#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3g8r n PRO 6 N 0.00 1.78 -4.77 -1.58 -0.02 -1.26 -4.68 135.00 124.47 3g8r n PRO 6 Ca 0.00 0.65 -0.33 0.00 -2.02 0.00 0.00 63.50 61.80 3g8r n PRO 6 Cb 0.00 -2.49 -0.14 0.00 -0.02 0.00 0.00 33.50 30.85 3g8r n PRO 6 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 3g8r s LEU 7 N -2.65 2.78 -0.25 2.45 2.96 0.12 -1.15 118.68 122.93 3g8r s LEU 7 Ca 0.67 -0.28 0.01 0.00 -0.22 0.00 0.00 54.13 54.31 3g8r s LEU 7 Cb -0.45 -1.62 0.04 0.00 0.50 0.00 0.00 46.19 44.67 3g8r s LEU 7 CO 0.53 0.21 -0.10 -0.36 -1.32 0.00 0.00 176.35 175.31 3g8r s PHE 8 N 0.10 3.14 -0.22 5.38 0.08 0.07 -0.18 117.98 126.35 3g8r s PHE 8 Ca -0.05 -1.98 -0.12 0.00 0.12 0.00 0.00 56.93 54.90 3g8r s PHE 8 Cb -0.15 -1.98 -0.05 0.00 -0.57 0.00 0.00 43.02 40.27 3g8r s PHE 8 CO 0.04 -0.82 0.21 0.42 -0.10 0.00 0.00 175.22 174.97 3g8r s ILE 9 N 1.20 5.33 -0.40 0.64 1.01 0.17 -0.61 121.20 128.55 3g8r s ILE 9 Ca -0.04 0.31 -0.14 0.00 0.00 0.00 0.00 60.65 60.77 3g8r s ILE 9 Cb -0.18 -3.55 0.01 0.00 0.01 0.00 0.00 42.46 38.75 3g8r s ILE 9 CO -0.06 0.34 0.29 -0.36 0.00 0.00 0.00 174.94 175.15 3g8r s PHE 10 N 1.01 3.24 0.78 3.97 0.08 0.53 -1.84 117.98 125.75 3g8r s PHE 10 Ca 0.10 -0.53 -0.12 0.00 0.12 0.00 0.00 56.93 56.51 3g8r s PHE 10 Cb -0.13 -2.56 0.06 0.00 -0.57 0.00 0.00 43.02 39.81 3g8r s PHE 10 CO 0.04 -0.55 1.11 -2.00 -0.10 0.00 0.00 175.22 173.73 3g8r s GLU 11 N 1.69 2.21 0.00 0.44 2.56 0.63 -1.32 118.70 124.90 3g8r s GLU 11 Ca 0.05 0.47 0.00 0.00 0.00 0.00 0.00 54.97 55.49 3g8r s GLU 11 Cb -0.19 -1.95 0.00 0.00 2.00 0.00 0.00 34.13 34.00 3g8r s GLU 11 CO 0.10 -1.50 0.00 0.00 -0.56 0.00 0.00 175.26 173.30 3g8r n ALA 13 N -3.32 0.00 -1.14 6.30 0.00 -1.25 -0.78 120.51 120.32 3g8r n ALA 13 Ca 0.07 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.56 3g8r n ALA 13 Cb 0.58 0.00 0.23 0.00 0.00 0.00 0.00 19.45 20.26 3g8r n ALA 13 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3g8r n ASN 14 N 0.00 3.34 0.00 0.00 3.02 -1.26 -4.45 115.26 115.90 3g8r n ASN 14 Ca 0.00 -3.25 0.09 0.00 -0.03 0.00 0.00 54.58 51.39 3g8r n ASN 14 Cb 0.00 -0.56 0.56 0.00 -0.61 0.00 0.00 39.78 39.17 3g8r n ASN 14 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 3g8r n ASN 15 N -0.78 0.00 0.00 6.41 3.02 -1.26 -4.42 115.26 118.22 3g8r n ASN 15 Ca 0.25 -0.61 0.00 0.00 -0.03 0.00 0.00 54.58 54.19 3g8r n ASN 15 Cb 0.92 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 40.09 3g8r n ASN 15 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3g8r n HIS 16 N -0.99 0.00 0.00 3.10 1.44 -1.26 -4.78 115.22 112.73 3g8r n HIS 16 Ca 0.14 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.85 3g8r n HIS 16 Cb 0.07 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.18 3g8r n HIS 16 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 3g8r n GLY 18 N 2.26 0.00 3.47 -1.39 0.00 -1.26 -4.49 105.19 103.79 3g8r n GLY 18 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 3g8r n GLY 18 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3g8r s ASN 19 N -0.92 5.73 0.17 1.61 3.84 -1.26 -4.83 114.94 119.27 3g8r s ASN 19 Ca 0.00 -0.47 -0.15 0.00 0.21 0.00 0.00 52.86 52.46 3g8r s ASN 19 Cb 0.00 -2.05 0.06 0.00 -0.55 0.00 0.00 41.25 38.71 3g8r s ASN 19 CO 0.00 -0.20 1.82 0.58 -2.79 0.00 0.00 177.10 176.51 3g8r h VAL 20 N 5.59 1.08 -0.49 -5.21 2.07 -1.95 -1.65 116.25 115.69 3g8r h VAL 20 Ca -0.32 -0.21 -0.01 0.00 0.82 0.00 0.00 66.70 66.98 3g8r h VAL 20 Cb 1.15 0.43 -0.02 0.00 -1.52 0.00 0.00 31.29 31.32 3g8r h VAL 20 CO 0.62 0.11 0.26 -0.33 0.02 0.00 0.00 177.57 178.24 3g8r h GLU 21 N 0.60 0.68 -0.26 1.57 4.39 -1.95 0.43 114.58 120.05 3g8r h GLU 21 Ca 0.18 -0.07 -0.19 0.00 0.34 0.00 0.00 59.36 59.62 3g8r h GLU 21 Cb -0.02 -0.14 0.00 0.00 -0.10 0.00 0.00 28.75 28.49 3g8r h GLU 21 CO -0.07 0.51 -0.58 1.25 -1.16 0.00 0.00 179.01 178.97 3g8r h HIS 22 N 0.69 1.08 -0.07 4.33 2.76 -1.81 -1.88 115.15 120.25 3g8r h HIS 22 Ca 0.18 -0.40 0.01 0.00 -2.20 0.00 0.00 60.37 57.96 3g8r h HIS 22 Cb 0.04 -0.19 -0.01 0.00 1.55 0.00 0.00 27.41 28.79 3g8r h HIS 22 CO 0.00 1.23 -0.02 0.78 -1.30 0.00 0.00 177.93 178.62 3g8r h GLY 23 N 0.61 0.05 -0.19 5.26 0.00 -0.49 -1.25 103.07 107.06 3g8r h GLY 23 Ca 0.00 0.03 0.11 0.00 0.00 0.00 0.00 47.33 47.47 3g8r h GLY 23 CO 0.13 -0.03 -0.21 -2.08 0.00 0.00 0.00 176.54 174.35 3g8r h VAL 24 N -0.01 0.35 0.00 4.60 2.07 -0.86 -1.11 116.25 121.29 3g8r h VAL 24 Ca 0.04 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.53 3g8r h VAL 24 Cb 0.06 0.35 -0.00 0.00 -1.52 0.00 0.00 31.29 30.17 3g8r h VAL 24 CO -0.08 0.00 -0.12 0.00 0.02 0.00 0.00 177.57 177.39 3g8r h ALA 25 N 1.33 1.38 0.18 1.67 0.00 -0.67 -0.24 119.26 122.90 3g8r h ALA 25 Ca 0.25 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 3g8r h ALA 25 Cb 0.47 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.24 3g8r h ALA 25 CO -0.59 0.16 -0.08 1.25 0.00 0.00 0.00 179.25 179.98 3g8r h LEU 26 N 0.00 -0.20 -0.54 0.00 5.85 -0.12 0.68 115.31 120.98 3g8r h LEU 26 Ca -0.00 -0.33 0.11 0.00 0.84 0.00 0.00 57.88 58.49 3g8r h LEU 26 Cb 0.31 0.05 -0.10 0.00 0.37 0.00 0.00 40.66 41.29 3g8r h LEU 26 CO 0.02 0.31 -0.07 0.40 -0.34 0.00 0.00 178.44 178.75 3g8r h ILE 27 N -0.80 0.50 -0.70 4.05 2.04 -0.71 0.30 117.51 122.19 3g8r h ILE 27 Ca -0.02 -0.02 -0.05 0.00 1.00 0.00 0.00 64.86 65.77 3g8r h ILE 27 Cb 0.52 0.45 -0.03 0.00 -0.74 0.00 0.00 36.82 37.02 3g8r h ILE 27 CO 0.04 0.01 0.26 0.03 0.00 0.00 0.00 178.15 178.49 3g8r h ARG 28 N 0.05 1.06 -0.09 2.37 3.08 -1.03 0.16 114.38 119.97 3g8r h ARG 28 Ca 0.27 -0.20 -0.06 0.00 0.07 0.00 0.00 59.98 60.06 3g8r h ARG 28 Cb 0.42 -0.17 -0.01 0.00 0.08 0.00 0.00 29.97 30.30 3g8r h ARG 28 CO -0.52 0.89 -0.21 0.00 -1.07 0.00 0.00 179.97 179.06 3g8r h ALA 29 N 1.12 1.47 0.07 0.04 0.00 0.24 -2.93 119.26 119.27 3g8r h ALA 29 Ca 0.23 -0.24 -0.25 0.00 0.00 0.00 0.00 54.91 54.64 3g8r h ALA 29 Cb 0.24 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 3g8r h ALA 29 CO -0.01 0.38 -1.21 0.82 0.00 0.00 0.00 179.25 179.22 3g8r h ILE 30 N 0.14 1.50 -0.30 0.00 1.08 0.44 -3.03 117.51 117.35 3g8r h ILE 30 Ca 0.03 -3.15 0.06 0.00 -0.39 0.00 0.00 64.86 61.40 3g8r h ILE 30 Cb 0.46 2.85 -0.06 0.00 -3.07 0.00 0.00 36.82 37.00 3g8r h ILE 30 CO 0.03 0.89 -0.10 -0.09 -0.69 0.00 0.00 178.15 178.19 3g8r h ARG 31 N 0.04 -0.04 -0.55 2.37 2.43 -0.83 -1.53 114.38 116.27 3g8r h ARG 31 Ca -0.11 0.00 0.11 0.00 -0.81 0.00 0.00 59.98 59.17 3g8r h ARG 31 Cb 1.90 0.01 -0.11 0.00 -0.42 0.00 0.00 29.97 31.35 3g8r h ARG 31 CO 0.16 -0.03 -0.24 0.93 -1.51 0.00 0.00 179.97 179.29 3g8r h GLU 32 N -0.04 -0.10 -0.45 0.20 5.08 -1.53 -0.91 114.58 116.82 3g8r h GLU 32 Ca 0.15 0.01 0.13 0.00 -1.00 0.00 0.00 59.36 58.65 3g8r h GLU 32 Cb 0.27 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.52 3g8r h GLU 32 CO -0.33 -0.07 0.49 0.77 -1.00 0.00 0.00 179.01 178.87 3g8r h SER 33 N -0.10 0.00 0.45 1.42 0.02 -1.16 -1.19 113.55 112.99 3g8r h SER 33 Ca 0.25 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.20 3g8r h SER 33 Cb 0.50 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.04 3g8r h SER 33 CO -0.62 0.00 -0.23 0.00 -1.14 0.00 0.00 176.83 174.84 3g8r n GLN 35 N -1.09 2.73 0.00 0.00 -0.06 -0.45 -2.97 117.38 115.53 3g8r n GLN 35 Ca 0.11 0.99 0.00 0.00 -2.00 0.00 0.00 57.00 56.10 3g8r n GLN 35 Cb 0.32 -2.85 0.00 0.00 -4.06 0.00 0.00 30.24 23.65 3g8r n GLN 35 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 3g8r n GLY 36 N 4.05 1.08 3.86 1.69 0.00 -1.26 -5.06 105.19 109.54 3g8r n GLY 36 Ca 0.17 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.82 3g8r n GLY 36 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3g8r s PHE 37 N -2.26 3.58 -1.05 1.61 0.40 -1.16 -4.99 117.98 114.11 3g8r s PHE 37 Ca 0.00 0.52 -0.03 0.00 -0.60 0.00 0.00 56.93 56.82 3g8r s PHE 37 Cb 0.00 -1.98 0.25 0.00 0.51 0.00 0.00 43.02 41.80 3g8r s PHE 37 CO 0.00 0.68 2.09 -3.47 0.70 0.00 0.00 175.22 175.22 3g8r n ASP 38 N 2.18 7.53 -4.72 1.36 4.64 -1.26 -4.91 116.55 121.38 3g8r n ASP 38 Ca -0.19 -3.51 -0.26 0.00 -1.38 0.00 0.00 54.79 49.45 3g8r n ASP 38 Cb 0.55 -1.22 -0.08 0.00 -1.04 0.00 0.00 41.12 39.33 3g8r n ASP 38 CO 0.00 0.00 0.00 -0.36 -0.82 0.00 0.00 177.20 176.02 3g8r s PHE 39 N -3.18 2.50 0.26 -0.67 0.08 -1.26 -4.82 117.98 110.90 3g8r s PHE 39 Ca 0.47 -0.64 -0.16 0.00 0.12 0.00 0.00 56.93 56.71 3g8r s PHE 39 Cb 0.23 -1.89 -0.08 0.00 -0.57 0.00 0.00 43.02 40.71 3g8r s PHE 39 CO -0.16 0.23 0.71 -0.51 -0.10 0.00 0.00 175.22 175.38 3g8r s ASP 40 N -3.87 6.88 0.01 1.36 1.01 -0.30 -5.02 116.67 116.74 3g8r s ASP 40 Ca 0.37 1.30 0.04 0.00 0.71 0.00 0.00 52.55 54.97 3g8r s ASP 40 Cb 0.05 -2.38 -0.01 0.00 1.01 0.00 0.00 42.92 41.59 3g8r s ASP 40 CO 0.20 -0.08 -0.12 -0.36 0.21 0.00 0.00 175.17 175.02 3g8r s PHE 41 N -1.75 1.06 0.06 4.23 0.08 -1.26 -0.75 117.98 119.65 3g8r s PHE 41 Ca 0.48 -0.27 0.04 0.00 0.12 0.00 0.00 56.93 57.29 3g8r s PHE 41 Cb -0.13 -0.66 -0.03 0.00 -0.57 0.00 0.00 43.02 41.63 3g8r s PHE 41 CO 0.19 0.00 -0.11 0.20 -0.10 0.00 0.00 175.22 175.41 3g8r s GLY 42 N -0.70 0.69 -0.03 4.36 0.00 0.22 -0.96 107.32 110.91 3g8r s GLY 42 Ca 0.02 -0.92 0.07 0.00 0.00 0.00 0.00 44.72 43.89 3g8r s GLY 42 CO 0.00 -0.96 -0.22 -0.12 0.00 0.00 0.00 173.10 171.80 3g8r s PHE 43 N -1.49 2.45 -0.04 1.90 5.36 -0.60 -0.34 117.98 125.22 3g8r s PHE 43 Ca -0.05 -0.35 0.05 0.00 -0.96 0.00 0.00 56.93 55.62 3g8r s PHE 43 Cb -0.09 -1.54 -0.01 0.00 -0.34 0.00 0.00 43.02 41.05 3g8r s PHE 43 CO 0.01 0.04 -0.19 0.21 -1.46 0.00 0.00 175.22 173.83 3g8r s LYS 44 N -0.68 1.95 0.51 10.12 2.20 -0.43 -1.38 119.74 132.03 3g8r s LYS 44 Ca 0.11 -0.69 0.07 0.00 -0.36 0.00 0.00 55.97 55.09 3g8r s LYS 44 Cb -0.10 -1.70 0.03 0.00 -1.51 0.00 0.00 37.83 34.55 3g8r s LYS 44 CO -0.00 0.30 0.48 -0.51 -0.36 0.00 0.00 175.35 175.26 3g8r s LEU 45 N -0.07 3.01 -0.17 5.43 1.43 -0.46 -3.95 118.68 123.91 3g8r s LEU 45 Ca -0.02 -1.00 -0.00 0.00 -1.03 0.00 0.00 54.13 52.08 3g8r s LEU 45 Cb -0.12 -1.57 0.04 0.00 0.03 0.00 0.00 46.19 44.57 3g8r s LEU 45 CO 0.02 -1.01 -0.06 -1.10 0.23 0.00 0.00 176.35 174.43 3g8r s GLN 46 N -4.32 1.49 -0.22 1.70 -0.21 -1.26 -1.46 119.66 115.38 3g8r s GLN 46 Ca 0.45 -0.56 -0.07 0.00 0.02 0.00 0.00 55.36 55.20 3g8r s GLN 46 Cb -0.03 -2.06 -0.03 0.00 1.00 0.00 0.00 33.01 31.88 3g8r s GLN 46 CO 0.27 -0.44 0.06 0.71 -2.12 0.00 0.00 175.29 173.77 3g8r s TYR 47 N 1.61 3.12 -0.04 0.91 1.51 0.76 -4.96 117.35 120.25 3g8r s TYR 47 Ca 0.00 -0.27 -0.02 0.00 -1.01 0.00 0.00 57.07 55.78 3g8r s TYR 47 Cb -0.15 -2.16 0.03 0.00 -0.11 0.00 0.00 41.96 39.57 3g8r s TYR 47 CO -0.08 -0.18 0.07 1.03 -1.11 0.00 0.00 175.55 175.28 3g8r s ARG 48 N 1.13 -0.04 -1.10 -0.62 0.52 -1.26 -1.46 118.95 116.13 3g8r s ARG 48 Ca 0.04 0.34 -0.22 0.00 -0.52 0.00 0.00 55.73 55.37 3g8r s ARG 48 Cb -0.14 -0.37 0.00 0.00 0.52 0.00 0.00 34.95 34.96 3g8r s ARG 48 CO 0.03 -0.26 1.75 1.21 0.02 0.00 0.00 175.30 178.05 3g8r s ASN 49 N 1.75 5.95 0.34 0.23 3.04 -1.26 -4.87 114.94 120.12 3g8r s ASN 49 Ca -0.01 -1.57 0.03 0.00 0.04 0.00 0.00 52.86 51.35 