00 0.00 0.00 0.00 60.65 62.47 1f0r s ILE 46 Cb -0.13 -4.11 -0.25 0.00 0.01 0.00 0.00 42.46 37.98 1f0r s ILE 46 CO 0.04 -0.06 0.10 0.18 0.00 0.00 0.00 174.94 175.20 1f0r n LEU 47 N 5.66 0.00 0.00 2.97 4.77 -0.32 -1.39 117.00 128.70 1f0r n LEU 47 Ca 0.11 0.00 -0.01 0.00 -0.03 0.00 0.00 56.01 56.08 1f0r n LEU 47 Cb 0.46 0.44 0.01 0.00 -2.33 0.00 0.00 43.42 42.00 1f0r n LEU 47 CO 0.54 0.44 0.44 -1.54 -1.33 0.00 0.00 177.39 175.94 1f0r n SER 48 N -2.68 -0.86 0.25 -1.43 3.41 -1.15 -4.69 113.62 106.46 1f0r n SER 48 Ca -0.29 -1.43 0.07 0.00 -0.26 0.00 0.00 58.87 56.96 1f0r n SER 48 Cb 1.09 1.40 0.60 0.00 -0.26 0.00 0.00 64.21 67.03 1f0r n SER 48 CO 0.00 0.00 0.00 1.05 -0.16 0.00 0.00 175.04 175.93 1f0r h GLU 49 N 0.00 0.00 0.00 4.33 4.11 -1.98 -3.15 114.58 117.89 1f0r h GLU 49 Ca -0.14 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.29 1f0r h GLU 49 Cb 0.62 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.87 1f0r h GLU 49 CO 0.19 0.08 -0.82 1.19 0.07 0.00 0.00 179.01 179.72 1f0r n PHE 50 N -4.39 0.00 -5.06 2.06 3.72 -1.26 0.24 117.46 112.78 1f0r n PHE 50 Ca -0.03 0.00 -0.29 0.00 -0.05 0.00 0.00 57.45 57.09 1f0r n PHE 50 Cb 0.16 -0.06 -0.16 0.00 -0.94 0.00 0.00 39.48 38.48 1f0r n PHE 50 CO 0.00 0.00 0.00 0.71 -0.05 0.00 0.00 176.76 177.42 1f0r s TYR 51 N -2.41 2.07 -0.07 1.38 2.02 -1.19 0.14 117.35 119.30 1f0r s TYR 51 Ca 0.03 -0.60 0.05 0.00 -0.37 0.00 0.00 57.07 56.18 1f0r s TYR 51 Cb 0.10 -1.37 -0.01 0.00 -0.40 0.00 0.00 41.96 40.28 1f0r s TYR 51 CO 0.57 -0.19 -0.22 0.42 -1.57 0.00 0.00 175.55 174.56 1f0r s ILE 52 N -0.08 2.34 -0.17 2.71 -1.09 -0.52 -1.17 121.20 123.21 1f0r s ILE 52 Ca -0.03 -0.96 -0.10 0.00 -2.23 0.00 0.00 60.65 57.33 1f0r s ILE 52 Cb -0.12 -1.88 -0.05 0.00 -1.58 0.00 0.00 42.46 38.83 1f0r s ILE 52 CO 0.03 0.57 0.17 -0.22 -1.23 0.00 0.00 174.94 174.25 1f0r s LEU 53 N -0.15 4.25 0.00 2.97 2.96 0.80 -0.47 118.68 129.05 1f0r s LEU 53 Ca -0.03 0.34 -0.01 0.00 -0.22 0.00 0.00 54.13 54.21 1f0r s LEU 53 Cb -0.14 -2.15 0.00 0.00 0.50 0.00 0.00 46.19 44.41 1f0r s LEU 53 CO 0.04 0.21 0.30 1.07 -1.32 0.00 0.00 176.35 176.64 1f0r n THR 54 N 3.21 0.00 -3.39 3.68 5.66 -0.43 0.19 114.28 123.20 1f0r n THR 54 Ca -0.16 -1.15 -0.38 0.00 -3.05 0.00 0.00 64.05 59.31 1f0r n THR 54 Cb 0.53 0.69 -0.06 0.00 -1.55 0.00 0.00 70.33 69.94 1f0r n THR 54 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1f0r s ALA 55 N -2.37 3.57 0.42 1.79 0.00 -1.26 -0.99 121.76 122.92 1f0r s ALA 55 Ca 0.19 -0.20 0.13 0.00 0.00 0.00 0.00 51.96 52.08 1f0r s ALA 55 Cb -0.00 -2.54 0.99 0.00 0.00 0.00 0.00 23.12 21.57 1f0r s ALA 55 CO 0.13 0.21 1.96 0.00 0.00 0.00 0.00 175.76 178.07 1f0r h ALA 56 N 5.83 1.99 0.00 0.00 0.00 -1.71 -1.65 119.26 123.72 1f0r h ALA 56 Ca -0.45 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.45 1f0r h ALA 56 Cb 1.19 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.89 1f0r h ALA 56 CO 0.70 -0.14 0.00 1.12 0.00 0.00 0.00 179.25 180.93 1f0r h HIS 57 N 0.46 0.00 0.00 0.00 2.07 -1.92 -2.15 115.15 113.61 1f0r h HIS 57 Ca 0.30 0.00 -0.11 0.00 -2.85 0.00 0.00 60.37 57.71 1f0r h HIS 57 Cb 0.56 0.00 -0.02 0.00 2.57 0.00 0.00 27.41 30.53 1f0r h HIS 57 CO -0.00 0.00 -0.53 0.00 -3.07 0.00 0.00 177.93 174.33 1f0r n LEU 59 N -3.81 0.65 -0.06 0.00 4.77 -0.81 -0.72 117.00 117.02 1f0r n LEU 59 Ca -0.01 0.71 0.12 0.00 -0.03 0.00 0.00 56.01 56.80 1f0r n LEU 59 Cb 0.56 -0.67 0.30 0.00 -2.33 0.00 0.00 43.42 41.28 1f0r n LEU 59 CO 0.40 -0.71 0.53 -1.22 -1.33 0.00 0.00 177.39 175.06 1f0r n TYR 60 N -2.27 0.00 0.74 -1.77 0.53 -1.15 -4.25 117.16 108.99 1f0r n TYR 60 Ca 0.01 0.00 0.13 0.00 -1.02 0.00 0.00 57.90 57.02 1f0r n TYR 60 Cb 0.16 -0.22 0.41 0.00 -1.03 0.00 0.00 39.34 38.66 1f0r n TYR 60 CO 0.00 0.00 0.00 0.94 -1.02 0.00 0.00 176.86 176.78 1f0r n GLN 61 N -1.27 0.18 -3.72 -0.72 -0.06 0.10 -4.92 117.38 106.96 1f0r n GLN 61 Ca 0.07 0.12 -0.13 0.00 -2.00 0.00 0.00 57.00 55.06 1f0r n GLN 61 Cb 0.34 -1.68 -0.10 0.00 -4.06 0.00 0.00 30.24 24.74 1f0r n GLN 61 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 1f0r s ALA 61 N -3.08 -1.06 0.10 1.69 0.00 -1.26 -5.05 121.76 113.10 1f0r s ALA 61 Ca 0.11 1.16 -0.23 0.00 0.00 0.00 0.00 51.96 52.99 1f0r s ALA 61 Cb 0.15 -0.64 -0.12 0.00 0.00 0.00 0.00 23.12 22.50 1f0r s ALA 61 CO 0.61 -0.21 1.72 -0.22 0.00 0.00 0.00 175.76 177.66 1f0r h LYS 62 N 5.30 -0.07 -3.56 0.00 3.64 -1.91 -3.44 116.57 116.52 1f0r h LYS 62 Ca -0.27 0.00 -0.15 0.00 -1.27 0.00 0.00 60.65 58.96 1f0r h LYS 62 Cb 1.18 0.02 -0.21 0.00 -0.41 0.00 0.00 32.23 32.81 1f0r h LYS 62 CO 0.25 -0.05 -0.52 0.50 -2.27 0.00 0.00 179.45 177.36 1f0r s ARG 63 N -6.18 0.45 0.09 1.90 3.52 -1.26 -5.15 118.95 112.33 1f0r s ARG 63 Ca -0.13 -0.40 -0.20 0.00 -0.13 0.00 0.00 55.73 54.86 1f0r s ARG 63 Cb 0.07 0.19 0.05 0.00 -1.56 0.00 0.00 34.95 33.69 1f0r s ARG 63 CO 0.66 -0.10 0.48 -0.59 -0.81 0.00 0.00 175.30 174.94 1f0r s PHE 64 N -1.34 -0.35 0.41 5.12 -0.71 -1.26 -3.77 117.98 116.07 1f0r s PHE 64 Ca -0.14 0.23 0.07 0.00 -1.04 0.00 0.00 56.93 56.05 1f0r s PHE 64 Cb -0.08 0.34 -0.08 0.00 -1.21 0.00 0.00 43.02 41.99 1f0r s PHE 64 CO 0.01 -0.69 0.01 0.15 -1.34 0.00 0.00 175.22 173.36 1f0r s LYS 65 N -3.12 1.95 -0.13 1.99 1.02 -0.52 -4.50 119.74 116.43 1f0r s LYS 65 Ca -0.01 -2.10 0.00 0.00 0.02 0.00 0.00 55.97 53.88 1f0r s LYS 65 Cb 0.00 -1.61 -0.02 0.00 -0.52 0.00 0.00 37.83 35.68 1f0r s LYS 65 CO -0.07 -0.05 -0.13 0.08 -0.92 0.00 0.00 175.35 174.26 1f0r s VAL 66 N -2.73 3.06 -0.13 3.17 1.01 0.09 -0.76 120.40 124.11 1f0r s VAL 66 Ca 0.35 -0.66 -0.02 0.00 0.00 0.00 0.00 61.98 61.65 1f0r s VAL 66 Cb 0.10 -2.28 -0.02 0.00 0.00 0.00 0.00 36.38 34.17 1f0r s VAL 66 CO 0.18 0.53 -0.07 -0.60 0.00 0.00 0.00 175.10 175.14 1f0r s ARG 67 N 0.29 3.38 0.25 2.72 3.52 0.70 0.05 118.95 129.86 1f0r s ARG 67 Ca -0.10 -0.57 0.11 0.00 -0.13 0.00 0.00 55.73 55.03 1f0r s ARG 67 Cb -0.16 -2.76 -0.05 0.00 -1.56 0.00 0.00 34.95 30.43 1f0r s ARG 67 CO 0.05 0.33 -0.18 0.14 -0.81 0.00 0.00 175.30 174.83 1f0r s VAL 68 N 0.08 2.23 0.00 7.11 -7.23 -0.15 -0.75 120.40 121.69 1f0r s VAL 68 Ca -0.02 -2.32 0.00 0.00 -1.81 0.00 0.00 61.98 57.83 1f0r s VAL 68 Cb -0.14 -2.20 0.00 0.00 0.56 0.00 0.00 36.38 34.60 1f0r s VAL 68 CO 0.03 -0.45 0.00 0.61 -0.31 0.00 0.00 175.10 174.99 1f0r n GLY 69 N -0.49 0.61 3.75 2.32 0.00 -1.25 -1.17 105.19 108.96 1f0r n GLY 69 Ca -0.06 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.58 1f0r n GLY 69 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1f0r s ASP 70 N -2.38 6.77 0.00 1.61 2.15 -1.26 -4.15 116.67 119.40 1f0r s ASP 70 Ca 0.00 0.91 0.00 0.00 0.43 0.00 0.00 52.55 53.89 1f0r s ASP 70 Cb 0.00 -2.30 0.00 0.00 -0.30 0.00 0.00 42.92 40.32 1f0r s ASP 70 CO 0.00 