#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1i05 s ALA 21 N 0.00 0.17 0.00 0.62 0.00 -0.08 -4.97 121.76 117.51 1i05 s ALA 21 Ca 0.00 -1.03 0.08 0.00 0.00 0.00 0.00 51.96 51.01 1i05 s ALA 21 Cb 0.00 0.95 -0.02 0.00 0.00 0.00 0.00 23.12 24.05 1i05 s ALA 21 CO 0.00 -0.66 -0.25 0.45 0.00 0.00 0.00 175.76 175.31 1i05 s SER 22 N -3.00 2.91 0.60 0.00 0.15 -1.26 -1.61 113.70 111.49 1i05 s SER 22 Ca 0.21 -0.49 0.31 0.00 0.70 0.00 0.00 55.95 56.68 1i05 s SER 22 Cb 0.03 -0.30 1.87 0.00 -1.71 0.00 0.00 66.02 65.91 1i05 s SER 22 CO 0.03 0.28 2.24 0.77 1.20 0.00 0.00 173.24 177.75 1i05 h SER 23 N 5.27 0.00 0.76 5.45 4.64 -1.32 -0.65 113.55 127.71 1i05 h SER 23 Ca -0.43 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.89 1i05 h SER 23 Cb 1.13 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.22 1i05 h SER 23 CO 0.46 0.00 -0.30 0.35 -0.87 0.00 0.00 176.83 176.47 1i05 n THR 24 N -3.73 0.06 -1.94 2.95 -2.24 -1.26 -3.53 114.28 104.59 1i05 n THR 24 Ca -0.02 -0.04 -0.30 0.00 -2.27 0.00 0.00 64.05 61.42 1i05 n THR 24 Cb 0.13 -0.10 0.18 0.00 -2.10 0.00 0.00 70.33 68.44 1i05 n THR 24 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1i05 s GLY 25 N -3.08 1.78 0.05 3.38 0.00 -0.25 -4.90 107.32 104.29 1i05 s GLY 25 Ca 0.12 -1.19 0.22 0.00 0.00 0.00 0.00 44.72 43.87 1i05 s GLY 25 CO 0.63 -0.43 0.87 -0.96 0.00 0.00 0.00 173.10 173.21 1i05 n ARG 26 N -3.75 0.42 -0.28 2.90 0.00 -1.26 -4.10 116.66 110.60 1i05 n ARG 26 Ca 0.15 -0.04 0.07 0.00 -0.00 0.00 0.00 57.85 58.03 1i05 n ARG 26 Cb 0.59 -1.60 0.21 0.00 -0.00 0.00 0.00 32.46 31.66 1i05 n ARG 26 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.63 177.90 1i05 n ASN 27 N -2.12 2.63 -4.73 2.89 6.94 -1.26 -4.92 115.26 114.69 1i05 n ASN 27 Ca 0.00 -2.08 -0.41 0.00 -0.02 0.00 0.00 54.58 52.07 1i05 n ASN 27 Cb 0.48 -0.35 -0.04 0.00 -2.36 0.00 0.00 39.78 37.52 1i05 n ASN 27 CO 0.00 0.00 0.00 0.12 -1.03 0.00 0.00 177.26 176.35 1i05 s PHE 28 N -1.49 3.56 -0.50 -2.53 5.36 -1.26 -4.99 117.98 116.13 1i05 s PHE 28 Ca 0.31 1.52 0.02 0.00 -0.96 0.00 0.00 56.93 57.82 1i05 s PHE 28 Cb 0.17 -3.30 0.13 0.00 -0.34 0.00 0.00 43.02 39.68 1i05 s PHE 28 CO 0.19 -0.73 0.25 1.21 -1.46 0.00 0.00 175.22 174.68 1i05 s ASN 29 N 0.45 4.65 0.21 6.13 3.84 -1.26 -4.99 114.94 123.96 1i05 s ASN 29 Ca 0.53 -2.75 -0.12 0.00 0.21 0.00 0.00 52.86 50.73 1i05 s ASN 29 Cb -0.28 -1.69 0.27 0.00 -0.55 0.00 0.00 41.25 38.99 1i05 s ASN 29 CO 0.32 -0.31 1.65 0.58 -2.79 0.00 0.00 177.10 176.54 1i05 h VAL 30 N 5.73 0.43 -1.50 -5.21 2.07 -1.99 -1.69 116.25 114.09 1i05 h VAL 30 Ca -0.06 -0.02 0.44 0.00 0.82 0.00 0.00 66.70 67.88 1i05 h VAL 30 Cb 0.94 0.37 -0.07 0.00 -1.52 0.00 0.00 31.29 31.01 1i05 h VAL 30 CO 0.66 0.01 1.07 -0.33 0.02 0.00 0.00 177.57 179.00 1i05 h GLU 31 N 0.06 0.03 0.00 1.57 5.08 -1.96 0.56 114.58 119.92 1i05 h GLU 31 Ca 0.31 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.67 1i05 h GLU 31 Cb 0.50 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.74 1i05 h GLU 31 CO -0.58 0.02 0.00 1.63 -1.00 0.00 0.00 179.01 179.08 1i05 n LYS 32 N -4.17 0.05 -0.19 2.33 5.02 -0.63 -2.54 118.16 118.02 1i05 n LYS 32 Ca 0.34 0.24 0.11 0.00 -2.02 0.00 0.00 58.31 56.98 1i05 n LYS 32 Cb 1.55 -1.58 0.26 0.00 -0.02 0.00 0.00 35.03 35.24 1i05 n LYS 32 CO 0.00 0.00 0.00 0.44 -0.52 0.00 0.00 177.40 177.32 1i05 n ILE 33 N -1.67 0.51 -2.03 -0.18 -5.35 0.19 -4.82 119.36 106.01 1i05 n ILE 33 Ca 0.04 -0.67 -0.37 0.00 -0.27 0.00 0.00 62.75 61.48 1i05 n ILE 33 Cb 0.22 0.70 0.02 0.00 -1.74 0.00 0.00 39.64 38.84 1i05 n ILE 33 CO 0.00 0.00 0.00 0.21 -1.76 0.00 0.00 176.55 175.00 1i05 s ASN 34 N -1.39 5.63 0.00 7.28 2.47 -1.05 -4.70 114.94 123.17 1i05 s ASN 34 Ca 0.38 2.49 0.00 0.00 0.42 0.00 0.00 52.86 56.15 1i05 s ASN 34 Cb 0.21 -2.61 0.00 0.00 -1.45 0.00 0.00 41.25 37.40 1i05 s ASN 34 CO 0.29 -1.30 0.00 0.61 -3.72 0.00 0.00 177.10 172.98 1i05 n GLY 35 N 0.56 -0.75 3.77 1.21 0.00 0.38 -4.93 105.19 105.42 1i05 n GLY 35 Ca 0.10 -2.17 -0.40 0.00 0.00 0.00 0.00 46.02 43.55 1i05 n GLY 35 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1i05 s GLU 36 N 0.00 4.28 0.20 1.61 2.12 -1.26 -1.38 118.70 124.27 1i05 s GLU 36 Ca 0.00 2.05 -0.10 0.00 0.36 0.00 0.00 54.97 57.28 1i05 s GLU 36 Cb 0.00 -2.96 -0.01 0.00 0.26 0.00 0.00 34.13 31.42 1i05 s GLU 36 CO 0.00 -0.19 0.36 -1.58 -0.54 0.00 0.00 175.26 173.31 1i05 s TRP 37 N -1.22 0.40 0.01 5.30 0.52 -1.03 -4.64 118.94 118.27 1i05 s TRP 37 Ca 0.51 -0.75 -0.02 0.00 0.02 0.00 0.00 56.10 55.86 1i05 s TRP 37 Cb -0.36 0.03 -0.01 0.00 -1.15 0.00 0.00 33.47 31.97 1i05 s TRP 37 CO 0.47 -0.82 0.03 -1.01 0.02 0.00 0.00 176.95 175.64 1i05 s HIS 38 N -3.99 0.16 -0.13 -1.98 3.76 0.24 -3.91 115.29 109.43 1i05 s HIS 38 Ca 0.20 -0.33 -0.28 0.00 -0.15 0.00 0.00 55.06 54.50 1i05 s HIS 38 Cb 0.02 -0.12 -0.01 0.00 1.11 0.00 0.00 32.58 33.58 1i05 s HIS 38 CO 0.04 -0.19 0.95 0.99 -0.85 0.00 0.00 174.74 175.67 1i05 s THR 39 N -1.23 4.81 -0.17 1.30 2.01 -1.25 -1.24 115.64 119.87 1i05 s THR 39 Ca -0.13 1.91 -0.13 0.00 0.31 0.00 0.00 61.69 63.64 1i05 s THR 39 Cb -0.08 -4.26 -0.07 0.00 0.01 0.00 0.00 72.50 68.10 1i05 s THR 39 CO -0.00 0.01 -0.29 -0.38 -0.69 0.00 0.00 174.62 173.26 1i05 n ILE 40 N 4.63 1.37 -4.20 1.82 