3g8r s ASN 49 Cb -0.12 -2.57 0.64 0.00 -1.54 0.00 0.00 41.25 37.66 3g8r s ASN 49 CO -0.04 -2.06 1.98 -0.07 -3.04 0.00 0.00 177.10 173.88 3g8r h LEU 50 N 15.02 0.74 -1.48 3.21 -0.00 -1.97 0.20 115.31 131.03 3g8r h LEU 50 Ca 0.24 -0.01 0.29 0.00 -0.00 0.00 0.00 57.88 58.40 3g8r h LEU 50 Cb 0.96 -0.17 -0.09 0.00 -0.00 0.00 0.00 40.66 41.36 3g8r h LEU 50 CO 1.34 0.52 0.71 0.44 -0.00 0.00 0.00 178.44 181.44 3g8r h ASP 51 N 0.87 0.35 0.00 -0.43 3.45 -1.89 -1.36 116.42 117.40 3g8r h ASP 51 Ca 0.28 0.07 -0.19 0.00 0.43 0.00 0.00 57.03 57.63 3g8r h ASP 51 Cb 0.05 0.02 -0.04 0.00 -0.56 0.00 0.00 39.33 38.80 3g8r h ASP 51 CO -0.08 0.05 -1.87 0.41 -1.57 0.00 0.00 179.24 176.18 3g8r n THR 52 N -4.55 0.70 0.06 0.35 -1.04 -0.71 -4.64 114.28 104.45 3g8r n THR 52 Ca 0.26 -0.52 -0.16 0.00 -2.04 0.00 0.00 64.05 61.59 3g8r n THR 52 Cb 0.97 -0.43 -0.14 0.00 -1.82 0.00 0.00 70.33 68.91 3g8r n THR 52 CO 0.00 0.00 0.00 0.15 -0.64 0.00 0.00 175.07 174.58 3g8r h PHE 53 N 0.00 0.44 -3.54 -1.42 3.04 0.45 -3.40 116.94 112.51 3g8r h PHE 53 Ca -0.28 -0.32 -0.62 0.00 3.98 0.00 0.00 57.97 60.74 3g8r h PHE 53 Cb 1.54 -0.02 -0.12 0.00 2.56 0.00 0.00 35.95 39.91 3g8r h PHE 53 CO 0.00 1.36 0.10 0.42 -2.02 0.00 0.00 178.31 178.17 3g8r s ILE 54 N -2.62 4.98 0.35 1.41 1.01 -0.84 -5.02 121.20 120.46 3g8r s ILE 54 Ca -0.08 0.86 -0.28 0.00 0.00 0.00 0.00 60.65 61.15 3g8r s ILE 54 Cb 0.07 -3.95 -0.09 0.00 0.01 0.00 0.00 42.46 38.50 3g8r s ILE 54 CO 0.85 -0.07 1.22 -2.28 0.00 0.00 0.00 174.94 174.66 3g8r s HIS 55 N 2.51 3.15 0.24 3.97 2.46 -1.26 -4.78 115.29 121.58 3g8r s HIS 55 Ca 0.24 1.52 -0.15 0.00 0.47 0.00 0.00 55.06 57.15 3g8r s HIS 55 Cb -0.15 -3.50 0.30 0.00 -0.13 0.00 0.00 32.58 29.09 3g8r s HIS 55 CO 0.11 -1.42 1.56 0.77 -2.47 0.00 0.00 174.74 173.29 3g8r h SER 56 N 3.18 -1.18 -1.48 9.88 0.02 -1.93 0.97 113.55 123.01 3g8r h SER 56 Ca -0.48 0.29 0.43 0.00 -0.84 0.00 0.00 61.79 61.18 3g8r h SER 56 Cb 1.23 0.67 -0.06 0.00 0.14 0.00 0.00 62.40 64.37 3g8r h SER 56 CO 0.65 -0.30 1.31 0.77 -1.14 0.00 0.00 176.83 178.12 3g8r h SER 57 N -0.02 0.00 -0.00 3.07 4.64 -2.03 0.24 113.55 119.44 3g8r h SER 57 Ca 0.37 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.69 3g8r h SER 57 Cb 0.63 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.72 3g8r h SER 57 CO -0.94 0.00 -0.21 0.49 -0.87 0.00 0.00 176.83 175.30 3g8r n PHE 58 N -3.58 0.00 -1.75 4.77 3.72 0.33 -5.02 117.46 115.93 3g8r n PHE 58 Ca 0.33 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 57.32 3g8r n PHE 58 Cb 1.76 0.00 -0.01 0.00 -0.94 0.00 0.00 39.48 40.28 3g8r n PHE 58 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 3g8r n LYS 59 N -0.55 2.70 -0.73 -1.08 5.02 0.83 -2.24 118.16 122.11 3g8r n LYS 59 Ca 0.03 0.96 0.00 0.00 -2.02 0.00 0.00 58.31 57.27 3g8r n LYS 59 Cb 0.15 -2.73 0.00 0.00 -0.02 0.00 0.00 35.03 32.43 3g8r n LYS 59 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3g8r n GLY 60 N 1.74 0.68 3.72 0.72 0.00 -1.26 -5.03 105.19 105.76 3g8r n GLY 60 Ca 0.07 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.78 3g8r n GLY 60 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3g8r s ARG 61 N -0.27 2.76 -0.29 1.61 0.52 -0.95 -5.00 118.95 117.34 3g8r s ARG 61 Ca 0.00 -0.70 0.17 0.00 -0.52 0.00 0.00 55.73 54.69 3g8r s ARG 61 Cb 0.00 -2.66 0.49 0.00 0.52 0.00 0.00 34.95 33.29 3g8r s ARG 61 CO 0.00 0.58 1.11 -3.47 0.02 0.00 0.00 175.30 173.54 3g8r n ASP 62 N 0.82 2.55 -0.04 0.23 2.03 -1.26 -3.75 116.55 117.13 3g8r n ASP 62 Ca -0.11 -2.63 0.03 0.00 0.52 0.00 0.00 54.79 52.59 3g8r n ASP 62 Cb 0.52 -0.45 -0.15 0.00 -0.72 0.00 0.00 41.12 40.32 3g8r n ASP 62 CO 0.00 0.00 0.00 -0.67 -1.92 0.00 0.00 177.20 174.61 3g8r n ASP 63 N -0.54 0.56 -3.88 1.67 2.03 -1.26 -4.92 116.55 110.20 3g8r n ASP 63 Ca 0.18 0.00 -0.09 0.00 0.52 0.00 0.00 54.79 55.40 3g8r n ASP 63 Cb 0.84 1.52 -0.08 0.00 -0.72 0.00 0.00 41.12 42.68 3g8r n ASP 63 CO 0.00 0.00 0.00 0.68 -1.92 0.00 0.00 177.20 175.96 3g8r s VAL 64 N -3.00 0.14 0.83 5.18 -7.23 -1.26 -5.15 120.40 109.91 3g8r s VAL 64 Ca -0.08 -1.13 -0.12 0.00 -1.81 0.00 0.00 61.98 58.84 3g8r s VAL 64 Cb 0.10 -1.18 0.09 0.00 0.56 0.00 0.00 36.38 35.96 3g8r s VAL 64 CO 0.78 -0.62 1.17 -0.75 -0.31 0.00 0.00 175.10 175.37 3g8r s LYS 65 N -3.34 1.58 0.00 4.82 2.20 -1.26 -4.06 119.74 119.68 3g8r s LYS 65 Ca 0.01 1.60 0.00 0.00 -0.36 0.00 0.00 55.97 57.22 3g8r s LYS 65 Cb 0.03 -1.78 0.00 0.00 -1.51 0.00 0.00 37.83 34.56 3g8r s LYS 65 CO -0.08 -2.23 0.00 0.66 -0.36 0.00 0.00 175.35 173.34 3g8r n TYR 66 N -3.56 0.00 -0.03 4.03 4.01 -1.26 -4.78 117.16 115.56 3g8r n TYR 66 Ca 0.12 0.00 -0.11 0.00 -0.16 0.00 0.00 57.90 57.76 3g8r n TYR 66 Cb 0.51 0.00 -0.04 0.00 -0.31 0.00 0.00 39.34 39.50 3g8r n TYR 66 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 3g8r h VAL 67 N 0.00 0.21 0.26 -0.72 2.07 -1.84 0.15 116.25 116.37 3g8r h VAL 67 Ca 0.00 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.53 3g8r h VAL 67 Cb 0.00 0.21 -0.04 0.00 -1.52 0.00 0.00 31.29 29.94 3g8r h VAL 67 CO 0.00 0.00 -0.47 0.50 0.02 0.00 0.00 177.57 177.62 3g8r h LYS 68 N -0.40 -0.76 -0.68 1.57 3.64 -1.85 0.10 116.57 118.19 3g8r h LYS 68 Ca 0.11 0.05 0.12 0.00 -1.27 0.00 0.00 60.65 59.66 3g8r h LYS 68 Cb 0.58 0.17 -0.08 0.00 -0.41 0.00 0.00 32.23 32.49 3g8r h LYS 68 CO -0.43 -0.51 0.26 -0.09 -2.27 0.00 0.00 179.45 176.41 3g8r h ARG 69 N -0.79 0.41 0.63 1.90 9.65 -1.83 0.29 114.38 124.65 3g8r h ARG 69 Ca -0.01 -0.02 -0.02 0.00 -1.10 0.00 0.00 59.98 58.82 3g8r h ARG 69 Cb 0.76 -0.09 -0.01 0.00 -1.39 0.00 0.00 29.97 29.23 3g8r h ARG 69 CO -0.19 0.27 -0.48 0.74 2.80 0.00 0.00 179.97 183.11 3g8r h PHE 70 N 0.42 -1.31 -0.31 2.20 0.05 -0.49 -1.62 116.94 115.87 3g8r h PHE 70 Ca 0.36 -0.00 0.06 0.00 3.82 0.00 0.00 57.97 62.20 3g8r h PHE 70 Cb 0.50 0.49 -0.05 0.00 2.00 0.00 0.00 35.95 38.89 3g8r h PHE 70 CO -0.17 -0.69 -0.01 0.93 -0.18 0.00 0.00 178.31 178.19 3g8r h GLU 71 N -1.08 0.07 -0.78 1.51 5.08 0.13 -1.83 114.58 117.68 3g8r h GLU 71 Ca -0.08 -0.00 0.17 0.00 -1.00 0.00 0.00 59.36 58.44 3g8r h GLU 71 Cb 0.90 -0.02 -0.05 0.00 0.50 0.00 0.00 28.75 30.08 3g8r h GLU 71 CO 0.02 0.05 0.52 0.93 -1.00 0.00 0.00 179.01 179.53 3g8r h GLU 72 N 0.07 0.34 -0.67 2.33 5.08 -0.48 -2.39 114.58 118.86 3g8r h GLU 72 Ca 0.15 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.49 3g8r h GLU 72 Cb 0.20 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.38 3g8r h GLU 72 CO -0.26 0.22 0.00 0.25 -1.00 0.00 0.00 179.01 178.22 3g8r n THR 73 N -4.46 1.02 -1.60 1.13 -2.24 -0.62 -4.71 114.28 102.79 3g8r n THR 73 Ca 0.15 -1.01 -0.56 0.00 -2.27 0.00 0.00 64.05 60.37 3g8r n THR 73 Cb 0.60 0.49 -0.07 0.00 -2.10 0.00 0.00 70.33 69.25 3g8r n THR 73 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 3g8r n ARG 74 N 1.46 0.75 -5.18 -0.78 0.63 -0.90 -4.01 116.66 108.63 3g8r n ARG 74 Ca 0.23 0.27 -0.30 0.00 -0.92 0.00 0.00 57.85 57.13 3g8r n ARG 74 Cb 0.60 -1.87 -0.16 0.00 0.45 0.00 0.00 32.46 31.48 3g8r n ARG 74 CO 0.00 0.00 0.00 -0.51 -2.51 0.00 0.00 177.63 174.61 3g8r s LEU 75 N 1.04 2.06 0.60 6.15 1.43 -1.26 -4.86 118.68 123.84 3g8r s LEU 75 Ca 0.90 -0.45 -0.10 0.00 -1.03 0.00 0.00 54.13 53.45 3g8r s LEU 75 Cb -1.10 -1.24 -0.04 0.00 0.03 0.00 0.00 46.19 43.84 3g8r s LEU 75 CO 0.55 0.29 0.99 -1.10 0.23 0.00 0.00 176.35 177.32 3g8r s GLN 76 N -0.62 3.57 0.24 1.70 -1.52 -1.26 -4.93 119.66 116.83 3g8r s GLN 76 Ca 0.09 0.65 -0.05 0.00 -1.95 0.00 0.00 55.36 54.10 3g8r s GLN 76 Cb -0.09 -2.13 0.41 0.00 -0.22 0.00 0.00 33.01 30.98 3g8r s GLN 76 CO -0.01 -0.52 1.74 -1.35 -0.25 0.00 0.00 175.29 174.90 3g8r h PRO 77 N -0.24 0.45 -0.06 2.91 0.11 -2.01 -0.23 132.00 132.94 3g8r h PRO 77 Ca -0.45 -0.03 0.02 0.00 0.11 0.00 0.00 66.00 65.66 3g8r h PRO 77 Cb 1.19 -0.10 -0.00 0.00 0.11 0.00 0.00 31.00 32.20 3g8r h PRO 77 CO 0.62 0.30 0.06 1.49 -0.21 0.00 0.00 178.00 180.26 3g8r h GLU 78 N 0.47 0.00 -0.98 1.05 4.81 -2.06 0.58 114.58 118.46 3g8r h GLU 78 Ca 0.39 0.00 -0.16 0.00 -0.13 0.00 0.00 59.36 59.46 3g8r h GLU 78 Cb 0.55 0.00 -0.10 0.00 0.63 0.00 0.00 28.75 29.83 3g8r h GLU 78 CO -0.37 0.00 0.20 1.04 -0.73 0.00 0.00 179.01 179.16 3g8r n GLN 79 N -4.04 1.59 0.00 1.92 6.02 -0.10 -2.11 117.38 120.66 3g8r n GLN 79 Ca -0.01 -1.09 0.00 0.00 -0.01 0.00 0.00 57.00 55.88 3g8r n GLN 79 Cb 0.16 -1.48 0.00 0.00 1.02 0.00 0.00 30.24 29.94 3g8r n GLN 79 CO 0.00 0.00 0.00 0.94 -1.01 0.00 0.00 177.06 176.99 3g8r n GLN 81 N -0.05 0.00 -0.19 -1.09 -0.06 0.20 -2.34 117.38 113.85 3g8r n GLN 81 Ca 0.20 0.00 -0.05 0.00 -2.00 0.00 0.00 57.00 55.15 3g8r n GLN 81 Cb 0.88 0.00 0.05 0.00 -4.06 0.00 0.00 30.24 27.11 3g8r n GLN 81 CO 0.00 0.00 0.00 -0.22 -0.20 0.00 0.00 177.06 176.64 3g8r h LYS 82 N 0.00 0.62 -0.00 3.69 3.64 -1.66 -1.86 116.57 120.99 3g8r h LYS 82 Ca 0.00 -0.04 -0.00 0.00 -1.27 0.00 0.00 60.65 59.34 3g8r h LYS 82 Cb 0.00 -0.14 -0.00 0.00 -0.41 0.00 0.00 32.23 31.68 3g8r h LYS 82 CO 0.00 0.41 0.00 -0.07 -2.27 0.00 0.00 179.45 177.52 3g8r h LEU 83 N 0.64 0.00 -0.40 5.20 3.38 -1.77 0.26 115.31 122.61 3g8r h LEU 83 Ca 0.23 -0.05 0.08 0.00 0.09 0.00 0.00 57.88 58.23 3g8r h LEU 83 Cb 0.06 -0.00 -0.08 0.00 0.09 0.00 0.00 40.66 40.73 3g8r h LEU 83 CO -0.12 0.06 -0.16 0.58 0.09 0.00 0.00 178.44 178.89 3g8r h VAL 84 N -0.05 0.49 -0.68 1.22 2.07 -1.83 0.90 116.25 118.37 3g8r h VAL 84 Ca 0.00 0.00 0.15 0.00 0.82 0.00 0.00 66.70 67.67 3g8r h VAL 84 Cb 0.05 0.49 -0.11 0.00 -1.52 0.00 0.00 31.29 30.20 3g8r h VAL 84 CO -0.00 0.00 0.07 0.00 0.02 0.00 0.00 177.57 177.66 3g8r h ALA 85 N 1.26 0.76 0.00 1.67 0.00 -1.10 -0.77 119.26 121.08 3g8r h ALA 85 Ca 0.20 0.19 0.00 0.00 0.00 0.00 0.00 54.91 55.30 3g8r h ALA 85 Cb 0.38 0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.47 3g8r h ALA 85 CO -0.45 -0.38 0.00 0.39 0.00 0.00 0.00 179.25 178.81 3g8r n GLU 86 N -5.24 0.23 0.00 0.00 -0.58 0.31 -2.00 120.64 113.36 3g8r n GLU 86 Ca 0.12 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.86 3g8r n GLU 86 Cb 0.41 -1.36 0.00 0.00 -0.57 0.00 0.00 31.44 29.92 3g8r n GLU 86 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 3g8r n LYS 88 N 0.84 0.00 0.08 3.49 5.02 -0.30 -2.51 118.16 124.79 3g8r n LYS 88 Ca 0.00 0.00 -0.02 0.00 -2.02 0.00 0.00 58.31 56.27 3g8r n LYS 88 Cb 0.11 0.00 0.25 0.00 -0.02 0.00 0.00 35.03 35.37 3g8r n LYS 88 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3g8r h ALA 89 N 0.00 1.17 -0.09 7.82 0.00 -1.66 0.21 119.26 126.71 3g8r h ALA 89 Ca 0.00 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.55 3g8r h ALA 89 Cb 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.69 3g8r h ALA 89 CO 0.00 0.54 0.00 0.09 0.00 0.00 0.00 179.25 179.88 3g8r n ASN 90 N -4.09 0.82 -2.87 0.00 3.02 -1.04 -4.89 115.26 106.20 3g8r n ASN 90 Ca -0.01 -2.03 -0.20 0.00 -0.03 0.00 0.00 54.58 52.31 3g8r n ASN 90 Cb 0.43 -0.18 0.05 0.00 -0.61 0.00 0.00 39.78 39.46 3g8r n ASN 90 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3g8r n GLY 91 N 0.51 -0.36 3.88 7.41 0.00 0.75 -5.01 105.19 112.37 3g8r n GLY 91 Ca 0.03 0.06 -0.32 0.00 0.00 0.00 0.00 46.02 45.80 