#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1g9r s ILE 3 N 0.00 4.44 -0.08 0.53 -1.09 -0.00 -0.52 121.20 124.48 1g9r s ILE 3 Ca 0.00 -0.18 0.04 0.00 -2.23 0.00 0.00 60.65 58.28 1g9r s ILE 3 Cb 0.00 -2.92 -0.01 0.00 -1.58 0.00 0.00 42.46 37.95 1g9r s ILE 3 CO 0.00 0.56 -0.21 -0.69 -1.23 0.00 0.00 174.94 173.37 1g9r s VAL 4 N -0.41 2.41 0.19 2.92 1.01 -0.27 -0.50 120.40 125.75 1g9r s VAL 4 Ca 0.08 -0.92 0.06 0.00 0.00 0.00 0.00 61.98 61.20 1g9r s VAL 4 Cb -0.12 -1.93 -0.05 0.00 0.00 0.00 0.00 36.38 34.28 1g9r s VAL 4 CO 0.02 0.56 -0.11 -0.36 0.00 0.00 0.00 175.10 175.21 1g9r s PHE 5 N 0.01 1.55 -0.03 5.22 0.08 -0.77 -1.10 117.98 122.94 1g9r s PHE 5 Ca -0.07 -0.68 0.01 0.00 0.12 0.00 0.00 56.93 56.31 1g9r s PHE 5 Cb -0.15 -0.77 0.02 0.00 -0.57 0.00 0.00 43.02 41.55 1g9r s PHE 5 CO 0.05 0.22 -0.03 0.00 -0.10 0.00 0.00 175.22 175.36 1g9r s ALA 6 N -3.14 0.53 -0.05 5.36 0.00 -1.26 -0.70 121.76 122.50 1g9r s ALA 6 Ca 0.21 -0.01 -0.29 0.00 0.00 0.00 0.00 51.96 51.87 1g9r s ALA 6 Cb 0.01 -0.34 0.06 0.00 0.00 0.00 0.00 23.12 22.86 1g9r s ALA 6 CO 0.05 -0.00 0.63 0.00 0.00 0.00 0.00 175.76 176.44 1g9r s ALA 7 N 0.76 -1.65 0.56 0.00 0.00 -0.62 -4.73 121.76 116.08 1g9r s ALA 7 Ca -0.09 1.20 0.09 0.00 0.00 0.00 0.00 51.96 53.15 1g9r s ALA 7 Cb -0.12 -0.00 0.07 0.00 0.00 0.00 0.00 23.12 23.07 1g9r s ALA 7 CO -0.00 -0.36 0.68 0.16 0.00 0.00 0.00 175.76 176.24 1g9r s ASP 8 N -1.19 5.00 0.34 0.00 1.47 -1.26 -1.89 116.67 119.13 1g9r s ASP 8 Ca -0.11 -0.94 0.06 0.00 1.18 0.00 0.00 52.55 52.74 1g9r s ASP 8 Cb -0.01 0.29 0.72 0.00 -0.34 0.00 0.00 42.92 43.58 1g9r s ASP 8 CO 0.09 -1.26 1.90 -0.78 0.68 0.00 0.00 175.17 175.80 1g9r h ASP 9 N 0.35 0.73 -0.59 2.11 3.58 -1.86 -1.95 116.42 118.80 1g9r h ASP 9 Ca -0.32 0.02 0.11 0.00 0.42 0.00 0.00 57.03 57.26 1g9r h ASP 9 Cb 1.29 -0.13 -0.03 0.00 1.72 0.00 0.00 39.33 42.18 1g9r h ASP 9 CO 0.45 0.42 0.40 -1.13 -2.88 0.00 0.00 179.24 176.50 1g9r h ASN 10 N 0.80 0.31 -0.70 2.28 -1.24 -1.95 -2.10 115.58 112.99 1g9r h ASN 10 Ca 0.40 0.01 0.00 0.00 0.71 0.00 0.00 56.30 57.42 1g9r h ASN 10 Cb 0.47 -0.06 0.00 0.00 0.73 0.00 0.00 38.32 39.46 1g9r h ASN 10 CO -0.17 0.18 0.00 -1.22 -1.29 0.00 0.00 177.43 174.93 1g9r n TYR 11 N -4.46 0.94 -0.27 0.67 4.02 -0.74 -4.61 117.16 112.71 1g9r n TYR 11 Ca 0.10 -0.50 0.01 0.00 -0.01 0.00 0.00 57.90 57.49 1g9r n TYR 11 Cb 0.41 -0.01 0.13 0.00 -0.02 0.00 0.00 39.34 39.85 1g9r n TYR 11 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1g9r h ALA 12 N 4.06 1.07 -0.54 -0.72 0.00 -1.29 0.38 119.26 122.22 1g9r h ALA 12 Ca 0.00 0.02 -0.11 0.00 0.00 0.00 0.00 54.91 54.82 1g9r h ALA 12 Cb 0.98 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.60 1g9r h ALA 12 CO 0.01 0.12 -0.09 0.00 0.00 0.00 0.00 179.25 179.29 1g9r h ALA 13 N 1.40 0.83 -0.22 0.00 0.00 -1.81 -2.70 119.26 116.76 1g9r h ALA 13 Ca 0.35 -0.34 -0.14 0.00 0.00 0.00 0.00 54.91 54.78 1g9r h ALA 13 Cb 0.25 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 1g9r h ALA 13 CO -0.20 0.66 -0.45 1.88 0.00 0.00 0.00 179.25 181.13 1g9r h TYR 14 N 0.89 0.68 -0.42 0.00 0.05 -1.75 -2.90 116.97 113.52 1g9r h TYR 14 Ca 0.14 -0.21 0.06 0.00 0.05 0.00 0.00 58.73 58.77 1g9r h TYR 14 Cb 0.64 -0.14 -0.05 0.00 1.01 0.00 0.00 36.73 38.19 1g9r h TYR 14 CO 0.04 0.91 0.12 1.25 -1.05 0.00 0.00 178.16 179.44 1g9r h LEU 15 N 0.45 0.10 -0.56 3.88 5.85 -0.79 -0.85 115.31 123.39 1g9r h LEU 15 Ca 0.03 0.06 0.04 0.00 0.84 0.00 0.00 57.88 58.85 1g9r h LEU 15 Cb 0.97 0.06 -0.05 0.00 0.37 0.00 0.00 40.66 42.01 1g9r h LEU 15 CO 0.09 0.09 0.30 0.00 -0.34 0.00 0.00 178.44 178.58 1g9r h VAL 17 N 0.58 1.23 -0.28 0.00 2.07 -1.26 -1.22 116.25 117.37 1g9r h VAL 17 Ca 0.24 -0.79 0.01 0.00 0.82 0.00 0.00 66.70 66.99 1g9r h VAL 17 Cb 0.13 1.26 -0.02 0.00 -1.52 0.00 0.00 31.29 31.13 1g9r h VAL 17 CO -0.15 0.25 0.16 0.00 0.02 0.00 0.00 177.57 177.85 1g9r h ALA 18 N 0.85 0.35 -0.66 1.67 0.00 -0.83 -0.96 119.26 119.68 1g9r h ALA 18 Ca 0.08 -0.00 0.01 0.00 0.00 0.00 0.00 54.91 55.00 1g9r h ALA 18 Cb 0.34 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.03 1g9r h ALA 18 CO 0.01 -0.23 0.43 0.00 0.00 0.00 0.00 179.25 179.46 1g9r h ALA 19 N 1.13 0.83 -0.20 0.00 0.00 -0.74 -1.23 119.26 119.06 1g9r h ALA 19 Ca 0.11 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.94 1g9r h ALA 19 Cb 0.01 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.53 1g9r h ALA 19 CO -0.06 0.24 -0.06 -0.22 0.00 0.00 0.00 179.25 179.15 1g9r h LYS 20 N 0.87 0.30 -0.35 0.00 3.64 -0.79 -1.36 116.57 118.88 1g9r h LYS 20 Ca 0.24 -0.06 -0.05 0.00 -1.27 0.00 0.00 60.65 59.52 1g9r h LYS 20 Cb -0.08 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 31.67 1g9r h LYS 20 CO -0.06 0.38 0.02 0.66 -2.27 0.00 0.00 179.45 178.18 1g9r h SER 21 N 0.29 0.50 -0.31 4.20 4.64 0.01 -0.42 113.55 122.47 1g9r h SER 21 Ca 0.06 -0.09 -0.11 0.00 -0.47 0.00 0.00 61.79 61.18 1g9r h SER 21 Cb 0.30 -0.13 -0.01 0.00 -0.31 0.00 0.00 62.40 62.25 1g9r h SER 21 CO 0.01 0.56 -0.25 0.58 -0.87 0.00 0.00 176.83 176.86 1g9r h VAL 22 N 0.52 1.30 -0.62 0.95 2.07 -0.77 -2.66 116.25 117.04 1g9r h VAL 22 Ca 0.11 -1.40 -0.05 0.00 0.82 0.00 0.00 66.70 66.18 1g9r h VAL 22 Cb 0.31 1.51 -0.03 0.00 -1.52 0.00 0.00 31.29 31.56 1g9r h VAL 22 CO 0.01 0.45 0.17 -0.33 0.02 0.00 0.00 177.57 177.90 1g9r h GLU 23 N 0.48 0.97 -0.66 1.57 5.08 -0.96 -2.89 114.58 118.17 1g9r h GLU 23 Ca 0.06 -0.22 -0.00 0.00 -1.00 0.00 0.00 59.36 58.19 1g9r h GLU 23 Cb 0.81 -0.13 -0.03 0.00 0.50 0.00 0.00 28.75 29.90 1g9r h GLU 23 CO 0.07 0.87 0.40 0.00 -1.00 0.00 0.00 179.01 179.34 1g9r h ALA 24 N 1.06 1.45 -0.00 3.43 0.00 -1.03 -1.79 119.26 122.37 1g9r h ALA 24 Ca 0.20 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.03 1g9r h ALA 24 Cb 0.32 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.84 1g9r h ALA 24 CO -0.00 0.48 -0.01 0.00 0.00 0.00 0.00 179.25 179.71 1g9r n ALA 25 N -2.44 2.60 -3.20 0.00 0.00 -1.01 -4.12 120.51 112.34 1g9r n ALA 25 Ca 0.07 -0.19 -0.23 0.00 0.00 0.00 0.00 53.44 53.09 1g9r n ALA 25 Cb 0.07 -1.48 -0.06 0.00 0.00 0.00 0.00 19.45 17.98 1g9r n ALA 25 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1g9r n HIS 26 N -1.10 0.31 0.01 0.00 8.25 -0.67 -4.17 115.22 117.85 1g9r n HIS 26 Ca 0.19 -3.70 0.18 0.00 -0.26 0.00 0.00 57.72 54.13 1g9r n HIS 26 Cb 0.19 -0.39 0.66 0.00 1.12 0.00 0.00 29.99 31.57 1g9r n HIS 26 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 1g9r h PRO 27 N 3.71 0.05 0.00 -0.41 0.13 -1.71 -2.82 132.00 130.94 1g9r h PRO 27 Ca 0.09 -0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.21 1g9r h PRO 27 Cb 0.87 -0.01 -0.02 0.00 0.13 0.00 0.00 31.00 31.96 1g9r h PRO 27 CO 0.52 0.03 -0.43 -3.47 -0.23 0.00 0.00 178.00 174.42 1g9r n ASP 28 N -4.41 1.76 -4.25 1.44 2.03 -1.26 -5.00 116.55 106.87 1g9r n ASP 28 Ca 0.09 -3.59 -0.30 0.00 0.52 0.00 0.00 54.79 51.51 1g9r n ASP 28 Cb 0.54 -0.49 -0.16 0.00 -0.72 0.00 0.00 41.12 40.29 1g9r n ASP 28 CO 0.00 0.00 0.00 -0.89 -1.92 0.00 0.00 177.20 174.39 1g9r s THR 29 N -2.90 1.88 0.05 5.18 2.01 -1.07 -5.10 115.64 115.69 1g9r s THR 29 Ca 0.36 -0.99 -0.31 0.00 0.31 0.00 0.00 61.69 61.07 1g9r s THR 29 Cb 0.35 -1.58 -0.06 0.00 0.01 0.00 0.00 72.50 71.21 1g9r s THR 29 CO -0.06 0.53 1.34 -0.70 -0.69 0.00 0.00 174.62 175.04 1g9r s GLU 30 N -0.27 4.33 -0.27 4.92 2.56 -1.26 -4.96 118.70 123.76 1g9r s GLU 30 Ca 0.01 1.94 -0.01 0.00 0.00 0.00 0.00 54.97 56.91 1g9r s GLU 30 Cb -0.12 -3.41 0.04 0.00 2.00 0.00 0.00 34.13 32.64 1g9r s GLU 30 CO 0.02 -0.45 -0.04 0.42 -0.56 0.00 0.00 175.26 174.65 1g9r s ILE 31 N 1.63 2.84 -0.40 -3.70 -1.09 -1.26 -4.80 121.20 114.42 1g9r s ILE 31 Ca 0.62 -1.24 -0.13 0.00 -2.23 0.00 0.00 60.65 57.68 1g9r s ILE 31 Cb -0.32 -2.54 0.02 0.00 -1.58 0.00 0.00 42.46 38.04 1g9r s ILE 31 CO 0.28 0.05 0.26 -0.13 -1.23 0.00 0.00 174.94 174.17 1g9r s ARG 32 N 1.27 2.91 -0.02 2.79 0.52 -1.26 -4.80 118.95 120.36 1g9r s ARG 32 Ca -0.03 -1.05 -0.20 0.00 -0.52 0.00 0.00 55.73 53.93 1g9r s ARG 32 Cb -0.18 -3.88 -0.05 0.00 0.52 0.00 0.00 34.95 31.36 1g9r s ARG 32 CO -0.03 -0.73 0.58 -0.06 0.02 0.00 0.00 175.30 175.08 1g9r s PHE 33 N 1.63 3.65 -0.20 -0.53 0.08 0.49 -0.82 117.98 122.28 1g9r s PHE 33 Ca 0.04 1.15 0.01 0.00 0.12 0.00 0.00 56.93 58.25 1g9r s PHE 33 Cb -0.19 -2.60 0.04 0.00 -0.57 0.00 0.00 43.02 39.70 1g9r s PHE 33 CO 0.09 0.32 -0.10 -1.01 -0.10 0.00 0.00 175.22 174.41 1g9r s HIS 34 N -0.04 2.43 -0.23 0.36 3.76 0.34 -1.20 115.29 120.72 1g9r s HIS 34 Ca 0.31 -1.61 -0.06 0.00 -0.15 0.00 0.00 55.06 53.55 1g9r s HIS 34 Cb -0.18 -1.64 -0.02 0.00 1.11 0.00 0.00 32.58 31.85 1g9r s HIS 34 CO 0.16 -0.75 0.01 0.08 -0.85 0.00 0.00 174.74 173.40 1g9r s VAL 35 N 1.39 3.85 -0.60 -0.90 1.01 0.29 -1.84 120.40 123.60 1g9r s VAL 35 Ca -0.01 -0.33 -0.28 0.00 0.00 0.00 0.00 61.98 61.36 1g9r s VAL 35 Cb -0.16 -2.78 0.02 0.00 0.00 0.00 0.00 36.38 33.46 1g9r s VAL 35 CO -0.08 0.38 1.30 -0.76 0.00 0.00 0.00 175.10 175.95 1g9r s LEU 36 N 1.52 3.38 -0.53 3.92 1.43 0.13 0.82 118.68 129.35 1g9r s LEU 36 Ca 0.06 0.08 -0.19 0.00 -1.03 0.00 0.00 