2.08 0.60 -4.51 119.36 121.16 1i05 n ILE 40 Ca 0.07 -0.01 -0.16 0.00 0.56 0.00 0.00 62.75 63.21 1i05 n ILE 40 Cb 0.49 -2.05 -0.14 0.00 -0.75 0.00 0.00 39.64 37.19 1i05 n ILE 40 CO 0.00 0.00 0.00 -0.63 0.56 0.00 0.00 176.55 176.48 1i05 s ILE 41 N -2.61 0.59 0.02 1.39 1.01 -0.99 -0.37 121.20 120.24 1i05 s ILE 41 Ca -0.27 -0.55 0.06 0.00 0.00 0.00 0.00 60.65 59.89 1i05 s ILE 41 Cb 0.07 -0.54 -0.02 0.00 0.01 0.00 0.00 42.46 41.98 1i05 s ILE 41 CO 0.37 0.00 -0.19 -0.76 0.00 0.00 0.00 174.94 174.37 1i05 s LEU 42 N -0.61 2.12 -0.02 2.97 1.43 -0.73 -0.68 118.68 123.17 1i05 s LEU 42 Ca -0.01 -0.44 -0.07 0.00 -1.03 0.00 0.00 54.13 52.58 1i05 s LEU 42 Cb -0.05 -0.90 0.01 0.00 0.03 0.00 0.00 46.19 45.28 1i05 s LEU 42 CO 0.00 0.16 0.15 0.00 0.23 0.00 0.00 176.35 176.89 1i05 s ALA 43 N -0.67 -0.35 -0.05 4.21 0.00 0.22 -0.43 121.76 124.68 1i05 s ALA 43 Ca 0.06 0.04 -0.29 0.00 0.00 0.00 0.00 51.96 51.77 1i05 s ALA 43 Cb -0.08 0.00 0.07 0.00 0.00 0.00 0.00 23.12 23.11 1i05 s ALA 43 CO 0.01 -0.17 0.64 0.45 0.00 0.00 0.00 175.76 176.69 1i05 s SER 44 N -0.98 -0.62 0.00 0.00 0.15 -1.09 -0.62 113.70 110.54 1i05 s SER 44 Ca -0.11 0.68 0.29 0.00 0.70 0.00 0.00 55.95 57.51 1i05 s SER 44 Cb -0.06 0.54 1.65 0.00 -1.71 0.00 0.00 66.02 66.44 1i05 s SER 44 CO 0.01 -0.58 2.05 -0.90 1.20 0.00 0.00 173.24 175.02 1i05 n ASP 45 N 0.99 0.00 -3.77 5.45 5.68 -1.18 -3.84 116.55 119.89 1i05 n ASP 45 Ca -0.19 -0.65 -0.28 0.00 -0.50 0.00 0.00 54.79 53.18 1i05 n ASP 45 Cb 0.57 -0.10 -0.12 0.00 -1.14 0.00 0.00 41.12 40.33 1i05 n ASP 45 CO 0.00 0.00 0.00 -0.75 -1.33 0.00 0.00 177.20 175.12 1i05 s LYS 46 N -2.20 2.06 0.38 0.11 2.47 -1.26 -5.00 119.74 116.30 1i05 s LYS 46 Ca 0.38 -3.03 0.16 0.00 -1.56 0.00 0.00 55.97 51.92 1i05 s LYS 46 Cb 0.20 -2.91 1.02 0.00 -1.46 0.00 0.00 37.83 34.68 1i05 s LYS 46 CO 0.37 -1.31 1.78 -0.09 0.16 0.00 0.00 175.35 176.26 1i05 h ARG 47 N 5.47 0.46 -0.07 4.03 2.43 -1.93 -1.65 114.38 123.13 1i05 h ARG 47 Ca 0.17 -0.03 0.02 0.00 -0.81 0.00 0.00 59.98 59.34 1i05 h ARG 47 Cb 0.79 -0.10 -0.00 0.00 -0.42 0.00 0.00 29.97 30.24 1i05 h ARG 47 CO 0.63 0.30 0.05 1.05 -1.51 0.00 0.00 179.97 180.50 1i05 h GLU 48 N 0.47 0.00 0.00 0.20 9.09 -1.94 -1.86 114.58 120.54 1i05 h GLU 48 Ca 0.58 0.00 -0.03 0.00 0.05 0.00 0.00 59.36 59.96 1i05 h GLU 48 Cb 1.33 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 28.42 1i05 h GLU 48 CO -0.30 0.00 -0.12 0.87 0.05 0.00 0.00 179.01 179.50 1i05 h LYS 49 N 0.00 0.00 -0.16 1.06 1.79 -1.70 -3.02 116.57 114.54 1i05 h LYS 49 Ca 0.03 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.50 1i05 h LYS 49 Cb 0.14 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.79 1i05 h LYS 49 CO -0.00 0.12 0.00 0.44 -1.08 0.00 0.00 179.45 178.93 1i05 n ILE 50 N -3.81 1.08 -1.98 1.86 -5.35 -0.72 -1.52 119.36 108.91 1i05 n ILE 50 Ca -0.02 -1.08 -0.28 0.00 -0.27 0.00 0.00 62.75 61.10 1i05 n ILE 50 Cb 0.23 0.44 0.09 0.00 -1.74 0.00 0.00 39.64 38.66 1i05 n ILE 50 CO 0.00 0.00 0.00 -1.61 -1.76 0.00 0.00 176.55 173.18 1i05 s GLU 51 N -1.14 1.88 0.16 6.28 2.02 -1.07 -4.67 118.70 122.17 1i05 s GLU 51 Ca 0.13 -0.05 0.04 0.00 0.02 0.00 0.00 54.97 55.11 1i05 s GLU 51 Cb 0.08 -2.00 0.47 0.00 0.10 0.00 0.00 34.13 32.78 1i05 s GLU 51 CO 0.07 -1.59 0.78 -0.25 0.02 0.00 0.00 175.26 174.29 1i05 n ASP 52 N -3.26 0.01 -1.00 -0.19 9.92 -1.26 0.48 116.55 121.25 1i05 n ASP 52 Ca 0.09 0.84 0.05 0.00 -0.53 0.00 0.00 54.79 55.24 1i05 n ASP 52 Cb 0.61 -0.34 0.25 0.00 -0.64 0.00 0.00 41.12 41.00 1i05 n ASP 52 CO 0.00 0.00 0.00 0.59 0.13 0.00 0.00 177.20 177.92 1i05 n ASN 53 N -4.44 3.68 -4.81 -2.24 4.13 -1.26 -4.94 115.26 105.38 1i05 n ASN 53 Ca 0.14 -3.17 -0.35 0.00 1.68 0.00 0.00 54.58 52.88 1i05 n ASN 53 Cb 0.46 -0.57 -0.07 0.00 -1.54 0.00 0.00 39.78 38.06 1i05 n ASN 53 CO 0.00 0.00 0.00 -0.83 0.28 0.00 0.00 177.26 176.71 1i05 s GLY 54 N -2.00 2.56 0.48 7.41 0.00 0.18 -4.95 107.32 111.00 1i05 s GLY 54 Ca 0.43 0.40 0.32 0.00 0.00 0.00 0.00 44.72 45.87 1i05 s GLY 54 CO 0.07 0.75 1.93 3.43 0.00 0.00 0.00 173.10 179.28 1i05 h ASN 55 N 2.54 0.00 -0.50 1.64 2.35 -1.84 -3.04 115.58 116.72 1i05 h ASN 55 Ca -0.48 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.27 1i05 h ASN 55 Cb 1.18 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.55 1i05 h ASN 55 CO 0.63 0.00 0.00 0.49 -1.65 0.00 0.00 177.43 176.90 1i05 n PHE 56 N -2.87 0.66 -2.67 1.19 3.01 -0.57 -4.68 117.46 111.53 1i05 n PHE 56 Ca 0.01 -0.39 -0.43 0.00 1.01 0.00 0.00 57.45 57.65 1i05 n PHE 56 Cb 0.27 -0.01 0.00 0.00 -0.01 0.00 0.00 39.48 39.74 1i05 n PHE 56 CO 0.00 0.00 0.00 -2.13 1.01 0.00 0.00 176.76 175.64 1i05 n ARG 57 N 1.33 3.26 -4.62 -1.08 0.63 -1.15 -4.81 116.66 110.21 1i05 n ARG 57 Ca 0.19 -3.47 -0.34 0.00 -0.92 0.00 0.00 57.85 53.32 1i05 n ARG 57 Cb 0.56 -3.31 -0.12 0.00 0.45 0.00 0.00 32.46 30.04 1i05 n ARG 57 CO 0.00 0.00 0.00 -0.51 -2.51 0.00 0.00 177.63 174.61 1i05 s LEU 58 N 3.04 3.06 -0.47 6.15 1.43 -1.26 -4.68 118.68 125.95 1i05 s LEU 58 Ca 0.49 -0.13 -0.14 0.00 -1.03 0.00 0.00 54.13 53.32 1i05 s LEU 58 Cb 0.02 -1.69 0.08 0.00 0.03 0.00 0.00 46.19 44.63 1i05 s LEU 58 CO 0.04 0.27 0.38 -0.36 0.23 0.00 0.00 176.35 176.91 1i05 s PHE 59 N -0.26 3.26 0.35 0.29 0.40 -0.96 -4.84 117.98 