3g8r n GLY 91 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3g8r s PHE 92 N -3.17 3.44 0.39 1.61 0.08 -1.25 -4.85 117.98 114.23 3g8r s PHE 92 Ca 0.36 0.76 -0.26 0.00 0.12 0.00 0.00 56.93 57.92 3g8r s PHE 92 Cb -0.16 -2.17 -0.09 0.00 -0.57 0.00 0.00 43.02 40.03 3g8r s PHE 92 CO 0.45 0.32 1.20 0.15 -0.10 0.00 0.00 175.22 177.24 3g8r s LYS 93 N -2.78 4.07 -0.24 0.44 1.02 -0.14 -4.10 119.74 118.00 3g8r s LYS 93 Ca 0.45 1.92 -0.14 0.00 0.02 0.00 0.00 55.97 58.22 3g8r s LYS 93 Cb -0.11 -2.73 -0.04 0.00 -0.52 0.00 0.00 37.83 34.43 3g8r s LYS 93 CO 0.22 -0.33 0.33 0.00 -0.92 0.00 0.00 175.35 174.65 3g8r s ALA 94 N -1.36 3.57 0.07 5.17 0.00 -1.26 -1.55 121.76 126.40 3g8r s ALA 94 Ca 0.56 -0.76 0.06 0.00 0.00 0.00 0.00 51.96 51.82 3g8r s ALA 94 Cb -0.33 -2.60 -0.03 0.00 0.00 0.00 0.00 23.12 20.17 3g8r s ALA 94 CO 0.41 -0.45 -0.16 0.42 0.00 0.00 0.00 175.76 175.98 3g8r s ILE 95 N 1.62 1.32 -0.01 0.00 1.01 -0.48 -0.61 121.20 124.05 3g8r s ILE 95 Ca 0.14 -1.29 -0.13 0.00 0.00 0.00 0.00 60.65 59.37 3g8r s ILE 95 Cb -0.15 -1.22 0.02 0.00 0.01 0.00 0.00 42.46 41.12 3g8r s ILE 95 CO 0.08 -0.09 0.27 0.00 0.00 0.00 0.00 174.94 175.20 3g8r s THR 97 N -1.40 4.94 0.25 0.00 2.01 -0.54 0.59 115.64 121.50 3g8r s THR 97 Ca -0.13 -0.60 -0.18 0.00 0.31 0.00 0.00 61.69 61.09 3g8r s THR 97 Cb -0.06 -3.68 -0.08 0.00 0.01 0.00 0.00 72.50 68.70 3g8r s THR 97 CO 0.03 -0.17 0.71 -2.16 -0.69 0.00 0.00 174.62 172.35 3g8r s PRO 98 N 1.64 4.15 0.00 4.92 0.04 -1.26 -0.17 135.00 144.32 3g8r s PRO 98 Ca 0.04 0.78 0.06 0.00 0.04 0.00 0.00 61.00 61.91 3g8r s PRO 98 Cb -0.18 -2.75 -0.02 0.00 0.04 0.00 0.00 34.50 31.58 3g8r s PRO 98 CO 0.08 0.33 0.39 1.19 0.04 0.00 0.00 177.00 179.04 3g8r n PHE 99 N 0.40 0.00 -4.25 0.56 3.72 -0.53 -4.82 117.46 112.54 3g8r n PHE 99 Ca -0.01 0.00 -0.18 0.00 -0.05 0.00 0.00 57.45 57.22 3g8r n PHE 99 Cb 0.52 0.00 -0.08 0.00 -0.94 0.00 0.00 39.48 38.97 3g8r n PHE 99 CO 0.00 0.00 0.00 0.16 -0.05 0.00 0.00 176.76 176.87 3g8r s ASP 100 N -1.17 1.32 0.26 4.37 1.47 -1.26 -5.02 116.67 116.63 3g8r s ASP 100 Ca 0.04 -1.67 0.14 0.00 1.18 0.00 0.00 52.55 52.24 3g8r s ASP 100 Cb 0.04 0.53 0.06 0.00 -0.34 0.00 0.00 42.92 43.21 3g8r s ASP 100 CO 0.17 -1.03 1.43 1.05 0.68 0.00 0.00 175.17 177.48 3g8r h GLU 101 N 2.24 0.00 0.00 2.11 9.09 -1.94 -2.85 114.58 123.23 3g8r h GLU 101 Ca -0.27 0.00 -0.05 0.00 0.05 0.00 0.00 59.36 59.09 3g8r h GLU 101 Cb 1.24 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 28.33 3g8r h GLU 101 CO 0.40 0.58 -0.22 1.49 0.05 0.00 0.00 179.01 181.31 3g8r h GLU 102 N 0.00 0.00 -0.03 1.06 4.81 -1.99 -2.33 114.58 116.10 3g8r h GLU 102 Ca -0.01 0.00 -0.13 0.00 -0.13 0.00 0.00 59.36 59.10 3g8r h GLU 102 Cb 1.42 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.79 3g8r h GLU 102 CO 0.08 0.22 -0.58 0.77 -0.73 0.00 0.00 179.01 178.76 3g8r h SER 103 N 0.00 0.09 -0.33 1.04 0.02 -1.83 -2.40 113.55 110.14 3g8r h SER 103 Ca -0.00 -0.05 -0.06 0.00 -0.84 0.00 0.00 61.79 60.84 3g8r h SER 103 Cb 0.44 -0.03 -0.01 0.00 0.14 0.00 0.00 62.40 62.94 3g8r h SER 103 CO 0.03 0.65 -0.01 0.58 -1.14 0.00 0.00 176.83 176.94 3g8r h VAL 104 N 0.06 1.26 -0.99 2.27 2.07 -1.44 0.45 116.25 119.93 3g8r h VAL 104 Ca -0.00 -0.98 0.20 0.00 0.82 0.00 0.00 66.70 66.73 3g8r h VAL 104 Cb 1.04 1.25 -0.11 0.00 -1.52 0.00 0.00 31.29 31.95 3g8r h VAL 104 CO 0.08 0.32 0.59 0.44 0.02 0.00 0.00 177.57 179.02 3g8r h ASP 105 N 0.39 0.73 0.25 0.57 3.45 -1.32 0.03 116.42 120.52 3g8r h ASP 105 Ca 0.09 0.11 -0.24 0.00 0.43 0.00 0.00 57.03 57.42 3g8r h ASP 105 Cb 0.46 -0.02 0.01 0.00 -0.56 0.00 0.00 39.33 39.22 3g8r h ASP 105 CO 0.02 0.23 -0.97 0.25 -1.57 0.00 0.00 179.24 177.20 3g8r h LEU 106 N 0.70 0.63 -0.68 1.55 5.85 -0.92 0.84 115.31 123.27 3g8r h LEU 106 Ca 0.58 -0.50 0.07 0.00 0.84 0.00 0.00 57.88 58.87 3g8r h LEU 106 Cb 0.95 -0.19 -0.06 0.00 0.37 0.00 0.00 40.66 41.73 3g8r h LEU 106 CO -0.41 1.30 0.37 0.40 -0.34 0.00 0.00 178.44 179.76 3g8r h ILE 107 N 0.27 0.93 -0.30 4.05 2.04 -0.32 0.44 117.51 124.61 3g8r h ILE 107 Ca -0.09 -0.23 -0.10 0.00 1.00 0.00 0.00 64.86 65.44 3g8r h ILE 107 Cb 1.61 0.21 -0.01 0.00 -0.74 0.00 0.00 36.82 37.89 3g8r h ILE 107 CO 0.17 0.12 -0.20 -0.33 0.00 0.00 0.00 178.15 177.91 3g8r h GLU 108 N 0.66 0.68 -0.93 2.37 5.08 -0.40 -2.57 114.58 119.47 3g8r h GLU 108 Ca 0.32 -0.32 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3g8r h GLU 108 Cb 0.25 -0.01 -0.05 0.00 0.50 0.00 0.00 28.75 29.44 3g8r h GLU 108 CO -0.21 0.92 0.59 0.00 -1.00 0.00 0.00 179.01 179.31 3g8r h ALA 109 N 0.74 1.30 0.00 3.43 0.00 -0.39 -2.88 119.26 121.46 3g8r h ALA 109 Ca 0.06 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.89 3g8r h ALA 109 Cb 0.75 -0.37 0.00 0.00 0.00 0.00 0.00 17.79 18.16 3g8r h ALA 109 CO 0.06 0.63 -0.25 0.72 0.00 0.00 0.00 179.25 180.41 3g8r n HIS 110 N -4.38 0.12 -0.82 0.00 8.25 0.15 -4.91 115.22 113.63 3g8r n HIS 110 Ca 0.11 0.04 0.00 0.00 -0.26 0.00 0.00 57.72 57.60 3g8r n HIS 110 Cb 0.03 -0.45 0.00 0.00 1.12 0.00 0.00 29.99 30.69 3g8r n HIS 110 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3g8r n GLY 111 N 1.47 0.50 3.72 -1.41 0.00 -0.99 -4.93 105.19 103.55 3g8r n GLY 111 Ca 0.06 -0.82 -0.40 0.00 0.00 0.00 0.00 46.02 44.86 3g8r n GLY 111 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3g8r n ILE 112 N -2.82 2.72 -0.01 -0.61 2.08 -1.12 -4.97 119.36 114.62 3g8r n ILE 112 Ca 0.00 -0.50 -0.01 0.00 0.56 0.00 0.00 62.75 62.80 3g8r n ILE 112 Cb 0.00 -1.65 -0.12 0.00 -0.75 0.00 0.00 39.64 37.12 3g8r n ILE 112 CO 0.00 0.00 0.00 -0.62 0.56 0.00 0.00 176.55 176.49 3g8r n GLU 113 N -0.10 0.65 -4.00 0.38 1.02 0.22 -4.85 120.64 113.95 3g8r n GLU 113 Ca 0.06 0.09 -0.11 0.00 -0.02 0.00 0.00 57.16 57.18 3g8r n GLU 113 Cb 0.41 -1.68 -0.12 0.00 -0.02 0.00 0.00 31.44 30.03 3g8r n GLU 113 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 3g8r s ILE 114 N -2.91 0.25 -0.21 -3.67 1.01 -0.98 -4.15 121.20 110.54 3g8r s ILE 114 Ca -0.06 -0.75 -0.05 0.00 0.00 0.00 0.00 60.65 59.79 3g8r s ILE 114 Cb 0.09 -0.33 -0.02 0.00 0.01 0.00 0.00 42.46 42.21 3g8r s ILE 114 CO 0.83 -0.33 0.00 -0.63 0.00 0.00 0.00 174.94 174.82 3g8r s ILE 115 N -1.08 3.91 -0.06 2.92 1.01 -0.18 -2.12 121.20 125.60 3g8r s ILE 115 Ca -0.10 -0.32 -0.06 0.00 0.00 0.00 0.00 60.65 60.17 3g8r s ILE 115 Cb -0.08 -2.78 -0.04 0.00 0.01 0.00 0.00 42.46 39.57 3g8r s ILE 115 CO -0.00 0.41 0.19 -0.75 0.00 0.00 0.00 174.94 174.78 3g8r s LYS 116 N 1.19 3.49 -0.21 2.79 2.36 0.20 0.07 119.74 129.62 3g8r s LYS 116 Ca 0.03 -0.15 -0.02 0.00 -2.55 0.00 0.00 55.97 53.29 3g8r s LYS 116 Cb -0.14 -3.15 0.01 0.00 -1.05 0.00 0.00 37.83 33.49 3g8r s LYS 116 CO 0.01 0.73 -0.09 0.42 1.55 0.00 0.00 175.35 177.97 3g8r s ILE 117 N -1.15 2.90 0.75 5.43 1.01 0.23 -4.09 121.20 126.27 3g8r s ILE 117 Ca 0.21 -0.71 -0.13 0.00 0.00 0.00 0.00 60.65 60.02 3g8r s ILE 117 Cb -0.13 -2.32 0.05 0.00 0.01 0.00 0.00 42.46 40.07 3g8r s ILE 117 CO 0.10 0.42 1.14 0.00 0.00 0.00 0.00 174.94 176.61 3g8r s ALA 118 N 1.40 2.14 0.34 9.38 0.00 -1.26 -0.23 121.76 133.53 3g8r s ALA 118 Ca 0.05 0.60 0.03 0.00 0.00 0.00 0.00 51.96 52.63 3g8r s ALA 118 Cb -0.14 -3.38 0.64 0.00 0.00 0.00 0.00 23.12 20.23 3g8r s ALA 118 CO -0.06 -1.83 1.97 0.77 0.00 0.00 0.00 175.76 176.60 3g8r h SER 119 N -0.66 0.76 0.89 0.00 0.02 -1.92 -1.51 113.55 111.13 3g8r h SER 119 Ca -0.46 -0.01 -0.05 0.00 -0.84 0.00 0.00 61.79 60.44 3g8r h SER 119 Cb 1.26 -0.17 -0.01 0.00 0.14 0.00 0.00 62.40 63.62 3g8r h SER 119 CO 0.50 0.52 -0.23 0.00 -1.14 0.00 0.00 176.83 176.48 3g8r n SER 121 N -3.41 3.63 -0.22 0.00 7.64 -0.74 -4.60 113.62 115.92 3g8r n SER 121 Ca -0.00 -1.99 -0.00 0.00 1.01 0.00 0.00 58.87 57.89 3g8r n SER 121 Cb 0.43 -0.33 0.11 0.00 -1.01 0.00 0.00 64.21 63.40 3g8r n SER 121 CO 0.00 0.00 0.00 0.15 -3.01 0.00 0.00 175.04 172.18 3g8r h PHE 122 N 4.36 0.52 -0.86 1.43 3.04 -0.51 -1.80 116.94 123.12 3g8r h PHE 122 Ca 0.00 0.03 -0.51 0.00 3.98 0.00 0.00 57.97 61.46 3g8r h PHE 122 Cb 0.98 -0.14 -0.28 0.00 2.56 0.00 0.00 35.95 39.08 3g8r h PHE 122 CO 0.33 0.18 0.46 0.25 -2.02 0.00 0.00 178.31 177.52 3g8r n THR 123 N -4.91 3.17 -2.66 4.41 -2.24 -1.26 -4.84 114.28 105.95 3g8r n THR 123 Ca 0.09 -2.63 -0.43 0.00 -2.27 0.00 0.00 64.05 58.81 3g8r n THR 123 Cb 0.25 -0.73 0.00 0.00 -2.10 0.00 0.00 70.33 67.75 3g8r n THR 123 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 3g8r n ASP 124 N -1.03 5.01 -0.33 3.42 -0.08 -0.68 -4.85 116.55 118.02 3g8r n ASP 124 Ca 0.55 -2.97 0.14 0.00 -1.51 0.00 0.00 54.79 51.00 3g8r n ASP 124 Cb 1.15 -1.62 0.32 0.00 2.34 0.00 0.00 41.12 43.32 3g8r n ASP 124 CO 0.00 0.00 0.00 -0.50 0.12 0.00 0.00 177.20 176.82 3g8r h TRP 125 N 6.99 0.92 -0.43 -0.67 4.06 -1.88 0.46 115.95 125.41 3g8r h TRP 125 Ca 0.39 0.04 -0.09 0.00 2.06 0.00 0.00 58.89 61.28 3g8r h TRP 125 Cb 0.82 -0.26 -0.02 0.00 -1.00 0.00 0.00 29.16 28.70 3g8r h TRP 125 CO 1.25 0.11 -0.11 -1.35 -3.56 0.00 0.00 178.44 174.78 3g8r h PRO 126 N 0.61 0.77 -0.17 0.49 0.11 -1.99 0.23 132.00 132.05 3g8r h PRO 126 Ca 0.58 -0.26 -0.03 0.00 0.11 0.00 0.00 66.00 66.40 3g8r h PRO 126 Cb 1.00 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 32.04 3g8r h PRO 126 CO -0.44 0.85 -0.02 1.25 -0.21 0.00 0.00 178.00 179.43 3g8r h LEU 127 N 0.69 0.32 -1.07 2.35 5.85 -0.89 -2.73 115.31 119.83 3g8r h LEU 127 Ca 0.12 -0.34 0.21 0.00 0.84 0.00 0.00 57.88 58.70 3g8r h LEU 127 Cb 0.59 -0.09 -0.11 0.00 0.37 0.00 0.00 40.66 41.43 3g8r h LEU 127 CO 0.04 0.59 0.61 -0.07 -0.34 0.00 0.00 178.44 179.27 3g8r h LEU 128 N 0.05 0.72 -0.37 2.25 3.38 0.33 0.38 115.31 122.04 3g8r h LEU 128 Ca 0.05 0.10 -0.09 0.00 0.09 0.00 0.00 57.88 58.03 3g8r h LEU 128 Cb 0.44 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.15 3g8r h LEU 128 CO 0.01 0.23 -0.41 -0.08 0.09 0.00 0.00 178.44 178.28 3g8r h GLU 129 N 0.68 0.00 -0.00 1.13 4.81 -0.33 0.20 114.58 121.06 3g8r h GLU 129 Ca 0.58 0.00 -0.06 0.00 -0.13 0.00 0.00 59.36 59.75 3g8r h GLU 129 Cb 1.02 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.40 3g8r h GLU 129 CO -0.37 0.41 -0.24 -0.09 -0.73 0.00 0.00 179.01 177.98 3g8r h ARG 130 N 0.00 0.17 -0.87 1.92 9.65 -0.68 -3.27 114.38 121.31 3g8r h ARG 130 Ca -0.00 -0.18 0.02 0.00 -1.10 0.00 0.00 59.98 58.71 3g8r h ARG 130 Cb 1.17 0.05 -0.04 0.00 -1.39 0.00 0.00 29.97 29.75 3g8r h ARG 130 CO 0.05 0.91 0.57 0.82 2.80 0.00 0.00 179.97 185.13 3g8r h ILE 131 N -0.50 1.20 -0.02 1.20 2.04 0.03 -0.28 117.51 121.18 3g8r h ILE 131 Ca -0.03 -0.39 0.01 0.00 1.00 0.00 0.00 64.86 65.44 3g8r h ILE 131 Cb 0.99 -0.05 -0.00 0.00 -0.74 0.00 0.00 36.82 37.02 3g8r h ILE 131 CO 0.05 0.21 0.06 0.00 0.00 0.00 0.00 178.15 178.46 3g8r h ALA 132 N 1.47 1.27 0.00 1.87 0.00 -0.68 -2.00 119.26 121.19 3g8r h ALA 132 Ca 0.32 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.23 3g8r h ALA 132 Cb -0.09 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.70 3g8r h ALA 132 CO -0.08 -0.07 -0.14 0.54 0.00 0.00 0.00 179.25 179.51 3g8r n ARG 133 N -3.35 0.10 -1.97 0.00 5.12 -0.12 -4.78 116.66 111.66 3g8r n ARG 133 Ca -0.02 0.07 -0.29 