0.07 0.00 0.54 -0.17 0.00 0.00 175.17 175.61 1f0r n ARG 71 N 3.20 3.00 -3.44 4.34 1.74 -1.26 -4.84 116.66 119.40 1f0r n ARG 71 Ca -0.08 0.00 -0.19 0.00 -0.77 0.00 0.00 57.85 56.81 1f0r n ARG 71 Cb 0.52 -0.78 -0.11 0.00 -1.02 0.00 0.00 32.46 31.07 1f0r n ARG 71 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 1f0r s ASN 72 N -1.54 1.76 0.00 0.55 3.04 -1.26 -1.28 114.94 116.21 1f0r s ASN 72 Ca 0.00 -0.63 0.10 0.00 0.04 0.00 0.00 52.86 52.37 1f0r s ASN 72 Cb 0.00 0.39 0.52 0.00 -1.54 0.00 0.00 41.25 40.63 1f0r s ASN 72 CO 0.00 -0.37 1.14 0.35 -3.04 0.00 0.00 177.10 175.18 1f0r n THR 73 N 5.31 0.53 0.47 -5.21 -2.24 0.04 -2.62 114.28 110.55 1f0r n THR 73 Ca -0.04 0.13 0.12 0.00 -2.27 0.00 0.00 64.05 62.00 1f0r n THR 73 Cb 0.47 -0.97 0.26 0.00 -2.10 0.00 0.00 70.33 67.99 1f0r n THR 73 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 1f0r h GLU 74 N 0.00 0.00 -2.09 -0.78 4.39 -1.96 -3.46 114.58 110.68 1f0r h GLU 74 Ca 0.00 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.69 1f0r h GLU 74 Cb 0.06 0.00 -0.22 0.00 -0.10 0.00 0.00 28.75 28.49 1f0r h GLU 74 CO 0.00 0.00 0.00 1.14 -1.16 0.00 0.00 179.01 178.99 1f0r s GLN 75 N -3.16 0.70 0.18 2.33 -2.07 -1.08 -5.11 119.66 111.44 1f0r s GLN 75 Ca 0.08 1.11 -0.32 0.00 -1.82 0.00 0.00 55.36 54.41 1f0r s GLN 75 Cb 0.11 0.19 -0.11 0.00 -1.09 0.00 0.00 33.01 32.10 1f0r s GLN 75 CO 0.66 -0.14 1.66 -1.21 -1.32 0.00 0.00 175.29 174.94 1f0r s GLU 76 N 1.28 4.17 -0.16 9.60 8.01 -1.26 -4.79 118.70 135.55 1f0r s GLU 76 Ca -0.07 2.49 0.13 0.00 0.01 0.00 0.00 54.97 57.53 1f0r s GLU 76 Cb -0.05 -3.14 -0.19 0.00 -4.31 0.00 0.00 34.13 26.43 1f0r s GLU 76 CO -0.14 -0.69 0.03 -1.91 0.01 0.00 0.00 175.26 172.56 1f0r n GLU 77 N 4.09 1.29 0.00 1.61 4.07 -1.26 -5.03 120.64 125.41 1f0r n GLU 77 Ca 0.15 0.01 0.00 0.00 -0.06 0.00 0.00 57.16 57.26 1f0r n GLU 77 Cb 0.37 -1.41 0.00 0.00 -0.06 0.00 0.00 31.44 30.34 1f0r n GLU 77 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1f0r n GLY 78 N 2.06 2.58 0.07 8.31 0.00 -1.26 -4.96 105.19 111.99 1f0r n GLY 78 Ca -0.27 -0.56 0.15 0.00 0.00 0.00 0.00 46.02 45.34 1f0r n GLY 78 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1f0r n GLY 79 N 0.00 -1.06 3.81 -0.02 0.00 -1.26 -4.92 105.19 101.73 1f0r n GLY 79 Ca 0.00 -0.22 -0.32 0.00 0.00 0.00 0.00 46.02 45.48 1f0r n GLY 79 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1f0r s GLU 80 N -2.45 3.24 -0.22 1.61 8.01 -1.26 -4.52 118.70 123.10 1f0r s GLU 80 Ca 0.31 1.14 -0.14 0.00 0.01 0.00 0.00 54.97 56.30 1f0r s GLU 80 Cb 0.20 -2.02 0.07 0.00 -4.31 0.00 0.00 34.13 28.06 1f0r s GLU 80 CO 0.46 -0.87 0.54 0.00 0.01 0.00 0.00 175.26 175.39 1f0r s ALA 81 N -2.59 -1.40 -0.07 5.21 0.00 -0.32 -4.99 121.76 117.60 1f0r s ALA 81 Ca 0.62 1.85 -0.08 0.00 0.00 0.00 0.00 51.96 54.35 1f0r s ALA 81 Cb -0.15 -1.10 -0.04 0.00 0.00 0.00 0.00 23.12 21.82 1f0r s ALA 81 CO 0.41 -0.30 0.21 0.08 0.00 0.00 0.00 175.76 176.15 1f0r s VAL 82 N 1.26 5.39 -0.02 0.00 1.01 -1.26 -0.98 120.40 125.79 1f0r s VAL 82 Ca -0.08 0.26 0.01 0.00 0.00 0.00 0.00 61.98 62.17 1f0r s VAL 82 Cb -0.06 -3.49 0.01 0.00 0.00 0.00 0.00 36.38 32.84 1f0r s VAL 82 CO -0.13 0.54 -0.03 -1.00 0.00 0.00 0.00 175.10 174.48 1f0r s HIS 83 N -1.12 0.46 0.35 5.22 3.76 0.11 -5.00 115.29 119.07 1f0r s HIS 83 Ca 0.20 -0.08 -0.11 0.00 -0.15 0.00 0.00 55.06 54.91 1f0r s HIS 83 Cb -0.13 -0.40 -0.07 0.00 1.11 0.00 0.00 32.58 33.09 1f0r s HIS 83 CO 0.09 -0.08 0.71 -1.21 -0.85 0.00 0.00 174.74 173.40 1f0r s GLU 84 N 0.46 3.84 -0.12 1.40 2.02 -1.26 -0.73 118.70 124.30 1f0r s GLU 84 Ca -0.05 0.47 -0.18 0.00 0.02 0.00 0.00 54.97 55.22 1f0r s GLU 84 Cb -0.08 -2.45 -0.04 0.00 0.10 0.00 0.00 34.13 31.65 1f0r s GLU 84 CO -0.01 0.09 0.49 0.08 0.02 0.00 0.00 175.26 175.93 1f0r s VAL 85 N -2.16 5.17 -0.15 2.63 1.01 -1.26 -1.06 120.40 124.59 1f0r s VAL 85 Ca 0.51 0.98 -0.09 0.00 0.00 0.00 0.00 61.98 63.38 1f0r s VAL 85 Cb -0.10 -3.83 -0.24 0.00 0.00 0.00 0.00 36.38 32.21 1f0r s VAL 85 CO 0.26 0.31 0.28 1.21 0.00 0.00 0.00 175.10 177.16 1f0r n GLU 86 N 3.80 0.71 -3.78 2.72 2.13 0.01 -4.74 120.64 121.48 1f0r n GLU 86 Ca -0.06 0.32 -0.13 0.00 0.66 0.00 0.00 57.16 57.94 1f0r n GLU 86 Cb 0.51 -1.70 -0.14 0.00 0.27 0.00 0.00 31.44 30.38 1f0r n GLU 86 CO 0.00 0.00 0.00 0.08 -0.41 0.00 0.00 177.13 176.80 1f0r s VAL 87 N -2.52 -0.04 -0.30 6.31 1.01 -0.97 -4.99 120.40 118.91 1f0r s VAL 87 Ca -0.25 0.13 -0.08 0.00 0.00 0.00 0.00 61.98 61.78 1f0r s VAL 87 Cb 0.07 -0.16 -0.00 0.00 0.00 0.00 0.00 36.38 36.28 1f0r s VAL 87 CO 0.72 0.05 0.11 -0.69 0.00 0.00 0.00 175.10 175.29 1f0r s VAL 88 N 0.78 4.28 -0.49 2.92 1.01 -1.26 -0.57 120.40 127.07 1f0r s VAL 88 Ca -0.06 -0.52 -0.08 0.00 0.00 0.00 0.00 61.98 61.31 1f0r s VAL 88 Cb -0.08 -3.18 0.13 0.00 0.00 0.00 0.00 36.38 33.25 1f0r s VAL 88 CO -0.03 0.10 0.35 -0.63 0.00 0.00 0.00 175.10 174.89 1f0r s ILE 89 N 1.56 4.12 0.16 2.22 1.01 0.12 -5.00 121.20 125.39 1f0r s ILE 89 Ca 0.04 -1.92 -0.11 0.00 0.00 0.00 0.00 60.65 58.65 1f0r s ILE 89 Cb -0.17 -3.72 -0.07 0.00 0.01 0.00 0.00 42.46 38.52 1f0r s ILE 89 CO 0.04 -0.78 0.51 -0.75 0.00 0.00 0.00 174.94 173.96 1f0r s LYS 90 N 1.20 3.86 0.15 2.79 2.20 -1.26 -0.42 119.74 128.26 1f0r s LYS 90 Ca 0.07 0.33 -0.31 0.00 -0.36 0.00 0.00 55.97 55.70 1f0r s LYS 90 Cb -0.25 -2.85 -0.10 0.00 -1.51 0.00 0.00 37.83 33.12 1f0r s LYS 90 CO -0.02 0.45 1.57 -1.58 -0.36 0.00 0.00 175.35 175.41 1f0r s HIS 91 N -1.57 3.00 0.30 4.03 5.65 -1.01 -4.90 115.29 120.80 1f0r s HIS 91 Ca 0.40 0.61 0.01 0.00 0.25 0.00 0.00 55.06 56.33 1f0r s HIS 91 Cb -0.13 -3.92 0.54 0.00 -1.18 0.00 0.00 32.58 27.89 1f0r s HIS 91 CO 0.20 -3.42 1.89 -2.95 -0.65 0.00 0.00 174.74 169.81 1f0r h ASN 92 N 6.99 0.91 -0.22 9.88 -1.07 -1.94 -2.54 115.58 127.58 1f0r h ASN 92 Ca -0.43 0.02 0.00 0.00 0.07 0.00 0.00 56.30 55.96 1f0r h ASN 92 Cb 1.20 -0.17 0.00 0.00 -2.07 0.00 0.00 38.32 37.28 1f0r h ASN 92 CO 0.91 0.55 0.00 0.54 0.07 0.00 0.00 177.43 179.50 1f0r n ARG 93 N -4.53 2.04 -2.54 4.14 1.74 -1.26 -4.95 116.66 111.31 1f0r n ARG 93 Ca 0.16 -1.02 -0.41 0.00 -0.77 0.00 0.00 57.85 55.80 1f0r n ARG 93 Cb 0.26 -1.54 -0.04 0.00 -1.02 0.00 0.00 32.46 30.12 1f0r n ARG 93 CO 0.00 0.00 0.00 0.12 -1.52 0.00 0.00 177.63 176.23 1f0r s PHE 94 N -1.63 3.61 -0.16 -1.55 5.36 -0.96 -4.63 117.98 118.02 1f0r s PHE 94 Ca 0.18 1.60 -0.00 0.00 -0.96 0.00 0.00 56.93 57.75 1f0r s PHE 94 Cb 0.12 -3.26 0.04 0.00 -0.34 0.00 0.00 43.02 39.58 1f0r s PHE 94 CO 0.08 -0.55 -0.06 0.95 -1.46 0.00 0.00 175.22 174.18 1f0r s THR 95 N -0.08 1.11 0.50 0.12 -4.23 -0.93 -4.99 115.64 107.14 1f0r s THR 95 Ca 0.50 -0.58 0.24 0.00 -1.18 0.00 0.00 61.69 60.67 1f0r s THR 95 Cb -0.28 -1.26 0.41 0.00 1.34 0.00 0.00 72.50 72.71 1f0r s