116.21 1i05 s PHE 59 Ca 0.03 -1.07 -0.28 0.00 -0.60 0.00 0.00 56.93 55.01 1i05 s PHE 59 Cb -0.13 -3.18 -0.10 0.00 0.51 0.00 0.00 43.02 40.12 1i05 s PHE 59 CO 0.03 -0.82 1.33 -1.17 0.70 0.00 0.00 175.22 175.28 1i05 s LEU 60 N 1.60 4.39 0.00 -0.37 2.96 -1.26 -1.87 118.68 124.13 1i05 s LEU 60 Ca 0.04 2.74 0.00 0.00 -0.22 0.00 0.00 54.13 56.68 1i05 s LEU 60 Cb -0.24 -3.68 0.00 0.00 0.50 0.00 0.00 46.19 42.77 1i05 s LEU 60 CO 0.05 -0.61 0.00 -0.62 -1.32 0.00 0.00 176.35 173.85 1i05 n GLU 61 N 0.68 2.15 -3.55 1.98 1.02 0.68 -3.88 120.64 119.73 1i05 n GLU 61 Ca 0.00 0.00 -0.17 0.00 -0.02 0.00 0.00 57.16 56.98 1i05 n GLU 61 Cb 0.42 -0.95 -0.06 0.00 -0.02 0.00 0.00 31.44 30.83 1i05 n GLU 61 CO 0.00 0.00 0.00 -1.14 1.18 0.00 0.00 177.13 177.17 1i05 s GLN 62 N -1.89 0.97 -0.09 3.49 0.74 -1.10 -2.47 119.66 119.31 1i05 s GLN 62 Ca 0.00 0.39 0.02 0.00 0.05 0.00 0.00 55.36 55.82 1i05 s GLN 62 Cb 0.00 0.46 0.01 0.00 1.10 0.00 0.00 33.01 34.58 1i05 s GLN 62 CO 0.00 -0.27 -0.16 0.42 -0.55 0.00 0.00 175.29 174.72 1i05 s ILE 63 N -0.88 1.51 -0.25 -2.34 1.01 -0.48 -1.46 121.20 118.32 1i05 s ILE 63 Ca -0.08 -0.68 -0.00 0.00 0.00 0.00 0.00 60.65 59.89 1i05 s ILE 63 Cb -0.01 -1.35 0.04 0.00 0.01 0.00 0.00 42.46 41.15 1i05 s ILE 63 CO 0.07 0.44 -0.08 -2.28 0.00 0.00 0.00 174.94 173.10 1i05 s HIS 64 N 0.70 3.11 -0.18 3.97 2.46 -0.22 -0.47 115.29 124.66 1i05 s HIS 64 Ca -0.13 -1.78 -0.28 0.00 0.47 0.00 0.00 55.06 53.34 1i05 s HIS 64 Cb -0.16 -2.02 -0.00 0.00 -0.13 0.00 0.00 32.58 30.26 1i05 s HIS 64 CO 0.03 -0.78 0.99 0.08 -2.47 0.00 0.00 174.74 172.59 1i05 s VAL 65 N 1.26 4.75 0.39 0.89 1.01 -1.26 -1.01 120.40 126.43 1i05 s VAL 65 Ca -0.02 1.96 0.08 0.00 0.00 0.00 0.00 61.98 63.99 1i05 s VAL 65 Cb -0.17 -4.28 -0.05 0.00 0.00 0.00 0.00 36.38 31.88 1i05 s VAL 65 CO -0.05 -0.08 0.16 -0.76 0.00 0.00 0.00 175.10 174.37 1i05 s LEU 66 N 2.64 3.15 0.19 3.92 1.43 -0.45 -5.01 118.68 124.55 1i05 s LEU 66 Ca 0.44 -0.99 -0.14 0.00 -1.03 0.00 0.00 54.13 52.42 1i05 s LEU 66 Cb -0.16 -1.53 0.20 0.00 0.03 0.00 0.00 46.19 44.73 1i05 s LEU 66 CO 0.11 -0.46 1.66 1.05 0.23 0.00 0.00 176.35 178.94 1i05 h GLU 67 N 1.47 0.05 0.00 1.70 4.11 -2.03 -3.21 114.58 116.68 1i05 h GLU 67 Ca -0.43 -0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.00 1i05 h GLU 67 Cb 1.25 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.49 1i05 h GLU 67 CO 0.67 0.03 -0.09 0.09 0.07 0.00 0.00 179.01 179.78 1i05 n ASN 68 N -5.32 1.45 -3.67 3.06 3.02 -1.26 -5.07 115.26 107.48 1i05 n ASN 68 Ca 0.06 -2.26 -0.13 0.00 -0.03 0.00 0.00 54.58 52.22 1i05 n ASN 68 Cb 0.29 -0.20 -0.06 0.00 -0.61 0.00 0.00 39.78 39.20 1i05 n ASN 68 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 1i05 s SER 69 N -1.55 0.61 -0.06 6.41 0.01 -1.21 -1.61 113.70 116.31 1i05 s SER 69 Ca 0.12 -1.38 -0.00 0.00 1.31 0.00 0.00 55.95 56.00 1i05 s SER 69 Cb 0.10 0.56 0.03 0.00 0.21 0.00 0.00 66.02 66.92 1i05 s SER 69 CO 0.01 -1.11 -0.02 -0.76 0.41 0.00 0.00 173.24 171.77 1i05 s LEU 70 N -3.19 0.96 -0.21 2.44 1.02 0.47 -1.34 118.68 118.82 1i05 s LEU 70 Ca 0.32 -0.09 -0.17 0.00 0.02 0.00 0.00 54.13 54.21 1i05 s LEU 70 Cb 0.02 -0.41 -0.03 0.00 0.02 0.00 0.00 46.19 45.78 1i05 s LEU 70 CO 0.17 -0.13 0.46 -0.69 0.02 0.00 0.00 176.35 176.18 1i05 s VAL 71 N 1.43 5.14 -0.15 -1.59 1.01 -0.18 -0.63 120.40 125.44 1i05 s VAL 71 Ca -0.03 0.83 -0.01 0.00 0.00 0.00 0.00 61.98 62.77 1i05 s VAL 71 Cb -0.13 -3.79 -0.01 0.00 0.00 0.00 0.00 36.38 32.45 1i05 s VAL 71 CO -0.03 0.20 -0.11 -0.76 0.00 0.00 0.00 175.10 174.39 1i05 s LEU 72 N 1.59 2.73 -0.13 3.92 1.43 0.36 -1.06 118.68 127.52 1i05 s LEU 72 Ca 0.21 -0.36 0.01 0.00 -1.03 0.00 0.00 54.13 52.97 1i05 s LEU 72 Cb -0.15 -1.63 -0.00 0.00 0.03 0.00 0.00 46.19 44.43 1i05 s LEU 72 CO 0.09 0.12 -0.17 -0.54 0.23 0.00 0.00 176.35 176.07 1i05 s LYS 73 N 0.63 3.20 0.30 1.70 1.02 -0.53 -1.46 119.74 124.60 1i05 s LYS 73 Ca -0.06 -0.77 0.04 0.00 0.02 0.00 0.00 55.97 55.19 1i05 s LYS 73 Cb -0.15 -2.53 -0.01 0.00 -0.52 0.00 0.00 37.83 34.61 1i05 s LYS 73 CO 0.03 0.11 0.14 1.19 -0.92 0.00 0.00 175.35 175.90 1i05 n PHE 74 N 3.78 -0.10 -3.89 3.18 3.01 0.15 -0.23 117.46 123.35 1i05 n PHE 74 Ca -0.19 -2.06 -0.11 0.00 1.01 0.00 0.00 57.45 56.10 1i05 n PHE 74 Cb 0.52 0.06 -0.10 0.00 -0.01 0.00 0.00 39.48 39.95 1i05 n PHE 74 CO 0.00 0.00 0.00 -3.38 1.01 0.00 0.00 176.76 174.39 1i05 s HIS 75 N -2.82 0.08 0.32 1.38 -3.43 -0.78 -0.65 115.29 109.38 1i05 s HIS 75 Ca 0.20 -0.19 0.08 0.00 -0.80 0.00 0.00 55.06 54.35 1i05 s HIS 75 Cb 0.01 -0.07 -0.04 0.00 -1.43 0.00 0.00 32.58 31.05 1i05 s HIS 75 CO 0.14 -0.25 0.17 0.95 -2.00 0.00 0.00 174.74 173.76 1i05 s THR 76 N -1.30 3.37 -0.02 -5.38 -4.23 0.04 -2.28 115.64 105.85 1i05 s THR 76 Ca -0.14 -1.60 0.02 0.00 -1.18 0.00 0.00 61.69 58.79 1i05 s THR 76 Cb -0.08 -3.07 0.00 0.00 1.34 0.00 0.00 72.50 70.70 1i05 s THR 76 CO 0.01 -0.22 -0.08 -0.69 -0.54 0.00 0.00 174.62 173.09 1i05 s VAL 77 N -2.35 0.73 -0.21 2.29 1.01 -1.26 -1.52 120.40 119.10 1i05 s VAL 77 Ca 0.37 -0.33 -0.03 0.00 0.00 0.00 0.00 61.98 61.99 1i05 s VAL 77 Cb -0.04 -0.65 0.07 0.00 0.00 0.00 0.00 36.38 35.75 1i05 s VAL 77 CO 0.24 0.23 0.05 0.00 0.00 0.00 0.00 175.10 175.62 1i05 s ARG 78 N 0.19 0.57 -1.31 2.72 1.70 -0.44 -4.85 118.95 117.54 1i05 s ARG 78 Ca -0.03 -0.47 -0.13 0.00 -0.47 0.00 0.00 55.73 54.63 1i05 s ARG 78 Cb -0.08 -2.01 0.01 0.00 -0.57 0.00 0.00 34.95 32.29 1i05 s ARG 78 CO 0.00 -0.71 0.52 -0.25 -1.08 0.00 0.00 175.30 173.78 1i05 n ASP 79 N 5.06 -2.28 0.00 -2.89 8.00 -1.26 -0.91 116.55 122.27 1i05 n ASP 79 Ca -0.08 -1.10 0.00 0.00 0.71 0.00 0.00 54.79 54.32 1i05 n ASP 79 Cb 0.46 -2.69 0.00 0.00 -0.02 0.00 0.00 41.12 38.88 1i05 n ASP 79 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1i05 n GLU 80 N -4.49 0.00 -3.12 -1.24 1.02 -1.26 -4.99 120.64 106.56 1i05 n GLU 80 Ca -0.21 0.00 -0.39 0.00 -0.02 0.00 0.00 57.16 56.53 1i05 n GLU 80 Cb 0.64 -2.77 -0.05 0.00 -0.02 0.00 0.00 31.44 29.23 1i05 n GLU 80 CO 0.00 0.00 0.00 -2.00 1.18 0.00 0.00 177.13 176.31 1i05 s GLU 81 N -0.14 4.33 -0.04 3.49 2.12 -0.09 -4.98 118.70 123.40 1i05 s GLU 81 Ca 0.00 0.70 -0.06 0.00 0.36 0.00 0.00 54.97 55.96 1i05 s GLU 81 Cb 0.00 -3.49 -0.04 0.00 0.26 0.00 0.00 34.13 30.85 1i05 s GLU 81 CO 0.00 -0.04 0.22 0.00 -0.54 0.00 0.00 175.26 174.90 1i05 s SER 83 N -1.48 1.25 0.32 0.00 0.01 -0.57 -4.94 113.70 108.29 1i05 s SER 83 Ca 0.23 -0.20 -0.28 0.00 1.31 0.00 0.00 55.95 57.01 1i05 s SER 83 Cb -0.13 -0.57 -0.10 0.00 0.21 0.00 0.00 66.02 65.44 1i05 s SER 83 CO 0.12 -0.01 1.22 -0.70 0.41 0.00 0.00 173.24 174.29 1i05 s GLU 84 N 0.72 4.41 -0.06 12.44 2.56 -1.26 -0.78 118.70 136.73 1i05 s GLU 84 Ca -0.12 2.03 -0.04 0.00 0.00 0.00 0.00 54.97 56.84 1i05 s GLU 84 Cb -0.14 -3.06 0.03 0.00 2.00 0.00 0.00 34.13 32.96 1i05 s GLU 84 CO 0.02 -0.07 0.15 -1.17 -0.56 0.00 0.00 175.26 173.63 1i05 s LEU 85 N -1.77 1.01 0.08 2.70 0.20 0.17 -4.90 118.68 116.18 1i05 s LEU 85 Ca 0.48 0.30 0.04 0.00 0.69 0.00 0.00 54.13 55.64 1i05 s LEU 85 Cb -0.36 0.43 -0.03 0.00 -0.43 0.00 0.00 46.19 45.80 1i05 s LEU 85 CO 0.47 -0.11 -0.10 -0.94 -0.29 0.00 0.00 176.35 175.38 1i05 s SER 86 N 0.72 1.36 0.15 3.68 1.04 -1.26 0.30 113.70 119.69 1i05 s SER 86 Ca -0.05 -0.72 -0.23 0.00 0.48 0.00 0.00 55.95 55.42 1i05 s SER 86 Cb -0.07 0.01 0.07 0.00 0.10 0.00 0.00 66.02 66.12 1i05 s SER 86 CO -0.04 -0.22 0.63 0.00 0.98 0.00 0.00 173.24 174.59 1i05 s MET 87 N -2.34 1.27 -0.11 4.02 0.23 -0.54 -5.02 119.30 116.82 1i05 s MET 87 Ca 0.01 -0.49 0.03 0.00 -1.03 0.00 0.00 55.69 54.21 1i05 s MET 87 Cb -0.06 0.58 0.01 0.00 -1.53 0.00 0.00 34.83 33.83 1i05 s MET 87 CO 0.00 -0.56 -0.21 0.08 -2.03 0.00 0.00 175.02 172.30 1i05 s VAL 88 N -3.71 1.89 -0.14 5.16 1.01 -1.26 -0.49 120.40 122.85 1i05 s VAL 88 Ca 0.02 -0.90 -0.06 0.00 0.00 0.00 0.00 61.98 61.04 1i05 s VAL 88 Cb -0.01 -1.66 -0.04 0.00 0.00 0.00 0.00 36.38 34.67 1i05 s VAL 88 CO -0.12 0.52 0.06 0.00 0.00 0.00 0.00 175.10 175.56 1i05 s ALA 89 N 0.60 3.45 0.12 5.51 0.00 0.20 -4.77 121.76 126.87 1i05 s ALA 89 Ca -0.13 -0.74 0.04 0.00 0.00 0.00 0.00 51.96 51.13 1i05 s ALA 89 Cb -0.17 -1.80 -0.04 0.00 0.00 0.00 0.00 23.12 21.11 1i05 s ALA 89 CO 0.04 0.38 0.09 -0.51 0.00 0.00 0.00 175.76 175.75 1i05 s ASP 90 N -0.24 5.45 0.53 0.00 1.01 -0.04 -0.40 116.67 122.98 1i05 s ASP 90 Ca 0.08 -0.09 -0.21 0.00 0.71 0.00 0.00 52.55 53.04 1i05 s ASP 90 Cb -0.12 -1.42 -0.06 0.00 1.01 0.00 0.00 42.92 42.33 1i05 s ASP 90 CO 0.01 0.13 1.20 -0.54 0.21 0.00 0.00 175.17 176.18 1i05 s LYS 91 N -2.68 3.36 0.00 8.23 1.02 -0.63 -0.15 119.74 128.88 1i05 s LYS 91 Ca 0.29 1.83 0.00 0.00 0.02 0.00 0.00 55.97 58.12 1i05 s LYS 91 Cb -0.11 -2.17 0.00 0.00 -0.52 0.00 0.00 37.83 35.03 1i05 s LYS 91 CO 0.22 -0.90 0.00 0.25 -0.92 0.00 0.00 175.35 174.00 1i05 n THR 92 N -1.04 0.00 0.58 2.17 -2.24 -0.72 -4.79 114.28 108.24 1i05 n THR 92 Ca 0.10 0.00 0.13 0.00 -2.27 0.00 0.00 64.05 62.01 1i05 n THR 92 Cb 0.49 -0.93 0.35 0.00 -2.10 0.00 0.00 70.33 68.13 1i05 n THR 92 CO 0.00 0.00 0.00 1.05 -0.57 0.00 0.00 175.07 175.55 1i05 h GLU 93 N 0.00 0.00 -5.49 -0.78 9.09 -1.96 -3.45 114.58 112.00 1i05 h GLU 93 Ca 0.00 0.00 -0.59 0.00 0.05 0.00 0.00 59.36 58.82 1i05 h GLU 93 Cb 0.00 0.00 -0.10 0.00 -1.65 0.00 0.00 28.75 27.00 1i05 h GLU 93 CO 0.00 0.00 -0.34 -1.59 0.05 0.00 0.00 179.01 177.13 1i05 s LYS 94 N -3.12 4.23 0.18 1.06 0.00 -1.26 -5.04 119.74 115.79 1i05 s LYS 94 Ca 0.10 0.07 -0.33 0.00 0.00 0.00 0.00 55.97 55.81 1i05 s LYS 94 Cb 0.12 -3.42 -0.14 0.00 0.00 0.00 0.00 37.83 34.40 1i05 s LYS 94 CO 0.62 0.26 1.56 0.00 0.00 0.00 0.00 175.35 177.79 1i05 n ALA 95 N 3.51 1.45 -0.98 0.59 0.00 -1.26 -2.09 120.51 121.73 1i05 n ALA 95 Ca -0.12 0.43 0.00 0.00 0.00 0.00 0.00 53.44 53.75 1i05 n ALA 95 Cb 0.52 -2.35 0.00 0.00 0.00 0.00 0.00 19.45 17.62 1i05 n ALA 95 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1i05 n GLY 96 N 3.18 0.58 3.44 0.00 0.00 -1.23 -4.45 105.19 106.71 1i05 n GLY 96 Ca 0.16 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.85 1i05 n GLY 96 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1i05 s GLU 97 N -0.18 2.51 0.26 1.61 2.12 -0.89 -4.27 118.70 119.86 1i05 s GLU 97 Ca 0.00 -0.73 0.08 0.00 0.36 0.00 0.00 54.97 54.67 1i05 s GLU 97 Cb 0.00 -2.34 -0.05 0.00 0.26 0.00 0.00 34.13 32.00 1i05 s GLU 97 CO 0.00 0.58 -0.10 0.71 -0.54 0.00 0.00 175.26 175.91 1i05 s TYR 98 N -0.63 1.96 0.05 5.30 1.51 -0.13 -1.75 117.35 123.66 1i05 s TYR 98 Ca 0.09 -0.60 0.03 0.00 -1.01 0.00 0.00 