0.00 -1.93 0.00 0.00 57.85 55.68 3g8r n ARG 133 Cb 0.13 -1.60 0.07 0.00 -1.16 0.00 0.00 32.46 29.91 3g8r n ARG 133 CO 0.00 0.00 0.00 0.45 -1.93 0.00 0.00 177.63 176.15 3g8r s SER 134 N -3.54 4.80 -0.46 0.55 0.15 -0.75 -5.01 113.70 109.44 3g8r s SER 134 Ca 0.12 0.79 0.08 0.00 0.70 0.00 0.00 55.95 57.64 3g8r s SER 134 Cb 0.16 -1.40 0.39 0.00 -1.71 0.00 0.00 66.02 63.47 3g8r s SER 134 CO 0.59 -1.70 1.00 -0.90 1.20 0.00 0.00 173.24 173.43 3g8r n ASP 135 N -3.15 3.78 -4.28 5.45 5.75 -1.26 -5.03 116.55 117.80 3g8r n ASP 135 Ca 0.08 -3.49 -0.30 0.00 -0.01 0.00 0.00 54.79 51.06 3g8r n ASP 135 Cb 0.60 -0.52 -0.16 0.00 -1.03 0.00 0.00 41.12 40.01 3g8r n ASP 135 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 3g8r s LYS 136 N -3.35 2.11 0.44 0.11 1.02 -1.26 -5.11 119.74 113.70 3g8r s LYS 136 Ca 0.44 -0.89 -0.23 0.00 0.02 0.00 0.00 55.97 55.31 3g8r s LYS 136 Cb 0.37 -1.98 -0.10 0.00 -0.52 0.00 0.00 37.83 35.60 3g8r s LYS 136 CO -0.13 0.50 0.95 -2.30 -0.92 0.00 0.00 175.35 173.45 3g8r n PRO 137 N 2.57 1.21 -4.92 -1.68 -0.02 -1.26 -4.69 135.00 126.22 3g8r n PRO 137 Ca -0.16 0.44 -0.33 0.00 -2.02 0.00 0.00 63.50 61.43 3g8r n PRO 137 Cb 0.52 -1.99 -0.13 0.00 -0.02 0.00 0.00 33.50 31.87 3g8r n PRO 137 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3g8r s VAL 138 N -1.33 2.97 -0.07 -1.45 1.01 -0.02 -1.01 120.40 120.50 3g8r s VAL 138 Ca 0.65 -0.75 0.03 0.00 0.00 0.00 0.00 61.98 61.90 3g8r s VAL 138 Cb -0.55 -2.16 0.01 0.00 0.00 0.00 0.00 36.38 33.68 3g8r s VAL 138 CO 0.56 0.58 -0.14 -0.69 0.00 0.00 0.00 175.10 175.41 3g8r s VAL 139 N -0.60 1.30 -0.06 2.92 1.01 0.11 -1.50 120.40 123.58 3g8r s VAL 139 Ca 0.09 -0.58 0.01 0.00 0.00 0.00 0.00 61.98 61.50 3g8r s VAL 139 Cb -0.11 -1.17 0.02 0.00 0.00 0.00 0.00 36.38 35.12 3g8r s VAL 139 CO 0.01 0.39 -0.06 0.00 0.00 0.00 0.00 175.10 175.44 3g8r s ALA 140 N 0.60 0.85 0.22 5.51 0.00 0.92 0.75 121.76 130.61 3g8r s ALA 140 Ca -0.15 -0.18 0.00 0.00 0.00 0.00 0.00 51.96 51.63 3g8r s ALA 140 Cb -0.16 -0.53 -0.04 0.00 0.00 0.00 0.00 23.12 22.39 3g8r s ALA 140 CO 0.05 -0.08 0.40 -1.12 0.00 0.00 0.00 175.76 175.01 3g8r s SER 141 N 1.05 6.36 0.00 0.00 0.01 0.68 -4.25 113.70 117.57 3g8r s SER 141 Ca -0.09 0.35 0.00 0.00 1.31 0.00 0.00 55.95 57.53 3g8r s SER 141 Cb -0.14 -1.99 0.00 0.00 0.21 0.00 0.00 66.02 64.10 3g8r s SER 141 CO -0.01 -0.07 0.26 0.41 0.41 0.00 0.00 173.24 174.25 3g8r n THR 142 N -0.87 0.07 -1.60 1.44 -1.04 -1.26 -3.97 114.28 107.05 3g8r n THR 142 Ca -0.05 -0.18 -0.54 0.00 -2.04 0.00 0.00 64.05 61.23 3g8r n THR 142 Cb 0.54 1.51 -0.06 0.00 -1.82 0.00 0.00 70.33 70.50 3g8r n THR 142 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3g8r n ALA 143 N -0.03 -1.27 -1.75 2.41 0.00 -1.24 -1.63 120.51 117.00 3g8r n ALA 143 Ca 0.00 0.51 -0.17 0.00 0.00 0.00 0.00 53.44 53.78 3g8r n ALA 143 Cb 0.23 -2.05 -0.06 0.00 0.00 0.00 0.00 19.45 17.58 3g8r n ALA 143 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3g8r n GLY 144 N 2.61 1.07 3.75 0.00 0.00 -1.26 -4.87 105.19 106.49 3g8r n GLY 144 Ca 0.20 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.82 3g8r n GLY 144 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g8r s ALA 145 N -2.58 3.35 0.63 4.61 0.00 -0.64 -5.05 121.76 122.07 3g8r s ALA 145 Ca 0.00 0.66 -0.13 0.00 0.00 0.00 0.00 51.96 52.49 3g8r s ALA 145 Cb 0.00 -3.23 -0.02 0.00 0.00 0.00 0.00 23.12 19.87 3g8r s ALA 145 CO 0.00 0.15 1.04 1.03 0.00 0.00 0.00 175.76 177.99 3g8r s ARG 146 N -1.24 3.29 0.35 0.00 0.52 -1.26 -4.89 118.95 115.72 3g8r s ARG 146 Ca 0.42 0.99 0.12 0.00 -0.52 0.00 0.00 55.73 56.74 3g8r s ARG 146 Cb -0.27 -2.04 0.92 0.00 0.52 0.00 0.00 34.95 34.08 3g8r s ARG 146 CO 0.33 -0.82 1.77 -0.09 0.02 0.00 0.00 175.30 176.52 3g8r h ARG 147 N -0.10 0.56 0.00 3.54 2.43 -2.00 -2.15 114.38 116.67 3g8r h ARG 147 Ca -0.45 -0.03 -0.12 0.00 -0.81 0.00 0.00 59.98 58.56 3g8r h ARG 147 Cb 1.21 -0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 30.61 3g8r h ARG 147 CO 0.58 0.37 -0.59 1.05 -1.51 0.00 0.00 179.97 179.88 3g8r h GLU 148 N 0.57 0.00 -0.03 0.20 9.09 -1.99 0.09 114.58 122.52 3g8r h GLU 148 Ca 0.59 0.00 -0.01 0.00 0.05 0.00 0.00 59.36 59.99 3g8r h GLU 148 Cb 1.19 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 28.29 3g8r h GLU 148 CO -0.36 0.59 -0.04 -0.44 0.05 0.00 0.00 179.01 178.80 3g8r h ASP 149 N 0.00 0.08 -0.78 3.06 3.32 -1.79 -0.81 116.42 119.51 3g8r h ASP 149 Ca -0.01 -0.52 0.05 0.00 0.02 0.00 0.00 57.03 56.58 3g8r h ASP 149 Cb 1.14 -0.02 -0.06 0.00 0.22 0.00 0.00 39.33 40.61 3g8r h ASP 149 CO 0.08 0.59 0.48 0.40 -1.72 0.00 0.00 179.24 179.06 3g8r h ILE 150 N -0.42 1.04 0.07 0.35 2.04 -1.16 0.23 117.51 119.66 3g8r h ILE 150 Ca 0.00 -0.30 0.01 0.00 1.00 0.00 0.00 64.86 65.57 3g8r h ILE 150 Cb 0.57 0.07 -0.02 0.00 -0.74 0.00 0.00 36.82 36.70 3g8r h ILE 150 CO 0.01 0.16 -0.13 0.44 0.00 0.00 0.00 178.15 178.63 3g8r h ASP 151 N 0.88 -0.36 0.23 1.72 3.32 -0.89 0.15 116.42 121.48 3g8r h ASP 151 Ca 0.34 0.04 0.00 0.00 0.02 0.00 0.00 57.03 57.43 3g8r h ASP 151 Cb 0.14 0.14 -0.02 0.00 0.22 0.00 0.00 39.33 39.81 3g8r h ASP 151 CO -0.16 -0.19 -0.21 0.11 -1.72 0.00 0.00 179.24 177.06 3g8r h LYS 152 N -0.26 -0.45 -0.23 3.56 1.57 -0.44 -0.48 116.57 119.83 3g8r h LYS 152 Ca 0.02 0.03 -0.04 0.00 -1.87 0.00 0.00 60.65 58.79 3g8r h LYS 152 Cb 0.27 0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.68 3g8r h LYS 152 CO -0.07 -0.30 -0.01 0.28 -0.57 0.00 0.00 179.45 178.77 3g8r h VAL 153 N -0.47 1.26 -0.59 0.50 2.07 -0.91 0.99 116.25 119.10 3g8r h VAL 153 Ca -0.01 -0.93 0.12 0.00 0.82 0.00 0.00 66.70 66.70 3g8r h VAL 153 Cb 0.43 1.41 -0.10 0.00 -1.52 0.00 0.00 31.29 31.51 3g8r h VAL 153 CO -0.04 0.29 -0.02 0.58 0.02 0.00 0.00 177.57 178.40 3g8r h VAL 154 N 0.18 0.51 0.00 2.57 2.07 -0.49 -2.35 116.25 118.75 3g8r h VAL 154 Ca 0.06 -0.03 -0.22 0.00 0.82 0.00 0.00 66.70 67.33 3g8r h VAL 154 Cb 0.43 0.40 -0.00 0.00 -1.52 0.00 0.00 31.29 30.60 3g8r h VAL 154 CO 0.01 0.02 -0.93 0.77 0.02 0.00 0.00 177.57 177.47 3g8r h SER 155 N 0.10 0.44 0.00 0.57 4.64 -0.61 -0.38 113.55 118.31 3g8r h SER 155 Ca 0.30 -0.36 0.00 0.00 -0.47 0.00 0.00 61.79 61.26 3g8r h SER 155 Cb 0.48 -0.14 0.00 0.00 -0.31 0.00 0.00 62.40 62.43 3g8r h SER 155 CO -0.51 1.16 0.00 0.33 -0.87 0.00 0.00 176.83 176.93 3g8r n PHE 156 N -3.71 0.00 0.00 4.77 -0.00 0.30 -0.39 117.46 118.42 3g8r n PHE 156 Ca -0.06 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.39 3g8r n PHE 156 Cb 0.83 0.00 0.00 0.00 -0.00 0.00 0.00 39.48 40.31 3g8r n PHE 156 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 176.76 178.04 3g8r n LEU 158 N -0.34 0.00 0.16 -2.13 4.77 -0.15 -2.17 117.00 117.13 3g8r n LEU 158 Ca 0.00 0.00 0.04 0.00 -0.03 0.00 0.00 56.01 56.02 3g8r n LEU 158 Cb 0.00 0.00 0.15 0.00 -2.33 0.00 0.00 43.42 41.24 3g8r n LEU 158 CO 0.00 0.00 0.55 0.45 -1.33 0.00 0.00 177.39 177.06 3g8r h HIS 159 N 0.00 0.00 0.00 -1.77 3.86 -0.97 -2.59 115.15 113.68 3g8r h HIS 159 Ca 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 3g8r h HIS 159 Cb 0.00 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.47 3g8r h HIS 159 CO 0.00 0.46 0.00 0.54 0.86 0.00 0.00 177.93 179.79 3g8r n ARG 160 N -3.34 0.00 -0.35 2.45 5.12 -0.92 -4.90 116.66 114.72 3g8r n ARG 160 Ca 0.01 0.14 0.00 0.00 -1.93 0.00 0.00 57.85 56.07 3g8r n ARG 160 Cb 0.65 -1.50 0.00 0.00 -1.16 0.00 0.00 32.46 30.45 3g8r n ARG 160 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 3g8r n GLY 161 N 0.67 0.80 3.76 -0.13 0.00 -0.98 -5.05 105.19 104.26 3g8r n GLY 161 Ca 0.05 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.71 3g8r n GLY 161 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3g8r s LYS 162 N -0.65 3.25 -0.70 1.61 -0.14 -1.26 -4.97 119.74 116.89 3g8r s LYS 162 Ca 0.00 1.78 -0.20 0.00 -1.36 0.00 0.00 55.97 56.19 3g8r s LYS 162 Cb 0.00 -2.06 0.10 0.00 -1.68 0.00 0.00 37.83 34.19 3g8r s LYS 162 CO 0.00 -0.97 0.88 0.34 -0.76 0.00 0.00 175.35 174.85 3g8r s ASP 163 N -1.56 6.30 -0.04 2.83 2.15 -1.26 -4.74 116.67 120.36 3g8r s ASP 163 Ca 0.73 -1.49 -0.02 0.00 0.43 0.00 0.00 52.55 52.21 3g8r s ASP 163 Cb -0.29 -2.36 -0.04 0.00 -0.30 0.00 0.00 42.92 39.94 3g8r s ASP 163 CO 0.32 -1.18 0.07 -0.22 -0.17 0.00 0.00 175.17 173.99 3g8r s LEU 164 N 3.00 3.88 -0.02 -1.34 2.96 -1.26 -0.84 118.68 125.07 3g8r s LEU 164 Ca 0.20 0.19 0.04 0.00 -0.22 0.00 0.00 54.13 54.34 3g8r s LEU 164 Cb -0.17 -2.13 -0.01 0.00 0.50 0.00 0.00 46.19 44.38 3g8r s LEU 164 CO 0.03 0.32 -0.14 -0.89 -1.32 0.00 0.00 176.35 174.35 3g8r s THR 165 N -1.10 1.12 0.00 3.68 2.01 -0.56 -3.81 115.64 116.98 3g8r s THR 165 Ca 0.20 -0.59 0.00 0.00 0.31 0.00 0.00 61.69 61.60 3g8r s THR 165 Cb -0.12 -0.95 0.00 0.00 0.01 0.00 0.00 72.50 71.44 3g8r s THR 165 CO 0.10 0.32 0.00 -0.38 -0.69 0.00 0.00 174.62 173.97 3g8r n ILE 166 N 2.86 0.00 -4.99 1.82 2.08 -0.58 -0.05 119.36 120.50 3g8r n ILE 166 Ca -0.15 0.00 -0.29 0.00 0.56 0.00 0.00 62.75 62.87 3g8r n ILE 166 Cb 0.55 -0.49 -0.17 0.00 -0.75 0.00 0.00 39.64 38.78 3g8r n ILE 166 CO 0.00 0.00 0.00 -2.28 0.56 0.00 0.00 176.55 174.83 3g8r s HIS 168 N 0.58 2.09 0.29 1.39 2.46 -0.81 -1.05 115.29 120.24 3g8r s HIS 168 Ca 0.00 -0.76 -0.10 0.00 0.47 0.00 0.00 55.06 54.67 3g8r s HIS 168 Cb 0.00 -1.42 0.00 0.00 -0.13 0.00 0.00 32.58 31.03 3g8r s HIS 168 CO 0.00 -0.31 0.50 0.00 -2.47 0.00 0.00 174.74 172.46 3g8r s VAL 170 N -3.57 1.12 -1.35 0.00 1.01 -1.26 -3.60 120.40 112.74 3g8r s VAL 170 Ca 0.25 -0.48 -0.07 0.00 0.00 0.00 0.00 61.98 61.68 3g8r s VAL 170 Cb -0.01 -1.02 0.04 0.00 0.00 0.00 0.00 36.38 35.39 3g8r s VAL 170 CO 0.13 0.35 2.63 0.00 0.00 0.00 0.00 175.10 178.20 3g8r n ALA 171 N 3.74 7.05 -3.46 5.51 0.00 -1.26 -4.77 120.51 127.32 3g8r n ALA 171 Ca -0.22 -3.80 -0.26 0.00 0.00 0.00 0.00 53.44 49.15 3g8r n ALA 171 Cb 0.52 -2.94 -0.17 0.00 0.00 0.00 0.00 19.45 16.87 3g8r n ALA 171 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 3g8r s GLU 172 N -0.02 1.97 -0.37 0.00 2.02 -1.26 -5.08 118.70 115.96 3g8r s GLU 172 Ca 0.60 -0.50 0.04 0.00 0.02 0.00 0.00 54.97 55.13 3g8r s GLU 172 Cb 0.20 -1.61 0.11 0.00 0.10 0.00 0.00 34.13 32.92 3g8r s GLU 172 CO -0.09 0.03 0.09 0.71 0.02 0.00 0.00 175.26 176.03 3g8r s TYR 173 N 0.68 3.52 0.68 1.61 1.51 -1.26 -1.86 117.35 122.23 3g8r s TYR 173 Ca -0.14 -2.95 -0.08 0.00 -1.01 0.00 0.00 57.07 52.89 3g8r s TYR 173 Cb -0.16 -2.82 0.04 0.00 -0.11 0.00 0.00 41.96 38.91 3g8r s TYR 173 CO 0.04 -0.91 1.01 -1.25 -1.11 0.00 0.00 175.55 173.33 3g8r s PRO 174 N 0.74 2.54 -0.23 -1.71 0.04 -1.26 -5.00 135.00 130.12 3g8r s PRO 174 Ca 0.12 0.00 -0.23 0.00 0.04 0.00 0.00 61.00 60.93 3g8r s PRO 174 Cb -0.20 -2.15 -0.01 0.00 0.04 0.00 0.00 34.50 32.17 3g8r s PRO 174 CO -0.08 -1.06 0.75 0.99 0.04 0.00 0.00 177.00 177.64 3g8r s THR 175 N -3.22 4.91 0.49 1.26 2.01 0.23 -5.00 115.64 116.32 3g8r s THR 175 Ca 0.58 1.42 -0.24 0.00 0.31 0.00 0.00 61.69 63.76 3g8r s THR 175 Cb -0.11 -4.05 -0.07 0.00 0.01 0.00 0.00 72.50 68.29 3g8r s THR 175 CO 0.47 -0.00 1.36 -2.16 -0.69 0.00 0.00 174.62 173.60 3g8r s PRO 176 N 2.50 3.48 0.15 4.92 0.04 -1.26 -4.57 135.00 140.26 3g8r s PRO 176 Ca 0.32 2.26 -0.30 0.00 0.04 0.00 0.00 61.00 63.32 3g8r s PRO 176 Cb -0.16 -2.47 -0.05 0.00 0.04 0.00 0.00 34.50 31.86 3g8r s PRO 176 CO 0.09 -0.92 1.55 -0.44 0.04 0.00 0.00 177.00 177.32 3g8r h ASP 177 N 1.96 -1.76 -0.26 6.66 5.19 -1.96 0.79 116.42 127.03 3g8r h ASP 177 Ca -0.51 0.25 0.09 0.00 -0.62 0.00 0.00 57.03 56.25 3g8r h ASP 177 Cb 1.28 0.75 -0.03 0.00 0.18 0.00 0.00 39.33 41.51 3g8r h ASP 177 CO 0.59 -0.36 0.17 -0.67 -3.12 0.00 0.00 179.24 175.85 3g8r n ASP 178 N -5.37 0.04 -0.00 6.45 2.03 -1.26 -2.72 116.55 115.71 3g8r n ASP 178 Ca -0.01 0.28 0.00 0.00 0.52 0.00 0.00 54.79 55.58 3g8r n ASP 178 Cb 0.34 -0.14 0.00 0.00 -0.72 0.00 0.00 41.12 40.60 3g8r n ASP 178 CO 0.00 0.00 0.00 1.41 -1.92 0.00 0.00 177.20 176.69 3g8r n HIS 179 N -3.07 0.00 -0.14 -0.67 8.25 0.27 -4.59 115.22 115.27 3g8r n HIS 179 Ca 0.08 0.00 0.26 0.00 -0.26 0.00 0.00 57.72 57.80 3g8r n HIS 179 Cb 0.30 0.00 0.71 0.00 1.12 0.00 0.00 29.99 32.12 3g8r n HIS 179 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 3g8r h LEU 180 N 0.02 0.02 -1.41 2.41 3.38 -1.29 -3.47 115.31 114.98 3g8r h LEU 180 Ca 0.00 0.00 -0.53 0.00 0.09 0.00 0.00 57.88 57.44 3g8r h LEU 180 Cb 0.01 -0.00 -0.15 0.00 0.09 0.00 0.00 40.66 40.61 3g8r h LEU 180 CO 0.00 0.01 -0.85 1.57 0.09 0.00 0.00 178.44 179.25 3g8r n HIS 181 N -4.31 -1.72 0.27 1.13 -0.00 -1.26 -4.78 115.22 104.55 3g8r n HIS 181 Ca 0.16 0.78 0.15 0.00 0.46 0.00 0.00 57.72 59.28 3g8r n HIS 181 Cb 0.86 -3.26 0.82 0.00 -0.12 0.00 0.00 29.99 28.30 3g8r n HIS 181 CO 0.00 0.00 0.00 -0.07 0.46 0.00 0.00 176.34 176.73 3g8r h LEU 182 N -1.66 0.00 0.00 0.27 3.38 -1.95 -1.39 115.31 113.96 3g8r h LEU 182 Ca -0.61 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.36 3g8r h LEU 182 Cb 1.38 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.13 3g8r h LEU 182 CO 0.72 0.00 0.00 0.00 0.09 0.00 0.00 178.44 179.25 3g8r n ALA 183 N -1.87 2.43 0.19 1.53 0.00 -1.26 -2.01 120.51 119.52 3g8r n ALA 183 Ca -0.02 -0.14 0.03 0.00 0.00 0.00 0.00 53.44 53.31 3g8r n ALA 183 Cb 0.18 -1.46 0.38 0.00 0.00 0.00 0.00 19.45 18.55 3g8r n ALA 183 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 3g8r h ARG 184 N 0.00 0.00 -0.56 0.00 2.43 -1.60 -2.03 114.38 112.62 3g8r h ARG 184 Ca 0.00 0.00 0.11 0.00 -0.81 0.00 0.00 59.98 59.28 3g8r h ARG 184 Cb 0.19 0.00 -0.10 0.00 -0.42 0.00 0.00 29.97 29.64 3g8r h ARG 184 CO 0.00 0.35 -0.10 0.82 -1.51 0.00 0.00 179.97 179.53 3g8r h ILE 185 N 0.00 0.47 -0.15 1.20 2.04 -1.64 0.29 117.51 119.72 3g8r h ILE 185 Ca -0.00 -0.01 -0.04 0.00 1.00 0.00 0.00 64.86 65.81 3g8r h ILE 185 Cb 0.65 0.44 -0.00 0.00 -0.74 0.00 0.00 36.82 37.16 3g8r h ILE 185 CO 0.05 0.01 -0.05 0.50 0.00 0.00 0.00 178.15 178.65 3g8r h LYS 186 N 0.03 0.29 -0.58 2.37 3.64 -1.64 -1.89 116.57 118.79 3g8r h LYS 186 Ca 0.28 -0.12 0.12 0.00 -1.27 0.00 0.00 60.65 59.66 3g8r h LYS 186 Cb 0.43 -0.01 -0.11 0.00 -0.41 0.00 0.00 32.23 32.13 3g8r h LYS 186 CO -0.55 0.59 -0.09 1.15 -2.27 0.00 0.00 179.45 178.29 3g8r h THR 187 N -0.03 0.46 0.00 1.00 2.02 -0.64 0.27 112.91 115.99 3g8r h THR 187 Ca 0.04 -0.01 -0.08 0.00 0.77 0.00 0.00 66.41 67.12 3g8r h THR 187 Cb 0.50 0.41 -0.01 0.00 -1.74 0.00 0.00 68.15 67.30 3g8r h THR 187 CO 0.02 0.01 -0.39 -0.07 0.37 0.00 0.00 175.52 175.46 3g8r h LEU 188 N 0.04 0.00 -0.43 2.58 3.38 -0.37 -0.65 115.31 119.86 3g8r h LEU 188 Ca 0.29 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 58.16 3g8r h LEU 188 Cb 0.46 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.19 3g8r h LEU 188 CO -0.56 0.39 -0.14 -0.09 0.09 0.00 0.00 178.44 178.13 3g8r h ARG 189 N 0.00 0.86 0.00 1.13 2.43 -0.18 -2.65 114.38 115.97 3g8r h ARG 189 Ca -0.00 -0.34 -0.12 0.00 -0.81 0.00 0.00 59.98 58.70 3g8r h ARG 189 Cb 0.96 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 30.46 3g8r h ARG 189 CO 0.05 0.98 -0.59 1.96 -1.51 0.00 0.00 179.97 180.86 3g8r h GLN 190 N 0.68 0.00 0.00 0.20 4.20 -0.23 -3.22 115.11 116.75 3g8r h GLN 190 Ca 0.10 0.00 -0.19 0.00 0.06 0.00 0.00 58.65 58.63 3g8r h GLN 190 Cb 0.69 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.44 3g8r h GLN 190 CO 0.05 0.59 -1.20 1.96 -0.67 0.00 0.00 178.83 179.56 3g8r h GLN 191 N 0.00 0.00 -2.37 1.46 4.20 -1.15 -3.39 115.11 113.86 3g8r h GLN 191 Ca -0.01 0.00 -0.60 0.00 0.06 0.00 0.00 58.65 58.10 3g8r h GLN 191 Cb 1.08 0.00 -0.42 0.00 0.30 0.00 0.00 27.48 28.44 3g8r h GLN 191 CO 0.08 0.51 -0.60 0.66 -0.67 0.00 0.00 178.83 178.80 3g8r n TYR 192 N -3.08 3.47 -2.14 2.96 4.01 -1.00 -5.07 117.16 116.31 3g8r n TYR 192 Ca -0.07 -4.17 -0.41 0.00 -0.16 0.00 0.00 57.90 53.09 3g8r n TYR 192 Cb 0.88 -0.56 -0.03 0.00 -0.31 0.00 0.00 39.34 39.32 3g8r n TYR 192 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3g8r s ALA 193 N -2.24 3.54 0.00 -0.72 0.00 -1.22 -2.39 121.76 118.74 3g8r s ALA 193 Ca 0.37 1.20 0.00 0.00 0.00 0.00 0.00 51.96 53.53 3g8r s ALA 193 Cb 0.11 -3.50 0.00 0.00 0.00 0.00 0.00 23.12 19.73 3g8r s ALA 193 CO -0.05 -0.61 0.00 0.41 0.00 0.00 0.00 175.76 175.52 3g8r n GLY 194 N 1.86 2.99 3.71 0.00 0.00 -1.26 -5.02 105.19 107.48 3g8r n GLY 194 Ca 0.04 -0.13 -0.42 0.00 0.00 0.00 0.00 46.02 45.52 3g8r n GLY 194 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3g8r s VAL 195 N -2.61 4.25 0.29 1.61 1.01 -1.00 -5.01 120.40 118.94 3g8r s VAL 195 Ca 0.00 1.63 -0.30 0.00 0.00 0.00 0.00 61.98 63.32 3g8r s VAL 195 Cb 0.00 -4.04 -0.11 0.00 0.00 0.00 0.00 36.38 32.23 3g8r s VAL 195 CO 0.00 0.13 1.47 -0.60 0.00 0.00 0.00 175.10 176.10 3g8r s ARG 196 N 0.98 4.22 -0.06 2.72 3.52 -1.25 -4.92 118.95 124.16 3g8r s ARG 196 Ca 0.56 2.40 0.04 0.00 -0.13 0.00 0.00 55.73 58.60 3g8r s ARG 196 Cb -0.27 -3.06 -0.02 0.00 -1.56 0.00 0.00 34.95 30.04 3g8r s ARG 196 CO 0.29 -0.46 -0.17 0.42 -0.81 0.00 0.00 175.30 174.57 3g8r s ILE 197 N -0.34 2.81 0.00 4.11 -1.09 -1.26 -1.53 121.20 123.90 3g8r s ILE 197 Ca 0.58 -0.80 0.00 0.00 -2.23 0.00 0.00 60.65 58.20 3g8r s ILE 197 Cb -0.44 -2.10 0.00 0.00 -1.58 0.00 0.00 42.46 38.34 3g8r s ILE 197 CO 0.49 0.57 0.00 0.61 -1.23 0.00 0.00 174.94 175.38 3g8r n GLY 198 N 2.67 4.27 2.87 6.18 0.00 -0.22 -0.56 105.19 120.41 3g8r n GLY 198 Ca -0.17 -1.92 -0.15 0.00 0.00 0.00 0.00 46.02 43.78 3g8r n GLY 198 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3g8r s TYR 199 N -1.40 -0.15 -0.09 1.61 6.04 0.44 -1.92 117.35 121.87 3g8r s TYR 199 Ca 0.00 0.49 0.01 0.00 0.04 0.00 0.00 57.07 57.61 3g8r s TYR 199 Cb 0.00 -0.17 -0.02 0.00 -1.04 0.00 0.00 41.96 40.72 3g8r s TYR 199 CO 0.00 -0.20 -0.12 -1.54 -1.54 0.00 0.00 175.55 172.15 3g8r s SER 200 N 1.60 4.17 0.16 4.32 1.04 -0.35 -1.30 113.70 123.34 3g8r s SER 200 Ca -0.04 -0.22 0.08 0.00 0.48 0.00 0.00 55.95 56.25 3g8r s SER 200 Cb -0.12 -1.27 -0.04 0.00 0.10 0.00 0.00 66.02 64.69 3g8r s SER 200 CO -0.06 0.26 -0.18 0.28 0.98 0.00 0.00 173.24 174.53 3g8r s THR 201 N -0.23 1.74 -0.36 2.02 -1.32 -0.90 -4.29 115.64 112.31 3g8r s THR 201 Ca 0.01 -1.89 0.14 0.00 -1.21 0.00 0.00 61.69 58.75 3g8r s THR 201 Cb -0.13 -1.80 0.44 0.00 -1.51 0.00 0.00 72.50 69.50 3g8r s THR 201 CO 0.03 -0.33 0.96 1.41 -2.21 0.00 0.00 174.62 174.48 3g8r n HIS 202 N 0.33 1.58 -0.06 9.09 8.25 -1.26 -4.47 115.22 128.69 3g8r n HIS 202 Ca -0.14 -2.99 -0.07 0.00 -0.26 0.00 0.00 57.72 54.27 3g8r n HIS 202 Cb 0.57 -0.33 -0.02 0.00 1.12 0.00 0.00 29.99 31.33 3g8r n HIS 202 CO 0.00 0.00 0.00 -0.85 0.64 0.00 0.00 176.34 176.13 3g8r n GLU 203 N -0.11 0.40 -2.29 -0.41 0.28 -1.26 0.77 120.64 118.01 3g8r n GLU 203 Ca 0.17 0.16 -0.43 0.00 -0.16 0.00 0.00 57.16 56.90 3g8r n GLU 203 Cb 0.76 -1.19 -0.02 0.00 1.43 0.00 0.00 31.44 32.42 3g8r n GLU 203 CO 0.00 0.00 0.00 0.16 -0.16 0.00 0.00 177.13 177.13 3g8r s ASP 204 N -5.75 6.73 -1.37 -1.84 3.84 -1.26 -4.62 116.67 112.40 3g8r s ASP 204 Ca -0.22 1.69 -0.12 0.00 -0.00 0.00 0.00 52.55 53.90 3g8r s ASP 204 Cb 0.03 -2.54 0.11 0.00 -1.38 0.00 0.00 42.92 39.14 3g8r s ASP 204 CO 0.32 -0.95 2.05 -0.81 -0.00 0.00 0.00 175.17 175.78 3g8r n PRO 205 N 7.04 3.25 -0.99 2.11 -0.04 -1.26 -4.60 135.00 140.50 3g8r n PRO 205 Ca 0.16 -3.08 0.00 0.00 -0.04 0.00 0.00 63.50 60.54 3g8r n PRO 205 Cb 0.45 -3.10 0.00 0.00 -0.04 0.00 0.00 33.50 30.80 3g8r n PRO 205 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 3g8r n ASP 206 N 4.97 -2.98 -4.19 3.54 9.92 -1.26 -5.20 116.55 121.35 3g8r n ASP 206 Ca 0.46 0.00 -0.29 0.00 -0.53 0.00 0.00 54.79 54.43 3g8r n ASP 206 Cb 0.38 -0.81 0.26 0.00 -0.64 0.00 0.00 41.12 40.31 3g8r n ASP 206 CO 0.00 0.00 0.00 -0.76 0.13 0.00 0.00 177.20 176.57 3g8r s LEU 207 N 0.00 0.31 0.00 0.64 1.02 -1.26 -5.08 118.68 114.30 3g8r s LEU 207 Ca 0.00 1.22 0.00 0.00 0.02 0.00 0.00 54.13 55.37 3g8r s LEU 207 Cb 0.00 -3.00 0.00 0.00 0.02 0.00 0.00 46.19 43.21 3g8r s LEU 207 CO 0.00 -4.45 0.00 -1.84 0.02 0.00 0.00 176.35 170.08 3g8r n GLU 209 N -5.05 0.00 -0.27 1.70 0.00 -1.26 -4.87 120.64 110.89 3g8r n GLU 209 Ca 0.06 0.00 -0.07 0.00 0.00 0.00 0.00 57.16 57.15 3g8r n GLU 209 Cb 0.57 0.00 0.05 0.00 0.00 0.00 0.00 31.44 32.06 3g8r n GLU 209 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.13 175.78 3g8r h PRO 210 N 0.00 1.16 -1.99 3.44 0.11 -2.02 -1.50 132.00 131.20 3g8r h PRO 210 Ca 0.00 -0.25 0.00 0.00 0.11 0.00 0.00 66.00 65.86 3g8r h PRO 210 Cb 0.00 -0.17 0.00 0.00 0.11 0.00 0.00 31.00 30.94 3g8r h PRO 210 CO 0.00 0.99 0.00 1.51 -0.21 0.00 0.00 178.00 180.29 3g8r n ILE 211 N -4.25 0.00 0.00 4.15 3.06 -1.26 0.30 119.36 121.36 3g8r n ILE 211 Ca 0.06 0.00 0.00 0.00 -2.50 0.00 0.00 62.75 60.31 3g8r n ILE 211 Cb 0.23 -0.57 0.00 0.00 0.54 0.00 0.00 39.64 39.84 3g8r n ILE 211 CO 0.00 0.00 0.00 0.18 -2.50 0.00 0.00 176.55 174.23 3g8r n LEU 213 N 1.15 0.00 -0.14 9.51 4.32 -0.57 -0.60 117.00 130.67 3g8r n LEU 213 Ca 0.00 0.00 -0.04 0.00 -0.02 0.00 0.00 56.01 55.95 3g8r n LEU 213 Cb 0.00 0.00 0.02 0.00 -1.62 0.00 0.00 43.42 41.82 3g8r n LEU 213 CO 0.00 0.00 0.72 0.00 -1.22 0.00 0.00 177.39 176.89 3g8r h ALA 214 N 0.00 0.16 -0.65 -1.18 0.00 -0.43 -1.71 119.26 115.46 3g8r h ALA 214 Ca 0.00 0.16 -0.09 0.00 0.00 0.00 0.00 54.91 54.99 3g8r h ALA 214 Cb 0.00 0.48 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 3g8r h ALA 214 CO 0.00 -0.53 0.07 0.28 0.00 0.00 0.00 179.25 179.06 3g8r h VAL 215 N -0.09 1.26 0.00 0.00 2.07 -1.10 -1.54 116.25 116.86 3g8r h VAL 215 Ca 0.22 -1.08 -0.02 0.00 0.82 0.00 0.00 66.70 66.63 3g8r h VAL 215 Cb 0.43 0.70 -0.00 0.00 -1.52 0.00 0.00 31.29 30.90 3g8r h VAL 215 CO -0.52 0.40 -0.09 0.00 0.02 0.00 0.00 177.57 177.38 3g8r h ALA 216 N 1.03 1.23 -0.08 1.67 0.00 -1.62 -0.03 119.26 121.47 3g8r h ALA 216 Ca 0.19 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.02 3g8r h ALA 216 Cb 0.49 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.26 3g8r h ALA 216 CO 0.02 0.12 0.00 1.04 0.00 0.00 0.00 179.25 180.43 3g8r n GLN 217 N -3.54 1.71 -1.29 0.00 6.02 -0.62 -4.93 117.38 114.73 3g8r n GLN 217 Ca -0.02 -1.04 0.00 0.00 -0.01 0.00 0.00 57.00 55.93 3g8r n GLN 217 Cb 0.22 -1.45 0.00 0.00 1.02 0.00 0.00 30.24 30.04 3g8r n GLN 217 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3g8r