54.13 53.05 1g9r s LEU 36 Cb -0.15 -3.01 0.07 0.00 0.03 0.00 0.00 46.19 43.13 1g9r s LEU 36 CO 0.00 -1.65 0.66 -0.62 0.23 0.00 0.00 176.35 174.97 1g9r s ASP 37 N 3.75 6.22 -0.14 2.29 -1.08 0.11 -1.59 116.67 126.22 1g9r s ASP 37 Ca 0.46 -0.99 0.07 0.00 -0.52 0.00 0.00 52.55 51.57 1g9r s ASP 37 Cb -0.09 -2.30 0.45 0.00 -1.46 0.00 0.00 42.92 39.53 1g9r s ASP 37 CO 0.23 -0.96 1.22 0.00 0.52 0.00 0.00 175.17 176.18 1g9r n ALA 38 N 6.27 3.34 0.00 3.66 0.00 -0.79 -1.35 120.51 131.64 1g9r n ALA 38 Ca -0.07 -1.10 0.00 0.00 0.00 0.00 0.00 53.44 52.27 1g9r n ALA 38 Cb 0.45 -1.08 0.00 0.00 0.00 0.00 0.00 19.45 18.82 1g9r n ALA 38 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1g9r n GLY 39 N 0.30 0.65 3.72 0.00 0.00 -1.26 -4.73 105.19 103.87 1g9r n GLY 39 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 1g9r n GLY 39 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1g9r s ILE 40 N -0.65 3.07 0.88 -0.61 1.01 -1.26 -3.90 121.20 119.74 1g9r s ILE 40 Ca 0.00 0.80 -0.10 0.00 0.00 0.00 0.00 60.65 61.35 1g9r s ILE 40 Cb 0.00 -3.51 0.13 0.00 0.01 0.00 0.00 42.46 39.09 1g9r s ILE 40 CO 0.00 0.08 1.13 -0.94 0.00 0.00 0.00 174.94 175.21 1g9r s SER 41 N 0.90 3.27 0.25 3.58 1.04 -1.26 -4.79 113.70 116.68 1g9r s SER 41 Ca 0.64 2.08 -0.04 0.00 0.48 0.00 0.00 55.95 59.11 1g9r s SER 41 Cb -0.39 -2.55 0.30 0.00 0.10 0.00 0.00 66.02 63.48 1g9r s SER 41 CO 0.33 -2.87 1.82 -0.08 0.98 0.00 0.00 173.24 173.43 1g9r h GLU 42 N -1.71 1.04 -0.60 4.02 4.22 -1.99 -1.26 114.58 118.30 1g9r h GLU 42 Ca -0.44 -0.18 -0.05 0.00 0.08 0.00 0.00 59.36 58.78 1g9r h GLU 42 Cb 1.26 -0.17 -0.03 0.00 0.50 0.00 0.00 28.75 30.31 1g9r h GLU 42 CO 0.44 0.85 0.18 0.00 -2.18 0.00 0.00 179.01 178.30 1g9r h ALA 43 N 1.28 0.79 -0.05 2.92 0.00 -2.00 -1.81 119.26 120.39 1g9r h ALA 43 Ca 0.23 -0.21 -0.12 0.00 0.00 0.00 0.00 54.91 54.82 1g9r h ALA 43 Cb 0.20 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 1g9r h ALA 43 CO -0.02 0.46 -0.52 -0.91 0.00 0.00 0.00 179.25 178.26 1g9r h ASN 44 N 0.85 0.16 -0.31 0.00 2.35 -1.82 -1.20 115.58 115.62 1g9r h ASN 44 Ca 0.19 -0.08 -0.08 0.00 -0.55 0.00 0.00 56.30 55.78 1g9r h ASN 44 Cb 0.30 -0.05 -0.01 0.00 0.05 0.00 0.00 38.32 38.61 1g9r h ASN 44 CO -0.01 0.66 -0.11 0.03 -1.65 0.00 0.00 177.43 176.36 1g9r h ARG 45 N 0.12 0.61 -0.62 0.81 3.08 -1.00 -0.70 114.38 116.67 1g9r h ARG 45 Ca 0.00 -0.25 -0.02 0.00 0.07 0.00 0.00 59.98 59.78 1g9r h ARG 45 Cb 0.97 -0.03 -0.03 0.00 0.08 0.00 0.00 29.97 30.96 1g9r h ARG 45 CO 0.08 0.82 0.30 0.00 -1.07 0.00 0.00 179.97 180.10 1g9r h ALA 46 N 0.78 0.80 -0.56 0.04 0.00 -1.20 -1.52 119.26 117.60 1g9r h ALA 46 Ca 0.07 -0.13 -0.09 0.00 0.00 0.00 0.00 54.91 54.76 1g9r h ALA 46 Cb 0.61 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 1g9r h ALA 46 CO 0.04 0.36 0.01 0.00 0.00 0.00 0.00 179.25 179.66 1g9r h ALA 47 N 1.13 0.95 -0.18 0.00 0.00 -1.06 0.20 119.26 120.29 1g9r h ALA 47 Ca 0.21 -0.29 -0.02 0.00 0.00 0.00 0.00 54.91 54.82 1g9r h ALA 47 Cb 0.11 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 1g9r h ALA 47 CO -0.03 0.63 0.05 0.28 0.00 0.00 0.00 179.25 180.19 1g9r h VAL 48 N 0.89 1.19 -0.64 0.00 2.07 -0.89 -3.00 116.25 115.87 1g9r h VAL 48 Ca 0.16 -0.61 -0.07 0.00 0.82 0.00 0.00 66.70 67.01 1g9r h VAL 48 Cb 0.51 1.25 -0.03 0.00 -1.52 0.00 0.00 31.29 31.50 1g9r h VAL 48 CO 0.02 0.19 0.14 0.00 0.02 0.00 0.00 177.57 177.94 1g9r h ALA 49 N 0.87 0.84 -0.23 1.67 0.00 -1.07 -2.80 119.26 118.54 1g9r h ALA 49 Ca 0.06 -0.25 0.07 0.00 0.00 0.00 0.00 54.91 54.79 1g9r h ALA 49 Cb 0.24 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1g9r h ALA 49 CO -0.00 0.57 0.18 0.00 0.00 0.00 0.00 179.25 180.00 1g9r h ALA 50 N 1.05 2.10 0.00 0.00 0.00 -0.54 -1.43 119.26 120.44 1g9r h ALA 50 Ca 0.20 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.10 1g9r h ALA 50 Cb 0.39 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.19 1g9r h ALA 50 CO 0.01 -0.30 -0.44 0.09 0.00 0.00 0.00 179.25 178.61 1g9r n ASN 51 N -4.27 0.47 -4.83 0.00 3.02 -1.06 -4.69 115.26 103.90 1g9r n ASN 51 Ca 0.02 -0.04 -0.23 0.00 -0.03 0.00 0.00 54.58 54.31 1g9r n ASN 51 Cb 0.32 0.10 0.07 0.00 -0.61 0.00 0.00 39.78 39.66 1g9r n ASN 51 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1g9r s LEU 52 N -3.30 3.08 0.36 3.41 1.43 -0.62 -4.76 118.68 118.27 1g9r s LEU 52 Ca 0.10 -0.09 -0.28 0.00 -1.03 0.00 0.00 54.13 52.83 1g9r s LEU 52 Cb 0.17 -2.52 -0.11 0.00 0.03 0.00 0.00 46.19 43.76 1g9r s LEU 52 CO 0.68 -1.53 1.50 0.54 0.23 0.00 0.00 176.35 177.76 1g9r n ARG 53 N -2.65 2.64 -1.15 1.70 1.74 -1.26 -1.92 116.66 115.76 1g9r n ARG 53 Ca 0.11 0.93 -0.05 0.00 -0.77 0.00 0.00 57.85 58.07 1g9r n ARG 53 Cb 0.60 -2.66 -0.02 0.00 -1.02 0.00 0.00 32.46 29.36 1g9r n ARG 53 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1g9r n GLY 54 N 0.82 0.63 2.14 -0.13 0.00 -1.26 -1.98 105.19 105.40 1g9r n GLY 54 Ca 0.03 -0.12 -0.04 0.00 0.00 0.00 0.00 46.02 45.89 1g9r n GLY 54 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1g9r n GLY 55 N -0.56 0.72 0.29 -0.02 0.00 -0.81 -3.53 105.19 101.28 1g9r n GLY 55 Ca -0.05 -0.82 0.00 0.00 0.00 0.00 0.00 46.02 45.15 1g9r n GLY 55 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1g9r n GLY 56 N -2.41 1.27 0.26 -0.02 0.00 -0.72 -4.02 105.19 99.55 1g9r n GLY 56 Ca -0.04 -0.14 0.15 0.00 0.00 0.00 0.00 46.02 45.98 1g9r n GLY 56 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1g9r h GLY 57 N 0.00 0.00 -3.36 -0.02 0.00 -1.60 -3.12 103.07 94.97 1g9r h GLY 57 Ca 0.00 0.00 -0.47 0.00 0.00 0.00 0.00 47.33 46.86 1g9r h GLY 57 CO 0.00 0.00 0.20 0.70 0.00 0.00 0.00 176.54 177.44 1g9r n ASN 58 N -3.21 4.77 -3.84 0.19 3.02 -1.26 -4.95 115.26 109.99 1g9r n ASN 58 Ca 0.00 -3.75 -0.17 0.00 -0.03 0.00 0.00 54.58 50.63 1g9r n ASN 58 Cb 0.33 -0.72 -0.16 0.00 -0.61 0.00 0.00 39.78 38.62 1g9r n ASN 58 CO 0.00 0.00 0.00 -0.51 -2.62 0.00 0.00 177.26 174.13 1g9r s ILE 59 N -4.00 0.23 -0.09 2.41 2.07 -1.18 -0.38 121.20 120.26 1g9r s ILE 59 Ca 0.54 0.04 0.03 0.00 -1.41 0.00 0.00 60.65 59.85 1g9r s ILE 59 Cb 0.45 -0.30 0.01 0.00 0.13 0.00 0.00 42.46 42.75 1g9r s ILE 59 CO 0.02 0.15 -0.16 -0.60 -1.91 0.00 0.00 174.94 172.44 1g9r s ARG 60 N 0.90 2.18 -0.10 3.50 3.52 -0.34 -4.99 118.95 123.62 1g9r s ARG 60 Ca -0.09 -0.57 -0.14 0.00 -0.13 0.00 0.00 55.73 54.80 1g9r s ARG 60 Cb -0.13 -1.76 -0.05 0.00 -1.56 0.00 0.00 34.95 31.45 1g9r s ARG 60 CO -0.01 0.04 0.35 -0.06 -0.81 0.00 0.00 175.30 174.80 1g9r s PHE 61 N 0.68 3.57 -0.24 5.12 0.40 -1.26 -0.54 117.98 125.71 1g9r s PHE 61 Ca -0.13 0.77 -0.01 0.00 -0.60 0.00 0.00 56.93 56.96 1g9r s PHE 61 Cb -0.16 -2.32 0.03 0.00 0.51 0.00 0.00 43.02 41.08 1g9r s PHE 61 CO 0.04 0.41 -0.09 0.42 0.70 0.00 0.00 175.22 176.70 1g9r s ILE 62 N -0.18 2.68 0.17 0.64 1.01 0.24 -4.91 121.20 120.85 1g9r s ILE 62 Ca 0.20 -1.06 -0.32 0.00 0.00 0.00 0.00 60.65 59.48 1g9r s ILE 62 Cb -0.14 -2.34 -0.10 0.00 0.01 0.00 0.00 42.46 39.88 1g9r s ILE 62 CO 0.08 0.24 1.59 -1.81 0.00 0.00 0.00 174.94 175.04 1g9r s ASP 63 N 1.30 6.56 0.02 3.58 1.01 -1.26 0.04 116.67 127.91 1g9r s ASP 63 Ca 0.00 2.65 0.05 0.00 0.71 0.00 0.00 52.55 55.97 1g9r s ASP 63 Cb -0.16 -2.59 -0.02 0.00 1.01 0.00 0.00 42.92 41.15 1g9r s ASP 63 CO -0.06 -0.85 -0.16 0.68 0.21 0.00 0.00 175.17 174.99 1g9r s VAL 64 N 1.14 1.29 -0.45 -1.27 -7.23 -0.46 -4.86 120.40 108.56 1g9r s VAL 64 Ca 0.71 -0.89 -0.20 0.00 -1.81 0.00 0.00 61.98 59.79 1g9r s VAL 64 Cb -0.45 -1.11 0.03 0.00 0.56 0.00 0.00 36.38 35.42 1g9r s VAL 64 CO 0.31 0.21 0.59 0.21 -0.31 0.00 0.00 175.10 176.11 1g9r s ASN 65 N -0.79 6.27 0.60 4.85 3.84 -1.26 -4.41 114.94 124.03 1g9r s ASN 65 Ca 0.05 -0.56 0.34 0.00 0.21 0.00 0.00 52.86 52.90 1g9r s ASN 65 Cb -0.07 -2.29 1.90 0.00 -0.55 0.00 0.00 41.25 40.24 1g9r s ASN 65 CO 0.01 -0.77 2.23 1.55 -2.79 0.00 0.00 177.10 177.33 1g9r h PRO 66 N 8.88 0.00 0.00 0.43 0.13 -1.94 -1.61 132.00 137.88 1g9r h PRO 66 Ca -0.26 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.86 1g9r h PRO 66 Cb 1.10 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.23 1g9r h PRO 66 CO 0.89 0.03 -0.03 0.93 -0.23 0.00 0.00 178.00 179.59 1g9r h GLU 67 N 0.00 0.00 -0.87 0.86 5.08 -1.98 -2.45 114.58 115.23 1g9r h GLU 67 Ca -0.00 0.00 0.19 0.00 -1.00 0.00 0.00 59.36 58.55 1g9r h GLU 67 Cb 0.12 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.31 1g9r h GLU 67 CO 0.00 0.03 0.58 -0.44 -1.00 0.00 0.00 179.01 178.18 1g9r h ASP 68 N 0.00 0.38 -0.50 1.42 3.45 -1.71 -0.87 116.42 118.59 1g9r h ASP 68 Ca -0.00 0.04 -0.08 0.00 0.43 0.00 0.00 57.03 57.42 1g9r h ASP 68 Cb 0.09 -0.04 -0.05 0.00 -0.56 0.00 0.00 39.33 38.78 1g9r h ASP 68 CO 0.00 0.16 0.07 0.49 -1.57 0.00 0.00 179.24 178.40 1g9r n PHE 69 N -4.49 1.74 -0.17 4.55 3.01 -0.92 -4.68 117.46 116.50 1g9r n PHE 69 Ca 0.18 -0.99 0.22 0.00 1.01 0.00 0.00 57.45 57.87 1g9r n PHE 69 Cb 0.67 -0.50 0.61 0.00 -0.01 0.00 0.00 39.48 40.25 1g9r n PHE 69 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1g9r h ALA 70 N 2.64 2.44 0.00 4.37 0.00 -1.26 -1.99 119.26 125.46 1g9r h ALA 70 Ca 0.10 