THR 95 CO 0.34 0.17 1.95 0.11 -0.54 0.00 0.00 174.62 176.64 1f0r h LYS 96 N 8.12 0.12 -0.37 3.99 1.57 -1.96 0.50 116.57 128.55 1f0r h LYS 96 Ca -0.25 -0.01 -0.10 0.00 -1.87 0.00 0.00 60.65 58.42 1f0r h LYS 96 Cb 1.11 -0.03 -0.02 0.00 0.08 0.00 0.00 32.23 33.38 1f0r h LYS 96 CO 0.40 0.08 -0.19 0.93 -0.57 0.00 0.00 179.45 180.10 1f0r h GLU 97 N 0.12 0.69 0.00 3.15 4.39 -1.97 -3.33 114.58 117.64 1f0r h GLU 97 Ca 0.33 -0.26 0.00 0.00 0.34 0.00 0.00 59.36 59.78 1f0r h GLU 97 Cb 1.14 -0.04 0.00 0.00 -0.10 0.00 0.00 28.75 29.75 1f0r h GLU 97 CO -0.04 0.84 -0.66 0.25 -1.16 0.00 0.00 179.01 178.23 1f0r n THR 98 N -4.13 0.00 -1.68 1.13 -2.24 -0.98 -5.00 114.28 101.38 1f0r n THR 98 Ca 0.00 -0.28 -0.08 0.00 -2.27 0.00 0.00 64.05 61.43 1f0r n THR 98 Cb 0.40 0.76 -0.02 0.00 -2.10 0.00 0.00 70.33 69.38 1f0r n THR 98 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 1f0r n TYR 99 N -1.36 -0.18 -3.14 4.78 4.02 0.13 -4.97 117.16 116.44 1f0r n TYR 99 Ca 0.00 0.00 -0.32 0.00 -0.01 0.00 0.00 57.90 57.58 1f0r n TYR 99 Cb 0.12 -1.84 -0.05 0.00 -0.02 0.00 0.00 39.34 37.55 1f0r n TYR 99 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 176.86 176.19 1f0r s ASP 100 N -2.79 6.67 -1.27 7.72 2.15 -1.23 -4.07 116.67 123.85 1f0r s ASP 100 Ca 0.00 1.15 -0.02 0.00 0.43 0.00 0.00 52.55 54.11 1f0r s ASP 100 Cb 0.00 -2.32 0.01 0.00 -0.30 0.00 0.00 42.92 40.30 1f0r s ASP 100 CO 0.00 -0.22 0.91 0.49 -0.17 0.00 0.00 175.17 176.18 1f0r n PHE 101 N -0.55 -2.16 -2.58 -5.34 3.01 -1.26 -2.20 117.46 106.39 1f0r n PHE 101 Ca 0.02 0.91 -0.43 0.00 1.01 0.00 0.00 57.45 58.96 1f0r n PHE 101 Cb 0.53 -4.77 0.00 0.00 -0.01 0.00 0.00 39.48 35.23 1f0r n PHE 101 CO 0.00 0.00 0.00 -3.47 1.01 0.00 0.00 176.76 174.30 1f0r n ASP 102 N -3.08 5.14 -3.78 4.37 2.03 -1.26 -4.25 116.55 115.72 1f0r n ASP 102 Ca -0.25 -3.06 -0.13 0.00 0.52 0.00 0.00 54.79 51.88 1f0r n ASP 102 Cb 0.65 -1.52 -0.10 0.00 -0.72 0.00 0.00 41.12 39.44 1f0r n ASP 102 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 1f0r s ILE 103 N 0.88 0.04 -0.08 5.18 2.07 -1.26 -4.10 121.20 123.92 1f0r s ILE 103 Ca 0.41 -0.30 -0.21 0.00 -1.41 0.00 0.00 60.65 59.13 1f0r s ILE 103 Cb 0.05 -0.49 0.05 0.00 0.13 0.00 0.00 42.46 42.19 1f0r s ILE 103 CO 0.00 -0.17 0.50 0.00 -1.91 0.00 0.00 174.94 173.37 1f0r s ALA 104 N -0.69 -1.28 -0.09 1.50 0.00 -0.16 -2.39 121.76 118.66 1f0r s ALA 104 Ca -0.08 1.03 0.03 0.00 0.00 0.00 0.00 51.96 52.94 1f0r s ALA 104 Cb -0.04 -0.25 -0.01 0.00 0.00 0.00 0.00 23.12 22.81 1f0r s ALA 104 CO 0.02 -0.29 -0.18 0.08 0.00 0.00 0.00 175.76 175.39 1f0r s VAL 105 N -0.77 2.65 -0.20 0.00 1.01 0.44 -1.31 120.40 122.22 1f0r s VAL 105 Ca -0.08 -0.84 -0.05 0.00 0.00 0.00 0.00 61.98 61.01 1f0r s VAL 105 Cb -0.03 -2.04 -0.02 0.00 0.00 0.00 0.00 36.38 34.28 1f0r s VAL 105 CO 0.05 0.56 -0.01 -0.76 0.00 0.00 0.00 175.10 174.93 1f0r s LEU 106 N -0.04 3.17 -0.16 3.92 1.43 0.39 0.15 118.68 127.52 1f0r s LEU 106 Ca -0.05 -0.24 -0.16 0.00 -1.03 0.00 0.00 54.13 52.65 1f0r s LEU 106 Cb -0.14 -1.80 -0.04 0.00 0.03 0.00 0.00 46.19 44.23 1f0r s LEU 106 CO 0.04 0.05 0.39 -0.60 0.23 0.00 0.00 176.35 176.47 1f0r s ARG 107 N 1.05 4.25 0.30 1.70 3.52 0.27 -1.44 118.95 128.61 1f0r s ARG 107 Ca 0.02 0.25 -0.17 0.00 -0.13 0.00 0.00 55.73 55.70 1f0r s ARG 107 Cb -0.14 -3.47 -0.09 0.00 -1.56 0.00 0.00 34.95 29.69 1f0r s ARG 107 CO 0.01 0.11 0.75 -0.51 -0.81 0.00 0.00 175.30 174.84 1f0r s LEU 108 N 0.84 4.13 0.14 -0.88 1.43 0.12 -0.81 118.68 123.65 1f0r s LEU 108 Ca 0.20 1.34 -0.14 0.00 -1.03 0.00 0.00 54.13 54.50 1f0r s LEU 108 Cb -0.14 -3.98 0.00 0.00 0.03 0.00 0.00 46.19 42.10 1f0r s LEU 108 CO 0.07 -0.15 1.63 0.11 0.23 0.00 0.00 176.35 178.24 1f0r h LYS 109 N 2.53 0.72 -6.81 1.70 1.57 -1.39 -3.42 116.57 111.48 1f0r h LYS 109 Ca -0.48 -0.18 -0.69 0.00 -1.87 0.00 0.00 60.65 57.43 1f0r h LYS 109 Cb 1.18 -0.09 -0.22 0.00 0.08 0.00 0.00 32.23 33.18 1f0r h LYS 109 CO 0.65 0.73 -0.85 0.95 -0.57 0.00 0.00 179.45 180.36 1f0r s THR 110 N -5.26 2.42 0.44 -0.16 -4.23 -1.26 -5.01 115.64 102.58 1f0r s THR 110 Ca -0.13 -1.59 -0.24 0.00 -1.18 0.00 0.00 61.69 58.54 1f0r s THR 110 Cb 0.11 -2.06 -0.08 0.00 1.34 0.00 0.00 72.50 71.81 1f0r s THR 110 CO 0.78 0.16 1.24 -2.16 -0.54 0.00 0.00 174.62 174.10 1f0r s PRO 111 N -1.90 3.81 0.25 3.99 0.04 -1.26 -4.88 135.00 135.05 1f0r s PRO 111 Ca 0.15 1.98 -0.30 0.00 0.04 0.00 0.00 61.00 62.87 1f0r s PRO 111 Cb -0.10 -2.57 -0.09 0.00 0.04 0.00 0.00 34.50 31.78 1f0r s PRO 111 CO 0.06 -0.56 0.94 0.42 0.04 0.00 0.00 177.00 177.90 1f0r s ILE 112 N -1.38 4.08 -0.33 0.56 1.01 0.14 -5.01 121.20 120.26 1f0r s ILE 112 Ca 0.61 2.07 -0.12 0.00 0.00 0.00 0.00 60.65 63.21 1f0r s ILE 112 Cb -0.34 -4.30 -0.01 0.00 0.01 0.00 0.00 42.46 37.82 1f0r s ILE 112 CO 0.42 0.47 0.21 -0.89 0.00 0.00 0.00 174.94 175.15 1f0r s THR 113 N -1.22 5.01 0.44 2.92 2.01 -1.26 -4.70 115.64 118.84 1f0r s THR 113 Ca 0.42 -0.32 -0.24 0.00 0.31 0.00 0.00 61.69 61.86 1f0r s THR 113 Cb -0.25 -3.58 -0.08 0.00 0.01 0.00 0.00 72.50 68.60 1f0r s THR 113 CO 0.31 0.01 1.21 -0.36 -0.69 0.00 0.00 174.62 175.10 1f0r s PHE 114 N 1.68 2.86 0.03 4.92 0.08 -1.26 -4.94 117.98 121.34 1f0r s PHE 114 Ca 0.05 1.51 -0.06 0.00 0.12 0.00 0.00 56.93 58.55 1f0r s PHE 114 Cb -0.17 -3.47 0.02 0.00 -0.57 0.00 0.00 43.02 38.83 1f0r s PHE 114 CO 0.09 -1.68 0.28 2.89 -0.10 0.00 0.00 175.22 176.70 1f0r n ARG 115 N -0.30 0.13 -1.67 0.44 1.85 -0.27 -4.99 116.66 111.85 1f0r n ARG 115 Ca 0.06 -0.32 -0.45 0.00 -1.00 0.00 0.00 57.85 56.14 1f0r n ARG 115 Cb 0.47 0.46 -0.03 0.00 -1.05 0.00 0.00 32.46 32.30 1f0r n ARG 115 CO 0.00 0.00 0.00 -0.12 -0.01 0.00 0.00 177.63 177.50 1f0r n MET 116 N -0.20 2.02 -0.98 2.89 0.00 -1.26 -0.50 117.12 119.09 1f0r n MET 116 Ca -0.00 0.72 0.00 0.00 -0.00 0.00 0.00 57.70 58.42 1f0r n MET 116 Cb 0.15 -2.40 0.00 0.00 0.00 0.00 0.00 33.22 30.97 1f0r n MET 116 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 175.97 176.06 1f0r n ASN 117 N 2.44 -4.82 -3.67 6.12 3.02 -1.26 -4.96 115.26 112.14 1f0r n ASN 117 Ca 0.13 0.00 -0.28 0.00 -0.03 0.00 0.00 54.58 54.40 1f0r n ASN 117 Cb 0.30 -2.60 -0.16 0.00 -0.61 0.00 0.00 39.78 36.71 1f0r n ASN 117 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1f0r s VAL 118 N -1.32 0.31 -0.04 2.41 1.01 0.34 -3.86 120.40 119.26 1f0r s VAL 118 Ca 0.00 -0.62 -0.29 0.00 0.00 0.00 0.00 61.98 61.07 1f0r s VAL 118 Cb 0.00 -1.00 0.09 0.00 0.00 0.00 0.00 36.38 35.48 1f0r s VAL 118 CO 0.00 -0.39 0.80 0.00 0.00 0.00 0.00 175.10 175.51 1f0r s ALA 119 N 1.94 -1.80 0.55 5.51 0.00 -0.57 -1.11 121.76 126.28 1f0r s ALA 119 Ca 0.03 1.22 -0.10 0.00 0.00 0.00 0.00 51.96 53.11 1f0r s ALA 119 Cb -0.17 -0.00 -0.05 0.00 0.00 0.00 0.00 23.12 22.90 1f0r s ALA 119 CO -0.16 -0.47 0.94 -1.25 0.00 0.00 0.00 175.76 174.82 1f0r s PRO 120 N -1.89 3.64 0.14 0.00 0.04 -1.26 -2.72 135.00 132.95 1f0r s PRO 120 Ca -0.04 0.60 -0.02 0.00 0.04 0.00 0.00 61.00 61.58 1f0r s PRO 120 Cb -0.00 -2.19 -0.05 0.00 0.04 0.00 0.00 34.50 32.29 1f0r s PRO 120 CO 0.01 -0.39 0.34 0.00 0.04 0.00 0.00 177.00 177.00 1f0r s ALA 121 N -2.93 3.86 0.34 8.56 0.00 -0.48 -4.84 121.76 126.26 1f0r s ALA 121 Ca 0.53 -0.72 -0.24 0.00 0.00 0.00 0.00 51.96 51.54 1f0r s ALA 121 Cb -0.11 -2.01 -0.10 0.00 0.00 0.00 0.00 23.12 20.90 1f0r s ALA 121 CO 0.47 0.63 0.91 0.00 0.00 0.00 0.00 175.76 177.77 1f0r s LEU 123 N -2.40 4.21 0.84 0.00 1.43 -1.26 -0.80 118.68 120.70 1f0r s LEU 123 Ca 0.53 0.71 -0.09 0.00 -1.03 0.00 0.00 54.13 54.25 1f0r s LEU 123 Cb -0.15 -2.66 0.16 0.00 0.03 0.00 0.00 46.19 43.56 1f0r s LEU 123 CO 0.20 -0.08 1.16 -2.16 0.23 0.00 0.00 176.35 175.71 1f0r s PRO 124 N 1.11 1.18 0.15 1.29 0.04 -1.26 -4.98 135.00 132.53 1f0r s PRO 124 Ca 0.24 -0.71 -0.11 0.00 0.04 0.00 0.00 61.00 60.46 1f0r s PRO 124 Cb -0.15 -2.08 -0.07 0.00 0.04 0.00 0.00 34.50 32.25 1f0r s PRO 124 CO 0.09 -1.93 0.49 -1.21 0.04 0.00 0.00 177.00 174.48 1f0r s GLU 124 N -5.53 3.83 0.07 4.56 2.02 -1.26 -4.98 118.70 117.40 1f0r s GLU 124 Ca 0.70 0.27 -0.31 0.00 0.02 0.00 0.00 54.97 55.65 1f0r s GLU 124 Cb -0.05 -2.86 -0.15 0.00 0.10 0.00 0.00 34.13 31.16 1f0r s GLU 124 CO 0.49 0.46 1.48 -0.09 0.02 0.00 0.00 175.26 177.61 1f0r h ARG 125 N 3.25 -0.89 0.05 1.61 1.12 -1.98 0.22 114.38 117.76 1f0r h ARG 125 Ca -0.48 0.06 0.02 0.00 -1.11 0.00 0.00 59.98 58.47 1f0r h ARG 125 Cb 1.18 0.20 -0.03 0.00 -0.01 0.00 0.00 29.97 31.31 1f0r h ARG 125 CO 0.68 -0.59 -0.19 -0.44 -3.11 0.00 0.00 179.97 176.31 1f0r h ASP 126 N -0.92 -0.54 -0.93 -3.80 5.19 -1.96 0.15 116.42 113.61 1f0r h ASP 126 Ca -0.07 0.07 0.02 0.00 -0.62 0.00 0.00 57.03 56.43 1f0r h ASP 126 Cb 0.78 0.21 -0.05 0.00 0.18 0.00 0.00 39.33 40.45 1f0r h ASP 126 CO -0.00 -0.26 0.61 -0.25 -3.12 0.00 0.00 179.24 176.22 1f0r h TRP 127 N -0.33 1.15 -0.24 4.55 7.01 -1.99 -0.69 115.95 125.41 1f0r h TRP 127 Ca 0.04 0.03 0.02 0.00 2.11 0.00 0.00 58.89 61.09 1f0r h TRP 127 Cb 0.38 -0.39 -0.02 0.00 -2.10 0.00 0.00 29.16 27.03 1f0r h TRP 127 CO -0.21 0.70 0.11 0.00 -2.79 0.00 0.00 178.44 176.26 1f0r h ALA 128 N 1.36 0.29 -0.69 2.65 0.00 0.22 0.11 119.26 123.19 1f0r h ALA 128 Ca 0.35 0.01 -0.07 0.00 0.00 0.00 0.00 54.91 55.20 1f0r h ALA 128 Cb -0.09 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 17.64 1f0r h ALA 128 CO -0.09 -0.29 0.15 0.93 0.00 0.00 0.00 179.25 179.95 1f0r h GLU 129 N 0.24 1.12 0.03 0.00 5.08 -0.45 0.13 114.58 120.74 1f0r h GLU 129 Ca 0.10 -0.28 -0.24 0.00 -1.00 0.00 0.00 59.36 57.94 1f0r h GLU 129 Cb 0.03 -0.14 0.01 0.00 0.50 0.00 0.00 28.75 29.15 1f0r h GLU 129 CO -0.07 1.00 -1.03 0.77 -1.00 0.00 0.00 179.01 178.67 1f0r h SER 130 N 1.05 0.58 0.00 1.42 0.02 -0.89 -3.38 113.55 112.34 1f0r h SER 130 Ca 0.21 -0.49 -0.13 0.00 -0.84 0.00 0.00 61.79 60.55 1f0r h SER 130 Cb 0.39 -0.18 -0.02 0.00 0.14 0.00 0.00 62.40 62.73 1f0r h SER 130 CO 0.01 1.31 -1.55 0.41 -1.14 0.00 0.00 176.83 175.86 1f0r n THR 131 N -3.72 0.48 -0.09 -2.27 -1.04 0.37 -4.49 114.28 103.52 1f0r n THR 131 Ca -0.08 -0.33 -0.13 0.00 -2.04 0.00 0.00 64.05 61.47 1f0r n THR 131 Cb 0.88 -0.60 -0.06 0.00 -1.82 0.00 0.00 70.33 68.73 1f0r n THR 131 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 1f0r h LEU 131 N 0.00 0.00 0.00 -4.42 4.07 -0.86 -3.33 115.31 110.77 1f0r h LEU 131 Ca -0.19 -0.24 0.00 0.00 0.08 0.00 0.00 57.88 57.53 1f0r h LEU 131 Cb 1.34 0.00 0.00 0.00 1.08 0.00 0.00 40.66 43.08 1f0r h LEU 131 CO 0.01 1.10 0.00 0.23 -1.08 0.00 0.00 178.44 178.70 1f0r n MET 131 N -4.53 0.54 -0.00 1.13 2.81 -0.45 -0.94 117.12 115.67 1f0r n MET 131 Ca -0.19 0.00 0.11 0.00 -1.81 0.00 0.00 57.70 55.81 1f0r n MET 131 Cb 0.46 -1.29 -0.13 0.00 -0.71 0.00 0.00 33.22 31.54 1f0r n MET 131 CO 0.00 0.00 0.00 2.41 1.51 0.00 0.00 175.97 179.89 1f0r n THR 132 N -0.79 0.03 -0.68 2.03 -1.04 -1.26 -4.96 114.28 107.61 1f0r n THR 132 Ca 0.08 -0.32 -0.30 0.00 -2.04 0.00 0.00 64.05 61.47 1f0r n THR 132 Cb 0.03 0.34 0.19 0.00 -1.82 0.00 0.00 70.33 69.07 1f0r n THR 132 CO 0.00 0.00 0.00 -1.58 -0.64 0.00 0.00 175.07 172.85 1f0r s GLN 133 N -3.32 0.38 0.07 -2.82 2.00 -0.11 -4.94 119.66 110.92 1f0r s GLN 133 Ca -0.02 1.27 -0.18 0.00 -2.00 0.00 0.00 55.36 54.43 1f0r s GLN 133 Cb 0.15 -1.67 -0.10 0.00 0.80 0.00 0.00 33.01 32.18 1f0r s GLN 133 CO 0.88 -2.98 1.44 0.87 -0.50 0.00 0.00 175.29 175.00 1f0r h LYS 134 N -2.11 0.48 -4.76 1.67 1.57 -1.93 -3.43 116.57 108.07 1f0r h LYS 134 Ca -0.50 -0.21 -0.29 0.00 -1.87 0.00 0.00 60.65 57.78 1f0r h LYS 134 Cb 1.29 -0.01 -0.15 0.00 0.08 0.00 0.00 32.23 33.44 1f0r h LYS 134 CO 0.45 0.75 -0.63 0.95 -0.57 0.00 0.00 179.45 180.40 1f0r s THR 135 N -4.60 0.43 0.40 -0.16 -4.23 -1.26 -1.47 115.64 104.75 1f0r s THR 135 Ca -0.14 -1.99 0.05 0.00 -1.18 0.00 0.00 61.69 58.44 1f0r s THR 135 Cb 0.07 -2.42 -0.02 0.00 1.34 0.00 0.00 72.50 71.47 1f0r s THR 135 CO 0.77 -0.17 0.17 0.61 -0.54 0.00 0.00 174.62 175.46 1f0r n GLY 136 N -0.33 3.16 2.92 3.99 0.00 -0.59 -4.69 105.19 109.65 1f0r n GLY 136 Ca -0.02 -2.07 -0.20 0.00 0.00 0.00 0.00 46.02 43.73 1f0r n GLY 136 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1f0r s ILE 137 N -3.15 0.60 0.16 -0.61 1.01 0.15 -1.18 121.20 118.18 1f0r s ILE 137 Ca 0.25 -0.18 0.09 0.00 0.00 0.00 0.00 60.65 60.81 1f0r s ILE 137 Cb 0.01 -0.61 -0.04 0.00 0.01 0.00 0.00 42.46 41.83 1f0r s ILE 137 CO 0.17 0.23 -0.13 0.54 0.00 0.00 0.00 174.94 175.76 1f0r s VAL 138 N 0.79 3.06 0.09 2.92 0.11 -0.39 -1.39 120.40 125.59 1f0r s VAL 138 Ca -0.11 -1.61 -0.17 0.00 -2.93 0.00 0.00 61.98 57.16 1f0r s VAL 138 Cb -0.14 -2.48 0.04 0.00 -1.53 0.00 0.00 36.38 32.27 1f0r s VAL 138 CO 0.01 -0.03 0.41 -0.94 -3.33 0.00 0.00 175.10 171.22 1f0r s SER 139 N -2.58 -0.27 0.00 3.54 1.04 -1.18 -0.44 113.70 113.81 1f0r s SER 139 Ca 0.22 -0.16 0.00 0.00 0.48 0.00 0.00 55.95 56.49 1f0r s SER 139 Cb -0.09 0.46 0.00 0.00 0.10 0.00 0.00 66.02 66.48 1f0r s SER 139 CO 0.13 -0.77 0.00 0.61 0.98 0.00 0.00 173.24 174.19 1f0r n GLY 140 N 0.09 -0.09 1.28 7.32 0.00 -0.16 -4.31 105.19 109.32 1f0r n GLY 140 Ca -0.17 -1.12 0.10 0.00 0.00 0.00 0.00 46.02 44.82 1f0r n GLY 140 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1f0r n PHE 141 N -0.61 1.05 -0.56 1.61 3.72 -1.26 -1.87 117.46 119.55 1f0r n PHE 141 Ca 0.00 -0.56 -0.15 0.00 -0.05 0.00 0.00 57.45 56.70 1f0r n PHE 141 Cb 0.00 -0.10 0.13 0.00 -0.94 0.00 0.00 39.48 38.56 1f0r n PHE 141 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1f0r n GLY 142 N 1.16 -2.99 3.68 1.37 0.00 -1.26 0.10 105.19 107.24 1f0r n GLY 142 Ca 0.22 -1.40 -0.39 0.00 0.00 0.00 0.00 46.02 44.45 1f0r n GLY 142 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1f0r n ARG 143 N -3.35 1.46 -0.09 1.61 1.74 0.14 -2.08 116.66 116.09 1f0r n ARG 143 Ca 0.07 0.54 0.12 0.00 -0.77 0.00 0.00 57.85 57.81 1f0r n ARG 143 Cb 0.29 -2.35 0.20 0.00 -1.02 0.00 0.00 32.46 29.58 1f0r n ARG 143 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 1f0r n THR 144 N -1.01 0.25 -3.65 0.55 -2.24 -1.25 -0.83 114.28 106.10 1f0r n THR 144 Ca 0.11 -0.59 -0.15 0.00 -2.27 0.00 0.00 64.05 61.14 1f0r n THR 144 Cb 0.44 1.11 -0.07 0.00 -2.10 0.00 0.00 70.33 69.70 1f0r n THR 144 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 1f0r s HIS 145 N -1.75 -0.42 0.28 4.78 3.76 -1.26 -4.41 115.29 116.26 1f0r s HIS 145 Ca 0.34 0.73 0.01 0.00 -0.15 0.00 0.00 55.06 55.99 1f0r s HIS 145 Cb 0.21 0.24 0.65 0.00 1.11 0.00 0.00 32.58 34.80 1f0r s HIS 145 CO 0.31 -0.48 1.67 1.49 -0.85 0.00 0.00 174.74 176.87 1f0r h GLU 147 N 3.58 0.26 -0.02 1.40 4.81 -1.91 -2.25 114.58 120.46 1f0r h GLU 147 Ca -0.28 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 58.93 1f0r h GLU 147 Cb 1.16 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 30.48 1f0r h GLU 147 CO 0.38 0.17 -0.41 1.63 -0.73 0.00 0.00 179.01 180.05 1f0r n LYS 148 N -5.17 1.30 0.00 1.92 5.02 -1.26 -4.93 118.16 115.04 1f0r n LYS 148 Ca 0.20 -1.05 0.00 0.00 -2.02 0.00 0.00 58.31 55.44 1f0r n LYS 148 Cb 0.62 -1.48 0.00 0.00 -0.02 0.00 0.00 35.03 34.16 1f0r n LYS 148 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1f0r n GLY 149 N 1.41 -2.72 4.01 0.72 0.00 -0.85 -5.08 105.19 102.67 1f0r n GLY 149 Ca 0.10 -1.39 -0.17 0.00 0.00 0.00 0.00 46.02 44.56 1f0r n GLY 149 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1f0r s ARG 150 N -2.67 2.89 0.46 1.61 3.52 -1.26 -4.91 118.95 118.59 1f0r s ARG 150 Ca 0.00 -1.19 -0.25 0.00 -0.13 0.00 0.00 55.73 54.16 1f0r s ARG 150 Cb 0.00 -2.77 -0.08 0.00 -1.56 0.00 0.00 34.95 30.54 1f0r s ARG 150 CO 0.00 -0.20 1.38 0.94 -0.81 0.00 0.00 175.30 176.61 1f0r n GLN 151 N -1.81 2.09 -2.46 5.12 -0.06 -1.26 -3.85 117.38 115.15 1f0r n GLN 151 Ca 0.06 0.75 -0.34 0.00 -2.00 0.00 0.00 57.00 55.47 1f0r n GLN 151 Cb 0.59 -2.56 -0.02 0.00 -4.06 0.00 0.00 30.24 24.19 1f0r n GLN 151 CO 0.00 0.00 0.00 0.45 -0.20 0.00 0.00 177.06 177.31 1f0r s SER 152 N -0.55 6.17 0.03 1.69 0.15 0.11 -4.88 113.70 116.42 1f0r s SER 152 Ca 0.63 2.01 0.21 0.00 0.70 0.00 0.00 55.95 59.50 1f0r s SER 152 Cb -0.46 -2.57 -0.20 0.00 -1.71 0.00 0.00 66.02 61.08 1f0r s SER 152 CO 0.57 -0.90 0.64 1.07 1.20 0.00 0.00 173.24 175.81 1f0r n THR 153 N -1.03 0.52 -4.81 6.45 5.66 -1.26 -4.75 114.28 115.06 1f0r n THR 153 Ca 0.10 -0.59 -0.33 0.00 -3.05 0.00 0.00 64.05 60.18 1f0r n THR 153 Cb 0.52 -0.26 -0.13 0.00 -1.55 0.00 0.00 70.33 68.91 1f0r n THR 153 CO 0.00 0.00 0.00 -0.13 -3.05 0.00 0.00 175.07 171.89 1f0r s ARG 154 N -3.26 2.56 0.14 1.09 1.81 -1.26 -0.78 118.95 119.24 1f0r s ARG 154 Ca -0.05 -0.66 -0.31 0.00 -1.72 0.00 0.00 55.73 52.98 1f0r s ARG 154 Cb 0.11 -2.43 -0.09 0.00 -0.45 0.00 0.00 34.95 32.09 1f0r s ARG 154 CO 0.85 0.63 1.52 -1.17 -0.68 0.00 0.00 175.30 176.45 1f0r s LEU 155 N -0.78 4.37 0.28 2.53 2.96 -0.40 -4.68 118.68 122.96 1f0r s LEU 155 Ca 0.12 2.52 0.09 0.00 -0.22 0.00 0.00 54.13 56.63 1f0r s LEU 155 Cb -0.11 -3.59 -0.06 0.00 0.50 0.00 0.00 46.19 42.94 1f0r s LEU 155 CO 0.01 -0.77 -0.11 -0.54 -1.32 0.00 0.00 176.35 173.61 1f0r s LYS 156 N 1.21 1.61 0.07 1.98 1.02 -0.78 -0.93 119.74 123.92 1f0r s LYS 156 Ca 0.68 -1.79 0.02 0.00 0.02 0.00 0.00 55.97 54.91 1f0r s LYS 156 Cb -0.41 -1.42 -0.04 0.00 -0.52 0.00 0.00 37.83 35.45 1f0r s LYS 156 CO 0.31 0.15 -0.07 0.00 -0.92 0.00 0.00 175.35 174.82 1f0r s MET 157 N -3.64 0.71 -0.11 1.68 0.23 0.14 -0.98 119.30 117.33 1f0r s MET 157 Ca 0.29 -1.11 -0.08 0.00 -1.03 0.00 0.00 55.69 53.76 1f0r s MET 157 Cb 0.01 -0.21 0.04 0.00 -1.53 0.00 0.00 34.83 33.14 1f0r s MET 157 CO 0.13 -0.00 0.28 -1.17 -2.03 0.00 0.00 175.02 172.23 1f0r s LEU 158 N -2.50 0.58 -0.17 0.18 0.20 0.41 -1.31 118.68 116.08 1f0r s LEU 158 Ca 0.03 0.58 -0.29 0.00 0.69 0.00 0.00 54.13 55.15 1f0r s LEU 158 Cb -0.00 0.90 -0.00 0.00 -0.43 0.00 0.00 46.19 46.65 1f0r s LEU 158 CO -0.03 -0.14 1.00 -1.61 -0.29 0.00 0.00 176.35 175.28 1f0r s GLU 159 N 0.80 4.34 -0.15 1.98 2.02 -1.26 -1.26 118.70 125.17 1f0r s GLU 159 Ca -0.05 1.34 0.01 0.00 0.02 0.00 0.00 54.97 56.29 1f0r s GLU 159 Cb -0.07 -3.59 0.02 0.00 0.10 0.00 0.00 34.13 30.59 1f0r s GLU 159 CO -0.05 -0.46 -0.18 0.14 0.02 0.00 0.00 175.26 174.73 1f0r s VAL 160 N 2.55 1.84 0.42 2.63 -7.23 -0.32 -4.96 120.40 115.32 1f0r s VAL 160 Ca 0.45 -0.82 -0.26 0.00 -1.81 0.00 0.00 61.98 59.54 1f0r s VAL 160 Cb -0.17 -1.66 -0.09 0.00 0.56 0.00 0.00 36.38 35.02 1f0r s VAL 160 CO 0.12 0.50 1.42 -2.84 -0.31 0.00 0.00 175.10 173.99 1f0r s PRO 161 N 1.15 3.86 0.42 4.82 0.02 -1.26 -1.54 135.00 142.48 1f0r s PRO 161 Ca -0.01 2.41 -0.25 0.00 0.02 0.00 0.00 61.00 63.17 1f0r s PRO 161 Cb -0.14 -2.77 -0.08 0.00 0.02 0.00 0.00 34.50 31.53 1f0r s PRO 161 CO -0.07 -0.67 1.23 0.71 -0.33 0.00 0.00 177.00 177.87 1f0r s TYR 162 N -1.19 2.90 -0.14 6.54 2.02 -0.54 -1.45 117.35 125.50 1f0r s TYR 162 Ca 0.58 1.49 -0.01 0.00 -0.37 0.00 0.00 57.07 58.76 1f0r s TYR 162 Cb -0.43 -3.52 -0.02 0.00 -0.40 0.00 0.00 41.96 37.59 1f0r s TYR 162 CO 0.57 -1.73 -0.12 0.08 -1.57 0.00 0.00 175.55 172.78 1f0r s VAL 163 N -1.36 3.13 0.05 0.71 1.01 -0.74 -4.86 120.40 118.34 1f0r s VAL 163 Ca 0.59 -0.63 -0.38 0.00 0.00 0.00 0.00 61.98 61.56 1f0r s VAL 163 Cb -0.34 -2.32 -0.18 0.00 0.00 0.00 0.00 36.38 33.54 1f0r s VAL 163 CO 0.43 0.52 1.28 -0.67 0.00 0.00 0.00 175.10 176.65 1f0r n ASP 164 N 3.57 1.21 -0.23 3.32 2.03 -1.26 -4.59 116.55 120.61 1f0r n ASP 164 Ca -0.18 1.13 0.10 0.00 0.52 0.00 0.00 54.79 56.36 1f0r n ASP 164 Cb 0.53 -1.12 0.38 0.00 -0.72 0.00 0.00 41.12 40.19 1f0r n ASP 164 CO 0.00 0.00 0.00 -0.09 -1.92 0.00 0.00 177.20 175.19 1f0r h ARG 165 N 4.19 0.67 -0.03 -0.67 2.43 -1.98 -1.11 114.38 117.89 1f0r h ARG 165 Ca -0.49 -0.04 -0.03 0.00 -0.81 0.00 0.00 59.98 58.62 1f0r h ARG 165 Cb 1.36 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 30.76 1f0r h ARG 165 CO 0.75 0.45 -0.08 -0.91 -1.51 0.00 0.00 179.97 178.66 1f0r h ASN 166 N 0.69 0.13 -0.18 -3.80 2.35 -1.99 -0.85 115.58 111.93 1f0r h ASN 166 Ca 0.40 -0.60 -0.04 0.00 -0.55 0.00 0.00 56.30 55.51 1f0r h ASN 166 Cb 0.57 -0.04 -0.02 0.00 0.05 0.00 0.00 38.32 38.89 1f0r h ASN 166 CO -0.16 0.70 0.02 0.28 -1.65 0.00 0.00 177.43 176.62 1f0r h SER 167 N -0.44 0.38 0.24 5.81 0.02 -1.90 -1.27 113.55 116.39 1f0r h SER 167 Ca -0.00 -0.06 -0.01 0.00 -0.84 0.00 0.00 61.79 60.88 1f0r h SER 167 Cb 0.69 -0.10 0.00 0.00 0.14 0.00 0.00 62.40 