n GLY 218 N 1.17 0.99 3.79 1.08 0.00 -0.02 -4.64 105.19 107.55 3g8r n GLY 218 Ca 0.18 -0.52 -0.34 0.00 0.00 0.00 0.00 46.02 45.33 3g8r n GLY 218 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g8r s ALA 219 N -2.12 2.76 0.00 4.61 0.00 -0.96 -4.70 121.76 121.35 3g8r s ALA 219 Ca 0.00 0.67 0.00 0.00 0.00 0.00 0.00 51.96 52.63 3g8r s ALA 219 Cb 0.00 -3.30 0.00 0.00 0.00 0.00 0.00 23.12 19.82 3g8r s ALA 219 CO 0.00 -0.61 0.05 0.25 0.00 0.00 0.00 175.76 175.45 3g8r n THR 220 N -1.30 0.00 -4.57 0.00 -2.24 0.28 -4.67 114.28 101.78 3g8r n THR 220 Ca 0.10 -0.21 -0.25 0.00 -2.27 0.00 0.00 64.05 61.42 3g8r n THR 220 Cb 0.52 1.14 -0.17 0.00 -2.10 0.00 0.00 70.33 69.73 3g8r n THR 220 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 3g8r s VAL 221 N -0.32 1.18 -0.02 2.28 1.01 -1.23 -0.70 120.40 122.59 3g8r s VAL 221 Ca 0.00 -0.50 0.04 0.00 0.00 0.00 0.00 61.98 61.53 3g8r s VAL 221 Cb 0.00 -1.08 -0.01 0.00 0.00 0.00 0.00 36.38 35.29 3g8r s VAL 221 CO 0.00 0.37 -0.15 -0.36 0.00 0.00 0.00 175.10 174.96 3g8r s PHE 222 N 0.72 1.39 0.02 5.22 0.08 0.75 -0.42 117.98 125.74 3g8r s PHE 222 Ca -0.13 -0.32 0.06 0.00 0.12 0.00 0.00 56.93 56.66 3g8r s PHE 222 Cb -0.16 -0.92 -0.02 0.00 -0.57 0.00 0.00 43.02 41.35 3g8r s PHE 222 CO 0.03 -0.07 -0.19 -2.00 -0.10 0.00 0.00 175.22 172.89 3g8r s GLU 223 N -0.16 1.36 -0.15 0.44 2.12 -0.42 0.43 118.70 122.32 3g8r s GLU 223 Ca 0.02 -0.82 -0.16 0.00 0.36 0.00 0.00 54.97 54.37 3g8r s GLU 223 Cb -0.08 -1.40 0.04 0.00 0.26 0.00 0.00 34.13 32.95 3g8r s GLU 223 CO 0.00 0.37 0.44 0.21 -0.54 0.00 0.00 175.26 175.74 3g8r s LYS 224 N -0.93 0.56 0.41 4.30 2.20 -0.76 -2.12 119.74 123.39 3g8r s LYS 224 Ca 0.06 0.52 -0.24 0.00 -0.36 0.00 0.00 55.97 55.95 3g8r s LYS 224 Cb -0.08 0.27 -0.09 0.00 -1.51 0.00 0.00 37.83 36.42 3g8r s LYS 224 CO 0.01 -0.08 1.10 -1.01 -0.36 0.00 0.00 175.35 175.00 3g8r s HIS 225 N 0.02 3.16 0.08 4.03 3.76 -1.26 -0.27 115.29 124.81 3g8r s HIS 225 Ca -0.02 1.61 0.02 0.00 -0.15 0.00 0.00 55.06 56.52 3g8r s HIS 225 Cb -0.03 -3.24 -0.04 0.00 1.11 0.00 0.00 32.58 30.38 3g8r s HIS 225 CO 0.01 -0.94 -0.07 0.14 -0.85 0.00 0.00 174.74 173.03 3g8r s VAL 226 N -1.56 0.66 0.22 -0.90 -7.23 0.04 -0.41 120.40 111.23 3g8r s VAL 226 Ca 0.58 -1.72 -0.23 0.00 -1.81 0.00 0.00 61.98 58.81 3g8r s VAL 226 Cb -0.26 -1.41 0.04 0.00 0.56 0.00 0.00 36.38 35.32 3g8r s VAL 226 CO 0.32 -0.74 0.79 -0.83 -0.31 0.00 0.00 175.10 174.32 3g8r s GLY 227 N -2.66 -0.19 -0.44 2.32 0.00 -0.28 -4.75 107.32 101.32 3g8r s GLY 227 Ca 0.06 -0.06 0.02 0.00 0.00 0.00 0.00 44.72 44.75 3g8r s GLY 227 CO -0.03 -0.02 0.25 -2.27 0.00 0.00 0.00 173.10 171.03 3g8r s LEU 228 N -2.89 2.46 0.44 0.66 2.96 -1.26 -4.04 118.68 117.00 3g8r s LEU 228 Ca 0.10 -2.65 -0.25 0.00 -0.22 0.00 0.00 54.13 51.11 3g8r s LEU 228 Cb -0.04 -0.93 -0.09 0.00 0.50 0.00 0.00 46.19 45.63 3g8r s LEU 228 CO 0.03 -0.26 1.31 -2.65 -1.32 0.00 0.00 176.35 173.46 3g8r n PRO 229 N 3.49 1.95 0.00 0.98 -0.02 -1.26 -4.88 135.00 135.27 3g8r n PRO 229 Ca 0.11 0.70 0.00 0.00 -2.02 0.00 0.00 63.50 62.29 3g8r n PRO 229 Cb 0.36 -2.45 0.00 0.00 -0.02 0.00 0.00 33.50 31.39 3g8r n PRO 229 CO 0.00 0.00 0.00 2.41 1.98 0.00 0.00 175.50 179.89 3g8r n THR 230 N -0.32 0.00 0.00 3.45 -1.04 -0.14 -4.99 114.28 111.24 3g8r n THR 230 Ca 0.07 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.08 3g8r n THR 230 Cb 0.41 0.54 0.00 0.00 -1.82 0.00 0.00 70.33 69.46 3g8r n THR 230 CO 0.00 0.00 0.00 -0.90 -0.64 0.00 0.00 175.07 173.53 3g8r n ASP 231 N 0.00 0.00 0.05 8.00 5.68 -1.26 -4.35 116.55 124.68 3g8r n ASP 231 Ca 0.00 0.00 -0.01 0.00 -0.50 0.00 0.00 54.79 54.28 3g8r n ASP 231 Cb 0.04 0.00 0.27 0.00 -1.14 0.00 0.00 41.12 40.29 3g8r n ASP 231 CO 0.00 0.00 0.00 -0.61 -1.33 0.00 0.00 177.20 175.26 3g8r h GLN 232 N 0.00 0.38 -4.67 0.11 4.15 -1.98 -3.44 115.11 109.67 3g8r h GLN 232 Ca 0.00 -0.12 -0.40 0.00 0.77 0.00 0.00 58.65 58.90 3g8r h GLN 232 Cb 0.00 -0.04 -0.29 0.00 0.21 0.00 0.00 27.48 27.36 3g8r h GLN 232 CO 0.00 0.57 -0.78 0.71 -1.93 0.00 0.00 178.83 177.40 3g8r s TYR 233 N -4.59 0.82 0.00 3.99 4.12 -1.26 -5.17 117.35 115.26 3g8r s TYR 233 Ca -0.06 -0.17 0.00 0.00 0.02 0.00 0.00 57.07 56.86 3g8r s TYR 233 Cb 0.14 -0.54 0.00 0.00 -1.52 0.00 0.00 41.96 40.04 3g8r s TYR 233 CO 0.77 -0.03 0.00 0.41 0.02 0.00 0.00 175.55 176.71 3g8r n GLY 234 N 2.98 1.05 3.09 0.71 0.00 -1.26 -0.97 105.19 110.80 3g8r n GLY 234 Ca -0.15 -1.94 -0.13 0.00 0.00 0.00 0.00 46.02 43.81 3g8r n GLY 234 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 3g8r s ILE 235 N 1.05 -0.01 0.87 -0.61 2.07 -1.26 -4.75 121.20 118.57 3g8r s ILE 235 Ca 0.00 0.04 -0.12 0.00 -1.41 0.00 0.00 60.65 59.16 3g8r s ILE 235 Cb 0.00 -0.34 0.12 0.00 0.13 0.00 0.00 42.46 42.37 3g8r s ILE 235 CO 0.00 0.02 1.15 0.54 -1.91 0.00 0.00 174.94 174.73 3g8r s ASN 236 N 0.43 3.88 -0.26 4.50 6.03 -1.26 -4.98 114.94 123.29 3g8r s ASN 236 Ca -0.03 0.92 0.03 0.00 -1.03 0.00 0.00 52.86 52.76 3g8r s ASN 236 Cb -0.04 -1.48 0.43 0.00 -3.03 0.00 0.00 41.25 37.12 3g8r s ASN 236 CO -0.02 -2.31 1.52 -0.46 -2.03 0.00 0.00 177.10 173.79 3g8r n ASN 237 N -3.60 3.53 -0.30 3.54 6.94 -1.26 -3.25 115.26 120.86 3g8r n ASN 237 Ca 0.07 -2.92 0.01 0.00 -0.02 0.00 0.00 54.58 51.72 3g8r n ASN 237 Cb 0.60 -0.69 0.01 0.00 -2.36 0.00 0.00 39.78 37.33 3g8r n ASN 237 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 3g8r n TYR 238 N -0.37 0.00 -4.29 -2.53 4.11 -1.26 -4.58 117.16 108.25 3g8r n TYR 238 Ca 0.34 -0.09 -0.18 0.00 -0.00 0.00 0.00 57.90 57.97 3g8r n TYR 238 Cb 1.16 -0.04 -0.14 0.00 -0.00 0.00 0.00 39.34 40.32 3g8r n TYR 238 CO 0.00 0.00 0.00 -1.54 -0.00 0.00 0.00 176.86 175.32 3g8r s SER 239 N -0.82 1.19 0.02 9.48 1.04 -1.20 -4.29 113.70 119.11 3g8r s SER 239 Ca 0.02 -0.33 0.01 0.00 0.48 0.00 0.00 55.95 56.13 3g8r s SER 239 Cb 0.02 -0.08 -0.04 0.00 0.10 0.00 0.00 66.02 66.02 3g8r s SER 239 CO 0.00 0.02 0.06 0.00 0.98 0.00 0.00 173.24 174.30 3g8r s ALA 240 N -0.64 3.49 0.87 5.32 0.00 0.45 -4.74 121.76 126.51 3g8r s ALA 240 Ca 0.00 -0.94 -0.08 0.00 0.00 0.00 0.00 51.96 50.94 3g8r s ALA 240 Cb -0.06 -1.46 0.16 0.00 0.00 0.00 0.00 23.12 21.76 3g8r s ALA 240 CO 0.00 0.69 1.01 0.27 0.00 0.00 0.00 175.76 177.73 3g8r n ASN 241 N 1.05 0.52 -0.10 0.00 0.23 -1.26 -1.12 115.26 114.57 3g8r n ASN 241 Ca -0.12 -1.63 -0.10 0.00 -0.53 0.00 0.00 54.58 52.19 3g8r n ASN 241 Cb 0.52 -0.73 0.04 0.00 -2.08 0.00 0.00 39.78 37.53 3g8r n ASN 241 CO 0.00 0.00 0.00 -0.65 -0.93 0.00 0.00 177.26 175.68 3g8r h PRO 242 N 0.00 0.83 -0.13 -0.53 0.11 -1.91 0.26 132.00 130.64 3g8r h PRO 242 Ca -0.33 -0.39 0.02 0.00 0.11 0.00 0.00 66.00 65.41 3g8r h PRO 242 Cb 1.01 -0.01 -0.02 0.00 0.11 0.00 0.00 31.00 32.09 3g8r h PRO 242 CO 0.27 1.03 -0.00 0.93 -0.21 0.00 0.00 178.00 180.02 3g8r h GLU 243 N 0.70 0.04 0.00 1.05 3.07 -1.94 -2.47 114.58 115.03 3g8r h GLU 243 Ca 0.07 -0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.93 3g8r h GLU 243 Cb 0.87 -0.01 0.00 0.00 -0.84 0.00 0.00 28.75 28.77 3g8r h GLU 243 CO 0.08 0.03 -0.11 0.00 -1.40 0.00 0.00 179.01 177.60 3g8r n GLN 244 N -5.12 0.22 -0.23 2.33 10.64 -1.07 -2.07 117.38 122.08 3g8r n GLN 244 Ca -0.04 0.16 -0.08 0.00 -1.83 0.00 0.00 57.00 55.20 3g8r n GLN 244 Cb 0.08 -1.73 0.03 0.00 -0.86 0.00 0.00 30.24 27.76 3g8r n GLN 244 CO 0.00 0.00 0.00 0.28 -1.83 0.00 0.00 177.06 175.51 3g8r h VAL 245 N 0.00 1.26 -0.04 -0.39 2.07 -0.50 -1.92 116.25 116.73 3g8r h VAL 245 Ca 0.00 -1.06 -0.00 0.00 0.82 0.00 0.00 66.70 66.45 3g8r h VAL 245 Cb 0.70 0.71 -0.00 0.00 -1.52 0.00 0.00 31.29 31.17 3g8r h VAL 245 CO 0.00 0.39 0.01 -0.09 0.02 0.00 0.00 177.57 177.90 3g8r h ARG 246 N 0.98 0.06 -0.74 1.57 2.43 -1.07 -1.88 114.38 115.73 3g8r h ARG 246 Ca 0.19 -0.01 0.17 0.00 -0.81 0.00 0.00 59.98 59.51 3g8r h ARG 246 Cb 0.47 -0.01 -0.11 0.00 -0.42 0.00 0.00 29.97 29.90 3g8r h ARG 246 CO 0.02 0.25 0.15 0.00 -1.51 0.00 0.00 179.97 178.88 3g8r h ARG 247 N -0.14 0.23 -0.32 0.20 3.08 -1.51 0.30 114.38 116.22 3g8r h ARG 247 Ca 0.01 -0.01 0.05 0.00 0.07 0.00 0.00 59.98 60.10 3g8r h ARG 247 Cb 0.22 -0.05 -0.04 0.00 0.08 0.00 0.00 29.97 30.17 3g8r h ARG 247 CO -0.00 0.15 0.04 2.35 -1.07 0.00 0.00 179.97 181.45 3g8r h TRP 248 N 0.24 0.07 -0.44 3.04 7.01 -0.64 0.30 115.95 125.51 3g8r h TRP 248 Ca 0.42 0.02 -0.10 0.00 2.11 0.00 0.00 58.89 61.34 3g8r h TRP 248 Cb 0.74 0.02 -0.01 0.00 -2.10 0.00 0.00 29.16 27.80 3g8r h TRP 248 CO -0.28 -0.01 -0.13 -0.07 -2.79 0.00 0.00 178.44 175.16 3g8r h LEU 249 N 0.15 0.88 -1.17 0.65 3.38 -0.52 -1.62 115.31 117.06 3g8r h LEU 249 Ca 0.15 -0.37 0.02 0.00 0.09 0.00 0.00 57.88 57.77 3g8r h LEU 249 Cb 0.18 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 40.64 3g8r h LEU 249 CO -0.22 1.05 0.56 0.00 0.09 0.00 0.00 178.44 179.93 3g8r h ALA 250 N 0.86 1.42 0.03 1.53 0.00 0.39 0.52 119.26 124.01 3g8r h ALA 250 Ca 0.11 -0.05 0.01 0.00 0.00 0.00 0.00 54.91 54.97 3g8r h ALA 250 Cb 0.68 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 3g8r h ALA 250 CO 0.05 0.52 -0.06 0.00 0.00 0.00 0.00 179.25 179.75 3g8r h ALA 251 N 1.48 -0.09 -0.15 0.00 0.00 0.33 -0.56 119.26 120.27 3g8r h ALA 251 Ca 0.32 -0.00 0.05 0.00 0.00 0.00 0.00 54.91 55.28 3g8r h ALA 251 Cb -0.07 0.10 -0.06 0.00 0.00 0.00 0.00 17.79 17.75 3g8r h ALA 251 CO -0.08 -0.57 -0.32 0.00 0.00 0.00 0.00 179.25 178.28 3g8r h ALA 252 N 0.83 -0.35 -0.65 0.00 0.00 -0.70 -0.28 119.26 118.11 3g8r h ALA 252 Ca 0.02 0.03 0.11 0.00 0.00 0.00 0.00 54.91 55.07 3g8r h ALA 252 Cb 0.14 0.61 -0.08 0.00 0.00 0.00 0.00 17.79 18.46 3g8r h ALA 252 CO -0.04 -0.79 0.21 0.00 0.00 0.00 0.00 179.25 178.62 3g8r h ALA 253 N 0.46 0.83 -0.38 0.00 0.00 -0.77 -1.35 119.26 118.04 3g8r h ALA 253 Ca 0.10 0.11 -0.00 0.00 0.00 0.00 0.00 54.91 55.12 3g8r h ALA 253 Cb 0.54 0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.43 3g8r h ALA 253 CO -0.37 -0.24 0.22 -0.09 0.00 0.00 0.00 179.25 178.77 3g8r h ARG 254 N 0.36 0.52 -0.41 0.00 2.43 -0.13 0.55 114.38 117.69 3g8r h ARG 254 Ca 0.34 -0.05 0.06 0.00 -0.81 0.00 0.00 59.98 59.52 3g8r h ARG 254 Cb 0.48 -0.11 -0.05 0.00 -0.42 0.00 0.00 29.97 29.87 3g8r h ARG 254 CO -0.37 0.40 0.09 0.00 -1.51 0.00 0.00 179.97 178.58 3g8r h ALA 255 N 1.09 0.45 -0.29 2.80 0.00 -0.12 -1.68 119.26 121.52 3g8r h ALA 255 Ca 0.14 0.08 0.04 0.00 0.00 0.00 0.00 54.91 55.16 3g8r h ALA 255 Cb 0.02 0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.87 3g8r h ALA 255 CO -0.02 -0.31 0.08 -0.07 0.00 0.00 0.00 179.25 178.93 3g8r h LEU 256 N 0.22 0.06 -0.67 0.00 3.38 -0.90 0.35 115.31 117.75 3g8r h LEU 256 Ca 0.20 0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.21 3g8r h LEU 256 Cb 0.24 0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.03 3g8r h LEU 256 CO -0.25 0.07 0.00 0.00 0.09 0.00 0.00 178.44 178.35 3g8r n ALA 257 N -2.32 0.77 0.00 1.53 0.00 0.15 -0.90 120.51 119.75 3g8r n ALA 257 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 3g8r n ALA 257 Cb 0.11 -0.66 0.00 0.00 0.00 0.00 0.00 19.45 18.90 3g8r n ALA 257 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3g8r