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1g9r h ALA 70 Cb 1.89 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.69 1g9r h ALA 70 CO 0.47 -0.68 -0.21 0.41 0.00 0.00 0.00 179.25 179.24 1g9r n GLY 71 N -1.60 -1.40 3.76 0.00 0.00 -1.26 -4.90 105.19 99.79 1g9r n GLY 71 Ca 0.17 -0.20 -0.39 0.00 0.00 0.00 0.00 46.02 45.60 1g9r n GLY 71 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1g9r s PHE 72 N -3.01 3.85 0.54 1.61 2.99 -0.75 -5.02 117.98 118.20 1g9r s PHE 72 Ca 0.13 1.86 -0.21 0.00 0.00 0.00 0.00 56.93 58.70 1g9r s PHE 72 Cb 0.18 -2.97 -0.05 0.00 0.00 0.00 0.00 43.02 40.17 1g9r s PHE 72 CO 0.60 0.31 1.26 -0.35 -0.00 0.00 0.00 175.22 177.04 1g9r n PRO 73 N 1.10 1.53 -3.18 0.24 -0.04 -1.26 -4.98 135.00 128.41 1g9r n PRO 73 Ca -0.00 0.57 -0.19 0.00 -0.04 0.00 0.00 63.50 63.83 1g9r n PRO 73 Cb 0.48 -2.46 -0.04 0.00 -0.04 0.00 0.00 33.50 31.44 1g9r n PRO 73 CO 0.00 0.00 0.00 -0.11 -0.04 0.00 0.00 175.50 175.35 1g9r n LEU 74 N -0.82 0.59 0.22 1.53 7.94 -1.26 -4.84 117.00 120.37 1g9r n LEU 74 Ca 0.11 -4.90 0.12 0.00 -1.11 0.00 0.00 56.01 50.23 1g9r n LEU 74 Cb 0.44 0.70 0.22 0.00 0.53 0.00 0.00 43.42 45.31 1g9r n LEU 74 CO 0.53 2.23 0.83 -0.55 -1.11 0.00 0.00 177.39 179.32 1g9r h ASN 75 N 3.26 0.00 -3.45 1.96 -1.07 -1.93 -3.43 115.58 110.92 1g9r h ASN 75 Ca 0.09 0.00 -0.62 0.00 0.07 0.00 0.00 56.30 55.83 1g9r h ASN 75 Cb 0.95 0.00 -0.13 0.00 -2.07 0.00 0.00 38.32 37.07 1g9r h ASN 75 CO 0.48 0.00 0.42 -0.63 0.07 0.00 0.00 177.43 177.77 1g9r s ILE 76 N -3.24 4.57 0.26 6.14 1.01 -1.26 -4.96 121.20 123.72 1g9r s ILE 76 Ca 0.07 0.32 -0.01 0.00 0.00 0.00 0.00 60.65 61.02 1g9r s ILE 76 Cb 0.05 -4.40 0.24 0.00 0.01 0.00 0.00 42.46 38.37 1g9r s ILE 76 CO 0.66 -0.87 1.72 -0.09 0.00 0.00 0.00 174.94 176.36 1g9r h ARG 77 N 9.10 0.43 0.00 2.79 2.43 -2.04 -1.60 114.38 125.50 1g9r h ARG 77 Ca -0.25 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 58.89 1g9r h ARG 77 Cb 1.08 -0.10 0.00 0.00 -0.42 0.00 0.00 29.97 30.53 1g9r h ARG 77 CO 1.01 0.29 0.00 -2.39 -1.51 0.00 0.00 179.97 177.37 1g9r n HIS 78 N -5.01 0.00 -4.28 2.20 1.44 -1.26 -4.73 115.22 103.59 1g9r n HIS 78 Ca 0.17 0.00 -0.34 0.00 -2.01 0.00 0.00 57.72 55.54 1g9r n HIS 78 Cb 0.49 0.00 -0.13 0.00 0.12 0.00 0.00 29.99 30.47 1g9r n HIS 78 CO 0.00 0.00 0.00 0.42 -2.81 0.00 0.00 176.34 173.95 1g9r s ILE 79 N -2.00 3.61 0.63 0.61 1.01 -0.60 -5.11 121.20 119.34 1g9r s ILE 79 Ca 0.35 -0.44 -0.04 0.00 0.00 0.00 0.00 60.65 60.52 1g9r s ILE 79 Cb 0.16 -2.60 0.04 0.00 0.01 0.00 0.00 42.46 40.08 1g9r s ILE 79 CO 0.27 0.47 0.90 -0.94 0.00 0.00 0.00 174.94 175.64 1g9r s SER 80 N 0.78 5.12 0.64 3.58 1.04 -1.26 -4.85 113.70 118.76 1g9r s SER 80 Ca -0.02 0.33 0.39 0.00 0.48 0.00 0.00 55.95 57.13 1g9r s SER 80 Cb -0.15 -1.13 2.17 0.00 0.10 0.00 0.00 66.02 67.02 1g9r s SER 80 CO 0.02 -1.33 2.30 -0.29 0.98 0.00 0.00 173.24 174.92 1g9r h ILE 81 N -0.27 0.18 -0.13 -1.02 6.09 -1.98 -2.54 117.51 117.83 1g9r h ILE 81 Ca -0.44 0.00 0.04 0.00 -1.37 0.00 0.00 64.86 63.09 1g9r h ILE 81 Cb 1.30 0.97 -0.01 0.00 0.47 0.00 0.00 36.82 39.55 1g9r h ILE 81 CO 0.58 0.00 0.18 0.74 -3.07 0.00 0.00 178.15 176.58 1g9r h THR 82 N 0.00 0.37 -0.07 2.19 2.02 -1.93 -2.07 112.91 113.42 1g9r h THR 82 Ca 0.01 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.20 1g9r h THR 82 Cb 0.07 0.85 -0.00 0.00 -1.74 0.00 0.00 68.15 67.32 1g9r h THR 82 CO -0.00 0.00 0.20 0.00 0.37 0.00 0.00 175.52 176.09 1g9r h THR 83 N 0.00 0.15 0.00 3.16 1.03 -1.84 -1.05 112.91 114.36 1g9r h THR 83 Ca 0.06 0.00 0.00 0.00 -0.01 0.00 0.00 66.41 66.46 1g9r h THR 83 Cb 0.43 0.82 0.00 0.00 -1.07 0.00 0.00 68.15 68.33 1g9r h THR 83 CO -0.00 0.00 -0.50 -1.22 -0.01 0.00 0.00 175.52 173.79 1g9r n TYR 84 N -3.24 0.13 0.04 0.00 4.02 -0.78 -4.24 117.16 113.10 1g9r n TYR 84 Ca -0.01 0.04 0.16 0.00 -0.01 0.00 0.00 57.90 58.08 1g9r n TYR 84 Cb 0.28 -0.37 0.64 0.00 -0.02 0.00 0.00 39.34 39.87 1g9r n TYR 84 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1g9r h ALA 85 N 2.88 2.29 -0.07 -0.72 0.00 -1.37 -1.45 119.26 120.82 1g9r h ALA 85 Ca 0.00 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 54.92 1g9r h ALA 85 Cb 0.56 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.35 1g9r h ALA 85 CO 0.00 -0.41 0.08 0.07 0.00 0.00 0.00 179.25 179.00 1g9r h ARG 86 N 0.09 0.00 0.00 0.00 0.11 -1.78 -2.05 114.38 110.75 1g9r h ARG 86 Ca 0.20 0.00 -0.01 0.00 0.10 0.00 0.00 59.98 60.27 1g9r h ARG 86 Cb 0.70 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 31.77 1g9r h ARG 86 CO -0.02 0.00 -0.04 -0.07 0.10 0.00 0.00 179.97 179.94 1g9r h LEU 87 N 0.00 0.00 -3.69 0.08 3.38 -1.57 -2.27 115.31 111.23 1g9r h LEU 87 Ca 0.03 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 57.82 1g9r h LEU 87 Cb 0.20 0.00 -0.11 0.00 0.09 0.00 0.00 40.66 40.84 1g9r h LEU 87 CO -0.00 0.04 0.22 0.29 0.09 0.00 0.00 178.44 179.07 1g9r n LYS 88 N -4.23 3.80 -0.14 1.13 5.02 -0.77 -4.18 118.16 118.80 1g9r n LYS 88 Ca -0.03 -3.10 0.12 0.00 -2.02 0.00 0.00 58.31 53.28 1g9r n LYS 88 Cb 0.12 -2.20 0.47 0.00 -0.02 0.00 0.00 35.03 33.40 1g9r n LYS 88 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 1g9r h LEU 89 N 2.76 0.44 -1.73 -0.35 5.85 -1.53 0.15 115.31 120.90 1g9r h LEU 89 Ca 0.22 0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.93 1g9r h LEU 89 Cb 2.24 -0.08 -0.00 0.00 0.37 0.00 0.00 40.66 43.19 1g9r h LEU 89 CO 0.68 0.25 -0.12 1.23 -0.34 0.00 0.00 178.44 180.14 1g9r h GLY 90 N 0.48 0.00 0.98 3.75 0.00 -1.85 -2.02 103.07 104.41 1g9r h GLY 90 Ca 0.33 0.00 -0.25 0.00 0.00 0.00 0.00 47.33 47.41 1g9r h GLY 90 CO -0.10 0.00 -1.61 1.18 0.00 0.00 0.00 176.54 176.01 1g9r n GLU 91 N -3.44 0.63 0.08 4.80 1.02 0.43 -4.40 120.64 119.75 1g9r n GLU 91 Ca -0.01 0.27 -0.00 0.00 -0.02 0.00 0.00 57.16 57.40 1g9r n GLU 91 Cb 0.28 -1.80 -0.05 0.00 -0.02 0.00 0.00 31.44 29.86 1g9r n GLU 91 CO 0.00 0.00 0.00 1.88 1.18 0.00 0.00 177.13 180.19 1g9r h TYR 92 N 0.00 0.00 -3.19 -0.32 0.05 -0.98 -3.45 116.97 109.08 1g9r h TYR 92 Ca -0.24 0.00 -0.57 0.00 0.05 0.00 0.00 58.73 57.96 1g9r h TYR 92 Cb 1.86 0.00 -0.36 0.00 1.01 0.00 0.00 36.73 39.24 1g9r h TYR 92 CO 0.00 0.60 -0.82 0.42 -1.05 0.00 0.00 178.16 177.31 1g9r s ILE 93 N -2.91 1.38 -0.13 -2.88 1.01 -0.78 -5.00 121.20 111.89 1g9r s ILE 93 Ca 0.00 -0.54 0.10 0.00 0.00 0.00 0.00 60.65 60.22 1g9r s ILE 93 Cb 0.08 -1.31 -0.15 0.00 0.01 0.00 0.00 42.46 41.09 1g9r s ILE 93 CO 0.79 0.42 0.02 0.00 0.00 0.00 0.00 174.94 176.17 1g9r n ALA 94 N 4.61 1.68 0.64 9.38 0.00 -1.26 -4.67 120.51 130.89 1g9r n ALA 94 Ca -0.17 -0.83 0.10 0.00 0.00 0.00 0.00 53.44 52.55 1g9r n ALA 94 Cb 0.50 -0.00 0.43 0.00 0.00 0.00 0.00 19.45 20.38 1g9r n ALA 94 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1g9r n ASP 95 N -2.53 0.15 -4.33 0.00 3.85 -1.26 -4.82 116.55 107.61 1g9r n ASP 95 Ca -0.22 0.53 -0.31 0.00 -0.71 0.00 0.00 54.79 54.08 1g9r n ASP 95 Cb 0.90 -0.56 -0.16 0.00 -1.35 0.00 0.00 41.12 39.95 1g9r n ASP 95 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 1g9r h ASP 97 N 5.55 0.00 -3.73 0.00 3.45 -1.94 -3.41 116.42 116.33 1g9r h ASP 97 Ca -0.42 -0.06 -0.16 0.00 0.43 0.00 0.00 57.03 56.82 1g9r h ASP 97 Cb 1.13 0.00 -0.26 0.00 -0.56 0.00 0.00 39.33 39.64 1g9r h ASP 97 CO 0.48 0.03 -0.41 -0.75 -1.57 0.00 0.00 179.24 177.01 1g9r s LYS 98 N -3.30 0.30 0.03 3.56 2.20 -1.26 -1.51 119.74 119.76 1g9r s LYS 98 Ca 0.02 0.41 -0.01 0.00 -0.36 0.00 0.00 55.97 56.04 1g9r s LYS 98 Cb 0.10 0.10 -0.03 0.00 -1.51 0.00 0.00 37.83 36.50 1g9r s LYS 98 CO 0.76 -0.06 -0.03 0.14 -0.36 0.00 0.00 175.35 175.81 1g9r s VAL 99 N 0.36 0.15 -0.35 4.02 -7.23 -1.06 -4.69 120.40 111.60 1g9r s VAL 99 Ca -0.02 -1.25 -0.05 0.00 -1.81 0.00 0.00 61.98 58.85 1g9r s VAL 99 Cb -0.03 -0.74 0.06 0.00 0.56 0.00 0.00 36.38 36.22 1g9r s VAL 99 CO -0.01 -0.69 0.11 -0.22 -0.31 0.00 0.00 175.10 173.98 1g9r s LEU 100 N -2.02 4.44 0.01 1.32 2.96 0.33 -0.60 118.68 125.12 1g9r s LEU 100 Ca -0.07 -1.34 -0.22 0.00 -0.22 0.00 0.00 54.13 52.27 1g9r s LEU 100 Cb -0.03 -1.84 -0.05 0.00 0.50 0.00 0.00 46.19 44.77 1g9r s LEU 100 CO -0.04 -0.37 0.67 -0.47 -1.32 0.00 0.00 176.35 174.82 1g9r s TYR 101 N 1.33 3.69 0.02 5.38 5.04 0.96 -1.11 117.35 132.66 1g9r s TYR 101 Ca -0.01 1.30 0.04 0.00 -2.44 0.00 0.00 57.07 55.97 1g9r s TYR 101 Cb -0.20 -2.71 -0.02 0.00 0.35 0.00 0.00 41.96 39.38 1g9r s TYR 101 CO 0.01 0.29 -0.13 -0.51 -1.34 0.00 0.00 175.55 173.86 1g9r s LEU 102 N -0.01 2.11 0.92 6.97 1.43 -0.25 -0.82 118.68 129.02 1g9r s LEU 102 Ca 0.35 -0.36 -0.12 0.00 -1.03 0.00 0.00 54.13 52.97 1g9r s LEU 102 Cb -0.19 -0.61 0.14 0.00 0.03 0.00 0.00 46.19 45.56 1g9r s LEU 102 CO 0.19 0.08 1.11 -1.81 0.23 0.00 0.00 176.35 176.16 1g9r s ASP 103 N -0.78 3.41 0.16 2.29 -0.00 -0.16 -4.42 116.67 117.17 1g9r s ASP 103 Ca 0.03 1.12 0.08 0.00 -0.00 0.00 0.00 52.55 53.78 1g9r s ASP 103 Cb -0.07 -1.76 -0.08 0.00 -0.00 0.00 0.00 42.92 41.01 1g9r s ASP 103 CO 0.00 -2.63 1.36 0.40 -0.00 0.00 0.00 175.17 174.30 1g9r h ILE 104 N -1.55 1.63 -0.49 0.77 1.08 -1.91 -3.33 117.51 113.71 1g9r h ILE 104 Ca -0.51 -3.12 -0.32 0.00 -0.39 0.00 0.00 64.86 60.53 1g9r h ILE 104 Cb 1.32 2.69 -0.12 0.00 -3.07 0.00 0.00 36.82 37.64 1g9r h ILE 104 CO 0.60 0.89 0.03 -0.90 -0.69 0.00 0.00 178.15 178.08 1g9r n ASP 105 N -3.44 5.87 -4.37 1.72 5.75 -1.26 -4.68 116.55 116.14 1g9r n ASP 105 Ca -0.00 -2.83 -0.22 0.00 -0.01 0.00 0.00 54.79 51.72 1g9r n ASP 105 Cb 0.87 -1.29 -0.11 0.00 -1.03 0.00 0.00 41.12 39.56 1g9r n ASP 105 CO 0.00 0.00 0.00 0.68 -0.11 0.00 0.00 177.20 177.77 1g9r s VAL 106 N -0.71 1.99 -0.23 2.12 -7.23 -1.25 -1.71 120.40 113.37 1g9r s VAL 106 Ca 0.56 -2.05 -0.03 0.00 -1.81 0.00 0.00 61.98 58.65 1g9r s VAL 106 Cb 0.32 -1.98 0.08 0.00 0.56 0.00 0.00 36.38 35.35 1g9r s VAL 106 CO -0.09 -0.33 0.08 -0.22 -0.31 0.00 0.00 175.10 174.22 1g9r s LEU 107 N -2.88 1.12 -0.11 1.32 2.96 0.05 -4.61 118.68 116.54 1g9r s LEU 107 Ca 0.20 -1.05 -0.30 0.00 -0.22 0.00 0.00 54.13 52.76 1g9r s LEU 107 Cb -0.05 -0.54 -0.02 0.00 0.50 0.00 0.00 46.19 46.08 1g9r s LEU 107 CO 0.08 -0.36 1.16 -0.69 -1.32 0.00 0.00 176.35 175.22 1g9r s VAL 108 N 1.91 4.41 -0.47 1.68 1.01 -1.26 -1.03 120.40 126.64 1g9r s VAL 108 Ca 0.04 1.71 0.08 0.00 0.00 0.00 0.00 61.98 63.81 1g9r s VAL 108 Cb -0.17 -4.10 -0.06 0.00 0.00 0.00 0.00 36.38 32.05 1g9r s VAL 108 CO -0.18 -0.05 0.39 0.54 0.00 0.00 0.00 175.10 175.81 1g9r n ARG 109 N 5.63 3.82 -3.89 2.72 1.74 0.67 -4.71 116.66 122.64 1g9r n ARG 109 Ca 0.11 -0.15 -0.09 0.00 -0.77 0.00 0.00 57.85 56.95 1g9r n ARG 109 Cb 0.46 -0.91 -0.06 0.00 -1.02 0.00 0.00 32.46 30.93 1g9r n ARG 109 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 1g9r s ASP 110 N -1.59 -0.00 0.33 0.55 2.15 -1.03 -4.91 116.67 112.17 1g9r s ASP 110 Ca 0.04 -0.75 -0.28 0.00 0.43 0.00 0.00 52.55 51.99 1g9r s ASP 110 Cb 0.06 0.44 -0.13 0.00 -0.30 0.00 0.00 42.92 42.99 1g9r s ASP 110 CO 0.29 -0.89 1.16 -0.24 -0.17 0.00 0.00 175.17 175.32 1g9r n SER 111 N -0.21 2.06 -0.76 -0.34 2.88 -1.26 -4.81 113.62 111.19 1g9r n SER 111 Ca -0.09 1.18 0.12 0.00 -1.33 0.00 0.00 58.87 58.75 1g9r n SER 111 Cb 0.63 -1.40 0.18 0.00 -0.75 0.00 0.00 64.21 62.87 1g9r n SER 111 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 1g9r n LEU 112 N 0.93 2.46 -0.35 2.46 4.32 -1.26 -4.54 117.00 121.01 1g9r n LEU 112 Ca 0.07 -0.83 0.09 0.00 -0.02 0.00 0.00 56.01 55.33 1g9r n LEU 112 Cb 0.35 -0.01 0.27 0.00 -1.62 0.00 0.00 43.42 42.41 1g9r n LEU 112 CO 0.61 0.42 1.21 0.74 -1.22 0.00 0.00 177.39 179.15 1g9r h THR 113 N 3.72 0.82 -0.86 -5.08 2.02 -1.97 0.98 112.91 112.55 1g9r h THR 113 Ca 0.00 -0.30 -0.01 0.00 0.77 0.00 0.00 66.41 66.87 1g9r h THR 113 Cb 0.84 -0.14 -0.04 0.00 -1.74 0.00 0.00 68.15 67.07 1g9r h THR 113 CO 0.00 0.16 0.50 -0.65 0.37 0.00 0.00 175.52 175.90 1g9r h PRO 114 N 0.88 1.17 -0.08 6.66 0.11 -1.98 0.33 132.00 139.09 1g9r h PRO 114 Ca 0.53 -0.11 -0.04 0.00 0.11 0.00 0.00 66.00 66.48 1g9r h PRO 114 Cb 0.66 -0.24 -0.00 0.00 0.11 0.00 0.00 31.00 31.53 1g9r h PRO 114 CO -0.32 0.83 -0.11 1.25 -0.21 0.00 0.00 178.00 179.44 1g9r h LEU 115 N 1.18 0.24 -1.12 2.35 5.85 -1.52 -3.00 115.31 119.30 1g9r h LEU 115 Ca 0.31 -0.52 0.08 0.00 0.84 0.00 0.00 57.88 58.59 1g9r h LEU 115 Cb -0.03 -0.07 -0.07 0.00 0.37 0.00 0.00 40.66 40.87 1g9r h LEU 115 CO -0.06 0.72 0.60 -0.25 -0.34 0.00 0.00 178.44 179.12 1g9r h TRP 116 N -0.23 1.06 0.00 1.25 2.91 -0.52 -1.39 115.95 119.04 1g9r h TRP 116 Ca 0.01 0.03 0.00 0.00 1.13 0.00 0.00 58.89 60.06 1g9r h TRP 116 Cb 0.66 -0.35 0.00 0.00 -0.51 0.00 0.00 29.16 28.97 1g9r h TRP 116 CO 0.10 0.51 0.00 -0.25 -1.03 0.00 0.00 178.44 177.77 1g9r n ASP 117 N -4.52 0.00 -4.73 2.65 8.00 0.11 -4.86 116.55 113.20 1g9r n ASP 117 Ca 0.15 -0.29 -0.42 0.00 0.71 0.00 0.00 54.79 54.94 1g9r n ASP 117 Cb 0.26 -0.22 -0.03 0.00 -0.02 0.00 0.00 41.12 41.12 1g9r n ASP 117 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1g9r s THR 118 N -2.43 2.36 -0.42 -3.53 2.01 -0.52 -4.94 115.64 108.16 1g9r s THR 118 Ca 0.30 0.27 -0.24 0.00 0.31 0.00 0.00 61.69 62.32 1g9r s THR 118 Cb 0.19 -3.17 0.02 0.00 0.01 0.00 0.00 72.50 69.54 1g9r s THR 118 CO 0.39 0.03 0.86 -0.62 -0.69 0.00 0.00 174.62 174.60 1g9r s ASP 119 N 0.92 6.52 0.08 3.53 2.15 -1.26 -4.92 116.67 123.70 1g9r s ASP 119 Ca 0.69 0.19 0.28 0.00 0.43 0.00 0.00 52.55 54.13 1g9r s ASP 119 Cb -0.46 -2.43 1.07 0.00 -0.30 0.00 0.00 42.92 40.81 1g9r s ASP 119 CO 0.36 -0.92 1.87 0.18 -0.17 0.00 0.00 175.17 176.49 1g9r n LEU 120 N 6.85 0.31 0.00 -1.34 4.77 -1.26 -5.00 117.00 121.33 1g9r n LEU 120 Ca 0.05 0.53 0.00 0.00 -0.03 0.00 0.00 56.01 56.56 1g9r n LEU 120 Cb 0.48 -0.43 0.00 0.00 -2.33 0.00 0.00 43.42 41.14 1g9r n LEU 120 CO 0.60 -0.07 0.00 0.61 -1.33 0.00 0.00 177.39 177.20 1g9r n GLY 121 N 1.41 2.73 1.55 -0.72 0.00 -1.26 -0.89 105.19 108.01 1g9r n GLY 121 Ca 0.06 -0.27 0.06 0.00 0.00 0.00 0.00 46.02 45.88 1g9r n GLY 121 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1g9r n ASP 122 N 1.15 4.58 -4.81 1.61 2.03 -1.26 -4.93 116.55 114.92 1g9r n ASP 122 Ca 0.00 -2.66 -0.32 0.00 0.52 0.00 0.00 54.79 52.34 1g9r n ASP 122 Cb 0.00 -0.62 0.03 0.00 -0.72 0.00 0.00 41.12 39.81 1g9r n ASP 122 CO 0.00 0.00 0.00 0.20 -1.92 0.00 0.00 177.20 175.48 1g9r s ASN 123 N -0.66 5.56 0.14 1.67 -0.87 -0.07 -4.97 114.94 115.75 1g9r s ASN 123 Ca 0.43 1.73 -0.06 0.00 -1.57 0.00 0.00 52.86 53.38 1g9r s ASN 123 Cb 0.32 -2.52 -0.05 0.00 -0.02 0.00 0.00 41.25 38.98 1g9r s ASN 123 CO 0.14 -1.32 1.36 -0.50 -2.57 0.00 0.00 177.10 174.21 1g9r h TRP 124 N -0.13 0.76 -2.24 2.20 4.06 -1.27 -3.43 115.95 115.89 1g9r h TRP 124 Ca -0.45 -0.35 0.20 0.00 2.06 0.00 0.00 58.89 60.34 1g9r h TRP 124 Cb 1.22 -0.11 -0.08 0.00 -1.00 0.00 0.00 29.16 29.19 1g9r h TRP 124 CO 0.60 1.15 0.56 -0.48 -3.56 0.00 0.00 178.44 176.71 1g9r s LEU 125 N -8.08 -0.12 -0.06 -4.49 2.34 -1.25 -2.19 118.68 104.82 1g9r s LEU 125 Ca -0.07 -0.42 0.06 0.00 0.06 0.00 0.00 54.13 53.75 1g9r s LEU 125 Cb 0.09 2.02 -0.01 0.00 -0.56 0.00 0.00 46.19 47.74 1g9r s LEU 125 CO 0.87 -0.83 -0.24 -0.83 -1.06 0.00 0.00 176.35 174.26 1g9r s GLY 126 N -3.05 1.32 0.16 -3.48 0.00 0.59 -1.15 107.32 101.71 1g9r s GLY 126 Ca 0.15 -1.03 -0.14 0.00 0.00 0.00 0.00 44.72 43.69 1g9r s GLY 126 CO 0.02 -0.61 0.40 0.00 0.00 0.00 0.00 173.10 172.91 1g9r s ALA 127 N -0.11 -0.63 0.21 3.20 0.00 -0.10 -1.04 121.76 123.28 1g9r s ALA 127 Ca -0.05 -0.38 -0.07 0.00 0.00 0.00 0.00 51.96 51.46 1g9r s ALA 127 Cb -0.14 0.78 -0.06 0.00 0.00 0.00 0.00 23.12 23.70 1g9r s ALA 127 CO 0.04 -0.69 0.49 -1.12 0.00 0.00 0.00 175.76 174.48 1g9r s SER 128 N -2.88 6.54 0.33 0.00 0.01 -1.26 -0.65 113.70 115.80 1g9r s SER 128 Ca 0.09 0.76 -0.27 0.00 1.31 0.00 0.00 55.95 57.85 1g9r s SER 128 Cb 0.01 -2.16 -0.09 0.00 0.21 0.00 0.00 66.02 63.99 1g9r s SER 128 CO -0.05 -0.06 1.09 -0.63 0.41 0.00 0.00 173.24 174.00 1g9r s ILE 129 N -1.82 3.52 -0.56 1.44 1.01 -1.26 -1.02 121.20 122.50 1g9r s ILE 129 Ca 0.45 1.37 -0.18 0.00 0.00 0.00 0.00 60.65 62.29 1g9r s ILE 129 Cb -0.11 -3.81 0.10 0.00 0.01 0.00 0.00 42.46 38.65 1g9r s ILE 129 CO 0.24 0.21 0.63 -0.62 0.00 0.00 0.00 174.94 175.40 1g9r s ASP 130 N -1.14 6.19 0.31 3.58 -1.08 -0.23 -4.61 116.67 119.68 1g9r s ASP 130 Ca 0.50 -1.43 -0.01 0.00 -0.52 0.00 0.00 52.55 51.09 1g9r s ASP 130 Cb -0.29 -2.27 0.49 0.00 -1.46 0.00 0.00 42.92 39.39 1g9r s ASP 130 CO 0.36 -1.00 1.96 -0.07 0.52 0.00 0.00 175.17 176.94 1g9r h LEU 131 N 9.63 0.91 0.03 -1.34 4.07 -1.95 -1.34 115.31 125.34 1g9r h LEU 131 Ca -0.29 -0.02 -0.00 0.00 0.08 0.00 0.00 57.88 57.65 1g9r h LEU 131 Cb 1.09 -0.22 0.00 0.00 1.08 0.00 0.00 40.66 42.61 1g9r h LEU 131 CO 1.06 0.64 -0.02 0.15 -1.08 0.00 0.00 178.44 179.19 1g9r h PHE 132 N 1.07 -0.04 -0.25 1.13 3.04 -1.94 -2.28 116.94 117.66 1g9r h PHE 132 Ca 0.32 -0.00 -0.16 0.00 3.98 0.00 0.00 57.97 62.11 1g9r h PHE 132 Cb -0.03 0.01 -0.00 0.00 2.56 0.00 0.00 35.95 38.49 1g9r h PHE 132 CO -0.00 0.03 -0.50 0.28 -2.02 0.00 0.00 178.31 176.09 1g9r h VAL 133 N -0.10 1.30 -0.09 1.41 2.07 -1.91 -2.97 116.25 115.95 1g9r h VAL 133 Ca -0.00 -1.71 -0.01 0.00 0.82 0.00 0.00 66.70 65.79 1g9r h VAL 133 Cb 0.09 1.64 -0.01 0.00 -1.52 0.00 0.00 31.29 31.49 1g9r h VAL 133 CO 0.01 0.55 -0.01 -0.08 0.02 0.00 0.00 177.57 178.05 1g9r h GLU 134 N 0.55 0.12 -0.50 1.57 4.57 -1.18 -1.45 114.58 118.27 1g9r h GLU 134 Ca 0.02 -0.01 0.00 0.00 -1.18 0.00 0.00 59.36 58.19 1g9r h GLU 134 Cb 1.07 -0.02 0.00 0.00 -0.16 0.00 0.00 28.75 29.63 1g9r h GLU 134 CO 0.10 0.15 0.00 2.89 -1.18 0.00 0.00 179.01 180.97 1g9r n ARG 135 N -4.45 2.35 -2.69 1.92 1.85 -0.86 -4.74 116.66 110.04 1g9r n ARG 135 Ca -0.02 -2.08 -0.42 0.00 -1.00 0.00 0.00 57.85 54.34 1g9r n ARG 135 Cb 0.14 -1.47 -0.03 0.00 -1.05 0.00 0.00 32.46 30.05 1g9r n ARG 135 CO 0.00 0.00 0.00 -1.14 -0.01 0.00 0.00 177.63 176.48 1g9r s GLN 136 N -1.34 3.32 -0.29 2.89 0.74 -0.55 -4.95 119.66 119.48 1g9r s GLN 136 Ca 0.39 -0.81 -0.43 0.00 0.05 0.00 0.00 55.36 54.55 1g9r s GLN 136 Cb 0.21 -4.57 -0.19 0.00 1.10 0.00 0.00 33.01 29.56 1g9r s GLN 136 CO 0.28 -2.02 1.50 -1.91 -0.55 0.00 0.00 175.29 172.59 1g9r n GLU 137 N 8.43 0.35 -0.09 1.67 0.00 -1.26 -1.65 120.64 128.09 1g9r