57.07 55.58 1i05 s TYR 98 Cb -0.11 -1.03 -0.03 0.00 -0.11 0.00 0.00 41.96 40.69 1i05 s TYR 98 CO 0.01 0.38 -0.09 -1.54 -1.11 0.00 0.00 175.55 173.20 1i05 s SER 99 N -3.43 1.00 -0.21 2.29 1.04 0.79 -0.44 113.70 114.73 1i05 s SER 99 Ca 0.28 -0.59 -0.21 0.00 0.48 0.00 0.00 55.95 55.91 1i05 s SER 99 Cb 0.01 0.03 0.06 0.00 0.10 0.00 0.00 66.02 66.22 1i05 s SER 99 CO 0.11 -0.20 0.59 0.54 0.98 0.00 0.00 173.24 175.25 1i05 s VAL 100 N -1.53 0.00 -0.29 5.02 0.11 0.30 -0.86 120.40 123.17 1i05 s VAL 100 Ca -0.07 -0.01 -0.19 0.00 -2.93 0.00 0.00 61.98 58.78 1i05 s VAL 100 Cb -0.09 -0.82 -0.02 0.00 -1.53 0.00 0.00 36.38 33.92 1i05 s VAL 100 CO 0.00 -0.00 0.56 -0.89 -3.33 0.00 0.00 175.10 171.44 1i05 s THR 101 N 0.26 5.01 -0.30 5.04 2.01 -1.26 -1.25 115.64 125.14 1i05 s THR 101 Ca -0.00 0.83 -0.03 0.00 0.31 0.00 0.00 61.69 62.80 1i05 s THR 101 Cb -0.04 -3.91 0.19 0.00 0.01 0.00 0.00 72.50 68.74 1i05 s THR 101 CO 0.01 -0.04 0.67 -0.47 -0.69 0.00 0.00 174.62 174.10 1i05 s TYR 102 N 2.44 -1.45 -1.30 4.92 5.04 -1.26 -4.93 117.35 120.81 1i05 s TYR 102 Ca 0.23 1.55 -0.14 0.00 -2.44 0.00 0.00 57.07 56.26 1i05 s TYR 102 Cb -0.15 0.51 0.01 0.00 0.35 0.00 0.00 41.96 42.68 1i05 s TYR 102 CO 0.10 -0.80 0.54 -3.47 -1.34 0.00 0.00 175.55 170.59 1i05 n ASP 103 N 5.44 -2.52 0.00 4.32 2.03 -1.26 -4.59 116.55 119.97 1i05 n ASP 103 Ca -0.02 -1.11 0.00 0.00 0.52 0.00 0.00 54.79 54.18 1i05 n ASP 103 Cb 0.51 -2.68 0.00 0.00 -0.72 0.00 0.00 41.12 38.24 1i05 n ASP 103 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1i05 n GLY 104 N -1.99 -0.49 3.67 0.27 0.00 -1.26 -4.85 105.19 100.53 1i05 n GLY 104 Ca -0.20 -2.23 -0.35 0.00 0.00 0.00 0.00 46.02 43.24 1i05 n GLY 104 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1i05 s PHE 105 N -0.17 3.30 -0.02 1.61 5.36 -0.29 -4.49 117.98 123.27 1i05 s PHE 105 Ca 0.00 0.15 0.07 0.00 -0.96 0.00 0.00 56.93 56.19 1i05 s PHE 105 Cb 0.00 -2.07 -0.02 0.00 -0.34 0.00 0.00 43.02 40.59 1i05 s PHE 105 CO 0.00 0.23 -0.22 -0.80 -1.46 0.00 0.00 175.22 172.96 1i05 s ASN 106 N 0.23 2.62 0.00 6.13 0.01 -0.38 -0.91 114.94 122.64 1i05 s ASN 106 Ca 0.05 -0.41 0.06 0.00 -0.71 0.00 0.00 52.86 51.85 1i05 s ASN 106 Cb -0.12 -0.34 -0.02 0.00 0.41 0.00 0.00 41.25 41.18 1i05 s ASN 106 CO -0.00 0.27 -0.18 0.42 -1.51 0.00 0.00 177.10 176.10 1i05 s THR 107 N -0.47 1.40 0.06 1.60 -4.23 -0.88 -0.54 115.64 112.58 1i05 s THR 107 Ca 0.07 -0.85 -0.09 0.00 -1.18 0.00 0.00 61.69 59.64 1i05 s THR 107 Cb -0.09 -1.19 0.00 0.00 1.34 0.00 0.00 72.50 72.57 1i05 s THR 107 CO -0.00 0.32 0.19 0.72 -0.54 0.00 0.00 174.62 175.31 1i05 s PHE 108 N -0.52 0.09 0.28 3.99 -0.71 0.42 -1.04 117.98 120.49 1i05 s PHE 108 Ca 0.06 -0.41 0.02 0.00 -1.04 0.00 0.00 56.93 55.57 1i05 s PHE 108 Cb -0.07 -0.04 -0.05 0.00 -1.21 0.00 0.00 43.02 41.65 1i05 s PHE 108 CO -0.00 -0.48 0.11 0.95 -1.34 0.00 0.00 175.22 174.46 1i05 s THR 109 N -3.13 0.56 -0.53 -4.49 -4.23 -0.54 -0.96 115.64 102.32 1i05 s THR 109 Ca -0.01 -2.00 0.04 0.00 -1.18 0.00 0.00 61.69 58.54 1i05 s THR 109 Cb 0.02 -2.61 0.13 0.00 1.34 0.00 0.00 72.50 71.38 1i05 s THR 109 CO -0.07 0.00 0.28 -0.63 -0.54 0.00 0.00 174.62 173.66 1i05 s ILE 110 N -3.67 2.60 0.56 2.99 1.01 -1.26 -1.62 121.20 121.81 1i05 s ILE 110 Ca 0.37 -3.39 0.25 0.00 0.00 0.00 0.00 60.65 57.88 1i05 s ILE 110 Cb 0.07 -2.80 0.35 0.00 0.01 0.00 0.00 42.46 40.09 1i05 s ILE 110 CO 0.15 -0.82 2.10 1.55 0.00 0.00 0.00 174.94 177.92 1i05 h PRO 111 N 6.41 0.00 -1.74 2.79 0.13 -1.90 -0.25 132.00 137.45 1i05 h PRO 111 Ca -0.06 0.00 0.04 0.00 -0.87 0.00 0.00 66.00 65.10 1i05 h PRO 111 Cb 0.88 0.00 -0.24 0.00 0.13 0.00 0.00 31.00 31.77 1i05 h PRO 111 CO 0.69 0.00 0.31 0.21 -0.23 0.00 0.00 178.00 178.98 1i05 s LYS 112 N -4.82 0.60 0.02 0.86 2.47 -1.24 -4.39 119.74 113.24 1i05 s LYS 112 Ca -0.05 0.78 -0.28 0.00 -1.56 0.00 0.00 55.97 54.86 1i05 s LYS 112 Cb 0.17 0.26 0.07 0.00 -1.46 0.00 0.00 37.83 36.86 1i05 s LYS 112 CO 0.62 -0.08 0.66 -0.08 0.16 0.00 0.00 175.35 176.62 1i05 s THR 113 N 0.55 0.00 -0.51 3.43 -1.32 -0.63 -0.22 115.64 116.95 1i05 s THR 113 Ca -0.01 0.00 0.06 0.00 -1.21 0.00 0.00 61.69 60.53 1i05 s THR 113 Cb -0.05 -1.00 0.14 0.00 -1.51 0.00 0.00 72.50 70.09 1i05 s THR 113 CO -0.07 0.00 1.08 -0.90 -2.21 0.00 0.00 174.62 172.52 1i05 n ASP 114 N 0.49 2.36 0.00 8.08 5.75 -1.09 -0.90 116.55 131.24 1i05 n ASP 114 Ca -0.18 -1.91 0.00 0.00 -0.01 0.00 0.00 54.79 52.69 1i05 n ASP 114 Cb 0.60 -0.10 0.00 0.00 -1.03 0.00 0.00 41.12 40.58 1i05 n ASP 114 CO 0.00 0.00 0.00 -1.22 -0.11 0.00 0.00 177.20 175.87 1i05 n TYR 115 N 0.06 0.00 0.92 2.11 4.01 -1.25 -4.46 117.16 118.55 1i05 n TYR 115 Ca 0.06 0.00 0.12 0.00 -0.16 0.00 0.00 57.90 57.91 1i05 n TYR 115 Cb 0.32 0.00 0.14 0.00 -0.31 0.00 0.00 39.34 39.49 1i05 n TYR 115 CO 0.00 0.00 0.00 -0.25 -0.46 0.00 0.00 176.86 176.15 1i05 n ASP 116 N 2.05 0.62 0.02 7.72 8.00 -1.26 -4.76 116.55 128.94 1i05 n ASP 116 Ca 0.00 -0.37 0.00 0.00 0.71 0.00 0.00 54.79 55.13 1i05 n ASP 116 Cb 0.00 0.47 0.00 0.00 -0.02 0.00 0.00 41.12 41.57 1i05 n ASP 116 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1i05 n ASN 117 N -1.59 0.08 -4.24 -2.24 3.02 -1.26 -4.70 115.26 104.32 1i05 n ASN 117 Ca 0.05 0.06 -0.13 0.00 -0.03 0.00 0.00 54.58 