n LEU 259 N 0.11 0.00 0.00 0.00 4.77 0.12 -4.96 117.00 117.04 3g8r n LEU 259 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 3g8r n LEU 259 Cb 0.00 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 3g8r n LEU 259 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 176.67 3g8r n GLY 260 N 0.00 0.83 3.40 -0.72 0.00 -0.07 -4.74 105.19 103.89 3g8r n GLY 260 Ca 0.00 -0.84 -0.41 0.00 0.00 0.00 0.00 46.02 44.77 3g8r n GLY 260 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3g8r s ASP 261 N -4.00 5.83 0.48 1.61 3.68 -1.26 -4.97 116.67 118.04 3g8r s ASP 261 Ca 0.00 -0.94 0.29 0.00 2.13 0.00 0.00 52.55 54.02 3g8r s ASP 261 Cb 0.00 -2.06 1.36 0.00 -1.45 0.00 0.00 42.92 40.77 3g8r s ASP 261 CO 0.00 -0.39 1.79 1.23 0.13 0.00 0.00 175.17 177.93 3g8r h GLY 262 N 8.48 0.54 -2.34 2.66 0.00 -2.02 -2.42 103.07 107.97 3g8r h GLY 262 Ca -0.26 -0.09 0.00 0.00 0.00 0.00 0.00 47.33 46.98 3g8r h GLY 262 CO 0.68 -0.07 0.00 1.18 0.00 0.00 0.00 176.54 178.33 3g8r n GLU 263 N -4.38 2.58 -3.59 4.80 1.02 -1.26 -4.83 120.64 114.98 3g8r n GLU 263 Ca 0.25 -2.25 -0.40 0.00 -0.02 0.00 0.00 57.16 54.74 3g8r n GLU 263 Cb 1.08 -1.53 -0.11 0.00 -0.02 0.00 0.00 31.44 30.86 3g8r n GLU 263 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 3g8r s ASP 264 N -0.97 5.77 0.00 1.62 2.15 -0.91 -4.94 116.67 119.39 3g8r s ASP 264 Ca 0.41 -0.75 0.18 0.00 0.43 0.00 0.00 52.55 52.82 3g8r s ASP 264 Cb 0.23 -2.05 0.12 0.00 -0.30 0.00 0.00 42.92 40.91 3g8r s ASP 264 CO 0.27 -0.31 1.03 0.47 -0.17 0.00 0.00 175.17 176.46 3g8r n ASP 265 N 5.03 2.35 -4.68 -0.34 10.43 -1.26 -4.96 116.55 123.12 3g8r n ASP 265 Ca -0.12 -1.67 -0.44 0.00 2.57 0.00 0.00 54.79 55.12 3g8r n ASP 265 Cb 0.48 0.08 -0.03 0.00 1.84 0.00 0.00 41.12 43.48 3g8r n ASP 265 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 3g8r n ALA 266 N 0.81 1.84 -2.87 2.24 0.00 -1.26 -5.00 120.51 116.28 3g8r n ALA 266 Ca 0.10 0.32 -0.32 0.00 0.00 0.00 0.00 53.44 53.53 3g8r n ALA 266 Cb 0.43 -2.55 -0.05 0.00 0.00 0.00 0.00 19.45 17.28 3g8r n ALA 266 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3g8r s VAL 267 N 2.81 5.17 0.70 0.00 0.11 -1.26 -5.11 120.40 122.82 3g8r s VAL 267 Ca 0.84 -0.33 -0.11 0.00 -2.93 0.00 0.00 61.98 59.44 3g8r s VAL 267 Cb -0.54 -3.44 0.01 0.00 -1.53 0.00 0.00 36.38 30.89 3g8r s VAL 267 CO 0.40 0.27 1.08 -0.94 -3.33 0.00 0.00 175.10 172.58 3g8r s SER 268 N -2.07 5.46 0.06 3.54 1.04 -1.26 -4.91 113.70 115.56 3g8r s SER 268 Ca 0.28 1.23 -0.22 0.00 0.48 0.00 0.00 55.95 57.73 3g8r s SER 268 Cb -0.13 -2.07 -0.13 0.00 0.10 0.00 0.00 66.02 63.80 3g8r s SER 268 CO 0.20 -1.34 1.52 -0.33 0.98 0.00 0.00 173.24 174.27 3g8r h GLU 269 N -0.65 0.21 -0.51 4.02 5.08 -1.99 -0.84 114.58 119.91 3g8r h GLU 269 Ca -0.45 -0.06 0.09 0.00 -1.00 0.00 0.00 59.36 57.94 3g8r h GLU 269 Cb 1.24 -0.02 -0.07 0.00 0.50 0.00 0.00 28.75 30.39 3g8r h GLU 269 CO 0.62 0.41 0.07 1.15 -1.00 0.00 0.00 179.01 180.26 3g8r h THR 270 N -0.02 0.68 0.27 1.13 2.02 -1.98 0.17 112.91 115.17 3g8r h THR 270 Ca 0.04 -0.07 -0.01 0.00 0.77 0.00 0.00 66.41 67.14 3g8r h THR 270 Cb 0.30 0.46 0.00 0.00 -1.74 0.00 0.00 68.15 67.18 3g8r h THR 270 CO 0.00 0.04 -0.13 -0.08 0.37 0.00 0.00 175.52 175.72 3g8r h GLU 271 N 0.20 -0.35 -0.97 6.66 4.81 -1.94 0.41 114.58 123.41 3g8r h GLU 271 Ca 0.26 0.02 0.06 0.00 -0.13 0.00 0.00 59.36 59.56 3g8r h GLU 271 Cb 0.36 0.08 -0.06 0.00 0.63 0.00 0.00 28.75 29.76 3g8r h GLU 271 CO -0.36 -0.09 0.62 0.37 -0.73 0.00 0.00 179.01 178.82 3g8r h GLN 272 N -0.57 1.12 -0.06 1.92 5.75 -0.75 -0.94 115.11 121.59 3g8r h GLN 272 Ca -0.04 -0.07 -0.20 0.00 -0.15 0.00 0.00 58.65 58.19 3g8r h GLN 272 Cb 0.41 -0.25 -0.00 0.00 1.07 0.00 0.00 27.48 28.71 3g8r h GLN 272 CO 0.06 0.74 -0.81 0.00 -2.65 0.00 0.00 178.83 176.17 3g8r h ALA 273 N 1.43 0.49 0.29 3.38 0.00 -0.62 -2.55 119.26 121.68 3g8r h ALA 273 Ca 0.41 -0.64 0.00 0.00 0.00 0.00 0.00 54.91 54.68 3g8r h ALA 273 Cb 0.11 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.84 3g8r h ALA 273 CO -0.16 0.77 -0.35 0.77 0.00 0.00 0.00 179.25 180.29 3g8r h SER 274 N 0.28 -0.97 -0.51 0.00 0.02 -0.10 -3.05 113.55 109.22 3g8r h SER 274 Ca -0.05 0.09 0.08 0.00 -0.84 0.00 0.00 61.79 61.07 3g8r h SER 274 Cb 1.41 0.34 -0.07 0.00 0.14 0.00 0.00 62.40 64.22 3g8r h SER 274 CO 0.14 -0.48 0.14 -0.07 -1.14 0.00 0.00 176.83 175.42 3g8r h LEU 275 N -0.69 0.08 -1.21 5.07 3.38 -1.10 -1.29 115.31 119.55 3g8r h LEU 275 Ca -0.01 0.08 0.20 0.00 0.09 0.00 0.00 57.88 58.24 3g8r h LEU 275 Cb 0.65 0.09 -0.09 0.00 0.09 0.00 0.00 40.66 41.40 3g8r h LEU 275 CO -0.10 0.07 0.61 -0.09 0.09 0.00 0.00 178.44 179.02 3g8r h ARG 276 N 0.29 0.61 0.00 1.13 2.43 -1.42 -2.23 114.38 115.19 3g8r h ARG 276 Ca 0.26 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.39 3g8r h ARG 276 Cb 0.32 -0.14 0.00 0.00 -0.42 0.00 0.00 29.97 29.73 3g8r h ARG 276 CO -0.30 0.41 0.00 -1.13 -1.51 0.00 0.00 179.97 177.43 3g8r n SER 277 N -4.65 0.27 -0.74 -3.80 3.41 -0.49 -2.00 113.62 105.61 3g8r n SER 277 Ca 0.22 0.54 0.10 0.00 -0.26 0.00 0.00 58.87 59.47 3g8r n SER 277 Cb 0.62 -0.61 0.07 0.00 -0.26 0.00 0.00 64.21 64.03 3g8r n SER 277 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3g8r n LEU 278 N -1.77 2.54 -4.83 1.04 4.77 -0.84 -4.86 117.00 113.04 3g8r n LEU 278 Ca 0.05 -0.95 -0.32 0.00 -0.03 0.00 0.00 56.01 54.75 3g8r n LEU 278 Cb 0.29 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.33 3g8r n LEU 278 CO 0.23 0.44 0.60 -0.13 -1.33 0.00 0.00 177.39 177.20 3g8r s ARG 279 N -1.80 4.08 -0.03 3.23 0.52 -0.85 -5.03 118.95 119.07 3g8r s ARG 279 Ca 0.22 0.95 -0.30 0.00 -0.52 0.00 0.00 55.73 56.09 3g8r s ARG 279 Cb 0.17 -2.23 -0.03 0.00 0.52 0.00 0.00 34.95 33.38 3g8r s ARG 279 CO 0.30 -0.06 1.12 1.03 0.02 0.00 0.00 175.30 177.71 3g8r s ARG 280 N -3.43 4.42 0.83 3.54 0.52 -1.26 -3.95 118.95 119.62 3g8r s ARG 280 Ca 0.59 1.59 -0.05 0.00 -0.52 0.00 0.00 55.73 57.34 3g8r s ARG 280 Cb -0.10 -3.49 0.17 0.00 0.52 0.00 0.00 34.95 32.06 3g8r s ARG 280 CO 0.20 -0.30 1.13 0.20 0.02 0.00 0.00 175.30 176.54 3g8r s GLY 281 N 1.22 1.77 -0.16 -3.53 0.00 0.31 -3.80 107.32 103.13 3g8r s GLY 281 Ca 0.54 -1.73 0.01 0.00 0.00 0.00 0.00 44.72 43.54 3g8r s GLY 281 CO 0.24 -1.03 -0.18 0.14 0.00 0.00 0.00 173.10 172.27 3g8r s VAL 282 N -3.43 2.42 -0.03 1.40 1.01 0.17 -2.12 120.40 119.82 3g8r s VAL 282 Ca 0.71 -0.85 0.07 0.00 0.00 0.00 0.00 61.98 61.91 3g8r s VAL 282 Cb -0.03 -2.01 -0.02 0.00 0.00 0.00 0.00 36.38 34.32 3g8r s VAL 282 CO 0.48 0.52 -0.26 -0.36 0.00 0.00 0.00 175.10 175.49 3g8r s PHE 283 N 0.91 2.36 0.01 5.22 0.08 -0.61 0.11 117.98 126.06 3g8r s PHE 283 Ca -0.04 -0.55 -0.30 0.00 0.12 0.00 0.00 56.93 56.16 3g8r s PHE 283 Cb -0.15 -1.53 -0.05 0.00 -0.57 0.00 0.00 43.02 40.72 3g8r s PHE 283 CO -0.03 -0.11 1.27 0.00 -0.10 0.00 0.00 175.22 176.26 3g8r s ALA 284 N -0.43 3.49 -0.38 5.36 0.00 -0.07 -0.56 121.76 129.16 3g8r s ALA 284 Ca 0.05 0.81 0.23 0.00 0.00 0.00 0.00 51.96 53.05 3g8r s ALA 284 Cb -0.11 -3.52 0.00 0.00 0.00 0.00 0.00 23.12 19.49 3g8r s ALA 284 CO 0.01 -0.68 0.98 0.25 0.00 0.00 0.00 175.76 176.32 3g8r n THR 285 N 4.34 0.34 -4.31 0.00 -2.24 0.27 0.72 114.28 113.39 3g8r n THR 285 Ca 0.11 -0.40 -0.16 0.00 -2.27 0.00 0.00 64.05 61.32 3g8r n THR 285 Cb 0.45 -0.07 -0.10 0.00 -2.10 0.00 0.00 70.33 68.50 3g8r n THR 285 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 3g8r s ARG 286 N -3.31 1.36 0.76 -0.78 0.52 -1.25 -4.63 118.95 111.62 3g8r s ARG 286 Ca 0.01 -1.72 -0.15 0.00 -0.52 0.00 0.00 55.73 53.35 3g8r s ARG 286 Cb 0.12 -0.36 0.03 0.00 0.52 0.00 0.00 34.95 35.26 3g8r s ARG 286 CO 0.80 -0.23 0.97 -0.35 0.02 0.00 0.00 175.30 176.52 3g8r n PRO 287 N -0.43 0.36 -3.82 3.54 -0.04 -1.26 -3.75 135.00 129.59 3g8r n PRO 287 Ca -0.02 0.18 -0.29 0.00 -0.04 0.00 0.00 63.50 63.33 3g8r n PRO 287 Cb 0.65 -2.24 -0.16 0.00 -0.04 0.00 0.00 33.50 31.72 3g8r n PRO 287 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 3g8r s VAL 288 N -1.94 1.04 0.91 0.52 1.01 0.20 -4.87 120.40 117.26 3g8r s VAL 288 Ca 0.72 -1.06 -0.11 0.00 0.00 0.00 0.00 61.98 61.53 3g8r s VAL 288 Cb -0.32 -1.52 0.13 0.00 0.00 0.00 0.00 36.38 34.67 3g8r s VAL 288 CO 0.52 -0.29 1.07 0.00 0.00 0.00 0.00 175.10 176.40 3g8r n ALA 289 N 4.84 -0.93 -1.75 5.51 0.00 -1.26 -0.21 120.51 126.69 3g8r n ALA 289 Ca -0.08 -0.54 -0.37 0.00 0.00 0.00 0.00 53.44 52.45 3g8r n ALA 289 Cb 0.45 -2.16 0.03 0.00 0.00 0.00 0.00 19.45 17.77 3g8r n ALA 289 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3g8r s ALA 290 N -2.56 2.73 -1.50 0.00 0.00 -1.26 -2.85 121.76 116.32 3g8r s ALA 290 Ca 0.67 1.14 0.00 0.00 0.00 0.00 0.00 51.96 53.77 3g8r s ALA 290 Cb -0.23 -3.49 0.00 0.00 0.00 0.00 0.00 23.12 19.39 3g8r s ALA 290 CO 0.58 -1.18 0.00 0.41 0.00 0.00 0.00 175.76 175.57 3g8r n GLY 291 N 0.62 0.16 3.77 0.00 0.00 0.49 -4.94 105.19 105.29 3g8r n GLY 291 Ca 0.11 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.80 3g8r n GLY 291 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3g8r s GLU 292 N -4.50 3.07 0.50 1.61 2.12 -1.13 -4.79 118.70 115.57 3g8r s GLU 292 Ca 0.00 -0.45 -0.19 0.00 0.36 0.00 0.00 54.97 54.69 3g8r s GLU 292 Cb 0.00 -2.87 -0.08 0.00 0.26 0.00 0.00 34.13 31.44 3g8r s GLU 292 CO 0.00 0.66 1.00 0.00 -0.54 0.00 0.00 175.26 176.39 3g8r s ALA 293 N -1.14 2.95 -0.18 6.30 0.00 -1.26 -1.33 121.76 127.12 3g8r s ALA 293 Ca 0.21 0.39 -0.07 0.00 0.00 0.00 0.00 51.96 52.49 3g8r s ALA 293 Cb -0.12 -3.18 -0.04 0.00 0.00 0.00 0.00 23.12 19.78 3g8r s ALA 293 CO 0.11 -0.25 0.04 -0.51 0.00 0.00 0.00 175.76 175.16 3g8r s LEU 294 N -3.74 3.70 0.32 0.00 1.02 0.24 -4.92 118.68 115.28 3g8r s LEU 294 Ca 0.63 0.04 0.06 0.00 0.02 0.00 0.00 54.13 54.88 3g8r s LEU 294 Cb -0.12 -1.93 -0.03 0.00 0.02 0.00 0.00 46.19 44.13 3g8r s LEU 294 CO 0.24 0.18 0.26 0.42 0.02 0.00 0.00 176.35 177.46 3g8r s THR 295 N 0.36 0.02 0.56 5.49 -4.23 -1.26 -4.60 115.64 111.97 3g8r s THR 295 Ca 0.01 -2.00 0.26 0.00 -1.18 0.00 0.00 61.69 58.78 3g8r s THR 295 Cb -0.13 -2.50 0.32 0.00 1.34 0.00 0.00 72.50 71.54 3g8r s THR 295 CO 0.01 0.00 2.21 0.00 -0.54 0.00 0.00 174.62 176.29 3g8r h ALA 296 N 2.18 1.62 -0.74 3.99 0.00 -1.99 -1.82 119.26 122.51 3g8r h ALA 296 Ca -0.27 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.63 3g8r h ALA 296 Cb 1.24 -0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.99 3g8r h ALA 296 CO 0.39 0.02 0.45 -0.44 0.00 0.00 0.00 179.25 179.67 3g8r h ASP 297 N 0.00 0.88 -0.16 0.00 5.19 -2.00 -3.31 116.42 117.02 3g8r h ASP 297 Ca -0.00 -0.06 0.00 0.00 -0.62 0.00 0.00 57.03 56.35 3g8r h ASP 297 Cb 0.04 -0.22 0.00 0.00 0.18 0.00 0.00 39.33 39.33 3g8r h ASP 297 CO 0.00 0.68 0.00 -0.46 -3.12 0.00 0.00 179.24 176.34 3g8r n ASN 298 N -4.52 2.55 -4.17 6.45 0.23 -0.71 -4.87 115.26 110.23 3g8r n ASN 298 Ca 0.07 -1.74 -0.24 0.00 -0.53 0.00 0.00 54.58 52.14 3g8r n ASN 298 Cb 0.05 -0.10 -0.15 0.00 -2.08 0.00 0.00 39.78 37.51 3g8r n ASN 298 CO 0.00 0.00 0.00 0.68 -0.93 0.00 0.00 177.26 177.01 3g8r s VAL 299 N -1.17 1.36 0.31 3.53 -7.23 -1.09 0.94 120.40 117.06 3g8r s VAL 299 Ca 