n GLU 137 Ca 0.11 0.13 0.00 0.00 0.00 0.00 0.00 57.16 57.40 1g9r n GLU 137 Cb 0.49 -1.68 0.00 0.00 0.00 0.00 0.00 31.44 30.24 1g9r n GLU 137 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1g9r n GLY 138 N 3.38 1.85 0.23 8.31 0.00 -1.26 -4.89 105.19 112.81 1g9r n GLY 138 Ca 0.27 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.14 1g9r n GLY 138 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1g9r h TYR 139 N 0.00 -0.46 -0.91 1.61 3.20 -1.65 -2.98 116.97 115.78 1g9r h TYR 139 Ca 0.00 -0.01 0.26 0.00 3.14 0.00 0.00 58.73 62.11 1g9r h TYR 139 Cb 0.00 0.15 -0.15 0.00 1.54 0.00 0.00 36.73 38.28 1g9r h TYR 139 CO 0.00 -0.16 0.27 -0.22 -1.64 0.00 0.00 178.16 176.41 1g9r h LYS 140 N -0.75 0.19 -0.05 1.82 3.64 -1.83 0.16 116.57 119.75 1g9r h LYS 140 Ca -0.05 -0.01 -0.10 0.00 -1.27 0.00 0.00 60.65 59.22 1g9r h LYS 140 Cb 0.51 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.27 1g9r h LYS 140 CO 0.08 0.13 -0.43 1.96 -2.27 0.00 0.00 179.45 178.92 1g9r h GLN 141 N 0.20 0.11 -0.06 1.90 7.50 -1.92 -2.78 115.11 120.07 1g9r h GLN 141 Ca 0.59 -0.05 0.02 0.00 0.50 0.00 0.00 58.65 59.71 1g9r h GLN 141 Cb 1.24 -0.00 -0.00 0.00 0.05 0.00 0.00 27.48 28.76 1g9r h GLN 141 CO -0.68 0.52 0.05 0.87 -1.50 0.00 0.00 178.83 178.10 1g9r h LYS 142 N 0.09 0.00 -0.56 1.46 1.57 -0.51 -0.44 116.57 118.17 1g9r h LYS 142 Ca 0.01 0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 58.72 1g9r h LYS 142 Cb 0.80 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 33.07 1g9r h LYS 142 CO 0.06 0.00 0.07 0.44 -0.57 0.00 0.00 179.45 179.45 1g9r n ILE 143 N -4.09 2.74 -1.17 1.86 -5.35 -1.05 -5.02 119.36 107.27 1g9r n ILE 143 Ca -0.02 -1.59 0.00 0.00 -0.27 0.00 0.00 62.75 60.87 1g9r n ILE 143 Cb 0.15 -0.30 0.00 0.00 -1.74 0.00 0.00 39.64 37.75 1g9r n ILE 143 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1g9r n GLY 144 N 0.17 -0.28 3.22 3.28 0.00 -0.18 -4.79 105.19 106.62 1g9r n GLY 144 Ca 0.31 -0.26 -0.13 0.00 0.00 0.00 0.00 46.02 45.94 1g9r n GLY 144 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1g9r s ALA 146 N -1.42 1.28 0.43 4.61 0.00 -1.26 -5.00 121.76 120.40 1g9r s ALA 146 Ca 0.00 -1.41 0.15 0.00 0.00 0.00 0.00 51.96 50.70 1g9r s ALA 146 Cb 0.00 0.07 1.04 0.00 0.00 0.00 0.00 23.12 24.23 1g9r s ALA 146 CO 0.00 -0.12 1.95 0.22 0.00 0.00 0.00 175.76 177.81 1g9r h ASP 147 N 2.96 0.38 0.23 0.00 3.58 -2.02 -1.07 116.42 120.48 1g9r h ASP 147 Ca -0.36 0.02 0.00 0.00 0.42 0.00 0.00 57.03 57.10 1g9r h ASP 147 Cb 1.18 -0.06 0.00 0.00 1.72 0.00 0.00 39.33 42.17 1g9r h ASP 147 CO 0.62 0.21 -0.09 0.61 -2.88 0.00 0.00 179.24 177.72 1g9r n GLY 148 N -1.52 -0.76 3.58 -0.78 0.00 -1.26 -4.70 105.19 99.74 1g9r n GLY 148 Ca 0.12 -0.30 -0.38 0.00 0.00 0.00 0.00 46.02 45.46 1g9r n GLY 148 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1g9r s GLU 149 N -2.32 3.85 -0.08 1.61 2.02 -0.41 -5.06 118.70 118.32 1g9r s GLU 149 Ca 0.33 -0.39 -0.22 0.00 0.02 0.00 0.00 54.97 54.71 1g9r s GLU 149 Cb 0.20 -3.68 -0.04 0.00 0.10 0.00 0.00 34.13 30.71 1g9r s GLU 149 CO 0.44 -0.23 0.65 0.71 0.02 0.00 0.00 175.26 176.85 1g9r s TYR 150 N 1.75 3.57 -0.06 1.61 4.12 -1.26 -4.64 117.35 122.43 1g9r s TYR 150 Ca 0.07 1.18 -0.30 0.00 0.02 0.00 0.00 57.07 58.04 1g9r s TYR 150 Cb -0.16 -2.75 -0.04 0.00 -1.52 0.00 0.00 41.96 37.48 1g9r s TYR 150 CO 0.11 0.11 1.42 -0.47 0.02 0.00 0.00 175.55 176.73 1g9r s TYR 151 N 0.76 2.64 0.18 2.71 6.14 -1.26 -4.97 117.35 123.54 1g9r s TYR 151 Ca 0.35 0.73 0.03 0.00 0.64 0.00 0.00 57.07 58.83 1g9r s TYR 151 Cb -0.17 -3.67 -0.03 0.00 0.42 0.00 0.00 41.96 38.50 1g9r s TYR 151 CO 0.17 -2.54 0.31 -0.59 0.64 0.00 0.00 175.55 173.54 1g9r s PHE 152 N 3.13 3.48 0.03 4.97 -0.71 -1.26 -1.07 117.98 126.54 1g9r s PHE 152 Ca 0.63 0.08 -0.21 0.00 -1.04 0.00 0.00 56.93 56.39 1g9r s PHE 152 Cb -0.29 -1.64 -0.06 0.00 -1.21 0.00 0.00 43.02 39.83 1g9r s PHE 152 CO 0.24 0.49 0.63 1.21 -1.34 0.00 0.00 175.22 176.45 1g9r s ASN 153 N -3.45 7.06 0.00 1.98 3.84 -0.19 -4.63 114.94 119.54 1g9r s ASN 153 Ca 0.34 1.26 0.24 0.00 0.21 0.00 0.00 52.86 54.91 1g9r s ASN 153 Cb -0.10 -2.39 1.19 0.00 -0.55 0.00 0.00 41.25 39.40 1g9r s ASN 153 CO 0.29 0.14 1.80 0.00 -2.79 0.00 0.00 177.10 176.53 1g9r n ALA 154 N 2.44 2.60 0.38 1.71 0.00 -1.26 -4.14 120.51 122.24 1g9r n ALA 154 Ca -0.07 -0.30 0.14 0.00 0.00 0.00 0.00 53.44 53.21 1g9r n ALA 154 Cb 0.51 -1.27 0.49 0.00 0.00 0.00 0.00 19.45 19.18 1g9r n ALA 154 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1g9r h GLY 155 N 5.12 0.00 -6.97 0.00 0.00 -1.93 -3.41 103.07 95.87 1g9r h GLY 155 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 47.33 46.91 1g9r h GLY 155 CO 0.00 0.00 -0.72 0.14 0.00 0.00 0.00 176.54 175.96 1g9r s VAL 156 N -3.37 -0.16 -0.08 4.60 1.01 -1.26 -0.99 120.40 120.16 1g9r s VAL 156 Ca 0.05 -0.15 -0.01 0.00 0.00 0.00 0.00 61.98 61.87 1g9r s VAL 156 Cb 0.09 -0.61 0.03 0.00 0.00 0.00 0.00 36.38 35.89 1g9r s VAL 156 CO 0.51 -0.26 -0.03 -0.76 0.00 0.00 0.00 175.10 174.56 1g9r s LEU 157 N 2.19 0.85 -0.47 3.92 1.43 -0.00 -4.28 118.68 122.31 1g9r s LEU 157 Ca 0.03 -0.16 -0.22 0.00 -1.03 0.00 0.00 54.13 52.76 1g9r s LEU 157 Cb -0.16 -0.58 0.03 0.00 0.03 0.00 0.00 46.19 45.52 1g9r s LEU 157 CO -0.10 -0.16 0.74 -0.22 0.23 0.00 0.00 176.35 176.84 1g9r s LEU 158 N 1.79 4.43 -0.19 1.79 2.96 -0.20 -0.03 118.68 129.24 1g9r s LEU 158 Ca 0.04 -0.37 -0.10 0.00 -0.22 0.00 0.00 54.13 53.47 1g9r s LEU 158 Cb -0.13 -2.77 -0.05 0.00 0.50 0.00 0.00 46.19 43.74 1g9r s LEU 158 CO -0.06 -0.92 0.16 -0.63 -1.32 0.00 0.00 176.35 173.58 1g9r s ILE 159 N 3.14 5.40 -1.31 6.68 1.01 0.23 -0.30 121.20 136.06 1g9r s ILE 159 Ca 0.25 0.25 -0.15 0.00 0.00 0.00 0.00 60.65 61.00 1g9r s ILE 159 Cb -0.14 -3.49 0.10 0.00 0.01 0.00 0.00 42.46 38.95 1g9r s ILE 159 CO 0.19 0.45 1.77 -3.20 0.00 0.00 0.00 174.94 174.15 1g9r n ASN 160 N 3.39 4.83 -0.23 3.58 2.85 -0.93 -2.58 115.26 126.17 1g9r n ASN 160 Ca -0.16 -2.94 0.09 0.00 -0.11 0.00 0.00 54.58 51.46 1g9r n ASN 160 Cb 0.52 -1.65 0.36 0.00 1.24 0.00 0.00 39.78 40.25 1g9r n ASN 160 CO 0.00 0.00 0.00 -0.07 -2.11 0.00 0.00 177.26 175.08 1g9r h LEU 161 N 10.71 0.67 -0.64 1.20 3.38 -1.57 -1.66 115.31 127.41 1g9r h LEU 161 Ca 0.43 0.02 0.04 0.00 0.09 0.00 0.00 57.88 58.46 1g9r h LEU 161 Cb 0.79 -0.12 -0.04 0.00 0.09 0.00 0.00 40.66 41.38 1g9r h LEU 161 CO 1.51 0.40 0.38 0.50 0.09 0.00 0.00 178.44 181.32 1g9r h LYS 162 N 0.74 0.72 -0.16 1.13 3.64 -1.64 -0.03 116.57 120.97 1g9r h LYS 162 Ca 0.38 -0.04 -0.02 0.00 -1.27 0.00 0.00 60.65 59.69 1g9r h LYS 162 Cb 0.46 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 32.12 1g9r h LYS 162 CO -0.15 0.48 0.02 -0.22 -2.27 0.00 0.00 179.45 177.31 1g9r h LYS 163 N 0.74 0.27 -0.77 1.90 3.64 -1.62 -3.03 116.57 117.69 1g9r h LYS 163 Ca 0.26 -0.07 0.13 0.00 -1.27 0.00 0.00 60.65 59.70 1g9r h LYS 163 Cb 0.06 -0.03 -0.09 0.00 -0.41 0.00 0.00 32.23 31.77 1g9r h LYS 163 CO -0.12 0.44 0.36 -1.49 -2.27 0.00 0.00 179.45 176.37 1g9r h TRP 164 N 0.05 0.63 0.00 1.91 4.06 -0.86 0.02 115.95 121.76 1g9r h TRP 164 Ca 0.05 0.03 0.00 0.00 2.06 0.00 0.00 58.89 61.03 1g9r h TRP 164 Cb 0.31 -0.16 0.00 0.00 -1.00 0.00 0.00 29.16 28.30 1g9r h TRP 164 CO 0.02 0.15 0.00 0.54 -3.56 0.00 0.00 178.44 175.59 1g9r n ARG 165 N -4.92 0.15 0.00 0.49 1.74 -0.07 -0.75 116.66 113.30 1g9r n ARG 165 Ca 0.14 0.58 0.14 0.00 -0.77 0.00 0.00 57.85 57.94 1g9r n ARG 165 Cb 0.38 -1.92 0.66 0.00 -1.02 0.00 0.00 32.46 30.55 1g9r n ARG 165 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1g9r n ARG 166 N -2.22 0.95 -4.25 5.56 1.74 -0.01 -4.89 116.66 113.53 1g9r n ARG 166 Ca -0.00 -0.34 -0.14 0.00 -0.77 0.00 0.00 57.85 56.60 1g9r n ARG 166 Cb 0.08 -1.49 -0.10 0.00 -1.02 0.00 0.00 32.46 29.93 1g9r n ARG 166 CO 0.00 0.00 0.00 -1.01 -1.52 0.00 0.00 177.63 175.10 1g9r s HIS 167 N -2.29 1.27 -0.96 -1.55 3.76 0.07 -5.08 115.29 110.52 1g9r s HIS 167 Ca 0.34 -1.08 -0.12 0.00 -0.15 0.00 0.00 55.06 54.06 1g9r s HIS 167 Cb 0.21 -0.72 0.25 0.00 1.11 0.00 0.00 32.58 33.42 1g9r s HIS 167 CO 0.43 -0.27 0.93 0.34 -0.85 0.00 0.00 174.74 175.32 1g9r s ASP 168 N -3.20 7.03 0.29 1.40 3.68 -1.26 -4.88 116.67 119.72 1g9r s ASP 168 Ca 0.28 -3.12 -0.02 0.00 2.13 0.00 0.00 52.55 51.82 1g9r s ASP 168 Cb 0.07 -2.21 0.41 0.00 -1.45 0.00 0.00 42.92 39.73 1g9r s ASP 168 CO 0.06 -0.44 1.90 0.40 0.13 0.00 0.00 175.17 177.23 1g9r h ILE 169 N 4.26 1.22 -0.47 4.11 1.08 -1.85 -2.84 117.51 123.02 1g9r h ILE 169 Ca 0.14 -0.56 -0.08 0.00 -0.39 0.00 0.00 64.86 63.97 1g9r h ILE 169 Cb 0.96 0.25 -0.02 0.00 -3.07 0.00 0.00 36.82 34.95 1g9r h ILE 169 CO 0.88 0.25 -0.03 0.15 -0.69 0.00 0.00 178.15 178.71 1g9r h PHE 170 N 1.02 0.94 0.00 1.37 3.04 -1.90 0.85 116.94 122.24 1g9r h PHE 170 Ca 0.26 -0.17 0.00 0.00 3.98 0.00 0.00 57.97 62.03 1g9r h PHE 170 Cb 0.04 -0.24 0.00 0.00 2.56 0.00 0.00 35.95 38.31 1g9r h PHE 170 CO 0.01 0.90 0.00 1.17 -2.02 0.00 0.00 178.31 178.37 1g9r n LYS 171 N -4.32 0.25 0.00 1.11 4.81 -1.07 -0.61 118.16 118.32 1g9r n LYS 171 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.44 1g9r n