54.52 1i05 n ASN 117 Cb 0.35 0.01 -0.10 0.00 -0.61 0.00 0.00 39.78 39.43 1i05 n ASN 117 CO 0.00 0.00 0.00 0.72 -2.62 0.00 0.00 177.26 175.36 1i05 s PHE 118 N -2.00 1.22 -0.16 3.10 -0.12 -1.26 -1.28 117.98 117.48 1i05 s PHE 118 Ca 0.00 -1.10 -0.10 0.00 -0.05 0.00 0.00 56.93 55.68 1i05 s PHE 118 Cb 0.00 -0.69 0.05 0.00 -0.63 0.00 0.00 43.02 41.75 1i05 s PHE 118 CO 0.00 -0.30 0.39 -1.17 -0.05 0.00 0.00 175.22 174.09 1i05 s LEU 119 N -3.18 0.11 -0.13 -1.99 0.20 0.34 -2.66 118.68 111.37 1i05 s LEU 119 Ca 0.27 0.83 0.01 0.00 0.69 0.00 0.00 54.13 55.93 1i05 s LEU 119 Cb 0.07 1.29 -0.01 0.00 -0.43 0.00 0.00 46.19 47.11 1i05 s LEU 119 CO 0.06 -0.18 -0.15 -0.04 -0.29 0.00 0.00 176.35 175.75 1i05 s MET 120 N 1.07 3.31 0.14 1.98 -1.94 0.70 -0.08 119.30 124.47 1i05 s MET 120 Ca -0.07 -0.73 0.10 0.00 -1.71 0.00 0.00 55.69 53.28 1i05 s MET 120 Cb -0.07 -2.58 -0.04 0.00 2.01 0.00 0.00 34.83 34.15 1i05 s MET 120 CO -0.09 0.18 -0.21 0.00 -0.01 0.00 0.00 175.02 174.89 1i05 s ALA 121 N 0.42 2.60 -0.07 3.03 0.00 -0.02 -3.20 121.76 124.51 1i05 s ALA 121 Ca -0.11 -1.45 -0.01 0.00 0.00 0.00 0.00 51.96 50.39 1i05 s ALA 121 Cb -0.16 -0.52 0.03 0.00 0.00 0.00 0.00 23.12 22.46 1i05 s ALA 121 CO 0.05 0.53 -0.03 -1.58 0.00 0.00 0.00 175.76 174.74 1i05 s HIS 122 N -1.28 0.87 0.04 0.00 5.65 -0.64 -1.60 115.29 118.33 1i05 s HIS 122 Ca 0.18 -0.30 0.06 0.00 0.25 0.00 0.00 55.06 55.24 1i05 s HIS 122 Cb -0.10 -0.87 -0.02 0.00 -1.18 0.00 0.00 32.58 30.41 1i05 s HIS 122 CO 0.09 -0.34 -0.16 -1.17 -0.65 0.00 0.00 174.74 172.51 1i05 s LEU 123 N 1.68 2.17 -0.15 8.88 0.20 0.16 -1.47 118.68 130.15 1i05 s LEU 123 Ca 0.01 -0.48 0.02 0.00 0.69 0.00 0.00 54.13 54.37 1i05 s LEU 123 Cb -0.13 -0.73 0.01 0.00 -0.43 0.00 0.00 46.19 44.92 1i05 s LEU 123 CO -0.05 0.08 -0.20 -0.63 -0.29 0.00 0.00 176.35 175.26 1i05 s ILE 124 N -0.83 1.99 -0.13 6.68 1.01 -0.21 -0.45 121.20 129.26 1i05 s ILE 124 Ca 0.04 -0.92 -0.03 0.00 0.00 0.00 0.00 60.65 59.73 1i05 s ILE 124 Cb -0.08 -1.78 -0.03 0.00 0.01 0.00 0.00 42.46 40.57 1i05 s ILE 124 CO 0.01 0.53 -0.01 0.21 0.00 0.00 0.00 174.94 175.69 1i05 s ASN 125 N 1.03 5.05 -0.13 3.58 3.84 -0.02 -2.08 114.94 126.20 1i05 s ASN 125 Ca -0.02 -0.01 0.01 0.00 0.21 0.00 0.00 52.86 53.05 1i05 s ASN 125 Cb -0.14 -1.68 0.02 0.00 -0.55 0.00 0.00 41.25 38.89 1i05 s ASN 125 CO -0.06 0.24 -0.17 -1.61 -2.79 0.00 0.00 177.10 172.71 1i05 s GLU 126 N -0.08 2.48 -0.11 0.43 2.02 -0.09 -1.95 118.70 121.41 1i05 s GLU 126 Ca 0.03 -0.64 -0.04 0.00 0.02 0.00 0.00 54.97 54.34 1i05 s GLU 126 Cb -0.13 -2.14 0.06 0.00 0.10 0.00 0.00 34.13 32.02 1i05 s GLU 126 CO 0.02 -0.12 0.18 0.21 0.02 0.00 0.00 175.26 175.57 1i05 s LYS 127 N 1.15 0.07 -1.23 1.61 2.20 0.70 -1.14 119.74 123.11 1i05 s LYS 127 Ca -0.02 0.52 -0.18 0.00 -0.36 0.00 0.00 55.97 55.93 1i05 s LYS 127 Cb -0.14 -0.42 0.00 0.00 -1.51 0.00 0.00 37.83 35.76 1i05 s LYS 127 CO -0.06 -0.36 0.66 -0.25 -0.36 0.00 0.00 175.35 174.98 1i05 n ASP 128 N 5.33 -3.70 0.00 1.43 8.00 -1.26 -0.81 116.55 125.54 1i05 n ASP 128 Ca -0.05 -1.08 0.00 0.00 0.71 0.00 0.00 54.79 54.37 1i05 n ASP 128 Cb 0.50 -2.93 0.00 0.00 -0.02 0.00 0.00 41.12 38.67 1i05 n ASP 128 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1i05 n GLY 129 N -1.86 0.62 3.76 0.44 0.00 -1.26 -4.98 105.19 101.91 1i05 n GLY 129 Ca -0.16 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.53 1i05 n GLY 129 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1i05 s GLU 130 N -0.44 3.02 0.05 1.61 2.56 0.01 -5.12 118.70 120.40 1i05 s GLU 130 Ca 0.00 -0.49 0.03 0.00 0.00 0.00 0.00 54.97 54.51 1i05 s GLU 130 Cb 0.00 -2.83 -0.03 0.00 2.00 0.00 0.00 34.13 33.27 1i05 s GLU 130 CO 0.00 0.65 -0.09 0.99 -0.56 0.00 0.00 175.26 176.25 1i05 s THR 131 N -1.14 0.70 -0.07 -1.70 2.01 -1.26 -0.21 115.64 113.97 1i05 s THR 131 Ca 0.21 -1.19 -0.24 0.00 0.31 0.00 0.00 61.69 60.79 1i05 s THR 131 Cb -0.12 -0.79 0.05 0.00 0.01 0.00 0.00 72.50 71.66 1i05 s THR 131 CO 0.12 -0.37 0.54 0.72 -0.69 0.00 0.00 174.62 174.94 1i05 s PHE 132 N -1.47 -0.50 0.09 4.92 -0.12 -0.82 -5.00 117.98 115.07 1i05 s PHE 132 Ca -0.07 0.92 0.05 0.00 -0.05 0.00 0.00 56.93 57.79 1i05 s PHE 132 Cb -0.09 0.28 -0.04 0.00 -0.63 0.00 0.00 43.02 42.53 1i05 s PHE 132 CO 0.01 -0.49 -0.04 1.14 -0.05 0.00 0.00 175.22 175.79 1i05 s GLN 133 N -0.97 2.40 -0.00 1.99 -2.07 -1.26 -0.84 119.66 118.90 1i05 s GLN 133 Ca -0.10 -0.89 0.03 0.00 -1.82 0.00 0.00 55.36 52.58 1i05 s GLN 133 Cb -0.02 -2.45 -0.01 0.00 -1.09 0.00 0.00 33.01 29.43 1i05 s GLN 133 CO 0.07 0.54 -0.09 -1.17 -1.32 0.00 0.00 175.29 173.32 1i05 s LEU 134 N -2.17 2.03 -0.01 2.60 0.20 0.40 -3.07 118.68 118.66 1i05 s LEU 134 Ca 0.23 -0.18 0.03 0.00 0.69 0.00 0.00 54.13 54.91 1i05 s LEU 134 Cb -0.11 -0.43 -0.01 0.00 -0.43 0.00 0.00 46.19 45.21 1i05 s LEU 134 CO 0.15 0.09 -0.11 -0.04 -0.29 0.00 0.00 176.35 176.15 1i05 s MET 135 N -0.29 0.91 0.06 1.98 -1.94 0.21 0.37 119.30 120.59 1i05 s MET 135 Ca 0.03 -0.39 0.02 0.00 -1.71 0.00 0.00 55.69 53.63 1i05 s MET 135 Cb -0.04 -0.88 -0.03 0.00 2.01 0.00 0.00 34.83 35.90 1i05 s MET 135 CO -0.00 0.23 -0.08 0.20 -0.01 0.00 0.00 175.02 175.36 1i05 s GLY 136 N -0.24 0.60 -0.17 -0.03 0.00 -0.62 -0.61 107.32 106.25 1i05 s GLY 136 Ca 0.04 -0.95 