0.22 -0.88 0.09 0.00 -1.81 0.00 0.00 61.98 59.60 3g8r s VAL 299 Cb 0.14 -1.16 -0.04 0.00 0.56 0.00 0.00 36.38 35.87 3g8r s VAL 299 CO 0.19 0.27 0.11 -0.94 -0.31 0.00 0.00 175.10 174.42 3g8r s SER 300 N -0.70 4.71 -0.09 4.85 1.04 0.27 -4.85 113.70 118.93 3g8r s SER 300 Ca 0.06 -0.70 0.02 0.00 0.48 0.00 0.00 55.95 55.81 3g8r s SER 300 Cb -0.07 -0.81 -0.02 0.00 0.10 0.00 0.00 66.02 65.22 3g8r s SER 300 CO 0.00 -0.20 -0.15 -0.36 0.98 0.00 0.00 173.24 173.51 3g8r s PHE 301 N -2.38 2.71 0.30 5.02 0.08 -1.26 -1.58 117.98 120.87 3g8r s PHE 301 Ca 0.36 -0.45 -0.20 0.00 0.12 0.00 0.00 56.93 56.76 3g8r s PHE 301 Cb -0.04 -1.72 0.03 0.00 -0.57 0.00 0.00 43.02 40.72 3g8r s PHE 301 CO 0.22 -0.04 0.73 0.00 -0.10 0.00 0.00 175.22 176.03 3g8r s ALA 302 N -0.19 -1.14 0.16 5.36 0.00 -0.90 -4.95 121.76 120.10 3g8r s ALA 302 Ca -0.00 -0.39 0.11 0.00 0.00 0.00 0.00 51.96 51.68 3g8r s ALA 302 Cb -0.13 0.82 -0.04 0.00 0.00 0.00 0.00 23.12 23.76 3g8r s ALA 302 CO 0.03 -1.03 -0.24 0.12 0.00 0.00 0.00 175.76 174.64 3g8r s PHE 303 N -3.64 2.21 0.33 0.00 5.36 -1.26 0.11 117.98 121.09 3g8r s PHE 303 Ca 0.12 -0.38 0.06 0.00 -0.96 0.00 0.00 56.93 55.76 3g8r s PHE 303 Cb -0.06 -1.15 -0.01 0.00 -0.34 0.00 0.00 43.02 41.46 3g8r s PHE 303 CO 0.08 0.39 0.47 -1.25 -1.46 0.00 0.00 175.22 173.45 3g8r s PRO 304 N -2.37 3.18 0.91 10.12 0.04 -1.26 -4.97 135.00 140.65 3g8r s PRO 304 Ca 0.16 -0.90 -0.15 0.00 0.04 0.00 0.00 61.00 60.16 3g8r s PRO 304 Cb -0.09 -2.81 0.16 0.00 0.04 0.00 0.00 34.50 31.80 3g8r s PRO 304 CO 0.07 0.10 1.27 -1.25 0.04 0.00 0.00 177.00 177.23 3g8r s PRO 305 N -4.18 1.10 0.09 0.56 0.04 -1.25 -4.70 135.00 126.66 3g8r s PRO 305 Ca 0.43 -0.21 0.02 0.00 0.04 0.00 0.00 61.00 61.28 3g8r s PRO 305 Cb -0.09 -1.88 -0.04 0.00 0.04 0.00 0.00 34.50 32.53 3g8r s PRO 305 CO 0.31 -2.13 -0.07 0.14 0.04 0.00 0.00 177.00 175.29 3g8r s VAL 306 N -3.77 0.68 0.16 -0.36 -7.23 -1.26 -5.02 120.40 103.60 3g8r s VAL 306 Ca 0.70 -1.79 -0.33 0.00 -1.81 0.00 0.00 61.98 58.75 3g8r s VAL 306 Cb -0.07 -1.50 -0.13 0.00 0.56 0.00 0.00 36.38 35.25 3g8r s VAL 306 CO 0.52 -0.78 1.66 -1.84 -0.31 0.00 0.00 175.10 174.34 3g8r n GLU 307 N 0.22 2.39 -3.83 4.82 0.28 -1.26 0.98 120.64 124.24 3g8r n GLU 307 Ca -0.14 0.86 -0.32 0.00 -0.16 0.00 0.00 57.16 57.41 3g8r n GLU 307 Cb 0.60 -2.67 -0.11 0.00 1.43 0.00 0.00 31.44 30.68 3g8r n GLU 307 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 177.13 177.17 3g8r s GLY 308 N 1.29 2.73 0.58 -1.84 0.00 -1.26 -5.12 107.32 103.70 3g8r s GLY 308 Ca 0.79 -3.56 -0.17 0.00 0.00 0.00 0.00 44.72 41.78 3g8r s GLY 308 CO 0.37 1.08 1.09 1.62 0.00 0.00 0.00 173.10 177.26 3g8r s GLN 309 N -0.81 3.26 0.66 2.90 0.74 0.27 -2.00 119.66 124.67 3g8r s GLN 309 Ca 0.21 1.38 -0.14 0.00 0.05 0.00 0.00 55.36 56.86 3g8r s GLN 309 Cb -0.15 -2.01 -0.00 0.00 1.10 0.00 0.00 33.01 31.95 3g8r s GLN 309 CO -0.08 -0.88 1.09 -1.17 -0.55 0.00 0.00 175.29 173.69 3g8r s LEU 310 N -4.28 3.36 -0.02 3.68 2.96 0.22 -4.67 118.68 119.94 3g8r s LEU 310 Ca 0.67 1.89 0.03 0.00 -0.22 0.00 0.00 54.13 56.51 3g8r s LEU 310 Cb -0.19 -4.54 0.05 0.00 0.50 0.00 0.00 46.19 42.01 3g8r s LEU 310 CO 0.33 -1.52 0.87 0.35 -1.32 0.00 0.00 176.35 175.06 3g8r n THR 311 N -2.49 0.71 0.00 3.68 -2.24 -1.26 -0.66 114.28 112.02 3g8r n THR 311 Ca 0.09 -0.77 0.00 0.00 -2.27 0.00 0.00 64.05 61.10 3g8r n THR 311 Cb 0.52 0.53 0.00 0.00 -2.10 0.00 0.00 70.33 69.28 3g8r n THR 311 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3g8r n ALA 312 N -0.44 0.00 0.88 6.98 0.00 -1.25 -4.32 120.51 122.36 3g8r n ALA 312 Ca 0.03 0.00 0.08 0.00 0.00 0.00 0.00 53.44 53.55 3g8r n ALA 312 Cb 0.46 0.00 0.44 0.00 0.00 0.00 0.00 19.45 20.35 3g8r n ALA 312 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3g8r n ASN 313 N 2.62 0.00 -0.10 0.00 3.02 -1.26 -1.48 115.26 118.05 3g8r n ASN 313 Ca 0.00 -0.21 0.09 0.00 -0.03 0.00 0.00 54.58 54.43 3g8r n ASN 313 Cb 0.00 -0.15 0.14 0.00 -0.61 0.00 0.00 39.78 39.16 3g8r n ASN 313 CO 0.00 0.00 0.00 -1.84 -2.62 0.00 0.00 177.26 172.80 3g8r n GLU 314 N -1.15 1.24 -2.74 3.52 0.28 -1.26 -4.85 120.64 115.68 3g8r n GLU 314 Ca 0.10 -2.54 -0.42 0.00 -0.16 0.00 0.00 57.16 54.14 3g8r n GLU 314 Cb 0.09 -1.46 0.01 0.00 1.43 0.00 0.00 31.44 31.51 3g8r n GLU 314 CO 0.00 0.00 0.00 1.87 -0.16 0.00 0.00 177.13 178.84 3g8r n TRP 315 N -1.37 2.48 -2.98 -1.84 -0.00 -0.55 -4.93 117.44 108.25 3g8r n TRP 315 Ca 0.15 -2.61 -0.39 0.00 -0.00 0.00 0.00 57.50 54.65 3g8r n TRP 315 Cb 0.64 -1.37 -0.06 0.00 -0.00 0.00 0.00 31.31 30.52 3g8r n TRP 315 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 177.69 178.14 3g8r s SER 316 N -1.17 7.38 0.00 5.87 0.15 -1.26 -4.92 113.70 119.74 3g8r s SER 316 Ca 0.36 1.63 0.13 0.00 0.70 0.00 0.00 55.95 58.77 3g8r s SER 316 Cb 0.10 -2.50 0.76 0.00 -1.71 0.00 0.00 66.02 62.68 3g8r s SER 316 CO 0.02 0.19 1.22 2.29 1.20 0.00 0.00 173.24 178.16 3g8r n LYS 317 N 1.71 0.38 -0.27 5.44 2.85 -1.26 -1.34 118.16 125.68 3g8r n LYS 317 Ca -0.05 0.02 0.11 0.00 -1.05 0.00 0.00 58.31 57.34 3g8r n LYS 317 Cb 0.49 -1.50 0.26 0.00 -0.65 0.00 0.00 35.03 33.62 3g8r n LYS 317 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 3g8r n TYR 318 N -1.04 0.71 -4.21 5.58 4.02 -1.26 -4.95 117.16 116.01 3g8r n TYR 318 Ca 0.09 -0.39 -0.24 0.00 -0.01 0.00 0.00 57.90 57.35 3g8r n TYR 318 Cb 0.05 -0.00 -0.17 0.00 -0.02 0.00 0.00 39.34 39.20 3g8r n TYR 318 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 176.86 176.39 3g8r s VAL 319 N -1.19 0.93 -0.12 -0.72 0.11 -0.45 -5.12 120.40 113.84 3g8r s VAL 319 Ca 0.41 -0.30 -0.16 0.00 -2.93 0.00 0.00 61.98 59.01 3g8r s VAL 319 Cb 0.23 -0.91 -0.05 0.00 -1.53 0.00 0.00 36.38 34.12 3g8r s VAL 319 CO 0.30 0.33 0.39 -0.60 -3.33 0.00 0.00 175.10 172.19 3g8r s ARG 320 N 1.16 4.22 -0.12 1.54 3.00 -1.26 -4.79 118.95 122.71 3g8r s ARG 320 Ca -0.06 0.29 0.03 0.00 -1.00 0.00 0.00 55.73 54.99 3g8r s ARG 320 Cb -0.14 -3.39 0.01 0.00 0.00 0.00 0.00 34.95 31.42 3g8r s ARG 320 CO -0.02 0.29 -0.21 0.71 0.00 0.00 0.00 175.30 176.07 3g8r s TYR 321 N 0.26 2.47 -0.04 5.12 2.02 -1.26 -4.43 117.35 121.47 3g8r s TYR 321 Ca 0.22 -1.15 0.06 0.00 -0.37 0.00 0.00 57.07 55.82 3g8r s TYR 321 Cb -0.14 -1.68 -0.01 0.00 -0.40 0.00 0.00 41.96 39.72 3g8r s TYR 321 CO 0.08 -0.52 -0.22 0.95 -1.57 0.00 0.00 175.55 174.27 3g8r s THR 322 N 0.69 1.81 0.11 -0.71 -4.23 -1.26 -0.60 115.64 111.45 3g8r s THR 322 Ca -0.11 -0.94 -0.31 0.00 -1.18 0.00 0.00 61.69 59.15 3g8r s THR 322 Cb -0.16 -1.53 -0.07 0.00 1.34 0.00 0.00 72.50 72.08 3g8r s THR 322 CO 0.02 0.51 1.32 0.00 -0.54 0.00 0.00 174.62 175.93 3g8r s ALA 323 N -0.18 3.52 -0.00 3.99 0.00 -0.44 -2.23 121.76 126.42 3g8r s ALA 323 Ca -0.01 1.04 -0.16 0.00 0.00 0.00 0.00 51.96 52.83 3g8r s ALA 323 Cb -0.12 -3.50 -0.09 0.00 0.00 0.00 0.00 23.12 19.41 3g8r s ALA 323 CO 0.02 -0.55 0.82 -0.22 0.00 0.00 0.00 175.76 175.84 3g8r h LYS 324 N 6.58 -0.55 -5.99 0.00 3.64 0.70 1.43 116.57 122.38 3g8r h LYS 324 Ca -0.42 0.04 -0.56 0.00 -1.27 0.00 0.00 60.65 58.44 3g8r h LYS 324 Cb 1.21 0.13 -0.08 0.00 -0.41 0.00 0.00 32.23 33.08 3g8r h LYS 324 CO 0.84 -0.37 -0.51 0.95 -2.27 0.00 0.00 179.45 178.09 3g8r s THR 325 N -3.58 2.57 0.31 1.00 -4.23 -1.26 -3.55 115.64 106.91 3g8r s THR 325 Ca -0.08 -1.70 -0.29 0.00 -1.18 0.00 0.00 61.69 58.44 3g8r s THR 325 Cb 0.01 -2.97 -0.10 0.00 1.34 0.00 0.00 72.50 70.78 3g8r s THR 325 CO 0.25 -0.07 1.23 -2.16 -0.54 0.00 0.00 174.62 173.33 3g8r s PRO 326 N -3.88 4.46 -0.16 3.99 0.04 -1.26 -4.47 135.00 133.72 3g8r s PRO 326 Ca 0.40 2.07 -0.01 0.00 0.04 0.00 0.00 61.00 63.50 3g8r s PRO 326 Cb 0.01 -3.12 -0.01 0.00 0.04 0.00 0.00 34.50 31.43 3g8r s PRO 326 CO 0.23 -0.05 -0.12 0.42 0.04 0.00 0.00 177.00 177.52 3g8r s ILE 327 N -1.11 2.97 0.47 0.56 1.09 0.70 -4.95 121.20 120.94 3g8r s ILE 327 Ca 0.48 -0.66 -0.22 0.00 -1.10 0.00 0.00 60.65 59.14 3g8r s ILE 327 Cb -0.37 -2.28 -0.07 0.00 -1.06 0.00 0.00 42.46 38.68 3g8r s ILE 327 CO 0.48 0.50 1.16 0.00 -0.10 0.00 0.00 174.94 176.98 3g8r s ALA 328 N 0.81 2.93 0.47 9.38 0.00 -1.26 0.59 121.76 134.67 3g8r s ALA 328 Ca -0.04 0.92 -0.21 0.00 0.00 0.00 0.00 51.96 52.63 3g8r s ALA 328 Cb -0.15 -3.38 -0.11 0.00 0.00 0.00 0.00 23.12 19.48 3g8r s ALA 328 CO 0.01 -0.68 0.65 0.00 0.00 0.00 0.00 175.76 175.74 3g8r n ALA 329 N -0.61 -0.99 -0.87 0.00 0.00 -1.25 -2.48 120.51 114.31 3g8r n ALA 329 Ca 0.08 0.12 0.00 0.00 0.00 0.00 0.00 53.44 53.64 3g8r n ALA 329 Cb 0.48 -1.86 0.00 0.00 0.00 0.00 0.00 19.45 18.07 3g8r n ALA 329 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 3g8r n ASP 330 N 0.82 -1.73 -4.91 0.00 9.92 0.22 -4.95 116.55 115.94 3g8r n ASP 330 Ca 0.11 0.00 -0.29 0.00 -0.53 0.00 0.00 54.79 54.08 3g8r n ASP 330 Cb 0.42 -1.40 -0.03 0.00 -0.64 0.00 0.00 41.12 39.47 3g8r n ASP 330 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 3g8r s ALA 331 N -2.23 3.69 0.19 2.24 0.00 -1.03 -4.81 121.76 119.81 3g8r s ALA 331 Ca 0.00 -0.61 -0.31 0.00 0.00 0.00 0.00 51.96 51.04 3g8r s ALA 331 Cb 0.00 -2.21 -0.10 0.00 0.00 0.00 0.00 23.12 20.81 3g8r s ALA 331 CO 0.00 0.36 1.51 -1.25 0.00 0.00 0.00 175.76 176.38 3g8r s PRO 332 N -3.34 4.24 0.86 0.00 0.04 -1.26 -0.90 135.00 134.64 3g8r s PRO 332 Ca 0.42 2.33 -0.15 0.00 0.04 0.00 0.00 61.00 63.65 3g8r s PRO 332 Cb -0.11 -3.14 0.21 0.00 0.04 0.00 0.00 34.50 31.50 3g8r s PRO 332 CO 0.28 -0.54 0.87 0.28 0.04 0.00 0.00 177.00 177.94 3g8r n VAL 333 N 3.39 0.00 -0.03 -0.36 0.31 0.30 -4.87 118.33 117.08 3g8r n VAL 333 Ca 0.11 -0.48 -0.05 0.00 -0.01 0.00 0.00 64.34 63.92 3g8r n VAL 333 Cb 0.39 -1.32 -0.02 0.00 -0.91 0.00 0.00 33.84 31.98 3g8r n VAL 333 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3g8r n ALA 335 N -4.17 2.21 0.02 3.52 0.00 -0.85 0.72 120.51 121.96 3g8r n ALA 335 Ca -0.16 -0.23 0.00 0.00 0.00 0.00 0.00 53.44 53.05 3g8r n ALA 335 Cb 0.44 0.40 0.01 0.00 0.00 0.00 0.00 19.45 20.30 3g8r n ALA 335 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3g8r n ALA 336 N -2.92 1.32 -0.27 0.00 0.00 -1.26 -1.33 120.51 116.05 3g8r n ALA 336 Ca -0.10 -0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.44 3g8r n ALA 336 Cb 0.59 -1.01 0.28 0.00 0.00 0.00 0.00 19.45 19.32 3g8r n ALA 336 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 3g8r n ASP 337 N -1.20 3.73 -0.65 0.00 9.92 -1.26 -4.94 116.55 122.15 3g8r n ASP 337 Ca 0.00 -1.99 0.00 0.00 -0.53 0.00 0.00 54.79 52.27 3g8r n ASP 337 Cb 0.00 -0.42 0.00 0.00 -0.64 0.00 0.00 41.12 40.06 3g8r n ASP 337 CO 0.00 0.00 0.00 0.18 0.13 0.00 0.00 177.20 177.51 3g8r n LEU 338 N 1.45 0.00 -3.08 0.64 7.99 -0.44 0.12 117.00 123.68 3g8r n LEU 338 Ca 0.22 0.00 -0.10 0.00 -0.01 0.00 0.00 56.01 56.12 3g8r n LEU 338 Cb 0.59 0.00 -0.03 0.00 -0.11 0.00 0.00 43.42 43.87 3g8r n LEU 338 CO 0.15 -0.05 -0.03 -1.61 -1.51 0.00 0.00 177.39 174.35 3g8r s GLU 339 N 0.44 0.92 0.00 3.23 0.41 -0.95 -4.46 118.70 118.29 3g8r s GLU 339 Ca 0.00 -1.10 0.00 0.00 -0.41 0.00 0.00 54.97 53.46 3g8r s GLU 339 Cb 0.00 -0.43 0.00 0.00 -1.78 0.00 0.00 34.13 31.92 3g8r s GLU 339 CO 0.00 -1.29 0.27 -2.30 -0.49 0.00 0.00 175.26 171.44