LYS 171 Cb 0.33 -1.29 0.00 0.00 0.02 0.00 0.00 35.03 34.09 1g9r n LYS 171 CO 0.00 0.00 0.00 0.43 1.17 0.00 0.00 177.40 179.00 1g9r n SER 173 N 0.70 0.00 -0.23 3.14 7.64 0.29 -1.39 113.62 123.78 1g9r n SER 173 Ca 0.00 0.00 -0.05 0.00 1.01 0.00 0.00 58.87 59.83 1g9r n SER 173 Cb 0.10 0.00 0.05 0.00 -1.01 0.00 0.00 64.21 63.35 1g9r n SER 173 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 1g9r h SER 174 N 0.00 0.71 -0.26 6.43 0.02 -1.11 -0.38 113.55 118.96 1g9r h SER 174 Ca 0.00 -0.01 -0.09 0.00 -0.84 0.00 0.00 61.79 60.84 1g9r h SER 174 Cb 0.00 -0.17 -0.02 0.00 0.14 0.00 0.00 62.40 62.35 1g9r h SER 174 CO 0.00 0.51 -0.15 -0.33 -1.14 0.00 0.00 176.83 175.72 1g9r h GLU 175 N 0.84 0.69 -0.32 3.45 5.08 -1.49 -1.41 114.58 121.42 1g9r h GLU 175 Ca 0.24 -0.24 -0.05 0.00 -1.00 0.00 0.00 59.36 58.31 1g9r h GLU 175 Cb -0.07 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.12 1g9r h GLU 175 CO -0.07 0.81 -0.01 2.35 -1.00 0.00 0.00 179.01 181.09 1g9r h TRP 176 N 0.62 0.62 -1.01 4.33 7.01 -1.69 -2.24 115.95 123.59 1g9r h TRP 176 Ca 0.10 -0.11 0.02 0.00 2.11 0.00 0.00 58.89 61.01 1g9r h TRP 176 Cb 0.61 -0.16 -0.05 0.00 -2.10 0.00 0.00 29.16 27.46 1g9r h TRP 176 CO 0.03 0.70 0.67 0.28 -2.79 0.00 0.00 178.44 177.32 1g9r h VAL 177 N 0.36 1.23 -0.68 2.65 2.07 -0.87 0.84 116.25 121.86 1g9r h VAL 177 Ca 0.09 -0.46 -0.00 0.00 0.82 0.00 0.00 66.70 67.15 1g9r h VAL 177 Cb 0.46 -0.22 -0.03 0.00 -1.52 0.00 0.00 31.29 29.97 1g9r h VAL 177 CO 0.02 0.24 0.41 -0.08 0.02 0.00 0.00 177.57 178.18 1g9r h GLU 178 N 1.34 0.92 0.03 1.57 4.57 -1.02 0.30 114.58 122.29 1g9r h GLU 178 Ca 0.38 -0.08 -0.23 0.00 -1.18 0.00 0.00 59.36 58.26 1g9r h GLU 178 Cb -0.11 -0.20 -0.00 0.00 -0.16 0.00 0.00 28.75 28.28 1g9r h GLU 178 CO -0.09 0.65 -0.99 0.37 -1.18 0.00 0.00 179.01 177.76 1g9r h GLN 179 N 0.94 0.26 0.00 1.92 4.15 -0.53 -3.38 115.11 118.47 1g9r h GLN 179 Ca 0.25 -0.33 0.00 0.00 0.77 0.00 0.00 58.65 59.34 1g9r h GLN 179 Cb -0.04 0.10 0.00 0.00 0.21 0.00 0.00 27.48 27.76 1g9r h GLN 179 CO -0.05 1.07 -0.01 0.66 -1.93 0.00 0.00 178.83 178.57 1g9r n TYR 180 N -3.63 0.00 -0.04 3.99 4.02 0.14 -4.79 117.16 116.85 1g9r n TYR 180 Ca -0.05 -0.72 0.19 0.00 -0.01 0.00 0.00 57.90 57.31 1g9r n TYR 180 Cb 0.88 -0.10 0.65 0.00 -0.02 0.00 0.00 39.34 40.75 1g9r n TYR 180 CO 0.00 0.00 0.00 -0.22 -1.01 0.00 0.00 176.86 175.63 1g9r h LYS 181 N 0.00 0.09 -0.00 -0.72 1.63 -0.59 -1.55 116.57 115.42 1g9r h LYS 181 Ca 0.00 -0.01 0.00 0.00 -0.85 0.00 0.00 60.65 59.79 1g9r h LYS 181 Cb 0.75 -0.02 0.00 0.00 -0.60 0.00 0.00 32.23 32.36 1g9r h LYS 181 CO 0.00 0.06 -0.11 -0.25 -3.45 0.00 0.00 179.45 175.70 1g9r n ASP 182 N -4.39 0.61 -3.59 4.20 10.43 -1.26 -5.01 116.55 117.54 1g9r n ASP 182 Ca 0.11 -0.73 -0.27 0.00 2.57 0.00 0.00 54.79 56.47 1g9r n ASP 182 Cb 0.60 -0.03 -0.10 0.00 1.84 0.00 0.00 41.12 43.43 1g9r n ASP 182 CO 0.00 0.00 0.00 0.55 -1.07 0.00 0.00 177.20 176.68 1g9r n VAL 183 N -0.81 1.22 -0.20 2.53 3.14 -0.59 -5.25 118.33 118.37 1g9r n VAL 183 Ca 0.15 -4.69 0.00 0.00 -2.96 0.00 0.00 64.34 56.84 1g9r n VAL 183 Cb 0.28 -2.06 0.00 0.00 -1.06 0.00 0.00 33.84 31.01 1g9r n VAL 183 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1g9r n GLN 185 N 1.64 0.00 -0.72 1.45 6.02 -1.26 -5.03 117.38 119.48 1g9r n GLN 185 Ca 0.25 0.00 0.01 0.00 -0.01 0.00 0.00 57.00 57.25 1g9r n GLN 185 Cb 0.41 0.00 0.20 0.00 1.02 0.00 0.00 30.24 31.87 1g9r n GLN 185 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 1g9r n TYR 186 N 0.00 0.49 0.00 1.08 4.02 -1.26 -4.89 117.16 116.61 1g9r n TYR 186 Ca 0.00 -1.57 0.00 0.00 -0.01 0.00 0.00 57.90 56.32 1g9r n TYR 186 Cb 0.00 -0.35 0.00 0.00 -0.02 0.00 0.00 39.34 38.97 1g9r n TYR 186 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 176.86 176.89 1g9r n GLN 187 N -1.11 0.00 0.15 -0.72 6.02 -1.26 -1.64 117.38 118.82 1g9r n GLN 187 Ca 0.25 0.00 0.11 0.00 -0.01 0.00 0.00 57.00 57.36 1g9r n GLN 187 Cb 0.83 0.00 0.63 0.00 1.02 0.00 0.00 30.24 32.72 1g9r n GLN 187 CO 0.00 0.00 0.00 0.38 -1.01 0.00 0.00 177.06 176.43 1g9r h ASP 188 N 0.00 0.06 -0.75 1.08 2.03 -1.90 -1.63 116.42 115.31 1g9r h ASP 188 Ca 0.00 -0.00 -0.05 0.00 -0.73 0.00 0.00 57.03 56.25 1g9r h ASP 188 Cb 0.00 -0.01 -0.03 0.00 -0.83 0.00 0.00 39.33 38.45 1g9r h ASP 188 CO 0.00 0.04 0.26 -0.61 -1.03 0.00 0.00 179.24 177.90 1g9r h GLN 189 N 0.07 1.15 -0.07 4.15 4.15 -1.69 -1.55 115.11 121.32 1g9r h GLN 189 Ca 0.10 -0.23 -0.01 0.00 0.77 0.00 0.00 58.65 59.28 1g9r h GLN 189 Cb 0.30 -0.18 -0.00 0.00 0.21 0.00 0.00 27.48 27.81 1g9r h GLN 189 CO -0.01 0.96 0.02 -0.44 -1.93 0.00 0.00 178.83 177.43 1g9r h ASP 190 N 1.11 0.11 -0.33 -0.69 3.45 -1.27 -2.22 116.42 116.58 1g9r h ASP 190 Ca 0.25 -0.20 0.07 0.00 0.43 0.00 0.00 57.03 57.57 1g9r h ASP 190 Cb 0.27 -0.03 -0.07 0.00 -0.56 0.00 0.00 39.33 38.94 1g9r h ASP 190 CO -0.01 0.29 -0.12 0.40 -1.57 0.00 0.00 179.24 178.22 1g9r h ILE 191 N -0.07 0.58 -0.58 0.35 2.04 -1.24 0.21 117.51 118.80 1g9r h ILE 191 Ca 0.02 0.00 0.01 0.00 1.00 0.00 0.00 64.86 65.89 1g9r h ILE 191 Cb 0.22 0.58 -0.03 0.00 -0.74 0.00 0.00 36.82 36.84 1g9r h ILE 191 CO -0.00 0.00 0.38 -0.07 0.00 0.00 0.00 178.15 178.46 1g9r h LEU 192 N -0.06 0.65 -0.36 1.44 3.38 -1.23 -0.51 115.31 118.61 1g9r h LEU 192 Ca 0.17 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.10 1g9r h LEU 192 Cb 0.31 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.89 1g9r h LEU 192 CO -0.38 0.47 0.13 0.78 0.09 0.00 0.00 178.44 179.53 1g9r h ASN 193 N 0.77 0.51 -0.39 -0.43 2.35 -0.73 -1.67 115.58 115.99 1g9r h ASN 193 Ca 0.22 -0.18 -0.02 0.00 -0.55 0.00 0.00 56.30 55.77 1g9r h ASN 193 Cb -0.07 -0.13 -0.02 0.00 0.05 0.00 0.00 38.32 38.15 1g9r h ASN 193 CO -0.06 0.56 0.18 1.23 -1.65 0.00 0.00 177.43 177.69 1g9r h GLY 194 N 0.44 0.61 1.11 2.83 0.00 -0.33 -1.15 103.07 106.59 1g9r h GLY 194 Ca 0.12 -0.31 -0.13 0.00 0.00 0.00 0.00 47.33 47.01 1g9r h GLY 194 CO -0.01 0.30 -0.19 1.41 0.00 0.00 0.00 176.54 178.05 1g9r h LEU 195 N 0.49 1.04 -1.61 3.11 3.38 -1.05 -3.34 115.31 117.33 1g9r h LEU 195 Ca 0.13 -0.38 0.00 0.00 0.09 0.00 0.00 57.88 57.72 1g9r h LEU 195 Cb 0.14 -0.29 0.00 0.00 0.09 0.00 0.00 40.66 40.61 1g9r h LEU 195 CO -0.01 1.19 -0.14 0.49 0.09 0.00 0.00 178.44 180.05 1g9r n PHE 196 N -4.12 0.00 -1.55 1.13 3.72 -0.63 -4.99 117.46 111.02 1g9r n PHE 196 Ca 0.01 0.00 -0.48 0.00 -0.05 0.00 0.00 57.45 56.92 1g9r n PHE 196 Cb 0.45 0.00 -0.04 0.00 -0.94 0.00 0.00 39.48 38.95 1g9r n PHE 196 CO 0.00 0.00 0.00 0.36 -0.05 0.00 0.00 176.76 177.07 1g9r n LYS 197 N 0.88 0.97 0.00 -1.08 2.85 -0.44 0.13 118.16 121.47 1g9r n LYS 197 Ca 0.12 0.35 0.00 0.00 -1.05 0.00 0.00 58.31 57.72 1g9r n LYS 197 Cb 0.53 -1.75 0.00 0.00 -0.65 0.00 0.00 35.03 33.17 1g9r n LYS 197 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1g9r n GLY 198 N 1.81 2.10 2.48 2.58 0.00 -1.26 -4.83 105.19 108.07 1g9r n GLY 198 Ca 0.15 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.06 1g9r n GLY 198 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1g9r n GLY 199 N -2.00 3.84 3.36 -0.02 0.00 0.12 -5.06 105.19 105.43 1g9r n GLY 199 Ca 0.00 -1.79 -0.32 0.00 0.00 0.00 0.00 46.02 43.91 1g9r n GLY 199 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1g9r s VAL 200 N -4.17 2.53 -0.22 1.61 1.01 -1.24 -0.81 120.40 119.12 1g9r s VAL 200 Ca 0.38 -0.90 -0.12 0.00 0.00 0.00 0.00 61.98 61.33 1g9r s VAL 200 Cb 0.36 -1.96 -0.05 0.00 0.00 0.00 0.00 36.38 34.73 1g9r s VAL 200 CO -0.01 0.57 0.23 0.00 0.00 0.00 0.00 175.10 175.90 1g9r s TYR 202 N 0.98 3.60 0.22 0.00 1.51 -1.26 -0.93 117.35 121.48 1g9r s TYR 202 Ca 0.11 0.91 0.05 0.00 -1.01 0.00 0.00 57.07 57.14 1g9r s TYR 202 Cb -0.13 -2.43 -0.03 0.00 -0.11 0.00 0.00 41.96 39.25 1g9r s TYR 202 CO 0.05 0.37 0.30 0.00 -1.11 0.00 0.00 175.55 175.15 1g9r s ALA 203 N -0.09 3.84 0.52 3.71 0.00 0.18 -4.87 121.76 125.05 1g9r s ALA 203 Ca 0.24 -1.24 -0.21 0.00 0.00 0.00 0.00 51.96 50.75 1g9r s ALA 203 Cb -0.16 -1.62 -0.06 0.00 0.00 0.00 0.00 23.12 21.29 1g9r s ALA 203 CO 0.11 0.30 1.21 1.21 0.00 0.00 0.00 175.76 178.59 1g9r s ASN 204 N -3.79 5.71 0.02 0.00 2.47 -1.26 -4.39 114.94 113.70 1g9r s ASN 204 Ca 0.34 2.40 0.04 0.00 0.42 0.00 0.00 52.86 56.05 1g9r s ASN 204 Cb -0.09 -2.61 0.17 0.00 -1.45 0.00 0.00 41.25 37.27 1g9r s ASN 204 CO 0.28 -1.24 1.12 -1.20 -3.72 0.00 0.00 177.10 172.33 1g9r n SER 205 N -0.95 0.04 0.30 -4.21 7.64 -0.15 -1.80 113.62 114.49 1g9r n SER 205 Ca 0.10 0.51 0.18 0.00 1.01 0.00 0.00 58.87 60.68 1g9r n SER 205 Cb 0.48 -0.52 0.95 0.00 -1.01 0.00 0.00 64.21 64.12 1g9r n SER 205 CO 0.00 0.00 0.00 0.08 -3.01 0.00 0.00 175.04 172.11 1g9r h ARG 206 N 0.00 0.00 -0.23 1.43 0.11 -1.86 -1.45 114.38 112.38 1g9r h ARG 206 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 1g9r h ARG 206 Cb 0.04 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.12 1g9r h ARG 206 CO 0.00 0.03 0.00 1.19 0.10 0.00 0.00 179.97 181.29 1g9r n PHE 207 N -3.31 0.29 -2.72 4.08 3.01 -0.75 -0.66 117.46 117.40 1g9r n PHE 207 Ca -0.02 -0.14 -0.06 0.00 1.01 0.00 0.00 57.45 58.23 1g9r n PHE 207 