0.00 0.00 0.00 0.00 0.00 44.72 43.81 1i05 s GLY 136 CO -0.00 -1.01 -0.15 -2.27 0.00 0.00 0.00 173.10 169.66 1i05 s LEU 137 N -2.01 2.43 0.09 0.66 2.96 0.14 -0.84 118.68 122.11 1i05 s LEU 137 Ca -0.03 -0.50 0.10 0.00 -0.22 0.00 0.00 54.13 53.47 1i05 s LEU 137 Cb -0.06 -1.56 -0.04 0.00 0.50 0.00 0.00 46.19 45.04 1i05 s LEU 137 CO -0.01 0.06 -0.26 -0.31 -1.32 0.00 0.00 176.35 174.51 1i05 s TYR 138 N 0.97 2.25 0.13 5.38 2.02 0.88 -0.29 117.35 128.70 1i05 s TYR 138 Ca -0.02 -0.39 0.05 0.00 -0.37 0.00 0.00 57.07 56.33 1i05 s TYR 138 Cb -0.15 -1.27 -0.04 0.00 -0.40 0.00 0.00 41.96 40.10 1i05 s TYR 138 CO -0.03 0.24 -0.12 0.20 -1.57 0.00 0.00 175.55 174.28 1i05 s GLY 139 N -1.73 1.06 0.32 0.71 0.00 -0.37 -0.51 107.32 106.81 1i05 s GLY 139 Ca 0.12 -1.38 0.13 0.00 0.00 0.00 0.00 44.72 43.59 1i05 s GLY 139 CO 0.04 -1.46 1.69 3.21 0.00 0.00 0.00 173.10 176.59 1i05 h ARG 140 N 3.17 0.00 -6.20 2.90 2.47 -1.45 0.70 114.38 115.97 1i05 h ARG 140 Ca -0.38 0.00 -0.50 0.00 -1.26 0.00 0.00 59.98 57.84 1i05 h ARG 140 Cb 1.20 0.00 -0.04 0.00 -1.65 0.00 0.00 29.97 29.48 1i05 h ARG 140 CO 0.57 0.50 -0.49 -1.21 0.56 0.00 0.00 179.97 179.90 1i05 s GLU 141 N -3.75 2.91 0.00 0.04 0.41 -1.26 -4.70 118.70 112.34 1i05 s GLU 141 Ca -0.01 -1.11 0.10 0.00 -0.41 0.00 0.00 54.97 53.54 1i05 s GLU 141 Cb 0.13 -2.57 0.61 0.00 -1.78 0.00 0.00 34.13 30.51 1i05 s GLU 141 CO 0.74 0.29 1.07 -2.30 -0.49 0.00 0.00 175.26 174.56 1i05 n PRO 142 N -1.28 0.31 -3.50 0.39 -0.02 -1.26 -4.64 135.00 125.00 1i05 n PRO 142 Ca -0.06 0.01 -0.14 0.00 -2.02 0.00 0.00 63.50 61.30 1i05 n PRO 142 Cb 0.58 -1.50 -0.04 0.00 -0.02 0.00 0.00 33.50 32.52 1i05 n PRO 142 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 1i05 s ASP 143 N -2.04 -0.52 0.29 2.55 2.15 -1.26 -4.74 116.67 113.10 1i05 s ASP 143 Ca 0.15 0.18 0.05 0.00 0.43 0.00 0.00 52.55 53.36 1i05 s ASP 143 Cb 0.07 0.54 -0.06 0.00 -0.30 0.00 0.00 42.92 43.18 1i05 s ASP 143 CO 0.12 -0.81 -0.00 -0.76 -0.17 0.00 0.00 175.17 173.55 1i05 s LEU 144 N -2.19 2.33 0.79 -1.34 1.43 -1.26 -4.94 118.68 113.50 1i05 s LEU 144 Ca -0.03 -1.27 -0.12 0.00 -1.03 0.00 0.00 54.13 51.67 1i05 s LEU 144 Cb -0.00 -0.48 0.07 0.00 0.03 0.00 0.00 46.19 45.80 1i05 s LEU 144 CO -0.05 -0.48 1.13 -0.94 0.23 0.00 0.00 176.35 176.24 1i05 s SER 145 N -3.45 4.09 0.43 2.29 1.04 -1.26 -4.87 113.70 111.98 1i05 s SER 145 Ca 0.32 2.05 0.17 0.00 0.48 0.00 0.00 55.95 58.96 1i05 s SER 145 Cb 0.06 -2.55 0.99 0.00 0.10 0.00 0.00 66.02 64.62 1i05 s SER 145 CO 0.13 -2.32 1.94 0.77 0.98 0.00 0.00 173.24 174.75 1i05 h SER 146 N -1.02 0.00 -0.58 7.02 4.64 -2.00 -2.37 113.55 119.23 1i05 h SER 146 Ca -0.45 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 60.81 1i05 h SER 146 Cb 1.25 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.32 1i05 h SER 146 CO 0.49 0.24 0.11 0.44 -0.87 0.00 0.00 176.83 177.23 1i05 h ASP 147 N 0.00 0.91 -0.43 4.97 5.19 -1.99 -0.42 116.42 124.65 1i05 h ASP 147 Ca -0.00 -0.25 -0.15 0.00 -0.62 0.00 0.00 57.03 56.01 1i05 h ASP 147 Cb 0.46 -0.24 -0.01 0.00 0.18 0.00 0.00 39.33 39.71 1i05 h ASP 147 CO 0.03 0.93 -0.30 0.40 -3.12 0.00 0.00 179.24 177.18 1i05 h ILE 148 N 0.85 1.27 -0.77 0.35 2.04 -1.85 -1.04 117.51 118.37 1i05 h ILE 148 Ca 0.18 -1.47 -0.03 0.00 1.00 0.00 0.00 64.86 64.54 1i05 h ILE 148 Cb 0.40 1.27 -0.04 0.00 -0.74 0.00 0.00 36.82 37.71 1i05 h ILE 148 CO 0.01 0.50 0.38 0.11 0.00 0.00 0.00 178.15 179.14 1i05 h LYS 149 N 0.80 1.10 -0.35 2.37 1.57 -1.20 -0.97 116.57 119.89 1i05 h LYS 149 Ca 0.08 -0.16 -0.13 0.00 -1.87 0.00 0.00 60.65 58.57 1i05 h LYS 149 Cb 0.89 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 32.99 1i05 h LYS 149 CO 0.08 0.85 -0.32 1.49 -0.57 0.00 0.00 179.45 180.98 1i05 h GLU 150 N 1.08 0.76 -0.46 3.15 4.57 -0.96 -0.92 114.58 121.80 1i05 h GLU 150 Ca 0.26 -0.35 -0.03 0.00 -1.18 0.00 0.00 59.36 58.06 1i05 h GLU 150 Cb 0.11 -0.01 -0.02 0.00 -0.16 0.00 0.00 28.75 28.66 1i05 h GLU 150 CO -0.03 0.97 0.17 -0.09 -1.18 0.00 0.00 179.01 178.84 1i05 h ARG 151 N 0.64 0.66 -0.32 1.92 2.43 -0.77 -0.91 114.38 118.03 1i05 h ARG 151 Ca 0.07 -0.10 -0.11 0.00 -0.81 0.00 0.00 59.98 59.03 1i05 h ARG 151 Cb 0.85 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 30.27 1i05 h ARG 151 CO 0.07 0.56 -0.22 0.35 -1.51 0.00 0.00 179.97 179.22 1i05 h PHE 152 N 0.65 0.85 -0.56 2.20 3.57 -0.67 -2.59 116.94 120.39 1i05 h PHE 152 Ca 0.16 -0.23 0.02 0.00 3.53 0.00 0.00 57.97 61.45 1i05 h PHE 152 Cb 0.16 -0.19 -0.03 0.00 2.79 0.00 0.00 35.95 38.68 1i05 h PHE 152 CO 0.01 0.96 0.37 0.00 -2.23 0.00 0.00 178.31 177.42 1i05 h ALA 153 N 0.75 1.66 -0.22 2.41 0.00 -0.36 -1.29 119.26 122.21 1i05 h ALA 153 Ca 0.06 -0.03 -0.13 0.00 0.00 0.00 0.00 54.91 54.81 1i05 h ALA 153 Cb 0.78 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 1i05 h ALA 153 CO 0.06 0.30 -0.40 1.96 0.00 0.00 0.00 179.25 181.17 1i05 h GLN 154 N 0.71 0.51 -0.40 0.00 1.08 -1.01 -1.72 115.11 114.28 1i05 h GLN 154 Ca 0.22 -0.25 -0.15 0.00 -1.45 0.00 0.00 58.65 57.01 1i05 h GLN 154 Cb 0.00 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.43 1i05 h GLN 154 CO -0.05 0.82 -0.36 1.25 -0.95 0.00 0.00 178.83 179.55 1i05 h LEU 155 N 0.42 1.00 -0.96 1.46 5.85 -0.97 -2.64 115.31 119.47 1i05 h LEU 