63.13 1f0r h SER 167 CO 0.02 0.43 -0.12 0.00 -1.14 0.00 0.00 176.83 176.02 1f0r h LYS 169 N -0.35 0.85 -0.27 0.00 1.57 -0.69 -2.44 116.57 115.24 1f0r h LYS 169 Ca -0.03 -0.05 -0.08 0.00 -1.87 0.00 0.00 60.65 58.62 1f0r h LYS 169 Cb 0.27 -0.19 -0.01 0.00 0.08 0.00 0.00 32.23 32.37 1f0r h LYS 169 CO 0.05 0.56 -0.17 -0.07 -0.57 0.00 0.00 179.45 179.26 1f0r h LEU 170 N 0.87 0.45 -1.05 2.94 3.38 -0.89 -3.09 115.31 117.93 1f0r h LEU 170 Ca 0.36 -0.13 -0.05 0.00 0.09 0.00 0.00 57.88 58.15 1f0r h LEU 170 Cb 0.20 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 1f0r h LEU 170 CO -0.19 0.64 -0.26 0.77 0.09 0.00 0.00 178.44 179.50 1f0r h SER 171 N 0.42 0.00 -3.18 -0.43 4.64 -0.62 -3.46 113.55 110.92 1f0r h SER 171 Ca 0.07 0.00 -0.58 0.00 -0.47 0.00 0.00 61.79 60.81 1f0r h SER 171 Cb 0.54 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.58 1f0r h SER 171 CO 0.03 0.26 -0.08 -0.55 -0.87 0.00 0.00 176.83 175.63 1f0r s SER 172 N -6.25 7.00 0.28 4.97 0.15 -1.10 -4.81 113.70 113.94 1f0r s SER 172 Ca 0.01 1.19 0.26 0.00 0.70 0.00 0.00 55.95 58.10 1f0r s SER 172 Cb 0.10 -2.33 0.76 0.00 -1.71 0.00 0.00 66.02 62.84 1f0r s SER 172 CO 0.65 0.29 1.74 0.28 1.20 0.00 0.00 173.24 177.40 1f0r h SER 173 N 4.58 0.00 -2.67 5.45 0.02 -1.89 -3.45 113.55 115.59 1f0r h SER 173 Ca -0.50 0.00 -0.63 0.00 -0.84 0.00 0.00 61.79 59.82 1f0r h SER 173 Cb 1.22 0.00 -0.16 0.00 0.14 0.00 0.00 62.40 63.59 1f0r h SER 173 CO 0.63 0.00 -0.79 -0.36 -1.14 0.00 0.00 176.83 175.17 1f0r s PHE 174 N -3.18 2.31 0.11 3.45 0.08 -1.26 -5.09 117.98 114.39 1f0r s PHE 174 Ca 0.09 -0.34 -0.31 0.00 0.12 0.00 0.00 56.93 56.49 1f0r s PHE 174 Cb 0.10 -1.07 -0.10 0.00 -0.57 0.00 0.00 43.02 41.39 1f0r s PHE 174 CO 0.58 0.62 1.84 0.42 -0.10 0.00 0.00 175.22 178.58 1f0r s ILE 175 N -2.11 2.64 -0.62 0.64 -1.09 -1.26 -4.95 121.20 114.44 1f0r s ILE 175 Ca 0.26 0.07 -0.21 0.00 -2.23 0.00 0.00 60.65 58.53 1f0r s ILE 175 Cb -0.06 -3.04 0.08 0.00 -1.58 0.00 0.00 42.46 37.85 1f0r s ILE 175 CO 0.13 -0.00 0.86 -0.63 -1.23 0.00 0.00 174.94 174.06 1f0r s ILE 176 N 3.01 4.52 1.05 2.92 -1.09 -1.26 -5.03 121.20 125.33 1f0r s ILE 176 Ca 0.82 -0.50 -0.16 0.00 -2.23 0.00 0.00 60.65 58.58 1f0r s ILE 176 Cb -0.45 -4.58 0.22 0.00 -1.58 0.00 0.00 42.46 36.06 1f0r s ILE 176 CO 0.37 -1.27 1.14 0.42 -1.23 0.00 0.00 174.94 174.37 1f0r s THR 177 N 3.53 1.85 -1.01 2.92 -4.23 -1.26 -4.91 115.64 112.52 1f0r s THR 177 Ca 0.19 0.00 0.19 0.00 -1.18 0.00 0.00 61.69 60.89 1f0r s THR 177 Cb -0.19 -2.62 0.16 0.00 1.34 0.00 0.00 72.50 71.18 1f0r s THR 177 CO 0.10 0.00 1.59 0.00 -0.54 0.00 0.00 174.62 175.77 1f0r n GLN 178 N -4.25 0.00 -0.59 3.99 0.00 -1.26 -2.20 117.38 113.08 1f0r n GLN 178 Ca 0.10 0.18 0.07 0.00 0.00 0.00 0.00 57.00 57.34 1f0r n GLN 178 Cb 0.59 -1.50 0.30 0.00 0.00 0.00 0.00 30.24 29.63 1f0r n GLN 178 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.06 177.15 1f0r n ASN 179 N -1.50 4.26 -4.13 2.61 3.02 -1.26 -4.91 115.26 113.35 1f0r n ASN 179 Ca 0.05 -2.51 -0.09 0.00 -0.03 0.00 0.00 54.58 51.99 1f0r n ASN 179 Cb 0.22 -0.57 -0.10 0.00 -0.61 0.00 0.00 39.78 38.71 1f0r n ASN 179 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 1f0r s MET 180 N -2.04 0.71 0.23 3.52 -1.94 -0.93 -1.14 119.30 117.72 1f0r s MET 180 Ca 0.42 -1.23 -0.09 0.00 -1.71 0.00 0.00 55.69 53.08 1f0r s MET 180 Cb 0.29 -0.05 -0.02 0.00 2.01 0.00 0.00 34.83 37.07 1f0r s MET 180 CO 0.17 -0.05 0.36 -0.59 -0.01 0.00 0.00 175.02 174.90 1f0r s PHE 181 N -3.51 0.65 0.06 -0.03 -0.12 -0.12 -4.75 117.98 110.16 1f0r s PHE 181 Ca 0.08 -0.96 0.08 0.00 -0.05 0.00 0.00 56.93 56.07 1f0r s PHE 181 Cb 0.05 -0.07 -0.03 0.00 -0.63 0.00 0.00 43.02 42.33 1f0r s PHE 181 CO -0.06 -0.88 -0.19 0.00 -0.05 0.00 0.00 175.22 174.03 1f0r s ALA 183 N -0.96 -1.44 0.00 0.00 0.00 -0.79 -1.79 121.76 116.78 1f0r s ALA 183 Ca 0.15 0.84 0.00 0.00 0.00 0.00 0.00 51.96 52.95 1f0r s ALA 183 Cb -0.10 0.21 0.00 0.00 0.00 0.00 0.00 23.12 23.23 1f0r s ALA 183 CO 0.06 -0.43 0.00 0.41 0.00 0.00 0.00 175.76 175.80 1f0r n GLY 184 N 0.69 0.65 3.21 0.00 0.00 -0.53 -1.69 105.19 107.52 1f0r n GLY 184 Ca -0.19 -1.90 -0.19 0.00 0.00 0.00 0.00 46.02 43.73 1f0r n GLY 184 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1f0r s TYR 185 N -2.05 1.37 -0.02 1.61 2.02 -1.26 -4.08 117.35 114.94 1f0r s TYR 185 Ca 0.00 -0.48 -0.20 0.00 -0.37 0.00 0.00 57.07 56.02 1f0r s TYR 185 Cb 0.00 -0.75 -0.12 0.00 -0.40 0.00 0.00 41.96 40.69 1f0r s TYR 185 CO 0.00 0.11 0.85 0.22 -1.57 0.00 0.00 175.55 175.16 1f0r h ASP 185 N 4.01 -0.57 0.00 2.29 3.58 -1.91 -3.42 116.42 120.40 1f0r h ASP 185 Ca -0.41 -0.01 -0.07 0.00 0.42 0.00 0.00 57.03 56.96 1f0r h ASP 185 Cb 1.19 0.15 -0.01 0.00 1.72 0.00 0.00 39.33 42.37 1f0r h ASP 185 CO 0.43 -0.15 -1.35 0.35 -2.88 0.00 0.00 179.24 175.64 1f0r n THR 185 N -5.22 0.26 -1.69 2.25 -2.24 -1.26 -0.32 114.28 106.05 1f0r n THR 185 Ca -0.09 -0.21 -0.43 0.00 -2.27 0.00 0.00 64.05 61.05 1f0r n THR 185 Cb 0.28 -0.44 -0.01 0.00 -2.10 0.00 0.00 70.33 68.06 1f0r n THR 185 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 1f0r n LYS 186 N -2.04 2.12 -1.72 -0.78 4.81 -1.26 -4.73 118.16 114.54 1f0r n LYS 186 Ca -0.06 0.75 -0.42 0.00 -0.87 0.00 0.00 58.31 57.70 1f0r n LYS 186 Cb 0.51 -2.36 -0.00 0.00 0.02 0.00 0.00 35.03 33.20 1f0r n LYS 186 CO 0.00 0.00 0.00 1.04 1.17 0.00 0.00 177.40 179.61 1f0r n GLN 187 N 1.15 2.87 -3.75 1.64 1.13 -1.26 -4.74 117.38 114.41 1f0r n GLN 187 Ca 0.07 -2.60 -0.13 0.00 -1.94 0.00 0.00 57.00 52.41 1f0r n GLN 187 Cb 0.34 -3.28 -0.11 0.00 0.11 0.00 0.00 30.24 27.31 1f0r n GLN 187 CO 0.00 0.00 0.00 -1.21 -1.44 0.00 0.00 177.06 174.41 1f0r s GLU 188 N 3.17 0.37 0.00 -1.09 2.02 -1.26 -3.96 118.70 117.95 1f0r s GLU 188 Ca 0.47 0.48 0.00 0.00 0.02 0.00 0.00 54.97 55.95 1f0r s GLU 188 Cb 0.14 0.16 0.00 0.00 0.10 0.00 0.00 34.13 34.53 1f0r s GLU 188 CO -0.09 -0.06 0.00 -3.47 0.02 0.00 0.00 175.26 171.66 1f0r n ASP 189 N 3.07 0.00 -4.20 -0.19 2.03 -1.04 -4.44 116.55 111.77 1f0r n ASP 189 Ca -0.14 0.00 -0.30 0.00 0.52 0.00 0.00 54.79 54.87 1f0r n ASP 189 Cb 0.57 0.00 0.18 0.00 -0.72 0.00 0.00 41.12 41.15 1f0r n ASP 189 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1f0r s ALA 190 N -2.00 1.95 0.20 -1.67 0.00 -1.26 -0.51 121.76 118.46 1f0r s ALA 190 Ca 0.00 -1.05 -0.07 0.00 0.00 0.00 0.00 51.96 50.85 1f0r s ALA 190 Cb 0.00 -2.83 0.03 0.00 0.00 0.00 0.00 23.12 20.31 1f0r s ALA 190 CO 0.00 -2.56 0.38 0.00 0.00 0.00 0.00 175.76 173.58 1f0r n GLN 192 N -0.27 2.24 0.00 0.00 7.27 -1.26 -1.48 117.38 123.87 1f0r n GLN 192 Ca -0.04 0.79 0.00 0.00 0.07 0.00 0.00 57.00 57.82 1f0r n GLN 192 Cb 0.30 -2.45 0.00 0.00 2.41 0.00 0.00 30.24 30.49 1f0r n GLN 192 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1f0r