Cb 0.16 0.00 0.05 0.00 -0.01 0.00 0.00 39.48 39.69 1g9r n PHE 207 CO 0.00 0.00 0.00 -1.71 1.01 0.00 0.00 176.76 176.06 1g9r n ASN 208 N 0.57 -2.46 -4.84 4.37 2.85 -0.57 -4.58 115.26 110.59 1g9r n ASN 208 Ca 0.16 -2.74 -0.36 0.00 -0.11 0.00 0.00 54.58 51.53 1g9r n ASN 208 Cb 0.38 1.47 -0.06 0.00 1.24 0.00 0.00 39.78 42.82 1g9r n ASN 208 CO 0.00 0.00 0.00 0.12 -2.11 0.00 0.00 177.26 175.27 1g9r s PHE 209 N 0.57 3.64 0.06 1.20 5.36 -0.19 -4.88 117.98 123.75 1g9r s PHE 209 Ca 0.30 1.07 -0.17 0.00 -0.96 0.00 0.00 56.93 57.17 1g9r s PHE 209 Cb 0.19 -2.37 -0.15 0.00 -0.34 0.00 0.00 43.02 40.36 1g9r s PHE 209 CO -0.18 0.48 1.29 -1.35 -1.46 0.00 0.00 175.22 174.00 1g9r h PRO 211 N 3.80 0.58 -0.49 10.12 0.11 -1.87 -0.58 132.00 143.67 1g9r h PRO 211 Ca -0.49 -0.42 -0.06 0.00 0.11 0.00 0.00 66.00 65.15 1g9r h PRO 211 Cb 1.20 0.07 -0.02 0.00 0.11 0.00 0.00 31.00 32.35 1g9r h PRO 211 CO 0.65 1.04 0.07 1.15 -0.21 0.00 0.00 178.00 180.69 1g9r h THR 212 N 0.23 1.23 -0.54 -1.15 2.02 -1.96 0.58 112.91 113.32 1g9r h THR 212 Ca -0.01 -0.87 -0.04 0.00 0.77 0.00 0.00 66.41 66.26 1g9r h THR 212 Cb 1.07 0.78 -0.02 0.00 -1.74 0.00 0.00 68.15 68.24 1g9r h THR 212 CO 0.10 0.31 0.18 0.78 0.37 0.00 0.00 175.52 177.26 1g9r h ASN 213 N 0.73 0.77 -0.14 4.18 2.35 -1.94 -1.09 115.58 120.45 1g9r h ASN 213 Ca 0.15 -0.20 -0.00 0.00 -0.55 0.00 0.00 56.30 55.71 1g9r h ASN 213 Cb 0.35 -0.20 -0.01 0.00 0.05 0.00 0.00 38.32 38.51 1g9r h ASN 213 CO 0.01 0.76 0.09 0.22 -1.65 0.00 0.00 177.43 176.86 1g9r h TYR 214 N 0.74 0.19 0.00 1.19 3.20 -1.76 -2.49 116.97 118.04 1g9r h TYR 214 Ca 0.18 -0.00 -0.00 0.00 3.14 0.00 0.00 58.73 62.04 1g9r h TYR 214 Cb 0.26 -0.06 -0.00 0.00 1.54 0.00 0.00 36.73 38.46 1g9r h TYR 214 CO 0.01 0.16 -0.01 0.00 -1.64 0.00 0.00 178.16 176.68 1g9r h ALA 215 N 1.01 1.96 -2.32 1.82 0.00 -0.65 -3.52 119.26 117.56 1g9r h ALA 215 Ca 0.05 -0.01 -0.50 0.00 0.00 0.00 0.00 54.91 54.45 1g9r h ALA 215 Cb 0.03 -0.00 0.07 0.00 0.00 0.00 0.00 17.79 17.88 1g9r h ALA 215 CO -0.01 0.01 0.38 -0.06 0.00 0.00 0.00 179.25 179.58 1g9r s PHE 216 N -5.02 3.21 0.01 0.00 0.40 -0.43 -5.09 117.98 111.06 1g9r s PHE 216 Ca -0.05 1.43 -0.03 0.00 -0.60 0.00 0.00 56.93 57.68 1g9r s PHE 216 Cb 0.17 -2.87 -0.01 0.00 0.51 0.00 0.00 43.02 40.82 1g9r s PHE 216 CO 0.67 -1.00 0.30 0.00 0.70 0.00 0.00 175.22 175.89 1g9r n ALA 222 N -2.59 -0.06 0.00 5.36 0.00 -1.26 -5.09 120.51 116.88 1g9r n ALA 222 Ca 0.07 0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.59 1g9r n ALA 222 Cb 0.53 0.07 0.00 0.00 0.00 0.00 0.00 19.45 20.05 1g9r n ALA 222 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1g9r n SER 223 N -2.99 0.00 -0.13 0.00 2.88 -1.26 -5.03 113.62 107.09 1g9r n SER 223 Ca 0.00 0.00 -0.05 0.00 -1.33 0.00 0.00 58.87 57.49 1g9r n SER 223 Cb 0.02 0.00 0.14 0.00 -0.75 0.00 0.00 64.21 63.62 1g9r n SER 223 CO 0.00 0.00 0.00 -0.09 -1.23 0.00 0.00 175.04 173.72 1g9r h ARG 224 N 0.00 0.84 -5.18 -1.46 9.65 -1.99 -3.45 114.38 112.79 1g9r h ARG 224 Ca 0.00 -0.23 -0.37 0.00 -1.10 0.00 0.00 59.98 58.28 1g9r h ARG 224 Cb 0.00 -0.10 -0.19 0.00 -1.39 0.00 0.00 29.97 28.29 1g9r h ARG 224 CO 0.00 0.83 -0.75 -1.01 2.80 0.00 0.00 179.97 181.84 1g9r s HIS 225 N -5.02 1.18 -0.22 2.20 3.76 -1.26 -5.03 115.29 110.90 1g9r s HIS 225 Ca -0.10 -0.56 0.21 0.00 -0.15 0.00 0.00 55.06 54.46 1g9r s HIS 225 Cb 0.15 -0.64 -0.00 0.00 1.11 0.00 0.00 32.58 33.19 1g9r s HIS 225 CO 0.82 0.05 1.05 1.79 -0.85 0.00 0.00 174.74 177.60 1g9r h THR 226 N 3.84 0.15 -1.07 1.30 1.35 -2.02 -3.43 112.91 113.02 1g9r h THR 226 Ca -0.39 -1.28 -0.82 0.00 -0.55 0.00 0.00 66.41 63.37 1g9r h THR 226 Cb 1.19 1.70 0.01 0.00 -1.73 0.00 0.00 68.15 69.32 1g9r h THR 226 CO 0.47 0.09 0.83 -0.67 -0.25 0.00 0.00 175.52 175.99 1g9r n ASP 227 N -2.78 1.54 -0.07 5.36 4.64 -1.26 -4.82 116.55 119.15 1g9r n ASP 227 Ca -0.02 1.09 0.10 0.00 -1.38 0.00 0.00 54.79 54.58 1g9r n ASP 227 Cb 0.62 -0.97 0.48 0.00 -1.04 0.00 0.00 41.12 40.22 1g9r n ASP 227 CO 0.00 0.00 0.00 1.55 -0.82 0.00 0.00 177.20 177.93 1g9r h PRO 228 N 6.20 0.44 -0.19 -0.67 0.13 -1.99 -1.21 132.00 134.70 1g9r h PRO 228 Ca -0.41 -0.03 -0.03 0.00 -0.87 0.00 0.00 66.00 64.66 1g9r h PRO 228 Cb 1.36 -0.10 -0.01 0.00 0.13 0.00 0.00 31.00 32.38 1g9r h PRO 228 CO 0.99 0.29 -0.00 1.25 -0.23 0.00 0.00 178.00 180.30 1g9r h LEU 229 N 0.45 0.34 -0.22 1.56 6.46 -1.99 0.12 115.31 122.02 1g9r h LEU 229 Ca 0.26 -0.31 0.04 0.00 -0.12 0.00 0.00 57.88 57.75 1g9r h LEU 229 Cb 0.42 -0.09 -0.04 0.00 -0.73 0.00 0.00 40.66 40.22 1g9r h LEU 229 CO -0.07 0.56 -0.04 0.22 -0.62 0.00 0.00 178.44 178.50 1g9r h TYR 230 N 0.10 -0.08 -0.86 1.25 3.20 -1.71 -1.03 116.97 117.84 1g9r h TYR 230 Ca 0.05 0.02 -0.02 0.00 3.14 0.00 0.00 58.73 61.93 1g9r h TYR 230 Cb 0.39 0.07 -0.04 0.00 1.54 0.00 0.00 36.73 38.69 1g9r h TYR 230 CO 0.03 -0.07 0.47 0.00 -1.64 0.00 0.00 178.16 176.95 1g9r h ARG 231 N 0.03 1.20 -0.51 1.82 3.08 -1.10 -1.00 114.38 117.89 1g9r h ARG 231 Ca 0.11 -0.14 -0.02 0.00 0.07 0.00 0.00 59.98 59.99 1g9r h ARG 231 Cb 0.15 -0.23 -0.02 0.00 0.08 0.00 0.00 29.97 29.95 1g9r h ARG 231 CO -0.21 0.89 0.22 0.22 -1.07 0.00 0.00 179.97 180.02 1g9r h ASP 232 N 1.20 0.69 0.31 7.04 1.82 -0.25 -1.62 116.42 125.61 1g9r h ASP 232 Ca 0.30 -0.15 -0.17 0.00 -0.39 0.00 0.00 57.03 56.62 1g9r h ASP 232 Cb 0.04 -0.18 -0.01 0.00 0.68 0.00 0.00 39.33 39.86 1g9r h ASP 232 CO -0.05 0.65 -0.70 0.03 -1.61 0.00 0.00 179.24 177.56 1g9r h ARG 233 N 0.68 0.34 0.00 0.28 2.47 -0.94 -3.25 114.38 113.96 1g9r h ARG 233 Ca 0.17 -0.27 0.00 0.00 -1.26 0.00 0.00 59.98 58.62 1g9r h ARG 233 Cb 0.16 0.05 0.00 0.00 -1.65 0.00 0.00 29.97 28.53 1g9r h ARG 233 CO -0.02 0.91 -0.43 1.79 0.56 0.00 0.00 179.97 182.78 1g9r h THR 234 N 0.24 0.00 -3.25 2.04 1.35 -1.14 -0.36 112.91 111.78 1g9r h THR 234 Ca -0.02 -0.60 -0.59 0.00 -0.55 0.00 0.00 66.41 64.65 1g9r h THR 234 Cb 1.25 1.33 -0.10 0.00 -1.73 0.00 0.00 68.15 68.91 1g9r h THR 234 CO 0.12 0.00 0.72 0.21 -0.25 0.00 0.00 175.52 176.31 1g9r s ASN 235 N -4.66 6.40 0.22 5.36 2.47 -0.61 -4.76 114.94 119.35 1g9r s ASN 235 Ca 0.07 -0.13 -0.31 0.00 0.42 0.00 0.00 52.86 52.90 1g9r s ASN 235 Cb 0.12 -2.48 -0.11 0.00 -1.45 0.00 0.00 41.25 37.33 1g9r s ASN 235 CO 0.69 -1.30 1.62 -0.89 -3.72 0.00 0.00 177.10 173.50 1g9r s THR 236 N 4.29 2.25 0.09 -5.21 2.01 -1.26 -4.69 115.64 113.11 1g9r s THR 236 Ca 0.36 0.19 0.01 0.00 0.31 0.00 0.00 61.69 62.55 1g9r s THR 236 Cb -0.10 -3.12 0.02 0.00 0.01 0.00 0.00 72.50 69.30 1g9r s THR 236 CO 0.22 0.02 0.12 0.52 -0.69 0.00 0.00 174.62 174.81 1g9r n VAL 237 N 3.39 0.00 -0.78 3.82 0.31 -1.26 -4.94 118.33 118.86 1g9r n VAL 237 Ca 0.13 -0.25 -0.33 0.00 -0.01 0.00 0.00 64.34 63.87 1g9r n VAL 237 Cb 0.37 -1.06 0.13 0.00 -0.91 0.00 0.00 33.84 32.37 1g9r n VAL 237 CO 0.00 0.00 0.00 -0.81 -1.32 0.00 0.00 176.83 174.70 1g9r n PRO 239 N -1.20 -0.64 -1.98 5.55 -0.04 -1.26 -4.73 135.00 130.70 1g9r n PRO 239 Ca 0.02 -0.16 -0.41 0.00 -0.04 0.00 0.00 63.50 62.91 1g9r n PRO 239 Cb 0.08 -1.73 -0.02 0.00 -0.04 0.00 0.00 33.50 31.79 1g9r n PRO 239 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1g9r s VAL 240 N -2.31 2.59 -0.21 0.52 1.01 -1.26 -4.90 120.40 115.85 1g9r s VAL 240 Ca 0.55 0.49 0.12 0.00 0.00 0.00 0.00 61.98 63.14 1g9r s VAL 240 Cb -0.17 -3.31 -0.22 0.00 0.00 0.00 0.00 36.38 32.67 1g9r s VAL 240 CO 0.68 0.07 0.02 0.00 0.00 0.00 0.00 175.10 175.87 1g9r n ALA 241 N 2.52 1.46 -3.74 5.51 0.00 0.16 -4.06 120.51 122.37 1g9r n ALA 241 Ca 0.08 -1.21 -0.23 0.00 0.00 0.00 0.00 53.44 52.08 1g9r n ALA 241 Cb 0.40 -0.21 -0.18 0.00 0.00 0.00 0.00 19.45 19.47 1g9r n ALA 241 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1g9r s VAL 242 N -2.51 0.27 -0.19 0.00 1.01 -0.30 -0.24 120.40 118.44 1g9r s VAL 242 Ca -0.18 0.13 -0.20 0.00 0.00 0.00 0.00 61.98 61.72 1g9r s VAL 242 Cb 0.07 -0.49 -0.03 0.00 0.00 0.00 0.00 36.38 35.93 1g9r s VAL 242 CO 0.76 0.19 0.61 -0.44 0.00 0.00 0.00 175.10 176.21 1g9r s SER 243 N 2.01 6.68 -0.22 3.32 0.01 -0.20 -1.02 113.70 124.28 1g9r s SER 243 Ca 0.04 0.82 0.01 0.00 1.31 0.00 0.00 55.95 58.14 1g9r s SER 243 Cb -0.13 -2.34 0.05 0.00 0.21 0.00 0.00 66.02 63.82 1g9r s SER 243 CO -0.05 -0.23 -0.10 -2.28 0.41 0.00 0.00 173.24 170.98 1g9r s HIS 244 N 1.74 2.68 -0.73 2.43 5.04 -0.23 -0.77 115.29 125.45 1g9r s HIS 244 Ca 0.28 -1.84 -0.06 0.00 -1.54 0.00 0.00 55.06 51.90 1g9r s HIS 244 Cb -0.16 -1.73 -0.03 0.00 0.04 0.00 0.00 32.58 30.70 1g9r s HIS 244 CO 0.11 -0.79 2.93 0.66 -2.34 0.00 0.00 174.74 175.30 1g9r n TYR 245 N 4.60 1.56 -1.72 3.88 4.01 -0.70 -4.23 117.16 124.57 1g9r n TYR 245 Ca -0.14 -2.22 -0.43 0.00 -0.16 0.00 0.00 57.90 54.95 1g9r n TYR 245 Cb 0.45 -1.73 -0.01 0.00 -0.31 0.00 0.00 39.34 37.74 1g9r n TYR 245 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1g9r n GLY 247 N 1.27 1.16 0.28 0.00 0.00 -1.26 -4.73 105.19 101.92 1g9r n GLY 247 Ca 0.06 -2.11 0.10 0.00 0.00 0.00 0.00 46.02 44.07 1g9r n GLY 247 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1g9r h PRO 248 N 0.00 0.05 -6.33 1.61 0.13 -2.00 -3.40 132.00 122.06 1g9r