155 Ca 0.04 -0.44 0.01 0.00 0.84 0.00 0.00 57.88 58.33 1i05 h LEU 155 Cb 0.89 -0.28 -0.05 0.00 0.37 0.00 0.00 40.66 41.59 1i05 h LEU 155 CO 0.08 1.24 0.63 0.00 -0.34 0.00 0.00 178.44 180.05 1i05 h GLU 157 N 1.29 0.27 -0.09 0.00 4.81 -1.07 0.54 114.58 120.34 1i05 h GLU 157 Ca 0.35 -0.02 0.02 0.00 -0.13 0.00 0.00 59.36 59.59 1i05 h GLU 157 Cb -0.13 -0.06 -0.00 0.00 0.63 0.00 0.00 28.75 29.18 1i05 h GLU 157 CO -0.08 0.18 0.12 0.93 -0.73 0.00 0.00 179.01 179.43 1i05 h GLU 158 N 0.28 0.00 -0.26 1.92 5.08 -1.08 0.20 114.58 120.72 1i05 h GLU 158 Ca 0.13 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.49 1i05 h GLU 158 Cb 0.08 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.33 1i05 h GLU 158 CO -0.12 0.00 0.00 0.72 -1.00 0.00 0.00 179.01 178.61 1i05 n HIS 159 N -3.64 0.33 -0.70 4.33 8.25 -0.49 -4.93 115.22 118.36 1i05 n HIS 159 Ca -0.01 -0.17 0.00 0.00 -0.26 0.00 0.00 57.72 57.29 1i05 n HIS 159 Cb 0.22 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.33 1i05 n HIS 159 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1i05 n GLY 160 N 1.31 0.58 3.42 -1.41 0.00 0.71 -5.05 105.19 104.74 1i05 n GLY 160 Ca 0.17 -0.63 -0.37 0.00 0.00 0.00 0.00 46.02 45.19 1i05 n GLY 160 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1i05 s ILE 161 N -2.00 4.29 0.56 -0.61 1.01 0.06 -4.98 121.20 119.52 1i05 s ILE 161 Ca 0.00 -0.38 -0.11 0.00 0.00 0.00 0.00 60.65 60.16 1i05 s ILE 161 Cb 0.00 -3.10 -0.05 0.00 0.01 0.00 0.00 42.46 39.32 1i05 s ILE 161 CO 0.00 0.20 0.96 -0.76 0.00 0.00 0.00 174.94 175.34 1i05 s LEU 162 N 1.58 3.43 0.52 2.97 1.43 -1.26 -3.32 118.68 124.04 1i05 s LEU 162 Ca 0.05 1.35 0.26 0.00 -1.03 0.00 0.00 54.13 54.76 1i05 s LEU 162 Cb -0.16 -4.35 1.38 0.00 0.03 0.00 0.00 46.19 43.09 1i05 s LEU 162 CO 0.04 -0.72 1.97 0.03 0.23 0.00 0.00 176.35 177.90 1i05 h ARG 163 N 0.18 0.04 0.00 1.70 3.08 -1.95 0.10 114.38 117.54 1i05 h ARG 163 Ca -0.45 -0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.59 1i05 h ARG 163 Cb 1.19 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 31.23 1i05 h ARG 163 CO 0.62 0.03 0.00 0.93 -1.07 0.00 0.00 179.97 180.48 1i05 h GLU 164 N 0.04 0.00 -0.41 0.04 4.39 -2.01 -2.16 114.58 114.46 1i05 h GLU 164 Ca 0.30 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.00 1i05 h GLU 164 Cb 1.13 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.78 1i05 h GLU 164 CO -0.02 0.00 0.00 0.09 -1.16 0.00 0.00 179.01 177.92 1i05 n ASN 165 N -2.62 4.36 -4.30 1.42 4.13 0.35 -4.90 115.26 113.70 1i05 n ASN 165 Ca -0.00 -2.77 -0.34 0.00 1.68 0.00 0.00 54.58 53.15 1i05 n ASN 165 Cb 0.17 -0.54 -0.14 0.00 -1.54 0.00 0.00 39.78 37.72 1i05 n ASN 165 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 1i05 s ILE 166 N -2.40 3.08 -0.21 2.41 1.01 -0.82 -2.67 121.20 121.60 1i05 s ILE 166 Ca 0.44 -0.61 -0.01 0.00 0.00 0.00 0.00 60.65 60.47 1i05 s ILE 166 Cb 0.33 -2.36 0.01 0.00 0.01 0.00 0.00 42.46 40.46 1i05 s ILE 166 CO 0.14 0.47 -0.12 -0.63 0.00 0.00 0.00 174.94 174.80 1i05 s ILE 167 N 1.11 2.64 -0.31 2.92 1.01 0.42 -5.00 121.20 123.99 1i05 s ILE 167 Ca 0.01 -0.83 -0.26 0.00 0.00 0.00 0.00 60.65 59.57 1i05 s ILE 167 Cb -0.14 -2.20 0.01 0.00 0.01 0.00 0.00 42.46 40.13 1i05 s ILE 167 CO -0.02 0.42 0.91 -0.62 0.00 0.00 0.00 174.94 175.63 1i05 s ASP 168 N 1.35 6.79 -0.07 3.58 -1.08 -1.26 -1.78 116.67 124.21 1i05 s ASP 168 Ca 0.04 0.85 0.14 0.00 -0.52 0.00 0.00 52.55 53.06 1i05 s ASP 168 Cb -0.14 -2.47 0.43 0.00 -1.46 0.00 0.00 42.92 39.28 1i05 s ASP 168 CO -0.08 -0.72 1.35 0.18 0.52 0.00 0.00 175.17 176.43 1i05 n LEU 169 N 6.46 3.45 0.04 -1.34 7.99 0.50 -4.68 117.00 129.42 1i05 n LEU 169 Ca 0.07 -2.36 0.20 0.00 -0.01 0.00 0.00 56.01 53.91 1i05 n LEU 169 Cb 0.48 -0.37 0.72 0.00 -0.11 0.00 0.00 43.42 44.13 1i05 n LEU 169 CO 0.54 0.73 1.18 0.77 -1.51 0.00 0.00 177.39 179.09 1i05 h SER 170 N 2.24 0.00 -0.21 -1.43 4.64 -1.72 0.27 113.55 117.34 1i05 h SER 170 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1i05 h SER 170 Cb 1.03 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.12 1i05 h SER 170 CO 0.09 0.00 0.00 0.59 -0.87 0.00 0.00 176.83 176.64 1i05 n ASN 171 N -4.20 2.14 -0.32 4.97 4.13 -1.26 -4.12 115.26 116.60 1i05 n ASN 171 Ca 0.08 -1.78 0.02 0.00 1.68 0.00 0.00 54.58 54.57 1i05 n ASN 171 Cb 0.57 -0.13 0.02 0.00 -1.54 0.00 0.00 39.78 38.70 1i05 n ASN 171 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1i05 n ALA 172 N 0.64 1.87 0.68 5.41 0.00 0.03 -4.85 120.51 124.29 1i05 n ALA 172 Ca 0.17 -1.18 0.07 0.00 0.00 0.00 0.00 53.44 52.50 1i05 n ALA 172 Cb 0.41 -0.37 0.20 0.00 0.00 0.00 0.00 19.45 19.68 1i05 n ALA 172 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 1i05 n ASN 173 N -0.26 2.24 -4.57 0.00 0.23 -0.88 -4.92 115.26 107.11 1i05 n ASN 173 Ca 0.03 -1.99 -0.27 0.00 -0.53 0.00 0.00 54.58 51.82 1i05 n ASN 173 Cb 0.64 -0.27 -0.09 0.00 -2.08 0.00 0.00 39.78 37.97 1i05 n ASN 173 CO 0.00 0.00 0.00 -0.13 -0.93 0.00 0.00 177.26 176.20 1i05 s ARG 174 N -1.45 2.06 0.00 -3.83 0.52 -1.26 -4.92 118.95 110.06 1i05 s ARG 174 Ca 0.29 -1.27 0.11 0.00 -0.52 0.00 0.00 55.73 54.34 1i05 s ARG 174 Cb 0.15 -2.16 0.09 0.00 0.52 0.00 0.00 34.95 33.55 1i05 s ARG 174 CO 0.20 0.44 0.86 0.00 0.02 0.00 0.00 175.30 176.81