n GLY 193 N 1.62 3.05 0.03 1.69 0.00 -1.26 0.27 105.19 110.58 1f0r n GLY 193 Ca 0.08 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.23 1f0r n GLY 193 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1f0r n ASP 194 N 0.00 0.30 -4.67 1.61 8.00 -0.55 -3.80 116.55 117.44 1f0r n ASP 194 Ca 0.00 0.34 -0.42 0.00 0.71 0.00 0.00 54.79 55.42 1f0r n ASP 194 Cb 0.00 -0.36 -0.00 0.00 -0.02 0.00 0.00 41.12 40.74 1f0r n ASP 194 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1f0r n SER 195 N -1.69 2.29 0.00 -2.24 7.64 -1.26 -1.66 113.62 116.70 1f0r n SER 195 Ca 0.06 1.15 0.00 0.00 1.01 0.00 0.00 58.87 61.10 1f0r n SER 195 Cb 0.36 -1.44 0.00 0.00 -1.01 0.00 0.00 64.21 62.12 1f0r n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1f0r n GLY 196 N 0.90 2.48 3.63 0.23 0.00 0.03 0.16 105.19 112.62 1f0r n GLY 196 Ca 0.06 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.80 1f0r n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1f0r s GLY 197 N -1.87 1.55 0.23 -0.02 0.00 -0.66 -2.71 107.32 103.84 1f0r s GLY 197 Ca 0.00 -0.37 -0.30 0.00 0.00 0.00 0.00 44.72 44.05 1f0r s GLY 197 CO 0.00 0.28 1.04 -4.14 0.00 0.00 0.00 173.10 170.29 1f0r s PRO 198 N -4.89 4.70 -0.17 2.90 0.02 -1.26 -1.48 135.00 134.82 1f0r s PRO 198 Ca 0.66 1.67 0.01 0.00 0.02 0.00 0.00 61.00 63.35 1f0r s PRO 198 Cb -0.20 -3.25 0.03 0.00 0.02 0.00 0.00 34.50 31.10 1f0r s PRO 198 CO 0.59 0.27 -0.12 -1.58 -0.33 0.00 0.00 177.00 175.82 1f0r s HIS 199 N -0.85 2.28 0.16 6.54 2.46 -0.90 -3.08 115.29 121.90 1f0r s HIS 199 Ca 0.45 -1.39 0.07 0.00 0.47 0.00 0.00 55.06 54.66 1f0r s HIS 199 Cb -0.29 -1.61 -0.04 0.00 -0.13 0.00 0.00 32.58 30.50 1f0r s HIS 199 CO 0.36 -0.70 -0.15 0.14 -2.47 0.00 0.00 174.74 171.92 1f0r s VAL 200 N 1.45 1.58 -0.08 0.89 -7.23 -0.49 -1.01 120.40 115.51 1f0r s VAL 200 Ca 0.02 -1.97 0.04 0.00 -1.81 0.00 0.00 61.98 58.26 1f0r s VAL 200 Cb -0.14 -1.82 0.00 0.00 0.56 0.00 0.00 36.38 34.98 1f0r s VAL 200 CO -0.10 -0.48 -0.20 -0.89 -0.31 0.00 0.00 175.10 173.12 1f0r s THR 201 N -2.51 1.72 0.09 5.32 2.01 0.50 0.32 115.64 123.09 1f0r s THR 201 Ca 0.16 -0.83 -0.26 0.00 0.31 0.00 0.00 61.69 61.07 1f0r s THR 201 Cb -0.03 -1.49 -0.06 0.00 0.01 0.00 0.00 72.50 70.92 1f0r s THR 201 CO 0.05 0.48 0.79 -0.60 -0.69 0.00 0.00 174.62 174.66 1f0r s ARG 202 N 0.34 4.55 -0.15 4.92 3.52 -1.26 -1.28 118.95 129.58 1f0r s ARG 202 Ca -0.14 1.14 -0.04 0.00 -0.13 0.00 0.00 55.73 56.56 1f0r s ARG 202 Cb -0.16 -3.33 0.07 0.00 -1.56 0.00 0.00 34.95 29.97 1f0r s ARG 202 CO 0.06 0.37 0.17 0.12 -0.81 0.00 0.00 175.30 175.22 1f0r s PHE 203 N -0.42 -0.16 -1.43 5.12 5.36 0.96 -4.88 117.98 122.52 1f0r s PHE 203 Ca 0.38 0.30 -0.05 0.00 -0.96 0.00 0.00 56.93 56.61 1f0r s PHE 203 Cb -0.22 -0.37 0.03 0.00 -0.34 0.00 0.00 43.02 42.12 1f0r s PHE 203 CO 0.25 -0.45 0.66 1.63 -1.46 0.00 0.00 175.22 175.85 1f0r n LYS 204 N 5.32 -4.24 -1.23 10.12 5.02 -1.26 -1.27 118.16 130.62 1f0r n LYS 204 Ca -0.05 0.51 -0.08 0.00 -2.02 0.00 0.00 58.31 56.67 1f0r n LYS 204 Cb 0.50 -4.99 -0.03 0.00 -0.02 0.00 0.00 35.03 30.48 1f0r n LYS 204 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1f0r n ASP 205 N -2.94 -4.86 -4.28 4.39 8.00 -1.26 -4.99 116.55 110.61 1f0r n ASP 205 Ca -0.20 0.19 -0.32 0.00 0.71 0.00 0.00 54.79 55.18 1f0r n ASP 205 Cb 0.63 -3.05 -0.16 0.00 -0.02 0.00 0.00 41.12 38.52 1f0r n ASP 205 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1f0r s THR 206 N -1.99 2.29 -0.22 -3.53 2.01 -0.39 -5.12 115.64 108.70 1f0r s THR 206 Ca 0.00 -0.95 -0.11 0.00 0.31 0.00 0.00 61.69 60.94 1f0r s THR 206 Cb 0.00 -1.88 -0.05 0.00 0.01 0.00 0.00 72.50 70.58 1f0r s THR 206 CO 0.00 0.56 0.16 -0.31 -0.69 0.00 0.00 174.62 174.34 1f0r s TYR 207 N 0.11 3.36 -0.03 4.92 1.51 -1.26 -0.03 117.35 125.94 1f0r s TYR 207 Ca -0.11 0.30 0.04 0.00 -1.01 0.00 0.00 57.07 56.29 1f0r s TYR 207 Cb -0.16 -2.23 -0.03 0.00 -0.11 0.00 0.00 41.96 39.44 1f0r s TYR 207 CO 0.06 0.17 -0.15 -0.06 -1.11 0.00 0.00 175.55 174.46 1f0r s PHE 208 N 0.73 2.68 -0.11 2.71 0.08 -0.40 -2.21 117.98 121.45 1f0r s PHE 208 Ca 0.08 -0.18 -0.30 0.00 0.12 0.00 0.00 56.93 56.66 1f0r s PHE 208 Cb -0.12 -1.59 -0.02 0.00 -0.57 0.00 0.00 43.02 40.71 1f0r s PHE 208 CO 0.02 0.21 1.23 0.54 -0.10 0.00 0.00 175.22 177.12 1f0r s VAL 209 N -0.79 4.26 -0.03 -0.44 0.11 0.02 -0.37 120.40 123.17 1f0r s VAL 209 Ca 0.13 1.56 0.01 0.00 -2.93 0.00 0.00 61.98 60.75 1f0r s VAL 209 Cb -0.11 -4.01 -0.01 0.00 -1.53 0.00 0.00 36.38 30.72 1f0r s VAL 209 CO 0.02 -0.07 0.04 0.35 -3.33 0.00 0.00 175.10 172.11 1f0r n THR 210 N 4.98 0.00 -3.78 5.04 -2.24 -0.18 -4.51 114.28 113.59 1f0r n THR 210 Ca 0.12 -0.25 -0.07 0.00 -2.27 0.00 0.00 64.05 61.58 1f0r n THR 210 Cb 0.45 0.74 -0.02 0.00 -2.10 0.00 0.00 70.33 69.41 1f0r n THR 210 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1f0r s GLY 211 N -1.61 -0.19 -0.09 3.38 0.00 -0.89 -2.99 107.32 104.93 1f0r s GLY 211 Ca 0.00 -0.09 0.03 0.00 0.00 0.00 0.00 44.72 44.66 1f0r s GLY 211 CO 0.05 -0.03 -0.18 -0.42 0.00 0.00 0.00 173.10 172.52 1f0r s ILE 212 N -3.73 1.60 -0.07 0.90 1.01 -1.05 -2.12 121.20 117.74 1f0r s ILE 212 Ca 0.10 -0.74 -0.35 0.00 0.00 0.00 0.00 60.65 59.66 1f0r s ILE 212 Cb -0.04 -1.43 -0.13 0.00 0.01 0.00 0.00 42.46 40.87 1f0r s ILE 212 CO 0.03 0.46 1.78 0.52 0.00 0.00 0.00 174.94 177.74 1f0r n VAL 213 N 3.83 0.41 0.01 2.92 0.31 -0.55 -1.11 118.33 124.16 1f0r n VAL 213 Ca -0.20 -0.07 -0.01 0.00 -0.01 0.00 0.00 64.34 64.05 1f0r n VAL 213 Cb 0.52 -1.66 -0.00 0.00 -0.91 0.00 0.00 33.84 31.78 1f0r n VAL 213 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 1f0r n SER 214 N 5.72 0.46 -2.33 4.52 2.88 -0.58 -0.79 113.62 123.49 1f0r n SER 214 Ca 0.22 0.06 -0.04 0.00 -1.33 0.00 0.00 58.87 57.78 1f0r n SER 214 Cb 0.26 -0.20 0.02 0.00 -0.75 0.00 0.00 64.21 63.54 1f0r n SER 214 CO 0.00 0.00 0.00 -2.67 -1.23 0.00 0.00 175.04 171.14 1f0r n TRP 215 N -2.92 -1.60 -3.59 0.66 4.27 -0.28 -4.89 117.44 109.09 1f0r n TRP 215 Ca -0.01 -1.09 0.04 0.00 -3.89 0.00 0.00 57.50 52.55 1f0r n TRP 215 Cb 0.03 0.54 0.00 0.00 -1.36 0.00 0.00 31.31 30.52 1f0r n TRP 215 CO 0.00 0.00 0.00 0.20 -2.29 0.00 0.00 177.69 175.60 1f0r s GLY 216 N -2.60 -0.48 -0.64 -1.67 0.00 -1.26 -0.02 107.32 100.65 1f0r s GLY 216 Ca 0.12 0.90 -0.17 0.00 0.00 0.00 0.00 44.72 45.58 1f0r s GLY 216 CO 0.06 0.56 0.65 -0.54 0.00 0.00 0.00 173.10 173.83 1f0r s GLU 217 N -2.05 3.17 2.94 2.90 2.02 -1.26 -4.88 118.70 121.54 1f0r s GLU 217 Ca 0.16 -1.76 0.00 0.00 0.02 0.00 0.00 54.97 53.39 1f0r s GLU 217 Cb 0.07 -4.35 0.00 0.00 0.10 0.00 0.00 34.13 29.95 1f0r s GLU 217 CO -0.06 -1.40 0.00 0.41 0.02 0.00 0.00 175.26 174.22 1f0r n GLY 219 N 5.00 -0.23 2.97 -1.39 0.00 -1.26 -4.60 105.19 