h PRO 248 Ca 0.00 -0.00 -0.54 0.00 -0.87 0.00 0.00 66.00 64.59 1g9r h PRO 248 Cb 0.00 -0.01 -0.08 0.00 0.13 0.00 0.00 31.00 31.04 1g9r h PRO 248 CO 0.00 0.03 1.09 0.00 -0.23 0.00 0.00 178.00 178.89 1g9r s ALA 249 N -5.10 2.70 0.03 -0.56 0.00 -1.26 -5.00 121.76 112.56 1g9r s ALA 249 Ca -0.05 -1.30 -0.01 0.00 0.00 0.00 0.00 51.96 50.60 1g9r s ALA 249 Cb 0.17 -4.26 -0.04 0.00 0.00 0.00 0.00 23.12 18.99 1g9r s ALA 249 CO 0.68 -3.34 0.19 0.15 0.00 0.00 0.00 175.76 173.44 1g9r s LYS 250 N 5.86 3.40 0.61 0.00 -0.14 -1.26 -4.79 119.74 123.41 1g9r s LYS 250 Ca 0.38 -0.40 0.34 0.00 -1.36 0.00 0.00 55.97 54.93 1g9r s LYS 250 Cb -0.08 -3.04 2.01 0.00 -1.68 0.00 0.00 37.83 35.03 1g9r s LYS 250 CO 0.16 0.64 2.29 -1.00 -0.76 0.00 0.00 175.35 176.67 1g9r h PRO 251 N 3.45 0.00 -0.22 -1.68 0.13 -1.93 0.41 132.00 132.16 1g9r h PRO 251 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 1g9r h PRO 251 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 1g9r h PRO 251 CO 0.72 0.00 0.00 -2.67 -0.23 0.00 0.00 178.00 175.82 1g9r n TRP 252 N -3.61 0.29 -2.83 1.56 2.14 -1.26 -4.87 117.44 108.86 1g9r n TRP 252 Ca -0.03 -0.14 -0.21 0.00 2.07 0.00 0.00 57.50 59.18 1g9r n TRP 252 Cb 0.08 0.00 0.08 0.00 -0.81 0.00 0.00 31.31 30.66 1g9r n TRP 252 CO 0.00 0.00 0.00 -1.01 2.07 0.00 0.00 177.69 178.75 1g9r s HIS 253 N -1.71 1.51 0.21 -2.67 3.76 0.13 -4.94 115.29 111.58 1g9r s HIS 253 Ca 0.27 -0.52 -0.18 0.00 -0.15 0.00 0.00 55.06 54.48 1g9r s HIS 253 Cb 0.14 -2.57 -0.08 0.00 1.11 0.00 0.00 32.58 31.19 1g9r s HIS 253 CO 0.21 -1.39 0.68 1.03 -0.85 0.00 0.00 174.74 174.42 1g9r s ARG 254 N -4.87 4.15 -1.29 1.40 0.52 -1.26 -4.28 118.95 113.32 1g9r s ARG 254 Ca 0.64 0.75 -0.08 0.00 -0.52 0.00 0.00 55.73 56.52 1g9r s ARG 254 Cb -0.06 -2.84 -0.00 0.00 0.52 0.00 0.00 34.95 32.57 1g9r s ARG 254 CO 0.41 0.39 0.60 -0.25 0.02 0.00 0.00 175.30 176.47 1g9r n ASP 255 N 0.62 -2.26 -4.55 0.23 8.00 -1.26 -4.91 116.55 112.42 1g9r n ASP 255 Ca -0.02 -0.98 -0.43 0.00 0.71 0.00 0.00 54.79 54.07 1g9r n ASP 255 Cb 0.51 -3.34 -0.04 0.00 -0.02 0.00 0.00 41.12 38.24 1g9r n ASP 255 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1g9r n THR 257 N 6.33 0.21 -2.06 0.00 -2.24 -1.26 -4.91 114.28 110.35 1g9r n THR 257 Ca 0.04 -0.37 -0.41 0.00 -2.27 0.00 0.00 64.05 61.04 1g9r n THR 257 Cb 0.48 0.45 -0.02 0.00 -2.10 0.00 0.00 70.33 69.14 1g9r n THR 257 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1g9r s ALA 258 N -1.79 3.55 0.46 6.98 0.00 -1.26 -4.94 121.76 124.76 1g9r s ALA 258 Ca 0.33 1.30 -0.25 0.00 0.00 0.00 0.00 51.96 53.35 1g9r s ALA 258 Cb 0.18 -3.52 -0.08 0.00 0.00 0.00 0.00 23.12 19.70 1g9r s ALA 258 CO 0.27 -0.71 1.35 1.87 0.00 0.00 0.00 175.76 178.55 1g9r n TRP 259 N 1.46 2.39 -0.89 0.00 -0.00 -1.26 -2.81 117.44 116.32 1g9r n TRP 259 Ca 0.03 0.46 0.00 0.00 -0.00 0.00 0.00 57.50 57.99 1g9r n TRP 259 Cb 0.41 -2.41 0.00 0.00 -0.00 0.00 0.00 31.31 29.31 1g9r n TRP 259 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 1g9r n GLY 260 N 0.71 0.37 0.30 5.87 0.00 -1.26 -4.88 105.19 106.29 1g9r n GLY 260 Ca 0.07 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.17 1g9r n GLY 260 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1g9r h ALA 261 N 0.00 1.97 -0.18 4.61 0.00 -1.87 -2.32 119.26 121.48 1g9r h ALA 261 Ca 0.00 -0.01 0.05 0.00 0.00 0.00 0.00 54.91 54.95 1g9r h ALA 261 Cb 0.27 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 1g9r h ALA 261 CO 0.00 -0.01 0.15 0.93 0.00 0.00 0.00 179.25 180.32 1g9r h GLU 262 N 0.20 0.00 -0.00 0.00 5.08 -1.90 -0.16 114.58 117.80 1g9r h GLU 262 Ca 0.10 0.00 -0.05 0.00 -1.00 0.00 0.00 59.36 58.41 1g9r h GLU 262 Cb 0.15 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.39 1g9r h GLU 262 CO -0.02 0.00 -0.23 -0.09 -1.00 0.00 0.00 179.01 177.67 1g9r h ARG 263 N 0.00 0.00 0.27 2.33 2.43 -1.83 -2.17 114.38 115.42 1g9r h ARG 263 Ca 0.08 -0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.24 1g9r h ARG 263 Cb 0.38 -0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.94 1g9r h ARG 263 CO -0.00 0.23 -0.13 0.35 -1.51 0.00 0.00 179.97 178.91 1g9r h PHE 264 N 0.00 -0.34 -0.84 2.20 3.57 -1.19 -1.33 116.94 119.02 1g9r h PHE 264 Ca -0.00 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.49 1g9r h PHE 264 Cb 0.41 0.11 -0.04 0.00 2.79 0.00 0.00 35.95 39.22 1g9r h PHE 264 CO 0.00 -0.19 0.53 0.00 -2.23 0.00 0.00 178.31 176.41 1g9r h THR 265 N -0.40 1.23 -0.80 4.41 1.03 -1.57 0.89 112.91 117.70 1g9r h THR 265 Ca -0.04 -0.46 -0.02 0.00 -0.01 0.00 0.00 66.41 65.88 1g9r h THR 265 Cb 0.30 0.03 -0.04 0.00 -1.07 0.00 0.00 68.15 67.37 1g9r h THR 265 CO 0.06 0.23 0.42 -0.08 -0.01 0.00 0.00 175.52 176.14 1g9r h GLU 266 N 1.15 1.12 -0.18 0.00 4.81 -1.23 -0.22 114.58 120.03 1g9r h GLU 266 Ca 0.30 -0.14 -0.16 0.00 -0.13 0.00 0.00 59.36 59.24 1g9r h GLU 266 Cb -0.08 -0.22 0.00 0.00 0.63 0.00 0.00 28.75 29.09 1g9r h GLU 266 CO -0.06 0.83 -0.51 -0.07 -0.73 0.00 0.00 179.01 178.47 1g9r h LEU 267 N 1.12 0.77 -1.54 1.64 3.38 -0.63 -2.89 115.31 117.17 1g9r h LEU 267 Ca 0.28 -0.58 -0.03 0.00 0.09 0.00 0.00 57.88 57.64 1g9r h LEU 267 Cb 0.05 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.57 1g9r h LEU 267 CO -0.04 1.21 0.00 0.00 0.09 0.00 0.00 178.44 179.71 1g9r h ALA 268 N 0.57 1.63 0.00 1.53 0.00 -0.55 -1.14 119.26 121.30 1g9r h ALA 268 Ca -0.01 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.77 1g9r h ALA 268 Cb 1.13 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.83 1g9r h ALA 268 CO 0.11 0.28 0.00 0.78 0.00 0.00 0.00 179.25 180.42 1g9r h GLY 269 N 0.58 0.00 -0.62 0.00 0.00 -0.96 -3.05 103.07 99.03 1g9r h GLY 269 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.40 1g9r h GLY 269 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 176.54 175.40 1g9r n SER 270 N -2.77 1.65 -4.75 0.19 3.41 -0.44 -4.96 113.62 105.96 1g9r n SER 270 Ca 0.03 -1.55 -0.42 0.00 -0.26 0.00 0.00 58.87 56.67 1g9r n SER 270 Cb 0.38 -0.01 -0.02 0.00 -0.26 0.00 0.00 64.21 64.31 1g9r n SER 270 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1g9r n LEU 271 N 0.29 4.38 -0.04 1.04 4.77 -1.15 -4.93 117.00 121.35 1g9r n LEU 271 Ca 0.18 1.13 -0.12 0.00 -0.03 0.00 0.00 56.01 57.18 1g9r n LEU 271 Cb 0.38 -1.60 -0.06 0.00 -2.33 0.00 0.00 43.42 39.81 1g9r n LEU 271 CO 0.16 0.19 0.78 0.74 -1.33 0.00 0.00 177.39 177.94 1g9r h THR 272 N 3.43 1.22 -3.34 -5.08 2.02 -1.90 -3.43 112.91 105.82 1g9r h THR 272 Ca -0.46 -0.69 -0.56 0.00 0.77 0.00 0.00 66.41 65.47 1g9r h THR 272 Cb 1.22 1.39 -0.34 0.00 -1.74 0.00 0.00 68.15 68.68 1g9r h THR 272 CO 0.82 0.20 -0.83 -0.89 0.37 0.00 0.00 175.52 175.20 1g9r s THR 273 N -5.20 1.34 -0.30 3.16 2.01 -1.26 -5.07 115.64 110.32 1g9r s THR 273 Ca -0.14 -0.57 0.00 0.00 0.31 0.00 0.00 61.69 61.29 1g9r s THR 273 Cb 0.06 -1.22 0.09 0.00 0.01 0.00 0.00 72.50 71.44 1g9r s THR 273 CO 0.71 0.41 0.07 0.54 -0.69 0.00 0.00 174.62 175.66 1g9r s VAL 274 N 0.81 1.16 0.39 3.82 0.11 -1.26 -4.86 120.40 120.56 1g9r s VAL 274 Ca -0.11 -1.51 -0.27 0.00 -2.93 0.00 0.00 61.98 57.16 1g9r s VAL 274 Cb -0.16 -1.82 -0.11 0.00 -1.53 0.00 0.00 36.38 32.76 1g9r s VAL 274 CO 0.02 -0.59 1.39 -2.65 -3.33 0.00 0.00 175.10 169.93 1g9r n PRO 275 N 4.74 2.33 -0.34 1.54 -0.02 -1.26 -4.86 135.00 137.13 1g9r n PRO 275 Ca -0.02 0.82 0.22 0.00 -2.02 0.00 0.00 63.50 62.50 1g9r n PRO 275 Cb 0.42 -2.53 0.47 0.00 -0.02 0.00 0.00 33.50 31.85 1g9r n PRO 275 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 1g9r h GLU 276 N 2.57 0.42 0.00 -0.52 4.57 -2.02 0.47 114.58 120.07 1g9r h GLU 276 Ca -0.49 -0.03 0.00 0.00 -1.18 0.00 0.00 59.36 57.66 1g9r h GLU 276 Cb 1.27 -0.09 0.00 0.00 -0.16 0.00 0.00 28.75 29.76 1g9r h GLU 276 CO 0.62 0.28 0.00 -1.91 -1.18 0.00 0.00 179.01 176.82 1g9r n GLU 277 N -4.76 0.33 -0.01 1.92 4.07 -1.26 -2.20 120.64 118.73 1g9r n GLU 277 Ca 0.27 0.09 0.10 0.00 -0.06 0.00 0.00 57.16 57.56 1g9r n GLU 277 Cb 0.88 -1.50 -0.15 0.00 -0.06 0.00 0.00 31.44 30.61 1g9r n GLU 277 CO 0.00 0.00 0.00 0.91 -0.06 0.00 0.00 177.13 177.98 1g9r n TRP 278 N -1.22 0.00 -0.25 4.31 7.02 0.16 -4.54 117.44 122.92 1g9r n TRP 278 Ca 0.10 0.00 0.06 0.00 -1.02 0.00 0.00 57.50 56.63 1g9r n TRP 278 Cb 0.12 -0.42 0.18 0.00 -2.42 0.00 0.00 31.31 28.78 1g9r n TRP 278 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 1g9r h ARG 279 N 0.00 0.26 -0.03 -0.99 2.47 -1.27 0.16 114.38 114.99 1g9r h ARG 279 Ca 0.00 -0.02 -0.01 0.00 -1.26 0.00 0.00 59.98 58.70 1g9r h ARG 279 Cb 0.87 -0.06 -0.00 0.00 -1.65 0.00 0.00 29.97 29.13 1g9r h ARG 279 CO 0.00 0.17 -0.01 0.78 0.56 0.00 0.00 179.97 181.47 1g9r h GLY 280 N 0.27 0.06 0.90 0.04 0.00 -1.80 -3.23 103.07 99.31 1g9r h GLY 280 Ca 0.42 -0.06 0.04 0.00 0.00 0.00 0.00 47.33 47.73 1g9r h GLY 280 CO -0.51 0.05 0.64 0.50 0.00 0.00 0.00 176.54 177.22 1g9r h LYS 281 N -0.35 1.19 -0.02 4.80 1.57 -1.65 -3.53 116.57 118.59 1g9r h LYS 281 Ca 0.01 -0.07 0.00 0.00 -1.87 0.00 0.00 60.65 58.71 1g9r h LYS 281 Cb 0.44 -0.27 0.00 0.00 0.08 0.00 0.00 32.23 32.49 1g9r h LYS 281 CO 0.00 0.79 0.00 1.28 -0.57 0.00 0.00 179.45 180.95