105.67 1f0r n GLY 219 Ca -0.05 -1.03 -0.13 0.00 0.00 0.00 0.00 46.02 44.81 1f0r n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1f0r n ALA 221 N 3.38 -0.28 -1.77 0.00 0.00 -1.26 -4.63 120.51 115.96 1f0r n ALA 221 Ca -0.17 0.29 -0.39 0.00 0.00 0.00 0.00 53.44 53.17 1f0r n ALA 221 Cb 0.57 -1.89 -0.00 0.00 0.00 0.00 0.00 19.45 18.12 1f0r n ALA 221 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1f0r s ARG 222 N -3.53 3.95 0.24 0.00 0.52 -1.26 -4.70 118.95 114.17 1f0r s ARG 222 Ca 0.00 2.15 -0.31 0.00 -0.52 0.00 0.00 55.73 57.05 1f0r s ARG 222 Cb 0.00 -2.74 -0.11 0.00 0.52 0.00 0.00 34.95 32.62 1f0r s ARG 222 CO 0.00 -0.51 1.59 0.15 0.02 0.00 0.00 175.30 176.55 1f0r s LYS 223 N -2.27 4.16 0.00 3.54 1.02 -1.26 -1.73 119.74 123.21 1f0r s LYS 223 Ca 0.57 2.50 0.00 0.00 0.02 0.00 0.00 55.97 59.06 1f0r s LYS 223 Cb -0.38 -3.07 0.00 0.00 -0.52 0.00 0.00 37.83 33.86 1f0r s LYS 223 CO 0.49 -0.62 0.00 0.41 -0.92 0.00 0.00 175.35 174.71 1f0r n GLY 223 N 2.84 0.86 3.42 -3.33 0.00 0.56 -4.99 105.19 104.55 1f0r n GLY 223 Ca 0.11 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.85 1f0r n GLY 223 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1f0r s LYS 224 N -0.12 1.49 0.48 1.61 -0.14 -0.70 -4.77 119.74 117.59 1f0r s LYS 224 Ca 0.00 -1.42 0.03 0.00 -1.36 0.00 0.00 55.97 53.21 1f0r s LYS 224 Cb 0.00 -1.89 -0.03 0.00 -1.68 0.00 0.00 37.83 34.23 1f0r s LYS 224 CO 0.00 0.43 0.01 0.71 -0.76 0.00 0.00 175.35 175.73 1f0r s TYR 225 N -1.37 2.04 -0.03 3.18 2.02 -1.26 -4.61 117.35 117.32 1f0r s TYR 225 Ca 0.18 -0.88 -0.16 0.00 -0.37 0.00 0.00 57.07 55.83 1f0r s TYR 225 Cb -0.09 -1.65 -0.05 0.00 -0.40 0.00 0.00 41.96 39.77 1f0r s TYR 225 CO 0.08 0.28 0.44 0.20 -1.57 0.00 0.00 175.55 174.99 1f0r s GLY 226 N -3.83 2.47 -0.14 0.71 0.00 -0.68 -4.56 107.32 101.29 1f0r s GLY 226 Ca 0.14 -0.19 -0.03 0.00 0.00 0.00 0.00 44.72 44.64 1f0r s GLY 226 CO 0.07 0.36 -0.02 -0.42 0.00 0.00 0.00 173.10 173.09 1f0r s ILE 227 N -0.60 4.07 0.04 0.90 -1.09 0.97 -1.89 121.20 123.60 1f0r s ILE 227 Ca 0.25 -0.31 0.08 0.00 -2.23 0.00 0.00 60.65 58.44 1f0r s ILE 227 Cb -0.17 -2.77 -0.03 0.00 -1.58 0.00 0.00 42.46 37.92 1f0r s ILE 227 CO 0.13 0.52 -0.23 -0.31 -1.23 0.00 0.00 174.94 173.82 1f0r s TYR 228 N 0.04 2.00 0.27 3.97 1.51 -0.42 -1.13 117.35 123.59 1f0r s TYR 228 Ca 0.01 -0.39 -0.29 0.00 -1.01 0.00 0.00 57.07 55.39 1f0r s TYR 228 Cb -0.13 -1.21 -0.10 0.00 -0.11 0.00 0.00 41.96 40.42 1f0r s TYR 228 CO 0.02 0.09 1.26 0.99 -1.11 0.00 0.00 175.55 176.80 1f0r s THR 229 N -0.76 3.07 -0.74 -0.71 2.01 -0.26 -0.95 115.64 117.30 1f0r s THR 229 Ca 0.09 1.00 -0.23 0.00 0.31 0.00 0.00 61.69 62.86 1f0r s THR 229 Cb -0.09 -3.63 0.07 0.00 0.01 0.00 0.00 72.50 68.85 1f0r s THR 229 CO 0.02 0.20 1.09 -0.75 -0.69 0.00 0.00 174.62 174.49 1f0r s LYS 230 N -1.06 3.23 0.33 4.92 2.20 -0.29 -2.52 119.74 126.55 1f0r s LYS 230 Ca 0.51 -0.86 0.04 0.00 -0.36 0.00 0.00 55.97 55.29 1f0r s LYS 230 Cb -0.37 -4.40 0.64 0.00 -1.51 0.00 0.00 37.83 32.20 1f0r s LYS 230 CO 0.45 -1.91 1.94 0.28 -0.36 0.00 0.00 175.35 175.74 1f0r h VAL 231 N 6.03 1.04 0.00 4.02 2.07 -1.87 -2.17 116.25 125.37 1f0r h VAL 231 Ca -0.19 -0.30 0.00 0.00 0.82 0.00 0.00 66.70 67.03 1f0r h VAL 231 Cb 1.06 0.08 0.00 0.00 -1.52 0.00 0.00 31.29 30.91 1f0r h VAL 231 CO 1.21 0.16 0.00 0.35 0.02 0.00 0.00 177.57 179.31 1f0r n THR 232 N -4.48 1.30 1.02 2.57 -2.24 -1.26 -0.93 114.28 110.25 1f0r n THR 232 Ca 0.12 0.66 0.12 0.00 -2.27 0.00 0.00 64.05 62.67 1f0r n THR 232 Cb 0.22 -1.65 0.17 0.00 -2.10 0.00 0.00 70.33 66.96 1f0r n THR 232 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1f0r n ALA 233 N -1.70 3.79 -0.87 6.98 0.00 -0.82 -4.05 120.51 123.84 1f0r n ALA 233 Ca -0.01 -0.42 0.06 0.00 0.00 0.00 0.00 53.44 53.07 1f0r n ALA 233 Cb 0.03 -1.03 0.09 0.00 0.00 0.00 0.00 19.45 18.54 1f0r n ALA 233 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1f0r n PHE 234 N -1.36 0.00 -0.02 0.00 3.72 -0.11 -4.78 117.46 114.90 1f0r n PHE 234 Ca 0.06 -0.75 0.03 0.00 -0.05 0.00 0.00 57.45 56.74 1f0r n PHE 234 Cb 0.34 -0.11 0.39 0.00 -0.94 0.00 0.00 39.48 39.16 1f0r n PHE 234 CO 0.00 0.00 0.00 -0.07 -0.05 0.00 0.00 176.76 176.64 1f0r h LEU 235 N 0.00 0.51 -0.17 4.37 4.07 -1.67 0.22 115.31 122.65 1f0r h LEU 235 Ca 0.00 -0.02 -0.23 0.00 0.08 0.00 0.00 57.88 57.71 1f0r h LEU 235 Cb 0.91 -0.13 0.01 0.00 1.08 0.00 0.00 40.66 42.53 1f0r h LEU 235 CO 0.00 0.40 -0.87 0.11 -1.08 0.00 0.00 178.44 177.00 1f0r h LYS 236 N 0.59 0.64 -0.50 1.13 6.56 -1.90 -1.74 116.57 121.36 1f0r h LYS 236 Ca 0.16 -0.59 -0.05 0.00 -1.06 0.00 0.00 60.65 59.11 1f0r h LYS 236 Cb -0.02 0.14 -0.02 0.00 -0.57 0.00 0.00 32.23 31.76 1f0r h LYS 236 CO -0.03 1.20 0.09 2.35 -2.06 0.00 0.00 179.45 181.00 1f0r h TRP 237 N 0.40 0.79 0.12 -1.35 7.01 -1.64 -1.23 115.95 120.06 1f0r h TRP 237 Ca -0.07 -0.08 -0.01 0.00 2.11 0.00 0.00 58.89 60.84 1f0r h TRP 237 Cb 1.49 -0.23 0.00 0.00 -2.10 0.00 0.00 29.16 28.32 1f0r h TRP 237 CO 0.08 0.69 -0.06 0.82 -2.79 0.00 0.00 178.44 177.18 1f0r h ILE 238 N 0.74 1.06 -0.86 2.65 2.04 -0.51 -0.87 117.51 121.75 1f0r h ILE 238 Ca 0.16 -0.85 0.18 0.00 1.00 0.00 0.00 64.86 65.36 1f0r h ILE 238 Cb 0.31 1.58 -0.11 0.00 -0.74 0.00 0.00 36.82 37.86 1f0r h ILE 238 CO 0.00 0.20 0.39 0.44 0.00 0.00 0.00 178.15 179.18 1f0r h ASP 239 N -0.57 0.38 -0.39 1.72 3.45 -1.03 -0.27 116.42 119.71 1f0r h ASP 239 Ca -0.02 0.13 -0.08 0.00 0.43 0.00 0.00 57.03 57.49 1f0r h ASP 239 Cb 0.45 0.09 -0.01 0.00 -0.56 0.00 0.00 39.33 39.30 1f0r h ASP 239 CO 0.03 0.08 -0.08 0.03 -1.57 0.00 0.00 179.24 177.73 1f0r h ARG 240 N 0.48 0.74 -0.66 3.56 3.08 -1.13 -2.03 114.38 118.41 1f0r h ARG 240 Ca 0.51 -0.28 -0.00 0.00 0.07 0.00 0.00 59.98 60.28 1f0r h ARG 240 Cb 0.86 -0.05 -0.03 0.00 0.08 0.00 0.00 29.97 30.84 1f0r h ARG 240 CO -0.46 0.87 0.41 0.77 -1.07 0.00 0.00 179.97 180.50 1f0r h SER 241 N 0.55 0.78 1.43 7.04 0.02 0.37 -2.45 113.55 121.29 1f0r h SER 241 Ca 0.10 -0.03 0.00 0.00 -0.84 0.00 0.00 61.79 61.02 1f0r h SER 241 Cb 0.59 -0.20 0.00 0.00 0.14 0.00 0.00 62.40 62.94 1f0r h SER 241 CO 0.04 0.59 -0.16 0.24 -1.14 0.00 0.00 176.83 176.39 1f0r h MET 242 N 0.91 0.00 0.00 3.45 2.86 -0.97 -3.14 114.93 118.04 1f0r h MET 242 Ca 0.24 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.88 1f0r h MET 242 Cb -0.06 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.60 1f0r h MET 242 CO -0.05 0.00 -0.14 1.63 1.06 0.00 0.00 176.91 179.41 1f0r n LYS 243 N -2.41 0.13 0.00 1.72 5.02 -0.78 -5.10 118.16 116.75 1f0r n LYS 243 Ca 0.05 0.09 0.00 0.00 -2.02 0.00 0.00 58.31 56.42 1f0r n LYS 243 Cb 0.46 -1.63 0.00 0.00 -0.02 0.00 0.00 35.03 33.84 1f0r n LYS 243 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13